A0A087XS46_POEFO Loading...

2,4-dienoyl-CoA reductase [(3E)-enoyl-CoA-producing], mitochondrial

Auxiliary enzyme of beta-oxidation. It participates in the metabolism of unsaturated fatty enoyl-CoA esters having double bonds in both even- and odd-numbered positions in mitochondria. Catalyzes the NADP-dependent reduction of 2,4-dienoyl-CoA to yield trans-3-enoyl-CoA.

AlphaFold DB , UniProt , Accession A0A087XS46, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 324 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	34.8	Very low	181 Å²	181	110 Å²	110	89%	0.892	62%	0.619	S	S	*	*				0	-36.3	0	-124.4	170.3	156.4	0	0	113.5	A3	M1-A3 VanDerWaalsContact C-N 3.34Å; M1-A3 PolarHBondContact O-N 2.92Å
2	A	29.6	Very low	35.2	Very low	83 Å²	83	109 Å²	109	69%	0.686	61%	0.61	S	S	*	*	H	α-helix	trans	-64.5	-28.7	174.9	0	0	0	0	0	115.1	V4 L6	A2-V4 PolarHBondContact O-N 3.01Å; A2-L6 WeakPolarHBondContact O-CD1 3.28Å
3	A	28.9	Very low	35.7	Very low	78 Å²	78	108 Å²	108	65%	0.645	60%	0.602	S	S	*	*	H	α-helix	trans	-73.3	-22.5	-177.8	0	0	0	0	0	115.1	M1	M1-A3 VanDerWaalsContact C-N 3.34Å; M1-A3 PolarHBondContact O-N 2.92Å
4	V	32	Very low	36.2	Very low	112 Å²	112	112.2 Å²	112.2	68%	0.679	61%	0.614	S	S	*	*	H	α-helix	trans	-89.5	-25.4	-175.1	-178.2	0	0	0	0	112	A2 L6	A2-V4 PolarHBondContact O-N 3.01Å; V4-L6 VanDerWaalsContact C-N 3.3Å; V4-L6 PolarHBondContact O-N 3.19Å
5	M	35.3	Very low	36.6	Very low	139 Å²	139	112.1 Å²	112.1	69%	0.685	62%	0.619	S	S	*	*	H	α-helix	trans	-72.3	-21.8	170.3	-83.3	-169	174.4	0	0	113.3	G9	M5-G9 PolarHBondContact O-N 3.23Å; M5-G9 VanDerWaalsContact O-N 3.09Å
6	L	41.7	Very low	36.9	Very low	88 Å²	88	117.4 Å²	117.4	46%	0.461	63%	0.626	S	S	.	*	H	α-helix	trans	-74.8	-30.1	-174.6	-80.6	161.9	0	0	0	114.1	A2 V4 R10	A2-L6 WeakPolarHBondContact O-CD1 3.28Å; V4-L6 VanDerWaalsContact C-N 3.3Å; V4-L6 PolarHBondContact O-N 3.19Å; L6-R10 PolarHBondContact O-N 2.73Å
7	S	33.5	Very low	37.1	Very low	78 Å²	78	116.2 Å²	116.2	55%	0.545	62%	0.615	S	S	.	*	H	α-helix	trans	-80.3	-38.3	-179.3	69	0	0	0	0	112.4
8	S	35.2	Very low	37.4	Very low	72 Å²	72	116.1 Å²	116.1	50%	0.503	62%	0.622	S	S	.	*	H	α-helix	trans	-78.9	-36.4	178.2	-58.5	0	0	0	0	112.4	L12	S8-L12 WeakPolarHBondContact O-CB 3.26Å; S8-L12 WeakPolarHBondContact O-CD1 3.48Å; S8-L12 PolarHBondContact O-N 2.92Å; S8-L12 VanDerWaalsContact O-N 3.14Å
9	G	36.8	Very low	37.8	Very low	29 Å²	29	122.9 Å²	122.9	30%	0.299	64%	0.638	S	S	.	*	H	α-helix	trans	-67.3	-39.8	178.1	0	0	0	0	0	114	M5 L12 L13	M5-G9 PolarHBondContact O-N 3.23Å; M5-G9 VanDerWaalsContact O-N 3.09Å; G9-L12 PolarHBondContact O-N 3.24Å; G9-L13 WeakPolarHBondContact O-CD1 3.16Å; G9-L13 WeakPolarHBondContact O-CG 3.38Å; G9-L13 PolarHBondContact O-N 3.13Å
10	R	38.9	Very low	38	Very low	191 Å²	191	121.1 Å²	121.1	72%	0.721	63%	0.634	S	S	*	*	H	α-helix	trans	-65.3	-39.6	177.2	-90.7	-175	176.8	-171.2	1.1	112.9	L6 Q14	L6-R10 PolarHBondContact O-N 2.73Å; R10-Q14 PolarHBondContact O-N 2.93Å
11	K	35.6	Very low	38.1	Very low	159 Å²	159	121 Å²	121	69%	0.691	64%	0.641	S	S	*	*	H	α-helix	trans	-71	-35.4	176.6	-87.1	-176.6	175	-178	0	112.5	T15	K11-T15 WeakPolarHBondContact O-CG2 3.47Å; K11-T15 PolarHBondContact O-N 3.2Å; K11-T15 PolarHBondContact O-OG1 3.29Å
12	L	38.9	Very low	38.5	Very low	98 Å²	98	118.3 Å²	118.3	51%	0.513	63%	0.634	S	S	.	*	H	α-helix	trans	-69.6	-37.7	177	-100.3	137.3	0	0	0	113.1	S8 G9	S8-L12 WeakPolarHBondContact O-CB 3.26Å; S8-L12 WeakPolarHBondContact O-CD1 3.48Å; S8-L12 PolarHBondContact O-N 2.92Å; S8-L12 VanDerWaalsContact O-N 3.14Å; G9-L12 PolarHBondContact O-N 3.24Å
13	L	42.2	Very low	39.2	Very low	96 Å²	96	121.9 Å²	121.9	50%	0.503	63%	0.63	S	S	.	*	H	α-helix	trans	-72.1	-29	179.3	-77.3	161.2	0	0	0	113.4	G9 F17	G9-L13 WeakPolarHBondContact O-CD1 3.16Å; G9-L13 WeakPolarHBondContact O-CG 3.38Å; G9-L13 PolarHBondContact O-N 3.13Å; L13-F17 HydrophobicContact CD2-CD2 4.4Å
14	Q	42	Very low	39.7	Very low	167 Å²	167	124.2 Å²	124.2	78%	0.78	64%	0.642	S	S	*	*	H	α-helix	trans	-85	-21.6	179.8	-77.1	-176.4	-15.3	0	0	114.5	R10	R10-Q14 PolarHBondContact O-N 2.93Å
15	T	42.9	Very low	40.2	Very low	111 Å²	111	122.5 Å²	122.5	68%	0.681	65%	0.647	S	S	*	*	H	α-helix	trans	-107.4	-13.3	-170	54.3	0	0	0	0	115.1	K11	K11-T15 WeakPolarHBondContact O-CG2 3.47Å; K11-T15 PolarHBondContact O-N 3.2Å; K11-T15 PolarHBondContact O-OG1 3.29Å
16	R	40.5	Very low	40.9	Very low	196 Å²	196	119.1 Å²	119.1	74%	0.74	64%	0.637	S	S	*	*	S	Bend	trans	-122.9	-3.7	-175.5	-77.9	-167.8	175.8	-152.9	-0.2	116.8
17	F	41.3	Very low	41.5	Very low	97 Å²	97	118.2 Å²	118.2	43%	0.425	64%	0.642	S	S	.	*			trans	-119.4	101.8	179.1	-65	-73.6	0	0	0	110	L13 Q310	L13-F17 HydrophobicContact CD2-CD2 4.4Å; F17-Q310 HydrophobicContact CE1-CG 4.35Å
18	P	41.7	Very low	43.2	Very low	115 Å²	115	124.1 Å²	124.1	75%	0.747	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-55.6	150.2	166.5	23.5	-31.1	0	0	0	109.2	P20	P18-P20 WeakPolarHBondContact O-CD 3.39Å
19	R	44.9	Very low	45.3	Very low	245 Å²	245	123.7 Å²	123.7	93%	0.925	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-46.7	120.4	172.9	-79.1	-179	176.1	173.9	-1	108
20	P	42.8	Very low	47.7	Very low	86 Å²	86	124.2 Å²	124.2	56%	0.558	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-63.5	143.9	179.2	24.5	-30.2	0	0	0	108.4	P18 V22	P18-P20 WeakPolarHBondContact O-CD 3.39Å; P20-V22 PolarHBondContact O-N 2.98Å
21	P	38.8	Very low	50.1	Low	120 Å²	120	118 Å²	118	78%	0.779	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-55.9	139.2	169.3	23.9	-31	0	0	0	108.7	R23	P21-R23 PolarHBondContact O-N 3.26Å; P21-R23 VanDerWaalsContact O-N 3.07Å
22	V	45.1	Very low	52.8	Low	125 Å²	125	117.8 Å²	117.8	76%	0.758	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-52.5	118.8	172.7	177.8	0	0	0	0	107.1	P20 S24	P20-V22 PolarHBondContact O-N 2.98Å; V22-S24 PolarHBondContact O-N 3.44Å
23	R	44.4	Very low	55.5	Low	158 Å²	158	117.8 Å²	117.8	60%	0.596	64%	0.638	S	S	*	*			trans	-54.5	105.3	175.9	-85.1	-176.8	166.4	-167.4	-6.4	109.1	P21 G25	P21-R23 PolarHBondContact O-N 3.26Å; P21-R23 VanDerWaalsContact O-N 3.07Å; R23-G25 VanDerWaalsContact C-N 3.31Å; R23-G25 PolarHBondContact O-N 3Å; R23-G25 VanDerWaalsContact O-N 3.15Å
24	S	38.9	Very low	57.9	Low	127 Å²	127	117 Å²	117	89%	0.888	65%	0.645	S	S	*	*	S	Bend	trans	-76.8	85.1	160.9	56.6	0	0	0	0	107.3	V22	V22-S24 PolarHBondContact O-N 3.44Å
25	G	41.8	Very low	60.5	Low	76 Å²	76	111.3 Å²	111.3	78%	0.784	62%	0.623	S	S	*	*	S	Bend	trans	156.1	-15.8	171.7	0	0	0	0	0	117.8	R23	R23-G25 VanDerWaalsContact C-N 3.31Å; R23-G25 PolarHBondContact O-N 3Å; R23-G25 VanDerWaalsContact O-N 3.15Å
26	S	49.9	Very low	62.8	Low	68 Å²	68	110.1 Å²	110.1	48%	0.476	62%	0.619	S	S	.	*	S	Bend	trans	-82.7	128.4	168.4	54.8	0	0	0	0	109.2	R28	S26-R28 PolarHBondContact O-N 3.06Å; S26-R28 VanDerWaalsContact O-N 3.16Å
27	A	55.3	Low	65.3	Low	69 Å²	69	105.6 Å²	105.6	57%	0.57	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-47.4	124.5	171.7	0	0	0	0	0	109.3	F32	A27-F32 HydrophobicContact CB-CE2 4.06Å; A27-F32 HydrophobicContact CB-CZ 4.18Å
28	R	68.6	Low	67.7	Low	201 Å²	201	103.2 Å²	103.2	76%	0.758	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-59.1	134.1	175.4	-69.2	-174.6	-177	179.2	3.1	107.4	S26 S30 G31	S26-R28 PolarHBondContact O-N 3.06Å; S26-R28 VanDerWaalsContact O-N 3.16Å; R28-S30 PolarHBondContact O-N 3.36Å; R28-G31 PolarHBondContact O-N 2.91Å
29	P	79.8	Confident	70.2	Confident	63 Å²	63	100 Å²	100	41%	0.409	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-49.5	-34	-178.3	-29.2	34.4	0	0	0	113.2	G31 F32 F33 P256 T257	P29-G31 PolarHBondContact O-N 3.48Å; P29-F32 PolarHBondContact O-N 2.95Å; P29-F33 WeakPolarHBondContact O-CD2 3.11Å; P29-P256 WeakPolarHBondContact CB-O 3.41Å; P29-T257 CarbonylContact C-O 3.54Å
30	S	87.1	Confident	72.8	Confident	40 Å²	40	93.6 Å²	93.6	28%	0.28	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-52.3	-27.1	175.5	61.3	0	0	0	0	115.2	R28 F32 F33 T257 G258	R28-S30 PolarHBondContact O-N 3.36Å; S30-F32 VanDerWaalsContact C-N 3.28Å; S30-F32 PolarHBondContact O-N 3.13Å; S30-F33 CarbonylContact O-C 3.6Å; S30-F33 PolarHBondContact O-N 3.17Å; S30-T257 VanDerWaalsContact CA-O 3.28Å; S30-T257 WeakPolarHBondContact CA-O 3.39Å; S30-T257 PolarHBondContact N-O 2.89Å; S30-G258 WeakPolarHBondContact CB-O 3.49Å
31	G	88.8	Confident	75.4	Confident	62 Å²	62	90.4 Å²	90.4	64%	0.639	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-66.8	-27.5	177.8	0	0	0	0	0	113.6	R28 P29	R28-G31 PolarHBondContact O-N 2.91Å; P29-G31 PolarHBondContact O-N 3.48Å
32	F	93.1	Very high	78.3	Confident	154 Å²	154	88.5 Å²	88.5	68%	0.675	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-15.7	175.8	-60	-70.4	0	0	0	113.1	A27 P29 S30	A27-F32 HydrophobicContact CB-CE2 4.06Å; A27-F32 HydrophobicContact CB-CZ 4.18Å; P29-F32 PolarHBondContact O-N 2.95Å; S30-F32 VanDerWaalsContact C-N 3.28Å; S30-F32 PolarHBondContact O-N 3.13Å
33	F	95.1	Very high	80.8	Confident	97 Å²	97	87.2 Å²	87.2	43%	0.425	54%	0.542	S	S	.	.	S	Bend	trans	-122.1	46.3	-171.9	-55.2	-67.3	0	0	0	111.1	P29 S30 T257 R259	P29-F33 WeakPolarHBondContact O-CD2 3.11Å; S30-F33 CarbonylContact O-C 3.6Å; S30-F33 PolarHBondContact O-N 3.17Å; F33-T257 HydrophobicContact CB-CG2 4.41Å; F33-T257 HydrophobicContact CD1-CG2 4.28Å; F33-T257 HydrophobicContact CD2-CG2 4.01Å; F33-T257 HydrophobicContact CE2-CG2 4.35Å; F33-T257 HydrophobicContact CG-CG2 3.97Å; F33-R259 VanDerWaalsContact O-CZ 3.31Å; F33-R259 PolarHBondContact O-NE 3.05Å; F33-R259 PolarHBondContact O-NH2 2.93Å
34	A	94.1	Very high	83.3	Confident	79 Å²	79	80.9 Å²	80.9	65%	0.653	53%	0.526	S	S	*	.			trans	-55.3	135.1	178.2	0	0	0	0	0	111
35	P	94.8	Very high	86.1	Confident	48 Å²	48	76.6 Å²	76.6	31%	0.312	50%	0.496	S	S	.	.			trans	-70.7	142.4	-179.6	29.6	-34.2	0	0	0	111.2	E37 K262 E265	P35-E37 HydrophobicContact CB-CG 4.28Å; P35-K262 HydrophobicContact CB-CG 3.74Å; P35-K262 HydrophobicContact CG-CG 4.2Å; P35-E265 WeakPolarHBondContact CA-OE1 3.35Å; P35-E265 HydrophobicContact CB-CG 4.33Å
36	S	92.9	Very high	88.8	Confident	87 Å²	87	73.1 Å²	73.1	61%	0.608	46%	0.46	S	S	*	.			trans	-105.4	111.4	166.7	-174.1	0	0	0	0	109.1	E265	S36-E265 WeakPolarHBondContact O-CG 3.39Å
37	E	93.1	Very high	91.1	Very high	100 Å²	100	78.1 Å²	78.1	47%	0.467	47%	0.468	S	S	.	.			trans	-103.1	-5.7	-172.2	-58.1	-167.8	-138.8	0	0	113.4	P35 K262 A264	P35-E37 HydrophobicContact CB-CG 4.28Å; E37-K262 HydrophobicContact CG-CB 4.33Å; E37-K262 HydrophobicContact CG-CG 4.29Å; E37-K262 WeakPolarHBondContact OE1-CE 3.49Å; E37-K262 IonicContact OE1-NZ 2.67Å; E37-A264 HydrophobicContact CB-CB 3.82Å; E37-A264 HydrophobicContact CG-CB 4.26Å; E37-A264 WeakPolarHBondContact O-CB 3.35Å
38	G	91.4	Very high	93	Very high	47 Å²	47	81 Å²	81	49%	0.485	47%	0.474	S	S	.	.	S	Bend	trans	-74.2	158.1	173.8	0	0	0	0	0	112.4	M40 N268	G38-M40 PolarHBondContact O-N 2.94Å; G38-N268 PolarHBondContact O-ND2 3.44Å; G38-N268 PolarHBondContact O-OD1 3.25Å
39	A	94.5	Very high	94.5	Very high	47 Å²	47	75 Å²	75	39%	0.388	45%	0.451	S	S	.	.			trans	-61	126	175	0	0	0	0	0	110.5	L71	A39-L71 HydrophobicContact CB-CD2 4.15Å
40	M	98.1	Very high	95.4	Very high	111 Å²	111	72 Å²	72	55%	0.547	43%	0.432	S	S	.	.			trans	-79.8	-39.1	-176.1	-179	-170.8	75.2	0	0	112.9	G38 N268 Y272	G38-M40 PolarHBondContact O-N 2.94Å; M40-N268 HydrophobicContact CB-CB 4.04Å; M40-N268 PolarHBondContact N-OD1 3.2Å; M40-Y272 HydrophobicContact CE-CD2 4.41Å; M40-Y272 HydrophobicContact CE-CG 4.31Å
41	L	98.4	Very high	95.9	Very high	19 Å²	19	70.1 Å²	70.1	10%	0.099	42%	0.419	C	S	.	.	S	Bend	trans	-79.8	156.8	-175.2	-68.8	176.5	0	0	0	111.8	F46 L71 A271 F277	L41-F46 HydrophobicContact CD1-CE2 3.75Å; L41-L71 HydrophobicContact CB-CD1 4Å; L41-L71 HydrophobicContact CB-CD2 3.99Å; L41-L71 HydrophobicContact CD1-CD1 4.2Å; L41-L71 VanDerWaalsContact O-CD2 3.31Å; L41-L71 WeakPolarHBondContact O-CD2 3.27Å; L41-A271 HydrophobicContact CD1-CB 4.09Å; L41-F277 HydrophobicContact CD2-CD2 3.99Å; L41-F277 HydrophobicContact CD2-CE2 4.19Å
42	P	98.4	Very high	96.4	Very high	81 Å²	81	67.4 Å²	67.4	53%	0.526	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-56.4	141.8	176.4	-24.3	34.3	0	0	0	112.3	G44 S45	P42-G44 PolarHBondContact O-N 3.38Å; P42-S45 WeakPolarHBondContact O-CB 3.33Å; P42-S45 PolarHBondContact O-N 3.36Å; P42-S45 VanDerWaalsContact O-N 3.08Å; P42-S45 PolarHBondContact O-OG 2.96Å
43	A	97.7	Very high	96.7	Very high	97 Å²	97	60 Å²	60	80%	0.802	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	134.5	176	0	0	0	0	0	111.1	S45	A43-S45 VanDerWaalsContact C-N 3.32Å
44	G	97.6	Very high	96.9	Very high	25 Å²	25	55.6 Å²	55.6	26%	0.258	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	5.2	-177.5	0	0	0	0	0	115	P42 F46 R47 L71	P42-G44 PolarHBondContact O-N 3.38Å; G44-F46 PolarHBondContact O-N 2.87Å; G44-F46 VanDerWaalsContact O-N 3.08Å; G44-R47 VanDerWaalsContact O-CB 3.26Å; G44-R47 WeakPolarHBondContact O-CB 3.42Å; G44-R47 PolarHBondContact O-N 3.21Å; G44-L71 CarbonylContact C-O 3.53Å; G44-L71 WeakPolarHBondContact CA-O 3.46Å; G44-L71 PolarHBondContact N-O 2.73Å
45	S	98.3	Very high	97.1	Very high	37 Å²	37	52.4 Å²	52.4	26%	0.259	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.3	177.7	68.1	0	0	0	0	114.2	P42 A43 L71	P42-S45 WeakPolarHBondContact O-CB 3.33Å; P42-S45 PolarHBondContact O-N 3.36Å; P42-S45 VanDerWaalsContact O-N 3.08Å; P42-S45 PolarHBondContact O-OG 2.96Å; A43-S45 VanDerWaalsContact C-N 3.32Å; S45-L71 PolarHBondContact N-O 3.03Å
46	F	98.6	Very high	97.2	Very high	3 Å²	3	50.1 Å²	50.1	1%	0.013	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114	16.3	174.1	-77.5	-87.3	0	0	0	113	L41 G44 D48 R49 L68 L71 G72 A73 V129 A271	L41-F46 HydrophobicContact CD1-CE2 3.75Å; G44-F46 PolarHBondContact O-N 2.87Å; G44-F46 VanDerWaalsContact O-N 3.08Å; F46-D48 PolarHBondContact O-N 3.14Å; F46-R49 HydrophobicContact CB-CB 4.43Å; F46-R49 HydrophobicContact CD1-CB 4.17Å; F46-R49 HydrophobicContact CD1-CG 4.22Å; F46-R49 VanDerWaalsContact O-CB 3.3Å; F46-R49 WeakPolarHBondContact O-CB 3.3Å; F46-R49 PolarHBondContact O-N 3.03Å; F46-R49 VanDerWaalsContact O-N 3.09Å; F46-L68 HydrophobicContact CD1-CD2 3.96Å; F46-L68 HydrophobicContact CD2-CD2 4.03Å; F46-L68 HydrophobicContact CE1-CD2 3.76Å; F46-L68 HydrophobicContact CE2-CD2 3.8Å; F46-L68 HydrophobicContact CG-CD2 4.1Å; F46-L68 HydrophobicContact CZ-CD2 3.66Å; F46-L71 HydrophobicContact CB-CB 4.19Å; F46-L71 HydrophobicContact CD2-CB 3.75Å; F46-L71 HydrophobicContact CD2-CD1 3.77Å; F46-L71 HydrophobicContact CD2-CG 4.41Å; F46-L71 HydrophobicContact CE2-CD1 3.95Å; F46-L71 HydrophobicContact CG-CB 4.42Å; F46-L71 PolarHBondContact N-O 3.12Å; F46-G72 CarbonylContact O-C 3.5Å; F46-A73 HydrophobicContact CB-CB 3.85Å; F46-A73 WeakPolarHBondContact O-CA 3.17Å; F46-A73 PolarHBondContact O-N 3.04Å; F46-V129 HydrophobicContact CD1-CG2 4.44Å; F46-V129 HydrophobicContact CE1-CG2 3.92Å; F46-A271 HydrophobicContact CE2-CB 4.12Å; F46-A271 VanDerWaalsContact CZ-O 3.27Å; F46-A271 WeakPolarHBondContact CZ-O 3.49Å
47	R	97.7	Very high	97.4	Very high	173 Å²	173	46.1 Å²	46.1	65%	0.653	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	139.2	174.9	-171.1	-178.2	-63.8	174.7	1.6	110.2	G44 R49	G44-R47 VanDerWaalsContact O-CB 3.26Å; G44-R47 WeakPolarHBondContact O-CB 3.42Å; G44-R47 PolarHBondContact O-N 3.21Å; R47-R49 PolarHBondContact O-N 3.1Å
48	D	95.9	Very high	97.6	Very high	129 Å²	129	45.5 Å²	45.5	69%	0.69	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	-0.6	-179.1	-52.8	-44.1	0	0	0	115.6	F46	F46-D48 PolarHBondContact O-N 3.14Å
49	R	98.3	Very high	97.7	Very high	77 Å²	77	44.8 Å²	44.8	29%	0.291	27%	0.266	S	S	.	.			trans	-81.8	143.9	172.8	-58.6	-62.1	-162.1	159.4	4.7	110.8	F46 R47 A73 R74 D128 D276	F46-R49 HydrophobicContact CB-CB 4.43Å; F46-R49 HydrophobicContact CD1-CB 4.17Å; F46-R49 HydrophobicContact CD1-CG 4.22Å; F46-R49 VanDerWaalsContact O-CB 3.3Å; F46-R49 WeakPolarHBondContact O-CB 3.3Å; F46-R49 PolarHBondContact O-N 3.03Å; F46-R49 VanDerWaalsContact O-N 3.09Å; R47-R49 PolarHBondContact O-N 3.1Å; R49-A73 WeakPolarHBondContact O-CA 3.38Å; R49-R74 PolarHBondContact O-N 2.78Å; R49-D128 HydrophobicContact CB-CB 4.3Å; R49-D128 IonicContact NH1-OD1 3.8Å; R49-D128 PolarHBondContact NH1-OD1 2.94Å; R49-D276 IonicContact CZ-OD2 2.73Å; R49-D276 IonicContact NH2-OD1 3.19Å; R49-D276 PolarHBondContact NH2-OD1 3.46Å; R49-D276 IonicContact NH2-OD2 3.57Å; R49-D276 PolarHBondContact NH2-OD2 2.92Å
50	L	98.8	Very high	97.9	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.5	170.6	177.8	64.3	0	0	0	110.5	R74 V76 G125 P127 D128 V129	L50-R74 WeakPolarHBondContact CA-O 3.22Å; L50-R74 HydrophobicContact CD1-CB 3.97Å; L50-R74 WeakPolarHBondContact CD1-O 3.31Å; L50-V76 HydrophobicContact CD1-CG2 3.88Å; L50-G125 WeakPolarHBondContact CD2-O 3.41Å; L50-P127 HydrophobicContact CD2-CB 4.44Å; L50-P127 HydrophobicContact CG-CB 4.29Å; L50-P127 WeakPolarHBondContact O-CA 3.47Å; L50-D128 PolarHBondContact N-OD2 2.8Å; L50-D128 PolarHBondContact O-N 3.36Å; L50-V129 PolarHBondContact O-N 2.75Å; L50-V129 VanDerWaalsContact O-N 3.1Å
51	A	98.9	Very high	97.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.6	174.7	0	0	0	0	0	111.8	I53 L68 R74 C75 V76 V129	A51-I53 HydrophobicContact CB-CD1 3.79Å; A51-L68 HydrophobicContact CB-CD1 3.86Å; A51-R74 PolarHBondContact N-O 2.96Å; A51-C75 CarbonylContact O-C 3.59Å; A51-C75 WeakPolarHBondContact O-CA 3.13Å; A51-V76 PolarHBondContact O-N 3.09Å; A51-V129 CarbonylContact C-O 3.58Å; A51-V129 WeakPolarHBondContact CA-O 3.47Å; A51-V129 HydrophobicContact CB-CB 4Å; A51-V129 HydrophobicContact CB-CG1 4.32Å
52	F	98.9	Very high	97.9	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.2	172	179.9	-101.5	0	0	0	110.3	T54 V76 A78 M120 P127 V129 I130 I131 V164 L168	F52-T54 HydrophobicContact CD1-CG2 4.42Å; F52-T54 HydrophobicContact CE1-CG2 3.6Å; F52-T54 HydrophobicContact CZ-CG2 4.16Å; F52-V76 WeakPolarHBondContact CA-O 3.25Å; F52-V76 HydrophobicContact CD2-CB 4.1Å; F52-V76 HydrophobicContact CD2-CG1 3.82Å; F52-V76 HydrophobicContact CE2-CG1 4.12Å; F52-A78 HydrophobicContact CE2-CB 3.7Å; F52-A78 HydrophobicContact CZ-CB 3.66Å; F52-M120 HydrophobicContact CB-SD 3.93Å; F52-M120 HydrophobicContact CD2-SD 3.45Å; F52-M120 WeakPolarHBondContact CD2-SD 3.44Å; F52-M120 HydrophobicContact CE2-SD 4.22Å; F52-M120 HydrophobicContact CG-SD 3.92Å; F52-P127 HydrophobicContact CB-CB 4.01Å; F52-P127 HydrophobicContact CB-CG 4.22Å; F52-V129 PolarHBondContact N-O 2.79Å; F52-I130 HydrophobicContact CD1-CG2 4.35Å; F52-I130 WeakPolarHBondContact O-CA 3.47Å; F52-I131 PolarHBondContact O-N 2.97Å; F52-V164 HydrophobicContact CD1-CG1 4.32Å; F52-V164 HydrophobicContact CE1-CG1 3.76Å; F52-L168 HydrophobicContact CD1-CD1 3.75Å; F52-L168 HydrophobicContact CE1-CD1 4.13Å; F52-L168 HydrophobicContact CG-CD1 4.39Å
53	I	98.9	Very high	97.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	114.9	-174.5	-52.6	92.7	0	0	0	110.8	A51 G56 L68 C75 V76 I77 A78 I131	A51-I53 HydrophobicContact CB-CD1 3.79Å; I53-G56 PolarHBondContact O-N 2.95Å; I53-L68 HydrophobicContact CD1-CD1 4.48Å; I53-C75 HydrophobicContact CD1-CB 4.37Å; I53-V76 PolarHBondContact N-O 2.81Å; I53-I77 HydrophobicContact CB-CG2 4.41Å; I53-I77 HydrophobicContact CD1-CG2 4.45Å; I53-I77 WeakPolarHBondContact O-CA 3.44Å; I53-A78 PolarHBondContact O-N 2.81Å; I53-I131 HydrophobicContact CB-CB 4.47Å; I53-I131 HydrophobicContact CG1-CB 4.13Å; I53-I131 HydrophobicContact CG1-CD1 4.19Å; I53-I131 HydrophobicContact CG1-CG1 4.3Å; I53-I131 HydrophobicContact CG2-CB 4.18Å; I53-I131 HydrophobicContact CG2-CG2 4.43Å
54	T	98.9	Very high	97.9	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	137.1	171.6	68.1	0	0	0	0	110.6	F52 G56 A78 V107 I131 N133 A134 V164	F52-T54 HydrophobicContact CD1-CG2 4.42Å; F52-T54 HydrophobicContact CE1-CG2 3.6Å; F52-T54 HydrophobicContact CZ-CG2 4.16Å; T54-G56 PolarHBondContact O-N 3.38Å; T54-A78 CarbonylContact C-O 3.04Å; T54-A78 WeakPolarHBondContact CA-O 3.38Å; T54-V107 HydrophobicContact CG2-CG1 4.08Å; T54-I131 PolarHBondContact N-O 2.68Å; T54-N133 CarbonylContact O-C 3.58Å; T54-N133 VanDerWaalsContact O-CB 3.32Å; T54-N133 WeakPolarHBondContact O-CB 3.41Å; T54-N133 PolarHBondContact O-ND2 3.24Å; T54-N133 PolarHBondContact OG1-N 2.91Å; T54-N133 VanDerWaalsContact OG1-N 3.08Å; T54-A134 PolarHBondContact O-N 3.08Å; T54-A134 WeakPolarHBondContact OG1-CB 3.49Å; T54-A134 PolarHBondContact OG1-N 3.01Å; T54-A134 VanDerWaalsContact OG1-N 3.07Å; T54-V164 HydrophobicContact CG2-CG1 4.27Å; T54-V164 HydrophobicContact CG2-CG2 4.13Å
55	G	98.2	Very high	98	Very high	12 Å²	12	32.6 Å²	32.6	12%	0.124	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	20.3	-171.7	0	0	0	0	0	113.6	G57 A78 N133	G55-G57 PolarHBondContact O-N 3.34Å; G55-G57 VanDerWaalsContact O-N 3.12Å; G55-A78 PolarHBondContact N-O 2.93Å; G55-N133 PolarHBondContact O-ND2 2.98Å
56	G	98.1	Very high	98	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.9	-174.8	0	0	0	0	0	116.3	I53 T54 G61 R62 T65	I53-G56 PolarHBondContact O-N 2.95Å; T54-G56 PolarHBondContact O-N 3.38Å; G56-G61 CarbonylContact O-C 3.49Å; G56-R62 WeakPolarHBondContact O-CA 3.46Å; G56-R62 PolarHBondContact O-N 3.2Å; G56-T65 PolarHBondContact O-OG1 3.38Å
57	G	97.1	Very high	98	Very high	3 Å²	3	31.8 Å²	31.8	3%	0.031	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-10.5	-179.3	0	0	0	0	0	115.5	G55 T88	G55-G57 PolarHBondContact O-N 3.34Å; G55-G57 VanDerWaalsContact O-N 3.12Å; G57-T88 PolarHBondContact O-OG1 3.29Å
58	T	96.1	Very high	98.1	Very high	88 Å²	88	23.7 Å²	23.7	54%	0.54	13%	0.131	S	C	.	.	S	Bend	trans	-143.7	160.5	-177	65.5	0	0	0	0	112.4	L60 G61 R62 V84	T58-L60 PolarHBondContact O-N 3.08Å; T58-G61 PolarHBondContact O-N 2.97Å; T58-G61 VanDerWaalsContact O-N 3.14Å; T58-R62 PolarHBondContact O-N 3.37Å; T58-R62 VanDerWaalsContact O-N 3.08Å; T58-V84 HydrophobicContact CG2-CG1 3.72Å
59	G	95	Very high	98.2	Very high	32 Å²	32	17.5 Å²	17.5	33%	0.33	10%	0.098	S	C	.	.	H	α-helix	trans	52.5	-128.3	168.8	0	0	0	0	0	113.8	R62 A63	G59-R62 PolarHBondContact O-N 2.88Å; G59-A63 PolarHBondContact O-N 2.99Å; G59-A63 VanDerWaalsContact O-N 3.16Å
60	L	97.3	Very high	98.2	Very high	29 Å²	29	18.3 Å²	18.3	15%	0.152	11%	0.106	C	C	.	.	H	α-helix	trans	-64.4	-38.6	179.8	-61.4	-179.8	0	0	0	112.5	T58 R62 A63 M64 I184 I232 T234 P263 L266	T58-L60 PolarHBondContact O-N 3.08Å; L60-R62 PolarHBondContact O-N 2.96Å; L60-A63 PolarHBondContact O-N 3.4Å; L60-M64 HydrophobicContact CB-CE 4.36Å; L60-M64 WeakPolarHBondContact O-CE 3.44Å; L60-M64 WeakPolarHBondContact O-CG 3.41Å; L60-M64 PolarHBondContact O-N 3.41Å; L60-I184 HydrophobicContact CD1-CG2 4.34Å; L60-I232 HydrophobicContact CD1-CD1 4.43Å; L60-I232 HydrophobicContact CD2-CB 4.15Å; L60-I232 HydrophobicContact CD2-CD1 3.86Å; L60-I232 HydrophobicContact CD2-CG2 3.68Å; L60-T234 HydrophobicContact CD2-CG2 4.31Å; L60-T234 HydrophobicContact CG-CG2 4.47Å; L60-P263 HydrophobicContact CD2-CB 4.25Å; L60-L266 HydrophobicContact CB-CD2 4.4Å; L60-L266 HydrophobicContact CD1-CD1 3.97Å; L60-L266 HydrophobicContact CD2-CD1 4.25Å; L60-L266 HydrophobicContact CD2-CD2 4.3Å
61	G	98.3	Very high	98.2	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-57.3	-48.5	175.8	0	0	0	0	0	111.6	G56 T58 A63 M64 T65 N133	G56-G61 CarbonylContact O-C 3.49Å; T58-G61 PolarHBondContact O-N 2.97Å; T58-G61 VanDerWaalsContact O-N 3.14Å; G61-A63 VanDerWaalsContact C-N 3.34Å; G61-A63 PolarHBondContact O-N 3.48Å; G61-M64 PolarHBondContact O-N 2.92Å; G61-T65 PolarHBondContact O-N 3.26Å; G61-T65 PolarHBondContact O-OG1 3.28Å; G61-N133 WeakPolarHBondContact CA-ND2 3.32Å
62	R	98.3	Very high	98.2	Very high	77 Å²	77	19.2 Å²	19.2	29%	0.291	11%	0.114	S	C	.	.	H	α-helix	trans	-60.6	-42	176	-178.6	176.5	-178.5	-72.4	5.1	112.2	G56 T58 G59 L60 T65 M66 T88 E91 I92	G56-R62 WeakPolarHBondContact O-CA 3.46Å; G56-R62 PolarHBondContact O-N 3.2Å; T58-R62 PolarHBondContact O-N 3.37Å; T58-R62 VanDerWaalsContact O-N 3.08Å; G59-R62 PolarHBondContact O-N 2.88Å; L60-R62 PolarHBondContact O-N 2.96Å; R62-T65 PolarHBondContact O-N 3.08Å; R62-M66 WeakPolarHBondContact O-CB 3.44Å; R62-M66 PolarHBondContact O-N 3.29Å; R62-T88 HydrophobicContact CB-CG2 4.3Å; R62-T88 HydrophobicContact CG-CG2 3.65Å; R62-E91 IonicContact CZ-OE2 2.69Å; R62-E91 IonicContact NE-OE2 2.69Å; R62-E91 IonicContact NH2-OE2 3.8Å; R62-E91 PolarHBondContact NH2-OE2 3.41Å; R62-I92 HydrophobicContact CG-CD1 4.26Å
63	A	98.3	Very high	98.1	Very high	15 Å²	15	19 Å²	19	12%	0.124	11%	0.113	C	C	.	.	H	α-helix	trans	-64.8	-43.1	179.2	0	0	0	0	0	112.3	G59 L60 G61 M66 V67 P263 A267	G59-A63 PolarHBondContact O-N 2.99Å; G59-A63 VanDerWaalsContact O-N 3.16Å; L60-A63 PolarHBondContact O-N 3.4Å; G61-A63 VanDerWaalsContact C-N 3.34Å; G61-A63 PolarHBondContact O-N 3.48Å; A63-M66 PolarHBondContact O-N 3.01Å; A63-V67 PolarHBondContact O-N 3.49Å; A63-P263 HydrophobicContact CB-CB 3.48Å; A63-P263 VanDerWaalsContact CB-CB 3.48Å; A63-A267 HydrophobicContact CB-CB 4.28Å; A63-A267 WeakPolarHBondContact O-CB 3.22Å
64	M	98.8	Very high	98.1	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-44.5	174.8	-70.3	-177.4	-71.1	0	0	111.8	L60 G61 M66 V67 L68 I131 N133 I184 L266 A267 A270	L60-M64 HydrophobicContact CB-CE 4.36Å; L60-M64 WeakPolarHBondContact O-CE 3.44Å; L60-M64 WeakPolarHBondContact O-CG 3.41Å; L60-M64 PolarHBondContact O-N 3.41Å; G61-M64 PolarHBondContact O-N 2.92Å; M64-M66 VanDerWaalsContact C-N 3.32Å; M64-M66 PolarHBondContact O-N 2.7Å; M64-V67 PolarHBondContact O-N 3.46Å; M64-L68 WeakPolarHBondContact O-CB 3.32Å; M64-L68 WeakPolarHBondContact O-CG 3.43Å; M64-L68 PolarHBondContact O-N 3.35Å; M64-I131 HydrophobicContact CB-CD1 4.36Å; M64-I131 HydrophobicContact CE-CG2 3.82Å; M64-I131 HydrophobicContact SD-CD1 4.08Å; M64-I131 HydrophobicContact SD-CG2 3.87Å; M64-N133 HydrophobicContact CE-CB 3.83Å; M64-I184 HydrophobicContact CE-CD1 4.25Å; M64-I184 HydrophobicContact CE-CG1 3.86Å; M64-I184 HydrophobicContact SD-CD1 3.95Å; M64-I184 HydrophobicContact SD-CG1 4.23Å; M64-L266 HydrophobicContact CE-CD2 4.45Å; M64-L266 HydrophobicContact CG-CD2 4.04Å; M64-L266 HydrophobicContact SD-CD2 3.85Å; M64-A267 HydrophobicContact CG-CB 4.14Å; M64-A270 HydrophobicContact CG-CB 3.86Å; M64-A270 HydrophobicContact SD-CB 3.55Å; M64-A270 VanDerWaalsContact SD-CB 3.55Å
65	T	98.9	Very high	98.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.1	-45.3	174.8	-53.2	0	0	0	0	111.2	G56 G61 R62 S69 C75 I77 I92 V100	G56-T65 PolarHBondContact O-OG1 3.38Å; G61-T65 PolarHBondContact O-N 3.26Å; G61-T65 PolarHBondContact O-OG1 3.28Å; R62-T65 PolarHBondContact O-N 3.08Å; T65-S69 VanDerWaalsContact O-CB 3.23Å; T65-S69 WeakPolarHBondContact O-CB 3.49Å; T65-S69 PolarHBondContact O-N 2.78Å; T65-C75 HydrophobicContact CG2-CB 3.87Å; T65-I77 HydrophobicContact CG2-CG2 3.54Å; T65-I77 VanDerWaalsContact OG1-CG2 3.29Å; T65-I77 WeakPolarHBondContact OG1-CG2 3.38Å; T65-I92 HydrophobicContact CG2-CD1 3.61Å; T65-V100 HydrophobicContact CG2-CG1 4Å; T65-V100 HydrophobicContact CG2-CG2 4.44Å
66	M	98.6	Very high	98.2	Very high	18 Å²	18	22.6 Å²	22.6	9%	0.089	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-52.1	178.7	176.9	60.3	82.6	0	0	111.6	R62 A63 M64 S69 Q70 I92 Q95 T96	R62-M66 WeakPolarHBondContact O-CB 3.44Å; R62-M66 PolarHBondContact O-N 3.29Å; A63-M66 PolarHBondContact O-N 3.01Å; M64-M66 VanDerWaalsContact C-N 3.32Å; M64-M66 PolarHBondContact O-N 2.7Å; M66-S69 PolarHBondContact O-N 2.82Å; M66-Q70 HydrophobicContact CG-CG 4.39Å; M66-Q70 WeakPolarHBondContact O-CB 3.22Å; M66-Q70 VanDerWaalsContact O-CG 3.27Å; M66-Q70 WeakPolarHBondContact O-CG 3.41Å; M66-Q70 PolarHBondContact O-N 2.9Å; M66-Q70 HydrophobicContact SD-CG 4.03Å; M66-I92 HydrophobicContact CB-CD1 4.48Å; M66-I92 HydrophobicContact CE-CB 4.36Å; M66-I92 HydrophobicContact CE-CG1 3.78Å; M66-I92 HydrophobicContact CE-CG2 4.42Å; M66-I92 HydrophobicContact SD-CG1 4.42Å; M66-I92 HydrophobicContact SD-CG2 4.07Å; M66-Q95 HydrophobicContact CE-CB 4.31Å; M66-T96 HydrophobicContact SD-CG2 3.72Å
67	V	98.7	Very high	98.2	Very high	6 Å²	6	22.6 Å²	22.6	4%	0.036	12%	0.122	C	C	.	.	H	α-helix	trans	-64.9	-43	-177.8	171.2	0	0	0	0	111.5	A63 M64 S69 Q70 L71 A267 A271	A63-V67 PolarHBondContact O-N 3.49Å; M64-V67 PolarHBondContact O-N 3.46Å; V67-S69 VanDerWaalsContact C-N 3.34Å; V67-S69 PolarHBondContact O-N 3.34Å; V67-Q70 PolarHBondContact O-N 3.43Å; V67-L71 HydrophobicContact CG1-CD1 3.88Å; V67-L71 HydrophobicContact CG1-CG 4.46Å; V67-L71 VanDerWaalsContact O-CG 3.25Å; V67-L71 WeakPolarHBondContact O-CG 3.42Å; V67-L71 PolarHBondContact O-N 2.82Å; V67-A267 HydrophobicContact CB-CB 3.96Å; V67-A267 HydrophobicContact CG2-CB 3.57Å; V67-A271 HydrophobicContact CG1-CB 4.12Å
68	L	98.8	Very high	98.3	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-62.1	-42.5	176.6	-71.1	170.6	0	0	0	111.6	F46 A51 I53 M64 L71 G72 A73 I131 A271	F46-L68 HydrophobicContact CD1-CD2 3.96Å; F46-L68 HydrophobicContact CD2-CD2 4.03Å; F46-L68 HydrophobicContact CE1-CD2 3.76Å; F46-L68 HydrophobicContact CE2-CD2 3.8Å; F46-L68 HydrophobicContact CG-CD2 4.1Å; F46-L68 HydrophobicContact CZ-CD2 3.66Å; A51-L68 HydrophobicContact CB-CD1 3.86Å; I53-L68 HydrophobicContact CD1-CD1 4.48Å; M64-L68 WeakPolarHBondContact O-CB 3.32Å; M64-L68 WeakPolarHBondContact O-CG 3.43Å; M64-L68 PolarHBondContact O-N 3.35Å; L68-L71 CarbonylContact O-C 3.52Å; L68-L71 PolarHBondContact O-N 2.69Å; L68-G72 PolarHBondContact O-N 3.29Å; L68-A73 HydrophobicContact CB-CB 4.03Å; L68-A73 WeakPolarHBondContact O-CB 3.2Å; L68-A73 PolarHBondContact O-N 2.75Å; L68-I131 HydrophobicContact CD1-CD1 3.84Å; L68-A271 HydrophobicContact CD2-CB 4.2Å
69	S	98.7	Very high	98.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.6	-41.4	175.5	-161.5	0	0	0	0	112	T65 M66 V67 L71 G72 T96 N98	T65-S69 VanDerWaalsContact O-CB 3.23Å; T65-S69 WeakPolarHBondContact O-CB 3.49Å; T65-S69 PolarHBondContact O-N 2.78Å; M66-S69 PolarHBondContact O-N 2.82Å; V67-S69 VanDerWaalsContact C-N 3.34Å; V67-S69 PolarHBondContact O-N 3.34Å; S69-L71 PolarHBondContact O-N 3.47Å; S69-G72 PolarHBondContact O-N 2.98Å; S69-T96 PolarHBondContact OG-OG1 3.39Å; S69-N98 PolarHBondContact O-ND2 3.02Å
70	Q	98.4	Very high	98.5	Very high	94 Å²	94	24.8 Å²	24.8	44%	0.439	11%	0.114	S	C	.	.	H	α-helix	trans	-60.3	-33.3	173.5	-76	173.6	-10.1	0	0	112.4	M66 V67 G72 T96	M66-Q70 HydrophobicContact CG-CG 4.39Å; M66-Q70 WeakPolarHBondContact O-CB 3.22Å; M66-Q70 VanDerWaalsContact O-CG 3.27Å; M66-Q70 WeakPolarHBondContact O-CG 3.41Å; M66-Q70 PolarHBondContact O-N 2.9Å; M66-Q70 HydrophobicContact SD-CG 4.03Å; V67-Q70 PolarHBondContact O-N 3.43Å; Q70-G72 VanDerWaalsContact C-N 3.26Å; Q70-G72 PolarHBondContact O-N 2.93Å; Q70-T96 HydrophobicContact CB-CG2 4.36Å; Q70-T96 HydrophobicContact CG-CG2 3.55Å
71	L	98.7	Very high	98.6	Very high	3 Å²	3	30 Å²	30	2%	0.016	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	2.7	177.5	-64.8	170.4	0	0	0	113.7	A39 L41 G44 S45 F46 V67 L68 S69 A271	A39-L71 HydrophobicContact CB-CD2 4.15Å; L41-L71 HydrophobicContact CB-CD1 4Å; L41-L71 HydrophobicContact CB-CD2 3.99Å; L41-L71 HydrophobicContact CD1-CD1 4.2Å; L41-L71 VanDerWaalsContact O-CD2 3.31Å; L41-L71 WeakPolarHBondContact O-CD2 3.27Å; G44-L71 CarbonylContact C-O 3.53Å; G44-L71 WeakPolarHBondContact CA-O 3.46Å; G44-L71 PolarHBondContact N-O 2.73Å; S45-L71 PolarHBondContact N-O 3.03Å; F46-L71 HydrophobicContact CB-CB 4.19Å; F46-L71 HydrophobicContact CD2-CB 3.75Å; F46-L71 HydrophobicContact CD2-CD1 3.77Å; F46-L71 HydrophobicContact CD2-CG 4.41Å; F46-L71 HydrophobicContact CE2-CD1 3.95Å; F46-L71 HydrophobicContact CG-CB 4.42Å; F46-L71 PolarHBondContact N-O 3.12Å; V67-L71 HydrophobicContact CG1-CD1 3.88Å; V67-L71 HydrophobicContact CG1-CG 4.46Å; V67-L71 VanDerWaalsContact O-CG 3.25Å; V67-L71 WeakPolarHBondContact O-CG 3.42Å; V67-L71 PolarHBondContact O-N 2.82Å; L68-L71 CarbonylContact O-C 3.52Å; L68-L71 PolarHBondContact O-N 2.69Å; S69-L71 PolarHBondContact O-N 3.47Å; L71-A271 HydrophobicContact CD1-CB 4Å
72	G	98.3	Very high	98.5	Very high	15 Å²	15	32.5 Å²	32.5	16%	0.155	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.6	5.2	173.7	0	0	0	0	0	115.8	F46 L68 S69 Q70	F46-G72 CarbonylContact O-C 3.5Å; L68-G72 PolarHBondContact O-N 3.29Å; S69-G72 PolarHBondContact O-N 2.98Å; Q70-G72 VanDerWaalsContact C-N 3.26Å; Q70-G72 PolarHBondContact O-N 2.93Å
73	A	98.6	Very high	98.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.161	C	C	.	.			trans	-70.7	140.4	176.8	0	0	0	0	0	111.3	F46 R49 L68	F46-A73 HydrophobicContact CB-CB 3.85Å; F46-A73 WeakPolarHBondContact O-CA 3.17Å; F46-A73 PolarHBondContact O-N 3.04Å; R49-A73 WeakPolarHBondContact O-CA 3.38Å; L68-A73 HydrophobicContact CB-CB 4.03Å; L68-A73 WeakPolarHBondContact O-CB 3.2Å; L68-A73 PolarHBondContact O-N 2.75Å
74	R	98.4	Very high	98.5	Very high	91 Å²	91	34.6 Å²	34.6	34%	0.343	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	137.7	154.1	-68.4	178.8	-67.7	136.9	3	107.7	R49 L50 A51 S124	R49-R74 PolarHBondContact O-N 2.78Å; L50-R74 WeakPolarHBondContact CA-O 3.22Å; L50-R74 HydrophobicContact CD1-CB 3.97Å; L50-R74 WeakPolarHBondContact CD1-O 3.31Å; A51-R74 PolarHBondContact N-O 2.96Å; R74-S124 PolarHBondContact NH1-O 2.99Å
75	C	98.9	Very high	98.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.6	-177.4	-64	0	0	0	0	111.7	A51 I53 T65 Q99 V100 H101	A51-C75 CarbonylContact O-C 3.59Å; A51-C75 WeakPolarHBondContact O-CA 3.13Å; I53-C75 HydrophobicContact CD1-CB 4.37Å; T65-C75 HydrophobicContact CG2-CB 3.87Å; C75-Q99 PolarHBondContact N-O 2.99Å; C75-Q99 VanDerWaalsContact N-O 3.1Å; C75-V100 HydrophobicContact CB-CB 4.45Å; C75-V100 HydrophobicContact CB-CG1 4.04Å; C75-V100 HydrophobicContact CB-CG2 4.1Å; C75-V100 CarbonylContact O-C 3.54Å; C75-V100 VanDerWaalsContact O-CA 3.29Å; C75-V100 WeakPolarHBondContact O-CA 3.3Å; C75-H101 PolarHBondContact O-N 3.11Å
76	V	98.9	Very high	98.5	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.3	168.9	176.1	0	0	0	0	107.2	L50 A51 F52 I53 H101 L103 M120	L50-V76 HydrophobicContact CD1-CG2 3.88Å; A51-V76 PolarHBondContact O-N 3.09Å; F52-V76 WeakPolarHBondContact CA-O 3.25Å; F52-V76 HydrophobicContact CD2-CB 4.1Å; F52-V76 HydrophobicContact CD2-CG1 3.82Å; F52-V76 HydrophobicContact CE2-CG1 4.12Å; I53-V76 PolarHBondContact N-O 2.81Å; V76-H101 CarbonylContact C-O 3.53Å; V76-H101 WeakPolarHBondContact CA-O 3.47Å; V76-H101 HydrophobicContact CG2-CB 4Å; V76-L103 HydrophobicContact CG1-CD1 3.59Å; V76-L103 HydrophobicContact CG1-CG 3.96Å; V76-M120 HydrophobicContact CB-CG 4.18Å; V76-M120 HydrophobicContact CB-SD 4.45Å; V76-M120 HydrophobicContact CG1-CB 4.29Å; V76-M120 HydrophobicContact CG1-CG 4Å; V76-M120 HydrophobicContact CG1-SD 4.44Å; V76-M120 HydrophobicContact CG2-CG 3.86Å
77	I	98.9	Very high	98.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.2	179.6	58	172.3	0	0	0	110.5	I53 T65 L85 T88 A89 V100 H101 L103	I53-I77 HydrophobicContact CB-CG2 4.41Å; I53-I77 HydrophobicContact CD1-CG2 4.45Å; I53-I77 WeakPolarHBondContact O-CA 3.44Å; T65-I77 HydrophobicContact CG2-CG2 3.54Å; T65-I77 VanDerWaalsContact OG1-CG2 3.29Å; T65-I77 WeakPolarHBondContact OG1-CG2 3.38Å; I77-L85 HydrophobicContact CB-CD2 4.08Å; I77-L85 HydrophobicContact CD1-CB 4.34Å; I77-L85 HydrophobicContact CD1-CD2 3.79Å; I77-L85 HydrophobicContact CG1-CD2 3.81Å; I77-T88 HydrophobicContact CD1-CG2 4.18Å; I77-A89 HydrophobicContact CD1-CB 4.15Å; I77-V100 HydrophobicContact CD1-CG1 4.21Å; I77-V100 HydrophobicContact CG1-CG1 4.1Å; I77-V100 HydrophobicContact CG2-CG1 4.25Å; I77-H101 WeakPolarHBondContact CG1-O 3.36Å; I77-H101 PolarHBondContact N-O 3.1Å; I77-L103 PolarHBondContact O-N 2.79Å
78	A	98.9	Very high	98.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.5	-175.1	0	0	0	0	0	113	F52 I53 T54 G55 L103 C105	F52-A78 HydrophobicContact CE2-CB 3.7Å; F52-A78 HydrophobicContact CZ-CB 3.66Å; I53-A78 PolarHBondContact O-N 2.81Å; T54-A78 CarbonylContact C-O 3.04Å; T54-A78 WeakPolarHBondContact CA-O 3.38Å; G55-A78 PolarHBondContact N-O 2.93Å; A78-L103 VanDerWaalsContact CA-O 3.28Å; A78-L103 WeakPolarHBondContact CA-O 3.36Å; A78-C105 HydrophobicContact CB-CB 4.1Å
79	S	98.6	Very high	98.5	Very high	28 Å²	28	45.3 Å²	45.3	20%	0.196	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	178.1	173.7	91.1	0	0	0	0	111.4	L85 L103 Q104 C105	S79-L85 VanDerWaalsContact N-CD1 3.33Å; S79-L85 WeakPolarHBondContact O-CD1 3.47Å; S79-L85 WeakPolarHBondContact OG-CD1 3.27Å; S79-L85 WeakPolarHBondContact OG-CG 3.47Å; S79-L103 PolarHBondContact N-O 3.15Å; S79-Q104 CarbonylContact O-C 3.57Å; S79-Q104 WeakPolarHBondContact O-CA 3.29Å; S79-C105 CarbonylContact C-O 3.59Å; S79-C105 WeakPolarHBondContact CA-O 3.41Å; S79-C105 PolarHBondContact O-N 3.47Å
80	R	97.9	Very high	98.5	Very high	140 Å²	140	47.3 Å²	47.3	53%	0.528	24%	0.236	S	C	.	.	S	Bend	trans	-71.9	-31.7	-176.1	-65.1	175	-65.7	163.9	-0.9	114.5	Q104 C105 D106	R80-Q104 WeakPolarHBondContact O-CG 3.33Å; R80-Q104 PolarHBondContact O-NE2 2.88Å; R80-C105 PolarHBondContact N-O 2.86Å; R80-D106 WeakPolarHBondContact CD-OD2 3.41Å; R80-D106 HydrophobicContact CG-CB 3.9Å
81	K	97.6	Very high	98.5	Very high	138 Å²	138	46.1 Å²	46.1	60%	0.6	23%	0.23	S	C	*	.			trans	-96.1	96.3	-173.5	-69.7	-168.4	175.9	-163.5	0	110.1	D83 V84 L85	K81-D83 WeakPolarHBondContact CB-OD1 3.4Å; K81-V84 HydrophobicContact CB-CB 4.18Å; K81-V84 HydrophobicContact CB-CG2 4.05Å; K81-V84 HydrophobicContact CD-CG2 4.12Å; K81-V84 PolarHBondContact O-N 3.01Å; K81-L85 WeakPolarHBondContact O-CG 3.48Å; K81-L85 PolarHBondContact O-N 3.45Å
82	L	98.2	Very high	98.5	Very high	53 Å²	53	46 Å²	46	28%	0.277	23%	0.23	S	C	.	.	H	α-helix	trans	-65.9	-39	-173.6	-177.4	58.2	0	0	0	112.5	V84 L85 Q86 A102 Q104	L82-V84 PolarHBondContact O-N 3.41Å; L82-L85 WeakPolarHBondContact O-CB 3.19Å; L82-L85 PolarHBondContact O-N 3.18Å; L82-Q86 HydrophobicContact CD1-CG 4.03Å; L82-Q86 HydrophobicContact CG-CG 4.21Å; L82-Q86 WeakPolarHBondContact O-CB 3.33Å; L82-Q86 WeakPolarHBondContact O-CG 3.48Å; L82-Q86 PolarHBondContact O-N 2.85Å; L82-A102 HydrophobicContact CD1-CB 4.5Å; L82-Q104 HydrophobicContact CB-CB 4.23Å; L82-Q104 HydrophobicContact CB-CG 4.34Å; L82-Q104 HydrophobicContact CD1-CB 4.25Å
83	D	98.3	Very high	98.5	Very high	103 Å²	103	46.3 Å²	46.3	55%	0.551	23%	0.23	S	C	*	.	H	α-helix	trans	-52.9	-52.8	174.9	58.3	-39.5	0	0	0	112.1	K81 L85 Q86 E87	K81-D83 WeakPolarHBondContact CB-OD1 3.4Å; D83-L85 VanDerWaalsContact C-N 3.3Å; D83-L85 PolarHBondContact O-N 3Å; D83-Q86 PolarHBondContact O-N 3.45Å; D83-E87 PolarHBondContact O-N 3.38Å
84	V	98	Very high	98.5	Very high	33 Å²	33	50.9 Å²	50.9	20%	0.2	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-36.2	179.2	178.8	0	0	0	0	111.6	T58 K81 L82 T88	T58-V84 HydrophobicContact CG2-CG1 3.72Å; K81-V84 HydrophobicContact CB-CB 4.18Å; K81-V84 HydrophobicContact CB-CG2 4.05Å; K81-V84 HydrophobicContact CD-CG2 4.12Å; K81-V84 PolarHBondContact O-N 3.01Å; L82-V84 PolarHBondContact O-N 3.41Å; V84-T88 WeakPolarHBondContact O-CB 3.2Å; V84-T88 PolarHBondContact O-N 3.49Å; V84-T88 VanDerWaalsContact O-N 3.09Å; V84-T88 PolarHBondContact O-OG1 3.31Å
85	L	98.6	Very high	98.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.6	-44.3	177	-68.4	166.2	0	0	0	111.5	I77 S79 K81 L82 D83 T88 A89 A102 L103	I77-L85 HydrophobicContact CB-CD2 4.08Å; I77-L85 HydrophobicContact CD1-CB 4.34Å; I77-L85 HydrophobicContact CD1-CD2 3.79Å; I77-L85 HydrophobicContact CG1-CD2 3.81Å; S79-L85 VanDerWaalsContact N-CD1 3.33Å; S79-L85 WeakPolarHBondContact O-CD1 3.47Å; S79-L85 WeakPolarHBondContact OG-CD1 3.27Å; S79-L85 WeakPolarHBondContact OG-CG 3.47Å; K81-L85 WeakPolarHBondContact O-CG 3.48Å; K81-L85 PolarHBondContact O-N 3.45Å; L82-L85 WeakPolarHBondContact O-CB 3.19Å; L82-L85 PolarHBondContact O-N 3.18Å; D83-L85 VanDerWaalsContact C-N 3.3Å; D83-L85 PolarHBondContact O-N 3Å; L85-T88 PolarHBondContact O-N 3.33Å; L85-A89 WeakPolarHBondContact O-CB 3.3Å; L85-A89 PolarHBondContact O-N 2.99Å; L85-A102 HydrophobicContact CB-CB 3.65Å; L85-L103 VanDerWaalsContact CD1-O 3.26Å; L85-L103 WeakPolarHBondContact CD1-O 3.47Å
86	Q	98.7	Very high	98.5	Very high	116 Å²	116	53.6 Å²	53.6	54%	0.542	28%	0.28	S	S	.	.	H	α-helix	trans	-64.1	-44.8	-179.4	-75.6	175	-33.2	0	0	111.3	L82 D83 A89 G90 A102	L82-Q86 HydrophobicContact CD1-CG 4.03Å; L82-Q86 HydrophobicContact CG-CG 4.21Å; L82-Q86 WeakPolarHBondContact O-CB 3.33Å; L82-Q86 WeakPolarHBondContact O-CG 3.48Å; L82-Q86 PolarHBondContact O-N 2.85Å; D83-Q86 PolarHBondContact O-N 3.45Å; Q86-A89 PolarHBondContact O-N 3.29Å; Q86-G90 PolarHBondContact O-N 2.95Å; Q86-A102 HydrophobicContact CG-CB 4Å
87	E	98.6	Very high	98.4	Very high	124 Å²	124	56.9 Å²	56.9	58%	0.579	31%	0.314	S	S	*	.	H	α-helix	trans	-56	-53.6	173	-177.6	-178	-168.1	0	0	110.6	D83 A89 G90 E91	D83-E87 PolarHBondContact O-N 3.38Å; E87-A89 PolarHBondContact O-N 3.45Å; E87-G90 PolarHBondContact O-N 2.93Å; E87-E91 WeakPolarHBondContact O-CG 3.25Å; E87-E91 PolarHBondContact O-N 3Å
88	T	98.7	Very high	98.4	Very high	7 Å²	7	59.4 Å²	59.4	4%	0.043	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-41.2	-179	-61.2	0	0	0	0	112.6	G57 R62 I77 V84 L85 E91 I92	G57-T88 PolarHBondContact O-OG1 3.29Å; R62-T88 HydrophobicContact CB-CG2 4.3Å; R62-T88 HydrophobicContact CG-CG2 3.65Å; I77-T88 HydrophobicContact CD1-CG2 4.18Å; V84-T88 WeakPolarHBondContact O-CB 3.2Å; V84-T88 PolarHBondContact O-N 3.49Å; V84-T88 VanDerWaalsContact O-N 3.09Å; V84-T88 PolarHBondContact O-OG1 3.31Å; L85-T88 PolarHBondContact O-N 3.33Å; T88-E91 PolarHBondContact O-N 2.89Å; T88-I92 HydrophobicContact CG2-CD1 3.69Å; T88-I92 HydrophobicContact CG2-CG1 4.34Å; T88-I92 VanDerWaalsContact O-CG1 3.28Å; T88-I92 WeakPolarHBondContact O-CG1 3.28Å; T88-I92 PolarHBondContact O-N 3.28Å
89	A	98.8	Very high	98.3	Very high	6 Å²	6	64.1 Å²	64.1	5%	0.05	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-43.1	178.4	0	0	0	0	0	111.5	I77 L85 Q86 E87 I92 S93 V100 A102	I77-A89 HydrophobicContact CD1-CB 4.15Å; L85-A89 WeakPolarHBondContact O-CB 3.3Å; L85-A89 PolarHBondContact O-N 2.99Å; Q86-A89 PolarHBondContact O-N 3.29Å; E87-A89 PolarHBondContact O-N 3.45Å; A89-I92 PolarHBondContact O-N 3.21Å; A89-S93 VanDerWaalsContact O-CB 3.27Å; A89-S93 WeakPolarHBondContact O-CB 3.45Å; A89-S93 PolarHBondContact O-N 3.23Å; A89-S93 PolarHBondContact O-OG 3.32Å; A89-V100 HydrophobicContact CB-CB 4.01Å; A89-V100 HydrophobicContact CB-CG1 3.77Å; A89-A102 HydrophobicContact CB-CB 4.07Å
90	G	98.8	Very high	98.3	Very high	42 Å²	42	63 Å²	63	43%	0.433	34%	0.341	S	S	.	.	H	α-helix	trans	-63.4	-43.6	175.8	0	0	0	0	0	112.6	Q86 E87 S93 S94	Q86-G90 PolarHBondContact O-N 2.95Å; E87-G90 PolarHBondContact O-N 2.93Å; G90-S93 PolarHBondContact O-N 3.14Å; G90-S94 WeakPolarHBondContact O-CB 3.36Å; G90-S94 PolarHBondContact O-N 3.45Å; G90-S94 PolarHBondContact O-OG 3.44Å
91	E	98.7	Very high	98.3	Very high	68 Å²	68	58.2 Å²	58.2	32%	0.318	33%	0.325	S	S	.	.	H	α-helix	trans	-60.4	-49	175.4	-73.8	-178.2	168.7	0	0	112.3	R62 E87 T88 S94 Q95	R62-E91 IonicContact CZ-OE2 2.69Å; R62-E91 IonicContact NE-OE2 2.69Å; R62-E91 IonicContact NH2-OE2 3.8Å; R62-E91 PolarHBondContact NH2-OE2 3.41Å; E87-E91 WeakPolarHBondContact O-CG 3.25Å; E87-E91 PolarHBondContact O-N 3Å; T88-E91 PolarHBondContact O-N 2.89Å; E91-S94 PolarHBondContact O-N 2.75Å; E91-S94 PolarHBondContact O-OG 3.31Å; E91-Q95 WeakPolarHBondContact O-CB 3.36Å; E91-Q95 VanDerWaalsContact O-CG 3.28Å; E91-Q95 WeakPolarHBondContact O-CG 3.49Å; E91-Q95 PolarHBondContact O-N 3.06Å; E91-Q95 VanDerWaalsContact O-N 3.07Å
92	I	98.8	Very high	98.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-40.3	-178.1	-63.7	171.4	0	0	0	110.5	R62 T65 M66 T88 A89 S94 Q95 T96 V100	R62-I92 HydrophobicContact CG-CD1 4.26Å; T65-I92 HydrophobicContact CG2-CD1 3.61Å; M66-I92 HydrophobicContact CB-CD1 4.48Å; M66-I92 HydrophobicContact CE-CB 4.36Å; M66-I92 HydrophobicContact CE-CG1 3.78Å; M66-I92 HydrophobicContact CE-CG2 4.42Å; M66-I92 HydrophobicContact SD-CG1 4.42Å; M66-I92 HydrophobicContact SD-CG2 4.07Å; T88-I92 HydrophobicContact CG2-CD1 3.69Å; T88-I92 HydrophobicContact CG2-CG1 4.34Å; T88-I92 VanDerWaalsContact O-CG1 3.28Å; T88-I92 WeakPolarHBondContact O-CG1 3.28Å; T88-I92 PolarHBondContact O-N 3.28Å; A89-I92 PolarHBondContact O-N 3.21Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.1Å; I92-Q95 PolarHBondContact O-N 2.83Å; I92-T96 HydrophobicContact CG2-CG2 4.17Å; I92-T96 WeakPolarHBondContact O-CB 3.38Å; I92-T96 WeakPolarHBondContact O-CG2 3.49Å; I92-T96 PolarHBondContact O-N 3.5Å; I92-T96 PolarHBondContact O-OG1 3.27Å; I92-V100 HydrophobicContact CB-CG2 3.96Å; I92-V100 HydrophobicContact CG2-CG2 3.63Å
93	S	98.6	Very high	98.4	Very high	22 Å²	22	50.9 Å²	50.9	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-43.4	178.9	-54.6	0	0	0	0	111.2	A89 G90 Q95 G97 N98 V100	A89-S93 VanDerWaalsContact O-CB 3.27Å; A89-S93 WeakPolarHBondContact O-CB 3.45Å; A89-S93 PolarHBondContact O-N 3.23Å; A89-S93 PolarHBondContact O-OG 3.32Å; G90-S93 PolarHBondContact O-N 3.14Å; S93-Q95 PolarHBondContact O-N 3.43Å; S93-G97 WeakPolarHBondContact O-CA 3.29Å; S93-G97 PolarHBondContact O-N 2.88Å; S93-N98 VanDerWaalsContact CA-O 3.28Å; S93-N98 WeakPolarHBondContact CA-O 3.33Å; S93-N98 PolarHBondContact OG-O 3.31Å; S93-V100 WeakPolarHBondContact OG-CB 3.22Å; S93-V100 PolarHBondContact OG-N 2.86Å
94	S	98.6	Very high	98.4	Very high	96 Å²	96	51.5 Å²	51.5	67%	0.671	30%	0.295	S	S	*	.	H	α-helix	trans	-66.6	-35.6	177.5	60.8	0	0	0	0	113.1	G90 E91 I92	G90-S94 WeakPolarHBondContact O-CB 3.36Å; G90-S94 PolarHBondContact O-N 3.45Å; G90-S94 PolarHBondContact O-OG 3.44Å; E91-S94 PolarHBondContact O-N 2.75Å; E91-S94 PolarHBondContact O-OG 3.31Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.1Å
95	Q	98.2	Very high	98.5	Very high	121 Å²	121	50.1 Å²	50.1	57%	0.565	29%	0.287	S	S	*	.	H	α-helix	trans	-75.4	-32.3	179.6	-73.6	174.8	41.1	0	0	113.8	M66 E91 I92 S93	M66-Q95 HydrophobicContact CE-CB 4.31Å; E91-Q95 WeakPolarHBondContact O-CB 3.36Å; E91-Q95 VanDerWaalsContact O-CG 3.28Å; E91-Q95 WeakPolarHBondContact O-CG 3.49Å; E91-Q95 PolarHBondContact O-N 3.06Å; E91-Q95 VanDerWaalsContact O-N 3.07Å; I92-Q95 PolarHBondContact O-N 2.83Å; S93-Q95 PolarHBondContact O-N 3.43Å
96	T	97.9	Very high	98.5	Very high	28 Å²	28	52 Å²	52	17%	0.172	30%	0.298	C	S	.	.	H	α-helix	trans	-106.8	-17.5	-171.9	64.1	0	0	0	0	113.7	M66 S69 Q70 I92 N98	M66-T96 HydrophobicContact SD-CG2 3.72Å; S69-T96 PolarHBondContact OG-OG1 3.39Å; Q70-T96 HydrophobicContact CB-CG2 4.36Å; Q70-T96 HydrophobicContact CG-CG2 3.55Å; I92-T96 HydrophobicContact CG2-CG2 4.17Å; I92-T96 WeakPolarHBondContact O-CB 3.38Å; I92-T96 WeakPolarHBondContact O-CG2 3.49Å; I92-T96 PolarHBondContact O-N 3.5Å; I92-T96 PolarHBondContact O-OG1 3.27Å; T96-N98 PolarHBondContact O-N 3.01Å; T96-N98 PolarHBondContact O-ND2 2.96Å; T96-N98 PolarHBondContact OG1-N 2.93Å
97	G	97.7	Very high	98.5	Very high	69 Å²	69	47 Å²	47	71%	0.711	28%	0.275	S	S	*	.	S	Bend	trans	74.1	-4.1	-172.1	0	0	0	0	0	114.3	S93	S93-G97 WeakPolarHBondContact O-CA 3.29Å; S93-G97 PolarHBondContact O-N 2.88Å
98	N	97.6	Very high	98.5	Very high	52 Å²	52	45.2 Å²	45.2	28%	0.278	26%	0.262	S	S	.	.	S	Bend	trans	-99.8	143	179.4	-63.7	-57.7	0	0	0	110.8	S69 S93 T96 V100	S69-N98 PolarHBondContact O-ND2 3.02Å; S93-N98 VanDerWaalsContact CA-O 3.28Å; S93-N98 WeakPolarHBondContact CA-O 3.33Å; S93-N98 PolarHBondContact OG-O 3.31Å; T96-N98 PolarHBondContact O-N 3.01Å; T96-N98 PolarHBondContact O-ND2 2.96Å; T96-N98 PolarHBondContact OG1-N 2.93Å; N98-V100 PolarHBondContact O-N 3.33Å
99	Q	97.4	Very high	98.5	Very high	100 Å²	100	47.8 Å²	47.8	47%	0.467	28%	0.276	S	S	.	.			trans	-70.7	128.8	-175.5	-173.5	63.6	54.5	0	0	112.1	C75 H101	C75-Q99 PolarHBondContact N-O 2.99Å; C75-Q99 VanDerWaalsContact N-O 3.1Å; Q99-H101 VanDerWaalsContact CG-CE1 3.42Å; Q99-H101 WeakPolarHBondContact CG-CE1 3.28Å; Q99-H101 VanDerWaalsContact CG-NE2 3.3Å; Q99-H101 WeakPolarHBondContact CG-NE2 3.39Å
100	V	98.8	Very high	98.5	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.024	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.6	166	-173.1	0	0	0	0	109.5	T65 C75 I77 A89 I92 S93 N98	T65-V100 HydrophobicContact CG2-CG1 4Å; T65-V100 HydrophobicContact CG2-CG2 4.44Å; C75-V100 HydrophobicContact CB-CB 4.45Å; C75-V100 HydrophobicContact CB-CG1 4.04Å; C75-V100 HydrophobicContact CB-CG2 4.1Å; C75-V100 CarbonylContact O-C 3.54Å; C75-V100 VanDerWaalsContact O-CA 3.29Å; C75-V100 WeakPolarHBondContact O-CA 3.3Å; I77-V100 HydrophobicContact CD1-CG1 4.21Å; I77-V100 HydrophobicContact CG1-CG1 4.1Å; I77-V100 HydrophobicContact CG2-CG1 4.25Å; A89-V100 HydrophobicContact CB-CB 4.01Å; A89-V100 HydrophobicContact CB-CG1 3.77Å; I92-V100 HydrophobicContact CB-CG2 3.96Å; I92-V100 HydrophobicContact CG2-CG2 3.63Å; S93-V100 WeakPolarHBondContact OG-CB 3.22Å; S93-V100 PolarHBondContact OG-N 2.86Å; N98-V100 PolarHBondContact O-N 3.33Å
101	H	98.7	Very high	98.5	Very high	41 Å²	41	54.3 Å²	54.3	19%	0.19	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.4	175.5	-62.2	-73.9	0	0	0	110.8	C75 V76 I77 Q99 S124	C75-H101 PolarHBondContact O-N 3.11Å; V76-H101 CarbonylContact C-O 3.53Å; V76-H101 WeakPolarHBondContact CA-O 3.47Å; V76-H101 HydrophobicContact CG2-CB 4Å; I77-H101 WeakPolarHBondContact CG1-O 3.36Å; I77-H101 PolarHBondContact N-O 3.1Å; Q99-H101 VanDerWaalsContact CG-CE1 3.42Å; Q99-H101 WeakPolarHBondContact CG-CE1 3.28Å; Q99-H101 VanDerWaalsContact CG-NE2 3.3Å; Q99-H101 WeakPolarHBondContact CG-NE2 3.39Å; H101-S124 PolarHBondContact CD2-OG 3.4Å; H101-S124 PolarHBondContact NE2-OG 3.07Å
102	A	98.8	Very high	98.5	Very high	24 Å²	24	51.7 Å²	51.7	20%	0.198	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.8	177.7	0	0	0	0	0	110.2	L82 L85 Q86 A89	L82-A102 HydrophobicContact CD1-CB 4.5Å; L85-A102 HydrophobicContact CB-CB 3.65Å; Q86-A102 HydrophobicContact CG-CB 4Å; A89-A102 HydrophobicContact CB-CB 4.07Å
103	L	98.8	Very high	98.5	Very high	12 Å²	12	51.9 Å²	51.9	6%	0.063	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.4	177.6	-61.3	-178.3	0	0	0	111.3	V76 I77 A78 S79 L85 C105 C116 Q119 M120 L123	V76-L103 HydrophobicContact CG1-CD1 3.59Å; V76-L103 HydrophobicContact CG1-CG 3.96Å; I77-L103 PolarHBondContact O-N 2.79Å; A78-L103 VanDerWaalsContact CA-O 3.28Å; A78-L103 WeakPolarHBondContact CA-O 3.36Å; S79-L103 PolarHBondContact N-O 3.15Å; L85-L103 VanDerWaalsContact CD1-O 3.26Å; L85-L103 WeakPolarHBondContact CD1-O 3.47Å; L103-C105 PolarHBondContact O-N 2.68Å; L103-C116 WeakPolarHBondContact CD1-O 3.37Å; L103-Q119 HydrophobicContact CD1-CB 4.07Å; L103-Q119 HydrophobicContact CD2-CB 4.06Å; L103-M120 HydrophobicContact CD1-CB 3.82Å; L103-L123 HydrophobicContact CD2-CD1 3.89Å
104	Q	98.7	Very high	98.5	Very high	116 Å²	116	51.8 Å²	51.8	54%	0.542	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	126.6	175.7	-165.9	177.4	29.2	0	0	110.2	S79 R80 L82	S79-Q104 CarbonylContact O-C 3.57Å; S79-Q104 WeakPolarHBondContact O-CA 3.29Å; R80-Q104 WeakPolarHBondContact O-CG 3.33Å; R80-Q104 PolarHBondContact O-NE2 2.88Å; L82-Q104 HydrophobicContact CB-CB 4.23Å; L82-Q104 HydrophobicContact CB-CG 4.34Å; L82-Q104 HydrophobicContact CD1-CB 4.25Å
105	C	98.6	Very high	98.5	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.034	28%	0.282	C	S	.	.			trans	-153.4	128.4	178.1	-172.9	0	0	0	0	111.3	A78 S79 R80 L103 C116	A78-C105 HydrophobicContact CB-CB 4.1Å; S79-C105 CarbonylContact C-O 3.59Å; S79-C105 WeakPolarHBondContact CA-O 3.41Å; S79-C105 PolarHBondContact O-N 3.47Å; R80-C105 PolarHBondContact N-O 2.86Å; L103-C105 PolarHBondContact O-N 2.68Å; C105-C116 HydrophobicContact CB-CB 3.9Å
106	D	98.7	Very high	98.5	Very high	40 Å²	40	47.7 Å²	47.7	21%	0.214	26%	0.256	C	S	.	.			trans	-94	107.8	159.8	-165.8	-24	0	0	0	108.3	R80 R108 D109	R80-D106 WeakPolarHBondContact CD-OD2 3.41Å; R80-D106 HydrophobicContact CG-CB 3.9Å; D106-R108 PolarHBondContact O-N 3.48Å; D106-R108 WeakPolarHBondContact OD1-CB 3.36Å; D106-R108 WeakPolarHBondContact OD1-CG 3.47Å; D106-R108 IonicContact OD1-CZ 3.57Å; D106-R108 PolarHBondContact OD1-N 2.79Å; D106-R108 VanDerWaalsContact OD1-N 3.16Å; D106-R108 IonicContact OD1-NE 3.4Å; D106-R108 PolarHBondContact OD1-NE 2.89Å; D106-R108 IonicContact OD1-NH2 3.35Å; D106-R108 IonicContact OD2-CZ 3.53Å; D106-R108 IonicContact OD2-NE 3.45Å; D106-R108 PolarHBondContact OD2-NE 2.97Å; D106-R108 IonicContact OD2-NH2 3.39Å; D106-R108 PolarHBondContact OD2-NH2 2.96Å; D106-D109 PolarHBondContact O-N 2.92Å
107	V	98.8	Very high	98.6	Very high	10 Å²	10	46.4 Å²	46.4	6%	0.061	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.6	-176.5	-63.7	0	0	0	0	113.1	T54 D109 A134 I156 G160 F163 V164	T54-V107 HydrophobicContact CG2-CG1 4.08Å; V107-D109 VanDerWaalsContact C-N 3.27Å; V107-D109 PolarHBondContact O-N 2.86Å; V107-A134 HydrophobicContact CG2-CB 4.43Å; V107-I156 HydrophobicContact CG2-CG2 4.47Å; V107-G160 VanDerWaalsContact O-CA 3.23Å; V107-G160 WeakPolarHBondContact O-CA 3.47Å; V107-F163 WeakPolarHBondContact O-CD2 3.46Å; V107-V164 HydrophobicContact CB-CG2 4.35Å; V107-V164 HydrophobicContact CG1-CG2 3.95Å
108	R	98.6	Very high	98.6	Very high	86 Å²	86	47 Å²	47	33%	0.325	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.6	176.5	-60.7	-179	-76	171.4	10.1	113.9	D106 P110 D155 I156 F163	D106-R108 PolarHBondContact O-N 3.48Å; D106-R108 WeakPolarHBondContact OD1-CB 3.36Å; D106-R108 WeakPolarHBondContact OD1-CG 3.47Å; D106-R108 IonicContact OD1-CZ 3.57Å; D106-R108 PolarHBondContact OD1-N 2.79Å; D106-R108 VanDerWaalsContact OD1-N 3.16Å; D106-R108 IonicContact OD1-NE 3.4Å; D106-R108 PolarHBondContact OD1-NE 2.89Å; D106-R108 IonicContact OD1-NH2 3.35Å; D106-R108 IonicContact OD2-CZ 3.53Å; D106-R108 IonicContact OD2-NE 3.45Å; D106-R108 PolarHBondContact OD2-NE 2.97Å; D106-R108 IonicContact OD2-NH2 3.39Å; D106-R108 PolarHBondContact OD2-NH2 2.96Å; R108-P110 WeakPolarHBondContact O-CD 3.44Å; R108-D155 HydrophobicContact CB-CB 4.37Å; R108-D155 HydrophobicContact CG-CB 3.86Å; R108-I156 HydrophobicContact CG-CB 4.41Å; R108-I156 HydrophobicContact CG-CG1 3.79Å; R108-F163 WeakPolarHBondContact O-CE2 3.47Å
109	D	98.8	Very high	98.7	Very high	61 Å²	61	49.2 Å²	49.2	33%	0.326	24%	0.244	S	C	.	.			trans	-101.5	108.6	-179.2	172.1	11.1	0	0	0	109.2	D106 V107 Q111 A112 V113 R115	D106-D109 PolarHBondContact O-N 2.92Å; V107-D109 VanDerWaalsContact C-N 3.27Å; V107-D109 PolarHBondContact O-N 2.86Å; D109-Q111 PolarHBondContact O-N 2.83Å; D109-Q111 VanDerWaalsContact O-N 3.16Å; D109-Q111 WeakPolarHBondContact OD1-CB 3.45Å; D109-Q111 PolarHBondContact OD1-N 2.82Å; D109-A112 HydrophobicContact CB-CB 3.78Å; D109-A112 PolarHBondContact O-N 3.43Å; D109-A112 PolarHBondContact OD1-N 2.68Å; D109-A112 WeakPolarHBondContact OD2-CB 3.36Å; D109-A112 PolarHBondContact OD2-N 2.81Å; D109-V113 PolarHBondContact O-N 3.36Å; D109-R115 IonicContact OD2-NH2 3.5Å
110	P	98.6	Very high	98.7	Very high	60 Å²	60	44.4 Å²	44.4	39%	0.39	22%	0.221	S	C	.	.	H	α-helix	trans	-54.3	-33.9	177.3	-23.9	31.9	0	0	0	113.5	R108 V113 A114 F163	R108-P110 WeakPolarHBondContact O-CD 3.44Å; P110-V113 PolarHBondContact O-N 3.5Å; P110-A114 PolarHBondContact O-N 2.83Å; P110-F163 HydrophobicContact CB-CD2 4.45Å; P110-F163 HydrophobicContact CB-CG 4.41Å; P110-F163 HydrophobicContact CG-CD1 4.14Å; P110-F163 HydrophobicContact CG-CD2 3.7Å; P110-F163 HydrophobicContact CG-CE1 4.04Å; P110-F163 HydrophobicContact CG-CE2 3.6Å; P110-F163 HydrophobicContact CG-CG 3.99Å; P110-F163 HydrophobicContact CG-CZ 3.78Å
111	Q	98.8	Very high	98.7	Very high	125 Å²	125	46.7 Å²	46.7	58%	0.584	24%	0.235	S	C	*	.	H	α-helix	trans	-73.2	-37.2	179.4	-61.9	-64	-26.9	0	0	111.1	D109 V113 A114 R115	D109-Q111 PolarHBondContact O-N 2.83Å; D109-Q111 VanDerWaalsContact O-N 3.16Å; D109-Q111 WeakPolarHBondContact OD1-CB 3.45Å; D109-Q111 PolarHBondContact OD1-N 2.82Å; Q111-V113 VanDerWaalsContact C-N 3.34Å; Q111-A114 PolarHBondContact O-N 2.69Å; Q111-R115 WeakPolarHBondContact O-CG 3.46Å; Q111-R115 PolarHBondContact O-N 3.05Å; Q111-R115 PolarHBondContact O-NH1 2.77Å
112	A	98.6	Very high	98.7	Very high	13 Å²	13	49 Å²	49	11%	0.107	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-36	171.8	0	0	0	0	0	112.2	D109 R115 C116	D109-A112 HydrophobicContact CB-CB 3.78Å; D109-A112 PolarHBondContact O-N 3.43Å; D109-A112 PolarHBondContact OD1-N 2.68Å; D109-A112 WeakPolarHBondContact OD2-CB 3.36Å; D109-A112 PolarHBondContact OD2-N 2.81Å; A112-R115 VanDerWaalsContact CA-NH2 3.34Å; A112-C116 VanDerWaalsContact O-CB 3.24Å; A112-C116 WeakPolarHBondContact O-CB 3.44Å; A112-C116 PolarHBondContact O-N 3.48Å
113	V	98.9	Very high	98.5	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.024	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-50.7	172.9	172.6	0	0	0	0	110.4	D109 P110 Q111 R115 C116 V117 F163 V164 E167	D109-V113 PolarHBondContact O-N 3.36Å; P110-V113 PolarHBondContact O-N 3.5Å; Q111-V113 VanDerWaalsContact C-N 3.34Å; V113-R115 PolarHBondContact O-N 3.4Å; V113-C116 WeakPolarHBondContact O-CB 3.35Å; V113-C116 PolarHBondContact O-N 2.9Å; V113-V117 HydrophobicContact CG1-CG2 4.43Å; V113-V117 WeakPolarHBondContact O-CG2 3.37Å; V113-V117 PolarHBondContact O-N 2.93Å; V113-F163 HydrophobicContact CG2-CB 4.22Å; V113-V164 HydrophobicContact CG1-CG2 4.01Å; V113-V164 HydrophobicContact CG2-CG2 4.04Å; V113-E167 HydrophobicContact CG1-CB 3.92Å; V113-E167 HydrophobicContact CG1-CG 4.26Å
114	A	98.8	Very high	98.4	Very high	20 Å²	20	52.4 Å²	52.4	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-56.1	-49.4	178.1	0	0	0	0	0	112.2	P110 Q111 C116 V117 D118 R171	P110-A114 PolarHBondContact O-N 2.83Å; Q111-A114 PolarHBondContact O-N 2.69Å; A114-C116 VanDerWaalsContact C-N 3.34Å; A114-C116 PolarHBondContact O-N 2.88Å; A114-V117 PolarHBondContact O-N 3.37Å; A114-V117 VanDerWaalsContact O-N 3.16Å; A114-D118 PolarHBondContact O-N 3.24Å; A114-R171 PolarHBondContact O-NH2 3.27Å
115	R	98.8	Very high	98.3	Very high	129 Å²	129	48.1 Å²	48.1	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-60.8	-39.7	176.7	-70.9	-173.4	-60.2	-88.2	0.6	113.1	D109 Q111 A112 V113 V117 D118 Q119	D109-R115 IonicContact OD2-NH2 3.5Å; Q111-R115 WeakPolarHBondContact O-CG 3.46Å; Q111-R115 PolarHBondContact O-N 3.05Å; Q111-R115 PolarHBondContact O-NH1 2.77Å; A112-R115 VanDerWaalsContact CA-NH2 3.34Å; V113-R115 PolarHBondContact O-N 3.4Å; R115-V117 VanDerWaalsContact C-N 3.35Å; R115-D118 WeakPolarHBondContact O-CB 3.46Å; R115-D118 PolarHBondContact O-N 3.2Å; R115-Q119 WeakPolarHBondContact O-CG 3.5Å; R115-Q119 PolarHBondContact O-N 3.33Å
116	C	98.8	Very high	98.3	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.014	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-42.5	176.2	179.3	0	0	0	0	111	L103 C105 A112 V113 A114 Q119 M120	L103-C116 WeakPolarHBondContact CD1-O 3.37Å; C105-C116 HydrophobicContact CB-CB 3.9Å; A112-C116 VanDerWaalsContact O-CB 3.24Å; A112-C116 WeakPolarHBondContact O-CB 3.44Å; A112-C116 PolarHBondContact O-N 3.48Å; V113-C116 WeakPolarHBondContact O-CB 3.35Å; V113-C116 PolarHBondContact O-N 2.9Å; A114-C116 VanDerWaalsContact C-N 3.34Å; A114-C116 PolarHBondContact O-N 2.88Å; C116-Q119 PolarHBondContact O-N 3.16Å; C116-M120 WeakPolarHBondContact O-CB 3.4Å; C116-M120 PolarHBondContact O-N 2.93Å
117	V	98.8	Very high	98.3	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-38.7	176.6	178.8	0	0	0	0	111.2	V113 A114 R115 Q119 M120 V121 E167 L168 R171	V113-V117 HydrophobicContact CG1-CG2 4.43Å; V113-V117 WeakPolarHBondContact O-CG2 3.37Å; V113-V117 PolarHBondContact O-N 2.93Å; A114-V117 PolarHBondContact O-N 3.37Å; A114-V117 VanDerWaalsContact O-N 3.16Å; R115-V117 VanDerWaalsContact C-N 3.35Å; V117-Q119 PolarHBondContact O-N 3.39Å; V117-M120 HydrophobicContact CG1-CE 4.01Å; V117-M120 PolarHBondContact O-N 3.37Å; V117-V121 HydrophobicContact CG1-CG2 4.25Å; V117-V121 WeakPolarHBondContact O-CB 3.23Å; V117-V121 VanDerWaalsContact O-CG2 3.29Å; V117-V121 WeakPolarHBondContact O-CG2 3.29Å; V117-V121 PolarHBondContact O-N 2.87Å; V117-E167 HydrophobicContact CB-CG 4.06Å; V117-E167 HydrophobicContact CG1-CG 4.3Å; V117-E167 HydrophobicContact CG2-CG 3.82Å; V117-L168 HydrophobicContact CB-CD2 4.44Å; V117-L168 HydrophobicContact CG1-CD2 3.67Å; V117-L168 HydrophobicContact CG2-CD2 3.81Å; V117-L168 HydrophobicContact CG2-CG 4.11Å; V117-R171 VanDerWaalsContact CG1-CZ 3.46Å
118	D	98.8	Very high	98.3	Very high	81 Å²	81	48 Å²	48	43%	0.433	26%	0.262	S	S	.	.	H	α-helix	trans	-56.4	-49.9	172.4	-69.2	-34.2	0	0	0	111.8	A114 R115 M120 V121 A122 R171	A114-D118 PolarHBondContact O-N 3.24Å; R115-D118 WeakPolarHBondContact O-CB 3.46Å; R115-D118 PolarHBondContact O-N 3.2Å; D118-M120 PolarHBondContact O-N 3.38Å; D118-V121 PolarHBondContact O-N 3.46Å; D118-A122 WeakPolarHBondContact O-CB 3.42Å; D118-A122 PolarHBondContact O-N 2.91Å; D118-R171 IonicContact OD1-CZ 3.03Å; D118-R171 IonicContact OD1-NH1 3.88Å; D118-R171 PolarHBondContact OD1-NH1 3.04Å; D118-R171 IonicContact OD1-NH2 3.1Å; D118-R171 PolarHBondContact OD1-NH2 2.69Å; D118-R171 IonicContact OD2-NH2 3.22Å
119	Q	98.6	Very high	98.3	Very high	99 Å²	99	44 Å²	44	46%	0.463	25%	0.247	S	C	.	.	H	α-helix	trans	-61.3	-45.1	178.3	-71.6	174.4	-10.1	0	0	111.6	L103 R115 C116 V117 V121 A122 L123	L103-Q119 HydrophobicContact CD1-CB 4.07Å; L103-Q119 HydrophobicContact CD2-CB 4.06Å; R115-Q119 WeakPolarHBondContact O-CG 3.5Å; R115-Q119 PolarHBondContact O-N 3.33Å; C116-Q119 PolarHBondContact O-N 3.16Å; V117-Q119 PolarHBondContact O-N 3.39Å; Q119-V121 PolarHBondContact O-N 3.38Å; Q119-A122 PolarHBondContact O-N 2.85Å; Q119-L123 WeakPolarHBondContact O-CB 3.19Å; Q119-L123 WeakPolarHBondContact O-CD1 3.49Å; Q119-L123 WeakPolarHBondContact O-CG 3.4Å; Q119-L123 PolarHBondContact O-N 2.78Å
120	M	98.5	Very high	98.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-47.3	176.8	178.2	-168.6	64.3	0	0	111.8	F52 V76 L103 C116 V117 D118 A122 L123 S124 G125 P127 L168	F52-M120 HydrophobicContact CB-SD 3.93Å; F52-M120 HydrophobicContact CD2-SD 3.45Å; F52-M120 WeakPolarHBondContact CD2-SD 3.44Å; F52-M120 HydrophobicContact CE2-SD 4.22Å; F52-M120 HydrophobicContact CG-SD 3.92Å; V76-M120 HydrophobicContact CB-CG 4.18Å; V76-M120 HydrophobicContact CB-SD 4.45Å; V76-M120 HydrophobicContact CG1-CB 4.29Å; V76-M120 HydrophobicContact CG1-CG 4Å; V76-M120 HydrophobicContact CG1-SD 4.44Å; V76-M120 HydrophobicContact CG2-CG 3.86Å; L103-M120 HydrophobicContact CD1-CB 3.82Å; C116-M120 WeakPolarHBondContact O-CB 3.4Å; C116-M120 PolarHBondContact O-N 2.93Å; V117-M120 HydrophobicContact CG1-CE 4.01Å; V117-M120 PolarHBondContact O-N 3.37Å; D118-M120 PolarHBondContact O-N 3.38Å; M120-A122 VanDerWaalsContact C-N 3.32Å; M120-A122 PolarHBondContact O-N 2.92Å; M120-L123 PolarHBondContact O-N 3.48Å; M120-S124 PolarHBondContact O-N 3.5Å; M120-G125 PolarHBondContact O-N 3.43Å; M120-P127 VanDerWaalsContact CE-CD 3.48Å; M120-P127 HydrophobicContact CE-CG 4.02Å; M120-P127 HydrophobicContact SD-CG 4.24Å; M120-L168 HydrophobicContact CE-CD2 3.58Å
121	V	98.4	Very high	98.4	Very high	52 Å²	52	38.2 Å²	38.2	32%	0.315	21%	0.213	S	C	.	.	H	α-helix	trans	-62.1	-42.7	-179.3	170.3	0	0	0	0	110.6	V117 D118 Q119 L123 G125 L126	V117-V121 HydrophobicContact CG1-CG2 4.25Å; V117-V121 WeakPolarHBondContact O-CB 3.23Å; V117-V121 VanDerWaalsContact O-CG2 3.29Å; V117-V121 WeakPolarHBondContact O-CG2 3.29Å; V117-V121 PolarHBondContact O-N 2.87Å; D118-V121 PolarHBondContact O-N 3.46Å; Q119-V121 PolarHBondContact O-N 3.38Å; V121-L123 VanDerWaalsContact C-N 3.32Å; V121-L123 PolarHBondContact O-N 2.79Å; V121-G125 WeakPolarHBondContact O-CA 3.27Å; V121-G125 PolarHBondContact O-N 2.92Å; V121-L126 HydrophobicContact CG2-CD2 3.54Å; V121-L126 HydrophobicContact CG2-CG 4.1Å
122	A	98.2	Very high	98.4	Very high	89 Å²	89	32.4 Å²	32.4	74%	0.736	19%	0.186	S	C	*	.	H	α-helix	trans	-63.7	-35.8	176	0	0	0	0	0	113	D118 Q119 M120	D118-A122 WeakPolarHBondContact O-CB 3.42Å; D118-A122 PolarHBondContact O-N 2.91Å; Q119-A122 PolarHBondContact O-N 2.85Å; M120-A122 VanDerWaalsContact C-N 3.32Å; M120-A122 PolarHBondContact O-N 2.92Å
123	L	95.8	Very high	98.4	Very high	93 Å²	93	32.8 Å²	32.8	49%	0.487	19%	0.186	S	C	.	.	H	α-helix	trans	-83	-36.4	-177.1	-71.6	168.9	0	0	0	113.9	L103 Q119 M120 V121	L103-L123 HydrophobicContact CD2-CD1 3.89Å; Q119-L123 WeakPolarHBondContact O-CB 3.19Å; Q119-L123 WeakPolarHBondContact O-CD1 3.49Å; Q119-L123 WeakPolarHBondContact O-CG 3.4Å; Q119-L123 PolarHBondContact O-N 2.78Å; M120-L123 PolarHBondContact O-N 3.48Å; V121-L123 VanDerWaalsContact C-N 3.32Å; V121-L123 PolarHBondContact O-N 2.79Å
124	S	95.3	Very high	98.3	Very high	14 Å²	14	33.4 Å²	33.4	10%	0.098	19%	0.192	C	C	.	.	H	α-helix	trans	-144.9	-10.6	-164.6	-66.5	0	0	0	0	114.9	R74 H101 M120	R74-S124 PolarHBondContact NH1-O 2.99Å; H101-S124 PolarHBondContact CD2-OG 3.4Å; H101-S124 PolarHBondContact NE2-OG 3.07Å; M120-S124 PolarHBondContact O-N 3.5Å
125	G	97.9	Very high	98.1	Very high	26 Å²	26	35.3 Å²	35.3	27%	0.268	21%	0.208	S	C	.	.			trans	90.5	-167.4	-174.2	0	0	0	0	0	113.7	L50 M120 V121	L50-G125 WeakPolarHBondContact CD2-O 3.41Å; M120-G125 PolarHBondContact O-N 3.43Å; V121-G125 WeakPolarHBondContact O-CA 3.27Å; V121-G125 PolarHBondContact O-N 2.92Å
126	L	98.6	Very high	97.5	Very high	32 Å²	32	30.2 Å²	30.2	17%	0.168	20%	0.195	C	C	.	.	S	Bend	trans	-82	140.8	178.3	-72.1	169.1	0	0	0	111.5	V121 R171 L172 A175 K177	V121-L126 HydrophobicContact CG2-CD2 3.54Å; V121-L126 HydrophobicContact CG2-CG 4.1Å; L126-R171 HydrophobicContact CD1-CB 4.49Å; L126-R171 HydrophobicContact CD2-CB 3.71Å; L126-L172 HydrophobicContact CB-CD2 3.97Å; L126-L172 HydrophobicContact CD1-CD2 4.43Å; L126-A175 HydrophobicContact CD1-CB 3.47Å; L126-A175 VanDerWaalsContact CD1-CB 3.47Å; L126-K177 HydrophobicContact CB-CD 4.19Å; L126-K177 PolarHBondContact O-NZ 3.21Å
127	P	98.7	Very high	97.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	21%	0.211	C	C	.	.			trans	-74.8	151.1	-174.6	30	-34.6	0	0	0	112.3	L50 F52 M120 I130 L168	L50-P127 HydrophobicContact CD2-CB 4.44Å; L50-P127 HydrophobicContact CG-CB 4.29Å; L50-P127 WeakPolarHBondContact O-CA 3.47Å; F52-P127 HydrophobicContact CB-CB 4.01Å; F52-P127 HydrophobicContact CB-CG 4.22Å; M120-P127 VanDerWaalsContact CE-CD 3.48Å; M120-P127 HydrophobicContact CE-CG 4.02Å; M120-P127 HydrophobicContact SD-CG 4.24Å; P127-I130 HydrophobicContact CB-CD1 4.33Å; P127-I130 HydrophobicContact CB-CG1 4.32Å; P127-I130 HydrophobicContact CG-CD1 4.01Å; P127-I130 HydrophobicContact CG-CG1 3.87Å; P127-L168 HydrophobicContact CG-CD1 4.39Å; P127-L168 HydrophobicContact CG-CD2 3.95Å
128	D	98.8	Very high	96.4	Very high	20 Å²	20	38.5 Å²	38.5	11%	0.107	23%	0.234	C	C	.	.	S	Bend	trans	-92.2	-28.4	168.4	-58.1	-89.8	0	0	0	111	R49 L50 K177 A179 S180	R49-D128 HydrophobicContact CB-CB 4.3Å; R49-D128 IonicContact NH1-OD1 3.8Å; R49-D128 PolarHBondContact NH1-OD1 2.94Å; L50-D128 PolarHBondContact N-OD2 2.8Å; L50-D128 PolarHBondContact O-N 3.36Å; D128-K177 WeakPolarHBondContact OD1-CE 3.33Å; D128-K177 IonicContact OD1-NZ 2.73Å; D128-K177 PolarHBondContact OD1-NZ 3.08Å; D128-K177 IonicContact OD2-NZ 2.92Å; D128-K177 PolarHBondContact OD2-NZ 3.4Å; D128-K177 VanDerWaalsContact OD2-NZ 3.1Å; D128-A179 CarbonylContact O-C 3.58Å; D128-A179 WeakPolarHBondContact O-CA 3.32Å; D128-S180 PolarHBondContact O-N 3.49Å
129	V	98.9	Very high	95.8	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.5	-177.6	177.9	0	0	0	0	109.3	F46 L50 A51 F52 I131 S180	F46-V129 HydrophobicContact CD1-CG2 4.44Å; F46-V129 HydrophobicContact CE1-CG2 3.92Å; L50-V129 PolarHBondContact O-N 2.75Å; L50-V129 VanDerWaalsContact O-N 3.1Å; A51-V129 CarbonylContact C-O 3.58Å; A51-V129 WeakPolarHBondContact CA-O 3.47Å; A51-V129 HydrophobicContact CB-CB 4Å; A51-V129 HydrophobicContact CB-CG1 4.32Å; F52-V129 PolarHBondContact N-O 2.79Å; V129-I131 HydrophobicContact CG1-CD1 4.21Å; V129-I131 HydrophobicContact CG1-CG1 3.89Å; V129-S180 CarbonylContact C-O 3.22Å; V129-S180 WeakPolarHBondContact CA-O 3.32Å
130	I	98.9	Very high	95.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	115.8	178	-59.1	84.4	0	0	0	107.9	F52 P127 V164 L168 L172 A179 S180 F181 L182	F52-I130 HydrophobicContact CD1-CG2 4.35Å; F52-I130 WeakPolarHBondContact O-CA 3.47Å; P127-I130 HydrophobicContact CB-CD1 4.33Å; P127-I130 HydrophobicContact CB-CG1 4.32Å; P127-I130 HydrophobicContact CG-CD1 4.01Å; P127-I130 HydrophobicContact CG-CG1 3.87Å; I130-V164 HydrophobicContact CG2-CG1 4.39Å; I130-L168 HydrophobicContact CB-CD1 4.46Å; I130-L168 HydrophobicContact CG1-CD1 3.76Å; I130-L168 HydrophobicContact CG2-CD1 3.78Å; I130-L172 HydrophobicContact CD1-CD1 4.12Å; I130-A179 HydrophobicContact CD1-CB 3.55Å; I130-S180 PolarHBondContact N-O 3Å; I130-F181 HydrophobicContact CB-CD1 3.67Å; I130-F181 HydrophobicContact CB-CE1 3.86Å; I130-F181 HydrophobicContact CB-CG 4.25Å; I130-F181 HydrophobicContact CD1-CD1 4.3Å; I130-F181 HydrophobicContact CD1-CD2 4.34Å; I130-F181 HydrophobicContact CD1-CE1 3.97Å; I130-F181 HydrophobicContact CD1-CE2 4.01Å; I130-F181 HydrophobicContact CD1-CG 4.47Å; I130-F181 HydrophobicContact CD1-CZ 3.82Å; I130-F181 HydrophobicContact CG1-CD1 4.14Å; I130-F181 HydrophobicContact CG1-CE1 3.82Å; I130-F181 HydrophobicContact CG1-CZ 4.15Å; I130-F181 HydrophobicContact CG2-CD1 3.79Å; I130-F181 HydrophobicContact CG2-CE1 3.9Å; I130-F181 CarbonylContact O-C 3.47Å; I130-F181 WeakPolarHBondContact O-CA 3.26Å; I130-L182 PolarHBondContact O-N 3.26Å
131	I	98.9	Very high	95.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	107.7	177.8	-52.3	-174.8	0	0	0	109.9	F52 I53 T54 M64 L68 V129 N133 L182 I184	F52-I131 PolarHBondContact O-N 2.97Å; I53-I131 HydrophobicContact CB-CB 4.47Å; I53-I131 HydrophobicContact CG1-CB 4.13Å; I53-I131 HydrophobicContact CG1-CD1 4.19Å; I53-I131 HydrophobicContact CG1-CG1 4.3Å; I53-I131 HydrophobicContact CG2-CB 4.18Å; I53-I131 HydrophobicContact CG2-CG2 4.43Å; T54-I131 PolarHBondContact N-O 2.68Å; M64-I131 HydrophobicContact CB-CD1 4.36Å; M64-I131 HydrophobicContact CE-CG2 3.82Å; M64-I131 HydrophobicContact SD-CD1 4.08Å; M64-I131 HydrophobicContact SD-CG2 3.87Å; L68-I131 HydrophobicContact CD1-CD1 3.84Å; V129-I131 HydrophobicContact CG1-CD1 4.21Å; V129-I131 HydrophobicContact CG1-CG1 3.89Å; I131-N133 HydrophobicContact CG2-CB 4.1Å; I131-N133 PolarHBondContact O-N 3.49Å; I131-L182 CarbonylContact C-O 3.37Å; I131-L182 WeakPolarHBondContact CA-O 3.45Å; I131-L182 HydrophobicContact CD1-CD2 4.33Å; I131-L182 HydrophobicContact CG1-CB 4.27Å; I131-L182 HydrophobicContact CG1-CD2 4.43Å; I131-L182 HydrophobicContact CG2-CD2 4.49Å; I131-I184 HydrophobicContact CG2-CG1 4.27Å
132	N	98.9	Very high	95.2	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.011	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	95.7	171.4	-77.7	-74.2	0	0	0	110	T161 V164 T165 L182 I184 Y210	N132-T161 HydrophobicContact CB-CG2 3.81Å; N132-V164 WeakPolarHBondContact OD1-CG1 3.28Å; N132-T165 PolarHBondContact ND2-OG1 3.23Å; N132-L182 PolarHBondContact N-O 2.95Å; N132-I184 PolarHBondContact O-N 3.38Å; N132-Y210 PolarHBondContact ND2-OH 3.3Å
133	N	98.8	Very high	95.2	Very high	22 Å²	22	41.5 Å²	41.5	12%	0.118	24%	0.239	C	C	.	.			trans	-119.4	-21.3	-176.9	157.3	89.8	0	0	0	113.2	T54 G55 G61 M64 I131 A135 I184	T54-N133 CarbonylContact O-C 3.58Å; T54-N133 VanDerWaalsContact O-CB 3.32Å; T54-N133 WeakPolarHBondContact O-CB 3.41Å; T54-N133 PolarHBondContact O-ND2 3.24Å; T54-N133 PolarHBondContact OG1-N 2.91Å; T54-N133 VanDerWaalsContact OG1-N 3.08Å; G55-N133 PolarHBondContact O-ND2 2.98Å; G61-N133 WeakPolarHBondContact CA-ND2 3.32Å; M64-N133 HydrophobicContact CE-CB 3.83Å; I131-N133 HydrophobicContact CG2-CB 4.1Å; I131-N133 PolarHBondContact O-N 3.49Å; N133-A135 PolarHBondContact O-N 3.31Å; N133-I184 HydrophobicContact CB-CB 4.39Å; N133-I184 HydrophobicContact CB-CG1 3.94Å
134	A	96.7	Very high	95.2	Very high	17 Å²	17	46 Å²	46	14%	0.14	25%	0.249	C	C	.	.			trans	-54.6	130.6	177.9	0	0	0	0	0	111.5	T54 V107	T54-A134 PolarHBondContact O-N 3.08Å; T54-A134 WeakPolarHBondContact OG1-CB 3.49Å; T54-A134 PolarHBondContact OG1-N 3.01Å; T54-A134 VanDerWaalsContact OG1-N 3.07Å; V107-A134 HydrophobicContact CG2-CB 4.43Å
135	A	94.1	Very high	95.2	Very high	60 Å²	60	47.1 Å²	47.1	50%	0.496	25%	0.254	S	S	.	.			trans	-151.6	157.2	-179	0	0	0	0	0	111.6	N133 V157	N133-A135 PolarHBondContact O-N 3.31Å; A135-V157 HydrophobicContact CB-CG2 4.09Å
136	G	88.1	Confident	95.2	Very high	21 Å²	21	50 Å²	50	22%	0.216	27%	0.266	C	S	.	.			trans	-130.3	148.7	164.7	0	0	0	0	0	108.8	V153	G136-V153 WeakPolarHBondContact O-CG1 3.27Å
137	N	88.9	Confident	95.2	Very high	65 Å²	65	53.7 Å²	53.7	35%	0.348	29%	0.292	S	S	.	.			trans	-152	154.3	175.8	-168.8	18.6	0	0	0	110.4	Y188 S199	N137-Y188 PolarHBondContact ND2-OH 3.46Å; N137-S199 WeakPolarHBondContact OD1-CB 3.24Å
138	F	83.6	Confident	95.2	Very high	112 Å²	112	58.8 Å²	58.8	49%	0.491	32%	0.32	S	S	.	.			trans	-131.3	137.6	170.2	-54	-73.9	0	0	0	108.5	V153	F138-V153 HydrophobicContact CD2-CG2 3.64Å; F138-V153 HydrophobicContact CE2-CG2 3.79Å
139	I	87.6	Confident	95.1	Very high	107 Å²	107	58.4 Å²	58.4	55%	0.549	32%	0.32	S	S	.	.			trans	-93.6	113	167.4	-64.5	172.7	0	0	0	106.8	F195 V196 L241	I139-F195 WeakPolarHBondContact CA-O 3.13Å; I139-F195 HydrophobicContact CG2-CB 4.3Å; I139-V196 HydrophobicContact CG1-CG1 3.85Å; I139-L241 HydrophobicContact CD1-CD2 3.22Å; I139-L241 HydrophobicContact CD1-CG 4.13Å
140	C	88.8	Confident	95	Very high	24 Å²	24	63.2 Å²	63.2	16%	0.162	34%	0.338	C	S	.	.			trans	-155.3	134.2	-173.4	-169	0	0	0	0	110.1	T142 L145 F195	C140-T142 PolarHBondContact O-N 3.07Å; C140-L145 HydrophobicContact CB-CD2 3.85Å; C140-L145 HydrophobicContact CB-CG 4.22Å; C140-F195 PolarHBondContact N-O 3.02Å; C140-F195 CarbonylContact O-C 3.52Å; C140-F195 VanDerWaalsContact O-CA 3.32Å; C140-F195 WeakPolarHBondContact O-CA 3.3Å
141	P	95.8	Very high	95	Very high	37 Å²	37	70.5 Å²	70.5	24%	0.24	37%	0.366	C	S	.	.			trans	-50.8	131.1	162.9	-22.7	33.3	0	0	0	110	E143 R144 F195	P141-E143 VanDerWaalsContact C-N 3.27Å; P141-E143 VanDerWaalsContact C-OE2 3.29Å; P141-E143 VanDerWaalsContact CB-CD 3.47Å; P141-E143 WeakPolarHBondContact CB-OE1 3.35Å; P141-E143 WeakPolarHBondContact CB-OE2 3.46Å; P141-E143 PolarHBondContact O-N 2.97Å; P141-R144 HydrophobicContact CB-CG 4.36Å; P141-R144 WeakPolarHBondContact O-CB 3.19Å; P141-R144 PolarHBondContact O-N 3.48Å; P141-F195 HydrophobicContact CB-CD1 4.41Å; P141-F195 HydrophobicContact CB-CE1 4.42Å; P141-F195 HydrophobicContact CG-CD1 4.23Å; P141-F195 HydrophobicContact CG-CE1 4.29Å
142	T	97.6	Very high	94.9	Very high	57 Å²	57	71.6 Å²	71.6	35%	0.35	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-67.4	-31.4	-164.7	-61	0	0	0	0	112.2	C140 R144 L145 V197	C140-T142 PolarHBondContact O-N 3.07Å; T142-R144 PolarHBondContact O-N 3.48Å; T142-R144 VanDerWaalsContact O-N 3.15Å; T142-L145 HydrophobicContact CG2-CD1 4.24Å; T142-L145 WeakPolarHBondContact O-CB 3.46Å; T142-L145 PolarHBondContact O-N 3.47Å; T142-L145 VanDerWaalsContact O-N 3.08Å; T142-V197 HydrophobicContact CG2-CB 4.39Å; T142-V197 HydrophobicContact CG2-CG2 4.32Å; T142-V197 WeakPolarHBondContact OG1-CG2 3.4Å
143	E	97.5	Very high	94.9	Very high	160 Å²	160	71.6 Å²	71.6	75%	0.748	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-64.2	-12.5	174.1	73.1	-75.9	-177.9	0	0	114.1	P141	P141-E143 VanDerWaalsContact C-N 3.27Å; P141-E143 VanDerWaalsContact C-OE2 3.29Å; P141-E143 VanDerWaalsContact CB-CD 3.47Å; P141-E143 WeakPolarHBondContact CB-OE1 3.35Å; P141-E143 WeakPolarHBondContact CB-OE2 3.46Å; P141-E143 PolarHBondContact O-N 2.97Å
144	R	96.9	Very high	94.9	Very high	186 Å²	186	71.7 Å²	71.7	70%	0.702	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-100.6	-4	175.6	-60.6	179.2	63.7	-177	-0.2	113.3	P141 T142	P141-R144 HydrophobicContact CB-CG 4.36Å; P141-R144 WeakPolarHBondContact O-CB 3.19Å; P141-R144 PolarHBondContact O-N 3.48Å; T142-R144 PolarHBondContact O-N 3.48Å; T142-R144 VanDerWaalsContact O-N 3.15Å
145	L	96.1	Very high	95	Very high	39 Å²	39	73 Å²	73	20%	0.204	38%	0.379	C	S	.	.			trans	-75.3	131.7	-179.9	-74.1	169.9	0	0	0	110.9	C140 T142 P198	C140-L145 HydrophobicContact CB-CD2 3.85Å; C140-L145 HydrophobicContact CB-CG 4.22Å; T142-L145 HydrophobicContact CG2-CD1 4.24Å; T142-L145 WeakPolarHBondContact O-CB 3.46Å; T142-L145 PolarHBondContact O-N 3.47Å; T142-L145 VanDerWaalsContact O-N 3.08Å; L145-P198 HydrophobicContact CD1-CG 3.53Å
146	T	97.8	Very high	95.2	Very high	86 Å²	86	71.2 Å²	71.2	53%	0.528	36%	0.361	S	S	.	.			trans	-78.8	154.1	167.6	66.4	0	0	0	0	110.1	N148 G149 W150	T146-N148 PolarHBondContact O-N 3.41Å; T146-G149 PolarHBondContact O-N 3.42Å; T146-G149 PolarHBondContact OG1-N 3.43Å; T146-G149 VanDerWaalsContact OG1-N 3.09Å; T146-W150 PolarHBondContact O-N 3.35Å; T146-W150 VanDerWaalsContact O-N 3.09Å
147	P	98.3	Very high	95.7	Very high	109 Å²	109	70.2 Å²	70.2	71%	0.708	35%	0.351	S	S	*	.	H	α-helix	trans	-54.2	-34.8	172	-28.1	35.7	0	0	0	113.2	W150 R151	P147-W150 PolarHBondContact O-N 3.14Å; P147-R151 WeakPolarHBondContact O-CB 3.44Å; P147-R151 PolarHBondContact O-N 3.26Å
148	N	97.8	Very high	96.2	Very high	108 Å²	108	69.3 Å²	69.3	58%	0.578	35%	0.346	S	S	*	.	H	α-helix	trans	-68.8	-36.3	175.7	-174.3	56.5	0	0	0	112.8	T146 R151 S152	T146-N148 PolarHBondContact O-N 3.41Å; N148-R151 PolarHBondContact O-N 3.47Å; N148-S152 VanDerWaalsContact O-CB 3.31Å; N148-S152 WeakPolarHBondContact O-CB 3.44Å; N148-S152 PolarHBondContact O-N 2.92Å; N148-S152 PolarHBondContact O-OG 2.98Å
149	G	96.3	Very high	96.9	Very high	12 Å²	12	66.5 Å²	66.5	12%	0.124	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-44.2	173.7	0	0	0	0	0	111.9	T146 V153	T146-G149 PolarHBondContact O-N 3.42Å; T146-G149 PolarHBondContact OG1-N 3.43Å; T146-G149 VanDerWaalsContact OG1-N 3.09Å; G149-V153 PolarHBondContact O-N 2.88Å
150	W	98.2	Very high	97.5	Very high	103 Å²	103	61.4 Å²	61.4	39%	0.39	31%	0.31	S	S	.	.	H	α-helix	trans	-58.8	-52.9	172.5	178	-78.9	0	0	0	111.9	T146 P147 S152 V153 T154 V197 P198 A201	T146-W150 PolarHBondContact O-N 3.35Å; T146-W150 VanDerWaalsContact O-N 3.09Å; P147-W150 PolarHBondContact O-N 3.14Å; W150-S152 VanDerWaalsContact C-N 3.31Å; W150-S152 PolarHBondContact O-N 3.47Å; W150-V153 PolarHBondContact O-N 3.02Å; W150-T154 PolarHBondContact NE1-OG1 2.97Å; W150-T154 PolarHBondContact O-N 3.45Å; W150-T154 PolarHBondContact O-OG1 3.4Å; W150-V197 HydrophobicContact CH2-CG1 4.05Å; W150-V197 HydrophobicContact CZ3-CB 4.35Å; W150-V197 HydrophobicContact CZ3-CG1 3.74Å; W150-P198 HydrophobicContact CD2-CB 4.18Å; W150-P198 HydrophobicContact CD2-CG 4.25Å; W150-P198 HydrophobicContact CE3-CB 3.96Å; W150-P198 HydrophobicContact CE3-CG 3.63Å; W150-P198 HydrophobicContact CZ3-CB 4.34Å; W150-P198 HydrophobicContact CZ3-CG 4.07Å; W150-A201 HydrophobicContact CH2-CB 4.01Å; W150-A201 HydrophobicContact CZ2-CB 4.11Å
151	R	98.3	Very high	97.9	Very high	154 Å²	154	60.5 Å²	60.5	58%	0.581	30%	0.304	S	S	*	.	H	α-helix	trans	-58.7	-43	-179.2	-177.6	178.5	-61.4	174.1	1.1	111.3	P147 N148 V153 T154 D155	P147-R151 WeakPolarHBondContact O-CB 3.44Å; P147-R151 PolarHBondContact O-N 3.26Å; N148-R151 PolarHBondContact O-N 3.47Å; R151-V153 VanDerWaalsContact C-N 3.33Å; R151-V153 PolarHBondContact O-N 3.17Å; R151-T154 PolarHBondContact O-N 2.83Å; R151-D155 WeakPolarHBondContact CG-OD2 3.43Å; R151-D155 VanDerWaalsContact O-CB 3.3Å; R151-D155 WeakPolarHBondContact O-CB 3.35Å; R151-D155 VanDerWaalsContact O-CG 3.24Å; R151-D155 PolarHBondContact O-N 2.83Å
152	S	97.8	Very high	98.1	Very high	23 Å²	23	59.7 Å²	59.7	16%	0.161	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-43.1	179.3	-65.5	0	0	0	0	112.8	N148 W150 I156	N148-S152 VanDerWaalsContact O-CB 3.31Å; N148-S152 WeakPolarHBondContact O-CB 3.44Å; N148-S152 PolarHBondContact O-N 2.92Å; N148-S152 PolarHBondContact O-OG 2.98Å; W150-S152 VanDerWaalsContact C-N 3.31Å; W150-S152 PolarHBondContact O-N 3.47Å; S152-I156 WeakPolarHBondContact O-CD1 3.07Å; S152-I156 WeakPolarHBondContact O-CG1 3.31Å; S152-I156 PolarHBondContact O-N 3.05Å
153	V	97.9	Very high	98.2	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-70.5	-45.7	177.5	175.7	0	0	0	0	110.9	G136 F138 G149 W150 R151 D155 I156 V157 P198	G136-V153 WeakPolarHBondContact O-CG1 3.27Å; F138-V153 HydrophobicContact CD2-CG2 3.64Å; F138-V153 HydrophobicContact CE2-CG2 3.79Å; G149-V153 PolarHBondContact O-N 2.88Å; W150-V153 PolarHBondContact O-N 3.02Å; R151-V153 VanDerWaalsContact C-N 3.33Å; R151-V153 PolarHBondContact O-N 3.17Å; V153-D155 VanDerWaalsContact C-N 3.33Å; V153-D155 PolarHBondContact O-N 2.97Å; V153-I156 PolarHBondContact O-N 3Å; V153-V157 HydrophobicContact CG1-CG2 4.24Å; V153-V157 VanDerWaalsContact O-CB 3.31Å; V153-V157 WeakPolarHBondContact O-CB 3.22Å; V153-V157 WeakPolarHBondContact O-CG2 3.49Å; V153-V157 PolarHBondContact O-N 2.8Å; V153-P198 HydrophobicContact CB-CB 3.79Å; V153-P198 HydrophobicContact CG1-CB 3.92Å; V153-P198 HydrophobicContact CG2-CB 4.2Å
154	T	98.8	Very high	98.2	Very high	25 Å²	25	52.1 Å²	52.1	15%	0.153	26%	0.26	C	S	.	.	H	α-helix	trans	-58.9	-45.5	179.1	-54.8	0	0	0	0	111.4	W150 R151 L158 N159	W150-T154 PolarHBondContact NE1-OG1 2.97Å; W150-T154 PolarHBondContact O-N 3.45Å; W150-T154 PolarHBondContact O-OG1 3.4Å; R151-T154 PolarHBondContact O-N 2.83Å; T154-L158 HydrophobicContact CG2-CB 4.45Å; T154-L158 WeakPolarHBondContact O-CA 3.21Å; T154-L158 WeakPolarHBondContact O-CB 3.38Å; T154-L158 PolarHBondContact O-N 2.94Å; T154-N159 PolarHBondContact O-N 3.39Å; T154-N159 VanDerWaalsContact O-N 3.14Å
155	D	98.8	Very high	98.3	Very high	44 Å²	44	43.3 Å²	43.3	24%	0.235	23%	0.227	C	C	.	.	I	π-helix	trans	-65.7	-43.8	-178.6	-73.1	-14.9	0	0	0	111.8	R108 R151 V153 N159 G160	R108-D155 HydrophobicContact CB-CB 4.37Å; R108-D155 HydrophobicContact CG-CB 3.86Å; R151-D155 WeakPolarHBondContact CG-OD2 3.43Å; R151-D155 VanDerWaalsContact O-CB 3.3Å; R151-D155 WeakPolarHBondContact O-CB 3.35Å; R151-D155 VanDerWaalsContact O-CG 3.24Å; R151-D155 PolarHBondContact O-N 2.83Å; V153-D155 VanDerWaalsContact C-N 3.33Å; V153-D155 PolarHBondContact O-N 2.97Å; D155-N159 PolarHBondContact OD1-ND2 3.34Å; D155-G160 PolarHBondContact O-N 3.04Å
156	I	98.7	Very high	98.5	Very high	22 Å²	22	45.2 Å²	45.2	11%	0.113	24%	0.237	C	C	.	.	I	π-helix	trans	-66.9	-47.8	179.7	-64.6	168.2	0	0	0	110.3	V107 R108 S152 V153	V107-I156 HydrophobicContact CG2-CG2 4.47Å; R108-I156 HydrophobicContact CG-CB 4.41Å; R108-I156 HydrophobicContact CG-CG1 3.79Å; S152-I156 WeakPolarHBondContact O-CD1 3.07Å; S152-I156 WeakPolarHBondContact O-CG1 3.31Å; S152-I156 PolarHBondContact O-N 3.05Å; V153-I156 PolarHBondContact O-N 3Å
157	V	98.8	Very high	98.5	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	I	π-helix	trans	-85.4	-55.9	-166	174.8	0	0	0	0	111.4	A135 V153 T161 A202 K203 V206	A135-V157 HydrophobicContact CB-CG2 4.09Å; V153-V157 HydrophobicContact CG1-CG2 4.24Å; V153-V157 VanDerWaalsContact O-CB 3.31Å; V153-V157 WeakPolarHBondContact O-CB 3.22Å; V153-V157 WeakPolarHBondContact O-CG2 3.49Å; V153-V157 PolarHBondContact O-N 2.8Å; V157-T161 WeakPolarHBondContact O-CB 3.45Å; V157-T161 PolarHBondContact O-N 3.12Å; V157-T161 PolarHBondContact O-OG1 3.18Å; V157-A202 HydrophobicContact CB-CB 3.78Å; V157-A202 HydrophobicContact CG1-CB 3.74Å; V157-K203 HydrophobicContact CG1-CD 3.45Å; V157-K203 VanDerWaalsContact CG1-CD 3.45Å; V157-K203 HydrophobicContact CG1-CG 3.99Å; V157-V206 HydrophobicContact CG1-CG2 4.23Å; V157-V206 WeakPolarHBondContact O-CG2 3.23Å
158	L	98.9	Very high	98.5	Very high	46 Å²	46	37.8 Å²	37.8	24%	0.241	19%	0.187	C	C	.	.	I	π-helix	trans	-84	-59.7	-175	178.8	58	0	0	0	110.7	T154 G160 T161 A162 A202 V206	T154-L158 HydrophobicContact CG2-CB 4.45Å; T154-L158 WeakPolarHBondContact O-CA 3.21Å; T154-L158 WeakPolarHBondContact O-CB 3.38Å; T154-L158 PolarHBondContact O-N 2.94Å; L158-G160 VanDerWaalsContact C-N 3.32Å; L158-G160 PolarHBondContact O-N 3.28Å; L158-T161 PolarHBondContact O-N 3.47Å; L158-A162 WeakPolarHBondContact O-CB 3.24Å; L158-A162 PolarHBondContact O-N 2.96Å; L158-A202 HydrophobicContact CB-CB 4.09Å; L158-V206 HydrophobicContact CD1-CG2 4.04Å
159	N	98.9	Very high	98.6	Very high	53 Å²	53	32.7 Å²	32.7	28%	0.283	16%	0.159	S	C	.	.	I	π-helix	trans	-63.8	-40.9	-176.7	-62.6	-24.5	0	0	0	110.8	T154 D155 T161 A162 F163	T154-N159 PolarHBondContact O-N 3.39Å; T154-N159 VanDerWaalsContact O-N 3.14Å; D155-N159 PolarHBondContact OD1-ND2 3.34Å; N159-T161 PolarHBondContact O-N 2.95Å; N159-A162 CarbonylContact O-C 3.59Å; N159-A162 WeakPolarHBondContact O-CB 3.34Å; N159-A162 PolarHBondContact O-N 3.38Å; N159-A162 VanDerWaalsContact O-N 3.17Å; N159-F163 HydrophobicContact CB-CD2 4.48Å; N159-F163 HydrophobicContact CB-CE2 3.83Å; N159-F163 HydrophobicContact CB-CZ 3.85Å; N159-F163 VanDerWaalsContact O-CD2 3.3Å; N159-F163 WeakPolarHBondContact O-CD2 3.32Å; N159-F163 WeakPolarHBondContact O-CG 3.37Å; N159-F163 PolarHBondContact O-N 3.05Å
160	G	98.9	Very high	98.7	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-43.4	176.9	0	0	0	0	0	114	V107 D155 L158 A162 F163 V164	V107-G160 VanDerWaalsContact O-CA 3.23Å; V107-G160 WeakPolarHBondContact O-CA 3.47Å; D155-G160 PolarHBondContact O-N 3.04Å; L158-G160 VanDerWaalsContact C-N 3.32Å; L158-G160 PolarHBondContact O-N 3.28Å; G160-A162 VanDerWaalsContact C-N 3.31Å; G160-A162 PolarHBondContact O-N 3.07Å; G160-F163 PolarHBondContact O-N 3.42Å; G160-V164 WeakPolarHBondContact O-CG2 3.42Å; G160-V164 PolarHBondContact O-N 3.08Å; G160-V164 VanDerWaalsContact O-N 3.12Å
161	T	98.9	Very high	98.7	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-61.9	-41.7	172.6	-62.8	0	0	0	0	111	N132 V157 L158 N159 T165 V206 L209 Y210	N132-T161 HydrophobicContact CB-CG2 3.81Å; V157-T161 WeakPolarHBondContact O-CB 3.45Å; V157-T161 PolarHBondContact O-N 3.12Å; V157-T161 PolarHBondContact O-OG1 3.18Å; L158-T161 PolarHBondContact O-N 3.47Å; N159-T161 PolarHBondContact O-N 2.95Å; T161-T165 WeakPolarHBondContact O-CB 3.26Å; T161-T165 PolarHBondContact O-N 3.03Å; T161-T165 PolarHBondContact O-OG1 3.42Å; T161-V206 HydrophobicContact CG2-CG1 4.01Å; T161-V206 HydrophobicContact CG2-CG2 4.17Å; T161-L209 HydrophobicContact CG2-CD2 4.2Å; T161-Y210 HydrophobicContact CG2-CE1 3.85Å
162	A	98.9	Very high	98.8	Very high	19 Å²	19	28.2 Å²	28.2	16%	0.157	14%	0.142	C	C	.	.	H	α-helix	trans	-63.5	-47.5	177.8	0	0	0	0	0	111.8	L158 N159 G160 V164 T165 L166 L209	L158-A162 WeakPolarHBondContact O-CB 3.24Å; L158-A162 PolarHBondContact O-N 2.96Å; N159-A162 CarbonylContact O-C 3.59Å; N159-A162 WeakPolarHBondContact O-CB 3.34Å; N159-A162 PolarHBondContact O-N 3.38Å; N159-A162 VanDerWaalsContact O-N 3.17Å; G160-A162 VanDerWaalsContact C-N 3.31Å; G160-A162 PolarHBondContact O-N 3.07Å; A162-V164 PolarHBondContact O-N 3.17Å; A162-T165 PolarHBondContact O-N 2.98Å; A162-L166 VanDerWaalsContact O-CB 3.28Å; A162-L166 WeakPolarHBondContact O-CB 3.49Å; A162-L166 WeakPolarHBondContact O-CG 3.47Å; A162-L166 PolarHBondContact O-N 3.32Å; A162-L209 HydrophobicContact CB-CD2 4.14Å
163	F	98.9	Very high	98.8	Very high	58 Å²	58	29.5 Å²	29.5	25%	0.254	15%	0.147	S	C	.	.	H	α-helix	trans	-62.6	-45	-178.8	-60.7	-25.6	0	0	0	112.2	V107 R108 P110 V113 N159 G160 L166 E167	V107-F163 WeakPolarHBondContact O-CD2 3.46Å; R108-F163 WeakPolarHBondContact O-CE2 3.47Å; P110-F163 HydrophobicContact CB-CD2 4.45Å; P110-F163 HydrophobicContact CB-CG 4.41Å; P110-F163 HydrophobicContact CG-CD1 4.14Å; P110-F163 HydrophobicContact CG-CD2 3.7Å; P110-F163 HydrophobicContact CG-CE1 4.04Å; P110-F163 HydrophobicContact CG-CE2 3.6Å; P110-F163 HydrophobicContact CG-CG 3.99Å; P110-F163 HydrophobicContact CG-CZ 3.78Å; V113-F163 HydrophobicContact CG2-CB 4.22Å; N159-F163 HydrophobicContact CB-CD2 4.48Å; N159-F163 HydrophobicContact CB-CE2 3.83Å; N159-F163 HydrophobicContact CB-CZ 3.85Å; N159-F163 VanDerWaalsContact O-CD2 3.3Å; N159-F163 WeakPolarHBondContact O-CD2 3.32Å; N159-F163 WeakPolarHBondContact O-CG 3.37Å; N159-F163 PolarHBondContact O-N 3.05Å; G160-F163 PolarHBondContact O-N 3.42Å; F163-L166 PolarHBondContact O-N 2.92Å; F163-E167 WeakPolarHBondContact O-CB 3.45Å; F163-E167 PolarHBondContact O-N 3.2Å
164	V	98.9	Very high	98.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-45.4	175.4	171	0	0	0	0	111.1	F52 T54 V107 V113 I130 N132 G160 A162 L168	F52-V164 HydrophobicContact CD1-CG1 4.32Å; F52-V164 HydrophobicContact CE1-CG1 3.76Å; T54-V164 HydrophobicContact CG2-CG1 4.27Å; T54-V164 HydrophobicContact CG2-CG2 4.13Å; V107-V164 HydrophobicContact CB-CG2 4.35Å; V107-V164 HydrophobicContact CG1-CG2 3.95Å; V113-V164 HydrophobicContact CG1-CG2 4.01Å; V113-V164 HydrophobicContact CG2-CG2 4.04Å; I130-V164 HydrophobicContact CG2-CG1 4.39Å; N132-V164 WeakPolarHBondContact OD1-CG1 3.28Å; G160-V164 WeakPolarHBondContact O-CG2 3.42Å; G160-V164 PolarHBondContact O-N 3.08Å; G160-V164 VanDerWaalsContact O-N 3.12Å; A162-V164 PolarHBondContact O-N 3.17Å; V164-L168 HydrophobicContact CG1-CD1 3.83Å; V164-L168 WeakPolarHBondContact O-CB 3.48Å; V164-L168 PolarHBondContact O-N 3.46Å
165	T	98.9	Very high	98.9	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-42.4	-179.5	-57.8	0	0	0	0	111.7	N132 T161 A162 G169 F181 L213 W217 F224	N132-T165 PolarHBondContact ND2-OG1 3.23Å; T161-T165 WeakPolarHBondContact O-CB 3.26Å; T161-T165 PolarHBondContact O-N 3.03Å; T161-T165 PolarHBondContact O-OG1 3.42Å; A162-T165 PolarHBondContact O-N 2.98Å; T165-G169 WeakPolarHBondContact O-CA 3.35Å; T165-G169 PolarHBondContact O-N 2.94Å; T165-F181 HydrophobicContact CG2-CD1 4.23Å; T165-F181 HydrophobicContact CG2-CE1 4.13Å; T165-L213 HydrophobicContact CG2-CD1 3.49Å; T165-L213 VanDerWaalsContact CG2-CD1 3.49Å; T165-W217 HydrophobicContact CG2-CH2 4.49Å; T165-W217 HydrophobicContact CG2-CZ3 4.03Å; T165-F224 HydrophobicContact CG2-CE1 3.77Å; T165-F224 HydrophobicContact CG2-CZ 4.36Å
166	L	98.9	Very high	98.9	Very high	79 Å²	79	45.7 Å²	45.7	41%	0.414	23%	0.229	S	C	.	.	H	α-helix	trans	-65.1	-46.8	177.8	-74.2	171.3	0	0	0	111.8	A162 F163 K170 W217	A162-L166 VanDerWaalsContact O-CB 3.28Å; A162-L166 WeakPolarHBondContact O-CB 3.49Å; A162-L166 WeakPolarHBondContact O-CG 3.47Å; A162-L166 PolarHBondContact O-N 3.32Å; F163-L166 PolarHBondContact O-N 2.92Å; L166-K170 WeakPolarHBondContact O-CB 3.38Å; L166-K170 WeakPolarHBondContact O-CG 3.46Å; L166-K170 PolarHBondContact O-N 2.84Å; L166-W217 HydrophobicContact CD2-CH2 4.3Å
167	E	98.9	Very high	98.8	Very high	39 Å²	39	47.4 Å²	47.4	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-65.7	-49.5	-178.2	-177	58.8	-157	0	0	111.5	V113 V117 F163 K170 R171	V113-E167 HydrophobicContact CG1-CB 3.92Å; V113-E167 HydrophobicContact CG1-CG 4.26Å; V117-E167 HydrophobicContact CB-CG 4.06Å; V117-E167 HydrophobicContact CG1-CG 4.3Å; V117-E167 HydrophobicContact CG2-CG 3.82Å; F163-E167 WeakPolarHBondContact O-CB 3.45Å; F163-E167 PolarHBondContact O-N 3.2Å; E167-K170 PolarHBondContact O-N 3.43Å; E167-R171 PolarHBondContact O-N 3.38Å; E167-R171 IonicContact OE1-CZ 3.04Å; E167-R171 IonicContact OE1-NE 2.77Å; E167-R171 PolarHBondContact OE1-NE 2.71Å; E167-R171 IonicContact OE1-NH2 3.1Å; E167-R171 PolarHBondContact OE1-NH2 3.4Å
168	L	98.9	Very high	98.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-41.5	178.3	-70.5	171.6	0	0	0	111.8	F52 V117 M120 P127 I130 V164 K170 R171 L172 F181	F52-L168 HydrophobicContact CD1-CD1 3.75Å; F52-L168 HydrophobicContact CE1-CD1 4.13Å; F52-L168 HydrophobicContact CG-CD1 4.39Å; V117-L168 HydrophobicContact CB-CD2 4.44Å; V117-L168 HydrophobicContact CG1-CD2 3.67Å; V117-L168 HydrophobicContact CG2-CD2 3.81Å; V117-L168 HydrophobicContact CG2-CG 4.11Å; M120-L168 HydrophobicContact CE-CD2 3.58Å; P127-L168 HydrophobicContact CG-CD1 4.39Å; P127-L168 HydrophobicContact CG-CD2 3.95Å; I130-L168 HydrophobicContact CB-CD1 4.46Å; I130-L168 HydrophobicContact CG1-CD1 3.76Å; I130-L168 HydrophobicContact CG2-CD1 3.78Å; V164-L168 HydrophobicContact CG1-CD1 3.83Å; V164-L168 WeakPolarHBondContact O-CB 3.48Å; V164-L168 PolarHBondContact O-N 3.46Å; L168-K170 PolarHBondContact O-N 3.49Å; L168-R171 PolarHBondContact O-N 2.95Å; L168-L172 HydrophobicContact CB-CD1 4.45Å; L168-L172 VanDerWaalsContact O-CB 3.3Å; L168-L172 WeakPolarHBondContact O-CB 3.41Å; L168-L172 WeakPolarHBondContact O-CD1 3.42Å; L168-L172 WeakPolarHBondContact O-CG 3.29Å; L168-L172 PolarHBondContact O-N 2.91Å; L168-F181 HydrophobicContact CB-CE1 4.5Å
169	G	98.9	Very high	98.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.7	-48.6	176.2	0	0	0	0	0	112	T165 R171 L172 I173	T165-G169 WeakPolarHBondContact O-CA 3.35Å; T165-G169 PolarHBondContact O-N 2.94Å; G169-R171 PolarHBondContact O-N 3Å; G169-L172 PolarHBondContact O-N 3.01Å; G169-I173 WeakPolarHBondContact O-CB 3.17Å; G169-I173 WeakPolarHBondContact O-CD1 3.28Å; G169-I173 WeakPolarHBondContact O-CG1 3.43Å; G169-I173 PolarHBondContact O-N 3.19Å
170	K	98.9	Very high	98.8	Very high	132 Å²	132	45 Å²	45	57%	0.574	23%	0.232	S	C	*	.	H	α-helix	trans	-55.7	-48.8	176.7	-75.5	169.8	-175.9	178.2	0	112.3	L166 E167 L168 Q174	L166-K170 WeakPolarHBondContact O-CB 3.38Å; L166-K170 WeakPolarHBondContact O-CG 3.46Å; L166-K170 PolarHBondContact O-N 2.84Å; E167-K170 PolarHBondContact O-N 3.43Å; L168-K170 PolarHBondContact O-N 3.49Å; K170-Q174 WeakPolarHBondContact O-CB 3.27Å; K170-Q174 PolarHBondContact O-N 3.16Å
171	R	98.8	Very high	98.8	Very high	43 Å²	43	44.9 Å²	44.9	16%	0.162	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-39.9	-178.2	-63.8	-167.9	-167.6	-153.5	-1.1	112.6	A114 V117 D118 L126 E167 L168 G169 Q174 A175	A114-R171 PolarHBondContact O-NH2 3.27Å; V117-R171 VanDerWaalsContact CG1-CZ 3.46Å; D118-R171 IonicContact OD1-CZ 3.03Å; D118-R171 IonicContact OD1-NH1 3.88Å; D118-R171 PolarHBondContact OD1-NH1 3.04Å; D118-R171 IonicContact OD1-NH2 3.1Å; D118-R171 PolarHBondContact OD1-NH2 2.69Å; D118-R171 IonicContact OD2-NH2 3.22Å; L126-R171 HydrophobicContact CD1-CB 4.49Å; L126-R171 HydrophobicContact CD2-CB 3.71Å; E167-R171 PolarHBondContact O-N 3.38Å; E167-R171 IonicContact OE1-CZ 3.04Å; E167-R171 IonicContact OE1-NE 2.77Å; E167-R171 PolarHBondContact OE1-NE 2.71Å; E167-R171 IonicContact OE1-NH2 3.1Å; E167-R171 PolarHBondContact OE1-NH2 3.4Å; L168-R171 PolarHBondContact O-N 2.95Å; G169-R171 PolarHBondContact O-N 3Å; R171-Q174 PolarHBondContact O-N 3.44Å; R171-A175 VanDerWaalsContact O-CB 3.27Å; R171-A175 WeakPolarHBondContact O-CB 3.21Å; R171-A175 PolarHBondContact O-N 3.45Å
172	L	98.9	Very high	98.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-44	177.6	-74.2	166.4	0	0	0	111.6	L126 I130 L168 G169 A175 Q176 K177 A179 F181	L126-L172 HydrophobicContact CB-CD2 3.97Å; L126-L172 HydrophobicContact CD1-CD2 4.43Å; I130-L172 HydrophobicContact CD1-CD1 4.12Å; L168-L172 HydrophobicContact CB-CD1 4.45Å; L168-L172 VanDerWaalsContact O-CB 3.3Å; L168-L172 WeakPolarHBondContact O-CB 3.41Å; L168-L172 WeakPolarHBondContact O-CD1 3.42Å; L168-L172 WeakPolarHBondContact O-CG 3.29Å; L168-L172 PolarHBondContact O-N 2.91Å; G169-L172 PolarHBondContact O-N 3.01Å; L172-A175 CarbonylContact O-C 3.59Å; L172-A175 PolarHBondContact O-N 2.76Å; L172-Q176 PolarHBondContact O-N 3.44Å; L172-K177 WeakPolarHBondContact CB-O 3.28Å; L172-K177 HydrophobicContact CD2-CB 4Å; L172-K177 HydrophobicContact CD2-CD 3.98Å; L172-K177 HydrophobicContact CD2-CG 3.86Å; L172-K177 PolarHBondContact O-N 2.96Å; L172-A179 HydrophobicContact CD1-CB 3.67Å; L172-A179 HydrophobicContact CD2-CB 4.39Å; L172-F181 HydrophobicContact CD1-CE2 4.18Å; L172-F181 HydrophobicContact CD1-CZ 3.87Å
173	I	98.9	Very high	98.8	Very high	51 Å²	51	43.8 Å²	43.8	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-60.3	-47.8	174.5	-67.8	165.8	0	0	0	110.4	G169 A175 Q176 W217 Y220 H222	G169-I173 WeakPolarHBondContact O-CB 3.17Å; G169-I173 WeakPolarHBondContact O-CD1 3.28Å; G169-I173 WeakPolarHBondContact O-CG1 3.43Å; G169-I173 PolarHBondContact O-N 3.19Å; I173-A175 VanDerWaalsContact C-N 3.27Å; I173-A175 PolarHBondContact O-N 3.27Å; I173-Q176 PolarHBondContact O-N 3.37Å; I173-W217 HydrophobicContact CD1-CD2 4.48Å; I173-Y220 HydrophobicContact CD1-CD2 3.47Å; I173-Y220 VanDerWaalsContact CD1-CD2 3.47Å; I173-Y220 HydrophobicContact CD1-CE2 3.68Å; I173-Y220 HydrophobicContact CD1-CG 4.02Å; I173-Y220 HydrophobicContact CG1-CD1 4.25Å; I173-Y220 HydrophobicContact CG1-CD2 3.72Å; I173-Y220 HydrophobicContact CG1-CE2 4.27Å; I173-Y220 HydrophobicContact CG1-CG 3.71Å; I173-Y220 HydrophobicContact CG2-CD1 4.09Å; I173-Y220 HydrophobicContact CG2-CE1 4.1Å; I173-Y220 HydrophobicContact CG2-CG 4.4Å; I173-H222 WeakPolarHBondContact CG1-NE2 3.47Å
174	Q	98.8	Very high	98.8	Very high	169 Å²	169	41.4 Å²	41.4	79%	0.79	21%	0.213	S	C	*	.	H	α-helix	trans	-60.4	-37.8	177.7	-175.9	178.9	2.6	0	0	112.2	K170 R171 Q176	K170-Q174 WeakPolarHBondContact O-CB 3.27Å; K170-Q174 PolarHBondContact O-N 3.16Å; R171-Q174 PolarHBondContact O-N 3.44Å; Q174-Q176 VanDerWaalsContact C-N 3.28Å; Q174-Q176 PolarHBondContact O-N 2.88Å
175	A	98.6	Very high	98.8	Very high	56 Å²	56	41.7 Å²	41.7	46%	0.463	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	1.6	177.7	0	0	0	0	0	114	L126 R171 L172 I173 K177	L126-A175 HydrophobicContact CD1-CB 3.47Å; L126-A175 VanDerWaalsContact CD1-CB 3.47Å; R171-A175 VanDerWaalsContact O-CB 3.27Å; R171-A175 WeakPolarHBondContact O-CB 3.21Å; R171-A175 PolarHBondContact O-N 3.45Å; L172-A175 CarbonylContact O-C 3.59Å; L172-A175 PolarHBondContact O-N 2.76Å; I173-A175 VanDerWaalsContact C-N 3.27Å; I173-A175 PolarHBondContact O-N 3.27Å; A175-K177 HydrophobicContact CB-CB 4.45Å; A175-K177 PolarHBondContact O-N 3.47Å
176	Q	98.6	Very high	98.8	Very high	185 Å²	185	42.3 Å²	42.3	86%	0.864	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	35.7	-174.7	-58.4	-178.6	-17.2	0	0	113.2	L172 I173 Q174	L172-Q176 PolarHBondContact O-N 3.44Å; I173-Q176 PolarHBondContact O-N 3.37Å; Q174-Q176 VanDerWaalsContact C-N 3.28Å; Q174-Q176 PolarHBondContact O-N 2.88Å
177	K	98.6	Very high	98.7	Very high	58 Å²	58	39.4 Å²	39.4	25%	0.252	20%	0.203	S	C	.	.			trans	-109	124	-178.2	177.6	172.8	175.7	169.2	0	110.7	L126 D128 L172 A175 H222	L126-K177 HydrophobicContact CB-CD 4.19Å; L126-K177 PolarHBondContact O-NZ 3.21Å; D128-K177 WeakPolarHBondContact OD1-CE 3.33Å; D128-K177 IonicContact OD1-NZ 2.73Å; D128-K177 PolarHBondContact OD1-NZ 3.08Å; D128-K177 IonicContact OD2-NZ 2.92Å; D128-K177 PolarHBondContact OD2-NZ 3.4Å; D128-K177 VanDerWaalsContact OD2-NZ 3.1Å; L172-K177 WeakPolarHBondContact CB-O 3.28Å; L172-K177 HydrophobicContact CD2-CB 4Å; L172-K177 HydrophobicContact CD2-CD 3.98Å; L172-K177 HydrophobicContact CD2-CG 3.86Å; L172-K177 PolarHBondContact O-N 2.96Å; A175-K177 HydrophobicContact CB-CB 4.45Å; A175-K177 PolarHBondContact O-N 3.47Å; K177-H222 PolarHBondContact O-CE1 2.89Å; K177-H222 VanDerWaalsContact O-CE1 3.26Å
178	G	98.5	Very high	98.7	Very high	33 Å²	33	39.9 Å²	39.9	34%	0.34	20%	0.203	S	C	.	.			trans	-73.2	160.5	171.6	0	0	0	0	0	113.3	G221	G178-G221 CarbonylContact C-O 3.47Å; G178-G221 WeakPolarHBondContact CA-O 3.44Å
179	A	98.8	Very high	98.6	Very high	9 Å²	9	40.2 Å²	40.2	7%	0.074	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	157.1	179.9	0	0	0	0	0	113.4	D128 I130 L172 F181 G221 H222 R223	D128-A179 CarbonylContact O-C 3.58Å; D128-A179 WeakPolarHBondContact O-CA 3.32Å; I130-A179 HydrophobicContact CD1-CB 3.55Å; L172-A179 HydrophobicContact CD1-CB 3.67Å; L172-A179 HydrophobicContact CD2-CB 4.39Å; A179-F181 HydrophobicContact CB-CD2 4.5Å; A179-F181 HydrophobicContact CB-CE2 4.01Å; A179-G221 PolarHBondContact N-O 3.12Å; A179-H222 WeakPolarHBondContact O-CA 3.37Å; A179-R223 PolarHBondContact O-N 3.03Å; A179-R223 VanDerWaalsContact O-N 3.08Å
180	S	98.9	Very high	98.5	Very high	5 Å²	5	45.8 Å²	45.8	4%	0.035	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.1	171.7	178.4	0	0	0	0	111.2	D128 V129 I130 R223	D128-S180 PolarHBondContact O-N 3.49Å; V129-S180 CarbonylContact C-O 3.22Å; V129-S180 WeakPolarHBondContact CA-O 3.32Å; I130-S180 PolarHBondContact N-O 3Å; S180-R223 PolarHBondContact OG-NH1 2.96Å; S180-R223 PolarHBondContact OG-NH2 3.18Å; S180-R223 VanDerWaalsContact OG-NH2 3.14Å
181	F	98.9	Very high	98.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131	172.5	-69.5	-99.7	0	0	0	110.4	I130 T165 L168 L172 A179 Y210 H222 R223 F224 N225	I130-F181 HydrophobicContact CB-CD1 3.67Å; I130-F181 HydrophobicContact CB-CE1 3.86Å; I130-F181 HydrophobicContact CB-CG 4.25Å; I130-F181 HydrophobicContact CD1-CD1 4.3Å; I130-F181 HydrophobicContact CD1-CD2 4.34Å; I130-F181 HydrophobicContact CD1-CE1 3.97Å; I130-F181 HydrophobicContact CD1-CE2 4.01Å; I130-F181 HydrophobicContact CD1-CG 4.47Å; I130-F181 HydrophobicContact CD1-CZ 3.82Å; I130-F181 HydrophobicContact CG1-CD1 4.14Å; I130-F181 HydrophobicContact CG1-CE1 3.82Å; I130-F181 HydrophobicContact CG1-CZ 4.15Å; I130-F181 HydrophobicContact CG2-CD1 3.79Å; I130-F181 HydrophobicContact CG2-CE1 3.9Å; I130-F181 CarbonylContact O-C 3.47Å; I130-F181 WeakPolarHBondContact O-CA 3.26Å; T165-F181 HydrophobicContact CG2-CD1 4.23Å; T165-F181 HydrophobicContact CG2-CE1 4.13Å; L168-F181 HydrophobicContact CB-CE1 4.5Å; L172-F181 HydrophobicContact CD1-CE2 4.18Å; L172-F181 HydrophobicContact CD1-CZ 3.87Å; A179-F181 HydrophobicContact CB-CD2 4.5Å; A179-F181 HydrophobicContact CB-CE2 4.01Å; F181-Y210 HydrophobicContact CB-CE2 3.9Å; F181-H222 HydrophobicContact CD2-CB 4.32Å; F181-H222 HydrophobicContact CE2-CB 4.13Å; F181-H222 AromaticContact CE2-CG 3.98Å; F181-R223 PolarHBondContact N-O 2.87Å; F181-F224 HydrophobicContact CB-CD1 3.38Å; F181-F224 HydrophobicContact CB-CE1 3.5Å; F181-F224 HydrophobicContact CB-CG 4.01Å; F181-F224 HydrophobicContact CB-CZ 4.23Å; F181-F224 HydrophobicContact CD1-CD1 4.48Å; F181-F224 AromaticContact CD1-CE1 3.78Å; F181-F224 HydrophobicContact CD1-CE1 3.78Å; F181-F224 HydrophobicContact CD1-CZ 4.33Å; F181-F224 HydrophobicContact CD2-CD1 4.31Å; F181-F224 AromaticContact CD2-CE1 3.7Å; F181-F224 HydrophobicContact CD2-CE1 3.7Å; F181-F224 HydrophobicContact CD2-CE2 4.14Å; F181-F224 AromaticContact CD2-CZ 3.59Å; F181-F224 HydrophobicContact CD2-CZ 3.59Å; F181-F224 HydrophobicContact CE1-CE1 4.42Å; F181-F224 HydrophobicContact CE2-CE1 4.35Å; F181-F224 AromaticContact CE2-CZ 3.96Å; F181-F224 HydrophobicContact CE2-CZ 3.96Å; F181-F224 AromaticContact CG-CD1 3.84Å; F181-F224 HydrophobicContact CG-CD1 3.84Å; F181-F224 AromaticContact CG-CE1 3.38Å; F181-F224 HydrophobicContact CG-CE1 3.38Å; F181-F224 AromaticContact CG-CZ 3.8Å; F181-F224 HydrophobicContact CG-CZ 3.8Å; F181-F224 HydrophobicContact CZ-CZ 4.48Å; F181-F224 CarbonylContact O-C 3.55Å; F181-F224 WeakPolarHBondContact O-CA 3.48Å; F181-N225 PolarHBondContact O-N 3.48Å
182	L	99	Very high	98.4	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.9	177.5	-175.6	64.8	0	0	0	110.4	I130 I131 N132 I184 Y210 N225 I227 A270 L273	I130-L182 PolarHBondContact O-N 3.26Å; I131-L182 CarbonylContact C-O 3.37Å; I131-L182 WeakPolarHBondContact CA-O 3.45Å; I131-L182 HydrophobicContact CD1-CD2 4.33Å; I131-L182 HydrophobicContact CG1-CB 4.27Å; I131-L182 HydrophobicContact CG1-CD2 4.43Å; I131-L182 HydrophobicContact CG2-CD2 4.49Å; N132-L182 PolarHBondContact N-O 2.95Å; L182-I184 HydrophobicContact CD2-CD1 4.33Å; L182-I184 HydrophobicContact CG-CD1 4.36Å; L182-Y210 VanDerWaalsContact C-CE2 3.49Å; L182-N225 WeakPolarHBondContact CA-O 3.49Å; L182-N225 HydrophobicContact CD1-CB 4.2Å; L182-N225 WeakPolarHBondContact CD1-O 3.36Å; L182-I227 HydrophobicContact CD1-CD1 4.23Å; L182-I227 HydrophobicContact CD1-CG1 4.08Å; L182-I227 HydrophobicContact CD2-CD1 4.05Å; L182-A270 HydrophobicContact CD2-CB 3.57Å; L182-L273 HydrophobicContact CD1-CB 4.32Å; L182-L273 HydrophobicContact CD1-CD1 4.02Å
183	A	98.9	Very high	98.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	136.2	171.9	0	0	0	0	0	110.5	T185 V206 Y210 N225 I226 I227	A183-T185 HydrophobicContact CB-CG2 4.49Å; A183-V206 HydrophobicContact CB-CG1 3.65Å; A183-Y210 HydrophobicContact CB-CD1 4.28Å; A183-Y210 HydrophobicContact CB-CD2 3.73Å; A183-Y210 HydrophobicContact CB-CE1 4.1Å; A183-Y210 HydrophobicContact CB-CE2 3.51Å; A183-Y210 HydrophobicContact CB-CG 4.13Å; A183-N225 PolarHBondContact N-O 2.85Å; A183-I226 HydrophobicContact CB-CG1 4.27Å; A183-I226 WeakPolarHBondContact O-CA 3.49Å; A183-I227 PolarHBondContact O-N 2.86Å
184	I	98.8	Very high	98.2	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.036	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	111.8	169.4	-52	-55.3	0	0	0	108.1	L60 M64 I131 N132 N133 L182 K203 I227 P229 L266	L60-I184 HydrophobicContact CD1-CG2 4.34Å; M64-I184 HydrophobicContact CE-CD1 4.25Å; M64-I184 HydrophobicContact CE-CG1 3.86Å; M64-I184 HydrophobicContact SD-CD1 3.95Å; M64-I184 HydrophobicContact SD-CG1 4.23Å; I131-I184 HydrophobicContact CG2-CG1 4.27Å; N132-I184 PolarHBondContact O-N 3.38Å; N133-I184 HydrophobicContact CB-CB 4.39Å; N133-I184 HydrophobicContact CB-CG1 3.94Å; L182-I184 HydrophobicContact CD2-CD1 4.33Å; L182-I184 HydrophobicContact CG-CD1 4.36Å; I184-K203 PolarHBondContact O-NZ 3.5Å; I184-I227 HydrophobicContact CD1-CB 4.09Å; I184-I227 HydrophobicContact CD1-CD1 4.03Å; I184-I227 HydrophobicContact CD1-CG1 4.47Å; I184-P229 HydrophobicContact CG2-CG 3.9Å; I184-L266 HydrophobicContact CD1-CD2 4.5Å
185	T	98.7	Very high	97.9	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.043	25%	0.254	C	S	.	.			trans	-106.8	-124.8	177.1	64.1	0	0	0	0	111	A183 K203 V206 E207 I226 I227 Q228 P229	A183-T185 HydrophobicContact CB-CG2 4.49Å; T185-K203 HydrophobicContact CG2-CD 4.09Å; T185-V206 HydrophobicContact CG2-CB 4.34Å; T185-V206 HydrophobicContact CG2-CG1 3.97Å; T185-E207 WeakPolarHBondContact CB-OE1 3.44Å; T185-E207 HydrophobicContact CG2-CG 3.76Å; T185-E207 PolarHBondContact OG1-OE1 2.72Å; T185-I226 HydrophobicContact CG2-CG2 3.85Å; T185-I226 VanDerWaalsContact OG1-CG2 3.22Å; T185-I226 WeakPolarHBondContact OG1-CG2 3.36Å; T185-I227 PolarHBondContact N-O 3.36Å; T185-I227 PolarHBondContact OG1-O 3.09Å; T185-Q228 VanDerWaalsContact OG1-CG 3.31Å; T185-Q228 WeakPolarHBondContact OG1-CG 3.33Å; T185-P229 WeakPolarHBondContact O-CD 3.22Å
186	T	97.9	Very high	97.8	Very high	15 Å²	15	40.8 Å²	40.8	9%	0.092	24%	0.236	C	C	.	.			trans	-177.2	152.7	-176.4	-178.2	0	0	0	0	109.2	Y188 A189 K203	T186-Y188 HydrophobicContact CG2-CD1 3.8Å; T186-Y188 HydrophobicContact CG2-CD2 3.47Å; T186-Y188 VanDerWaalsContact CG2-CD2 3.47Å; T186-Y188 HydrophobicContact CG2-CE1 3.59Å; T186-Y188 HydrophobicContact CG2-CE2 3.23Å; T186-Y188 HydrophobicContact CG2-CG 3.74Å; T186-Y188 PolarHBondContact O-N 3.4Å; T186-Y188 VanDerWaalsContact O-N 3.14Å; T186-Y188 WeakPolarHBondContact OG1-CD1 3.23Å; T186-Y188 WeakPolarHBondContact OG1-CE1 3.46Å; T186-A189 HydrophobicContact CG2-CB 4.23Å; T186-A189 WeakPolarHBondContact O-CB 3.45Å; T186-A189 PolarHBondContact O-N 2.89Å; T186-K203 HydrophobicContact CG2-CB 4.25Å; T186-K203 HydrophobicContact CG2-CG 4.09Å
187	I	97.9	Very high	97.8	Very high	18 Å²	18	34 Å²	34	9%	0.092	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.5	179.7	60.8	174.8	0	0	0	114	A189 Q228 R287 D289 E292 Y293	I187-A189 VanDerWaalsContact C-N 3.26Å; I187-A189 PolarHBondContact O-N 2.8Å; I187-Q228 HydrophobicContact CG2-CB 4.28Å; I187-R287 HydrophobicContact CG2-CG 4.43Å; I187-D289 HydrophobicContact CG2-CB 3.67Å; I187-E292 HydrophobicContact CD1-CB 4.36Å; I187-E292 HydrophobicContact CD1-CG 4.23Å; I187-E292 WeakPolarHBondContact CD1-OE2 3.45Å; I187-Y293 HydrophobicContact CB-CD2 4.09Å
188	Y	97.5	Very high	97.7	Very high	48 Å²	48	31.4 Å²	31.4	19%	0.188	20%	0.196	C	C	.	.	H	α-helix	trans	-81	-1	178.5	63.6	-108.6	0	0	0	114.2	N137 T186 E190 G192 V196 S199 A200	N137-Y188 PolarHBondContact ND2-OH 3.46Å; T186-Y188 HydrophobicContact CG2-CD1 3.8Å; T186-Y188 HydrophobicContact CG2-CD2 3.47Å; T186-Y188 VanDerWaalsContact CG2-CD2 3.47Å; T186-Y188 HydrophobicContact CG2-CE1 3.59Å; T186-Y188 HydrophobicContact CG2-CE2 3.23Å; T186-Y188 HydrophobicContact CG2-CG 3.74Å; T186-Y188 PolarHBondContact O-N 3.4Å; T186-Y188 VanDerWaalsContact O-N 3.14Å; T186-Y188 WeakPolarHBondContact OG1-CD1 3.23Å; T186-Y188 WeakPolarHBondContact OG1-CE1 3.46Å; Y188-E190 VanDerWaalsContact C-N 3.25Å; Y188-G192 CarbonylContact O-C 3.5Å; Y188-G192 WeakPolarHBondContact O-CA 3.49Å; Y188-G192 PolarHBondContact O-N 3.01Å; Y188-V196 HydrophobicContact CD1-CG2 4.32Å; Y188-V196 HydrophobicContact CD2-CG2 4.01Å; Y188-V196 HydrophobicContact CE1-CG2 4.3Å; Y188-V196 HydrophobicContact CE2-CB 4.5Å; Y188-V196 HydrophobicContact CE2-CG2 3.99Å; Y188-V196 HydrophobicContact CG-CG2 4.2Å; Y188-S199 PolarHBondContact OH-OG 2.86Å; Y188-A200 HydrophobicContact CD2-CB 3.72Å; Y188-A200 HydrophobicContact CE2-CB 4.16Å
189	A	98.2	Very high	97.7	Very high	7 Å²	7	30 Å²	30	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-33.5	171.8	0	0	0	0	0	111.3	T186 I187 K203 A204 E207	T186-A189 HydrophobicContact CG2-CB 4.23Å; T186-A189 WeakPolarHBondContact O-CB 3.45Å; T186-A189 PolarHBondContact O-N 2.89Å; I187-A189 VanDerWaalsContact C-N 3.26Å; I187-A189 PolarHBondContact O-N 2.8Å; A189-K203 HydrophobicContact CB-CB 3.77Å; A189-A204 WeakPolarHBondContact O-CB 3.42Å; A189-E207 HydrophobicContact CB-CG 4.43Å; A189-E207 VanDerWaalsContact CB-OE1 3.32Å; A189-E207 WeakPolarHBondContact CB-OE1 3.27Å
190	E	96.8	Very high	97.7	Very high	117 Å²	117	30 Å²	30	55%	0.547	18%	0.181	S	C	.	.	H	α-helix	trans	-88.2	-43.7	-178.2	-173.3	172.8	176.6	0	0	112.7	Y188	Y188-E190 VanDerWaalsContact C-N 3.25Å
191	S	97.3	Very high	97.7	Very high	72 Å²	72	32 Å²	32	50%	0.503	20%	0.198	S	C	.	.	H	α-helix	trans	-81.7	-19	-179.9	55.6	0	0	0	0	114.3
192	G	97.9	Very high	97.6	Very high	34 Å²	34	32 Å²	32	35%	0.351	20%	0.198	S	C	.	.			trans	68.3	168	-153.7	0	0	0	0	0	112.2	Y188	Y188-G192 CarbonylContact O-C 3.5Å; Y188-G192 WeakPolarHBondContact O-CA 3.49Å; Y188-G192 PolarHBondContact O-N 3.01Å
193	S	96.5	Very high	97.6	Very high	57 Å²	57	32.5 Å²	32.5	40%	0.399	20%	0.2	S	C	.	.			trans	-158.9	131.1	168.6	175.6	0	0	0	0	109.7
194	G	96.1	Very high	97.6	Very high	42 Å²	42	34.3 Å²	34.3	43%	0.433	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	159.6	166	0	0	0	0	0	111.2	V196	G194-V196 PolarHBondContact O-N 3.41Å
195	F	94.4	Very high	97.6	Very high	127 Å²	127	35 Å²	35	56%	0.557	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.7	-11.3	-179.5	-47.6	-78.9	0	0	0	116.9	I139 C140 P141	I139-F195 WeakPolarHBondContact CA-O 3.13Å; I139-F195 HydrophobicContact CG2-CB 4.3Å; C140-F195 PolarHBondContact N-O 3.02Å; C140-F195 CarbonylContact O-C 3.52Å; C140-F195 VanDerWaalsContact O-CA 3.32Å; C140-F195 WeakPolarHBondContact O-CA 3.3Å; P141-F195 HydrophobicContact CB-CD1 4.41Å; P141-F195 HydrophobicContact CB-CE1 4.42Å; P141-F195 HydrophobicContact CG-CD1 4.23Å; P141-F195 HydrophobicContact CG-CE1 4.29Å
196	V	95.6	Very high	97.6	Very high	14 Å²	14	34.8 Å²	34.8	9%	0.085	22%	0.223	C	C	.	.			trans	-129.7	26.7	175.7	-65.8	0	0	0	0	112	I139 Y188 G194 S199 A200	I139-V196 HydrophobicContact CG1-CG1 3.85Å; Y188-V196 HydrophobicContact CD1-CG2 4.32Å; Y188-V196 HydrophobicContact CD2-CG2 4.01Å; Y188-V196 HydrophobicContact CE1-CG2 4.3Å; Y188-V196 HydrophobicContact CE2-CB 4.5Å; Y188-V196 HydrophobicContact CE2-CG2 3.99Å; Y188-V196 HydrophobicContact CG-CG2 4.2Å; G194-V196 PolarHBondContact O-N 3.41Å; V196-S199 WeakPolarHBondContact O-CA 3.45Å; V196-S199 WeakPolarHBondContact O-CB 3.35Å; V196-S199 PolarHBondContact O-N 3.32Å; V196-A200 PolarHBondContact O-N 3.31Å
197	V	98	Very high	97.7	Very high	43 Å²	43	34.5 Å²	34.5	26%	0.261	22%	0.221	S	C	.	.	H	α-helix	trans	-53.6	-44.8	-168.2	-175.7	0	0	0	0	114.2	T142 W150 S199 A200 A201	T142-V197 HydrophobicContact CG2-CB 4.39Å; T142-V197 HydrophobicContact CG2-CG2 4.32Å; T142-V197 WeakPolarHBondContact OG1-CG2 3.4Å; W150-V197 HydrophobicContact CH2-CG1 4.05Å; W150-V197 HydrophobicContact CZ3-CB 4.35Å; W150-V197 HydrophobicContact CZ3-CG1 3.74Å; V197-S199 VanDerWaalsContact C-N 3.29Å; V197-S199 PolarHBondContact O-N 3.21Å; V197-A200 PolarHBondContact O-N 3.39Å; V197-A201 WeakPolarHBondContact O-CB 3.24Å; V197-A201 PolarHBondContact O-N 2.83Å
198	P	97.9	Very high	97.7	Very high	4 Å²	4	36 Å²	36	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-37.9	177	-19.9	30.3	0	0	0	112.8	L145 W150 V153 A202	L145-P198 HydrophobicContact CD1-CG 3.53Å; W150-P198 HydrophobicContact CD2-CB 4.18Å; W150-P198 HydrophobicContact CD2-CG 4.25Å; W150-P198 HydrophobicContact CE3-CB 3.96Å; W150-P198 HydrophobicContact CE3-CG 3.63Å; W150-P198 HydrophobicContact CZ3-CB 4.34Å; W150-P198 HydrophobicContact CZ3-CG 4.07Å; V153-P198 HydrophobicContact CB-CB 3.79Å; V153-P198 HydrophobicContact CG1-CB 3.92Å; V153-P198 HydrophobicContact CG2-CB 4.2Å; P198-A202 VanDerWaalsContact O-CB 3.24Å; P198-A202 WeakPolarHBondContact O-CB 3.42Å; P198-A202 PolarHBondContact O-N 3.03Å
199	S	97.7	Very high	97.8	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-70.5	-44	177.8	-177.2	0	0	0	0	110.8	N137 Y188 V196 V197 A201 A202 K203	N137-S199 WeakPolarHBondContact OD1-CB 3.24Å; Y188-S199 PolarHBondContact OH-OG 2.86Å; V196-S199 WeakPolarHBondContact O-CA 3.45Å; V196-S199 WeakPolarHBondContact O-CB 3.35Å; V196-S199 PolarHBondContact O-N 3.32Å; V197-S199 VanDerWaalsContact C-N 3.29Å; V197-S199 PolarHBondContact O-N 3.21Å; S199-A201 PolarHBondContact O-N 2.69Å; S199-A202 PolarHBondContact O-N 3.44Å; S199-K203 VanDerWaalsContact O-CB 3.23Å; S199-K203 WeakPolarHBondContact O-CB 3.46Å; S199-K203 WeakPolarHBondContact O-CG 3.08Å; S199-K203 PolarHBondContact O-N 2.88Å
200	A	98.1	Very high	97.8	Very high	8 Å²	8	35.3 Å²	35.3	7%	0.066	23%	0.234	C	C	.	.	H	α-helix	trans	-57.7	-49.9	176.5	0	0	0	0	0	111.2	Y188 V196 V197 K203 A204	Y188-A200 HydrophobicContact CD2-CB 3.72Å; Y188-A200 HydrophobicContact CE2-CB 4.16Å; V196-A200 PolarHBondContact O-N 3.31Å; V197-A200 PolarHBondContact O-N 3.39Å; A200-K203 PolarHBondContact O-N 3.39Å; A200-A204 VanDerWaalsContact O-CB 3.32Å; A200-A204 WeakPolarHBondContact O-CB 3.4Å; A200-A204 PolarHBondContact O-N 3.14Å
201	A	98.7	Very high	97.9	Very high	47 Å²	47	34.8 Å²	34.8	39%	0.388	23%	0.23	S	C	.	.	H	α-helix	trans	-61.5	-48.2	178.3	0	0	0	0	0	112.3	W150 V197 S199 K203 A204 G205	W150-A201 HydrophobicContact CH2-CB 4.01Å; W150-A201 HydrophobicContact CZ2-CB 4.11Å; V197-A201 WeakPolarHBondContact O-CB 3.24Å; V197-A201 PolarHBondContact O-N 2.83Å; S199-A201 PolarHBondContact O-N 2.69Å; A201-K203 PolarHBondContact O-N 2.9Å; A201-A204 PolarHBondContact O-N 3.11Å; A201-G205 PolarHBondContact O-N 3.01Å
202	A	98.8	Very high	98	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-40.4	-179.6	0	0	0	0	0	112.2	V157 L158 P198 S199 G205 V206	V157-A202 HydrophobicContact CB-CB 3.78Å; V157-A202 HydrophobicContact CG1-CB 3.74Å; L158-A202 HydrophobicContact CB-CB 4.09Å; P198-A202 VanDerWaalsContact O-CB 3.24Å; P198-A202 WeakPolarHBondContact O-CB 3.42Å; P198-A202 PolarHBondContact O-N 3.03Å; S199-A202 PolarHBondContact O-N 3.44Å; A202-G205 PolarHBondContact O-N 3.44Å; A202-V206 WeakPolarHBondContact O-CG2 3.38Å; A202-V206 PolarHBondContact O-N 2.85Å
203	K	98.8	Very high	98.1	Very high	11 Å²	11	33.7 Å²	33.7	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-68.8	-39.9	177.3	-70	-62.2	-168.6	-179.8	0	112.1	V157 I184 T185 T186 A189 S199 A200 A201 G205 V206 E207	V157-K203 HydrophobicContact CG1-CD 3.45Å; V157-K203 VanDerWaalsContact CG1-CD 3.45Å; V157-K203 HydrophobicContact CG1-CG 3.99Å; I184-K203 PolarHBondContact O-NZ 3.5Å; T185-K203 HydrophobicContact CG2-CD 4.09Å; T186-K203 HydrophobicContact CG2-CB 4.25Å; T186-K203 HydrophobicContact CG2-CG 4.09Å; A189-K203 HydrophobicContact CB-CB 3.77Å; S199-K203 VanDerWaalsContact O-CB 3.23Å; S199-K203 WeakPolarHBondContact O-CB 3.46Å; S199-K203 WeakPolarHBondContact O-CG 3.08Å; S199-K203 PolarHBondContact O-N 2.88Å; A200-K203 PolarHBondContact O-N 3.39Å; A201-K203 PolarHBondContact O-N 2.9Å; K203-G205 VanDerWaalsContact C-N 3.28Å; K203-G205 PolarHBondContact O-N 3.41Å; K203-V206 WeakPolarHBondContact O-CB 3.47Å; K203-V206 PolarHBondContact O-N 2.81Å; K203-V206 VanDerWaalsContact O-N 3.11Å; K203-E207 WeakPolarHBondContact O-CG 3.35Å; K203-E207 PolarHBondContact O-N 2.9Å
204	A	98.9	Very high	98.2	Very high	37 Å²	37	31.7 Å²	31.7	31%	0.306	20%	0.203	S	C	.	.	H	α-helix	trans	-58.3	-42.2	171.4	0	0	0	0	0	111.6	A189 A200 A201 V206 E207 A208	A189-A204 WeakPolarHBondContact O-CB 3.42Å; A200-A204 VanDerWaalsContact O-CB 3.32Å; A200-A204 WeakPolarHBondContact O-CB 3.4Å; A200-A204 PolarHBondContact O-N 3.14Å; A201-A204 PolarHBondContact O-N 3.11Å; A204-V206 VanDerWaalsContact C-N 3.33Å; A204-V206 PolarHBondContact O-N 3.29Å; A204-E207 PolarHBondContact O-N 3.24Å; A204-A208 PolarHBondContact O-N 3.44Å
205	G	98.9	Very high	98.3	Very high	23 Å²	23	33.9 Å²	33.9	24%	0.237	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-39	173.8	0	0	0	0	0	113.2	A201 A202 K203 A208 L209	A201-G205 PolarHBondContact O-N 3.01Å; A202-G205 PolarHBondContact O-N 3.44Å; K203-G205 VanDerWaalsContact C-N 3.28Å; K203-G205 PolarHBondContact O-N 3.41Å; G205-A208 PolarHBondContact O-N 3.45Å; G205-L209 WeakPolarHBondContact O-CB 3.5Å; G205-L209 PolarHBondContact O-N 3.02Å
206	V	98.9	Very high	98.5	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-64.7	-40.3	174.5	169.6	0	0	0	0	111.5	V157 L158 T161 A183 T185 A202 K203 A204 L209 Y210	V157-V206 HydrophobicContact CG1-CG2 4.23Å; V157-V206 WeakPolarHBondContact O-CG2 3.23Å; L158-V206 HydrophobicContact CD1-CG2 4.04Å; T161-V206 HydrophobicContact CG2-CG1 4.01Å; T161-V206 HydrophobicContact CG2-CG2 4.17Å; A183-V206 HydrophobicContact CB-CG1 3.65Å; T185-V206 HydrophobicContact CG2-CB 4.34Å; T185-V206 HydrophobicContact CG2-CG1 3.97Å; A202-V206 WeakPolarHBondContact O-CG2 3.38Å; A202-V206 PolarHBondContact O-N 2.85Å; K203-V206 WeakPolarHBondContact O-CB 3.47Å; K203-V206 PolarHBondContact O-N 2.81Å; K203-V206 VanDerWaalsContact O-N 3.11Å; A204-V206 VanDerWaalsContact C-N 3.33Å; A204-V206 PolarHBondContact O-N 3.29Å; V206-L209 WeakPolarHBondContact O-CB 3.32Å; V206-L209 PolarHBondContact O-N 3.16Å; V206-Y210 HydrophobicContact CG1-CD1 4.47Å; V206-Y210 PolarHBondContact O-N 3.47Å
207	E	98.9	Very high	98.7	Very high	10 Å²	10	32.9 Å²	32.9	5%	0.047	21%	0.212	C	C	.	.	H	α-helix	trans	-65.4	-42.3	176.6	-62.1	-167.6	175.8	0	0	112	T185 A189 K203 A204 Y210 K211 I226 Q228	T185-E207 WeakPolarHBondContact CB-OE1 3.44Å; T185-E207 HydrophobicContact CG2-CG 3.76Å; T185-E207 PolarHBondContact OG1-OE1 2.72Å; A189-E207 HydrophobicContact CB-CG 4.43Å; A189-E207 VanDerWaalsContact CB-OE1 3.32Å; A189-E207 WeakPolarHBondContact CB-OE1 3.27Å; K203-E207 WeakPolarHBondContact O-CG 3.35Å; K203-E207 PolarHBondContact O-N 2.9Å; A204-E207 PolarHBondContact O-N 3.24Å; E207-Y210 PolarHBondContact O-N 2.89Å; E207-K211 WeakPolarHBondContact O-CB 3.33Å; E207-K211 VanDerWaalsContact O-CE 3.27Å; E207-K211 WeakPolarHBondContact O-CE 3.49Å; E207-K211 WeakPolarHBondContact O-CG 3.44Å; E207-K211 PolarHBondContact O-N 3.43Å; E207-I226 HydrophobicContact CB-CD1 3.97Å; E207-I226 HydrophobicContact CG-CD1 4.1Å; E207-I226 HydrophobicContact CG-CG2 4.07Å; E207-Q228 VanDerWaalsContact CD-NE2 3.34Å; E207-Q228 VanDerWaalsContact OE1-CG 3.26Å; E207-Q228 WeakPolarHBondContact OE1-CG 3.48Å; E207-Q228 PolarHBondContact OE1-NE2 3.03Å; E207-Q228 PolarHBondContact OE2-NE2 2.67Å; E207-Q228 VanDerWaalsContact OE2-NE2 3.14Å
208	A	98.9	Very high	98.7	Very high	48 Å²	48	32.8 Å²	32.8	40%	0.397	22%	0.219	S	C	.	.	H	α-helix	trans	-61	-46.4	173.7	0	0	0	0	0	111.2	A204 G205 Y210 K211 S212	A204-A208 PolarHBondContact O-N 3.44Å; G205-A208 PolarHBondContact O-N 3.45Å; A208-Y210 PolarHBondContact O-N 3.04Å; A208-K211 PolarHBondContact O-N 3.05Å; A208-S212 WeakPolarHBondContact O-CB 3.28Å; A208-S212 PolarHBondContact O-N 2.87Å; A208-S212 PolarHBondContact O-OG 3.08Å
209	L	98.9	Very high	98.8	Very high	41 Å²	41	41.1 Å²	41.1	22%	0.215	25%	0.25	C	S	.	.	H	α-helix	trans	-54.3	-49.9	175.9	174.7	66.8	0	0	0	111.7	T161 A162 G205 V206 S212 L213	T161-L209 HydrophobicContact CG2-CD2 4.2Å; A162-L209 HydrophobicContact CB-CD2 4.14Å; G205-L209 WeakPolarHBondContact O-CB 3.5Å; G205-L209 PolarHBondContact O-N 3.02Å; V206-L209 WeakPolarHBondContact O-CB 3.32Å; V206-L209 PolarHBondContact O-N 3.16Å; L209-S212 PolarHBondContact O-N 3.16Å; L209-L213 HydrophobicContact CD1-CD1 3.79Å; L209-L213 HydrophobicContact CD1-CG 4.12Å; L209-L213 HydrophobicContact CG-CD1 4.14Å; L209-L213 WeakPolarHBondContact O-CG 3.49Å; L209-L213 PolarHBondContact O-N 3.14Å
210	Y	98.9	Very high	98.8	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.4	-37.6	-177.3	-93.3	46.3	0	0	0	112.5	N132 T161 F181 L182 A183 V206 E207 A208 A214 F224 N225 I226	N132-Y210 PolarHBondContact ND2-OH 3.3Å; T161-Y210 HydrophobicContact CG2-CE1 3.85Å; F181-Y210 HydrophobicContact CB-CE2 3.9Å; L182-Y210 VanDerWaalsContact C-CE2 3.49Å; A183-Y210 HydrophobicContact CB-CD1 4.28Å; A183-Y210 HydrophobicContact CB-CD2 3.73Å; A183-Y210 HydrophobicContact CB-CE1 4.1Å; A183-Y210 HydrophobicContact CB-CE2 3.51Å; A183-Y210 HydrophobicContact CB-CG 4.13Å; V206-Y210 HydrophobicContact CG1-CD1 4.47Å; V206-Y210 PolarHBondContact O-N 3.47Å; E207-Y210 PolarHBondContact O-N 2.89Å; A208-Y210 PolarHBondContact O-N 3.04Å; Y210-A214 WeakPolarHBondContact O-CB 3.46Å; Y210-A214 PolarHBondContact O-N 3.24Å; Y210-F224 HydrophobicContact CD1-CD1 4.12Å; Y210-F224 HydrophobicContact CD2-CB 3.86Å; Y210-F224 AromaticContact CD2-CD1 3.88Å; Y210-F224 HydrophobicContact CD2-CD1 3.88Å; Y210-F224 HydrophobicContact CD2-CG 4.39Å; Y210-F224 HydrophobicContact CE1-CD1 4.17Å; Y210-F224 HydrophobicContact CE2-CB 4.49Å; Y210-F224 AromaticContact CE2-CD1 3.94Å; Y210-F224 HydrophobicContact CE2-CD1 3.94Å; Y210-F224 HydrophobicContact CG-CB 4.19Å; Y210-F224 AromaticContact CG-CD1 3.95Å; Y210-F224 HydrophobicContact CG-CD1 3.95Å; Y210-F224 WeakPolarHBondContact O-CB 3.5Å; Y210-N225 VanDerWaalsContact CD2-O 3.29Å; Y210-N225 WeakPolarHBondContact CD2-O 3.33Å; Y210-I226 HydrophobicContact CD2-CG1 4.1Å; Y210-I226 HydrophobicContact CG-CG1 4.27Å
211	K	98.9	Very high	98.8	Very high	106 Å²	106	47 Å²	47	46%	0.461	29%	0.286	S	S	.	.	H	α-helix	trans	-64.4	-40.9	173	-73.1	179.9	-66.1	-170.3	0	111.9	E207 A208	E207-K211 WeakPolarHBondContact O-CB 3.33Å; E207-K211 VanDerWaalsContact O-CE 3.27Å; E207-K211 WeakPolarHBondContact O-CE 3.49Å; E207-K211 WeakPolarHBondContact O-CG 3.44Å; E207-K211 PolarHBondContact O-N 3.43Å; A208-K211 PolarHBondContact O-N 3.05Å
212	S	98.9	Very high	98.8	Very high	72 Å²	72	44.9 Å²	44.9	50%	0.503	27%	0.268	S	S	.	.	H	α-helix	trans	-63.5	-48.1	176.5	-61.9	0	0	0	0	111.8	A208 L209 A214 A215 E216	A208-S212 WeakPolarHBondContact O-CB 3.28Å; A208-S212 PolarHBondContact O-N 2.87Å; A208-S212 PolarHBondContact O-OG 3.08Å; L209-S212 PolarHBondContact O-N 3.16Å; S212-A214 PolarHBondContact O-N 2.91Å; S212-A215 PolarHBondContact O-N 3.24Å; S212-E216 PolarHBondContact O-N 3.23Å
213	L	98.9	Very high	98.8	Very high	12 Å²	12	46.1 Å²	46.1	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-72.9	-26.7	-178.2	-64.5	-178.8	0	0	0	113.2	T165 L209 A215 E216 W217 F224	T165-L213 HydrophobicContact CG2-CD1 3.49Å; T165-L213 VanDerWaalsContact CG2-CD1 3.49Å; L209-L213 HydrophobicContact CD1-CD1 3.79Å; L209-L213 HydrophobicContact CD1-CG 4.12Å; L209-L213 HydrophobicContact CG-CD1 4.14Å; L209-L213 WeakPolarHBondContact O-CG 3.49Å; L209-L213 PolarHBondContact O-N 3.14Å; L213-A215 PolarHBondContact O-N 3.29Å; L213-E216 PolarHBondContact O-N 3.19Å; L213-W217 HydrophobicContact CD1-CE3 4.35Å; L213-W217 HydrophobicContact CD1-CH2 4.21Å; L213-W217 HydrophobicContact CD1-CZ3 4.08Å; L213-W217 HydrophobicContact CD2-CD2 3.9Å; L213-W217 HydrophobicContact CD2-CE3 4.33Å; L213-W217 HydrophobicContact CD2-CG 4.34Å; L213-W217 HydrophobicContact CD2-CH2 4.25Å; L213-W217 HydrophobicContact CD2-CZ2 3.82Å; L213-W217 HydrophobicContact CD2-CZ3 4.49Å; L213-W217 WeakPolarHBondContact O-CB 3.14Å; L213-W217 PolarHBondContact O-N 3.19Å; L213-F224 HydrophobicContact CB-CD1 4.05Å; L213-F224 HydrophobicContact CB-CD2 3.94Å; L213-F224 HydrophobicContact CB-CE1 3.84Å; L213-F224 HydrophobicContact CB-CE2 3.72Å; L213-F224 HydrophobicContact CB-CG 4.12Å; L213-F224 HydrophobicContact CB-CZ 3.69Å; L213-F224 HydrophobicContact CD1-CE1 3.87Å; L213-F224 HydrophobicContact CD1-CZ 4.09Å
214	A	98.9	Very high	98.9	Very high	15 Å²	15	45.6 Å²	45.6	12%	0.124	27%	0.27	C	S	.	.	H	α-helix	trans	-54.9	-42.2	168.6	0	0	0	0	0	111.7	Y210 S212 F224 S282	Y210-A214 WeakPolarHBondContact O-CB 3.46Å; Y210-A214 PolarHBondContact O-N 3.24Å; S212-A214 PolarHBondContact O-N 2.91Å; A214-F224 HydrophobicContact CB-CB 4.09Å; A214-S282 WeakPolarHBondContact CB-OG 3.49Å
215	A	98.9	Very high	98.9	Very high	87 Å²	87	43.9 Å²	43.9	72%	0.719	26%	0.256	S	S	*	.	H	α-helix	trans	-77.2	-45.9	177.4	0	0	0	0	0	112	S212 L213	S212-A215 PolarHBondContact O-N 3.24Å; L213-A215 PolarHBondContact O-N 3.29Å
216	E	98.9	Very high	98.9	Very high	100 Å²	100	42.8 Å²	42.8	47%	0.467	24%	0.244	S	C	.	.	H	α-helix	trans	-73.1	-39.3	-172.5	-164.7	-168	128.8	0	0	113.5	S212 L213 R219	S212-E216 PolarHBondContact O-N 3.23Å; L213-E216 PolarHBondContact O-N 3.19Å; E216-R219 PolarHBondContact O-NE 3.2Å
217	W	98.9	Very high	98.9	Very high	21 Å²	21	42.8 Å²	42.8	8%	0.08	24%	0.244	C	C	.	.	S	Bend	trans	-107.4	4.7	-170	-66.7	2.9	0	0	0	113.9	T165 L166 I173 L213 R219 Y220 H222 F224	T165-W217 HydrophobicContact CG2-CH2 4.49Å; T165-W217 HydrophobicContact CG2-CZ3 4.03Å; L166-W217 HydrophobicContact CD2-CH2 4.3Å; I173-W217 HydrophobicContact CD1-CD2 4.48Å; L213-W217 HydrophobicContact CD1-CE3 4.35Å; L213-W217 HydrophobicContact CD1-CH2 4.21Å; L213-W217 HydrophobicContact CD1-CZ3 4.08Å; L213-W217 HydrophobicContact CD2-CD2 3.9Å; L213-W217 HydrophobicContact CD2-CE3 4.33Å; L213-W217 HydrophobicContact CD2-CG 4.34Å; L213-W217 HydrophobicContact CD2-CH2 4.25Å; L213-W217 HydrophobicContact CD2-CZ2 3.82Å; L213-W217 HydrophobicContact CD2-CZ3 4.49Å; L213-W217 WeakPolarHBondContact O-CB 3.14Å; L213-W217 PolarHBondContact O-N 3.19Å; W217-R219 PolarHBondContact O-N 3.34Å; W217-Y220 HydrophobicContact CB-CD2 3.98Å; W217-Y220 AromaticContact CD1-CD2 3.88Å; W217-Y220 AromaticContact CD1-CE2 3.85Å; W217-Y220 AromaticContact CG-CD2 3.92Å; W217-Y220 HydrophobicContact CG-CD2 3.92Å; W217-Y220 HydrophobicContact CG-CE2 4.35Å; W217-Y220 PolarHBondContact O-N 3.14Å; W217-H222 HydrophobicContact CB-CB 4.09Å; W217-H222 AromaticContact CE3-CD2 3.8Å; W217-H222 PolarHBondContact O-N 2.78Å; W217-F224 HydrophobicContact CB-CE2 4.08Å; W217-F224 HydrophobicContact CE3-CE2 4.16Å; W217-F224 AromaticContact CE3-CZ 3.62Å; W217-F224 HydrophobicContact CE3-CZ 3.62Å; W217-F224 HydrophobicContact CZ3-CZ 4.13Å
218	G	98.8	Very high	98.9	Very high	40 Å²	40	42.3 Å²	42.3	41%	0.412	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-54	-37.2	168.5	0	0	0	0	0	112.3	Y220 G221 H222	G218-Y220 PolarHBondContact O-N 3.35Å; G218-Y220 VanDerWaalsContact O-N 3.13Å; G218-G221 PolarHBondContact O-N 3.45Å; G218-H222 WeakPolarHBondContact CA-O 3.45Å
219	R	98.6	Very high	98.8	Very high	179 Å²	179	40.6 Å²	40.6	68%	0.675	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-61	-17.9	174.4	65.8	179.5	167.7	168.3	0.3	114.9	E216 W217	E216-R219 PolarHBondContact O-NE 3.2Å; W217-R219 PolarHBondContact O-N 3.34Å
220	Y	98.8	Very high	98.6	Very high	86 Å²	86	39.2 Å²	39.2	34%	0.337	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-100	7.7	176.8	-56	-53.2	0	0	0	112.6	I173 W217 G218 H222	I173-Y220 HydrophobicContact CD1-CD2 3.47Å; I173-Y220 VanDerWaalsContact CD1-CD2 3.47Å; I173-Y220 HydrophobicContact CD1-CE2 3.68Å; I173-Y220 HydrophobicContact CD1-CG 4.02Å; I173-Y220 HydrophobicContact CG1-CD1 4.25Å; I173-Y220 HydrophobicContact CG1-CD2 3.72Å; I173-Y220 HydrophobicContact CG1-CE2 4.27Å; I173-Y220 HydrophobicContact CG1-CG 3.71Å; I173-Y220 HydrophobicContact CG2-CD1 4.09Å; I173-Y220 HydrophobicContact CG2-CE1 4.1Å; I173-Y220 HydrophobicContact CG2-CG 4.4Å; W217-Y220 HydrophobicContact CB-CD2 3.98Å; W217-Y220 AromaticContact CD1-CD2 3.88Å; W217-Y220 AromaticContact CD1-CE2 3.85Å; W217-Y220 AromaticContact CG-CD2 3.92Å; W217-Y220 HydrophobicContact CG-CD2 3.92Å; W217-Y220 HydrophobicContact CG-CE2 4.35Å; W217-Y220 PolarHBondContact O-N 3.14Å; G218-Y220 PolarHBondContact O-N 3.35Å; G218-Y220 VanDerWaalsContact O-N 3.13Å; Y220-H222 VanDerWaalsContact C-N 3.31Å
221	G	98.6	Very high	98.3	Very high	48 Å²	48	40.4 Å²	40.4	50%	0.495	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	21.7	-176	0	0	0	0	0	113.3	G178 A179 G218	G178-G221 CarbonylContact C-O 3.47Å; G178-G221 WeakPolarHBondContact CA-O 3.44Å; A179-G221 PolarHBondContact N-O 3.12Å; G218-G221 PolarHBondContact O-N 3.45Å
222	H	98.8	Very high	97.9	Very high	4 Å²	4	36 Å²	36	2%	0.019	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	137.8	173.7	-56.3	-24.7	0	0	0	110.9	I173 K177 A179 F181 W217 G218 Y220 F224	I173-H222 WeakPolarHBondContact CG1-NE2 3.47Å; K177-H222 PolarHBondContact O-CE1 2.89Å; K177-H222 VanDerWaalsContact O-CE1 3.26Å; A179-H222 WeakPolarHBondContact O-CA 3.37Å; F181-H222 HydrophobicContact CD2-CB 4.32Å; F181-H222 HydrophobicContact CE2-CB 4.13Å; F181-H222 AromaticContact CE2-CG 3.98Å; W217-H222 HydrophobicContact CB-CB 4.09Å; W217-H222 AromaticContact CE3-CD2 3.8Å; W217-H222 PolarHBondContact O-N 2.78Å; G218-H222 WeakPolarHBondContact CA-O 3.45Å; Y220-H222 VanDerWaalsContact C-N 3.31Å; H222-F224 HydrophobicContact CB-CD2 4.47Å; H222-F224 HydrophobicContact CB-CE2 3.61Å; H222-F224 HydrophobicContact CB-CZ 4.2Å
223	R	98.8	Very high	97	Very high	28 Å²	28	39.5 Å²	39.5	11%	0.106	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.6	173.6	59	-173.5	-167.1	76	1.1	110.4	A179 S180 F181 N225 L273 S274 S275 S282	A179-R223 PolarHBondContact O-N 3.03Å; A179-R223 VanDerWaalsContact O-N 3.08Å; S180-R223 PolarHBondContact OG-NH1 2.96Å; S180-R223 PolarHBondContact OG-NH2 3.18Å; S180-R223 VanDerWaalsContact OG-NH2 3.14Å; F181-R223 PolarHBondContact N-O 2.87Å; R223-N225 PolarHBondContact NH1-ND2 3.49Å; R223-L273 VanDerWaalsContact CZ-O 3.23Å; R223-L273 PolarHBondContact NH1-O 2.92Å; R223-L273 PolarHBondContact NH2-O 3.23Å; R223-S274 PolarHBondContact NH2-O 3.37Å; R223-S275 PolarHBondContact NH2-O 2.86Å; R223-S282 WeakPolarHBondContact CA-OG 3.3Å
224	F	98.9	Very high	96.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	122.5	-171.3	-68.6	-97.7	0	0	0	110.1	T165 F181 Y210 L213 A214 W217 H222 S282 G283	T165-F224 HydrophobicContact CG2-CE1 3.77Å; T165-F224 HydrophobicContact CG2-CZ 4.36Å; F181-F224 HydrophobicContact CB-CD1 3.38Å; F181-F224 HydrophobicContact CB-CE1 3.5Å; F181-F224 HydrophobicContact CB-CG 4.01Å; F181-F224 HydrophobicContact CB-CZ 4.23Å; F181-F224 HydrophobicContact CD1-CD1 4.48Å; F181-F224 AromaticContact CD1-CE1 3.78Å; F181-F224 HydrophobicContact CD1-CE1 3.78Å; F181-F224 HydrophobicContact CD1-CZ 4.33Å; F181-F224 HydrophobicContact CD2-CD1 4.31Å; F181-F224 AromaticContact CD2-CE1 3.7Å; F181-F224 HydrophobicContact CD2-CE1 3.7Å; F181-F224 HydrophobicContact CD2-CE2 4.14Å; F181-F224 AromaticContact CD2-CZ 3.59Å; F181-F224 HydrophobicContact CD2-CZ 3.59Å; F181-F224 HydrophobicContact CE1-CE1 4.42Å; F181-F224 HydrophobicContact CE2-CE1 4.35Å; F181-F224 AromaticContact CE2-CZ 3.96Å; F181-F224 HydrophobicContact CE2-CZ 3.96Å; F181-F224 AromaticContact CG-CD1 3.84Å; F181-F224 HydrophobicContact CG-CD1 3.84Å; F181-F224 AromaticContact CG-CE1 3.38Å; F181-F224 HydrophobicContact CG-CE1 3.38Å; F181-F224 AromaticContact CG-CZ 3.8Å; F181-F224 HydrophobicContact CG-CZ 3.8Å; F181-F224 HydrophobicContact CZ-CZ 4.48Å; F181-F224 CarbonylContact O-C 3.55Å; F181-F224 WeakPolarHBondContact O-CA 3.48Å; Y210-F224 HydrophobicContact CD1-CD1 4.12Å; Y210-F224 HydrophobicContact CD2-CB 3.86Å; Y210-F224 AromaticContact CD2-CD1 3.88Å; Y210-F224 HydrophobicContact CD2-CD1 3.88Å; Y210-F224 HydrophobicContact CD2-CG 4.39Å; Y210-F224 HydrophobicContact CE1-CD1 4.17Å; Y210-F224 HydrophobicContact CE2-CB 4.49Å; Y210-F224 AromaticContact CE2-CD1 3.94Å; Y210-F224 HydrophobicContact CE2-CD1 3.94Å; Y210-F224 HydrophobicContact CG-CB 4.19Å; Y210-F224 AromaticContact CG-CD1 3.95Å; Y210-F224 HydrophobicContact CG-CD1 3.95Å; Y210-F224 WeakPolarHBondContact O-CB 3.5Å; L213-F224 HydrophobicContact CB-CD1 4.05Å; L213-F224 HydrophobicContact CB-CD2 3.94Å; L213-F224 HydrophobicContact CB-CE1 3.84Å; L213-F224 HydrophobicContact CB-CE2 3.72Å; L213-F224 HydrophobicContact CB-CG 4.12Å; L213-F224 HydrophobicContact CB-CZ 3.69Å; L213-F224 HydrophobicContact CD1-CE1 3.87Å; L213-F224 HydrophobicContact CD1-CZ 4.09Å; A214-F224 HydrophobicContact CB-CB 4.09Å; W217-F224 HydrophobicContact CB-CE2 4.08Å; W217-F224 HydrophobicContact CE3-CE2 4.16Å; W217-F224 AromaticContact CE3-CZ 3.62Å; W217-F224 HydrophobicContact CE3-CZ 3.62Å; W217-F224 HydrophobicContact CZ3-CZ 4.13Å; H222-F224 HydrophobicContact CB-CD2 4.47Å; H222-F224 HydrophobicContact CB-CE2 3.61Å; H222-F224 HydrophobicContact CB-CZ 4.2Å; F224-S282 PolarHBondContact N-OG 3.41Å; F224-G283 WeakPolarHBondContact O-CA 3.42Å; F224-G283 PolarHBondContact O-N 2.91Å
225	N	98.9	Very high	94.8	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	163.5	176	-62.6	-68.5	0	0	0	111.4	F181 L182 A183 Y210 R223 M281 S282 A284	F181-N225 PolarHBondContact O-N 3.48Å; L182-N225 WeakPolarHBondContact CA-O 3.49Å; L182-N225 HydrophobicContact CD1-CB 4.2Å; L182-N225 WeakPolarHBondContact CD1-O 3.36Å; A183-N225 PolarHBondContact N-O 2.85Å; Y210-N225 VanDerWaalsContact CD2-O 3.29Å; Y210-N225 WeakPolarHBondContact CD2-O 3.33Å; R223-N225 PolarHBondContact NH1-ND2 3.49Å; N225-M281 PolarHBondContact ND2-O 3.42Å; N225-M281 PolarHBondContact OD1-O 2.73Å; N225-S282 WeakPolarHBondContact OD1-CA 3.41Å; N225-A284 WeakPolarHBondContact OD1-CB 3.42Å; N225-A284 PolarHBondContact OD1-N 2.95Å; N225-A284 VanDerWaalsContact OD1-N 3.15Å
226	I	98.9	Very high	93.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	137.6	-174.7	-62.8	142.7	0	0	0	109.7	A183 T185 E207 Y210 Q228 A284 V285 I286	A183-I226 HydrophobicContact CB-CG1 4.27Å; A183-I226 WeakPolarHBondContact O-CA 3.49Å; T185-I226 HydrophobicContact CG2-CG2 3.85Å; T185-I226 VanDerWaalsContact OG1-CG2 3.22Å; T185-I226 WeakPolarHBondContact OG1-CG2 3.36Å; E207-I226 HydrophobicContact CB-CD1 3.97Å; E207-I226 HydrophobicContact CG-CD1 4.1Å; E207-I226 HydrophobicContact CG-CG2 4.07Å; Y210-I226 HydrophobicContact CD2-CG1 4.1Å; Y210-I226 HydrophobicContact CG-CG1 4.27Å; I226-Q228 HydrophobicContact CG2-CG 4.41Å; I226-A284 PolarHBondContact N-O 3.07Å; I226-V285 HydrophobicContact CB-CG1 4.4Å; I226-V285 HydrophobicContact CB-CG2 4.34Å; I226-V285 HydrophobicContact CD1-CG2 3.74Å; I226-V285 HydrophobicContact CG2-CG1 4.15Å; I226-I286 PolarHBondContact O-N 2.74Å
227	I	98.9	Very high	91.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.3	164.7	-60.4	168.6	0	0	0	108.7	L182 A183 I184 T185 P229 L266 L269 A270 L273 I286 F288	L182-I227 HydrophobicContact CD1-CD1 4.23Å; L182-I227 HydrophobicContact CD1-CG1 4.08Å; L182-I227 HydrophobicContact CD2-CD1 4.05Å; A183-I227 PolarHBondContact O-N 2.86Å; I184-I227 HydrophobicContact CD1-CB 4.09Å; I184-I227 HydrophobicContact CD1-CD1 4.03Å; I184-I227 HydrophobicContact CD1-CG1 4.47Å; T185-I227 PolarHBondContact N-O 3.36Å; T185-I227 PolarHBondContact OG1-O 3.09Å; I227-P229 WeakPolarHBondContact O-CD 3.49Å; I227-L266 HydrophobicContact CG2-CD1 4.28Å; I227-L269 HydrophobicContact CD1-CB 4.4Å; I227-L269 HydrophobicContact CD1-CD2 4Å; I227-L269 HydrophobicContact CD1-CG 3.87Å; I227-L269 HydrophobicContact CG1-CD2 4.05Å; I227-L269 HydrophobicContact CG1-CG 4.27Å; I227-L269 HydrophobicContact CG2-CD2 4.05Å; I227-A270 HydrophobicContact CD1-CB 4.01Å; I227-L273 HydrophobicContact CD1-CD1 3.93Å; I227-L273 HydrophobicContact CG1-CD1 3.61Å; I227-I286 WeakPolarHBondContact CA-O 3.32Å; I227-F288 HydrophobicContact CG2-CB 3.88Å
228	Q	98.8	Very high	90	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	89.2	171.5	-73.7	177.7	-16.8	0	0	109.9	T185 I187 E207 I226 V285 I286 R287 F288	T185-Q228 VanDerWaalsContact OG1-CG 3.31Å; T185-Q228 WeakPolarHBondContact OG1-CG 3.33Å; I187-Q228 HydrophobicContact CG2-CB 4.28Å; E207-Q228 VanDerWaalsContact CD-NE2 3.34Å; E207-Q228 VanDerWaalsContact OE1-CG 3.26Å; E207-Q228 WeakPolarHBondContact OE1-CG 3.48Å; E207-Q228 PolarHBondContact OE1-NE2 3.03Å; E207-Q228 PolarHBondContact OE2-NE2 2.67Å; E207-Q228 VanDerWaalsContact OE2-NE2 3.14Å; I226-Q228 HydrophobicContact CG2-CG 4.41Å; Q228-V285 HydrophobicContact CG-CG1 3.78Å; Q228-I286 PolarHBondContact N-O 2.67Å; Q228-R287 HydrophobicContact CB-CG 4.16Å; Q228-F288 PolarHBondContact O-N 2.96Å
229	P	98.2	Very high	88.2	Confident	11 Å²	11	46.2 Å²	46.2	7%	0.071	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	142.9	176.3	28.6	-35.3	0	0	0	112.4	I184 T185 I227 I232 L266 F288	I184-P229 HydrophobicContact CG2-CG 3.9Å; T185-P229 WeakPolarHBondContact O-CD 3.22Å; I227-P229 WeakPolarHBondContact O-CD 3.49Å; P229-I232 HydrophobicContact CB-CD1 3.95Å; P229-L266 HydrophobicContact CB-CD1 3.78Å; P229-L266 HydrophobicContact CG-CD1 4.31Å; P229-F288 CarbonylContact C-O 3.53Å; P229-F288 WeakPolarHBondContact CA-O 3.46Å
230	G	94.9	Very high	86.4	Confident	13 Å²	13	48.3 Å²	48.3	13%	0.134	25%	0.253	C	S	.	.			trans	-79.2	-160	155.5	0	0	0	0	0	111.5	I232 F288	G230-I232 PolarHBondContact O-N 3.28Å; G230-F288 PolarHBondContact N-O 3.15Å
231	P	91.8	Very high	84.6	Confident	24 Å²	24	47.4 Å²	47.4	16%	0.156	25%	0.254	C	S	.	.			trans	-71.8	117.6	-178.2	29.7	-36.6	0	0	0	111	M251 I255 L260 G261 E292	P231-M251 HydrophobicContact CB-SD 3.96Å; P231-I255 HydrophobicContact CG-CD1 3.63Å; P231-L260 HydrophobicContact CB-CD2 3.88Å; P231-L260 HydrophobicContact CG-CD2 3.75Å; P231-G261 PolarHBondContact O-N 3Å; P231-E292 WeakPolarHBondContact CD-OE2 3.32Å
232	I	91.6	Very high	82.8	Confident	13 Å²	13	46 Å²	46	7%	0.067	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-115.8	128	173.8	-64.6	169.3	0	0	0	108.6	L60 P229 G230 T234 F238 G261 P263 L266 F288	L60-I232 HydrophobicContact CD1-CD1 4.43Å; L60-I232 HydrophobicContact CD2-CB 4.15Å; L60-I232 HydrophobicContact CD2-CD1 3.86Å; L60-I232 HydrophobicContact CD2-CG2 3.68Å; P229-I232 HydrophobicContact CB-CD1 3.95Å; G230-I232 PolarHBondContact O-N 3.28Å; I232-T234 HydrophobicContact CG2-CG2 4.37Å; I232-T234 PolarHBondContact O-N 3.03Å; I232-T234 VanDerWaalsContact O-N 3.1Å; I232-F238 WeakPolarHBondContact O-CE2 3.44Å; I232-G261 WeakPolarHBondContact CG2-O 3.4Å; I232-P263 HydrophobicContact CG2-CB 4.48Å; I232-P263 HydrophobicContact CG2-CG 3.83Å; I232-L266 HydrophobicContact CD1-CB 3.87Å; I232-L266 HydrophobicContact CD1-CD1 3.38Å; I232-L266 HydrophobicContact CD1-CG 4.27Å; I232-F288 HydrophobicContact CD1-CD1 4.05Å; I232-F288 HydrophobicContact CD1-CE1 4.02Å
233	R	80.3	Confident	80.9	Confident	146 Å²	146	51.5 Å²	51.5	55%	0.551	27%	0.271	S	S	*	.			trans	-67.1	112.5	-177.7	-168.3	168	175.1	148.4	-1.1	110.5	F238 E248 L260	R233-F238 HydrophobicContact CB-CE2 4.41Å; R233-F238 HydrophobicContact CG-CD2 4.36Å; R233-F238 HydrophobicContact CG-CG 4.4Å; R233-E248 IonicContact CZ-OE1 3.77Å; R233-E248 IonicContact CZ-OE2 3.51Å; R233-E248 IonicContact NH1-OE1 2.75Å; R233-E248 PolarHBondContact NH1-OE1 2.99Å; R233-E248 IonicContact NH1-OE2 2.89Å; R233-E248 PolarHBondContact NH1-OE2 2.78Å; R233-L260 HydrophobicContact CB-CD1 4Å
234	T	78	Confident	79.2	Confident	23 Å²	23	55 Å²	55	14%	0.141	30%	0.296	C	S	.	.			trans	-134.1	145.8	171.9	64	0	0	0	0	110	L60 I232 G236 A237 F238 P263	L60-T234 HydrophobicContact CD2-CG2 4.31Å; L60-T234 HydrophobicContact CG-CG2 4.47Å; I232-T234 HydrophobicContact CG2-CG2 4.37Å; I232-T234 PolarHBondContact O-N 3.03Å; I232-T234 VanDerWaalsContact O-N 3.1Å; T234-G236 PolarHBondContact O-N 3.44Å; T234-A237 PolarHBondContact O-N 3.21Å; T234-A237 WeakPolarHBondContact OG1-CB 3.48Å; T234-A237 PolarHBondContact OG1-N 3.49Å; T234-F238 PolarHBondContact O-N 2.99Å; T234-P263 HydrophobicContact CG2-CG 4.21Å
235	K	72.1	Confident	77.6	Confident	195 Å²	195	57.1 Å²	57.1	85%	0.848	32%	0.317	S	S	*	.	H	α-helix	trans	-54.4	-40.2	179.8	-170.4	177.6	179.9	-179.1	0	111.8	S239	K235-S239 VanDerWaalsContact O-CB 3.25Å; K235-S239 WeakPolarHBondContact O-CB 3.34Å; K235-S239 PolarHBondContact O-N 3.13Å; K235-S239 PolarHBondContact O-OG 3.22Å
236	G	65.3	Low	76.1	Confident	50 Å²	50	61.8 Å²	61.8	52%	0.515	35%	0.345	S	S	.	.	H	α-helix	trans	-69.8	-41.6	-179.3	0	0	0	0	0	114.5	T234	T234-G236 PolarHBondContact O-N 3.44Å
237	A	66.6	Low	74.9	Confident	38 Å²	38	65.4 Å²	65.4	31%	0.314	36%	0.361	S	S	.	.	H	α-helix	trans	-75.4	-50.2	179.3	0	0	0	0	0	111.4	T234 L241	T234-A237 PolarHBondContact O-N 3.21Å; T234-A237 WeakPolarHBondContact OG1-CB 3.48Å; T234-A237 PolarHBondContact OG1-N 3.49Å; A237-L241 HydrophobicContact CB-CD1 4.49Å; A237-L241 WeakPolarHBondContact O-CB 3.19Å; A237-L241 WeakPolarHBondContact O-CD1 3.39Å
238	F	64.9	Low	74	Confident	26 Å²	26	67.2 Å²	67.2	11%	0.114	37%	0.37	C	S	.	.	H	α-helix	trans	-76.5	-30.9	-168.5	-84.4	-106.5	0	0	0	114.2	I232 R233 T234 R240 L241 D242 E248 M251 L260	I232-F238 WeakPolarHBondContact O-CE2 3.44Å; R233-F238 HydrophobicContact CB-CE2 4.41Å; R233-F238 HydrophobicContact CG-CD2 4.36Å; R233-F238 HydrophobicContact CG-CG 4.4Å; T234-F238 PolarHBondContact O-N 2.99Å; F238-R240 PolarHBondContact O-N 3.01Å; F238-R240 VanDerWaalsContact O-N 3.15Å; F238-L241 PolarHBondContact O-N 2.88Å; F238-D242 PolarHBondContact O-N 3.24Å; F238-D242 VanDerWaalsContact O-N 3.13Å; F238-E248 HydrophobicContact CE1-CB 4.16Å; F238-E248 HydrophobicContact CE1-CG 4.1Å; F238-M251 HydrophobicContact CD1-CE 4.49Å; F238-M251 HydrophobicContact CE1-CE 3.51Å; F238-M251 HydrophobicContact CZ-CE 3.7Å; F238-L260 HydrophobicContact CE1-CD1 3.66Å; F238-L260 HydrophobicContact CE2-CD1 4.26Å; F238-L260 HydrophobicContact CZ-CD1 3.36Å
239	S	61.3	Low	73.1	Confident	84 Å²	84	73.6 Å²	73.6	59%	0.587	40%	0.397	S	S	*	.	H	α-helix	trans	-62.6	-21.7	178.2	56.5	0	0	0	0	114.3	K235	K235-S239 VanDerWaalsContact O-CB 3.25Å; K235-S239 WeakPolarHBondContact O-CB 3.34Å; K235-S239 PolarHBondContact O-N 3.13Å; K235-S239 PolarHBondContact O-OG 3.22Å
240	R	60	Low	72.4	Confident	223 Å²	223	75.3 Å²	75.3	84%	0.842	41%	0.41	S	S	*	.	H	α-helix	trans	-99.3	-19.5	178.8	-64.7	-179.5	179	168.2	-0.2	113.8	F238	F238-R240 PolarHBondContact O-N 3.01Å; F238-R240 VanDerWaalsContact O-N 3.15Å
241	L	60.8	Low	71.9	Confident	68 Å²	68	75.4 Å²	75.4	36%	0.356	41%	0.407	S	S	.	.	H	α-helix	trans	-100.6	-29.9	-168.3	-98.7	154.5	0	0	0	113	I139 A237 F238 F247	I139-L241 HydrophobicContact CD1-CD2 3.22Å; I139-L241 HydrophobicContact CD1-CG 4.13Å; A237-L241 HydrophobicContact CB-CD1 4.49Å; A237-L241 WeakPolarHBondContact O-CB 3.19Å; A237-L241 WeakPolarHBondContact O-CD1 3.39Å; F238-L241 PolarHBondContact O-N 2.88Å; L241-F247 HydrophobicContact CD2-CD1 4.37Å; L241-F247 HydrophobicContact CD2-CE1 3.75Å; L241-F247 HydrophobicContact CD2-CZ 4.27Å
242	D	61.4	Low	71.8	Confident	19 Å²	19	76.5 Å²	76.5	10%	0.102	41%	0.411	C	S	.	.			trans	-144.7	70.4	-172.4	-167.7	14.8	0	0	0	113.4	F238 T244 G245 T246 F247 E248	F238-D242 PolarHBondContact O-N 3.24Å; F238-D242 VanDerWaalsContact O-N 3.13Å; D242-T244 PolarHBondContact O-N 3.42Å; D242-T244 VanDerWaalsContact O-N 3.16Å; D242-G245 VanDerWaalsContact CG-CA 3.45Å; D242-G245 VanDerWaalsContact CG-N 3.35Å; D242-G245 WeakPolarHBondContact OD1-CA 3.28Å; D242-G245 PolarHBondContact OD1-N 3.01Å; D242-G245 WeakPolarHBondContact OD2-CA 3.48Å; D242-T246 PolarHBondContact OD1-N 3.14Å; D242-T246 VanDerWaalsContact OD1-N 3.09Å; D242-T246 PolarHBondContact OD2-N 3.44Å; D242-F247 HydrophobicContact CB-CB 3.76Å; D242-F247 HydrophobicContact CB-CD1 4.44Å; D242-F247 WeakPolarHBondContact OD1-CB 3.34Å; D242-F247 PolarHBondContact OD1-N 2.94Å; D242-F247 VanDerWaalsContact OD1-N 3.08Å; D242-F247 PolarHBondContact OD2-N 3.29Å; D242-F247 VanDerWaalsContact OD2-N 3.14Å; D242-E248 WeakPolarHBondContact OD2-CB 3.27Å; D242-E248 PolarHBondContact OD2-N 2.92Å
243	P	58	Low	71.7	Confident	119 Å²	119	80.9 Å²	80.9	77%	0.773	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.9	177.8	25.6	-32.3	0	0	0	113.4
244	T	62.9	Low	72.2	Confident	102 Å²	102	77.6 Å²	77.6	63%	0.626	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-5.4	-175.3	63.4	0	0	0	0	114.3	D242 T246	D242-T244 PolarHBondContact O-N 3.42Å; D242-T244 VanDerWaalsContact O-N 3.16Å; T244-T246 PolarHBondContact O-N 2.84Å; T244-T246 PolarHBondContact OG1-OG1 3.47Å
245	G	65.1	Low	73	Confident	43 Å²	43	77 Å²	77	44%	0.443	42%	0.418	S	S	.	.	S	Bend	trans	72.4	-0.3	-177.3	0	0	0	0	0	114.9	D242	D242-G245 VanDerWaalsContact CG-CA 3.45Å; D242-G245 VanDerWaalsContact CG-N 3.35Å; D242-G245 WeakPolarHBondContact OD1-CA 3.28Å; D242-G245 PolarHBondContact OD1-N 3.01Å; D242-G245 WeakPolarHBondContact OD2-CA 3.48Å
246	T	69	Low	74.1	Confident	99 Å²	99	70.8 Å²	70.8	61%	0.607	40%	0.397	S	S	*	.	H	α-helix	trans	-80.8	-29.2	-176.5	56.9	0	0	0	0	111.9	D242 T244 S250	D242-T246 PolarHBondContact OD1-N 3.14Å; D242-T246 VanDerWaalsContact OD1-N 3.09Å; D242-T246 PolarHBondContact OD2-N 3.44Å; T244-T246 PolarHBondContact O-N 2.84Å; T244-T246 PolarHBondContact OG1-OG1 3.47Å; T246-S250 PolarHBondContact O-N 3.43Å
247	F	72.9	Confident	75.6	Confident	77 Å²	77	69.7 Å²	69.7	34%	0.338	38%	0.381	S	S	.	.	H	α-helix	trans	-73	-37.6	-178.2	-170.4	-106.9	0	0	0	111.5	L241 D242 K249 S250 M251	L241-F247 HydrophobicContact CD2-CD1 4.37Å; L241-F247 HydrophobicContact CD2-CE1 3.75Å; L241-F247 HydrophobicContact CD2-CZ 4.27Å; D242-F247 HydrophobicContact CB-CB 3.76Å; D242-F247 HydrophobicContact CB-CD1 4.44Å; D242-F247 WeakPolarHBondContact OD1-CB 3.34Å; D242-F247 PolarHBondContact OD1-N 2.94Å; D242-F247 VanDerWaalsContact OD1-N 3.08Å; D242-F247 PolarHBondContact OD2-N 3.29Å; D242-F247 VanDerWaalsContact OD2-N 3.14Å; F247-K249 PolarHBondContact O-N 2.77Å; F247-S250 PolarHBondContact O-N 3.23Å; F247-S250 PolarHBondContact O-OG 3.06Å; F247-M251 HydrophobicContact CD1-CE 3.24Å; F247-M251 HydrophobicContact CD1-CG 4.4Å; F247-M251 HydrophobicContact CD1-SD 3.96Å; F247-M251 HydrophobicContact CE1-CE 3.48Å; F247-M251 VanDerWaalsContact CE1-CE 3.48Å; F247-M251 HydrophobicContact CE1-CG 4.12Å; F247-M251 HydrophobicContact CE1-SD 3.54Å; F247-M251 VanDerWaalsContact CE1-SD 3.54Å; F247-M251 HydrophobicContact CG-CE 4.24Å; F247-M251 HydrophobicContact CZ-SD 4.35Å; F247-M251 PolarHBondContact O-N 3.1Å
248	E	80.2	Confident	76.9	Confident	38 Å²	38	68.6 Å²	68.6	18%	0.178	37%	0.373	C	S	.	.	H	α-helix	trans	-59	-44.8	176.6	-179.3	166.4	176.8	0	0	112	R233 F238 D242 S250 M251 I252 L260	R233-E248 IonicContact CZ-OE1 3.77Å; R233-E248 IonicContact CZ-OE2 3.51Å; R233-E248 IonicContact NH1-OE1 2.75Å; R233-E248 PolarHBondContact NH1-OE1 2.99Å; R233-E248 IonicContact NH1-OE2 2.89Å; R233-E248 PolarHBondContact NH1-OE2 2.78Å; F238-E248 HydrophobicContact CE1-CB 4.16Å; F238-E248 HydrophobicContact CE1-CG 4.1Å; D242-E248 WeakPolarHBondContact OD2-CB 3.27Å; D242-E248 PolarHBondContact OD2-N 2.92Å; E248-S250 VanDerWaalsContact C-N 3.33Å; E248-S250 PolarHBondContact O-N 3.4Å; E248-M251 HydrophobicContact CB-CE 4.49Å; E248-M251 WeakPolarHBondContact O-CB 3.44Å; E248-M251 PolarHBondContact O-N 3.27Å; E248-I252 HydrophobicContact CG-CD1 4.11Å; E248-I252 WeakPolarHBondContact O-CG1 3.28Å; E248-I252 PolarHBondContact O-N 2.95Å; E248-L260 HydrophobicContact CG-CD1 3.95Å
249	K	80.6	Confident	78.3	Confident	134 Å²	134	69.5 Å²	69.5	58%	0.583	38%	0.376	S	S	*	.	H	α-helix	trans	-60.8	-43.5	176.5	-171.6	177.2	178.6	-178.8	0	111.7	F247 M251 I252 D253	F247-K249 PolarHBondContact O-N 2.77Å; K249-M251 VanDerWaalsContact C-N 3.28Å; K249-M251 PolarHBondContact O-N 3Å; K249-I252 PolarHBondContact O-N 2.89Å; K249-D253 PolarHBondContact O-N 2.81Å; K249-D253 VanDerWaalsContact O-N 3.09Å
250	S	81.6	Confident	79.9	Confident	47 Å²	47	66.1 Å²	66.1	33%	0.329	35%	0.351	S	S	.	.	H	α-helix	trans	-66.6	-27.5	178.2	80.1	0	0	0	0	113.7	T246 F247 E248 R254	T246-S250 PolarHBondContact O-N 3.43Å; F247-S250 PolarHBondContact O-N 3.23Å; F247-S250 PolarHBondContact O-OG 3.06Å; E248-S250 VanDerWaalsContact C-N 3.33Å; E248-S250 PolarHBondContact O-N 3.4Å; S250-R254 PolarHBondContact O-NE 3.38Å
251	M	85.1	Confident	81.6	Confident	16 Å²	16	56.1 Å²	56.1	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-70.3	-49.5	171	-74.9	-174.7	-76.8	0	0	110.1	P231 F238 F247 E248 K249 D253 R254 I255 L260	P231-M251 HydrophobicContact CB-SD 3.96Å; F238-M251 HydrophobicContact CD1-CE 4.49Å; F238-M251 HydrophobicContact CE1-CE 3.51Å; F238-M251 HydrophobicContact CZ-CE 3.7Å; F247-M251 HydrophobicContact CD1-CE 3.24Å; F247-M251 HydrophobicContact CD1-CG 4.4Å; F247-M251 HydrophobicContact CD1-SD 3.96Å; F247-M251 HydrophobicContact CE1-CE 3.48Å; F247-M251 VanDerWaalsContact CE1-CE 3.48Å; F247-M251 HydrophobicContact CE1-CG 4.12Å; F247-M251 HydrophobicContact CE1-SD 3.54Å; F247-M251 VanDerWaalsContact CE1-SD 3.54Å; F247-M251 HydrophobicContact CG-CE 4.24Å; F247-M251 HydrophobicContact CZ-SD 4.35Å; F247-M251 PolarHBondContact O-N 3.1Å; E248-M251 HydrophobicContact CB-CE 4.49Å; E248-M251 WeakPolarHBondContact O-CB 3.44Å; E248-M251 PolarHBondContact O-N 3.27Å; K249-M251 VanDerWaalsContact C-N 3.28Å; K249-M251 PolarHBondContact O-N 3Å; M251-D253 VanDerWaalsContact C-N 3.27Å; M251-D253 PolarHBondContact O-N 3.36Å; M251-R254 WeakPolarHBondContact O-CB 3.49Å; M251-R254 PolarHBondContact O-N 3.49Å; M251-I255 WeakPolarHBondContact O-CG1 3.18Å; M251-L260 HydrophobicContact CB-CD2 4.37Å
252	I	90.7	Very high	83.2	Confident	47 Å²	47	56.6 Å²	56.6	24%	0.241	32%	0.317	C	S	.	.	H	α-helix	trans	-56.5	-40.3	-179.5	-68.7	167.7	0	0	0	112.1	E248 K249 R254 I255 G258 L260	E248-I252 HydrophobicContact CG-CD1 4.11Å; E248-I252 WeakPolarHBondContact O-CG1 3.28Å; E248-I252 PolarHBondContact O-N 2.95Å; K249-I252 PolarHBondContact O-N 2.89Å; I252-R254 PolarHBondContact O-N 2.97Å; I252-R254 VanDerWaalsContact O-N 3.07Å; I252-I255 PolarHBondContact O-N 3.23Å; I252-G258 VanDerWaalsContact CG2-O 3.3Å; I252-G258 WeakPolarHBondContact CG2-O 3.21Å; I252-L260 HydrophobicContact CG1-CD2 4.07Å; I252-L260 HydrophobicContact CG1-CG 4.19Å
253	D	88.9	Confident	84.9	Confident	104 Å²	104	57.1 Å²	57.1	56%	0.556	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.2	179.5	-71	-16.7	0	0	0	114.3	K249 M251 R304	K249-D253 PolarHBondContact O-N 2.81Å; K249-D253 VanDerWaalsContact O-N 3.09Å; M251-D253 VanDerWaalsContact C-N 3.27Å; M251-D253 PolarHBondContact O-N 3.36Å; D253-R304 PolarHBondContact O-NH2 3.02Å
254	R	90.4	Very high	86.7	Confident	77 Å²	77	52.3 Å²	52.3	29%	0.291	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-13.1	175.9	-66.5	179.5	-79.6	167.6	-2.5	113	S250 M251 I252 P256 S295 M296	S250-R254 PolarHBondContact O-NE 3.38Å; M251-R254 WeakPolarHBondContact O-CB 3.49Å; M251-R254 PolarHBondContact O-N 3.49Å; I252-R254 PolarHBondContact O-N 2.97Å; I252-R254 VanDerWaalsContact O-N 3.07Å; R254-P256 WeakPolarHBondContact O-CD 3.44Å; R254-S295 WeakPolarHBondContact O-CB 3.4Å; R254-S295 PolarHBondContact O-OG 3.19Å; R254-M296 HydrophobicContact CB-CG 4.43Å; R254-M296 HydrophobicContact CB-SD 4.48Å
255	I	95.2	Very high	88.4	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.051	27%	0.268	C	S	.	.			trans	-96.6	116.6	-175.2	-56.1	167	0	0	0	109.8	P231 M251 I252 T257 G258 R259 L260 E292	P231-I255 HydrophobicContact CG-CD1 3.63Å; M251-I255 WeakPolarHBondContact O-CG1 3.18Å; I252-I255 PolarHBondContact O-N 3.23Å; I255-T257 VanDerWaalsContact C-N 3.31Å; I255-T257 WeakPolarHBondContact CG2-OG1 3.3Å; I255-T257 PolarHBondContact O-N 3.19Å; I255-G258 WeakPolarHBondContact O-CA 3.24Å; I255-G258 PolarHBondContact O-N 2.99Å; I255-R259 WeakPolarHBondContact CD1-O 3.42Å; I255-R259 WeakPolarHBondContact CG2-O 3.47Å; I255-L260 HydrophobicContact CD1-CD2 3.79Å; I255-E292 HydrophobicContact CG1-CB 4.14Å; I255-E292 HydrophobicContact CG1-CG 4.2Å
256	P	95.8	Very high	90	Very high	65 Å²	65	46.8 Å²	46.8	42%	0.422	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-37.7	178.9	-30.8	36.7	0	0	0	115.4	P29 R254 G258 G290 G291	P29-P256 WeakPolarHBondContact CB-O 3.41Å; R254-P256 WeakPolarHBondContact O-CD 3.44Å; P256-G258 PolarHBondContact O-N 3.27Å; P256-G290 VanDerWaalsContact CD-O 3.27Å; P256-G290 WeakPolarHBondContact CD-O 3.18Å; P256-G291 VanDerWaalsContact CD-C 3.42Å; P256-G291 WeakPolarHBondContact CD-O 3.46Å; P256-G291 WeakPolarHBondContact CG-O 3.45Å
257	T	95.9	Very high	91.4	Very high	27 Å²	27	42.1 Å²	42.1	17%	0.166	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-7.3	175.4	58	0	0	0	0	113.5	P29 S30 F33 I255 R259 G290	P29-T257 CarbonylContact C-O 3.54Å; S30-T257 VanDerWaalsContact CA-O 3.28Å; S30-T257 WeakPolarHBondContact CA-O 3.39Å; S30-T257 PolarHBondContact N-O 2.89Å; F33-T257 HydrophobicContact CB-CG2 4.41Å; F33-T257 HydrophobicContact CD1-CG2 4.28Å; F33-T257 HydrophobicContact CD2-CG2 4.01Å; F33-T257 HydrophobicContact CE2-CG2 4.35Å; F33-T257 HydrophobicContact CG-CG2 3.97Å; I255-T257 VanDerWaalsContact C-N 3.31Å; I255-T257 WeakPolarHBondContact CG2-OG1 3.3Å; I255-T257 PolarHBondContact O-N 3.19Å; T257-R259 VanDerWaalsContact C-N 3.29Å; T257-R259 PolarHBondContact O-N 2.87Å; T257-G290 WeakPolarHBondContact CG2-O 3.23Å; T257-G290 PolarHBondContact N-O 3.32Å; T257-G290 WeakPolarHBondContact OG1-CA 3.45Å
258	G	94.4	Very high	92.7	Very high	15 Å²	15	39 Å²	39	16%	0.155	21%	0.206	C	C	.	.	S	Bend	trans	70.5	19.6	172.7	0	0	0	0	0	114.7	S30 I252 I255 P256	S30-G258 WeakPolarHBondContact CB-O 3.49Å; I252-G258 VanDerWaalsContact CG2-O 3.3Å; I252-G258 WeakPolarHBondContact CG2-O 3.21Å; I255-G258 WeakPolarHBondContact O-CA 3.24Å; I255-G258 PolarHBondContact O-N 2.99Å; P256-G258 PolarHBondContact O-N 3.27Å
259	R	94.4	Very high	93.5	Very high	45 Å²	45	38.9 Å²	38.9	17%	0.17	21%	0.206	C	C	.	.	S	Bend	trans	-153	164.6	175.9	62.8	165.7	179.3	94.6	-7.9	111.9	F33 I255 T257 E265	F33-R259 VanDerWaalsContact O-CZ 3.31Å; F33-R259 PolarHBondContact O-NE 3.05Å; F33-R259 PolarHBondContact O-NH2 2.93Å; I255-R259 WeakPolarHBondContact CD1-O 3.42Å; I255-R259 WeakPolarHBondContact CG2-O 3.47Å; T257-R259 VanDerWaalsContact C-N 3.29Å; T257-R259 PolarHBondContact O-N 2.87Å; R259-E265 IonicContact CZ-OE1 2.89Å; R259-E265 IonicContact CZ-OE2 3.95Å; R259-E265 IonicContact NH1-OE1 2.69Å; R259-E265 PolarHBondContact NH1-OE1 3.36Å; R259-E265 IonicContact NH1-OE2 2.74Å; R259-E265 PolarHBondContact NH1-OE2 3.16Å; R259-E265 IonicContact NH2-OE1 2.99Å; R259-E265 PolarHBondContact NH2-OE1 2.89Å; R259-E265 IonicContact NH2-OE2 2.81Å
260	L	94.4	Very high	94.4	Very high	13 Å²	13	32.5 Å²	32.5	7%	0.068	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-72.8	155.2	165.5	-56	-174.4	0	0	0	111.2	P231 R233 F238 E248 M251 I252 I255	P231-L260 HydrophobicContact CB-CD2 3.88Å; P231-L260 HydrophobicContact CG-CD2 3.75Å; R233-L260 HydrophobicContact CB-CD1 4Å; F238-L260 HydrophobicContact CE1-CD1 3.66Å; F238-L260 HydrophobicContact CE2-CD1 4.26Å; F238-L260 HydrophobicContact CZ-CD1 3.36Å; E248-L260 HydrophobicContact CG-CD1 3.95Å; M251-L260 HydrophobicContact CB-CD2 4.37Å; I252-L260 HydrophobicContact CG1-CD2 4.07Å; I252-L260 HydrophobicContact CG1-CG 4.19Å; I255-L260 HydrophobicContact CD1-CD2 3.79Å
261	G	95.8	Very high	95.2	Very high	14 Å²	14	30.3 Å²	30.3	14%	0.144	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-70.2	157.8	169	0	0	0	0	0	111.9	P231 I232	P231-G261 PolarHBondContact O-N 3Å; I232-G261 WeakPolarHBondContact CG2-O 3.4Å
262	K	95.6	Very high	95.9	Very high	78 Å²	78	33.4 Å²	33.4	34%	0.339	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-101.5	145.8	172.2	-60.8	-68.3	-169.9	156	0	111.3	P35 E37 A264 E265 L266	P35-K262 HydrophobicContact CB-CG 3.74Å; P35-K262 HydrophobicContact CG-CG 4.2Å; E37-K262 HydrophobicContact CG-CB 4.33Å; E37-K262 HydrophobicContact CG-CG 4.29Å; E37-K262 WeakPolarHBondContact OE1-CE 3.49Å; E37-K262 IonicContact OE1-NZ 2.67Å; K262-A264 PolarHBondContact O-N 2.69Å; K262-E265 HydrophobicContact CB-CG 4.02Å; K262-E265 WeakPolarHBondContact CB-OE2 3.49Å; K262-E265 WeakPolarHBondContact CG-OE2 3.35Å; K262-E265 PolarHBondContact N-OE2 3.23Å; K262-E265 PolarHBondContact O-N 3.1Å; K262-L266 PolarHBondContact O-N 3.47Å
263	P	96.6	Very high	96.3	Very high	30 Å²	30	31.2 Å²	31.2	20%	0.195	16%	0.163	C	C	.	.	H	α-helix	trans	-56.1	-37.2	175.4	-26.3	34.9	0	0	0	113.7	L60 A63 I232 T234 L266 A267	L60-P263 HydrophobicContact CD2-CB 4.25Å; A63-P263 HydrophobicContact CB-CB 3.48Å; A63-P263 VanDerWaalsContact CB-CB 3.48Å; I232-P263 HydrophobicContact CG2-CB 4.48Å; I232-P263 HydrophobicContact CG2-CG 3.83Å; T234-P263 HydrophobicContact CG2-CG 4.21Å; P263-L266 PolarHBondContact O-N 3.4Å; P263-A267 WeakPolarHBondContact O-CB 3.37Å; P263-A267 PolarHBondContact O-N 3.12Å
264	A	96.2	Very high	96.7	Very high	18 Å²	18	26.5 Å²	26.5	15%	0.149	14%	0.139	C	C	.	.	H	α-helix	trans	-66.2	-37.5	178.8	0	0	0	0	0	113	E37 K262 A267 N268	E37-A264 HydrophobicContact CB-CB 3.82Å; E37-A264 HydrophobicContact CG-CB 4.26Å; E37-A264 WeakPolarHBondContact O-CB 3.35Å; K262-A264 PolarHBondContact O-N 2.69Å; A264-A267 PolarHBondContact O-N 3.1Å; A264-N268 PolarHBondContact O-N 2.81Å
265	E	98.1	Very high	97.1	Very high	29 Å²	29	23.1 Å²	23.1	14%	0.136	13%	0.127	C	C	.	.	H	α-helix	trans	-65.2	-41.9	176.4	-63.5	174.6	109	0	0	111.4	P35 S36 R259 K262 A267 N268 L269 F288	P35-E265 WeakPolarHBondContact CA-OE1 3.35Å; P35-E265 HydrophobicContact CB-CG 4.33Å; S36-E265 WeakPolarHBondContact O-CG 3.39Å; R259-E265 IonicContact CZ-OE1 2.89Å; R259-E265 IonicContact CZ-OE2 3.95Å; R259-E265 IonicContact NH1-OE1 2.69Å; R259-E265 PolarHBondContact NH1-OE1 3.36Å; R259-E265 IonicContact NH1-OE2 2.74Å; R259-E265 PolarHBondContact NH1-OE2 3.16Å; R259-E265 IonicContact NH2-OE1 2.99Å; R259-E265 PolarHBondContact NH2-OE1 2.89Å; R259-E265 IonicContact NH2-OE2 2.81Å; K262-E265 HydrophobicContact CB-CG 4.02Å; K262-E265 WeakPolarHBondContact CB-OE2 3.49Å; K262-E265 WeakPolarHBondContact CG-OE2 3.35Å; K262-E265 PolarHBondContact N-OE2 3.23Å; K262-E265 PolarHBondContact O-N 3.1Å; E265-A267 VanDerWaalsContact C-N 3.33Å; E265-N268 PolarHBondContact O-N 3.31Å; E265-L269 PolarHBondContact O-N 2.96Å; E265-F288 HydrophobicContact CB-CE1 4.34Å; E265-F288 HydrophobicContact CB-CE2 4.33Å; E265-F288 HydrophobicContact CB-CZ 3.53Å
266	L	98.6	Very high	97.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.8	-39.7	173.2	-179.1	145	0	0	0	111.4	L60 M64 I184 I227 P229 I232 K262 P263 N268 L269 A270 F288	L60-L266 HydrophobicContact CB-CD2 4.4Å; L60-L266 HydrophobicContact CD1-CD1 3.97Å; L60-L266 HydrophobicContact CD2-CD1 4.25Å; L60-L266 HydrophobicContact CD2-CD2 4.3Å; M64-L266 HydrophobicContact CE-CD2 4.45Å; M64-L266 HydrophobicContact CG-CD2 4.04Å; M64-L266 HydrophobicContact SD-CD2 3.85Å; I184-L266 HydrophobicContact CD1-CD2 4.5Å; I227-L266 HydrophobicContact CG2-CD1 4.28Å; P229-L266 HydrophobicContact CB-CD1 3.78Å; P229-L266 HydrophobicContact CG-CD1 4.31Å; I232-L266 HydrophobicContact CD1-CB 3.87Å; I232-L266 HydrophobicContact CD1-CD1 3.38Å; I232-L266 HydrophobicContact CD1-CG 4.27Å; K262-L266 PolarHBondContact O-N 3.47Å; P263-L266 PolarHBondContact O-N 3.4Å; L266-N268 VanDerWaalsContact C-N 3.31Å; L266-N268 PolarHBondContact O-N 3.32Å; L266-L269 PolarHBondContact O-N 2.95Å; L266-A270 WeakPolarHBondContact O-CB 3.11Å; L266-A270 PolarHBondContact O-N 3.28Å; L266-F288 HydrophobicContact CB-CD1 4.12Å; L266-F288 HydrophobicContact CB-CE1 3.92Å; L266-F288 HydrophobicContact CD1-CD1 4.22Å
267	A	98.7	Very high	97.4	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.008	16%	0.158	C	C	.	.	H	α-helix	trans	-63.6	-36.6	177.9	0	0	0	0	0	112.4	A63 M64 V67 P263 A264 E265 A270 A271	A63-A267 HydrophobicContact CB-CB 4.28Å; A63-A267 WeakPolarHBondContact O-CB 3.22Å; M64-A267 HydrophobicContact CG-CB 4.14Å; V67-A267 HydrophobicContact CB-CB 3.96Å; V67-A267 HydrophobicContact CG2-CB 3.57Å; P263-A267 WeakPolarHBondContact O-CB 3.37Å; P263-A267 PolarHBondContact O-N 3.12Å; A264-A267 PolarHBondContact O-N 3.1Å; E265-A267 VanDerWaalsContact C-N 3.33Å; A267-A270 PolarHBondContact O-N 3.05Å; A267-A271 WeakPolarHBondContact O-CB 3.31Å; A267-A271 PolarHBondContact O-N 3.17Å
268	N	98.7	Very high	97.5	Very high	12 Å²	12	29.5 Å²	29.5	6%	0.064	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-44.7	171.9	-81.9	-33	0	0	0	112.4	G38 M40 A264 E265 L266 A271 Y272	G38-N268 PolarHBondContact O-ND2 3.44Å; G38-N268 PolarHBondContact O-OD1 3.25Å; M40-N268 HydrophobicContact CB-CB 4.04Å; M40-N268 PolarHBondContact N-OD1 3.2Å; A264-N268 PolarHBondContact O-N 2.81Å; E265-N268 PolarHBondContact O-N 3.31Å; L266-N268 VanDerWaalsContact C-N 3.31Å; L266-N268 PolarHBondContact O-N 3.32Å; N268-A271 PolarHBondContact O-N 2.96Å; N268-Y272 PolarHBondContact O-N 3.04Å
269	L	98.9	Very high	97.7	Very high	34 Å²	34	32.9 Å²	32.9	18%	0.178	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-43.4	175	178.1	60.9	0	0	0	111.5	I227 E265 L266 A271 Y272 L273 I286 F288	I227-L269 HydrophobicContact CD1-CB 4.4Å; I227-L269 HydrophobicContact CD1-CD2 4Å; I227-L269 HydrophobicContact CD1-CG 3.87Å; I227-L269 HydrophobicContact CG1-CD2 4.05Å; I227-L269 HydrophobicContact CG1-CG 4.27Å; I227-L269 HydrophobicContact CG2-CD2 4.05Å; E265-L269 PolarHBondContact O-N 2.96Å; L266-L269 PolarHBondContact O-N 2.95Å; L269-A271 PolarHBondContact O-N 3.4Å; L269-Y272 HydrophobicContact CD1-CD1 4.5Å; L269-Y272 PolarHBondContact O-N 3.28Å; L269-L273 HydrophobicContact CD1-CD1 4.12Å; L269-L273 HydrophobicContact CD1-CG 4.12Å; L269-L273 HydrophobicContact CG-CD1 4.12Å; L269-L273 HydrophobicContact CG-CG 4.49Å; L269-L273 WeakPolarHBondContact O-CB 3.39Å; L269-L273 WeakPolarHBondContact O-CG 3.18Å; L269-L273 PolarHBondContact O-N 3.11Å; L269-I286 HydrophobicContact CD1-CG2 4.41Å; L269-I286 HydrophobicContact CD2-CG2 3.94Å; L269-F288 HydrophobicContact CD2-CB 3.99Å; L269-F288 HydrophobicContact CD2-CD2 3.85Å; L269-F288 HydrophobicContact CD2-CG 4.11Å
270	A	98.9	Very high	97.9	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-41.5	177.2	0	0	0	0	0	112.3	M64 L182 I227 L266 A267 S274	M64-A270 HydrophobicContact CG-CB 3.86Å; M64-A270 HydrophobicContact SD-CB 3.55Å; M64-A270 VanDerWaalsContact SD-CB 3.55Å; L182-A270 HydrophobicContact CD2-CB 3.57Å; I227-A270 HydrophobicContact CD1-CB 4.01Å; L266-A270 WeakPolarHBondContact O-CB 3.11Å; L266-A270 PolarHBondContact O-N 3.28Å; A267-A270 PolarHBondContact O-N 3.05Å; A270-S274 VanDerWaalsContact O-CB 3.25Å; A270-S274 WeakPolarHBondContact O-CB 3.34Å; A270-S274 PolarHBondContact O-N 3.35Å; A270-S274 PolarHBondContact O-OG 3Å
271	A	98.9	Very high	98.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-47.2	175	0	0	0	0	0	111.1	L41 F46 V67 L68 L71 A267 N268 L269 L273 S274 S275	L41-A271 HydrophobicContact CD1-CB 4.09Å; F46-A271 HydrophobicContact CE2-CB 4.12Å; F46-A271 VanDerWaalsContact CZ-O 3.27Å; F46-A271 WeakPolarHBondContact CZ-O 3.49Å; V67-A271 HydrophobicContact CG1-CB 4.12Å; L68-A271 HydrophobicContact CD2-CB 4.2Å; L71-A271 HydrophobicContact CD1-CB 4Å; A267-A271 WeakPolarHBondContact O-CB 3.31Å; A267-A271 PolarHBondContact O-N 3.17Å; N268-A271 PolarHBondContact O-N 2.96Å; L269-A271 PolarHBondContact O-N 3.4Å; A271-L273 PolarHBondContact O-N 2.95Å; A271-S274 CarbonylContact O-C 3.59Å; A271-S274 PolarHBondContact O-N 2.97Å; A271-S274 VanDerWaalsContact O-N 3.11Å; A271-S275 WeakPolarHBondContact O-CB 3.36Å; A271-S275 PolarHBondContact O-N 3.38Å
272	Y	98.9	Very high	98.2	Very high	80 Å²	80	46.3 Å²	46.3	31%	0.314	23%	0.228	S	C	.	.	H	α-helix	trans	-56	-53.5	174.7	168.7	-105	0	0	0	112.2	M40 N268 L269 S274 S275 F277 A278 M281	M40-Y272 HydrophobicContact CE-CD2 4.41Å; M40-Y272 HydrophobicContact CE-CG 4.31Å; N268-Y272 PolarHBondContact O-N 3.04Å; L269-Y272 HydrophobicContact CD1-CD1 4.5Å; L269-Y272 PolarHBondContact O-N 3.28Å; Y272-S274 PolarHBondContact O-N 3.44Å; Y272-S274 VanDerWaalsContact O-N 3.12Å; Y272-S275 PolarHBondContact O-N 3.38Å; Y272-S275 PolarHBondContact O-OG 2.88Å; Y272-F277 HydrophobicContact CD2-CB 4.35Å; Y272-F277 HydrophobicContact CE2-CB 4.07Å; Y272-A278 HydrophobicContact CE1-CB 4.42Å; Y272-A278 WeakPolarHBondContact O-CB 3.42Å; Y272-M281 HydrophobicContact CE1-SD 3.82Å
273	L	98.8	Very high	98.4	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-22.5	179.4	-69.5	177.5	0	0	0	112.5	L182 R223 I227 L269 A271 M281 I286	L182-L273 HydrophobicContact CD1-CB 4.32Å; L182-L273 HydrophobicContact CD1-CD1 4.02Å; R223-L273 VanDerWaalsContact CZ-O 3.23Å; R223-L273 PolarHBondContact NH1-O 2.92Å; R223-L273 PolarHBondContact NH2-O 3.23Å; I227-L273 HydrophobicContact CD1-CD1 3.93Å; I227-L273 HydrophobicContact CG1-CD1 3.61Å; L269-L273 HydrophobicContact CD1-CD1 4.12Å; L269-L273 HydrophobicContact CD1-CG 4.12Å; L269-L273 HydrophobicContact CG-CD1 4.12Å; L269-L273 HydrophobicContact CG-CG 4.49Å; L269-L273 WeakPolarHBondContact O-CB 3.39Å; L269-L273 WeakPolarHBondContact O-CG 3.18Å; L269-L273 PolarHBondContact O-N 3.11Å; A271-L273 PolarHBondContact O-N 2.95Å; L273-M281 HydrophobicContact CD2-CE 3.63Å; L273-M281 HydrophobicContact CD2-SD 3.9Å; L273-I286 HydrophobicContact CD1-CG1 4.14Å; L273-I286 HydrophobicContact CD2-CG1 4.41Å
274	S	98.8	Very high	98.5	Very high	6 Å²	6	43.6 Å²	43.6	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-94.7	-6.6	178	-54.9	0	0	0	0	114.2	R223 A270 A271 Y272	R223-S274 PolarHBondContact NH2-O 3.37Å; A270-S274 VanDerWaalsContact O-CB 3.25Å; A270-S274 WeakPolarHBondContact O-CB 3.34Å; A270-S274 PolarHBondContact O-N 3.35Å; A270-S274 PolarHBondContact O-OG 3Å; A271-S274 CarbonylContact O-C 3.59Å; A271-S274 PolarHBondContact O-N 2.97Å; A271-S274 VanDerWaalsContact O-N 3.11Å; Y272-S274 PolarHBondContact O-N 3.44Å; Y272-S274 VanDerWaalsContact O-N 3.12Å
275	S	98.7	Very high	98.6	Very high	5 Å²	5	45.2 Å²	45.2	4%	0.035	23%	0.233	C	C	.	.	S	Bend	trans	-87.9	170.3	-177.8	74.3	0	0	0	0	113.3	R223 A271 Y272 F277 A278	R223-S275 PolarHBondContact NH2-O 2.86Å; A271-S275 WeakPolarHBondContact O-CB 3.36Å; A271-S275 PolarHBondContact O-N 3.38Å; Y272-S275 PolarHBondContact O-N 3.38Å; Y272-S275 PolarHBondContact O-OG 2.88Å; S275-F277 PolarHBondContact O-N 3.26Å; S275-F277 PolarHBondContact OG-N 3.39Å; S275-A278 PolarHBondContact O-N 3.27Å
276	D	98.1	Very high	98.6	Very high	98 Å²	98	46.2 Å²	46.2	52%	0.524	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-69.8	-18.1	175.1	-65.3	-39.9	0	0	0	113.2	R49 A278 S279	R49-D276 IonicContact CZ-OD2 2.73Å; R49-D276 IonicContact NH2-OD1 3.19Å; R49-D276 PolarHBondContact NH2-OD1 3.46Å; R49-D276 IonicContact NH2-OD2 3.57Å; R49-D276 PolarHBondContact NH2-OD2 2.92Å; D276-A278 PolarHBondContact O-N 3.32Å; D276-S279 VanDerWaalsContact O-CB 3.28Å; D276-S279 WeakPolarHBondContact O-CB 2.83Å; D276-S279 PolarHBondContact O-N 3.32Å; D276-S279 VanDerWaalsContact O-N 3.17Å; D276-S279 PolarHBondContact O-OG 3.08Å
277	F	98.6	Very high	98.6	Very high	138 Å²	138	51 Å²	51	61%	0.605	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-63.8	-21	171.6	-62.7	-75.1	0	0	0	112.7	L41 Y272 S275	L41-F277 HydrophobicContact CD2-CD2 3.99Å; L41-F277 HydrophobicContact CD2-CE2 4.19Å; Y272-F277 HydrophobicContact CD2-CB 4.35Å; Y272-F277 HydrophobicContact CE2-CB 4.07Å; S275-F277 PolarHBondContact O-N 3.26Å; S275-F277 PolarHBondContact OG-N 3.39Å
278	A	98.4	Very high	98.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.008	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-108.1	23.1	177.7	0	0	0	0	0	112.5	Y272 S275 D276 W280 M281	Y272-A278 HydrophobicContact CE1-CB 4.42Å; Y272-A278 WeakPolarHBondContact O-CB 3.42Å; S275-A278 PolarHBondContact O-N 3.27Å; D276-A278 PolarHBondContact O-N 3.32Å; A278-W280 PolarHBondContact O-N 3.28Å; A278-W280 VanDerWaalsContact O-N 3.13Å; A278-M281 HydrophobicContact CB-CB 4.3Å; A278-M281 HydrophobicContact CB-CG 4.28Å; A278-M281 HydrophobicContact CB-SD 4.01Å; A278-M281 WeakPolarHBondContact O-CB 3.41Å; A278-M281 PolarHBondContact O-N 3.11Å
279	S	98	Very high	98.6	Very high	85 Å²	85	53.5 Å²	53.5	59%	0.594	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.9	-176.3	49.5	0	0	0	0	114.3	D276	D276-S279 VanDerWaalsContact O-CB 3.28Å; D276-S279 WeakPolarHBondContact O-CB 2.83Å; D276-S279 PolarHBondContact O-N 3.32Å; D276-S279 VanDerWaalsContact O-N 3.17Å; D276-S279 PolarHBondContact O-OG 3.08Å
280	W	98.5	Very high	98.5	Very high	251 Å²	251	53.3 Å²	53.3	95%	0.951	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-2.2	175.4	-156.1	57.1	0	0	0	114.3	A278	A278-W280 PolarHBondContact O-N 3.28Å; A278-W280 VanDerWaalsContact O-N 3.13Å
281	M	98.5	Very high	98.5	Very high	51 Å²	51	54.1 Å²	54.1	25%	0.251	28%	0.282	S	S	.	.			trans	-89.2	112.3	175.2	-61.5	-175.7	70.8	0	0	110	N225 Y272 L273 A278 A284 I286	N225-M281 PolarHBondContact ND2-O 3.42Å; N225-M281 PolarHBondContact OD1-O 2.73Å; Y272-M281 HydrophobicContact CE1-SD 3.82Å; L273-M281 HydrophobicContact CD2-CE 3.63Å; L273-M281 HydrophobicContact CD2-SD 3.9Å; A278-M281 HydrophobicContact CB-CB 4.3Å; A278-M281 HydrophobicContact CB-CG 4.28Å; A278-M281 HydrophobicContact CB-SD 4.01Å; A278-M281 WeakPolarHBondContact O-CB 3.41Å; A278-M281 PolarHBondContact O-N 3.11Å; M281-A284 HydrophobicContact CE-CB 4.22Å; M281-I286 HydrophobicContact CE-CD1 4.07Å
282	S	98.6	Very high	98.4	Very high	53 Å²	53	54.7 Å²	54.7	37%	0.371	29%	0.285	S	S	.	.			trans	-146.5	136.2	172.1	-164.9	0	0	0	0	110	A214 R223 F224 N225 A284	A214-S282 WeakPolarHBondContact CB-OG 3.49Å; R223-S282 WeakPolarHBondContact CA-OG 3.3Å; F224-S282 PolarHBondContact N-OG 3.41Å; N225-S282 WeakPolarHBondContact OD1-CA 3.41Å; S282-A284 VanDerWaalsContact C-N 3.35Å
283	G	98.5	Very high	98.3	Very high	25 Å²	25	53.3 Å²	53.3	26%	0.258	28%	0.279	S	S	.	.	S	Bend	trans	83.1	4	-173.4	0	0	0	0	0	114.5	F224	F224-G283 WeakPolarHBondContact O-CA 3.42Å; F224-G283 PolarHBondContact O-N 2.91Å
284	A	98.8	Very high	98.2	Very high	26 Å²	26	56.6 Å²	56.6	22%	0.215	30%	0.299	C	S	.	.			trans	-76.5	142.8	-174.6	0	0	0	0	0	112.4	N225 I226 M281 S282 I286	N225-A284 WeakPolarHBondContact OD1-CB 3.42Å; N225-A284 PolarHBondContact OD1-N 2.95Å; N225-A284 VanDerWaalsContact OD1-N 3.15Å; I226-A284 PolarHBondContact N-O 3.07Å; M281-A284 HydrophobicContact CE-CB 4.22Å; S282-A284 VanDerWaalsContact C-N 3.35Å; A284-I286 HydrophobicContact CB-CD1 4.42Å
285	V	98.8	Very high	98.1	Very high	51 Å²	51	56.8 Å²	56.8	31%	0.309	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.2	171.6	-173.4	0	0	0	0	108.1	I226 Q228	I226-V285 HydrophobicContact CB-CG1 4.4Å; I226-V285 HydrophobicContact CB-CG2 4.34Å; I226-V285 HydrophobicContact CD1-CG2 3.74Å; I226-V285 HydrophobicContact CG2-CG1 4.15Å; Q228-V285 HydrophobicContact CG-CG1 3.78Å
286	I	98.9	Very high	97.9	Very high	50 Å²	50	61.6 Å²	61.6	26%	0.256	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	114.9	-173.8	-51.6	-75.1	0	0	0	109.5	I226 I227 Q228 L269 L273 M281 A284	I226-I286 PolarHBondContact O-N 2.74Å; I227-I286 WeakPolarHBondContact CA-O 3.32Å; Q228-I286 PolarHBondContact N-O 2.67Å; L269-I286 HydrophobicContact CD1-CG2 4.41Å; L269-I286 HydrophobicContact CD2-CG2 3.94Å; L273-I286 HydrophobicContact CD1-CG1 4.14Å; L273-I286 HydrophobicContact CD2-CG1 4.41Å; M281-I286 HydrophobicContact CE-CD1 4.07Å; A284-I286 HydrophobicContact CB-CD1 4.42Å
287	R	98.8	Very high	97.7	Very high	100 Å²	100	60.3 Å²	60.3	38%	0.377	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	130.8	170.1	-76.7	-171.6	-72.4	112.8	-2.7	110.8	I187 Q228 D289	I187-R287 HydrophobicContact CG2-CG 4.43Å; Q228-R287 HydrophobicContact CB-CG 4.16Å; R287-D289 IonicContact NH1-OD2 2.68Å
288	F	98.6	Very high	97.6	Very high	50 Å²	50	55.1 Å²	55.1	22%	0.219	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	72.2	175.7	-173.4	-98.2	0	0	0	109.2	I227 Q228 P229 G230 I232 E265 L266 L269	I227-F288 HydrophobicContact CG2-CB 3.88Å; Q228-F288 PolarHBondContact O-N 2.96Å; P229-F288 CarbonylContact C-O 3.53Å; P229-F288 WeakPolarHBondContact CA-O 3.46Å; G230-F288 PolarHBondContact N-O 3.15Å; I232-F288 HydrophobicContact CD1-CD1 4.05Å; I232-F288 HydrophobicContact CD1-CE1 4.02Å; E265-F288 HydrophobicContact CB-CE1 4.34Å; E265-F288 HydrophobicContact CB-CE2 4.33Å; E265-F288 HydrophobicContact CB-CZ 3.53Å; L266-F288 HydrophobicContact CB-CD1 4.12Å; L266-F288 HydrophobicContact CB-CE1 3.92Å; L266-F288 HydrophobicContact CD1-CD1 4.22Å; L269-F288 HydrophobicContact CD2-CB 3.99Å; L269-F288 HydrophobicContact CD2-CD2 3.85Å; L269-F288 HydrophobicContact CD2-CG 4.11Å
289	D	97.8	Very high	97.5	Very high	16 Å²	16	62.1 Å²	62.1	9%	0.086	35%	0.345	C	S	.	.	S	Bend	trans	-135.2	7.3	-163.9	69.8	-14.3	0	0	0	114.1	I187 R287 G291 E292 Y293	I187-D289 HydrophobicContact CG2-CB 3.67Å; R287-D289 IonicContact NH1-OD2 2.68Å; D289-G291 PolarHBondContact O-N 3.11Å; D289-G291 VanDerWaalsContact O-N 3.14Å; D289-G291 WeakPolarHBondContact OD1-CA 3.37Å; D289-G291 PolarHBondContact OD1-N 3.39Å; D289-E292 HydrophobicContact CB-CB 4.2Å; D289-E292 VanDerWaalsContact O-CB 3.32Å; D289-E292 WeakPolarHBondContact O-CB 3.44Å; D289-E292 PolarHBondContact O-N 3.18Å; D289-E292 VanDerWaalsContact O-N 3.08Å; D289-E292 PolarHBondContact OD2-N 3.32Å; D289-Y293 WeakPolarHBondContact OD2-CB 3.41Å; D289-Y293 PolarHBondContact OD2-N 3.37Å
290	G	97.6	Very high	97.4	Very high	30 Å²	30	64.6 Å²	64.6	31%	0.309	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	19.9	-175.7	0	0	0	0	0	114	P256 T257	P256-G290 VanDerWaalsContact CD-O 3.27Å; P256-G290 WeakPolarHBondContact CD-O 3.18Å; T257-G290 WeakPolarHBondContact CG2-O 3.23Å; T257-G290 PolarHBondContact N-O 3.32Å; T257-G290 WeakPolarHBondContact OG1-CA 3.45Å
291	G	97.6	Very high	97.3	Very high	18 Å²	18	55.8 Å²	55.8	19%	0.186	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	8.2	-176.3	0	0	0	0	0	114.8	P256 D289 Y293 V294 S295	P256-G291 VanDerWaalsContact CD-C 3.42Å; P256-G291 WeakPolarHBondContact CD-O 3.46Å; P256-G291 WeakPolarHBondContact CG-O 3.45Å; D289-G291 PolarHBondContact O-N 3.11Å; D289-G291 VanDerWaalsContact O-N 3.14Å; D289-G291 WeakPolarHBondContact OD1-CA 3.37Å; D289-G291 PolarHBondContact OD1-N 3.39Å; G291-Y293 PolarHBondContact O-N 3.07Å; G291-V294 VanDerWaalsContact O-CG2 3.24Å; G291-V294 WeakPolarHBondContact O-CG2 3.33Å; G291-S295 VanDerWaalsContact O-CB 3.24Å; G291-S295 WeakPolarHBondContact O-CB 3.42Å; G291-S295 PolarHBondContact O-N 3.02Å
292	E	97.3	Very high	96.9	Very high	13 Å²	13	58.1 Å²	58.1	6%	0.061	33%	0.326	C	S	.	.	H	α-helix	trans	-55.7	-47.7	-177.4	-173.3	-177.1	-159.8	0	0	113.1	I187 P231 I255 D289 V294 S295 M296	I187-E292 HydrophobicContact CD1-CB 4.36Å; I187-E292 HydrophobicContact CD1-CG 4.23Å; I187-E292 WeakPolarHBondContact CD1-OE2 3.45Å; P231-E292 WeakPolarHBondContact CD-OE2 3.32Å; I255-E292 HydrophobicContact CG1-CB 4.14Å; I255-E292 HydrophobicContact CG1-CG 4.2Å; D289-E292 HydrophobicContact CB-CB 4.2Å; D289-E292 VanDerWaalsContact O-CB 3.32Å; D289-E292 WeakPolarHBondContact O-CB 3.44Å; D289-E292 PolarHBondContact O-N 3.18Å; D289-E292 VanDerWaalsContact O-N 3.08Å; D289-E292 PolarHBondContact OD2-N 3.32Å; E292-V294 PolarHBondContact O-N 3.24Å; E292-S295 WeakPolarHBondContact O-CB 3.28Å; E292-S295 PolarHBondContact O-N 3.38Å; E292-M296 HydrophobicContact CG-CG 4.48Å; E292-M296 HydrophobicContact CG-SD 4.03Å; E292-M296 WeakPolarHBondContact O-CG 3.46Å; E292-M296 PolarHBondContact O-N 3Å
293	Y	97.1	Very high	96.7	Very high	52 Å²	52	58.4 Å²	58.4	20%	0.204	32%	0.324	C	S	.	.	H	α-helix	trans	-58.1	-52.9	-176.3	177.6	-91.7	0	0	0	111.5	I187 D289 G291 S295 M296 A297	I187-Y293 HydrophobicContact CB-CD2 4.09Å; D289-Y293 WeakPolarHBondContact OD2-CB 3.41Å; D289-Y293 PolarHBondContact OD2-N 3.37Å; G291-Y293 PolarHBondContact O-N 3.07Å; Y293-S295 VanDerWaalsContact C-N 3.3Å; Y293-S295 PolarHBondContact O-N 3Å; Y293-M296 PolarHBondContact O-N 3.05Å; Y293-A297 HydrophobicContact CE1-CB 4.37Å; Y293-A297 VanDerWaalsContact O-CB 3.28Å; Y293-A297 WeakPolarHBondContact O-CB 3.38Å; Y293-A297 PolarHBondContact O-N 3.43Å
294	V	97.1	Very high	96.3	Very high	69 Å²	69	62.5 Å²	62.5	42%	0.418	33%	0.331	S	S	.	.	H	α-helix	trans	-68.3	-32.2	-179	-69.8	0	0	0	0	112	G291 E292 G298 N301	G291-V294 VanDerWaalsContact O-CG2 3.24Å; G291-V294 WeakPolarHBondContact O-CG2 3.33Å; E292-V294 PolarHBondContact O-N 3.24Å; V294-G298 PolarHBondContact O-N 3.09Å; V294-N301 PolarHBondContact O-ND2 3.23Å
295	S	95.8	Very high	95.9	Very high	10 Å²	10	67.5 Å²	67.5	7%	0.07	35%	0.348	C	S	.	.	H	α-helix	trans	-60.3	-45.8	173.2	179.3	0	0	0	0	111.1	R254 G291 E292 Y293 N301	R254-S295 WeakPolarHBondContact O-CB 3.4Å; R254-S295 PolarHBondContact O-OG 3.19Å; G291-S295 VanDerWaalsContact O-CB 3.24Å; G291-S295 WeakPolarHBondContact O-CB 3.42Å; G291-S295 PolarHBondContact O-N 3.02Å; E292-S295 WeakPolarHBondContact O-CB 3.28Å; E292-S295 PolarHBondContact O-N 3.38Å; Y293-S295 VanDerWaalsContact C-N 3.3Å; Y293-S295 PolarHBondContact O-N 3Å; S295-N301 VanDerWaalsContact O-CB 3.28Å; S295-N301 WeakPolarHBondContact O-CB 3.5Å; S295-N301 PolarHBondContact O-ND2 2.75Å
296	M	94.4	Very high	95.6	Very high	107 Å²	107	66.1 Å²	66.1	53%	0.527	34%	0.34	S	S	.	.	H	α-helix	trans	-77.8	-33.5	-179.4	-71.3	-174.7	48.6	0	0	114.2	R254 E292 Y293	R254-M296 HydrophobicContact CB-CG 4.43Å; R254-M296 HydrophobicContact CB-SD 4.48Å; E292-M296 HydrophobicContact CG-CG 4.48Å; E292-M296 HydrophobicContact CG-SD 4.03Å; E292-M296 WeakPolarHBondContact O-CG 3.46Å; E292-M296 PolarHBondContact O-N 3Å; Y293-M296 PolarHBondContact O-N 3.05Å
297	A	94.8	Very high	95.3	Very high	70 Å²	70	65.7 Å²	65.7	58%	0.579	34%	0.339	S	S	*	.	H	α-helix	trans	-77.8	-23	-175.5	0	0	0	0	0	113.7	Y293	Y293-A297 HydrophobicContact CE1-CB 4.37Å; Y293-A297 VanDerWaalsContact O-CB 3.28Å; Y293-A297 WeakPolarHBondContact O-CB 3.38Å; Y293-A297 PolarHBondContact O-N 3.43Å
298	G	95.9	Very high	95.1	Very high	29 Å²	29	64.2 Å²	64.2	30%	0.299	34%	0.343	S	S	.	.			trans	-78.1	124.5	-177.1	0	0	0	0	0	113.6	V294 F300 N301	V294-G298 PolarHBondContact O-N 3.09Å; G298-F300 VanDerWaalsContact C-N 3.3Å; G298-F300 PolarHBondContact O-N 3.42Å; G298-N301 WeakPolarHBondContact CA-ND2 3.41Å; G298-N301 WeakPolarHBondContact O-CB 3.49Å; G298-N301 PolarHBondContact O-N 2.87Å
299	E	96.9	Very high	94.9	Very high	149 Å²	149	66.5 Å²	66.5	70%	0.696	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-41	-176.1	-177.4	176.8	-164.4	0	0	113.8
300	F	96	Very high	94.8	Very high	137 Å²	137	67.8 Å²	67.8	60%	0.601	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	2.1	-174.5	-64.3	-84.9	0	0	0	113.9	G298 E302 L303	G298-F300 VanDerWaalsContact C-N 3.3Å; G298-F300 PolarHBondContact O-N 3.42Å; F300-E302 PolarHBondContact O-N 3.02Å; F300-E302 VanDerWaalsContact O-N 3.13Å; F300-L303 HydrophobicContact CB-CD1 4.19Å; F300-L303 HydrophobicContact CD1-CD1 4.2Å; F300-L303 VanDerWaalsContact O-CB 3.27Å; F300-L303 WeakPolarHBondContact O-CB 3.15Å; F300-L303 WeakPolarHBondContact O-CG 3.33Å; F300-L303 PolarHBondContact O-N 3.28Å
301	N	95.1	Very high	94.7	Very high	65 Å²	65	70.9 Å²	70.9	35%	0.348	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-68.9	-13.9	-173.7	-74.2	-13.2	0	0	0	114	V294 S295 G298 L303 R304	V294-N301 PolarHBondContact O-ND2 3.23Å; S295-N301 VanDerWaalsContact O-CB 3.28Å; S295-N301 WeakPolarHBondContact O-CB 3.5Å; S295-N301 PolarHBondContact O-ND2 2.75Å; G298-N301 WeakPolarHBondContact CA-ND2 3.41Å; G298-N301 WeakPolarHBondContact O-CB 3.49Å; G298-N301 PolarHBondContact O-N 2.87Å; N301-L303 PolarHBondContact O-N 3.15Å; N301-R304 WeakPolarHBondContact O-CB 3.25Å; N301-R304 WeakPolarHBondContact O-CD 3.33Å; N301-R304 WeakPolarHBondContact O-CG 3.16Å; N301-R304 PolarHBondContact O-N 3.49Å; N301-R304 PolarHBondContact O-NH1 2.89Å
302	E	91.6	Very high	94.5	Very high	100 Å²	100	76.2 Å²	76.2	47%	0.467	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-68.1	-18.5	171	-71	-60.3	120.5	0	0	112.7	F300 R304 K305	F300-E302 PolarHBondContact O-N 3.02Å; F300-E302 VanDerWaalsContact O-N 3.13Å; E302-R304 PolarHBondContact O-N 3.47Å; E302-R304 VanDerWaalsContact O-N 3.1Å; E302-R304 IonicContact OE1-CZ 2.76Å; E302-R304 IonicContact OE1-NH1 3.59Å; E302-R304 PolarHBondContact OE1-NH1 3.09Å; E302-R304 IonicContact OE1-NH2 3.72Å; E302-R304 PolarHBondContact OE1-NH2 3.31Å; E302-K305 PolarHBondContact O-N 2.67Å; E302-K305 VanDerWaalsContact O-N 3.15Å; E302-K305 WeakPolarHBondContact OE2-CE 3.4Å; E302-K305 IonicContact OE2-NZ 3.91Å; E302-K305 PolarHBondContact OE2-NZ 3.34Å
303	L	93.4	Very high	94.4	Very high	60 Å²	60	80.9 Å²	80.9	31%	0.314	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-64.4	-11	172.8	-62.7	177.2	0	0	0	113.1	F300 N301 K305 V306 W311	F300-L303 HydrophobicContact CB-CD1 4.19Å; F300-L303 HydrophobicContact CD1-CD1 4.2Å; F300-L303 VanDerWaalsContact O-CB 3.27Å; F300-L303 WeakPolarHBondContact O-CB 3.15Å; F300-L303 WeakPolarHBondContact O-CG 3.33Å; F300-L303 PolarHBondContact O-N 3.28Å; N301-L303 PolarHBondContact O-N 3.15Å; L303-K305 PolarHBondContact O-N 3.47Å; L303-V306 HydrophobicContact CB-CG2 4.33Å; L303-V306 HydrophobicContact CD2-CG2 3.85Å; L303-V306 VanDerWaalsContact O-CB 3.28Å; L303-V306 WeakPolarHBondContact O-CB 3.5Å; L303-V306 WeakPolarHBondContact O-CG2 3.45Å; L303-V306 PolarHBondContact O-N 3.46Å; L303-W311 HydrophobicContact CB-CH2 4.29Å; L303-W311 HydrophobicContact CB-CZ2 3.86Å; L303-W311 HydrophobicContact CD1-CH2 3.84Å; L303-W311 HydrophobicContact CD1-CZ2 4.28Å
304	R	90.3	Very high	94.2	Very high	111 Å²	111	81.1 Å²	81.1	42%	0.419	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-57.5	-19.1	169.3	77.6	-174.1	-178	-82.5	1.7	113.8	D253 N301 E302	D253-R304 PolarHBondContact O-NH2 3.02Å; N301-R304 WeakPolarHBondContact O-CB 3.25Å; N301-R304 WeakPolarHBondContact O-CD 3.33Å; N301-R304 WeakPolarHBondContact O-CG 3.16Å; N301-R304 PolarHBondContact O-N 3.49Å; N301-R304 PolarHBondContact O-NH1 2.89Å; E302-R304 PolarHBondContact O-N 3.47Å; E302-R304 VanDerWaalsContact O-N 3.1Å; E302-R304 IonicContact OE1-CZ 2.76Å; E302-R304 IonicContact OE1-NH1 3.59Å; E302-R304 PolarHBondContact OE1-NH1 3.09Å; E302-R304 IonicContact OE1-NH2 3.72Å; E302-R304 PolarHBondContact OE1-NH2 3.31Å
305	K	89.6	Confident	94	Very high	130 Å²	130	82.5 Å²	82.5	57%	0.565	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-84.6	-13.4	176.9	-65.9	172.5	178.6	164.4	0	113.1	E302 L303	E302-K305 PolarHBondContact O-N 2.67Å; E302-K305 VanDerWaalsContact O-N 3.15Å; E302-K305 WeakPolarHBondContact OE2-CE 3.4Å; E302-K305 IonicContact OE2-NZ 3.91Å; E302-K305 PolarHBondContact OE2-NZ 3.34Å; L303-K305 PolarHBondContact O-N 3.47Å
306	V	92.2	Very high	93.9	Very high	23 Å²	23	85 Å²	85	14%	0.139	43%	0.434	C	S	.	.			trans	-74.1	126.4	-179.4	-179.9	0	0	0	0	109	L303 Q310 W311 L314	L303-V306 HydrophobicContact CB-CG2 4.33Å; L303-V306 HydrophobicContact CD2-CG2 3.85Å; L303-V306 VanDerWaalsContact O-CB 3.28Å; L303-V306 WeakPolarHBondContact O-CB 3.5Å; L303-V306 WeakPolarHBondContact O-CG2 3.45Å; L303-V306 PolarHBondContact O-N 3.46Å; V306-Q310 HydrophobicContact CG1-CB 3.48Å; V306-Q310 VanDerWaalsContact CG1-CB 3.48Å; V306-W311 HydrophobicContact CG1-CD2 3.96Å; V306-W311 HydrophobicContact CG1-CG 3.78Å; V306-L314 HydrophobicContact CG1-CD1 3.93Å
307	T	94	Very high	93.8	Very high	40 Å²	40	85.2 Å²	85.2	25%	0.245	44%	0.436	C	S	.	.			trans	-75.2	159.9	179.4	70.9	0	0	0	0	111.3	D309 Q310 W311	T307-D309 PolarHBondContact O-N 2.98Å; T307-Q310 PolarHBondContact O-N 3.09Å; T307-Q310 VanDerWaalsContact O-N 3.11Å; T307-Q310 WeakPolarHBondContact OG1-CG 3.32Å; T307-Q310 PolarHBondContact OG1-N 2.78Å; T307-Q310 PolarHBondContact OG1-OE1 3.09Å; T307-W311 PolarHBondContact O-N 3.18Å
308	P	94.4	Very high	93.5	Very high	69 Å²	69	87.5 Å²	87.5	45%	0.448	44%	0.437	S	S	.	.	H	α-helix	trans	-54.1	-35.7	176.8	-28.8	36.6	0	0	0	114.2	W311 K312	P308-W311 WeakPolarHBondContact O-CB 3.39Å; P308-W311 PolarHBondContact O-N 2.92Å; P308-K312 WeakPolarHBondContact O-CG 3.49Å; P308-K312 PolarHBondContact O-N 3.07Å; P308-K312 VanDerWaalsContact O-N 3.11Å
309	D	95	Very high	93.1	Very high	98 Å²	98	94.2 Å²	94.2	52%	0.524	46%	0.458	S	S	.	.	H	α-helix	trans	-75.8	-36.4	178.4	-62.8	-37.4	0	0	0	112.3	T307 W311 K312 M313	T307-D309 PolarHBondContact O-N 2.98Å; D309-W311 VanDerWaalsContact C-N 3.25Å; D309-W311 PolarHBondContact O-N 2.7Å; D309-K312 PolarHBondContact O-N 3.41Å; D309-K312 IonicContact OD1-NZ 3.61Å; D309-K312 PolarHBondContact OD1-NZ 3.43Å; D309-M313 WeakPolarHBondContact O-CG 3.31Å; D309-M313 PolarHBondContact O-N 3.19Å; D309-M313 VanDerWaalsContact O-N 3.08Å
310	Q	94.1	Very high	92.4	Very high	43 Å²	43	90 Å²	90	20%	0.201	45%	0.454	C	S	.	.	H	α-helix	trans	-62.5	-36.3	170.6	-70.9	172.9	-38.5	0	0	111.3	F17 V306 T307 M313 L314	F17-Q310 HydrophobicContact CE1-CG 4.35Å; V306-Q310 HydrophobicContact CG1-CB 3.48Å; V306-Q310 VanDerWaalsContact CG1-CB 3.48Å; T307-Q310 PolarHBondContact O-N 3.09Å; T307-Q310 VanDerWaalsContact O-N 3.11Å; T307-Q310 WeakPolarHBondContact OG1-CG 3.32Å; T307-Q310 PolarHBondContact OG1-N 2.78Å; T307-Q310 PolarHBondContact OG1-OE1 3.09Å; Q310-M313 PolarHBondContact O-N 2.77Å; Q310-L314 WeakPolarHBondContact O-CG 3.36Å; Q310-L314 PolarHBondContact O-N 3.08Å
311	W	95.9	Very high	91.8	Very high	95 Å²	95	87.6 Å²	87.6	36%	0.36	45%	0.451	S	S	.	.	H	α-helix	trans	-61.1	-48.3	172.8	-86.6	116.2	0	0	0	112.4	L303 V306 T307 P308 D309 M313 L314 E315	L303-W311 HydrophobicContact CB-CH2 4.29Å; L303-W311 HydrophobicContact CB-CZ2 3.86Å; L303-W311 HydrophobicContact CD1-CH2 3.84Å; L303-W311 HydrophobicContact CD1-CZ2 4.28Å; V306-W311 HydrophobicContact CG1-CD2 3.96Å; V306-W311 HydrophobicContact CG1-CG 3.78Å; T307-W311 PolarHBondContact O-N 3.18Å; P308-W311 WeakPolarHBondContact O-CB 3.39Å; P308-W311 PolarHBondContact O-N 2.92Å; D309-W311 VanDerWaalsContact C-N 3.25Å; D309-W311 PolarHBondContact O-N 2.7Å; W311-M313 PolarHBondContact O-N 3.14Å; W311-L314 HydrophobicContact CE3-CD1 4.17Å; W311-L314 HydrophobicContact CZ3-CD1 4.42Å; W311-L314 PolarHBondContact O-N 3.13Å; W311-L314 VanDerWaalsContact O-N 3.11Å; W311-E315 WeakPolarHBondContact O-CG 3.46Å; W311-E315 PolarHBondContact O-N 3.22Å
312	K	94.4	Very high	90.3	Very high	131 Å²	131	94.5 Å²	94.5	57%	0.57	48%	0.477	S	S	*	.	H	α-helix	trans	-55.5	-41.5	175.1	-67.7	170.7	-168.9	158.8	0	112.1	P308 D309 A316	P308-K312 WeakPolarHBondContact O-CG 3.49Å; P308-K312 PolarHBondContact O-N 3.07Å; P308-K312 VanDerWaalsContact O-N 3.11Å; D309-K312 PolarHBondContact O-N 3.41Å; D309-K312 IonicContact OD1-NZ 3.61Å; D309-K312 PolarHBondContact OD1-NZ 3.43Å; K312-A316 WeakPolarHBondContact O-CB 3.48Å; K312-A316 PolarHBondContact O-N 3.15Å
313	M	93.9	Very high	88.9	Confident	110 Å²	110	92.7 Å²	92.7	54%	0.542	49%	0.486	S	S	.	.	H	α-helix	trans	-64.7	-45.3	176.9	-67.5	175.1	68.5	0	0	111.9	D309 Q310 W311 A316 M317	D309-M313 WeakPolarHBondContact O-CG 3.31Å; D309-M313 PolarHBondContact O-N 3.19Å; D309-M313 VanDerWaalsContact O-N 3.08Å; Q310-M313 PolarHBondContact O-N 2.77Å; W311-M313 PolarHBondContact O-N 3.14Å; M313-A316 PolarHBondContact O-N 3.48Å; M313-M317 HydrophobicContact CB-CE 4.49Å; M313-M317 WeakPolarHBondContact O-CE 3.13Å; M313-M317 WeakPolarHBondContact O-CG 3.39Å; M313-M317 PolarHBondContact O-N 3.22Å
314	L	92.5	Very high	86.8	Confident	57 Å²	57	98.1 Å²	98.1	30%	0.298	53%	0.529	S	S	.	.	H	α-helix	trans	-60	-46.6	176.6	-71.6	168.8	0	0	0	111.2	V306 Q310 W311 A316 M317 I318	V306-L314 HydrophobicContact CG1-CD1 3.93Å; Q310-L314 WeakPolarHBondContact O-CG 3.36Å; Q310-L314 PolarHBondContact O-N 3.08Å; W311-L314 HydrophobicContact CE3-CD1 4.17Å; W311-L314 HydrophobicContact CZ3-CD1 4.42Å; W311-L314 PolarHBondContact O-N 3.13Å; W311-L314 VanDerWaalsContact O-N 3.11Å; L314-A316 PolarHBondContact O-N 3.09Å; L314-M317 HydrophobicContact CD2-CE 3.98Å; L314-M317 PolarHBondContact O-N 2.88Å; L314-I318 WeakPolarHBondContact O-CD1 3.4Å; L314-I318 VanDerWaalsContact O-CG1 3.23Å; L314-I318 WeakPolarHBondContact O-CG1 3.36Å; L314-I318 PolarHBondContact O-N 3.16Å
315	E	94.3	Very high	86.6	Confident	98 Å²	98	97.5 Å²	97.5	46%	0.458	54%	0.535	S	S	.	.	H	α-helix	trans	-60.6	-42.5	177.9	-72.2	176	-170.4	0	0	112.5	W311 I318 K319	W311-E315 WeakPolarHBondContact O-CG 3.46Å; W311-E315 PolarHBondContact O-N 3.22Å; E315-I318 PolarHBondContact O-N 3.14Å; E315-K319 WeakPolarHBondContact O-CB 3.47Å; E315-K319 WeakPolarHBondContact O-CG 3.1Å; E315-K319 PolarHBondContact O-N 3.29Å
316	A	92.9	Very high	86.4	Confident	63 Å²	63	95.8 Å²	95.8	52%	0.521	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-42.4	177.3	0	0	0	0	0	112	K312 M313 L314 K319 G320	K312-A316 WeakPolarHBondContact O-CB 3.48Å; K312-A316 PolarHBondContact O-N 3.15Å; M313-A316 PolarHBondContact O-N 3.48Å; L314-A316 PolarHBondContact O-N 3.09Å; A316-K319 PolarHBondContact O-N 3.15Å; A316-G320 PolarHBondContact O-N 3.08Å
317	M	91.8	Very high	86.1	Confident	112 Å²	112	99.8 Å²	99.8	55%	0.552	56%	0.555	S	S	*	*	H	α-helix	trans	-63.2	-42.5	175.5	-72.9	-174	-75	0	0	111.9	M313 L314 G320 T321	M313-M317 HydrophobicContact CB-CE 4.49Å; M313-M317 WeakPolarHBondContact O-CE 3.13Å; M313-M317 WeakPolarHBondContact O-CG 3.39Å; M313-M317 PolarHBondContact O-N 3.22Å; L314-M317 HydrophobicContact CD2-CE 3.98Å; L314-M317 PolarHBondContact O-N 2.88Å; M317-G320 PolarHBondContact O-N 3.4Å; M317-T321 PolarHBondContact O-N 3.4Å; M317-T321 PolarHBondContact O-OG1 2.82Å
318	I	90	Very high	85.6	Confident	118 Å²	118	103.4 Å²	103.4	61%	0.605	57%	0.573	S	S	*	*	H	α-helix	trans	-62.3	-49	177.1	-67.1	162.4	0	0	0	110.3	L314 E315 G320 T321	L314-I318 WeakPolarHBondContact O-CD1 3.4Å; L314-I318 VanDerWaalsContact O-CG1 3.23Å; L314-I318 WeakPolarHBondContact O-CG1 3.36Å; L314-I318 PolarHBondContact O-N 3.16Å; E315-I318 PolarHBondContact O-N 3.14Å; I318-G320 VanDerWaalsContact C-N 3.27Å; I318-G320 PolarHBondContact O-N 3.06Å; I318-T321 WeakPolarHBondContact O-CB 3.48Å; I318-T321 PolarHBondContact O-N 3.01Å; I318-T321 VanDerWaalsContact O-N 3.1Å
319	K	86.8	Confident	85.1	Confident	170 Å²	170	105.5 Å²	105.5	74%	0.739	58%	0.581	S	S	*	*	H	α-helix	trans	-62	-32.1	177.7	-72.5	174.9	-177.4	173.8	0	113.3	E315 A316 T321	E315-K319 WeakPolarHBondContact O-CB 3.47Å; E315-K319 WeakPolarHBondContact O-CG 3.1Å; E315-K319 PolarHBondContact O-N 3.29Å; A316-K319 PolarHBondContact O-N 3.15Å; K319-T321 VanDerWaalsContact C-N 3.31Å
320	G	82.8	Confident	84.4	Confident	60 Å²	60	106 Å²	106	62%	0.619	59%	0.585	S	S	*	*	H	α-helix	trans	-77.5	-13.1	177	0	0	0	0	0	114.4	A316 M317 I318 K322	A316-G320 PolarHBondContact O-N 3.08Å; M317-G320 PolarHBondContact O-N 3.4Å; I318-G320 VanDerWaalsContact C-N 3.27Å; I318-G320 PolarHBondContact O-N 3.06Å; G320-K322 PolarHBondContact O-N 2.72Å; G320-K322 VanDerWaalsContact O-N 3.12Å
321	T	83.6	Confident	83.7	Confident	86 Å²	86	110.5 Å²	110.5	53%	0.528	61%	0.612	S	S	.	*			trans	-80.1	93.4	177.8	-51.4	0	0	0	0	108.9	M317 I318 K319 G323	M317-T321 PolarHBondContact O-N 3.4Å; M317-T321 PolarHBondContact O-OG1 2.82Å; I318-T321 WeakPolarHBondContact O-CB 3.48Å; I318-T321 PolarHBondContact O-N 3.01Å; I318-T321 VanDerWaalsContact O-N 3.1Å; K319-T321 VanDerWaalsContact C-N 3.31Å; T321-G323 PolarHBondContact O-N 3.41Å
322	K	61.8	Low	82.8	Confident	210 Å²	210	111.7 Å²	111.7	91%	0.913	63%	0.632	S	S	*	*			trans	-72	123.6	171.7	-75.3	-172.3	177.6	-177.7	0	109.9	G320	G320-K322 PolarHBondContact O-N 2.72Å; G320-K322 VanDerWaalsContact O-N 3.12Å
323	G	62.7	Low	81.8	Confident	63 Å²	63	110.1 Å²	110.1	65%	0.649	64%	0.637	S	S	*	*			trans	110.6	90.6	169.2	0	0	0	0	0	114	T321	T321-G323 PolarHBondContact O-N 3.41Å
324	S	48.7	Very low	80.7	Confident	174 Å²	174	110.1 Å²	110.1	100%	1.217	65%	0.645	S	S	*	*			trans	-122.8	0	148.3	61.6	0	0	0	0	107.5

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