A0A096NP77_PAPAN Loading...

Mothers against decapentaplegic homolog

AlphaFold DB (Q15796), UniProt , Accession A0A096NP77, Species PAPAN (Papio anubis, Olive baboon), Gene SMAD2, Length 467 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	40.7	Very low	62.8	Low	243 Å²	243	110.9 Å²	110.9	100%	1.197	62%	0.624	S	S	*	*				0	92.7	0	-71	178	178.1	0	0	107.8	S3	M1-S3 PolarHBondContact O-N 3.32Å
2	S	40.1	Very low	65.1	Low	119 Å²	119	101.8 Å²	101.8	83%	0.832	57%	0.573	S	S	*	*			trans	-73.2	108	-178.7	-52	0	0	0	0	109	I4	S2-I4 PolarHBondContact O-N 2.86Å; S2-I4 VanDerWaalsContact O-N 3.1Å
3	S	42	Very low	67	Low	104 Å²	104	104.6 Å²	104.6	73%	0.727	58%	0.575	S	S	*	*			trans	-60.5	108.5	172.5	48.1	0	0	0	0	109.5	M1 L5	M1-S3 PolarHBondContact O-N 3.32Å; S3-L5 PolarHBondContact O-N 3.42Å
4	I	49.1	Very low	68.7	Low	163 Å²	163	105.6 Å²	105.6	84%	0.836	57%	0.566	S	S	*	*			trans	-62.2	106.9	171.6	-63.4	170.2	0	0	0	107.1	S2	S2-I4 PolarHBondContact O-N 2.86Å; S2-I4 VanDerWaalsContact O-N 3.1Å
5	L	54.4	Low	70.3	Confident	150 Å²	150	98.6 Å²	98.6	79%	0.785	53%	0.528	S	S	*	.			trans	-57.6	131.5	172.2	-69.7	170.5	0	0	0	108.5	S3 F7	S3-L5 PolarHBondContact O-N 3.42Å; L5-F7 PolarHBondContact O-N 2.83Å; L5-F7 VanDerWaalsContact O-N 3.15Å
6	P	61	Low	71.6	Confident	107 Å²	107	95.2 Å²	95.2	70%	0.695	51%	0.509	S	S	*	.			trans	-60.7	121.6	-177	22.4	-31.4	0	0	0	110.3	T8	P6-T8 PolarHBondContact O-N 2.98Å; P6-T8 VanDerWaalsContact O-N 3.07Å
7	F	70.1	Confident	72.7	Confident	175 Å²	175	93.4 Å²	93.4	77%	0.768	52%	0.519	S	S	*	.			trans	-66.7	107.3	179.2	-177.3	-97.4	0	0	0	110.4	L5 P9	L5-F7 PolarHBondContact O-N 2.83Å; L5-F7 VanDerWaalsContact O-N 3.15Å; F7-P9 WeakPolarHBondContact O-CD 3.35Å
8	T	74.7	Confident	73.8	Confident	18 Å²	18	93.1 Å²	93.1	11%	0.11	51%	0.509	C	S	.	.			trans	-85.7	118.9	172.1	-63.4	0	0	0	0	109.5	P6 V12 K13 E42 K46	P6-T8 PolarHBondContact O-N 2.98Å; P6-T8 VanDerWaalsContact O-N 3.07Å; T8-V12 HydrophobicContact CG2-CB 3.78Å; T8-V12 HydrophobicContact CG2-CG1 3.56Å; T8-K13 HydrophobicContact CG2-CG 3.87Å; T8-E42 WeakPolarHBondContact CG2-OE1 3.11Å; T8-E42 PolarHBondContact OG1-OE1 3.4Å; T8-K46 PolarHBondContact OG1-NZ 2.65Å; T8-K46 VanDerWaalsContact OG1-NZ 3.15Å
9	P	81.4	Confident	74.7	Confident	41 Å²	41	90.7 Å²	90.7	27%	0.266	49%	0.493	S	S	.	.			trans	-54.1	142.2	-177.7	-26.3	33.7	0	0	0	112.2	F7 V11 V12 K13	F7-P9 WeakPolarHBondContact O-CD 3.35Å; P9-V11 HydrophobicContact CB-CG1 4.13Å; P9-V11 PolarHBondContact O-N 3.22Å; P9-V11 VanDerWaalsContact O-N 3.14Å; P9-V12 HydrophobicContact CB-CG2 4.13Å; P9-V12 HydrophobicContact CG-CG2 4.19Å; P9-V12 WeakPolarHBondContact O-CB 3.49Å; P9-V12 PolarHBondContact O-N 3.26Å; P9-K13 PolarHBondContact O-N 3.26Å
10	P	88	Confident	75.5	Confident	86 Å²	86	91.1 Å²	91.1	56%	0.558	49%	0.489	S	S	*	.	H	α-helix	trans	-53.6	-38.1	-177.6	-28.7	34.8	0	0	0	114.1	V12 K13 R14	P10-V12 VanDerWaalsContact C-N 3.34Å; P10-V12 PolarHBondContact O-N 3.45Å; P10-K13 PolarHBondContact O-N 3.06Å; P10-R14 PolarHBondContact O-N 2.98Å
11	V	89.2	Confident	75.5	Confident	14 Å²	14	91.4 Å²	91.4	9%	0.085	50%	0.499	C	S	.	.	H	α-helix	trans	-61.1	-38.9	174.7	55.7	0	0	0	0	113.2	P9 K13 R14 L15 V49 L58 E62	P9-V11 HydrophobicContact CB-CG1 4.13Å; P9-V11 PolarHBondContact O-N 3.22Å; P9-V11 VanDerWaalsContact O-N 3.14Å; V11-K13 VanDerWaalsContact C-N 3.34Å; V11-R14 PolarHBondContact O-N 3.06Å; V11-L15 HydrophobicContact CG2-CD1 3.99Å; V11-L15 HydrophobicContact CG2-CG 4.36Å; V11-L15 WeakPolarHBondContact O-CB 3.43Å; V11-L15 WeakPolarHBondContact O-CG 3.12Å; V11-L15 PolarHBondContact O-N 2.99Å; V11-V49 HydrophobicContact CG1-CG1 3.8Å; V11-V49 HydrophobicContact CG2-CG2 4.31Å; V11-L58 HydrophobicContact CG2-CD1 4.04Å; V11-L58 HydrophobicContact CG2-CD2 4.08Å; V11-L58 HydrophobicContact CG2-CG 4.36Å; V11-E62 WeakPolarHBondContact CG2-OE1 3.43Å
12	V	90.2	Very high	76.7	Confident	2 Å²	2	83.7 Å²	83.7	1%	0.012	47%	0.473	C	S	.	.	H	α-helix	trans	-66.6	-41.5	178	173.7	0	0	0	0	109.7	T8 P9 P10 R14 L15 L16 V45 K46 V49	T8-V12 HydrophobicContact CG2-CB 3.78Å; T8-V12 HydrophobicContact CG2-CG1 3.56Å; P9-V12 HydrophobicContact CB-CG2 4.13Å; P9-V12 HydrophobicContact CG-CG2 4.19Å; P9-V12 WeakPolarHBondContact O-CB 3.49Å; P9-V12 PolarHBondContact O-N 3.26Å; P10-V12 VanDerWaalsContact C-N 3.34Å; P10-V12 PolarHBondContact O-N 3.45Å; V12-R14 PolarHBondContact O-N 3.14Å; V12-L15 PolarHBondContact O-N 3.44Å; V12-L16 HydrophobicContact CG1-CD1 3.77Å; V12-L16 HydrophobicContact CG1-CG 4.34Å; V12-L16 WeakPolarHBondContact O-CB 3.31Å; V12-L16 VanDerWaalsContact O-CG 3.27Å; V12-L16 WeakPolarHBondContact O-CG 3.25Å; V12-L16 PolarHBondContact O-N 3Å; V12-V45 HydrophobicContact CB-CG1 4.45Å; V12-V45 HydrophobicContact CG1-CB 4.44Å; V12-V45 HydrophobicContact CG1-CG1 4Å; V12-K46 HydrophobicContact CB-CG 4.49Å; V12-K46 HydrophobicContact CG1-CG 3.8Å; V12-K46 HydrophobicContact CG2-CG 3.96Å; V12-V49 HydrophobicContact CG2-CB 4.29Å; V12-V49 HydrophobicContact CG2-CG1 4.46Å; V12-V49 HydrophobicContact CG2-CG2 4Å
13	K	90.1	Very high	77.1	Confident	138 Å²	138	82.2 Å²	82.2	60%	0.6	48%	0.477	S	S	*	.	H	α-helix	trans	-60.7	-44	175	-65	-169.8	-179.5	-177.3	0	111.7	T8 P9 P10 V11 L16 G17	T8-K13 HydrophobicContact CG2-CG 3.87Å; P9-K13 PolarHBondContact O-N 3.26Å; P10-K13 PolarHBondContact O-N 3.06Å; V11-K13 VanDerWaalsContact C-N 3.34Å; K13-L16 PolarHBondContact O-N 2.95Å; K13-G17 PolarHBondContact O-N 3.39Å
14	R	91.1	Very high	77	Confident	119 Å²	119	80.6 Å²	80.6	45%	0.449	48%	0.477	S	S	.	.	H	α-helix	trans	-60.3	-50.3	175.8	-71.1	-171.2	-66.2	145.3	4.8	111.8	P10 V11 V12 L16 G17 W18 E62	P10-R14 PolarHBondContact O-N 2.98Å; V11-R14 PolarHBondContact O-N 3.06Å; V12-R14 PolarHBondContact O-N 3.14Å; R14-L16 VanDerWaalsContact C-N 3.33Å; R14-L16 PolarHBondContact O-N 2.93Å; R14-G17 WeakPolarHBondContact O-CA 3.37Å; R14-G17 PolarHBondContact O-N 3.32Å; R14-W18 HydrophobicContact CB-CH2 4Å; R14-W18 HydrophobicContact CB-CZ3 3.97Å; R14-W18 PolarHBondContact O-N 2.92Å; R14-E62 IonicContact CZ-OE1 3.42Å; R14-E62 IonicContact CZ-OE2 3.2Å; R14-E62 IonicContact NH1-OE1 3.79Å; R14-E62 IonicContact NH1-OE2 2.76Å; R14-E62 PolarHBondContact NH1-OE2 3.35Å; R14-E62 IonicContact NH2-OE1 2.68Å; R14-E62 PolarHBondContact NH2-OE1 3.48Å; R14-E62 IonicContact NH2-OE2 2.92Å; R14-E62 PolarHBondContact NH2-OE2 3.43Å
15	L	92.5	Very high	76.2	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	48%	0.479	C	S	.	.	H	α-helix	trans	-61.7	-37.1	179.3	-74	173.2	0	0	0	113.7	V11 V12 G17 W18 V45 V49 L58 L61 E62 I65 W132	V11-L15 HydrophobicContact CG2-CD1 3.99Å; V11-L15 HydrophobicContact CG2-CG 4.36Å; V11-L15 WeakPolarHBondContact O-CB 3.43Å; V11-L15 WeakPolarHBondContact O-CG 3.12Å; V11-L15 PolarHBondContact O-N 2.99Å; V12-L15 PolarHBondContact O-N 3.44Å; L15-G17 VanDerWaalsContact C-N 3.32Å; L15-W18 HydrophobicContact CD2-CE3 4.06Å; L15-W18 HydrophobicContact CD2-CZ3 3.95Å; L15-W18 HydrophobicContact CG-CZ3 4.42Å; L15-W18 PolarHBondContact O-N 2.68Å; L15-V45 HydrophobicContact CB-CG1 3.63Å; L15-V45 HydrophobicContact CD1-CG1 3.91Å; L15-V45 HydrophobicContact CG-CG1 4.45Å; L15-V49 HydrophobicContact CD1-CG2 3.49Å; L15-V49 VanDerWaalsContact CD1-CG2 3.49Å; L15-L58 HydrophobicContact CD1-CD1 4.42Å; L15-L61 HydrophobicContact CD1-CD2 4.39Å; L15-L61 HydrophobicContact CD2-CD2 4.23Å; L15-L61 HydrophobicContact CD2-CG 4.47Å; L15-E62 HydrophobicContact CD2-CG 4.44Å; L15-I65 HydrophobicContact CD2-CD1 3.56Å; L15-W132 HydrophobicContact CB-CZ2 4.26Å; L15-W132 HydrophobicContact CD2-CZ2 4.21Å; L15-W132 PolarHBondContact O-NE1 3.37Å
16	L	91.6	Very high	74.9	Confident	44 Å²	44	75.8 Å²	75.8	23%	0.23	48%	0.484	C	S	.	.	H	α-helix	trans	-70.2	-29	172.9	-71.4	168.7	0	0	0	112.3	V12 K13 R14 W18 K19 C41 E42 V45	V12-L16 HydrophobicContact CG1-CD1 3.77Å; V12-L16 HydrophobicContact CG1-CG 4.34Å; V12-L16 WeakPolarHBondContact O-CB 3.31Å; V12-L16 VanDerWaalsContact O-CG 3.27Å; V12-L16 WeakPolarHBondContact O-CG 3.25Å; V12-L16 PolarHBondContact O-N 3Å; K13-L16 PolarHBondContact O-N 2.95Å; R14-L16 VanDerWaalsContact C-N 3.33Å; R14-L16 PolarHBondContact O-N 2.93Å; L16-W18 PolarHBondContact O-N 2.76Å; L16-K19 WeakPolarHBondContact O-CB 3.2Å; L16-K19 PolarHBondContact O-N 2.72Å; L16-C41 HydrophobicContact CD2-CB 4.18Å; L16-E42 HydrophobicContact CD1-CB 4.03Å; L16-E42 HydrophobicContact CD1-CG 3.95Å; L16-V45 HydrophobicContact CD2-CB 4.19Å; L16-V45 HydrophobicContact CD2-CG2 3.72Å; L16-V45 HydrophobicContact CG-CB 4.38Å; L16-V45 HydrophobicContact CG-CG1 4.46Å; L16-V45 HydrophobicContact CG-CG2 4.27Å
17	G	90.6	Very high	73.6	Confident	65 Å²	65	74 Å²	74	67%	0.67	48%	0.484	S	S	*	.	H	α-helix	trans	-65.4	-23.1	175.3	0	0	0	0	0	114.3	K13 R14 L15	K13-G17 PolarHBondContact O-N 3.39Å; R14-G17 WeakPolarHBondContact O-CA 3.37Å; R14-G17 PolarHBondContact O-N 3.32Å; L15-G17 VanDerWaalsContact C-N 3.32Å
18	W	91.4	Very high	71.9	Confident	88 Å²	88	71.5 Å²	71.5	33%	0.333	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	3.5	172	-62.2	-61.4	0	0	0	113.7	R14 L15 L16 K20 I65	R14-W18 HydrophobicContact CB-CH2 4Å; R14-W18 HydrophobicContact CB-CZ3 3.97Å; R14-W18 PolarHBondContact O-N 2.92Å; L15-W18 HydrophobicContact CD2-CE3 4.06Å; L15-W18 HydrophobicContact CD2-CZ3 3.95Å; L15-W18 HydrophobicContact CG-CZ3 4.42Å; L15-W18 PolarHBondContact O-N 2.68Å; L16-W18 PolarHBondContact O-N 2.76Å; W18-K20 PolarHBondContact O-N 3.24Å; W18-I65 HydrophobicContact CB-CG2 3.58Å; W18-I65 HydrophobicContact CD2-CG2 3.66Å; W18-I65 HydrophobicContact CE3-CB 4.46Å; W18-I65 HydrophobicContact CE3-CG2 3.71Å; W18-I65 HydrophobicContact CG-CG2 3.6Å
19	K	91.7	Very high	70.2	Confident	47 Å²	47	74.4 Å²	74.4	20%	0.204	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-59.8	132.4	176.7	-169.9	-173.4	88.9	156.2	0	109.5	L16 C41 L131	L16-K19 WeakPolarHBondContact O-CB 3.2Å; L16-K19 PolarHBondContact O-N 2.72Å; K19-C41 HydrophobicContact CD-CB 4.16Å; K19-L131 WeakPolarHBondContact CA-O 3.32Å; K19-L131 HydrophobicContact CB-CD2 3.94Å; K19-L131 HydrophobicContact CD-CG 4.37Å; K19-L131 HydrophobicContact CG-CD2 3.8Å; K19-L131 HydrophobicContact CG-CG 3.95Å; K19-L131 WeakPolarHBondContact CG-O 3.34Å
20	K	89.4	Confident	68.3	Low	98 Å²	98	74.2 Å²	74.2	43%	0.426	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-78.8	138	170.6	-63.2	-65.7	-174.2	178.3	0	109.3	W18 L131 W132 P135	W18-K20 PolarHBondContact O-N 3.24Å; K20-L131 PolarHBondContact N-O 2.88Å; K20-W132 VanDerWaalsContact CG-O 3.31Å; K20-W132 WeakPolarHBondContact CG-O 3.33Å; K20-P135 HydrophobicContact CB-CG 3.5Å; K20-P135 WeakPolarHBondContact O-CG 3.35Å
21	S	76.7	Confident	66.1	Low	99 Å²	99	73.2 Å²	73.2	69%	0.692	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-91.9	139.3	175.9	-62	0	0	0	0	109.7	G23	S21-G23 PolarHBondContact O-N 3.41Å
22	A	64.9	Low	64.3	Low	80 Å²	80	81.2 Å²	81.2	66%	0.661	58%	0.577	S	S	*	*			trans	-66.6	104.6	169.2	0	0	0	0	0	108	G24 P135	A22-G24 PolarHBondContact O-N 2.92Å; A22-P135 HydrophobicContact CB-CB 3.99Å
23	G	48.7	Very low	62.7	Low	88 Å²	88	88.7 Å²	88.7	91%	0.907	61%	0.612	S	S	*	*			trans	-75.4	107.5	-175.5	0	0	0	0	0	111.8	S21	S21-G23 PolarHBondContact O-N 3.41Å
24	G	39.3	Very low	61.6	Low	70 Å²	70	86.2 Å²	86.2	72%	0.722	61%	0.605	S	S	*	*			trans	-145.3	113.5	161.9	0	0	0	0	0	108	A22	A22-G24 PolarHBondContact O-N 2.92Å
25	S	33.1	Very low	60.9	Low	126 Å²	126	81.7 Å²	81.7	88%	0.881	60%	0.596	S	S	*	*			trans	-55.3	129	179	45	0	0	0	0	113.1
26	G	28.1	Very low	60.4	Low	87 Å²	87	87.6 Å²	87.6	90%	0.897	62%	0.624	S	S	*	*			trans	51.5	71.8	144.9	0	0	0	0	0	118.1
27	G	32	Very low	60	Low	68 Å²	68	89.5 Å²	89.5	70%	0.701	63%	0.631	S	S	*	*			trans	-127.8	112.5	161.4	0	0	0	0	0	110.1	G29	G27-G29 PolarHBondContact O-N 2.96Å
28	A	35.8	Very low	59.7	Low	124 Å²	124	91.7 Å²	91.7	100%	1.025	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	30.4	-172	0	0	0	0	0	115.5
29	G	39.4	Very low	59.5	Low	78 Å²	78	94.3 Å²	94.3	80%	0.804	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	4.2	-174.1	0	0	0	0	0	116.8	G27	G27-G29 PolarHBondContact O-N 2.96Å
30	G	39.9	Very low	59.3	Low	37 Å²	37	93.5 Å²	93.5	38%	0.381	63%	0.634	S	S	.	*			trans	-108.7	9.6	-165.2	0	0	0	0	0	118.3	E32 Q33 N34	G30-E32 PolarHBondContact O-N 2.87Å; G30-Q33 PolarHBondContact O-N 3.49Å; G30-N34 PolarHBondContact O-N 3.49Å
31	G	42.2	Very low	59.4	Low	66 Å²	66	89.2 Å²	89.2	68%	0.68	62%	0.615	S	S	*	*	H	α-helix	trans	-57.2	-40.4	-166.3	0	0	0	0	0	115.6	G35	G31-G35 PolarHBondContact O-N 2.94Å
32	E	51.2	Low	60	Low	181 Å²	181	87 Å²	87	85%	0.846	60%	0.595	S	S	*	*	H	α-helix	trans	-78.3	-40	-176.7	-68.5	-172	137.2	0	0	113.3	G30 G35 Q36	G30-E32 PolarHBondContact O-N 2.87Å; E32-G35 PolarHBondContact O-N 3.25Å; E32-Q36 PolarHBondContact O-N 2.64Å; E32-Q36 VanDerWaalsContact O-N 3.14Å
33	Q	56.7	Low	61.2	Low	160 Å²	160	88.4 Å²	88.4	75%	0.748	59%	0.586	S	S	*	*	H	α-helix	trans	-66.2	-41.5	-179.6	-67.4	-173.7	29.2	0	0	111.2	G30 G35 Q36 E37	G30-Q33 PolarHBondContact O-N 3.49Å; Q33-G35 VanDerWaalsContact C-N 3.33Å; Q33-G35 PolarHBondContact O-N 2.75Å; Q33-Q36 PolarHBondContact O-N 2.87Å; Q33-E37 PolarHBondContact O-N 3.44Å; Q33-E37 VanDerWaalsContact O-N 3.11Å
34	N	67.3	Low	63.2	Low	85 Å²	85	84.2 Å²	84.2	46%	0.455	54%	0.542	S	S	.	.	H	α-helix	trans	-62.9	-40.8	176.8	-163.6	13.7	0	0	0	111.3	G30 Q36 E37 E38	G30-N34 PolarHBondContact O-N 3.49Å; N34-Q36 PolarHBondContact O-N 3.21Å; N34-E37 PolarHBondContact O-N 3.46Å; N34-E38 WeakPolarHBondContact O-CG 3.5Å; N34-E38 PolarHBondContact O-N 2.86Å
35	G	77	Confident	65.8	Low	24 Å²	24	80.9 Å²	80.9	25%	0.247	51%	0.508	C	S	.	.	H	α-helix	trans	-65.1	-33.9	177.2	0	0	0	0	0	114.2	G31 E32 Q33 K39	G31-G35 PolarHBondContact O-N 2.94Å; E32-G35 PolarHBondContact O-N 3.25Å; Q33-G35 VanDerWaalsContact C-N 3.33Å; Q33-G35 PolarHBondContact O-N 2.75Å; G35-K39 VanDerWaalsContact O-CG 3.29Å; G35-K39 WeakPolarHBondContact O-CG 3.28Å; G35-K39 PolarHBondContact O-N 3.19Å
36	Q	80.8	Confident	68.6	Low	125 Å²	125	78 Å²	78	58%	0.584	48%	0.48	S	S	*	.	H	α-helix	trans	-70.9	-38.5	174.6	-170.9	176.1	4.3	0	0	111.7	E32 Q33 N34 W40	E32-Q36 PolarHBondContact O-N 2.64Å; E32-Q36 VanDerWaalsContact O-N 3.14Å; Q33-Q36 PolarHBondContact O-N 2.87Å; N34-Q36 PolarHBondContact O-N 3.21Å; Q36-W40 PolarHBondContact O-N 2.91Å; Q36-W40 VanDerWaalsContact O-N 3.07Å
37	E	83.4	Confident	71.5	Confident	83 Å²	83	75.7 Å²	75.7	39%	0.388	45%	0.45	S	S	.	.	H	α-helix	trans	-66.3	-45.1	177	-172.7	174.5	-176.6	0	0	112	Q33 N34 K39 W40 C41	Q33-E37 PolarHBondContact O-N 3.44Å; Q33-E37 VanDerWaalsContact O-N 3.11Å; N34-E37 PolarHBondContact O-N 3.46Å; E37-K39 PolarHBondContact O-N 2.97Å; E37-W40 WeakPolarHBondContact O-CA 3.47Å; E37-W40 WeakPolarHBondContact O-CB 3.42Å; E37-W40 PolarHBondContact O-N 3.1Å; E37-C41 PolarHBondContact O-N 3Å; E37-C41 PolarHBondContact O-SG 3.21Å; E37-C41 VanDerWaalsContact O-SG 3.36Å
38	E	85.7	Confident	74.3	Confident	111 Å²	111	72.5 Å²	72.5	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-58.8	-45.2	175.9	-74.2	-174.8	164.9	0	0	112.4	N34 W40 C41 E42	N34-E38 WeakPolarHBondContact O-CG 3.5Å; N34-E38 PolarHBondContact O-N 2.86Å; E38-W40 PolarHBondContact O-N 3.04Å; E38-C41 PolarHBondContact O-N 2.88Å; E38-E42 PolarHBondContact O-N 3Å
39	K	86.6	Confident	77	Confident	143 Å²	143	66.9 Å²	66.9	62%	0.622	37%	0.369	S	S	*	.	H	α-helix	trans	-59.8	-36.1	174.3	-74.5	174.5	-174.8	175.2	0	111.8	G35 E37 K43	G35-K39 VanDerWaalsContact O-CG 3.29Å; G35-K39 WeakPolarHBondContact O-CG 3.28Å; G35-K39 PolarHBondContact O-N 3.19Å; E37-K39 PolarHBondContact O-N 2.97Å; K39-K43 WeakPolarHBondContact O-CG 3.32Å; K39-K43 PolarHBondContact O-N 3.19Å
40	W	88.3	Confident	79.4	Confident	31 Å²	31	70.2 Å²	70.2	12%	0.117	36%	0.362	C	S	.	.	H	α-helix	trans	-69.1	-45.7	176.2	-177.2	89.3	0	0	0	111.8	Q36 E37 E38 E42 K43 A44 V117 I127	Q36-W40 PolarHBondContact O-N 2.91Å; Q36-W40 VanDerWaalsContact O-N 3.07Å; E37-W40 WeakPolarHBondContact O-CA 3.47Å; E37-W40 WeakPolarHBondContact O-CB 3.42Å; E37-W40 PolarHBondContact O-N 3.1Å; E38-W40 PolarHBondContact O-N 3.04Å; W40-E42 VanDerWaalsContact C-N 3.33Å; W40-E42 PolarHBondContact O-N 3.44Å; W40-K43 PolarHBondContact O-N 3.25Å; W40-A44 HydrophobicContact CZ3-CB 4.49Å; W40-A44 PolarHBondContact O-N 3.39Å; W40-V117 HydrophobicContact CZ2-CB 4.22Å; W40-V117 PolarHBondContact NE1-O 3.42Å; W40-I127 HydrophobicContact CH2-CB 4.47Å; W40-I127 HydrophobicContact CH2-CG1 4.17Å; W40-I127 HydrophobicContact CH2-CG2 3.7Å; W40-I127 HydrophobicContact CZ2-CG2 4.46Å; W40-I127 HydrophobicContact CZ3-CG2 4.42Å
41	C	90.3	Very high	81.7	Confident	7 Å²	7	71.3 Å²	71.3	5%	0.047	36%	0.356	C	S	.	.	H	α-helix	trans	-57.6	-45.1	175.4	-67	0	0	0	0	111.5	L16 K19 E37 E38 K43 A44 V45 L131	L16-C41 HydrophobicContact CD2-CB 4.18Å; K19-C41 HydrophobicContact CD-CB 4.16Å; E37-C41 PolarHBondContact O-N 3Å; E37-C41 PolarHBondContact O-SG 3.21Å; E37-C41 VanDerWaalsContact O-SG 3.36Å; E38-C41 PolarHBondContact O-N 2.88Å; C41-K43 VanDerWaalsContact C-N 3.35Å; C41-K43 PolarHBondContact O-N 3.15Å; C41-A44 WeakPolarHBondContact O-CB 3.45Å; C41-A44 PolarHBondContact O-N 3.07Å; C41-V45 WeakPolarHBondContact O-CG2 3.43Å; C41-V45 PolarHBondContact O-N 3.42Å; C41-L131 HydrophobicContact CB-CD1 4.22Å
42	E	90.5	Very high	84.1	Confident	54 Å²	54	68.1 Å²	68.1	25%	0.252	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-43.4	177.7	-177	178	-164.1	0	0	111.7	T8 L16 E38 W40 V45 K46	T8-E42 WeakPolarHBondContact CG2-OE1 3.11Å; T8-E42 PolarHBondContact OG1-OE1 3.4Å; L16-E42 HydrophobicContact CD1-CB 4.03Å; L16-E42 HydrophobicContact CD1-CG 3.95Å; E38-E42 PolarHBondContact O-N 3Å; W40-E42 VanDerWaalsContact C-N 3.33Å; W40-E42 PolarHBondContact O-N 3.44Å; E42-V45 PolarHBondContact O-N 3.24Å; E42-K46 VanDerWaalsContact CD-NZ 3.28Å; E42-K46 HydrophobicContact CG-CD 4.04Å; E42-K46 HydrophobicContact CG-CG 4.43Å; E42-K46 WeakPolarHBondContact O-CB 3.5Å; E42-K46 VanDerWaalsContact O-CG 3.25Å; E42-K46 WeakPolarHBondContact O-CG 3.27Å; E42-K46 PolarHBondContact O-N 2.67Å; E42-K46 WeakPolarHBondContact OE1-CE 3.4Å; E42-K46 IonicContact OE1-NZ 2.75Å; E42-K46 PolarHBondContact OE1-NZ 2.92Å; E42-K46 IonicContact OE2-NZ 3.62Å
43	K	89.9	Confident	86	Confident	109 Å²	109	65.8 Å²	65.8	47%	0.474	31%	0.31	S	S	.	.	H	α-helix	trans	-63.8	-40.5	175.3	-72.6	179	-173	-176.6	0	112.2	K39 W40 C41 S47 V117 S118	K39-K43 WeakPolarHBondContact O-CG 3.32Å; K39-K43 PolarHBondContact O-N 3.19Å; W40-K43 PolarHBondContact O-N 3.25Å; C41-K43 VanDerWaalsContact C-N 3.35Å; C41-K43 PolarHBondContact O-N 3.15Å; K43-S47 WeakPolarHBondContact O-CB 3.43Å; K43-S47 PolarHBondContact O-N 3.23Å; K43-V117 HydrophobicContact CB-CG1 4.02Å; K43-S118 PolarHBondContact NZ-OG 2.77Å
44	A	90.9	Very high	87.4	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-49.4	177.7	0	0	0	0	0	111.2	W40 C41 S47 L48 V117 I127	W40-A44 HydrophobicContact CZ3-CB 4.49Å; W40-A44 PolarHBondContact O-N 3.39Å; C41-A44 WeakPolarHBondContact O-CB 3.45Å; C41-A44 PolarHBondContact O-N 3.07Å; A44-S47 WeakPolarHBondContact O-CB 3.4Å; A44-S47 PolarHBondContact O-N 2.93Å; A44-L48 PolarHBondContact O-N 3.5Å; A44-V117 HydrophobicContact CB-CG1 4.02Å; A44-V117 HydrophobicContact CB-CG2 4.44Å; A44-I127 HydrophobicContact CB-CG2 4.42Å
45	V	93.1	Very high	88.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-42.4	178.5	177.2	0	0	0	0	111.4	V12 L15 L16 C41 E42 S47 L48 V49 L131 W132	V12-V45 HydrophobicContact CB-CG1 4.45Å; V12-V45 HydrophobicContact CG1-CB 4.44Å; V12-V45 HydrophobicContact CG1-CG1 4Å; L15-V45 HydrophobicContact CB-CG1 3.63Å; L15-V45 HydrophobicContact CD1-CG1 3.91Å; L15-V45 HydrophobicContact CG-CG1 4.45Å; L16-V45 HydrophobicContact CD2-CB 4.19Å; L16-V45 HydrophobicContact CD2-CG2 3.72Å; L16-V45 HydrophobicContact CG-CB 4.38Å; L16-V45 HydrophobicContact CG-CG1 4.46Å; L16-V45 HydrophobicContact CG-CG2 4.27Å; C41-V45 WeakPolarHBondContact O-CG2 3.43Å; C41-V45 PolarHBondContact O-N 3.42Å; E42-V45 PolarHBondContact O-N 3.24Å; V45-S47 VanDerWaalsContact C-N 3.3Å; V45-S47 PolarHBondContact O-N 3.39Å; V45-L48 PolarHBondContact O-N 2.89Å; V45-V49 HydrophobicContact CG1-CG2 4.25Å; V45-V49 WeakPolarHBondContact O-CG2 3.44Å; V45-V49 PolarHBondContact O-N 2.94Å; V45-L131 HydrophobicContact CG2-CD1 3.66Å; V45-L131 HydrophobicContact CG2-CD2 4.2Å; V45-W132 HydrophobicContact CG2-CZ2 4.12Å
46	K	90.8	Very high	88.8	Confident	65 Å²	65	66.9 Å²	66.9	28%	0.283	32%	0.324	S	S	.	.	H	α-helix	trans	-57.5	-43.5	174.2	-77.6	177.5	-179.2	172.1	0	111.7	T8 V12 E42 K50	T8-K46 PolarHBondContact OG1-NZ 2.65Å; T8-K46 VanDerWaalsContact OG1-NZ 3.15Å; V12-K46 HydrophobicContact CB-CG 4.49Å; V12-K46 HydrophobicContact CG1-CG 3.8Å; V12-K46 HydrophobicContact CG2-CG 3.96Å; E42-K46 VanDerWaalsContact CD-NZ 3.28Å; E42-K46 HydrophobicContact CG-CD 4.04Å; E42-K46 HydrophobicContact CG-CG 4.43Å; E42-K46 WeakPolarHBondContact O-CB 3.5Å; E42-K46 VanDerWaalsContact O-CG 3.25Å; E42-K46 WeakPolarHBondContact O-CG 3.27Å; E42-K46 PolarHBondContact O-N 2.67Å; E42-K46 WeakPolarHBondContact OE1-CE 3.4Å; E42-K46 IonicContact OE1-NZ 2.75Å; E42-K46 PolarHBondContact OE1-NZ 2.92Å; E42-K46 IonicContact OE2-NZ 3.62Å; K46-K50 PolarHBondContact O-N 3.15Å; K46-K50 VanDerWaalsContact O-N 3.1Å
47	S	89.3	Confident	89.3	Confident	39 Å²	39	64.7 Å²	64.7	27%	0.273	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-44.6	176.9	-171.7	0	0	0	0	111.6	K43 A44 V45 K50 K51	K43-S47 WeakPolarHBondContact O-CB 3.43Å; K43-S47 PolarHBondContact O-N 3.23Å; A44-S47 WeakPolarHBondContact O-CB 3.4Å; A44-S47 PolarHBondContact O-N 2.93Å; V45-S47 VanDerWaalsContact C-N 3.3Å; V45-S47 PolarHBondContact O-N 3.39Å; S47-K50 PolarHBondContact O-N 2.91Å; S47-K51 WeakPolarHBondContact O-CG 3.44Å; S47-K51 PolarHBondContact O-N 3.17Å
48	L	92.1	Very high	89.7	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-50.6	176.6	-173.9	59.9	0	0	0	112	A44 V45 K50 K51 L52 L61 I77 Y128 W132 V162	A44-L48 PolarHBondContact O-N 3.5Å; V45-L48 PolarHBondContact O-N 2.89Å; L48-K50 PolarHBondContact O-N 3.44Å; L48-K51 WeakPolarHBondContact O-CA 3.42Å; L48-K51 WeakPolarHBondContact O-CB 3.32Å; L48-K51 PolarHBondContact O-N 2.94Å; L48-L52 HydrophobicContact CD1-CD1 3.9Å; L48-L52 HydrophobicContact CD1-CD2 4.16Å; L48-L52 HydrophobicContact CD1-CG 3.82Å; L48-L52 HydrophobicContact CD2-CD1 4.05Å; L48-L52 HydrophobicContact CG-CD1 3.71Å; L48-L52 HydrophobicContact CG-CG 3.98Å; L48-L52 WeakPolarHBondContact O-CG 3Å; L48-L52 PolarHBondContact O-N 3.13Å; L48-L61 HydrophobicContact CD2-CD2 3.51Å; L48-L61 HydrophobicContact CG-CD2 4.39Å; L48-I77 HydrophobicContact CD1-CG2 3.74Å; L48-Y128 HydrophobicContact CB-CE1 3.77Å; L48-Y128 WeakPolarHBondContact CB-OH 3.5Å; L48-Y128 HydrophobicContact CD1-CE1 4.36Å; L48-Y128 HydrophobicContact CD1-CE2 3.83Å; L48-Y128 HydrophobicContact CD2-CD1 3.81Å; L48-Y128 HydrophobicContact CD2-CD2 4.44Å; L48-Y128 HydrophobicContact CD2-CE1 3.61Å; L48-Y128 HydrophobicContact CD2-CE2 4.27Å; L48-Y128 HydrophobicContact CD2-CG 4.25Å; L48-Y128 HydrophobicContact CG-CE1 4.09Å; L48-Y128 HydrophobicContact CG-CE2 4.44Å; L48-W132 HydrophobicContact CD2-CH2 3.55Å; L48-W132 HydrophobicContact CD2-CZ3 3.96Å; L48-V162 HydrophobicContact CD1-CG2 4.05Å
49	V	92.8	Very high	90	Very high	6 Å²	6	62.1 Å²	62.1	4%	0.036	30%	0.302	C	S	.	.	H	α-helix	trans	-57.6	-41	-179.6	170.7	0	0	0	0	110.7	V11 V12 L15 V45 K51 L52 K53 L58	V11-V49 HydrophobicContact CG1-CG1 3.8Å; V11-V49 HydrophobicContact CG2-CG2 4.31Å; V12-V49 HydrophobicContact CG2-CB 4.29Å; V12-V49 HydrophobicContact CG2-CG1 4.46Å; V12-V49 HydrophobicContact CG2-CG2 4Å; L15-V49 HydrophobicContact CD1-CG2 3.49Å; L15-V49 VanDerWaalsContact CD1-CG2 3.49Å; V45-V49 HydrophobicContact CG1-CG2 4.25Å; V45-V49 WeakPolarHBondContact O-CG2 3.44Å; V45-V49 PolarHBondContact O-N 2.94Å; V49-K51 VanDerWaalsContact C-N 3.3Å; V49-K51 PolarHBondContact O-N 3.1Å; V49-L52 PolarHBondContact O-N 3.09Å; V49-K53 HydrophobicContact CG1-CD 4.19Å; V49-K53 HydrophobicContact CG1-CG 4.33Å; V49-K53 WeakPolarHBondContact O-CB 3.47Å; V49-K53 VanDerWaalsContact O-CG 3.3Å; V49-K53 WeakPolarHBondContact O-CG 3.41Å; V49-K53 PolarHBondContact O-N 3.44Å; V49-L58 HydrophobicContact CG1-CD1 4.46Å; V49-L58 HydrophobicContact CG1-CD2 4.35Å; V49-L58 HydrophobicContact CG2-CD1 4.16Å
50	K	89.3	Confident	90.3	Very high	149 Å²	149	57.1 Å²	57.1	65%	0.648	28%	0.281	S	S	*	.	H	α-helix	trans	-61.1	-37.4	175.6	-172	178.5	-178.6	178.6	0	112.3	K46 S47 L48	K46-K50 PolarHBondContact O-N 3.15Å; K46-K50 VanDerWaalsContact O-N 3.1Å; S47-K50 PolarHBondContact O-N 2.91Å; L48-K50 PolarHBondContact O-N 3.44Å
51	K	88.7	Confident	90.5	Very high	59 Å²	59	55.7 Å²	55.7	26%	0.257	28%	0.276	S	S	.	.	H	α-helix	trans	-72.7	-46.8	176.8	-68.5	-178.6	179.4	-166.8	0	111.8	S47 L48 V49 K53 K54 T55 I77 L115	S47-K51 WeakPolarHBondContact O-CG 3.44Å; S47-K51 PolarHBondContact O-N 3.17Å; L48-K51 WeakPolarHBondContact O-CA 3.42Å; L48-K51 WeakPolarHBondContact O-CB 3.32Å; L48-K51 PolarHBondContact O-N 2.94Å; V49-K51 VanDerWaalsContact C-N 3.3Å; V49-K51 PolarHBondContact O-N 3.1Å; K51-K53 VanDerWaalsContact C-N 3.34Å; K51-K53 PolarHBondContact O-N 2.74Å; K51-K54 WeakPolarHBondContact O-CB 3.47Å; K51-K54 PolarHBondContact O-N 2.74Å; K51-K54 VanDerWaalsContact O-N 3.1Å; K51-T55 PolarHBondContact O-N 3Å; K51-I77 HydrophobicContact CB-CG2 4.43Å; K51-I77 HydrophobicContact CD-CB 4.49Å; K51-I77 HydrophobicContact CD-CG2 4.42Å; K51-L115 VanDerWaalsContact NZ-CD1 3.27Å
52	L	92	Very high	90.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.2	-26.7	-176.7	-60.9	-176.3	0	0	0	113.8	L48 V49 K54 T55 G56 R57 L58 L61 V75 I77	L48-L52 HydrophobicContact CD1-CD1 3.9Å; L48-L52 HydrophobicContact CD1-CD2 4.16Å; L48-L52 HydrophobicContact CD1-CG 3.82Å; L48-L52 HydrophobicContact CD2-CD1 4.05Å; L48-L52 HydrophobicContact CG-CD1 3.71Å; L48-L52 HydrophobicContact CG-CG 3.98Å; L48-L52 WeakPolarHBondContact O-CG 3Å; L48-L52 PolarHBondContact O-N 3.13Å; V49-L52 PolarHBondContact O-N 3.09Å; L52-K54 PolarHBondContact O-N 2.79Å; L52-T55 PolarHBondContact O-N 3.02Å; L52-T55 PolarHBondContact O-OG1 3.38Å; L52-G56 PolarHBondContact O-N 3.21Å; L52-R57 HydrophobicContact CD2-CB 4.1Å; L52-R57 PolarHBondContact O-N 3.17Å; L52-L58 HydrophobicContact CB-CB 4.14Å; L52-L58 HydrophobicContact CB-CD1 4.37Å; L52-L58 HydrophobicContact CD1-CD1 4.46Å; L52-L61 HydrophobicContact CD1-CB 3.97Å; L52-L61 HydrophobicContact CD1-CD2 3.47Å; L52-L61 VanDerWaalsContact CD1-CD2 3.47Å; L52-L61 HydrophobicContact CD1-CG 4.3Å; L52-V75 HydrophobicContact CD1-CG1 3.68Å; L52-V75 HydrophobicContact CD2-CG1 3.59Å; L52-V75 HydrophobicContact CG-CG1 4.32Å; L52-I77 HydrophobicContact CD2-CG2 3.99Å
53	K	90.2	Very high	90.8	Very high	131 Å²	131	59.5 Å²	59.5	57%	0.57	29%	0.291	S	S	*	.	H	α-helix	trans	-63.4	-31.1	169.9	-78.9	-174.7	175.4	-167	0	112.7	V49 K51 L58	V49-K53 HydrophobicContact CG1-CD 4.19Å; V49-K53 HydrophobicContact CG1-CG 4.33Å; V49-K53 WeakPolarHBondContact O-CB 3.47Å; V49-K53 VanDerWaalsContact O-CG 3.3Å; V49-K53 WeakPolarHBondContact O-CG 3.41Å; V49-K53 PolarHBondContact O-N 3.44Å; K51-K53 VanDerWaalsContact C-N 3.34Å; K51-K53 PolarHBondContact O-N 2.74Å; K53-L58 HydrophobicContact CG-CD2 3.9Å
54	K	86.3	Confident	91	Very high	176 Å²	176	54.3 Å²	54.3	77%	0.765	27%	0.268	S	S	*	.	H	α-helix	trans	-76.2	-32.4	176.8	-67	-177.4	173.9	-166.6	0	112.4	K51 L52	K51-K54 WeakPolarHBondContact O-CB 3.47Å; K51-K54 PolarHBondContact O-N 2.74Å; K51-K54 VanDerWaalsContact O-N 3.1Å; L52-K54 PolarHBondContact O-N 2.79Å
55	T	86	Confident	91.1	Very high	59 Å²	59	54.6 Å²	54.6	36%	0.362	27%	0.27	S	S	.	.	H	α-helix	trans	-94.2	-6	-178.3	59.7	0	0	0	0	113.9	K51 L52 R57	K51-T55 PolarHBondContact O-N 3Å; L52-T55 PolarHBondContact O-N 3.02Å; L52-T55 PolarHBondContact O-OG1 3.38Å; T55-R57 VanDerWaalsContact C-N 3.26Å; T55-R57 PolarHBondContact O-N 3.46Å
56	G	88.7	Confident	91.1	Very high	58 Å²	58	58.5 Å²	58.5	60%	0.598	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	18.9	-177.5	0	0	0	0	0	114.3	L52	L52-G56 PolarHBondContact O-N 3.21Å
57	R	89.7	Confident	91.2	Very high	78 Å²	78	58.9 Å²	58.9	29%	0.294	30%	0.302	S	S	.	.			trans	-100.1	6.9	-175.6	-61.6	-67.1	-174.2	155.1	0.5	114	L52 T55 E60 L61 C74 V75	L52-R57 HydrophobicContact CD2-CB 4.1Å; L52-R57 PolarHBondContact O-N 3.17Å; T55-R57 VanDerWaalsContact C-N 3.26Å; T55-R57 PolarHBondContact O-N 3.46Å; R57-E60 PolarHBondContact O-N 2.6Å; R57-L61 PolarHBondContact O-N 2.88Å; R57-C74 PolarHBondContact NH1-O 3.18Å; R57-V75 HydrophobicContact CB-CG1 4.38Å
58	L	92.1	Very high	91.3	Very high	20 Å²	20	62.9 Å²	62.9	11%	0.105	32%	0.316	C	S	.	.	H	α-helix	trans	-65.5	-43.2	-175.7	-176.9	61.4	0	0	0	112.2	V11 L15 V49 L52 K53 E60 L61 E62	V11-L58 HydrophobicContact CG2-CD1 4.04Å; V11-L58 HydrophobicContact CG2-CD2 4.08Å; V11-L58 HydrophobicContact CG2-CG 4.36Å; L15-L58 HydrophobicContact CD1-CD1 4.42Å; V49-L58 HydrophobicContact CG1-CD1 4.46Å; V49-L58 HydrophobicContact CG1-CD2 4.35Å; V49-L58 HydrophobicContact CG2-CD1 4.16Å; L52-L58 HydrophobicContact CB-CB 4.14Å; L52-L58 HydrophobicContact CB-CD1 4.37Å; L52-L58 HydrophobicContact CD1-CD1 4.46Å; K53-L58 HydrophobicContact CG-CD2 3.9Å; L58-E60 VanDerWaalsContact C-N 3.31Å; L58-E60 PolarHBondContact O-N 2.82Å; L58-L61 WeakPolarHBondContact O-CB 3.08Å; L58-L61 PolarHBondContact O-N 2.82Å; L58-E62 PolarHBondContact O-N 3.4Å
59	D	92.2	Very high	91.2	Very high	121 Å²	121	66 Å²	66	65%	0.647	33%	0.333	S	S	*	.	H	α-helix	trans	-66.6	-35.1	-179.7	-59.7	-29.9	0	0	0	111.6	L61 E62 K63	D59-L61 VanDerWaalsContact C-N 3.34Å; D59-E62 PolarHBondContact O-N 3.45Å; D59-K63 VanDerWaalsContact O-CB 3.28Å; D59-K63 WeakPolarHBondContact O-CB 3.3Å; D59-K63 PolarHBondContact O-N 3.3Å
60	E	92.5	Very high	91	Very high	38 Å²	38	68.2 Å²	68.2	18%	0.178	35%	0.348	C	S	.	.	H	α-helix	trans	-65.4	-36.9	174.2	-67.1	-68.6	171.3	0	0	111.6	R57 L58 A64 K73 V75	R57-E60 PolarHBondContact O-N 2.6Å; L58-E60 VanDerWaalsContact C-N 3.31Å; L58-E60 PolarHBondContact O-N 2.82Å; E60-A64 VanDerWaalsContact O-CB 3.3Å; E60-A64 WeakPolarHBondContact O-CB 3.3Å; E60-A64 PolarHBondContact O-N 3.38Å; E60-K73 HydrophobicContact CG-CB 4.36Å; E60-K73 WeakPolarHBondContact OE1-CD 3.46Å; E60-K73 IonicContact OE1-NZ 3.87Å; E60-V75 HydrophobicContact CB-CG2 4.15Å
61	L	93.9	Very high	91.1	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-66.5	-46.5	173.5	-179.5	66.5	0	0	0	111.7	L15 L48 L52 R57 L58 D59 K63 A64 I65 V75 W132	L15-L61 HydrophobicContact CD1-CD2 4.39Å; L15-L61 HydrophobicContact CD2-CD2 4.23Å; L15-L61 HydrophobicContact CD2-CG 4.47Å; L48-L61 HydrophobicContact CD2-CD2 3.51Å; L48-L61 HydrophobicContact CG-CD2 4.39Å; L52-L61 HydrophobicContact CD1-CB 3.97Å; L52-L61 HydrophobicContact CD1-CD2 3.47Å; L52-L61 VanDerWaalsContact CD1-CD2 3.47Å; L52-L61 HydrophobicContact CD1-CG 4.3Å; R57-L61 PolarHBondContact O-N 2.88Å; L58-L61 WeakPolarHBondContact O-CB 3.08Å; L58-L61 PolarHBondContact O-N 2.82Å; D59-L61 VanDerWaalsContact C-N 3.34Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 2.76Å; L61-A64 PolarHBondContact O-N 2.79Å; L61-I65 HydrophobicContact CD1-CD1 3.78Å; L61-I65 HydrophobicContact CD1-CG1 4.17Å; L61-I65 HydrophobicContact CD2-CD1 4.38Å; L61-I65 HydrophobicContact CG-CD1 3.8Å; L61-I65 HydrophobicContact CG-CG1 4.5Å; L61-I65 WeakPolarHBondContact O-CG1 3.38Å; L61-I65 PolarHBondContact O-N 3.3Å; L61-V75 HydrophobicContact CB-CG1 4.08Å; L61-V75 HydrophobicContact CB-CG2 4.02Å; L61-V75 HydrophobicContact CD1-CG1 4.38Å; L61-V75 HydrophobicContact CD1-CG2 4.41Å; L61-W132 HydrophobicContact CD1-CZ3 4.32Å; L61-W132 HydrophobicContact CD2-CH2 4.12Å; L61-W132 HydrophobicContact CD2-CZ3 4.45Å
62	E	93.5	Very high	91.3	Very high	24 Å²	24	64.7 Å²	64.7	11%	0.112	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-42.9	177.1	-72.2	-169.9	-174	0	0	111	V11 R14 L15 L58 D59 I65 T66	V11-E62 WeakPolarHBondContact CG2-OE1 3.43Å; R14-E62 IonicContact CZ-OE1 3.42Å; R14-E62 IonicContact CZ-OE2 3.2Å; R14-E62 IonicContact NH1-OE1 3.79Å; R14-E62 IonicContact NH1-OE2 2.76Å; R14-E62 PolarHBondContact NH1-OE2 3.35Å; R14-E62 IonicContact NH2-OE1 2.68Å; R14-E62 PolarHBondContact NH2-OE1 3.48Å; R14-E62 IonicContact NH2-OE2 2.92Å; R14-E62 PolarHBondContact NH2-OE2 3.43Å; L15-E62 HydrophobicContact CD2-CG 4.44Å; L58-E62 PolarHBondContact O-N 3.4Å; D59-E62 PolarHBondContact O-N 3.45Å; E62-I65 PolarHBondContact O-N 2.81Å; E62-T66 VanDerWaalsContact O-CB 3.25Å; E62-T66 WeakPolarHBondContact O-CB 3.47Å; E62-T66 PolarHBondContact O-N 3.15Å; E62-T66 PolarHBondContact O-OG1 3.38Å
63	K	93.3	Very high	91.4	Very high	117 Å²	117	70.8 Å²	70.8	51%	0.509	37%	0.366	S	S	.	.	H	α-helix	trans	-61.4	-47	174.6	-173.6	-179.4	179.5	-179.1	0	111.6	D59 L61 I65 T66 T67 T72	D59-K63 VanDerWaalsContact O-CB 3.28Å; D59-K63 WeakPolarHBondContact O-CB 3.3Å; D59-K63 PolarHBondContact O-N 3.3Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 2.76Å; K63-I65 PolarHBondContact O-N 2.97Å; K63-T66 PolarHBondContact O-N 3.32Å; K63-T67 HydrophobicContact CG-CG2 4.16Å; K63-T67 WeakPolarHBondContact O-CB 3.47Å; K63-T67 WeakPolarHBondContact O-CG2 3.43Å; K63-T67 PolarHBondContact O-N 2.92Å; K63-T67 PolarHBondContact O-OG1 3.37Å; K63-T72 HydrophobicContact CG-CG2 4.29Å
64	A	93.5	Very high	91.6	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.2	-46.2	179.3	0	0	0	0	0	112.1	E60 L61 Q68 T72 N163 Y165	E60-A64 VanDerWaalsContact O-CB 3.3Å; E60-A64 WeakPolarHBondContact O-CB 3.3Å; E60-A64 PolarHBondContact O-N 3.38Å; L61-A64 PolarHBondContact O-N 2.79Å; A64-Q68 WeakPolarHBondContact O-CA 3.49Å; A64-Q68 PolarHBondContact O-N 3.25Å; A64-T72 HydrophobicContact CB-CG2 4.13Å; A64-T72 WeakPolarHBondContact CB-OG1 3.31Å; A64-N163 WeakPolarHBondContact CB-OD1 3.49Å; A64-Y165 VanDerWaalsContact O-CD2 3.32Å; A64-Y165 WeakPolarHBondContact O-CD2 3.43Å; A64-Y165 WeakPolarHBondContact O-CE2 3.47Å
65	I	93	Very high	92	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-67.9	-40.8	179.2	-64.7	167.7	0	0	0	111.8	L15 W18 L61 E62 K63 W132 P164	L15-I65 HydrophobicContact CD2-CD1 3.56Å; W18-I65 HydrophobicContact CB-CG2 3.58Å; W18-I65 HydrophobicContact CD2-CG2 3.66Å; W18-I65 HydrophobicContact CE3-CB 4.46Å; W18-I65 HydrophobicContact CE3-CG2 3.71Å; W18-I65 HydrophobicContact CG-CG2 3.6Å; L61-I65 HydrophobicContact CD1-CD1 3.78Å; L61-I65 HydrophobicContact CD1-CG1 4.17Å; L61-I65 HydrophobicContact CD2-CD1 4.38Å; L61-I65 HydrophobicContact CG-CD1 3.8Å; L61-I65 HydrophobicContact CG-CG1 4.5Å; L61-I65 WeakPolarHBondContact O-CG1 3.38Å; L61-I65 PolarHBondContact O-N 3.3Å; E62-I65 PolarHBondContact O-N 2.81Å; K63-I65 PolarHBondContact O-N 2.97Å; I65-W132 HydrophobicContact CD1-CD2 3.59Å; I65-W132 HydrophobicContact CD1-CE3 3.98Å; I65-W132 HydrophobicContact CD1-CG 3.98Å; I65-W132 HydrophobicContact CD1-CH2 4.33Å; I65-W132 HydrophobicContact CD1-CZ2 3.95Å; I65-W132 HydrophobicContact CD1-CZ3 4.3Å; I65-W132 HydrophobicContact CG1-CD2 4.31Å; I65-W132 HydrophobicContact CG1-CG 4.34Å; I65-P164 HydrophobicContact CG1-CG 4.37Å
66	T	92.6	Very high	92.3	Very high	82 Å²	82	54 Å²	54	50%	0.503	29%	0.29	S	S	.	.	H	α-helix	trans	-72.2	-43.7	-178	-54.3	0	0	0	0	112	E62 K63	E62-T66 VanDerWaalsContact O-CB 3.25Å; E62-T66 WeakPolarHBondContact O-CB 3.47Å; E62-T66 PolarHBondContact O-N 3.15Å; E62-T66 PolarHBondContact O-OG1 3.38Å; K63-T66 PolarHBondContact O-N 3.32Å
67	T	92.6	Very high	92.4	Very high	74 Å²	74	51.3 Å²	51.3	45%	0.454	26%	0.261	S	S	.	.	H	α-helix	trans	-85.2	-15.6	-177.2	62	0	0	0	0	113.7	K63 N69	K63-T67 HydrophobicContact CG-CG2 4.16Å; K63-T67 WeakPolarHBondContact O-CB 3.47Å; K63-T67 WeakPolarHBondContact O-CG2 3.43Å; K63-T67 PolarHBondContact O-N 2.92Å; K63-T67 PolarHBondContact O-OG1 3.37Å; T67-N69 PolarHBondContact O-N 2.94Å; T67-N69 WeakPolarHBondContact OG1-CB 3.34Å
68	Q	92	Very high	92.2	Very high	122 Å²	122	51 Å²	51	57%	0.57	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	35.2	-176.6	-49.6	-161.9	34.2	0	0	113.4	A64 Y165	A64-Q68 WeakPolarHBondContact O-CA 3.49Å; A64-Q68 PolarHBondContact O-N 3.25Å; Q68-Y165 VanDerWaalsContact CA-CE1 3.42Å; Q68-Y165 VanDerWaalsContact CA-CZ 3.49Å; Q68-Y165 HydrophobicContact CB-CD1 4.19Å; Q68-Y165 HydrophobicContact CB-CE1 3.44Å; Q68-Y165 VanDerWaalsContact CB-CE1 3.44Å; Q68-Y165 HydrophobicContact CB-CE2 4.44Å; Q68-Y165 HydrophobicContact CG-CE1 4.05Å; Q68-Y165 WeakPolarHBondContact CG-OH 3.27Å; Q68-Y165 WeakPolarHBondContact O-CD1 3.42Å; Q68-Y165 PolarHBondContact OE1-OH 3.22Å
69	N	89.7	Confident	91.2	Very high	66 Å²	66	50.9 Å²	50.9	35%	0.353	27%	0.27	S	S	.	.			trans	-110.9	125	-169	-169.4	-20.2	0	0	0	111.9	T67 N71 T72	T67-N69 PolarHBondContact O-N 2.94Å; T67-N69 WeakPolarHBondContact OG1-CB 3.34Å; N69-N71 VanDerWaalsContact C-N 3.26Å; N69-N71 PolarHBondContact O-N 3.32Å; N69-N71 VanDerWaalsContact OD1-CB 3.32Å; N69-N71 WeakPolarHBondContact OD1-CB 3.34Å; N69-N71 PolarHBondContact OD1-N 3.11Å; N69-N71 PolarHBondContact OD1-ND2 3.28Å; N69-T72 HydrophobicContact CB-CG2 4.3Å; N69-T72 WeakPolarHBondContact O-CG2 3.29Å; N69-T72 PolarHBondContact O-N 3.14Å; N69-T72 PolarHBondContact O-OG1 3.04Å
70	C	90.2	Very high	89.7	Confident	52 Å²	52	48 Å²	48	35%	0.351	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.2	176.9	57.2	0	0	0	0	113.8	T72 I146 Y165 H166	C70-T72 PolarHBondContact O-N 3.07Å; C70-I146 HydrophobicContact CB-CD1 3.85Å; C70-I146 WeakPolarHBondContact O-CD1 3.38Å; C70-Y165 WeakPolarHBondContact CA-O 3.46Å; C70-Y165 VanDerWaalsContact CB-O 3.31Å; C70-Y165 WeakPolarHBondContact CB-O 3.36Å; C70-H166 PolarHBondContact O-CD2 2.93Å; C70-H166 VanDerWaalsContact O-CD2 3.3Å; C70-H166 PolarHBondContact O-NE2 3.18Å; C70-H166 VanDerWaalsContact O-NE2 3.11Å
71	N	91.3	Very high	87.6	Confident	120 Å²	120	48.7 Å²	48.7	64%	0.642	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	2.5	178.4	-62.8	-42.6	0	0	0	113.7	N69	N69-N71 VanDerWaalsContact C-N 3.26Å; N69-N71 PolarHBondContact O-N 3.32Å; N69-N71 VanDerWaalsContact OD1-CB 3.32Å; N69-N71 WeakPolarHBondContact OD1-CB 3.34Å; N69-N71 PolarHBondContact OD1-N 3.11Å; N69-N71 PolarHBondContact OD1-ND2 3.28Å
72	T	92.4	Very high	84.9	Confident	14 Å²	14	51 Å²	51	9%	0.086	28%	0.282	C	S	.	.	S	Bend	trans	-66.6	159.2	170.9	51.4	0	0	0	0	111.2	K63 A64 N69 C70 N163 H166	K63-T72 HydrophobicContact CG-CG2 4.29Å; A64-T72 HydrophobicContact CB-CG2 4.13Å; A64-T72 WeakPolarHBondContact CB-OG1 3.31Å; N69-T72 HydrophobicContact CB-CG2 4.3Å; N69-T72 WeakPolarHBondContact O-CG2 3.29Å; N69-T72 PolarHBondContact O-N 3.14Å; N69-T72 PolarHBondContact O-OG1 3.04Å; C70-T72 PolarHBondContact O-N 3.07Å; T72-N163 PolarHBondContact OG1-ND2 3.03Å; T72-H166 PolarHBondContact O-CE1 3.24Å; T72-H166 VanDerWaalsContact O-CE1 3.25Å; T72-H166 PolarHBondContact O-NE2 3.33Å
73	K	94	Very high	81.9	Confident	128 Å²	128	56.9 Å²	56.9	56%	0.557	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-67.5	158	-179.7	-66.5	-176.8	-172.8	164	0	111.2	E60 V75 N163	E60-K73 HydrophobicContact CG-CB 4.36Å; E60-K73 WeakPolarHBondContact OE1-CD 3.46Å; E60-K73 IonicContact OE1-NZ 3.87Å; K73-V75 PolarHBondContact O-N 3.42Å; K73-N163 PolarHBondContact O-ND2 3.43Å
74	C	94.1	Very high	79.2	Confident	11 Å²	11	56.1 Å²	56.1	7%	0.074	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-59.7	133.2	171.5	-69.1	0	0	0	0	110.1	R57 T76 Y151 H166	R57-C74 PolarHBondContact NH1-O 3.18Å; C74-T76 HydrophobicContact CB-CG2 4.1Å; C74-Y151 HydrophobicContact CB-CD2 3.82Å; C74-H166 PolarHBondContact N-CE1 3.01Å; C74-H166 VanDerWaalsContact SG-CE1 3.55Å
75	V	94.8	Very high	76.4	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.349	C	S	.	.			trans	-104.1	106.6	170.5	178.5	0	0	0	0	106.3	L52 R57 E60 L61 K73 C161 V162 N163	L52-V75 HydrophobicContact CD1-CG1 3.68Å; L52-V75 HydrophobicContact CD2-CG1 3.59Å; L52-V75 HydrophobicContact CG-CG1 4.32Å; R57-V75 HydrophobicContact CB-CG1 4.38Å; E60-V75 HydrophobicContact CB-CG2 4.15Å; L61-V75 HydrophobicContact CB-CG1 4.08Å; L61-V75 HydrophobicContact CB-CG2 4.02Å; L61-V75 HydrophobicContact CD1-CG1 4.38Å; L61-V75 HydrophobicContact CD1-CG2 4.41Å; K73-V75 PolarHBondContact O-N 3.42Å; V75-C161 CarbonylContact O-C 3.44Å; V75-C161 VanDerWaalsContact O-CA 3.3Å; V75-C161 WeakPolarHBondContact O-CA 3.5Å; V75-V162 HydrophobicContact CB-CG2 4.3Å; V75-V162 HydrophobicContact CG1-CG2 3.79Å; V75-V162 VanDerWaalsContact O-CG2 3.3Å; V75-V162 WeakPolarHBondContact O-CG2 3.46Å; V75-V162 PolarHBondContact O-N 3.36Å; V75-N163 HydrophobicContact CB-CB 4.12Å; V75-N163 HydrophobicContact CG2-CB 4.11Å
76	T	93.5	Very high	73.4	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.018	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	149.4	-171.3	58.7	0	0	0	0	112.6	C74 Y151 E159 V160	C74-T76 HydrophobicContact CB-CG2 4.1Å; T76-Y151 HydrophobicContact CG2-CD1 3.85Å; T76-Y151 HydrophobicContact CG2-CD2 3.66Å; T76-Y151 HydrophobicContact CG2-CE1 4.42Å; T76-Y151 HydrophobicContact CG2-CE2 4.29Å; T76-Y151 HydrophobicContact CG2-CG 3.42Å; T76-Y151 VanDerWaalsContact CG2-CG 3.42Å; T76-E159 VanDerWaalsContact CB-OE2 3.3Å; T76-E159 WeakPolarHBondContact CB-OE2 3.43Å; T76-E159 HydrophobicContact CG2-CB 4.4Å; T76-E159 PolarHBondContact OG1-OE2 3.2Å; T76-V160 WeakPolarHBondContact CA-O 3.28Å
77	I	90.1	Very high	70.4	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.005	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	154.4	164.4	68.5	169.7	0	0	0	109.6	L48 K51 L52 S79 P124 Y128 E159 V160 V162	L48-I77 HydrophobicContact CD1-CG2 3.74Å; K51-I77 HydrophobicContact CB-CG2 4.43Å; K51-I77 HydrophobicContact CD-CB 4.49Å; K51-I77 HydrophobicContact CD-CG2 4.42Å; L52-I77 HydrophobicContact CD2-CG2 3.99Å; I77-S79 PolarHBondContact O-N 2.87Å; I77-P124 HydrophobicContact CD1-CB 3.55Å; I77-P124 HydrophobicContact CD1-CG 3.87Å; I77-P124 HydrophobicContact CG1-CB 4.26Å; I77-Y128 HydrophobicContact CD1-CE2 4.43Å; I77-E159 WeakPolarHBondContact O-CA 3.36Å; I77-V160 HydrophobicContact CG1-CG1 3.87Å; I77-V160 PolarHBondContact N-O 3.29Å; I77-V160 PolarHBondContact O-N 3.07Å; I77-V162 HydrophobicContact CD1-CG1 3.98Å; I77-V162 HydrophobicContact CG1-CG1 3.86Å; I77-V162 HydrophobicContact CG2-CG2 4.08Å
78	P	85.2	Confident	67.2	Low	73 Å²	73	75.2 Å²	75.2	47%	0.474	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	127.1	173.5	-25.8	34.3	0	0	0	111.1
79	S	71.6	Confident	64.3	Low	16 Å²	16	75.2 Å²	75.2	11%	0.112	42%	0.422	C	S	.	.			trans	-72.5	134.5	167	84.5	0	0	0	0	107.4	I77 C81 K157 D158	I77-S79 PolarHBondContact O-N 2.87Å; S79-C81 PolarHBondContact O-N 2.95Å; S79-K157 PolarHBondContact OG-O 3.42Å; S79-D158 VanDerWaalsContact CB-O 3.31Å; S79-D158 WeakPolarHBondContact CB-O 3.42Å; S79-D158 PolarHBondContact N-O 3.15Å; S79-D158 PolarHBondContact OG-O 3.34Å
80	T	59.9	Low	61.4	Low	61 Å²	61	77.4 Å²	77.4	37%	0.374	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	17.7	176.1	56.5	0	0	0	0	112.3	S110 G113 R114	T80-S110 PolarHBondContact OG1-O 3.28Å; T80-G113 VanDerWaalsContact OG1-C 3.27Å; T80-G113 VanDerWaalsContact OG1-CA 3.25Å; T80-G113 WeakPolarHBondContact OG1-CA 3.34Å; T80-R114 PolarHBondContact OG1-O 3.1Å
81	C	47.7	Very low	58.5	Low	52 Å²	52	82.2 Å²	82.2	35%	0.351	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-13	-174.2	-138.8	0	0	0	0	113.2	S79 E83	S79-C81 PolarHBondContact O-N 2.95Å; C81-E83 VanDerWaalsContact C-N 3.34Å; C81-E83 PolarHBondContact O-N 3.2Å; C81-E83 VanDerWaalsContact O-N 3.15Å
82	S	37.5	Very low	55.7	Low	50 Å²	50	83.1 Å²	83.1	35%	0.35	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	5.5	-160.5	-60.3	0	0	0	0	117.7	D158	S82-D158 VanDerWaalsContact CB-OD1 3.26Å; S82-D158 WeakPolarHBondContact CB-OD1 3.45Å; S82-D158 VanDerWaalsContact OG-CA 3.32Å; S82-D158 WeakPolarHBondContact OG-CA 3.35Å; S82-D158 WeakPolarHBondContact OG-CB 3.23Å; S82-D158 PolarHBondContact OG-OD1 3.42Å
83	E	31.8	Very low	52.6	Low	147 Å²	147	89.6 Å²	89.6	69%	0.687	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	3.3	-179.4	-82.5	178.4	176.5	0	0	115.4	C81 R109	C81-E83 VanDerWaalsContact C-N 3.34Å; C81-E83 PolarHBondContact O-N 3.2Å; C81-E83 VanDerWaalsContact O-N 3.15Å; E83-R109 IonicContact OE1-CZ 3.2Å; E83-R109 IonicContact OE1-NH1 2.86Å; E83-R109 PolarHBondContact OE1-NH1 2.94Å; E83-R109 IonicContact OE2-CZ 2.66Å; E83-R109 IonicContact OE2-NH1 2.72Å; E83-R109 PolarHBondContact OE2-NH1 2.89Å
84	I	36.4	Very low	49.5	Very low	100 Å²	100	89.8 Å²	89.8	51%	0.513	51%	0.512	S	S	.	.	S	Bend	trans	-112.4	-6.9	-177.2	-56	174.9	0	0	0	113.1	L111	I84-L111 HydrophobicContact CD1-CB 4.24Å; I84-L111 HydrophobicContact CD1-CD2 3.65Å; I84-L111 HydrophobicContact CD1-CG 4.48Å
85	W	34.7	Very low	46.4	Very low	219 Å²	219	96.9 Å²	96.9	83%	0.83	54%	0.544	S	S	*	.	S	Bend	trans	-118.2	16.7	-177.9	-59.8	100.5	0	0	0	113.9	L87	W85-L87 PolarHBondContact O-N 2.91Å
86	G	29.4	Very low	43.2	Very low	65 Å²	65	107.9 Å²	107.9	67%	0.67	59%	0.585	S	S	*	*			trans	-73.9	102.5	174.4	0	0	0	0	0	111.4	S88	G86-S88 PolarHBondContact O-N 3.43Å; G86-S88 VanDerWaalsContact O-N 3.08Å
87	L	30.5	Very low	40.2	Very low	164 Å²	164	114.4 Å²	114.4	86%	0.859	62%	0.62	S	S	*	*			trans	-12.7	103.7	151.9	-71.2	152.5	0	0	0	112.9	W85 T89	W85-L87 PolarHBondContact O-N 2.91Å; L87-T89 VanDerWaalsContact C-N 3.34Å; L87-T89 PolarHBondContact O-N 3.2Å
88	S	25.2	Very low	37.4	Very low	116 Å²	116	120.5 Å²	120.5	81%	0.811	66%	0.658	S	S	*	*			trans	-57.6	99.3	157.5	17	0	0	0	0	107.9	G86	G86-S88 PolarHBondContact O-N 3.43Å; G86-S88 VanDerWaalsContact O-N 3.08Å
89	T	30.2	Very low	35	Very low	122 Å²	122	123.3 Å²	123.3	75%	0.748	67%	0.674	S	S	*	*			trans	-64.7	121.2	154.3	42.7	0	0	0	0	107.1	L87 N91	L87-T89 VanDerWaalsContact C-N 3.34Å; L87-T89 PolarHBondContact O-N 3.2Å; T89-N91 PolarHBondContact O-N 2.96Å; T89-N91 VanDerWaalsContact O-N 3.12Å
90	P	28.9	Very low	32.9	Very low	112 Å²	112	125.6 Å²	125.6	73%	0.727	70%	0.7	S	S	*	*	S	Bend	trans	-74.6	107.7	174.7	30.2	-27.5	0	0	0	106.2
91	N	29.4	Very low	31.3	Very low	152 Å²	152	130.7 Å²	130.7	81%	0.813	72%	0.724	S	S	*	*			trans	162.4	96.9	154.4	-82.6	-18.9	0	0	0	107.6	T89	T89-N91 PolarHBondContact O-N 2.96Å; T89-N91 VanDerWaalsContact O-N 3.12Å
92	T	32.4	Very low	30.5	Very low	139 Å²	139	139 Å²	139	85%	0.853	75%	0.749	S	S	*	*			trans	164.7	85.4	130.7	-53.6	0	0	0	0	106
93	I	28	Very low	29.9	Very low	150 Å²	150	142.3 Å²	142.3	77%	0.769	77%	0.773	S	S	*	*			trans	-72	121.6	150.8	-93.8	168.5	0	0	0	104.5
94	D	28.9	Very low	29.7	Very low	133 Å²	133	144.4 Å²	144.4	71%	0.711	78%	0.78	S	S	*	*				175.4	149.5	128	-91.8	-35.1	0	0	0	113.3
95	Q	28.3	Very low	29.2	Very low	160 Å²	160	144.8 Å²	144.8	75%	0.748	79%	0.792	S	S	*	*			trans	82.8	88.3	162.9	-72.6	173.6	-6.2	0	0	119	D97	Q95-D97 PolarHBondContact O-N 3.38Å
96	W	28.3	Very low	28.8	Very low	230 Å²	230	143.6 Å²	143.6	87%	0.871	80%	0.795	S	S	*	*			trans	-70.1	102.2	149.4	6.8	-81	0	0	0	108.1
97	D	30.8	Very low	28.7	Very low	141 Å²	141	148.8 Å²	148.8	75%	0.754	80%	0.802	S	S	*	*			trans	-105.4	130.3	170.3	-112.5	-24	0	0	0	112.2	Q95 T99	Q95-D97 PolarHBondContact O-N 3.38Å; D97-T99 PolarHBondContact O-N 3.29Å
98	T	31.4	Very low	28.7	Very low	129 Å²	129	146.6 Å²	146.6	79%	0.791	80%	0.796	S	S	*	*			trans	-101.8	71.3	-165.4	-52.7	0	0	0	0	108.7
99	T	33.2	Very low	29.1	Very low	131 Å²	131	149.3 Å²	149.3	80%	0.804	79%	0.788	S	S	*	*			trans	-162.4	127.4	167.1	40	0	0	0	0	112.5	D97	D97-T99 PolarHBondContact O-N 3.29Å
100	G	27.3	Very low	29.6	Very low	65 Å²	65	144.1 Å²	144.1	67%	0.67	76%	0.757	S	S	*	*			trans	58.1	116.4	136.3	0	0	0	0	0	120.7
101	L	27.5	Very low	30.4	Very low	167 Å²	167	145.2 Å²	145.2	87%	0.874	76%	0.756	S	S	*	*			trans	69	80.6	137.3	-63.8	158.8	0	0	0	117.4
102	Y	30.2	Very low	31.7	Very low	226 Å²	226	141.4 Å²	141.4	89%	0.886	74%	0.736	S	S	*	*			trans	-137	120.1	141.1	-89.8	-82.2	0	0	0	111.1	F104	Y102-F104 PolarHBondContact O-N 2.9Å
103	S	24.8	Very low	33	Very low	120 Å²	120	135.2 Å²	135.2	84%	0.839	70%	0.699	S	S	*	*			trans	-66.7	109.1	170.2	40.9	0	0	0	0	109.5
104	F	27.4	Very low	34.7	Very low	191 Å²	191	131.7 Å²	131.7	84%	0.838	68%	0.676	S	S	*	*			trans	-111.3	116.9	168.8	-131.8	-95.7	0	0	0	108.5	Y102 E106	Y102-F104 PolarHBondContact O-N 2.9Å; F104-E106 PolarHBondContact O-N 3.5Å
105	S	27.3	Very low	36.8	Very low	108 Å²	108	126 Å²	126	76%	0.755	65%	0.646	S	S	*	*			trans	-57.1	107	176.8	51.9	0	0	0	0	110.7	Q107	S105-Q107 PolarHBondContact O-N 3.1Å
106	E	25.4	Very low	39.1	Very low	195 Å²	195	122.1 Å²	122.1	91%	0.911	63%	0.627	S	S	*	*			trans	-67.4	91.4	173.6	-75.6	-179.6	135.5	0	0	110.7	F104	F104-E106 PolarHBondContact O-N 3.5Å
107	Q	28.3	Very low	41.2	Very low	174 Å²	174	111.5 Å²	111.5	81%	0.813	59%	0.588	S	S	*	*			trans	-96.9	100.4	154.8	-101	177.6	-2.4	0	0	107.9	S105 R109	S105-Q107 PolarHBondContact O-N 3.1Å; Q107-R109 PolarHBondContact O-N 3.22Å
108	T	28.5	Very low	43	Very low	118 Å²	118	107.3 Å²	107.3	72%	0.724	57%	0.569	S	S	*	*			trans	-50.9	99.9	174.1	20.7	0	0	0	0	111.3
109	R	34.2	Very low	44.8	Very low	173 Å²	173	109 Å²	109	65%	0.653	57%	0.568	S	S	*	*			trans	-79.5	136.8	176	-73.4	-178.4	179.5	-172	0.7	110.9	E83 Q107	E83-R109 IonicContact OE1-CZ 3.2Å; E83-R109 IonicContact OE1-NH1 2.86Å; E83-R109 PolarHBondContact OE1-NH1 2.94Å; E83-R109 IonicContact OE2-CZ 2.66Å; E83-R109 IonicContact OE2-NH1 2.72Å; E83-R109 PolarHBondContact OE2-NH1 2.89Å; Q107-R109 PolarHBondContact O-N 3.22Å
110	S	40.4	Very low	46.7	Very low	13 Å²	13	108.8 Å²	108.8	9%	0.091	55%	0.553	C	S	.	*			trans	-81.7	116.9	174.6	23.5	0	0	0	0	110.9	T80 D112 R114	T80-S110 PolarHBondContact OG1-O 3.28Å; S110-D112 WeakPolarHBondContact CB-OD1 3.25Å; S110-D112 PolarHBondContact O-N 3.38Å; S110-D112 VanDerWaalsContact O-N 3.16Å; S110-R114 PolarHBondContact OG-O 3.43Å
111	L	46.9	Very low	49.1	Very low	134 Å²	134	110.9 Å²	110.9	70%	0.702	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.4	-177.5	-57.5	166.6	0	0	0	114.3	I84	I84-L111 HydrophobicContact CD1-CB 4.24Å; I84-L111 HydrophobicContact CD1-CD2 3.65Å; I84-L111 HydrophobicContact CD1-CG 4.48Å
112	D	55.7	Low	51.6	Low	73 Å²	73	103.8 Å²	103.8	39%	0.39	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	19.7	-168.8	65.9	-14.6	0	0	0	113.9	S110 R114	S110-D112 WeakPolarHBondContact CB-OD1 3.25Å; S110-D112 PolarHBondContact O-N 3.38Å; S110-D112 VanDerWaalsContact O-N 3.16Å; D112-R114 PolarHBondContact O-N 2.96Å; D112-R114 WeakPolarHBondContact OD1-CB 3.41Å; D112-R114 WeakPolarHBondContact OD1-CG 3.45Å; D112-R114 PolarHBondContact OD1-N 2.85Å; D112-R114 WeakPolarHBondContact OD2-CD 3.46Å; D112-R114 WeakPolarHBondContact OD2-CG 3.33Å; D112-R114 IonicContact OD2-CZ 3.77Å; D112-R114 IonicContact OD2-NE 3Å; D112-R114 PolarHBondContact OD2-NE 2.97Å; D112-R114 IonicContact OD2-NH1 3.91Å; D112-R114 IonicContact OD2-NH2 3.29Å
113	G	59.8	Low	54.4	Low	8 Å²	8	94 Å²	94	8%	0.082	47%	0.473	C	S	.	.	S	Bend	trans	72.5	5.7	179.7	0	0	0	0	0	115	T80 P124	T80-G113 VanDerWaalsContact OG1-C 3.27Å; T80-G113 VanDerWaalsContact OG1-CA 3.25Å; T80-G113 WeakPolarHBondContact OG1-CA 3.34Å; G113-P124 WeakPolarHBondContact O-CD 3.18Å
114	R	63.5	Low	57.6	Low	77 Å²	77	88.5 Å²	88.5	29%	0.291	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-78.1	136.3	179.3	-67.1	-177.2	-172.6	170.3	10.5	112.2	T80 S110 D112 K121 G122 L123	T80-R114 PolarHBondContact OG1-O 3.1Å; S110-R114 PolarHBondContact OG-O 3.43Å; D112-R114 PolarHBondContact O-N 2.96Å; D112-R114 WeakPolarHBondContact OD1-CB 3.41Å; D112-R114 WeakPolarHBondContact OD1-CG 3.45Å; D112-R114 PolarHBondContact OD1-N 2.85Å; D112-R114 WeakPolarHBondContact OD2-CD 3.46Å; D112-R114 WeakPolarHBondContact OD2-CG 3.33Å; D112-R114 IonicContact OD2-CZ 3.77Å; D112-R114 IonicContact OD2-NE 3Å; D112-R114 PolarHBondContact OD2-NE 2.97Å; D112-R114 IonicContact OD2-NH1 3.91Å; D112-R114 IonicContact OD2-NH2 3.29Å; R114-K121 HydrophobicContact CB-CB 4.32Å; R114-G122 CarbonylContact C-O 3.57Å; R114-G122 WeakPolarHBondContact CA-O 3.4Å; R114-L123 HydrophobicContact CG-CD2 3.89Å; R114-L123 HydrophobicContact CG-CG 4.27Å
115	L	74.6	Confident	60.6	Low	13 Å²	13	79.5 Å²	79.5	7%	0.068	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	131	169.1	179.3	65.1	0	0	0	110.4	K51 V117 K121 G122 P124 I127	K51-L115 VanDerWaalsContact NZ-CD1 3.27Å; L115-V117 HydrophobicContact CD2-CG2 4Å; L115-V117 HydrophobicContact CG-CG2 3.99Å; L115-K121 WeakPolarHBondContact O-CA 3.3Å; L115-G122 PolarHBondContact N-O 3Å; L115-G122 PolarHBondContact O-N 2.71Å; L115-P124 HydrophobicContact CB-CG 4.01Å; L115-I127 HydrophobicContact CB-CD1 4.39Å; L115-I127 HydrophobicContact CD2-CD1 4.47Å
116	Q	75.9	Confident	63.7	Low	79 Å²	79	74.9 Å²	74.9	37%	0.369	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.6	171	-172.7	167.2	-25.2	0	0	110.8	R120 K121	Q116-R120 CarbonylContact C-O 3.46Å; Q116-R120 WeakPolarHBondContact CA-O 3.46Å; Q116-K121 HydrophobicContact CB-CG 4.14Å; Q116-K121 HydrophobicContact CG-CG 4.2Å
117	V	72	Confident	66.9	Low	7 Å²	7	66.1 Å²	66.1	4%	0.042	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	113.6	172.5	-176.7	0	0	0	0	108.3	W40 K43 A44 L115 H119 R120	W40-V117 HydrophobicContact CZ2-CB 4.22Å; W40-V117 PolarHBondContact NE1-O 3.42Å; K43-V117 HydrophobicContact CB-CG1 4.02Å; A44-V117 HydrophobicContact CB-CG1 4.02Å; A44-V117 HydrophobicContact CB-CG2 4.44Å; L115-V117 HydrophobicContact CD2-CG2 4Å; L115-V117 HydrophobicContact CG-CG2 3.99Å; V117-H119 PolarHBondContact O-N 3.39Å; V117-R120 PolarHBondContact N-O 2.68Å; V117-R120 PolarHBondContact O-N 3.43Å
118	S	69	Low	70.1	Confident	52 Å²	52	57.8 Å²	57.8	36%	0.364	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	52.2	176.6	-164.7	0	0	0	0	113.3	K43 R120	K43-S118 PolarHBondContact NZ-OG 2.77Å; S118-R120 PolarHBondContact O-N 2.97Å
119	H	68.9	Low	73.2	Confident	166 Å²	166	52.2 Å²	52.2	77%	0.769	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.7	-4.9	-177.8	-50.2	-86.6	0	0	0	116.7	V117	V117-H119 PolarHBondContact O-N 3.39Å
120	R	73.5	Confident	76.1	Confident	125 Å²	125	48.1 Å²	48.1	47%	0.472	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.9	170.9	-60	-173.6	176.4	177.8	-3.8	110	Q116 V117 S118	Q116-R120 CarbonylContact C-O 3.46Å; Q116-R120 WeakPolarHBondContact CA-O 3.46Å; V117-R120 PolarHBondContact N-O 2.68Å; V117-R120 PolarHBondContact O-N 3.43Å; S118-R120 PolarHBondContact O-N 2.97Å
121	K	76.8	Confident	78.6	Confident	109 Å²	109	47.9 Å²	47.9	47%	0.474	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.2	173.6	-68.7	-176.8	177.3	-178.9	0	109.3	R114 L115 Q116	R114-K121 HydrophobicContact CB-CB 4.32Å; L115-K121 WeakPolarHBondContact O-CA 3.3Å; Q116-K121 HydrophobicContact CB-CG 4.14Å; Q116-K121 HydrophobicContact CG-CG 4.2Å
122	G	81.5	Confident	80.9	Confident	18 Å²	18	41.7 Å²	41.7	19%	0.186	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	159.2	176.5	0	0	0	0	0	111.7	R114 L115	R114-G122 CarbonylContact C-O 3.57Å; R114-G122 WeakPolarHBondContact CA-O 3.4Å; L115-G122 PolarHBondContact N-O 3Å; L115-G122 PolarHBondContact O-N 2.71Å
123	L	87.8	Confident	82.7	Confident	20 Å²	20	41.2 Å²	41.2	11%	0.105	19%	0.191	C	C	.	.			trans	-71.4	134	177.9	-68.4	169.4	0	0	0	109.8	R114 H125 V126 I127 H140 F153	R114-L123 HydrophobicContact CG-CD2 3.89Å; R114-L123 HydrophobicContact CG-CG 4.27Å; L123-H125 PolarHBondContact O-N 3.44Å; L123-V126 HydrophobicContact CB-CB 4.28Å; L123-V126 HydrophobicContact CB-CG2 3.86Å; L123-V126 HydrophobicContact CD1-CG2 4.43Å; L123-V126 PolarHBondContact O-N 3.37Å; L123-V126 VanDerWaalsContact O-N 3.16Å; L123-I127 WeakPolarHBondContact O-CG1 3.27Å; L123-I127 PolarHBondContact O-N 3.45Å; L123-H140 HydrophobicContact CD1-CB 3.65Å; L123-F153 HydrophobicContact CD1-CE1 4.18Å; L123-F153 HydrophobicContact CD1-CE2 4.39Å; L123-F153 HydrophobicContact CD1-CZ 3.83Å; L123-F153 HydrophobicContact CD2-CE2 3.7Å; L123-F153 HydrophobicContact CD2-CZ 3.77Å; L123-F153 HydrophobicContact CG-CZ 4.41Å
124	P	91.2	Very high	84.3	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.032	20%	0.195	C	C	.	.	H	α-helix	trans	-54.8	-49.6	-173.2	-27.3	32.4	0	0	0	114.3	I77 G113 L115 V126 I127 Y128 V160 V162	I77-P124 HydrophobicContact CD1-CB 3.55Å; I77-P124 HydrophobicContact CD1-CG 3.87Å; I77-P124 HydrophobicContact CG1-CB 4.26Å; G113-P124 WeakPolarHBondContact O-CD 3.18Å; L115-P124 HydrophobicContact CB-CG 4.01Å; P124-V126 VanDerWaalsContact C-N 3.3Å; P124-V126 PolarHBondContact O-N 3.1Å; P124-I127 PolarHBondContact O-N 3.33Å; P124-Y128 HydrophobicContact CB-CE2 4.34Å; P124-Y128 WeakPolarHBondContact O-CD2 3.47Å; P124-Y128 PolarHBondContact O-N 2.94Å; P124-Y128 VanDerWaalsContact O-N 3.14Å; P124-V160 HydrophobicContact CB-CG1 4.05Å; P124-V160 HydrophobicContact CG-CG1 3.97Å; P124-V162 HydrophobicContact CB-CG1 3.72Å
125	H	92.4	Very high	85.6	Confident	3 Å²	3	40.9 Å²	40.9	1%	0.014	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-37.6	-178.8	63.6	-77.7	0	0	0	112	L123 C129 H140 F153 V160 Y167	L123-H125 PolarHBondContact O-N 3.44Å; H125-C129 VanDerWaalsContact O-CB 3.27Å; H125-C129 WeakPolarHBondContact O-CB 3.36Å; H125-C129 PolarHBondContact O-N 3.14Å; H125-C129 PolarHBondContact O-SG 3.39Å; H125-H140 WeakPolarHBondContact NE2-CB 3.29Å; H125-F153 AromaticContact CE1-CD1 3.42Å; H125-F153 VanDerWaalsContact CE1-CD1 3.42Å; H125-F153 WeakPolarHBondContact CE1-CD1 3.26Å; H125-F153 AromaticContact CE1-CD2 3.36Å; H125-F153 WeakPolarHBondContact CE1-CD2 2.96Å; H125-F153 AromaticContact CE1-CE1 3.91Å; H125-F153 AromaticContact CE1-CE2 3.85Å; H125-F153 AromaticContact CE1-CG 3.11Å; H125-F153 WeakPolarHBondContact CE1-CG 3.26Å; H125-F153 AromaticContact ND1-CD2 3.62Å; H125-F153 AromaticContact ND1-CG 3.61Å; H125-F153 AromaticContact NE2-CD1 3.76Å; H125-F153 AromaticContact NE2-CG 3.74Å; H125-V160 HydrophobicContact CB-CG2 4.49Å; H125-Y167 HydrophobicContact CB-CE1 4.14Å; H125-Y167 HydrophobicContact CB-CE2 3.7Å; H125-Y167 VanDerWaalsContact CB-CZ 3.48Å; H125-Y167 WeakPolarHBondContact CB-OH 3.38Å; H125-Y167 AromaticContact CD2-CE1 3.87Å; H125-Y167 AromaticContact CG-CZ 3.98Å
126	V	92.3	Very high	86.1	Confident	11 Å²	11	43.9 Å²	43.9	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-47.2	174.9	-177.4	0	0	0	0	111.1	L123 P124 Y128 C129 R130 L137 H140 L143	L123-V126 HydrophobicContact CB-CB 4.28Å; L123-V126 HydrophobicContact CB-CG2 3.86Å; L123-V126 HydrophobicContact CD1-CG2 4.43Å; L123-V126 PolarHBondContact O-N 3.37Å; L123-V126 VanDerWaalsContact O-N 3.16Å; P124-V126 VanDerWaalsContact C-N 3.3Å; P124-V126 PolarHBondContact O-N 3.1Å; V126-Y128 VanDerWaalsContact C-N 3.3Å; V126-Y128 PolarHBondContact O-N 2.85Å; V126-C129 PolarHBondContact O-N 3.47Å; V126-R130 VanDerWaalsContact O-CB 3.26Å; V126-R130 WeakPolarHBondContact O-CB 3.28Å; V126-R130 PolarHBondContact O-N 3.35Å; V126-L137 HydrophobicContact CG1-CD2 3.83Å; V126-L137 HydrophobicContact CG1-CG 4.28Å; V126-H140 HydrophobicContact CG2-CB 3.52Å; V126-L143 HydrophobicContact CG2-CD1 4.47Å
127	I	92.2	Very high	86.7	Confident	10 Å²	10	40.1 Å²	40.1	5%	0.051	19%	0.19	C	C	.	.	H	α-helix	trans	-55.5	-47.2	179.9	-70.3	167.4	0	0	0	110.8	W40 A44 L115 L123 P124 R130 L131	W40-I127 HydrophobicContact CH2-CB 4.47Å; W40-I127 HydrophobicContact CH2-CG1 4.17Å; W40-I127 HydrophobicContact CH2-CG2 3.7Å; W40-I127 HydrophobicContact CZ2-CG2 4.46Å; W40-I127 HydrophobicContact CZ3-CG2 4.42Å; A44-I127 HydrophobicContact CB-CG2 4.42Å; L115-I127 HydrophobicContact CB-CD1 4.39Å; L115-I127 HydrophobicContact CD2-CD1 4.47Å; L123-I127 WeakPolarHBondContact O-CG1 3.27Å; L123-I127 PolarHBondContact O-N 3.45Å; P124-I127 PolarHBondContact O-N 3.33Å; I127-R130 PolarHBondContact O-N 3.18Å; I127-L131 PolarHBondContact O-N 3.31Å; I127-L131 VanDerWaalsContact O-N 3.1Å
128	Y	94.5	Very high	87.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-80.8	-33.3	-174.2	-65.2	-52.3	0	0	0	113.2	L48 I77 P124 V126 R130 L131 W132 V162	L48-Y128 HydrophobicContact CB-CE1 3.77Å; L48-Y128 WeakPolarHBondContact CB-OH 3.5Å; L48-Y128 HydrophobicContact CD1-CE1 4.36Å; L48-Y128 HydrophobicContact CD1-CE2 3.83Å; L48-Y128 HydrophobicContact CD2-CD1 3.81Å; L48-Y128 HydrophobicContact CD2-CD2 4.44Å; L48-Y128 HydrophobicContact CD2-CE1 3.61Å; L48-Y128 HydrophobicContact CD2-CE2 4.27Å; L48-Y128 HydrophobicContact CD2-CG 4.25Å; L48-Y128 HydrophobicContact CG-CE1 4.09Å; L48-Y128 HydrophobicContact CG-CE2 4.44Å; I77-Y128 HydrophobicContact CD1-CE2 4.43Å; P124-Y128 HydrophobicContact CB-CE2 4.34Å; P124-Y128 WeakPolarHBondContact O-CD2 3.47Å; P124-Y128 PolarHBondContact O-N 2.94Å; P124-Y128 VanDerWaalsContact O-N 3.14Å; V126-Y128 VanDerWaalsContact C-N 3.3Å; V126-Y128 PolarHBondContact O-N 2.85Å; Y128-R130 VanDerWaalsContact C-N 3.32Å; Y128-L131 PolarHBondContact O-N 3.29Å; Y128-W132 HydrophobicContact CD1-CE3 4.43Å; Y128-W132 AromaticContact CD1-CH2 3.69Å; Y128-W132 HydrophobicContact CD1-CH2 3.69Å; Y128-W132 AromaticContact CD1-CZ3 3.48Å; Y128-W132 HydrophobicContact CD1-CZ3 3.48Å; Y128-W132 VanDerWaalsContact CD1-CZ3 3.48Å; Y128-W132 HydrophobicContact CE1-CH2 4.39Å; Y128-W132 HydrophobicContact CG-CH2 4.39Å; Y128-W132 AromaticContact CG-CZ3 3.75Å; Y128-W132 HydrophobicContact CG-CZ3 3.75Å; Y128-W132 VanDerWaalsContact O-CE3 3.23Å; Y128-W132 PolarHBondContact O-N 3.1Å; Y128-W132 VanDerWaalsContact O-N 3.17Å; Y128-V162 HydrophobicContact CD2-CB 3.55Å; Y128-V162 HydrophobicContact CD2-CG1 3.58Å; Y128-V162 HydrophobicContact CD2-CG2 4.3Å; Y128-V162 HydrophobicContact CE2-CB 4.19Å; Y128-V162 HydrophobicContact CE2-CG1 3.92Å; Y128-V162 HydrophobicContact CG-CB 4.34Å
129	C	94.8	Very high	87.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.7	-40.5	167.5	-69	0	0	0	0	111.4	H125 V126 L131 R133 W134 L137 L143	H125-C129 VanDerWaalsContact O-CB 3.27Å; H125-C129 WeakPolarHBondContact O-CB 3.36Å; H125-C129 PolarHBondContact O-N 3.14Å; H125-C129 PolarHBondContact O-SG 3.39Å; V126-C129 PolarHBondContact O-N 3.47Å; C129-L131 VanDerWaalsContact C-N 3.31Å; C129-L131 PolarHBondContact O-N 2.95Å; C129-R133 WeakPolarHBondContact O-CA 3.3Å; C129-R133 WeakPolarHBondContact O-CB 3.3Å; C129-R133 PolarHBondContact O-N 3.05Å; C129-W134 HydrophobicContact CB-CE3 4.3Å; C129-W134 HydrophobicContact CB-CZ3 4.44Å; C129-W134 PolarHBondContact O-N 2.75Å; C129-W134 VanDerWaalsContact O-N 3.09Å; C129-L137 HydrophobicContact CB-CD2 3.81Å; C129-L143 HydrophobicContact CB-CD1 3.84Å; C129-L143 HydrophobicContact CB-CD2 4.44Å
130	R	93.5	Very high	88.6	Confident	88 Å²	88	36.2 Å²	36.2	33%	0.332	17%	0.167	S	C	.	.	H	α-helix	trans	-60.4	-42.7	176.1	-172.1	-173.8	-69	-174.6	-3.2	111.7	V126 I127 Y128 W134 P135 L137	V126-R130 VanDerWaalsContact O-CB 3.26Å; V126-R130 WeakPolarHBondContact O-CB 3.28Å; V126-R130 PolarHBondContact O-N 3.35Å; I127-R130 PolarHBondContact O-N 3.18Å; Y128-R130 VanDerWaalsContact C-N 3.32Å; R130-W134 VanDerWaalsContact CA-O 3.26Å; R130-W134 WeakPolarHBondContact CA-O 3.38Å; R130-W134 CarbonylContact O-C 3.54Å; R130-P135 WeakPolarHBondContact CG-O 3.39Å; R130-P135 WeakPolarHBondContact O-CA 3.32Å; R130-L137 HydrophobicContact CB-CB 4.34Å; R130-L137 HydrophobicContact CG-CB 4.5Å; R130-L137 PolarHBondContact NE-O 2.76Å; R130-L137 PolarHBondContact NH2-O 3.13Å
131	L	93.4	Very high	89.1	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.042	16%	0.155	C	C	.	.	H	α-helix	trans	-68.2	-43.6	-176.5	-157.6	149.8	0	0	0	112.7	K19 K20 C41 V45 I127 Y128 C129	K19-L131 WeakPolarHBondContact CA-O 3.32Å; K19-L131 HydrophobicContact CB-CD2 3.94Å; K19-L131 HydrophobicContact CD-CG 4.37Å; K19-L131 HydrophobicContact CG-CD2 3.8Å; K19-L131 HydrophobicContact CG-CG 3.95Å; K19-L131 WeakPolarHBondContact CG-O 3.34Å; K20-L131 PolarHBondContact N-O 2.88Å; C41-L131 HydrophobicContact CB-CD1 4.22Å; V45-L131 HydrophobicContact CG2-CD1 3.66Å; V45-L131 HydrophobicContact CG2-CD2 4.2Å; I127-L131 PolarHBondContact O-N 3.31Å; I127-L131 VanDerWaalsContact O-N 3.1Å; Y128-L131 PolarHBondContact O-N 3.29Å; C129-L131 VanDerWaalsContact C-N 3.31Å; C129-L131 PolarHBondContact O-N 2.95Å
132	W	95.1	Very high	89.7	Confident	3 Å²	3	27.9 Å²	27.9	1%	0.011	14%	0.135	C	C	.	.	H	α-helix	trans	-105.8	-12.5	-170.6	-68.1	-58.6	0	0	0	115.7	L15 K20 V45 L48 L61 I65 Y128 P164	L15-W132 HydrophobicContact CB-CZ2 4.26Å; L15-W132 HydrophobicContact CD2-CZ2 4.21Å; L15-W132 PolarHBondContact O-NE1 3.37Å; K20-W132 VanDerWaalsContact CG-O 3.31Å; K20-W132 WeakPolarHBondContact CG-O 3.33Å; V45-W132 HydrophobicContact CG2-CZ2 4.12Å; L48-W132 HydrophobicContact CD2-CH2 3.55Å; L48-W132 HydrophobicContact CD2-CZ3 3.96Å; L61-W132 HydrophobicContact CD1-CZ3 4.32Å; L61-W132 HydrophobicContact CD2-CH2 4.12Å; L61-W132 HydrophobicContact CD2-CZ3 4.45Å; I65-W132 HydrophobicContact CD1-CD2 3.59Å; I65-W132 HydrophobicContact CD1-CE3 3.98Å; I65-W132 HydrophobicContact CD1-CG 3.98Å; I65-W132 HydrophobicContact CD1-CH2 4.33Å; I65-W132 HydrophobicContact CD1-CZ2 3.95Å; I65-W132 HydrophobicContact CD1-CZ3 4.3Å; I65-W132 HydrophobicContact CG1-CD2 4.31Å; I65-W132 HydrophobicContact CG1-CG 4.34Å; Y128-W132 HydrophobicContact CD1-CE3 4.43Å; Y128-W132 AromaticContact CD1-CH2 3.69Å; Y128-W132 HydrophobicContact CD1-CH2 3.69Å; Y128-W132 AromaticContact CD1-CZ3 3.48Å; Y128-W132 HydrophobicContact CD1-CZ3 3.48Å; Y128-W132 VanDerWaalsContact CD1-CZ3 3.48Å; Y128-W132 HydrophobicContact CE1-CH2 4.39Å; Y128-W132 HydrophobicContact CG-CH2 4.39Å; Y128-W132 AromaticContact CG-CZ3 3.75Å; Y128-W132 HydrophobicContact CG-CZ3 3.75Å; Y128-W132 VanDerWaalsContact O-CE3 3.23Å; Y128-W132 PolarHBondContact O-N 3.1Å; Y128-W132 VanDerWaalsContact O-N 3.17Å; W132-P164 HydrophobicContact CB-CB 4.43Å; W132-P164 HydrophobicContact CB-CG 4.12Å; W132-P164 HydrophobicContact CE3-CG 4.09Å
133	R	93.8	Very high	90.2	Very high	63 Å²	63	27.9 Å²	27.9	24%	0.238	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-57.3	-176.7	-64.3	-170.5	68.8	-172.2	-0.3	113.7	C129 P164 Y167	C129-R133 WeakPolarHBondContact O-CA 3.3Å; C129-R133 WeakPolarHBondContact O-CB 3.3Å; C129-R133 PolarHBondContact O-N 3.05Å; R133-P164 WeakPolarHBondContact CD-O 3.43Å; R133-P164 HydrophobicContact CG-CB 3.94Å; R133-P164 PolarHBondContact NH1-O 3.35Å; R133-Y167 PolarHBondContact NH1-O 3.16Å
134	W	92.9	Very high	90.4	Very high	43 Å²	43	33.5 Å²	33.5	16%	0.163	16%	0.155	C	C	.	.			trans	-132	89.7	-168.7	-57.3	-67.9	0	0	0	111.2	C129 R130 D136 L137 L143 R169	C129-W134 HydrophobicContact CB-CE3 4.3Å; C129-W134 HydrophobicContact CB-CZ3 4.44Å; C129-W134 PolarHBondContact O-N 2.75Å; C129-W134 VanDerWaalsContact O-N 3.09Å; R130-W134 VanDerWaalsContact CA-O 3.26Å; R130-W134 WeakPolarHBondContact CA-O 3.38Å; R130-W134 CarbonylContact O-C 3.54Å; W134-D136 PolarHBondContact O-N 3.38Å; W134-D136 VanDerWaalsContact O-N 3.1Å; W134-L137 HydrophobicContact CB-CB 4.06Å; W134-L137 WeakPolarHBondContact O-CB 3.31Å; W134-L137 PolarHBondContact O-N 3.21Å; W134-L143 HydrophobicContact CE3-CD2 3.81Å; W134-L143 HydrophobicContact CH2-CD2 4.32Å; W134-L143 HydrophobicContact CZ3-CD2 3.43Å; W134-L143 VanDerWaalsContact CZ3-CD2 3.43Å; W134-R169 HydrophobicContact CD2-CB 4.14Å; W134-R169 HydrophobicContact CE3-CB 4.44Å; W134-R169 HydrophobicContact CH2-CB 3.82Å; W134-R169 HydrophobicContact CZ2-CB 3.5Å; W134-R169 VanDerWaalsContact CZ2-CB 3.5Å; W134-R169 HydrophobicContact CZ3-CB 4.31Å
135	P	90.7	Very high	90.5	Very high	35 Å²	35	34.2 Å²	34.2	23%	0.227	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.9	-179.2	-27.2	36.5	0	0	0	114.1	K20 A22 R130 L137	K20-P135 HydrophobicContact CB-CG 3.5Å; K20-P135 WeakPolarHBondContact O-CG 3.35Å; A22-P135 HydrophobicContact CB-CB 3.99Å; R130-P135 WeakPolarHBondContact CG-O 3.39Å; R130-P135 WeakPolarHBondContact O-CA 3.32Å; P135-L137 VanDerWaalsContact C-N 3.34Å
136	D	86.9	Confident	90.6	Very high	76 Å²	76	35 Å²	35	41%	0.406	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	10.1	179.7	66.5	-45.1	0	0	0	113.8	W134 H138 R169	W134-D136 PolarHBondContact O-N 3.38Å; W134-D136 VanDerWaalsContact O-N 3.1Å; D136-H138 PolarHBondContact O-CE1 2.97Å; D136-H138 PolarHBondContact O-N 3.38Å; D136-H138 PolarHBondContact O-ND1 2.73Å; D136-R169 VanDerWaalsContact CG-NH1 3.3Å; D136-R169 IonicContact OD1-CZ 3.77Å; D136-R169 IonicContact OD1-NH1 2.91Å; D136-R169 PolarHBondContact OD1-NH1 3.1Å; D136-R169 VanDerWaalsContact OD1-NH1 3.13Å; D136-R169 IonicContact OD1-NH2 3.2Å; D136-R169 IonicContact OD2-CZ 3.73Å; D136-R169 IonicContact OD2-NH1 2.88Å; D136-R169 PolarHBondContact OD2-NH1 3.35Å; D136-R169 IonicContact OD2-NH2 3.7Å; D136-R169 PolarHBondContact OD2-NH2 2.97Å
137	L	88	Confident	90.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.204	C	C	.	.			trans	-73.7	119.5	177.4	-177.1	75.3	0	0	0	110.8	V126 C129 R130 W134 P135 E142 L143	V126-L137 HydrophobicContact CG1-CD2 3.83Å; V126-L137 HydrophobicContact CG1-CG 4.28Å; C129-L137 HydrophobicContact CB-CD2 3.81Å; R130-L137 HydrophobicContact CB-CB 4.34Å; R130-L137 HydrophobicContact CG-CB 4.5Å; R130-L137 PolarHBondContact NE-O 2.76Å; R130-L137 PolarHBondContact NH2-O 3.13Å; W134-L137 HydrophobicContact CB-CB 4.06Å; W134-L137 WeakPolarHBondContact O-CB 3.31Å; W134-L137 PolarHBondContact O-N 3.21Å; P135-L137 VanDerWaalsContact C-N 3.34Å; L137-E142 HydrophobicContact CD1-CB 3.51Å; L137-E142 HydrophobicContact CD1-CG 4.39Å; L137-L143 HydrophobicContact CD1-CD2 3.8Å; L137-L143 HydrophobicContact CD1-CG 3.94Å; L137-L143 HydrophobicContact CD2-CD1 3.68Å; L137-L143 HydrophobicContact CD2-CD2 3.99Å; L137-L143 HydrophobicContact CD2-CG 3.91Å
138	H	81	Confident	90.5	Very high	77 Å²	77	48.7 Å²	48.7	36%	0.356	23%	0.232	S	C	.	.			trans	-100.3	-37.9	-176.2	-63.9	85.2	0	0	0	113.2	D136 E142	D136-H138 PolarHBondContact O-CE1 2.97Å; D136-H138 PolarHBondContact O-N 3.38Å; D136-H138 PolarHBondContact O-ND1 2.73Å; H138-E142 WeakPolarHBondContact CA-OE1 3.35Å; H138-E142 WeakPolarHBondContact CB-OE1 3.35Å; H138-E142 PolarHBondContact N-OE1 3.5Å
139	S	83.2	Confident	90.5	Very high	15 Å²	15	49 Å²	49	11%	0.105	23%	0.234	C	C	.	.			trans	-129.5	156.4	-171.1	-173	0	0	0	0	113.1	H141 E142	S139-H141 PolarHBondContact O-N 3.2Å; S139-H141 PolarHBondContact OG-CD2 2.9Å; S139-H141 PolarHBondContact OG-N 2.84Å; S139-E142 PolarHBondContact N-OE1 3.29Å; S139-E142 PolarHBondContact O-N 2.83Å
140	H	86.1	Confident	90.4	Very high	51 Å²	51	55 Å²	55	24%	0.236	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-67.1	-24.1	169.8	72	-68.2	0	0	0	113.2	L123 H125 V126 E142 L143 F153	L123-H140 HydrophobicContact CD1-CB 3.65Å; H125-H140 WeakPolarHBondContact NE2-CB 3.29Å; V126-H140 HydrophobicContact CG2-CB 3.52Å; H140-E142 PolarHBondContact O-N 3.47Å; H140-L143 PolarHBondContact O-N 3.3Å; H140-F153 AromaticContact CD2-CE1 3.53Å
141	H	84	Confident	90.4	Very high	45 Å²	45	53.8 Å²	53.8	21%	0.208	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-66.8	-21.1	177.4	-62.4	-59.6	0	0	0	112.5	S139 L143 Y339 I341	S139-H141 PolarHBondContact O-N 3.2Å; S139-H141 PolarHBondContact OG-CD2 2.9Å; S139-H141 PolarHBondContact OG-N 2.84Å; H141-L143 PolarHBondContact O-N 2.73Å; H141-Y339 HydrophobicContact CB-CD2 4.23Å; H141-Y339 HydrophobicContact CB-CE2 3.87Å; H141-Y339 AromaticContact CD2-CE1 3.66Å; H141-Y339 AromaticContact CD2-CE2 3.54Å; H141-Y339 AromaticContact CD2-CZ 3.36Å; H141-Y339 AromaticContact CE1-CZ 3.83Å; H141-Y339 PolarHBondContact CE1-OH 2.91Å; H141-Y339 AromaticContact CG-CE2 3.63Å; H141-Y339 AromaticContact CG-CZ 3.78Å; H141-Y339 AromaticContact NE2-CE1 3.65Å; H141-Y339 AromaticContact NE2-CZ 3.45Å; H141-Y339 PolarHBondContact NE2-OH 3.11Å; H141-I341 HydrophobicContact CB-CD1 3.18Å
142	E	89	Confident	90.3	Very high	14 Å²	14	53.6 Å²	53.6	7%	0.065	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-77.2	-2.9	173.6	-67.1	174.7	-99.4	0	0	112.5	L137 H138 S139 H140 R169 V170 I341	L137-E142 HydrophobicContact CD1-CB 3.51Å; L137-E142 HydrophobicContact CD1-CG 4.39Å; H138-E142 WeakPolarHBondContact CA-OE1 3.35Å; H138-E142 WeakPolarHBondContact CB-OE1 3.35Å; H138-E142 PolarHBondContact N-OE1 3.5Å; S139-E142 PolarHBondContact N-OE1 3.29Å; S139-E142 PolarHBondContact O-N 2.83Å; H140-E142 PolarHBondContact O-N 3.47Å; E142-R169 CarbonylContact O-C 3.57Å; E142-R169 WeakPolarHBondContact O-CA 3.36Å; E142-R169 IonicContact OE2-NE 2.67Å; E142-R169 IonicContact OE2-NH2 3.94Å; E142-R169 PolarHBondContact OE2-NH2 3.06Å; E142-V170 PolarHBondContact O-N 2.76Å; E142-I341 HydrophobicContact CG-CD1 3.85Å; E142-I341 HydrophobicContact CG-CG1 4.05Å; E142-I341 HydrophobicContact CG-CG2 4.25Å
143	L	92.2	Very high	90	Very high	18 Å²	18	56.5 Å²	56.5	9%	0.094	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.9	179.8	-63.2	-179.1	0	0	0	111.3	V126 C129 W134 L137 H140 H141 Y167 Q168	V126-L143 HydrophobicContact CG2-CD1 4.47Å; C129-L143 HydrophobicContact CB-CD1 3.84Å; C129-L143 HydrophobicContact CB-CD2 4.44Å; W134-L143 HydrophobicContact CE3-CD2 3.81Å; W134-L143 HydrophobicContact CH2-CD2 4.32Å; W134-L143 HydrophobicContact CZ3-CD2 3.43Å; W134-L143 VanDerWaalsContact CZ3-CD2 3.43Å; L137-L143 HydrophobicContact CD1-CD2 3.8Å; L137-L143 HydrophobicContact CD1-CG 3.94Å; L137-L143 HydrophobicContact CD2-CD1 3.68Å; L137-L143 HydrophobicContact CD2-CD2 3.99Å; L137-L143 HydrophobicContact CD2-CG 3.91Å; H140-L143 PolarHBondContact O-N 3.3Å; H141-L143 PolarHBondContact O-N 2.73Å; L143-Y167 HydrophobicContact CB-CD1 4.18Å; L143-Y167 HydrophobicContact CD1-CD1 4.39Å; L143-Y167 HydrophobicContact CD1-CG 4.35Å; L143-Q168 CarbonylContact C-O 3.49Å; L143-Q168 WeakPolarHBondContact CA-O 3.37Å
144	K	92.2	Very high	89.6	Confident	138 Å²	138	59 Å²	59	60%	0.6	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.9	166.9	-171.2	-178.9	178.7	-175.1	0	109.1	Y167 Q168 V170	K144-Y167 CarbonylContact O-C 3.54Å; K144-Y167 VanDerWaalsContact O-CA 3.31Å; K144-Y167 WeakPolarHBondContact O-CA 3.32Å; K144-Q168 PolarHBondContact N-O 2.94Å; K144-Q168 PolarHBondContact O-N 3.01Å; K144-V170 HydrophobicContact CB-CG2 4.43Å
145	A	93.5	Very high	89.4	Confident	20 Å²	20	60.8 Å²	60.8	17%	0.165	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	145.8	173.2	0	0	0	0	0	110.8	C149 A152 H166 Y167	A145-C149 HydrophobicContact CB-CB 4.48Å; A145-A152 HydrophobicContact CB-CB 3.35Å; A145-H166 CarbonylContact C-O 3.54Å; A145-H166 WeakPolarHBondContact CA-O 3.18Å; A145-Y167 HydrophobicContact CB-CD1 4.2Å; A145-Y167 HydrophobicContact CB-CE1 4.12Å
146	I	93.9	Very high	89	Confident	20 Å²	20	68.3 Å²	68.3	10%	0.103	33%	0.33	C	S	.	.			trans	-68.2	152.7	170.4	66.9	176.3	0	0	0	110	C70 N148 C149 H166 Q168	C70-I146 HydrophobicContact CB-CD1 3.85Å; C70-I146 WeakPolarHBondContact O-CD1 3.38Å; I146-N148 HydrophobicContact CD1-CB 4.49Å; I146-N148 PolarHBondContact O-N 3.38Å; I146-C149 HydrophobicContact CG1-CB 3.96Å; I146-C149 WeakPolarHBondContact O-CB 3.38Å; I146-C149 PolarHBondContact O-N 2.94Å; I146-C149 VanDerWaalsContact O-N 3.07Å; I146-H166 HydrophobicContact CD1-CB 4.31Å; I146-H166 HydrophobicContact CG1-CB 4.29Å; I146-H166 PolarHBondContact N-O 3.01Å; I146-Q168 HydrophobicContact CG2-CG 3.98Å
147	E	91.3	Very high	89	Confident	189 Å²	189	69.2 Å²	69.2	88%	0.883	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-31.6	-176.1	-62.6	-178.7	173.8	0	0	112.9	C149	E147-C149 PolarHBondContact O-N 2.93Å
148	N	91.3	Very high	88.9	Confident	119 Å²	119	74.4 Å²	74.4	64%	0.636	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	2.1	-179.5	-62.7	-8.1	0	0	0	113.9	I146 E150	I146-N148 HydrophobicContact CD1-CB 4.49Å; I146-N148 PolarHBondContact O-N 3.38Å; N148-E150 PolarHBondContact O-N 2.96Å
149	C	93.6	Very high	89.3	Confident	6 Å²	6	73.6 Å²	73.6	4%	0.041	35%	0.354	C	S	.	.			trans	-84.5	102.7	-179.1	-169.5	0	0	0	0	111.5	A145 I146 E147 Y151 A152 C161 H166	A145-C149 HydrophobicContact CB-CB 4.48Å; I146-C149 HydrophobicContact CG1-CB 3.96Å; I146-C149 WeakPolarHBondContact O-CB 3.38Å; I146-C149 PolarHBondContact O-N 2.94Å; I146-C149 VanDerWaalsContact O-N 3.07Å; E147-C149 PolarHBondContact O-N 2.93Å; C149-Y151 PolarHBondContact O-N 3.29Å; C149-A152 HydrophobicContact CB-CB 4.15Å; C149-C161 VanDerWaalsContact SG-CB 3.56Å; C149-H166 HydrophobicContact CB-CB 4.2Å
150	E	93.7	Very high	89.8	Confident	126 Å²	126	73.1 Å²	73.1	59%	0.589	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-17.9	-179.1	-63.2	179.8	165.5	0	0	114.5	N148 L155 K157	N148-E150 PolarHBondContact O-N 2.96Å; E150-L155 VanDerWaalsContact O-CD1 3.31Å; E150-L155 WeakPolarHBondContact O-CD1 3.42Å; E150-K157 WeakPolarHBondContact O-CD 3.48Å; E150-K157 WeakPolarHBondContact O-CE 3.47Å; E150-K157 PolarHBondContact O-NZ 3.38Å
151	Y	93.5	Very high	90.2	Very high	64 Å²	64	70.7 Å²	70.7	25%	0.251	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	30.7	-175.9	-62	-94.3	0	0	0	111.6	C74 T76 C149 K157 E159 C161	C74-Y151 HydrophobicContact CB-CD2 3.82Å; T76-Y151 HydrophobicContact CG2-CD1 3.85Å; T76-Y151 HydrophobicContact CG2-CD2 3.66Å; T76-Y151 HydrophobicContact CG2-CE1 4.42Å; T76-Y151 HydrophobicContact CG2-CE2 4.29Å; T76-Y151 HydrophobicContact CG2-CG 3.42Å; T76-Y151 VanDerWaalsContact CG2-CG 3.42Å; C149-Y151 PolarHBondContact O-N 3.29Å; Y151-K157 HydrophobicContact CD1-CD 4.11Å; Y151-K157 HydrophobicContact CE1-CD 4.46Å; Y151-E159 HydrophobicContact CD1-CB 4.03Å; Y151-E159 HydrophobicContact CE1-CB 4.45Å; Y151-C161 WeakPolarHBondContact O-CB 3.39Å; Y151-C161 PolarHBondContact O-N 3.32Å
152	A	91.5	Very high	90.7	Very high	4 Å²	4	68.6 Å²	68.6	3%	0.033	33%	0.33	C	S	.	.			trans	-57.6	145.5	177	0	0	0	0	0	111.9	A145 C149 N154 L155	A145-A152 HydrophobicContact CB-CB 3.35Å; C149-A152 HydrophobicContact CB-CB 4.15Å; A152-N154 VanDerWaalsContact C-N 3.26Å; A152-N154 WeakPolarHBondContact CB-OD1 3.48Å; A152-N154 PolarHBondContact O-N 3.15Å; A152-L155 HydrophobicContact CB-CD1 4.11Å; A152-L155 HydrophobicContact CB-CG 4.15Å; A152-L155 WeakPolarHBondContact O-CB 3.15Å; A152-L155 PolarHBondContact O-N 3.31Å
153	F	88.3	Confident	91	Very high	63 Å²	63	67.9 Å²	67.9	28%	0.276	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-55.2	-38.4	-176.7	174.3	-109	0	0	0	113.9	L123 H125 H140 L155 K156 V160	L123-F153 HydrophobicContact CD1-CE1 4.18Å; L123-F153 HydrophobicContact CD1-CE2 4.39Å; L123-F153 HydrophobicContact CD1-CZ 3.83Å; L123-F153 HydrophobicContact CD2-CE2 3.7Å; L123-F153 HydrophobicContact CD2-CZ 3.77Å; L123-F153 HydrophobicContact CG-CZ 4.41Å; H125-F153 AromaticContact CE1-CD1 3.42Å; H125-F153 VanDerWaalsContact CE1-CD1 3.42Å; H125-F153 WeakPolarHBondContact CE1-CD1 3.26Å; H125-F153 AromaticContact CE1-CD2 3.36Å; H125-F153 WeakPolarHBondContact CE1-CD2 2.96Å; H125-F153 AromaticContact CE1-CE1 3.91Å; H125-F153 AromaticContact CE1-CE2 3.85Å; H125-F153 AromaticContact CE1-CG 3.11Å; H125-F153 WeakPolarHBondContact CE1-CG 3.26Å; H125-F153 AromaticContact ND1-CD2 3.62Å; H125-F153 AromaticContact ND1-CG 3.61Å; H125-F153 AromaticContact NE2-CD1 3.76Å; H125-F153 AromaticContact NE2-CG 3.74Å; H140-F153 AromaticContact CD2-CE1 3.53Å; F153-L155 PolarHBondContact O-N 3.46Å; F153-K156 PolarHBondContact O-N 3.39Å; F153-V160 HydrophobicContact CB-CG2 4.04Å; F153-V160 HydrophobicContact CD2-CG2 4.16Å
154	N	85	Confident	91.2	Very high	115 Å²	115	67 Å²	67	62%	0.615	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18	178.8	61.9	-41	0	0	0	113.8	A152 K156	A152-N154 VanDerWaalsContact C-N 3.26Å; A152-N154 WeakPolarHBondContact CB-OD1 3.48Å; A152-N154 PolarHBondContact O-N 3.15Å; N154-K156 PolarHBondContact O-N 3.09Å
155	L	87.9	Confident	91.3	Very high	82 Å²	82	61.5 Å²	61.5	43%	0.429	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-75.7	-9.7	176.2	-60.9	175.6	0	0	0	113.1	E150 A152 F153 K157	E150-L155 VanDerWaalsContact O-CD1 3.31Å; E150-L155 WeakPolarHBondContact O-CD1 3.42Å; A152-L155 HydrophobicContact CB-CD1 4.11Å; A152-L155 HydrophobicContact CB-CG 4.15Å; A152-L155 WeakPolarHBondContact O-CB 3.15Å; A152-L155 PolarHBondContact O-N 3.31Å; F153-L155 PolarHBondContact O-N 3.46Å; L155-K157 HydrophobicContact CB-CG 4.16Å; L155-K157 PolarHBondContact O-N 2.87Å; L155-K157 VanDerWaalsContact O-N 3.1Å
156	K	83.3	Confident	91.5	Very high	192 Å²	192	60.7 Å²	60.7	84%	0.835	29%	0.291	S	S	*	.			trans	50.1	36.2	176.3	-60.3	-178.9	179.5	179.9	0	114.3	F153 N154	F153-K156 PolarHBondContact O-N 3.39Å; N154-K156 PolarHBondContact O-N 3.09Å
157	K	86.7	Confident	91.6	Very high	95 Å²	95	60 Å²	60	41%	0.413	29%	0.287	S	S	.	.			trans	-76.3	167.3	175.3	-67.2	-174.3	175.4	-178.9	0	111.4	S79 E150 Y151 L155 E159	S79-K157 PolarHBondContact OG-O 3.42Å; E150-K157 WeakPolarHBondContact O-CD 3.48Å; E150-K157 WeakPolarHBondContact O-CE 3.47Å; E150-K157 PolarHBondContact O-NZ 3.38Å; Y151-K157 HydrophobicContact CD1-CD 4.11Å; Y151-K157 HydrophobicContact CE1-CD 4.46Å; L155-K157 HydrophobicContact CB-CG 4.16Å; L155-K157 PolarHBondContact O-N 2.87Å; L155-K157 VanDerWaalsContact O-N 3.1Å; K157-E159 PolarHBondContact O-N 3.28Å
158	D	86	Confident	91.7	Very high	110 Å²	110	56.2 Å²	56.2	59%	0.588	27%	0.269	S	S	*	.	S	Bend	trans	-62	-22.9	175.9	-67.1	-38.4	0	0	0	113.5	S79 S82	S79-D158 VanDerWaalsContact CB-O 3.31Å; S79-D158 WeakPolarHBondContact CB-O 3.42Å; S79-D158 PolarHBondContact N-O 3.15Å; S79-D158 PolarHBondContact OG-O 3.34Å; S82-D158 VanDerWaalsContact CB-OD1 3.26Å; S82-D158 WeakPolarHBondContact CB-OD1 3.45Å; S82-D158 VanDerWaalsContact OG-CA 3.32Å; S82-D158 WeakPolarHBondContact OG-CA 3.35Å; S82-D158 WeakPolarHBondContact OG-CB 3.23Å; S82-D158 PolarHBondContact OG-OD1 3.42Å
159	E	90	Very high	91.7	Very high	59 Å²	59	54.1 Å²	54.1	28%	0.276	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	151	171.6	-54.9	-164.4	125.2	0	0	111.6	T76 I77 Y151 K157	T76-E159 VanDerWaalsContact CB-OE2 3.3Å; T76-E159 WeakPolarHBondContact CB-OE2 3.43Å; T76-E159 HydrophobicContact CG2-CB 4.4Å; T76-E159 PolarHBondContact OG1-OE2 3.2Å; I77-E159 WeakPolarHBondContact O-CA 3.36Å; Y151-E159 HydrophobicContact CD1-CB 4.03Å; Y151-E159 HydrophobicContact CE1-CB 4.45Å; K157-E159 PolarHBondContact O-N 3.28Å
160	V	92.4	Very high	91.5	Very high	6 Å²	6	56.4 Å²	56.4	4%	0.036	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.6	176.1	62.9	0	0	0	0	110.7	T76 I77 P124 H125 F153	T76-V160 WeakPolarHBondContact CA-O 3.28Å; I77-V160 HydrophobicContact CG1-CG1 3.87Å; I77-V160 PolarHBondContact N-O 3.29Å; I77-V160 PolarHBondContact O-N 3.07Å; P124-V160 HydrophobicContact CB-CG1 4.05Å; P124-V160 HydrophobicContact CG-CG1 3.97Å; H125-V160 HydrophobicContact CB-CG2 4.49Å; F153-V160 HydrophobicContact CB-CG2 4.04Å; F153-V160 HydrophobicContact CD2-CG2 4.16Å
161	C	95.5	Very high	90.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	129.9	173.4	-169.1	0	0	0	0	110.2	V75 C149 Y151 H166 Y167	V75-C161 CarbonylContact O-C 3.44Å; V75-C161 VanDerWaalsContact O-CA 3.3Å; V75-C161 WeakPolarHBondContact O-CA 3.5Å; C149-C161 VanDerWaalsContact SG-CB 3.56Å; Y151-C161 WeakPolarHBondContact O-CB 3.39Å; Y151-C161 PolarHBondContact O-N 3.32Å; C161-H166 PolarHBondContact SG-ND1 3.31Å; C161-Y167 WeakPolarHBondContact O-CE2 3.41Å; C161-Y167 PolarHBondContact O-OH 3.1Å
162	V	95	Very high	90.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.285	C	S	.	.			trans	-115.7	9.5	176.5	-64.7	0	0	0	0	112.5	L48 V75 I77 P124 Y128 P164	L48-V162 HydrophobicContact CD1-CG2 4.05Å; V75-V162 HydrophobicContact CB-CG2 4.3Å; V75-V162 HydrophobicContact CG1-CG2 3.79Å; V75-V162 VanDerWaalsContact O-CG2 3.3Å; V75-V162 WeakPolarHBondContact O-CG2 3.46Å; V75-V162 PolarHBondContact O-N 3.36Å; I77-V162 HydrophobicContact CD1-CG1 3.98Å; I77-V162 HydrophobicContact CG1-CG1 3.86Å; I77-V162 HydrophobicContact CG2-CG2 4.08Å; P124-V162 HydrophobicContact CB-CG1 3.72Å; Y128-V162 HydrophobicContact CD2-CB 3.55Å; Y128-V162 HydrophobicContact CD2-CG1 3.58Å; Y128-V162 HydrophobicContact CD2-CG2 4.3Å; Y128-V162 HydrophobicContact CE2-CB 4.19Å; Y128-V162 HydrophobicContact CE2-CG1 3.92Å; Y128-V162 HydrophobicContact CG-CB 4.34Å; V162-P164 VanDerWaalsContact O-CD 3.3Å; V162-P164 WeakPolarHBondContact O-CD 3.19Å
163	N	95.4	Very high	89.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.296	C	S	.	.			trans	-66.3	114.3	171.1	-177.6	-17.2	0	0	0	108.7	A64 T72 K73 V75 Y165 H166 Y167	A64-N163 WeakPolarHBondContact CB-OD1 3.49Å; T72-N163 PolarHBondContact OG1-ND2 3.03Å; K73-N163 PolarHBondContact O-ND2 3.43Å; V75-N163 HydrophobicContact CB-CB 4.12Å; V75-N163 HydrophobicContact CG2-CB 4.11Å; N163-Y165 PolarHBondContact O-N 3.24Å; N163-Y165 VanDerWaalsContact O-N 3.16Å; N163-Y165 PolarHBondContact OD1-N 3.42Å; N163-H166 HydrophobicContact CB-CB 4.2Å; N163-H166 PolarHBondContact ND2-CD2 3.29Å; N163-H166 PolarHBondContact ND2-NE2 3.43Å; N163-H166 WeakPolarHBondContact O-CB 3.47Å; N163-H166 PolarHBondContact O-N 3.14Å; N163-Y167 WeakPolarHBondContact O-CD2 3.44Å
164	P	94.9	Very high	89.5	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-66.7	-19.3	-174.9	29.1	-36.3	0	0	0	113.2	I65 W132 R133 V162 H166	I65-P164 HydrophobicContact CG1-CG 4.37Å; W132-P164 HydrophobicContact CB-CB 4.43Å; W132-P164 HydrophobicContact CB-CG 4.12Å; W132-P164 HydrophobicContact CE3-CG 4.09Å; R133-P164 WeakPolarHBondContact CD-O 3.43Å; R133-P164 HydrophobicContact CG-CB 3.94Å; R133-P164 PolarHBondContact NH1-O 3.35Å; V162-P164 VanDerWaalsContact O-CD 3.3Å; V162-P164 WeakPolarHBondContact O-CD 3.19Å; P164-H166 VanDerWaalsContact C-N 3.33Å
165	Y	95.7	Very high	89.5	Confident	21 Å²	21	60.1 Å²	60.1	8%	0.082	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-87.4	-0.9	176.8	-65.3	-84.3	0	0	0	113.5	A64 Q68 C70 N163 Y167	A64-Y165 VanDerWaalsContact O-CD2 3.32Å; A64-Y165 WeakPolarHBondContact O-CD2 3.43Å; A64-Y165 WeakPolarHBondContact O-CE2 3.47Å; Q68-Y165 VanDerWaalsContact CA-CE1 3.42Å; Q68-Y165 VanDerWaalsContact CA-CZ 3.49Å; Q68-Y165 HydrophobicContact CB-CD1 4.19Å; Q68-Y165 HydrophobicContact CB-CE1 3.44Å; Q68-Y165 VanDerWaalsContact CB-CE1 3.44Å; Q68-Y165 HydrophobicContact CB-CE2 4.44Å; Q68-Y165 HydrophobicContact CG-CE1 4.05Å; Q68-Y165 WeakPolarHBondContact CG-OH 3.27Å; Q68-Y165 WeakPolarHBondContact O-CD1 3.42Å; Q68-Y165 PolarHBondContact OE1-OH 3.22Å; C70-Y165 WeakPolarHBondContact CA-O 3.46Å; C70-Y165 VanDerWaalsContact CB-O 3.31Å; C70-Y165 WeakPolarHBondContact CB-O 3.36Å; N163-Y165 PolarHBondContact O-N 3.24Å; N163-Y165 VanDerWaalsContact O-N 3.16Å; N163-Y165 PolarHBondContact OD1-N 3.42Å; Y165-Y167 VanDerWaalsContact C-N 3.3Å
166	H	96.6	Very high	89.4	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.019	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-90.2	2.5	169.2	-73.2	-165.7	0	0	0	113.3	C70 T72 C74 A145 I146 C149 C161 N163 P164	C70-H166 PolarHBondContact O-CD2 2.93Å; C70-H166 VanDerWaalsContact O-CD2 3.3Å; C70-H166 PolarHBondContact O-NE2 3.18Å; C70-H166 VanDerWaalsContact O-NE2 3.11Å; T72-H166 PolarHBondContact O-CE1 3.24Å; T72-H166 VanDerWaalsContact O-CE1 3.25Å; T72-H166 PolarHBondContact O-NE2 3.33Å; C74-H166 PolarHBondContact N-CE1 3.01Å; C74-H166 VanDerWaalsContact SG-CE1 3.55Å; A145-H166 CarbonylContact C-O 3.54Å; A145-H166 WeakPolarHBondContact CA-O 3.18Å; I146-H166 HydrophobicContact CD1-CB 4.31Å; I146-H166 HydrophobicContact CG1-CB 4.29Å; I146-H166 PolarHBondContact N-O 3.01Å; C149-H166 HydrophobicContact CB-CB 4.2Å; C161-H166 PolarHBondContact SG-ND1 3.31Å; N163-H166 HydrophobicContact CB-CB 4.2Å; N163-H166 PolarHBondContact ND2-CD2 3.29Å; N163-H166 PolarHBondContact ND2-NE2 3.43Å; N163-H166 WeakPolarHBondContact O-CB 3.47Å; N163-H166 PolarHBondContact O-N 3.14Å; P164-H166 VanDerWaalsContact C-N 3.33Å
167	Y	96	Very high	89.6	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	150.9	174.2	-61.5	-86.7	0	0	0	109.4	H125 R133 L143 K144 A145 C161 N163 Y165	H125-Y167 HydrophobicContact CB-CE1 4.14Å; H125-Y167 HydrophobicContact CB-CE2 3.7Å; H125-Y167 VanDerWaalsContact CB-CZ 3.48Å; H125-Y167 WeakPolarHBondContact CB-OH 3.38Å; H125-Y167 AromaticContact CD2-CE1 3.87Å; H125-Y167 AromaticContact CG-CZ 3.98Å; R133-Y167 PolarHBondContact NH1-O 3.16Å; L143-Y167 HydrophobicContact CB-CD1 4.18Å; L143-Y167 HydrophobicContact CD1-CD1 4.39Å; L143-Y167 HydrophobicContact CD1-CG 4.35Å; K144-Y167 CarbonylContact O-C 3.54Å; K144-Y167 VanDerWaalsContact O-CA 3.31Å; K144-Y167 WeakPolarHBondContact O-CA 3.32Å; A145-Y167 HydrophobicContact CB-CD1 4.2Å; A145-Y167 HydrophobicContact CB-CE1 4.12Å; C161-Y167 WeakPolarHBondContact O-CE2 3.41Å; C161-Y167 PolarHBondContact O-OH 3.1Å; N163-Y167 WeakPolarHBondContact O-CD2 3.44Å; Y165-Y167 VanDerWaalsContact C-N 3.3Å
168	Q	93.4	Very high	89.7	Confident	111 Å²	111	50.1 Å²	50.1	52%	0.519	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.2	170.7	-69.9	175.6	-7.7	0	0	107.1	L143 K144 I146	L143-Q168 CarbonylContact C-O 3.49Å; L143-Q168 WeakPolarHBondContact CA-O 3.37Å; K144-Q168 PolarHBondContact N-O 2.94Å; K144-Q168 PolarHBondContact O-N 3.01Å; I146-Q168 HydrophobicContact CG2-CG 3.98Å
169	R	91.4	Very high	89.7	Confident	74 Å²	74	49 Å²	49	28%	0.279	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	137.2	173.3	-169.9	172.5	-169.4	172.6	4.9	107.8	W134 D136 E142 E171	W134-R169 HydrophobicContact CD2-CB 4.14Å; W134-R169 HydrophobicContact CE3-CB 4.44Å; W134-R169 HydrophobicContact CH2-CB 3.82Å; W134-R169 HydrophobicContact CZ2-CB 3.5Å; W134-R169 VanDerWaalsContact CZ2-CB 3.5Å; W134-R169 HydrophobicContact CZ3-CB 4.31Å; D136-R169 VanDerWaalsContact CG-NH1 3.3Å; D136-R169 IonicContact OD1-CZ 3.77Å; D136-R169 IonicContact OD1-NH1 2.91Å; D136-R169 PolarHBondContact OD1-NH1 3.1Å; D136-R169 VanDerWaalsContact OD1-NH1 3.13Å; D136-R169 IonicContact OD1-NH2 3.2Å; D136-R169 IonicContact OD2-CZ 3.73Å; D136-R169 IonicContact OD2-NH1 2.88Å; D136-R169 PolarHBondContact OD2-NH1 3.35Å; D136-R169 IonicContact OD2-NH2 3.7Å; D136-R169 PolarHBondContact OD2-NH2 2.97Å; E142-R169 CarbonylContact O-C 3.57Å; E142-R169 WeakPolarHBondContact O-CA 3.36Å; E142-R169 IonicContact OE2-NE 2.67Å; E142-R169 IonicContact OE2-NH2 3.94Å; E142-R169 PolarHBondContact OE2-NH2 3.06Å; R169-E171 PolarHBondContact O-N 2.77Å
170	V	88.4	Confident	89.5	Confident	55 Å²	55	46.3 Å²	46.3	33%	0.333	25%	0.251	S	S	.	.			trans	-68.9	112.9	172.2	179.8	0	0	0	0	107.3	E142 K144 I341	E142-V170 PolarHBondContact O-N 2.76Å; K144-V170 HydrophobicContact CB-CG2 4.43Å; V170-I341 HydrophobicContact CB-CG2 3.93Å; V170-I341 HydrophobicContact CG1-CG2 3.91Å; V170-I341 HydrophobicContact CG2-CG2 4.47Å
171	E	82.2	Confident	88.8	Confident	168 Å²	168	47.8 Å²	47.8	79%	0.785	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-85.6	141.6	177.4	-67.1	179.9	-179.3	0	0	110	R169 P173	R169-E171 PolarHBondContact O-N 2.77Å; E171-P173 WeakPolarHBondContact O-CD 3.11Å
172	T	80	Confident	87.5	Confident	72 Å²	72	53.2 Å²	53.2	44%	0.442	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-73.3	119.9	171.3	-58.4	0	0	0	0	108.5
173	P	80.5	Confident	85.7	Confident	43 Å²	43	59.6 Å²	59.6	28%	0.279	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-64	140.4	179.5	26.9	-32.6	0	0	0	110.2	E171 L175 G342 Q388	E171-P173 WeakPolarHBondContact O-CD 3.11Å; P173-L175 PolarHBondContact O-N 3.22Å; P173-G342 WeakPolarHBondContact CD-O 3.42Å; P173-Q388 HydrophobicContact CG-CG 4.01Å
174	V	82.5	Confident	83.3	Confident	144 Å²	144	65.4 Å²	65.4	87%	0.873	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-68.1	120.7	173.3	-178	0	0	0	0	108.4
175	L	85.9	Confident	80.8	Confident	23 Å²	23	73.2 Å²	73.2	12%	0.12	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-82.5	135.4	178.7	-60.7	171.3	0	0	0	109.9	P173 Y268 N387 Q388 A391 W448	P173-L175 PolarHBondContact O-N 3.22Å; L175-Y268 HydrophobicContact CD1-CD1 4.06Å; L175-Y268 HydrophobicContact CD1-CD2 4.11Å; L175-Y268 HydrophobicContact CD1-CE1 4.46Å; L175-Y268 HydrophobicContact CD1-CE2 4.47Å; L175-Y268 HydrophobicContact CD1-CG 3.87Å; L175-N387 HydrophobicContact CD1-CB 3.89Å; L175-N387 HydrophobicContact CD2-CB 4.37Å; L175-Q388 HydrophobicContact CD2-CB 4.31Å; L175-Q388 HydrophobicContact CD2-CG 3.67Å; L175-A391 HydrophobicContact CD2-CB 4.29Å; L175-W448 HydrophobicContact CB-CH2 3.73Å; L175-W448 HydrophobicContact CB-CZ3 4.19Å; L175-W448 HydrophobicContact CD1-CE3 4.46Å; L175-W448 HydrophobicContact CD1-CH2 4.09Å; L175-W448 HydrophobicContact CD1-CZ3 3.65Å; L175-W448 HydrophobicContact CG-CH2 4.44Å; L175-W448 HydrophobicContact CG-CZ3 4.43Å
176	P	86	Confident	78.4	Confident	89 Å²	89	79.2 Å²	79.2	58%	0.578	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-66.2	146.4	177.6	28.4	-34.2	0	0	0	110.7	W448	P176-W448 WeakPolarHBondContact O-CZ2 3.35Å
177	P	87.3	Confident	75.8	Confident	65 Å²	65	87 Å²	87	42%	0.422	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-63.4	142.7	174.1	26.7	-33.1	0	0	0	111	P265 V266 T267	P177-P265 HydrophobicContact CB-CB 4.04Å; P177-P265 HydrophobicContact CG-CB 4.49Å; P177-V266 WeakPolarHBondContact CA-O 3.38Å; P177-T267 HydrophobicContact CB-CG2 4.06Å
178	V	87.6	Confident	73.1	Confident	4 Å²	4	92.7 Å²	92.7	2%	0.024	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	125.7	171.7	173.8	0	0	0	0	108.1	V180 V266 L394 A395 V398 W448 V452	V178-V180 HydrophobicContact CG1-CG2 4.35Å; V178-V266 PolarHBondContact N-O 3.47Å; V178-V266 PolarHBondContact O-N 2.83Å; V178-L394 HydrophobicContact CG1-CG 4.47Å; V178-L394 HydrophobicContact CG2-CD2 3.99Å; V178-L394 HydrophobicContact CG2-CG 4Å; V178-A395 HydrophobicContact CG2-CB 4.4Å; V178-V398 HydrophobicContact CG1-CG2 3.7Å; V178-W448 HydrophobicContact CG2-CH2 4.4Å; V178-W448 HydrophobicContact CG2-CZ2 3.62Å; V178-V452 HydrophobicContact CB-CG2 4.14Å; V178-V452 HydrophobicContact CG1-CG2 3.94Å
179	L	87.8	Confident	70.5	Confident	88 Å²	88	96.5 Å²	96.5	46%	0.461	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119	178.3	-58.3	-177.8	0	0	0	109.3	L263 P265	L179-L263 HydrophobicContact CB-CB 4.33Å; L179-L263 HydrophobicContact CB-CD2 4.24Å; L179-L263 HydrophobicContact CD1-CD1 4.19Å; L179-P265 HydrophobicContact CD2-CB 3.91Å
180	V	84.3	Confident	68.3	Low	1 Å²	1	99.3 Å²	99.3	1%	0.006	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.2	179.7	-175	0	0	0	0	109.6	V178 R182 Q264 V266 V452 Q455 M456	V178-V180 HydrophobicContact CG1-CG2 4.35Å; V180-R182 PolarHBondContact O-N 3.02Å; V180-Q264 PolarHBondContact N-O 3.34Å; V180-Q264 PolarHBondContact O-N 3.46Å; V180-V266 HydrophobicContact CG2-CG2 3.89Å; V180-V452 HydrophobicContact CG2-CB 4.44Å; V180-V452 HydrophobicContact CG2-CG1 3.9Å; V180-V452 HydrophobicContact CG2-CG2 4.32Å; V180-Q455 HydrophobicContact CB-CB 4.09Å; V180-Q455 HydrophobicContact CG1-CB 3.72Å; V180-Q455 HydrophobicContact CG2-CB 4.34Å; V180-M456 HydrophobicContact CG1-CG 3.89Å; V180-M456 HydrophobicContact CG1-SD 3.63Å
181	P	78.1	Confident	66.2	Low	37 Å²	37	101.5 Å²	101.5	24%	0.24	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	125.3	171.6	-18.3	30.8	0	0	0	110.6	H183 L263	P181-H183 PolarHBondContact O-N 3.37Å; P181-L263 HydrophobicContact CB-CD2 4.28Å; P181-L263 HydrophobicContact CG-CD2 3.97Å
182	R	67.5	Low	64.5	Low	115 Å²	115	99.7 Å²	99.7	43%	0.434	55%	0.547	S	S	.	.			trans	-69.8	120.4	167.1	-72.5	-177.4	174	170.2	-3.7	108.9	V180 T184 D262	V180-R182 PolarHBondContact O-N 3.02Å; R182-T184 PolarHBondContact O-N 3.16Å; R182-D262 WeakPolarHBondContact CD-OD2 3.46Å; R182-D262 IonicContact CZ-OD2 2.73Å; R182-D262 PolarHBondContact N-O 2.83Å; R182-D262 IonicContact NE-OD2 3.94Å; R182-D262 IonicContact NH1-OD2 2.88Å; R182-D262 PolarHBondContact NH1-OD2 3.28Å
183	H	57.2	Low	62.9	Low	134 Å²	134	103.1 Å²	103.1	62%	0.62	56%	0.562	S	S	*	*			trans	-66.9	96.4	172.5	-86	-68.3	0	0	0	110	P181 M456	P181-H183 PolarHBondContact O-N 3.37Å; H183-M456 PolarHBondContact CD2-O 2.95Å
184	T	46.8	Very low	61.2	Low	122 Å²	122	107.2 Å²	107.2	75%	0.748	58%	0.582	S	S	*	*	S	Bend	trans	-98.1	-26.1	162.4	-30.7	0	0	0	0	112	R182	R182-T184 PolarHBondContact O-N 3.16Å
185	E	42.6	Very low	59.2	Low	163 Å²	163	106.3 Å²	106.3	76%	0.762	57%	0.572	S	S	*	*	S	Bend	trans	-148.7	142	179.1	-64.8	-175.6	168.1	0	0	112.9	L187	E185-L187 PolarHBondContact O-N 3.33Å
186	I	43.7	Very low	57.3	Low	148 Å²	148	113 Å²	113	76%	0.759	60%	0.597	S	S	*	*			trans	-75.3	112.7	-175.1	-64	161.2	0	0	0	109.8	T188	I186-T188 PolarHBondContact O-N 3.37Å
187	L	41.7	Very low	55.3	Low	166 Å²	166	113.5 Å²	113.5	87%	0.869	60%	0.598	S	S	*	*			trans	-74.9	107.8	164.8	-72.8	179.3	0	0	0	109.2	E185 E189	E185-L187 PolarHBondContact O-N 3.33Å; L187-E189 PolarHBondContact O-N 2.81Å
188	T	39.9	Very low	53.1	Low	124 Å²	124	117.8 Å²	117.8	76%	0.761	61%	0.612	S	S	*	*			trans	-91.4	71.9	179.5	-40.7	0	0	0	0	108.7	I186	I186-T188 PolarHBondContact O-N 3.37Å
189	E	39.2	Very low	51.1	Low	191 Å²	191	119.6 Å²	119.6	89%	0.893	63%	0.625	S	S	*	*			trans	176	103	157.5	-103.7	172.2	-172.8	0	0	108.9	L187	L187-E189 PolarHBondContact O-N 2.81Å
190	L	46	Very low	48.9	Very low	134 Å²	134	119.3 Å²	119.3	70%	0.702	62%	0.623	S	S	*	*			trans	-107.1	139.3	169.4	-86.9	159.5	0	0	0	108.8
191	P	44.4	Very low	47.2	Very low	101 Å²	101	120.3 Å²	120.3	66%	0.656	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-62.1	156.2	173.2	24.4	-27.5	0	0	0	110.5	L193	P191-L193 PolarHBondContact O-N 2.99Å; P191-L193 VanDerWaalsContact O-N 3.08Å
192	P	44.9	Very low	46.1	Very low	129 Å²	129	127 Å²	127	84%	0.838	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-56.2	119.5	-175.5	22.7	-31.9	0	0	0	110.1	D194	P192-D194 PolarHBondContact O-N 2.78Å
193	L	48	Very low	46	Very low	145 Å²	145	122.4 Å²	122.4	76%	0.759	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-64.1	125.7	169.5	-76	163.6	0	0	0	107.9	P191 D195	P191-L193 PolarHBondContact O-N 2.99Å; P191-L193 VanDerWaalsContact O-N 3.08Å; L193-D195 PolarHBondContact O-N 3.42Å
194	D	43.5	Very low	46	Very low	129 Å²	129	117 Å²	117	69%	0.69	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-58.3	134.8	165.3	-79.7	-35.1	0	0	0	108.8	P192 Y196	P192-D194 PolarHBondContact O-N 2.78Å; D194-Y196 HydrophobicContact CB-CE2 4.22Å; D194-Y196 WeakPolarHBondContact O-CD2 3.33Å; D194-Y196 PolarHBondContact O-N 2.86Å
195	D	41	Very low	46.1	Very low	124 Å²	124	116.3 Å²	116.3	66%	0.663	61%	0.61	S	S	*	*			trans	-67.4	89.6	-176.3	-159	-12.9	0	0	0	110	L193 T197	L193-D195 PolarHBondContact O-N 3.42Å; D195-T197 VanDerWaalsContact CG-OG1 3.28Å; D195-T197 PolarHBondContact O-N 3.36Å; D195-T197 VanDerWaalsContact O-N 3.12Å; D195-T197 WeakPolarHBondContact OD1-CB 3.3Å; D195-T197 WeakPolarHBondContact OD1-CG2 3.36Å; D195-T197 PolarHBondContact OD1-OG1 2.68Å
196	Y	46	Very low	46	Very low	164 Å²	164	112.2 Å²	112.2	64%	0.643	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-78.2	24.3	176.7	-77.9	-77.8	0	0	0	112.7	D194 H198 S199	D194-Y196 HydrophobicContact CB-CE2 4.22Å; D194-Y196 WeakPolarHBondContact O-CD2 3.33Å; D194-Y196 PolarHBondContact O-N 2.86Å; Y196-H198 PolarHBondContact O-N 2.77Å; Y196-S199 WeakPolarHBondContact O-CB 3.38Å; Y196-S199 PolarHBondContact O-N 3.32Å; Y196-S199 PolarHBondContact O-OG 3.01Å
197	T	44.1	Very low	45.6	Very low	100 Å²	100	110 Å²	110	61%	0.613	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-59.1	-13.7	168.4	42.3	0	0	0	0	112.8	D195	D195-T197 VanDerWaalsContact CG-OG1 3.28Å; D195-T197 PolarHBondContact O-N 3.36Å; D195-T197 VanDerWaalsContact O-N 3.12Å; D195-T197 WeakPolarHBondContact OD1-CB 3.3Å; D195-T197 WeakPolarHBondContact OD1-CG2 3.36Å; D195-T197 PolarHBondContact OD1-OG1 2.68Å
198	H	42.1	Very low	45.2	Very low	155 Å²	155	107.3 Å²	107.3	72%	0.718	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-88.8	3.7	168.2	-62	-59.9	0	0	0	115.3	Y196	Y196-H198 PolarHBondContact O-N 2.77Å
199	S	43.8	Very low	44.7	Very low	41 Å²	41	104.5 Å²	104.5	29%	0.287	58%	0.583	S	S	.	*	S	Bend	trans	-81.3	-13.9	-176.9	67.7	0	0	0	0	114.4	Y196 P201 R410	Y196-S199 WeakPolarHBondContact O-CB 3.38Å; Y196-S199 PolarHBondContact O-N 3.32Å; Y196-S199 PolarHBondContact O-OG 3.01Å; S199-P201 VanDerWaalsContact O-CD 3.29Å; S199-P201 WeakPolarHBondContact O-CD 3.5Å; S199-R410 PolarHBondContact O-NH1 3.29Å; S199-R410 PolarHBondContact OG-NH1 3.22Å
200	I	42.9	Very low	44.5	Very low	83 Å²	83	103.2 Å²	103.2	43%	0.426	58%	0.58	S	S	.	*	S	Bend	trans	-86.2	107.4	162.8	-57.8	170.6	0	0	0	105	E202	I200-E202 PolarHBondContact O-N 2.79Å
201	P	48.9	Very low	43.7	Very low	22 Å²	22	104.7 Å²	104.7	14%	0.143	58%	0.583	C	S	.	*			trans	-68.5	128.3	170.2	5.2	8	0	0	0	108	S199 N203 T204 A371	S199-P201 VanDerWaalsContact O-CD 3.29Å; S199-P201 WeakPolarHBondContact O-CD 3.5Å; P201-N203 WeakPolarHBondContact CB-OD1 3.45Å; P201-N203 PolarHBondContact O-N 2.85Å; P201-T204 HydrophobicContact CB-CG2 4.32Å; P201-T204 HydrophobicContact CG-CG2 3.81Å; P201-T204 WeakPolarHBondContact O-CB 3.36Å; P201-T204 PolarHBondContact O-N 3.38Å; P201-T204 PolarHBondContact O-OG1 3.24Å; P201-A371 HydrophobicContact CB-CB 3.21Å; P201-A371 HydrophobicContact CG-CB 3.46Å; P201-A371 VanDerWaalsContact CG-CB 3.46Å
202	E	54.8	Low	43.1	Very low	177 Å²	177	106 Å²	106	83%	0.827	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-50.3	-21.8	177.1	-68.9	-179	152.7	0	0	112.4	I200 T204	I200-E202 PolarHBondContact O-N 2.79Å; E202-T204 PolarHBondContact O-N 2.88Å
203	N	64.6	Low	42.6	Very low	19 Å²	19	108.1 Å²	108.1	10%	0.102	59%	0.591	C	S	.	*	G	3₁₀ helix	trans	-69.8	-1	173.6	73.5	19.2	0	0	0	116.6	P201 Q358 A371 Q429 T430 V431	P201-N203 WeakPolarHBondContact CB-OD1 3.45Å; P201-N203 PolarHBondContact O-N 2.85Å; N203-Q358 PolarHBondContact ND2-NE2 2.85Å; N203-Q358 PolarHBondContact OD1-NE2 2.76Å; N203-A371 PolarHBondContact ND2-O 3.08Å; N203-Q429 WeakPolarHBondContact CB-O 3.48Å; N203-T430 VanDerWaalsContact O-CA 3.26Å; N203-T430 WeakPolarHBondContact O-CA 3.49Å; N203-T430 WeakPolarHBondContact O-CB 3.29Å; N203-V431 PolarHBondContact O-N 3.11Å; N203-V431 VanDerWaalsContact O-N 3.16Å
204	T	56.4	Low	41.7	Very low	21 Å²	21	106.1 Å²	106.1	13%	0.129	59%	0.589	C	S	.	*	G	3₁₀ helix	trans	-113.7	-1.9	-174	63.5	0	0	0	0	115.8	P201 E202 F206 R415	P201-T204 HydrophobicContact CB-CG2 4.32Å; P201-T204 HydrophobicContact CG-CG2 3.81Å; P201-T204 WeakPolarHBondContact O-CB 3.36Å; P201-T204 PolarHBondContact O-N 3.38Å; P201-T204 PolarHBondContact O-OG1 3.24Å; E202-T204 PolarHBondContact O-N 2.88Å; T204-F206 PolarHBondContact O-N 2.97Å; T204-R415 VanDerWaalsContact CG2-NH1 3.31Å
205	N	49.3	Very low	41.2	Very low	106 Å²	106	107.3 Å²	107.3	57%	0.567	60%	0.595	S	S	*	*			trans	-68.6	122.4	-173	-103.8	4.2	0	0	0	113.3
206	F	41.1	Very low	40.7	Very low	77 Å²	77	112.3 Å²	112.3	34%	0.338	61%	0.606	S	S	.	*			trans	-90.1	150.7	157.2	-65	-91.4	0	0	0	108.9	T204 A208 Y280 T432 W437	T204-F206 PolarHBondContact O-N 2.97Å; F206-A208 PolarHBondContact O-N 3.3Å; F206-Y280 HydrophobicContact CE1-CE1 4.14Å; F206-T432 HydrophobicContact CD1-CG2 4.45Å; F206-T432 HydrophobicContact CE1-CG2 4.49Å; F206-W437 AromaticContact CE1-CH2 3.95Å; F206-W437 HydrophobicContact CE1-CH2 3.95Å; F206-W437 HydrophobicContact CE1-CZ2 4.28Å; F206-W437 AromaticContact CZ-CH2 3.71Å; F206-W437 HydrophobicContact CZ-CH2 3.71Å; F206-W437 HydrophobicContact CZ-CZ2 4.46Å
207	P	35.1	Very low	40.3	Very low	101 Å²	101	112.1 Å²	112.1	66%	0.656	62%	0.615	S	S	*	*			trans	-69.9	100.6	168.6	28.1	-29.8	0	0	0	109.1	G209	P207-G209 PolarHBondContact O-N 3.36Å
208	A	33.8	Very low	39.7	Very low	111 Å²	111	113 Å²	113	92%	0.917	62%	0.622	S	S	*	*			trans	-71.4	98.3	157	0	0	0	0	0	106.8	F206	F206-A208 PolarHBondContact O-N 3.3Å
209	G	29.3	Very low	39.2	Very low	65 Å²	65	114.5 Å²	114.5	67%	0.67	63%	0.63	S	S	*	*			trans	159.9	66.3	-178.4	0	0	0	0	0	113.5	P207	P207-G209 PolarHBondContact O-N 3.36Å
210	I	34.2	Very low	38.9	Very low	164 Å²	164	119.1 Å²	119.1	84%	0.841	66%	0.656	S	S	*	*			trans	-117.6	106.6	150.6	-59.8	177.9	0	0	0	104.9
211	E	29.5	Very low	38.8	Very low	164 Å²	164	120.7 Å²	120.7	77%	0.766	67%	0.672	S	S	*	*			trans	-49.2	134.7	167.1	-66.5	179.3	132.7	0	0	109.4	Q213	E211-Q213 PolarHBondContact O-N 3.05Å
212	P	33	Very low	38.8	Very low	130 Å²	130	125.4 Å²	125.4	84%	0.844	70%	0.702	S	S	*	*			trans	-75	95.3	175.9	30.2	-29.3	0	0	0	108.1	S214	P212-S214 VanDerWaalsContact C-N 3.28Å; P212-S214 PolarHBondContact O-N 3.24Å
213	Q	33.2	Very low	38.2	Very low	173 Å²	173	122.8 Å²	122.8	81%	0.808	70%	0.701	S	S	*	*			trans	-66.4	97.3	159.5	-77.8	-173.7	-16.5	0	0	107.9	E211 N215	E211-Q213 PolarHBondContact O-N 3.05Å; Q213-N215 PolarHBondContact O-N 2.9Å
214	S	28.8	Very low	36.6	Very low	103 Å²	103	125.6 Å²	125.6	72%	0.72	73%	0.734	S	S	*	*			trans	12.1	102	147.7	59.2	0	0	0	0	115.4	P212	P212-S214 VanDerWaalsContact C-N 3.28Å; P212-S214 PolarHBondContact O-N 3.24Å
215	N	34.4	Very low	35.9	Very low	153 Å²	153	135.1 Å²	135.1	82%	0.818	77%	0.769	S	S	*	*			trans	-153	114.9	149.9	-94.8	-30	0	0	0	110.2	Q213	Q213-N215 PolarHBondContact O-N 2.9Å
216	Y	29.8	Very low	35.3	Very low	230 Å²	230	136.9 Å²	136.9	90%	0.902	78%	0.777	S	S	*	*			trans	-18.4	123.5	170	-74.5	-100	0	0	0	116.8
217	I	36.3	Very low	35.7	Very low	160 Å²	160	138.9 Å²	138.9	82%	0.821	80%	0.801	S	S	*	*			trans	-124.9	124.5	149.9	-54.7	177.3	0	0	0	106.4
218	P	33	Very low	36.2	Very low	118 Å²	118	141.9 Å²	141.9	77%	0.766	81%	0.806	S	S	*	*			trans	-74.9	155	177.5	8.3	4.2	0	0	0	112.6
219	E	30.9	Very low	36.6	Very low	187 Å²	187	144.2 Å²	144.2	87%	0.874	80%	0.803	S	S	*	*			trans	-48.4	143.2	-175.2	-59.1	-179.3	116.2	0	0	116.9
220	T	36.7	Very low	37.2	Very low	138 Å²	138	144.6 Å²	144.6	85%	0.847	81%	0.806	S	S	*	*			trans	-143	118.7	144.6	26	0	0	0	0	109.1
221	P	42.3	Very low	37.6	Very low	115 Å²	115	145.3 Å²	145.3	75%	0.747	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83.8	151	174.2	33	-30.5	0	0	0	110.7
222	P	47.8	Very low	38.2	Very low	121 Å²	121	143.9 Å²	143.9	79%	0.786	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.9	152.2	172.5	-0	15.9	0	0	0	111.4
223	P	42.5	Very low	38.7	Very low	123 Å²	123	143.3 Å²	143.3	80%	0.799	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-75.2	135.9	-166.6	-11.4	28.1	0	0	0	113.6
224	G	31.3	Very low	38.9	Very low	77 Å²	77	142.2 Å²	142.2	79%	0.794	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.6	132.7	166.6	0	0	0	0	0	111.5
225	Y	42.8	Very low	39.6	Very low	222 Å²	222	145.2 Å²	145.2	87%	0.871	81%	0.81	S	S	*	*			trans	-108.2	110.1	169.1	-124	-91.4	0	0	0	109.2
226	I	36.6	Very low	39.9	Very low	143 Å²	143	145.3 Å²	145.3	73%	0.733	81%	0.806	S	S	*	*			trans	-66.9	138.7	161.7	39.2	168.9	0	0	0	109.7
227	S	47.9	Very low	40.4	Very low	119 Å²	119	141.5 Å²	141.5	83%	0.832	80%	0.8	S	S	*	*			trans	-135.5	117	160	-64.9	0	0	0	0	108.5
228	E	46.1	Very low	40.4	Very low	164 Å²	164	139.4 Å²	139.4	77%	0.766	79%	0.791	S	S	*	*			trans	-80.1	150.9	177.6	-71.2	169	118.9	0	0	112.2
229	D	43.3	Very low	40.8	Very low	160 Å²	160	141.4 Å²	141.4	86%	0.856	79%	0.79	S	S	*	*			trans	62.6	134.1	144.3	-56.1	-26	0	0	0	123.6
230	G	41.8	Very low	41.4	Very low	72 Å²	72	137.8 Å²	137.8	74%	0.742	79%	0.785	S	S	*	*			trans	159.8	56.8	160.8	0	0	0	0	0	119
231	E	42.2	Very low	41.6	Very low	180 Å²	180	139.6 Å²	139.6	84%	0.841	79%	0.786	S	S	*	*			trans	40.8	135	137.5	-59	-171.3	134.9	0	0	124.9
232	T	42.9	Very low	41.6	Very low	133 Å²	133	141.9 Å²	141.9	82%	0.816	79%	0.792	S	S	*	*			trans	80.8	134.8	146.6	66.1	0	0	0	0	118.8
233	S	42.1	Very low	41.1	Very low	118 Å²	118	142.7 Å²	142.7	83%	0.825	80%	0.795	S	S	*	*			cis	-153.6	149.9	11.8	-72.6	0	0	0	0	111.3
234	D	37.3	Very low	41	Very low	151 Å²	151	140.7 Å²	140.7	81%	0.807	80%	0.797	S	S	*	*			trans	-79.2	171.2	169.9	-89.4	-51.9	0	0	0	114.2
235	Q	43.1	Very low	41.5	Very low	166 Å²	166	142.7 Å²	142.7	78%	0.776	80%	0.799	S	S	*	*			trans	90.3	129.1	158.3	-45.5	-170.9	13.6	0	0	114.8
236	Q	40.8	Very low	41.6	Very low	155 Å²	155	138.2 Å²	138.2	72%	0.724	80%	0.796	S	S	*	*			cis	-170.9	141.3	37.8	-137.9	163.6	21.8	0	0	110.8
237	L	40.3	Very low	41.9	Very low	150 Å²	150	135.7 Å²	135.7	79%	0.785	80%	0.797	S	S	*	*			trans	18.1	157.5	145.9	-73.1	105.7	0	0	0	122
238	N	38	Very low	41.5	Very low	116 Å²	116	138.5 Å²	138.5	62%	0.62	80%	0.797	S	S	*	*			cis	168.3	151.5	-14.6	-162.4	6.7	0	0	0	105
239	Q	40.1	Very low	41.3	Very low	159 Å²	159	138.4 Å²	138.4	74%	0.743	80%	0.801	S	S	*	*			trans	69.3	147.7	160.5	-66	166.4	57.8	0	0	117.1
240	S	43.4	Very low	41.1	Very low	112 Å²	112	136.2 Å²	136.2	78%	0.783	80%	0.798	S	S	*	*			cis	-169.2	167	4.3	27	0	0	0	0	109.2
241	M	42.2	Very low	40.9	Very low	176 Å²	176	138.8 Å²	138.8	87%	0.867	80%	0.802	S	S	*	*			trans	-57.3	152	-176.6	-60.9	166.2	174.6	0	0	115.5
242	D	41	Very low	40.9	Very low	162 Å²	162	136 Å²	136	87%	0.866	80%	0.797	S	S	*	*				-172.3	149.8	122.8	-95.3	-26.9	0	0	0	115.5
243	T	38.7	Very low	40.8	Very low	139 Å²	139	135.5 Å²	135.5	85%	0.853	79%	0.794	S	S	*	*			trans	-49.4	151.8	-179.5	33.3	0	0	0	0	120
244	G	39.5	Very low	40.6	Very low	80 Å²	80	138.5 Å²	138.5	83%	0.825	80%	0.8	S	S	*	*			trans	154.2	96.2	151.1	0	0	0	0	0	117
245	S	42.7	Very low	40.8	Very low	120 Å²	120	136 Å²	136	84%	0.839	80%	0.795	S	S	*	*			trans	-78.2	-173.3	169.1	-50.6	0	0	0	0	112.4
246	P	43.2	Very low	40.8	Very low	127 Å²	127	133.7 Å²	133.7	83%	0.825	79%	0.794	S	S	*	*				-129.5	162.5	-58.9	34.1	-17.5	0	0	0	112.5
247	A	43.6	Very low	40.7	Very low	91 Å²	91	131.7 Å²	131.7	75%	0.752	79%	0.792	S	S	*	*			trans	-154.6	123.7	164.1	0	0	0	0	0	113.5
248	E	39.4	Very low	40.6	Very low	178 Å²	178	131.8 Å²	131.8	83%	0.832	79%	0.793	S	S	*	*			trans	69.5	100.5	137.7	-57.3	-170	136.2	0	0	122.4
249	L	41.3	Very low	40.9	Very low	161 Å²	161	133.5 Å²	133.5	84%	0.843	80%	0.797	S	S	*	*				35.9	116.5	125.3	-65.1	164.2	0	0	0	120.3
250	S	40.2	Very low	41.2	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	80%	0.797	S	S	*	*			trans	-167.1	127.6	135.1	-78.7	0	0	0	0	110.8
251	P	37.6	Very low	41.9	Very low	126 Å²	126	131.8 Å²	131.8	82%	0.818	79%	0.792	S	S	*	*			trans	-94.7	131.4	174.3	33.9	-26.3	0	0	0	110.5
252	T	41	Very low	43.2	Very low	121 Å²	121	127.6 Å²	127.6	74%	0.742	77%	0.773	S	S	*	*			trans	-151.4	115.4	167.8	-3.2	0	0	0	0	111.9
253	T	40.7	Very low	45	Very low	123 Å²	123	123.3 Å²	123.3	76%	0.755	75%	0.75	S	S	*	*			trans	64	100.4	145.9	51.9	0	0	0	0	119.4	S255	T253-S255 PolarHBondContact O-N 3.28Å
254	L	39.4	Very low	47.1	Very low	181 Å²	181	119.5 Å²	119.5	95%	0.948	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-52.3	117.8	155.8	-71.9	135.5	0	0	0	110.5
255	S	41.3	Very low	49.4	Very low	100 Å²	100	118.9 Å²	118.9	70%	0.699	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-93.1	137.6	162.7	-59.3	0	0	0	0	108.4	T253 V257	T253-S255 PolarHBondContact O-N 3.28Å; S255-V257 PolarHBondContact O-N 2.94Å
256	P	41.9	Very low	51.6	Low	117 Å²	117	113.7 Å²	113.7	76%	0.76	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-70.2	129.9	-179.2	28	-29.4	0	0	0	109.5	N258	P256-N258 PolarHBondContact O-N 2.84Å
257	V	38.7	Very low	53.8	Low	113 Å²	113	111.8 Å²	111.8	69%	0.685	65%	0.653	S	S	*	*			trans	-65.2	99.9	172.8	-171.5	0	0	0	0	107.5	S255 H259	S255-V257 PolarHBondContact O-N 2.94Å; V257-H259 VanDerWaalsContact C-N 3.29Å; V257-H259 PolarHBondContact O-N 2.74Å
258	N	38.2	Very low	56	Low	151 Å²	151	109.5 Å²	109.5	81%	0.807	63%	0.626	S	S	*	*			trans	-68.6	92.2	165.8	-100.2	-6.5	0	0	0	107.4	P256 S260	P256-N258 PolarHBondContact O-N 2.84Å; N258-S260 PolarHBondContact O-N 3Å
259	H	44	Very low	58.2	Low	153 Å²	153	103 Å²	103	71%	0.708	60%	0.6	S	S	*	*			trans	-67.4	79.8	158.9	-71.7	-77.6	0	0	0	107.8	V257 L261	V257-H259 VanDerWaalsContact C-N 3.29Å; V257-H259 PolarHBondContact O-N 2.74Å; H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 2.85Å
260	S	46.9	Very low	60.3	Low	104 Å²	104	99.6 Å²	99.6	73%	0.727	58%	0.579	S	S	*	*			trans	-68.6	98.1	162.9	65.4	0	0	0	0	106.5	N258 D262	N258-S260 PolarHBondContact O-N 3Å; S260-D262 PolarHBondContact O-N 3.28Å
261	L	57.9	Low	62.8	Low	131 Å²	131	95.6 Å²	95.6	69%	0.686	55%	0.551	S	S	*	*			trans	-52.7	112.5	165.8	-70.6	166	0	0	0	107	H259 L263	H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 2.85Å; L261-L263 VanDerWaalsContact C-N 3.26Å; L261-L263 HydrophobicContact CB-CG 4.32Å; L261-L263 PolarHBondContact O-N 3.44Å
262	D	70.1	Confident	65.3	Low	87 Å²	87	93.6 Å²	93.6	47%	0.465	55%	0.545	S	S	.	.			trans	-71.8	88.7	177.4	-164.9	22.9	0	0	0	107.4	R182 S260	R182-D262 WeakPolarHBondContact CD-OD2 3.46Å; R182-D262 IonicContact CZ-OD2 2.73Å; R182-D262 PolarHBondContact N-O 2.83Å; R182-D262 IonicContact NE-OD2 3.94Å; R182-D262 IonicContact NH1-OD2 2.88Å; R182-D262 PolarHBondContact NH1-OD2 3.28Å; S260-D262 PolarHBondContact O-N 3.28Å
263	L	79	Confident	67.8	Low	72 Å²	72	92.2 Å²	92.2	38%	0.377	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	117.2	-178.8	-72.3	168.2	0	0	0	109	L179 P181 L261 P265	L179-L263 HydrophobicContact CB-CB 4.33Å; L179-L263 HydrophobicContact CB-CD2 4.24Å; L179-L263 HydrophobicContact CD1-CD1 4.19Å; P181-L263 HydrophobicContact CB-CD2 4.28Å; P181-L263 HydrophobicContact CG-CD2 3.97Å; L261-L263 VanDerWaalsContact C-N 3.26Å; L261-L263 HydrophobicContact CB-CG 4.32Å; L261-L263 PolarHBondContact O-N 3.44Å; L263-P265 WeakPolarHBondContact O-CD 3.36Å
264	Q	82.8	Confident	70.4	Confident	59 Å²	59	87 Å²	87	28%	0.276	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.9	176.2	-173.6	69	33.2	0	0	110.1	V180	V180-Q264 PolarHBondContact N-O 3.34Å; V180-Q264 PolarHBondContact O-N 3.46Å
265	P	88.1	Confident	73.1	Confident	67 Å²	67	78.4 Å²	78.4	44%	0.435	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.7	174.6	29.7	-33	0	0	0	111.5	P177 L179 L263	P177-P265 HydrophobicContact CB-CB 4.04Å; P177-P265 HydrophobicContact CG-CB 4.49Å; L179-P265 HydrophobicContact CD2-CB 3.91Å; L263-P265 WeakPolarHBondContact O-CD 3.36Å
266	V	88.5	Confident	75.8	Confident	11 Å²	11	74.4 Å²	74.4	7%	0.067	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112.7	176.1	-178.8	0	0	0	0	110	P177 V178 V180 W448 K451 V452 Q455	P177-V266 WeakPolarHBondContact CA-O 3.38Å; V178-V266 PolarHBondContact N-O 3.47Å; V178-V266 PolarHBondContact O-N 2.83Å; V180-V266 HydrophobicContact CG2-CG2 3.89Å; V266-W448 PolarHBondContact O-NE1 3.14Å; V266-W448 VanDerWaalsContact O-NE1 3.15Å; V266-K451 HydrophobicContact CG1-CB 3.46Å; V266-K451 VanDerWaalsContact CG1-CB 3.46Å; V266-K451 HydrophobicContact CG1-CD 4.26Å; V266-V452 HydrophobicContact CB-CG2 4.18Å; V266-V452 HydrophobicContact CG1-CG2 4Å; V266-V452 HydrophobicContact CG2-CG2 4.5Å; V266-Q455 HydrophobicContact CG2-CG 4.17Å
267	T	89.4	Confident	78.5	Confident	88 Å²	88	68.9 Å²	68.9	54%	0.54	39%	0.386	S	S	.	.			trans	-91.4	145	-176.8	54.3	0	0	0	0	113.1	P177	P177-T267 HydrophobicContact CB-CG2 4.06Å
268	Y	89.5	Confident	81.4	Confident	43 Å²	43	63.9 Å²	63.9	17%	0.169	36%	0.357	C	S	.	.			trans	-70.6	141.8	170.4	-176	-95.6	0	0	0	111	L175 E270 N387 G444 W448	L175-Y268 HydrophobicContact CD1-CD1 4.06Å; L175-Y268 HydrophobicContact CD1-CD2 4.11Å; L175-Y268 HydrophobicContact CD1-CE1 4.46Å; L175-Y268 HydrophobicContact CD1-CE2 4.47Å; L175-Y268 HydrophobicContact CD1-CG 3.87Å; Y268-E270 HydrophobicContact CE1-CB 4.37Å; Y268-E270 PolarHBondContact OH-OE1 3.47Å; Y268-N387 PolarHBondContact OH-ND2 2.99Å; Y268-G444 VanDerWaalsContact CE2-C 3.49Å; Y268-G444 WeakPolarHBondContact OH-CA 3.47Å; Y268-W448 HydrophobicContact CD2-CB 3.91Å; Y268-W448 AromaticContact CD2-CD2 3.69Å; Y268-W448 HydrophobicContact CD2-CD2 3.69Å; Y268-W448 AromaticContact CD2-CE3 3.38Å; Y268-W448 HydrophobicContact CD2-CE3 3.38Å; Y268-W448 AromaticContact CD2-CG 3.98Å; Y268-W448 HydrophobicContact CD2-CG 3.98Å; Y268-W448 HydrophobicContact CD2-CZ3 4.02Å; Y268-W448 HydrophobicContact CE2-CB 4.49Å; Y268-W448 HydrophobicContact CE2-CE3 4.19Å; Y268-W448 HydrophobicContact CG-CD2 4.32Å; Y268-W448 HydrophobicContact CG-CE3 4.15Å; Y268-W448 HydrophobicContact CG-CZ3 4.46Å
269	S	85.8	Confident	84.3	Confident	42 Å²	42	56.8 Å²	56.8	29%	0.294	32%	0.319	S	S	.	.			trans	-133.3	134.1	170.8	51.4	0	0	0	0	109.4	Q447 K451	S269-Q447 PolarHBondContact O-OE1 2.99Å; S269-Q447 VanDerWaalsContact O-OE1 3.1Å; S269-Q447 PolarHBondContact OG-OE1 3.42Å; S269-K451 PolarHBondContact OG-NZ 3.46Å
270	E	86.3	Confident	86.9	Confident	88 Å²	88	50.8 Å²	50.8	41%	0.411	29%	0.29	S	S	.	.			trans	-76.5	125.2	179.3	-158.3	74	-109	0	0	110.2	Y268 Y340	Y268-E270 HydrophobicContact CE1-CB 4.37Å; Y268-E270 PolarHBondContact OH-OE1 3.47Å; E270-Y340 VanDerWaalsContact CD-OH 3.27Å; E270-Y340 PolarHBondContact OE1-OH 2.94Å; E270-Y340 VanDerWaalsContact OE1-OH 3.13Å; E270-Y340 PolarHBondContact OE2-OH 2.91Å
271	P	91.1	Very high	89.3	Confident	30 Å²	30	46 Å²	46	20%	0.195	26%	0.256	C	S	.	.			trans	-76.6	159.6	178.5	31.8	-36.6	0	0	0	112.1	F273 N443	P271-F273 VanDerWaalsContact CG-O 3.29Å; P271-F273 WeakPolarHBondContact CG-O 3.38Å; P271-F273 PolarHBondContact O-N 2.81Å; P271-N443 HydrophobicContact CB-CB 4.26Å; P271-N443 HydrophobicContact CG-CB 3.8Å
272	A	89.8	Confident	91.2	Very high	85 Å²	85	42.3 Å²	42.3	70%	0.702	24%	0.237	S	C	*	.	S	Bend	trans	-61.9	-31.7	176.3	0	0	0	0	0	113.4
273	F	94.3	Very high	92.5	Very high	91 Å²	91	42.8 Å²	42.8	40%	0.399	24%	0.24	S	C	.	.	S	Bend	trans	-116	118.4	170.8	-58.8	-82.5	0	0	0	108	P271 C275 H291 A292 N443	P271-F273 VanDerWaalsContact CG-O 3.29Å; P271-F273 WeakPolarHBondContact CG-O 3.38Å; P271-F273 PolarHBondContact O-N 2.81Å; F273-C275 VanDerWaalsContact C-N 3.34Å; F273-H291 HydrophobicContact CB-CB 4.5Å; F273-H291 HydrophobicContact CD1-CB 3.66Å; F273-H291 HydrophobicContact CE1-CB 3.95Å; F273-H291 HydrophobicContact CG-CB 4.01Å; F273-A292 CarbonylContact C-O 3.59Å; F273-A292 WeakPolarHBondContact CA-O 3.34Å; F273-N443 VanDerWaalsContact O-CB 3.27Å; F273-N443 WeakPolarHBondContact O-CB 3.33Å; F273-N443 PolarHBondContact O-ND2 3.46Å
274	W	95.1	Very high	93.4	Very high	15 Å²	15	42.6 Å²	42.6	6%	0.057	24%	0.237	C	C	.	.	S	Bend	trans	-75.5	-26.6	-175.7	67.5	-91.9	0	0	0	112.3	A292 Q294 L297 L338 Y340 V345 L442 N443	W274-A292 HydrophobicContact CZ2-CB 4.36Å; W274-A292 PolarHBondContact N-O 3.09Å; W274-Q294 PolarHBondContact NE1-O 3.5Å; W274-L297 HydrophobicContact CH2-CD2 4.23Å; W274-L297 HydrophobicContact CZ2-CD2 3.48Å; W274-L297 VanDerWaalsContact CZ2-CD2 3.48Å; W274-L338 HydrophobicContact CH2-CB 4.06Å; W274-L338 HydrophobicContact CZ2-CB 4.48Å; W274-Y340 HydrophobicContact CB-CD1 4.13Å; W274-Y340 HydrophobicContact CD2-CG 4.34Å; W274-Y340 HydrophobicContact CE3-CG 4.33Å; W274-Y340 HydrophobicContact CG-CD1 4.3Å; W274-Y340 HydrophobicContact CG-CG 4.47Å; W274-V345 HydrophobicContact CE3-CG2 4.43Å; W274-V345 HydrophobicContact CH2-CG1 4.01Å; W274-V345 HydrophobicContact CZ3-CG1 3.77Å; W274-V345 HydrophobicContact CZ3-CG2 3.98Å; W274-L442 HydrophobicContact CE3-CD2 4.18Å; W274-L442 HydrophobicContact CZ3-CD2 3.93Å; W274-N443 PolarHBondContact O-N 2.77Å
275	C	97.4	Very high	94.1	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	162.9	170.8	71.4	0	0	0	0	114.1	F273 A292 L440 H441 L442	F273-C275 VanDerWaalsContact C-N 3.34Å; C275-A292 PolarHBondContact O-N 3.16Å; C275-A292 WeakPolarHBondContact SG-CB 3.43Å; C275-L440 HydrophobicContact CB-CD1 4.26Å; C275-L440 HydrophobicContact CB-CG 4.18Å; C275-H441 CarbonylContact C-O 3.46Å; C275-H441 WeakPolarHBondContact CA-O 3.36Å; C275-H441 WeakPolarHBondContact CB-O 2.88Å; C275-L442 HydrophobicContact CB-CD2 4.11Å
276	S	97.9	Very high	94.6	Very high	16 Å²	16	43.1 Å²	43.1	11%	0.112	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.3	166.6	71.8	0	0	0	0	110.5	F290 H441	S276-F290 CarbonylContact C-O 3.59Å; S276-F290 VanDerWaalsContact CA-O 3.29Å; S276-F290 WeakPolarHBondContact CA-O 3.31Å; S276-H441 PolarHBondContact N-O 3.22Å; S276-H441 PolarHBondContact O-N 3.36Å
277	I	98.5	Very high	95	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.2	-173.8	-33.1	-162.6	0	0	0	109.9	T289 F290 L297 V299 F311 L338 I438 E439 L440	I277-T289 WeakPolarHBondContact O-CA 3.5Å; I277-F290 HydrophobicContact CB-CB 4.3Å; I277-F290 HydrophobicContact CD1-CD1 4.31Å; I277-F290 HydrophobicContact CG1-CD1 4.24Å; I277-F290 PolarHBondContact N-O 3.37Å; I277-F290 PolarHBondContact O-N 2.96Å; I277-L297 HydrophobicContact CD1-CD1 3.51Å; I277-L297 HydrophobicContact CD1-CD2 4.07Å; I277-L297 HydrophobicContact CD1-CG 4.45Å; I277-V299 HydrophobicContact CD1-CG2 3.82Å; I277-F311 HydrophobicContact CB-CD1 4.1Å; I277-F311 HydrophobicContact CB-CE1 4.13Å; I277-F311 HydrophobicContact CG2-CD1 4.07Å; I277-F311 HydrophobicContact CG2-CE1 4.04Å; I277-L338 HydrophobicContact CD1-CD1 4.01Å; I277-I438 HydrophobicContact CG2-CB 3.83Å; I277-I438 HydrophobicContact CG2-CD1 4.02Å; I277-I438 HydrophobicContact CG2-CG1 4.46Å; I277-I438 HydrophobicContact CG2-CG2 4.06Å; I277-E439 WeakPolarHBondContact CA-O 3.18Å; I277-L440 HydrophobicContact CB-CD1 4.13Å; I277-L440 HydrophobicContact CD1-CD1 3.48Å; I277-L440 VanDerWaalsContact CD1-CD1 3.48Å; I277-L440 HydrophobicContact CG1-CD1 3.43Å; I277-L440 VanDerWaalsContact CG1-CD1 3.43Å; I277-L440 HydrophobicContact CG2-CD1 4.05Å
278	A	98.6	Very high	95.3	Very high	9 Å²	9	48.3 Å²	48.3	7%	0.074	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.1	171.2	0	0	0	0	0	110.2	Y280 I438 E439	A278-Y280 HydrophobicContact CB-CD2 4.44Å; A278-Y280 HydrophobicContact CB-CE2 3.69Å; A278-I438 CarbonylContact O-C 3.53Å; A278-I438 WeakPolarHBondContact O-CA 3.48Å; A278-E439 PolarHBondContact N-O 2.66Å; A278-E439 PolarHBondContact O-N 3.33Å
279	Y	98.6	Very high	95.7	Very high	1 Å²	1	48 Å²	48	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	140.8	176.5	175.1	-119.3	0	0	0	111.5	E281 V286 L313 L316 R329 C436 W437 I438	Y279-E281 HydrophobicContact CE1-CG 3.7Å; Y279-E281 WeakPolarHBondContact CE1-OE1 3.29Å; Y279-E281 WeakPolarHBondContact OH-CG 3.11Å; Y279-E281 PolarHBondContact OH-OE1 3.41Å; Y279-E281 VanDerWaalsContact OH-OE1 3.12Å; Y279-V286 HydrophobicContact CD1-CB 3.74Å; Y279-V286 HydrophobicContact CD1-CG1 3.96Å; Y279-V286 HydrophobicContact CE1-CB 4Å; Y279-V286 HydrophobicContact CE1-CG1 3.99Å; Y279-V286 PolarHBondContact O-N 3.36Å; Y279-L313 HydrophobicContact CD1-CD2 4.13Å; Y279-L313 HydrophobicContact CD2-CD1 3.77Å; Y279-L313 HydrophobicContact CD2-CD2 3.86Å; Y279-L313 HydrophobicContact CD2-CG 4.37Å; Y279-L313 HydrophobicContact CE2-CD1 3.75Å; Y279-L313 HydrophobicContact CE2-CD2 4.46Å; Y279-L313 HydrophobicContact CG-CD1 4.42Å; Y279-L313 HydrophobicContact CG-CD2 3.67Å; Y279-L316 HydrophobicContact CD1-CD1 3.58Å; Y279-L316 HydrophobicContact CE1-CD1 4.29Å; Y279-L316 HydrophobicContact CG-CD1 4.25Å; Y279-R329 PolarHBondContact OH-NH1 3.08Å; Y279-R329 VanDerWaalsContact OH-NH1 3.14Å; Y279-C436 HydrophobicContact CE2-CB 4.05Å; Y279-C436 PolarHBondContact OH-SG 3.16Å; Y279-C436 VanDerWaalsContact OH-SG 3.35Å; Y279-W437 VanDerWaalsContact CD2-O 3.24Å; Y279-W437 WeakPolarHBondContact CD2-O 3.24Å; Y279-I438 HydrophobicContact CD2-CG2 3.92Å
280	Y	98.7	Very high	96.2	Very high	27 Å²	27	47.5 Å²	47.5	11%	0.106	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.1	-179.4	-67.2	-96.7	0	0	0	111.2	F206 A278 Q284 R285 W437 E439	F206-Y280 HydrophobicContact CE1-CE1 4.14Å; A278-Y280 HydrophobicContact CB-CD2 4.44Å; A278-Y280 HydrophobicContact CB-CE2 3.69Å; Y280-Q284 CarbonylContact C-O 3.57Å; Y280-Q284 VanDerWaalsContact CA-O 3.27Å; Y280-Q284 WeakPolarHBondContact CA-O 3.38Å; Y280-R285 HydrophobicContact CD1-CB 3.89Å; Y280-R285 HydrophobicContact CE1-CB 3.61Å; Y280-R285 HydrophobicContact CE1-CG 4.12Å; Y280-W437 VanDerWaalsContact CB-CZ2 3.44Å; Y280-W437 HydrophobicContact CD1-CH2 4.06Å; Y280-W437 AromaticContact CD1-CZ2 3.76Å; Y280-W437 HydrophobicContact CD1-CZ2 3.76Å; Y280-W437 HydrophobicContact CD2-CD2 4.33Å; Y280-W437 HydrophobicContact CD2-CE3 4.12Å; Y280-W437 AromaticContact CD2-CH2 3.55Å; Y280-W437 HydrophobicContact CD2-CH2 3.55Å; Y280-W437 AromaticContact CD2-CZ2 3.8Å; Y280-W437 HydrophobicContact CD2-CZ2 3.8Å; Y280-W437 AromaticContact CD2-CZ3 3.75Å; Y280-W437 HydrophobicContact CD2-CZ3 3.75Å; Y280-W437 HydrophobicContact CE1-CH2 4.37Å; Y280-W437 HydrophobicContact CE1-CZ2 4.45Å; Y280-W437 AromaticContact CE2-CH2 3.88Å; Y280-W437 HydrophobicContact CE2-CH2 3.88Å; Y280-W437 HydrophobicContact CE2-CZ2 4.47Å; Y280-W437 HydrophobicContact CE2-CZ3 4.12Å; Y280-W437 HydrophobicContact CG-CD2 4.3Å; Y280-W437 AromaticContact CG-CE2 3.76Å; Y280-W437 AromaticContact CG-CH2 3.66Å; Y280-W437 HydrophobicContact CG-CH2 3.66Å; Y280-W437 AromaticContact CG-CZ2 3.41Å; Y280-W437 HydrophobicContact CG-CZ2 3.41Å; Y280-W437 VanDerWaalsContact CG-CZ2 3.41Å; Y280-W437 HydrophobicContact CG-CZ3 4.24Å; Y280-W437 PolarHBondContact N-O 2.82Å; Y280-W437 PolarHBondContact O-N 3.34Å; Y280-E439 HydrophobicContact CD2-CB 4.5Å; Y280-E439 HydrophobicContact CE2-CB 3.96Å
281	E	98.5	Very high	96.7	Very high	3 Å²	3	48 Å²	48	1%	0.014	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	112.8	166.4	-66.7	179.1	-177.5	0	0	107.2	Y279 N283 Q284 V286 N318 R321 V325 R329 P435	Y279-E281 HydrophobicContact CE1-CG 3.7Å; Y279-E281 WeakPolarHBondContact CE1-OE1 3.29Å; Y279-E281 WeakPolarHBondContact OH-CG 3.11Å; Y279-E281 PolarHBondContact OH-OE1 3.41Å; Y279-E281 VanDerWaalsContact OH-OE1 3.12Å; E281-N283 PolarHBondContact O-N 3.34Å; E281-Q284 PolarHBondContact N-O 3.44Å; E281-Q284 PolarHBondContact O-N 3.24Å; E281-V286 HydrophobicContact CB-CG2 3.94Å; E281-V286 HydrophobicContact CG-CB 4.46Å; E281-V286 HydrophobicContact CG-CG2 3.87Å; E281-N318 WeakPolarHBondContact OE2-CB 3.32Å; E281-N318 PolarHBondContact OE2-ND2 2.92Å; E281-R321 IonicContact OE1-CZ 3.66Å; E281-R321 VanDerWaalsContact OE1-CZ 3.27Å; E281-R321 IonicContact OE1-NE 3.36Å; E281-R321 PolarHBondContact OE1-NE 3.23Å; E281-R321 IonicContact OE1-NH2 3.36Å; E281-R321 PolarHBondContact OE1-NH2 3.19Å; E281-R321 IonicContact OE2-CZ 3.62Å; E281-R321 IonicContact OE2-NE 3.23Å; E281-R321 PolarHBondContact OE2-NE 3.41Å; E281-R321 IonicContact OE2-NH2 2.74Å; E281-V325 HydrophobicContact CB-CG1 4.02Å; E281-V325 VanDerWaalsContact CD-CG1 3.44Å; E281-V325 HydrophobicContact CG-CG1 3.71Å; E281-V325 WeakPolarHBondContact OE2-CG1 3.12Å; E281-R329 WeakPolarHBondContact OE1-CD 3.4Å; E281-R329 IonicContact OE1-CZ 3.68Å; E281-R329 IonicContact OE1-NE 3.82Å; E281-R329 IonicContact OE1-NH1 3.01Å; E281-R329 PolarHBondContact OE1-NH1 3.37Å; E281-P435 WeakPolarHBondContact CA-O 3.2Å
282	L	98	Very high	96.9	Very high	54 Å²	54	46.7 Å²	46.7	28%	0.283	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	-121.9	-169.7	-54.4	168.9	0	0	0	111.4	V325 T432 T434 W437	L282-V325 HydrophobicContact CD1-CG2 4.43Å; L282-V325 HydrophobicContact CG-CG2 4.27Å; L282-T432 CarbonylContact C-O 3.54Å; L282-T432 WeakPolarHBondContact CA-O 3.36Å; L282-T432 WeakPolarHBondContact O-CA 3.32Å; L282-T434 WeakPolarHBondContact CA-O 3.36Å; L282-T434 PolarHBondContact N-O 3.11Å; L282-W437 PolarHBondContact O-NE1 2.95Å
283	N	97	Very high	96.9	Very high	98 Å²	98	45.2 Å²	45.2	52%	0.524	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	4.1	176	64.8	-26.3	0	0	0	113.3	E281 T432	E281-N283 PolarHBondContact O-N 3.34Å; N283-T432 HydrophobicContact CB-CG2 4.22Å
284	Q	97.8	Very high	96.8	Very high	67 Å²	67	43.7 Å²	43.7	31%	0.313	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	129	-176.1	-172.5	178.2	5.1	0	0	110.9	Y280 E281 N318 N320	Y280-Q284 CarbonylContact C-O 3.57Å; Y280-Q284 VanDerWaalsContact CA-O 3.27Å; Y280-Q284 WeakPolarHBondContact CA-O 3.38Å; E281-Q284 PolarHBondContact N-O 3.44Å; E281-Q284 PolarHBondContact O-N 3.24Å; Q284-N318 PolarHBondContact OE1-OD1 3.45Å; Q284-N320 PolarHBondContact NE2-ND2 3.29Å; Q284-N320 PolarHBondContact OE1-ND2 2.86Å
285	R	98	Very high	96.5	Very high	132 Å²	132	44.7 Å²	44.7	50%	0.498	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	134.8	170.5	-172.5	171.5	170.1	-167.8	-5.4	110	Y280 T289	Y280-R285 HydrophobicContact CD1-CB 3.89Å; Y280-R285 HydrophobicContact CE1-CB 3.61Å; Y280-R285 HydrophobicContact CE1-CG 4.12Å; R285-T289 PolarHBondContact NH2-OG1 3.49Å
286	V	98.2	Very high	96.3	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.03	24%	0.24	C	C	.	.			trans	-129.7	120.9	-176.1	177.3	0	0	0	0	109.6	Y279 E281 L316 N318	Y279-V286 HydrophobicContact CD1-CB 3.74Å; Y279-V286 HydrophobicContact CD1-CG1 3.96Å; Y279-V286 HydrophobicContact CE1-CB 4Å; Y279-V286 HydrophobicContact CE1-CG1 3.99Å; Y279-V286 PolarHBondContact O-N 3.36Å; E281-V286 HydrophobicContact CB-CG2 3.94Å; E281-V286 HydrophobicContact CG-CB 4.46Å; E281-V286 HydrophobicContact CG-CG2 3.87Å; V286-L316 HydrophobicContact CG1-CB 3.98Å; V286-N318 HydrophobicContact CG1-CB 4.05Å; V286-N318 HydrophobicContact CG2-CB 3.96Å
287	G	96.5	Very high	96.2	Very high	41 Å²	41	45.1 Å²	45.1	42%	0.423	24%	0.235	S	C	.	.	S	Bend	trans	81.4	-177.8	-179.3	0	0	0	0	0	114.5
288	E	95.8	Very high	96.2	Very high	168 Å²	168	46.2 Å²	46.2	79%	0.785	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-80.8	160.4	178.3	-61.3	-178.1	152.9	0	0	111.7	F290	E288-F290 PolarHBondContact O-N 3.15Å
289	T	97.1	Very high	96.2	Very high	35 Å²	35	45.8 Å²	45.8	22%	0.215	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-73.4	127.3	170.5	-69.5	0	0	0	0	110	I277 R285 H291	I277-T289 WeakPolarHBondContact O-CA 3.5Å; R285-T289 PolarHBondContact NH2-OG1 3.49Å; T289-H291 PolarHBondContact O-CE1 3.45Å; T289-H291 PolarHBondContact O-ND1 3.08Å; T289-H291 VanDerWaalsContact O-ND1 3.15Å
290	F	97	Very high	96.2	Very high	32 Å²	32	45.9 Å²	45.9	14%	0.14	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133.7	172.4	-174.8	-89.6	0	0	0	110.4	S276 I277 E288 A292 L297 S308 F311	S276-F290 CarbonylContact C-O 3.59Å; S276-F290 VanDerWaalsContact CA-O 3.29Å; S276-F290 WeakPolarHBondContact CA-O 3.31Å; I277-F290 HydrophobicContact CB-CB 4.3Å; I277-F290 HydrophobicContact CD1-CD1 4.31Å; I277-F290 HydrophobicContact CG1-CD1 4.24Å; I277-F290 PolarHBondContact N-O 3.37Å; I277-F290 PolarHBondContact O-N 2.96Å; E288-F290 PolarHBondContact O-N 3.15Å; F290-A292 HydrophobicContact CE1-CB 4.24Å; F290-L297 HydrophobicContact CE1-CD1 4.28Å; F290-S308 WeakPolarHBondContact CZ-O 3.41Å; F290-F311 HydrophobicContact CB-CB 4.21Å; F290-F311 HydrophobicContact CB-CD1 3.69Å; F290-F311 HydrophobicContact CB-CD2 3.85Å; F290-F311 HydrophobicContact CB-CE1 3.91Å; F290-F311 HydrophobicContact CB-CE2 4.08Å; F290-F311 HydrophobicContact CB-CG 3.66Å; F290-F311 HydrophobicContact CB-CZ 4.1Å; F290-F311 HydrophobicContact CD1-CB 4.15Å; F290-F311 HydrophobicContact CD2-CB 3.72Å; F290-F311 AromaticContact CD2-CD2 3.89Å; F290-F311 HydrophobicContact CD2-CD2 3.89Å; F290-F311 AromaticContact CD2-CG 3.88Å; F290-F311 HydrophobicContact CD2-CG 3.88Å; F290-F311 HydrophobicContact CE1-CB 4.45Å; F290-F311 HydrophobicContact CE2-CB 4.05Å; F290-F311 HydrophobicContact CG-CB 3.76Å; F290-F311 HydrophobicContact CG-CD1 4.17Å; F290-F311 HydrophobicContact CG-CD2 4.11Å; F290-F311 AromaticContact CG-CG 3.77Å; F290-F311 HydrophobicContact CG-CG 3.77Å; F290-F311 HydrophobicContact CZ-CB 4.39Å
291	H	96.9	Very high	96.1	Very high	100 Å²	100	45.5 Å²	45.5	46%	0.463	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121	179.3	-62.6	83.7	0	0	0	109.9	F273 T289	F273-H291 HydrophobicContact CB-CB 4.5Å; F273-H291 HydrophobicContact CD1-CB 3.66Å; F273-H291 HydrophobicContact CE1-CB 3.95Å; F273-H291 HydrophobicContact CG-CB 4.01Å; T289-H291 PolarHBondContact O-CE1 3.45Å; T289-H291 PolarHBondContact O-ND1 3.08Å; T289-H291 VanDerWaalsContact O-ND1 3.15Å
292	A	94.9	Very high	96.1	Very high	1 Å²	1	50 Å²	50	1%	0.008	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	110	-171.8	0	0	0	0	0	111.9	F273 W274 C275 F290 L297	F273-A292 CarbonylContact C-O 3.59Å; F273-A292 WeakPolarHBondContact CA-O 3.34Å; W274-A292 HydrophobicContact CZ2-CB 4.36Å; W274-A292 PolarHBondContact N-O 3.09Å; C275-A292 PolarHBondContact O-N 3.16Å; C275-A292 WeakPolarHBondContact SG-CB 3.43Å; F290-A292 HydrophobicContact CE1-CB 4.24Å; A292-L297 HydrophobicContact CB-CD2 3.31Å
293	S	91	Very high	96	Very high	55 Å²	55	52 Å²	52	39%	0.385	28%	0.278	S	S	.	.			trans	-93.5	-36.3	174.1	54.7	0	0	0	0	112.2
294	Q	90.6	Very high	95.9	Very high	59 Å²	59	49.3 Å²	49.3	28%	0.276	26%	0.263	S	S	.	.	S	Bend	trans	-74.9	144.2	179.6	-62.9	-57.3	-32.5	0	0	111.3	W274 S296 E309	W274-Q294 PolarHBondContact NE1-O 3.5Å; Q294-S296 PolarHBondContact O-N 3.2Å; Q294-E309 HydrophobicContact CB-CG 4.1Å; Q294-E309 HydrophobicContact CG-CG 3.84Å
295	P	89.9	Confident	95.6	Very high	36 Å²	36	51.4 Å²	51.4	23%	0.234	28%	0.283	C	S	.	.	S	Bend	trans	-65.9	-12.2	-179.2	27.9	-35.8	0	0	0	113	Y339 Y340	P295-Y339 CarbonylContact O-C 3.44Å; P295-Y339 WeakPolarHBondContact O-CA 3.3Å; P295-Y340 PolarHBondContact O-N 2.83Å
296	S	92.9	Very high	95.1	Very high	22 Å²	22	50.1 Å²	50.1	15%	0.154	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	132.8	175.7	170.2	0	0	0	0	109.4	Q294 L338	Q294-S296 PolarHBondContact O-N 3.2Å; S296-L338 WeakPolarHBondContact CA-O 3.36Å
297	L	96.1	Very high	94.6	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	160	172.3	75.5	106.2	0	0	0	110.9	W274 I277 F290 A292 V299 E309 R337 L338	W274-L297 HydrophobicContact CH2-CD2 4.23Å; W274-L297 HydrophobicContact CZ2-CD2 3.48Å; W274-L297 VanDerWaalsContact CZ2-CD2 3.48Å; I277-L297 HydrophobicContact CD1-CD1 3.51Å; I277-L297 HydrophobicContact CD1-CD2 4.07Å; I277-L297 HydrophobicContact CD1-CG 4.45Å; F290-L297 HydrophobicContact CE1-CD1 4.28Å; A292-L297 HydrophobicContact CB-CD2 3.31Å; L297-V299 HydrophobicContact CD1-CG2 3.65Å; L297-E309 CarbonylContact C-O 3.47Å; L297-E309 VanDerWaalsContact CA-O 3.25Å; L297-E309 WeakPolarHBondContact CA-O 3.44Å; L297-R337 WeakPolarHBondContact O-CA 3.43Å; L297-R337 WeakPolarHBondContact O-CG 3.49Å; L297-L338 HydrophobicContact CD1-CD1 4.45Å; L297-L338 HydrophobicContact CD2-CB 4.41Å; L297-L338 HydrophobicContact CG-CB 4.2Å; L297-L338 PolarHBondContact N-O 3.29Å; L297-L338 PolarHBondContact O-N 2.97Å
298	T	97.8	Very high	94.3	Very high	23 Å²	23	53.8 Å²	53.8	14%	0.141	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	126.6	174.5	-51.4	0	0	0	0	109.9	D300 E309 R310 F311 R334 V336 L350	T298-D300 HydrophobicContact CG2-CB 4.18Å; T298-E309 PolarHBondContact N-O 3.16Å; T298-R310 CarbonylContact O-C 3.45Å; T298-R310 VanDerWaalsContact O-CA 3.28Å; T298-R310 WeakPolarHBondContact O-CA 3.29Å; T298-F311 PolarHBondContact O-N 2.9Å; T298-R334 WeakPolarHBondContact CG2-O 3.27Å; T298-V336 CarbonylContact C-O 3.56Å; T298-V336 WeakPolarHBondContact CA-O 3.33Å; T298-L350 HydrophobicContact CG2-CD1 4.08Å
299	V	98.4	Very high	94.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	111.7	168.8	-172.8	0	0	0	0	107.3	I277 L297 F311 L313 G335 V336 F418 I438	I277-V299 HydrophobicContact CD1-CG2 3.82Å; L297-V299 HydrophobicContact CD1-CG2 3.65Å; V299-F311 WeakPolarHBondContact CA-O 3.46Å; V299-F311 HydrophobicContact CB-CB 4.45Å; V299-F311 HydrophobicContact CG1-CB 4.28Å; V299-F311 HydrophobicContact CG1-CD1 3.92Å; V299-F311 HydrophobicContact CG1-CG 4.35Å; V299-F311 HydrophobicContact CG2-CB 4.14Å; V299-F311 HydrophobicContact CG2-CD1 4.23Å; V299-L313 HydrophobicContact CG1-CD1 3.69Å; V299-L313 HydrophobicContact CG1-CD2 3.93Å; V299-L313 HydrophobicContact CG1-CG 3.76Å; V299-G335 CarbonylContact O-C 3.56Å; V299-G335 VanDerWaalsContact O-CA 3.27Å; V299-G335 WeakPolarHBondContact O-CA 3.49Å; V299-V336 HydrophobicContact CB-CG1 3.91Å; V299-V336 HydrophobicContact CG2-CG1 4.33Å; V299-V336 PolarHBondContact N-O 3.34Å; V299-V336 PolarHBondContact O-N 3.03Å; V299-F418 HydrophobicContact CB-CZ 4.32Å; V299-F418 HydrophobicContact CG1-CZ 3.9Å; V299-I438 HydrophobicContact CB-CD1 4.47Å; V299-I438 HydrophobicContact CG1-CD1 4.41Å; V299-I438 HydrophobicContact CG1-CG2 4.34Å; V299-I438 HydrophobicContact CG2-CD1 4.14Å
300	D	98.3	Very high	94	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	169	-171	70.3	50.4	0	0	0	113.2	T298 F302 R310 F311 C312 L313 G333	T298-D300 HydrophobicContact CG2-CB 4.18Å; D300-F302 VanDerWaalsContact C-N 3.34Å; D300-F302 HydrophobicContact CB-CD2 3.99Å; D300-F302 VanDerWaalsContact OD1-CB 3.32Å; D300-F302 WeakPolarHBondContact OD1-CB 3.43Å; D300-F302 PolarHBondContact OD1-N 2.83Å; D300-R310 IonicContact OD1-NH2 3.13Å; D300-R310 PolarHBondContact OD1-NH2 3.4Å; D300-R310 IonicContact OD2-CZ 3.88Å; D300-R310 VanDerWaalsContact OD2-CZ 3.23Å; D300-R310 IonicContact OD2-NE 3.27Å; D300-R310 PolarHBondContact OD2-NE 3.26Å; D300-R310 IonicContact OD2-NH2 3.89Å; D300-R310 PolarHBondContact OD2-NH2 2.79Å; D300-F311 PolarHBondContact N-O 2.88Å; D300-C312 PolarHBondContact OD1-SG 2.99Å; D300-L313 WeakPolarHBondContact O-CB 3.43Å; D300-L313 WeakPolarHBondContact O-CG 3.47Å; D300-L313 PolarHBondContact O-N 3.16Å; D300-G333 WeakPolarHBondContact CB-O 3.35Å
301	G	97.8	Very high	94.1	Very high	19 Å²	19	50.3 Å²	50.3	20%	0.196	29%	0.288	C	S	.	.	S	Bend	trans	-90.7	10.9	-179	0	0	0	0	0	114.3	G314 G333	G301-G314 WeakPolarHBondContact O-CA 3.5Å; G301-G333 PolarHBondContact N-O 3.07Å
302	F	97.4	Very high	94.1	Very high	97 Å²	97	45.8 Å²	45.8	43%	0.425	27%	0.267	S	S	.	.	S	Bend	trans	-90.8	-166.8	-178.9	-55.2	-61.9	0	0	0	111.2	D300 C312 G314 R334	D300-F302 VanDerWaalsContact C-N 3.34Å; D300-F302 HydrophobicContact CB-CD2 3.99Å; D300-F302 VanDerWaalsContact OD1-CB 3.32Å; D300-F302 WeakPolarHBondContact OD1-CB 3.43Å; D300-F302 PolarHBondContact OD1-N 2.83Å; F302-C312 VanDerWaalsContact O-CB 3.3Å; F302-C312 WeakPolarHBondContact O-CB 3.48Å; F302-G314 WeakPolarHBondContact O-CA 3.36Å; F302-G314 PolarHBondContact O-N 3.46Å; F302-R334 HydrophobicContact CE2-CG 4.07Å; F302-R334 HydrophobicContact CZ-CG 4.29Å
303	T	96.7	Very high	94.2	Very high	96 Å²	96	45.8 Å²	45.8	59%	0.589	27%	0.267	S	S	*	.			trans	-131.3	28.3	-162.5	61.2	0	0	0	0	114.5	P305 L315	T303-P305 VanDerWaalsContact O-CD 3.32Å; T303-P305 WeakPolarHBondContact O-CD 3.36Å; T303-L315 HydrophobicContact CG2-CB 4.46Å
304	D	94.2	Very high	94.5	Very high	42 Å²	42	44.4 Å²	44.4	23%	0.225	26%	0.261	C	S	.	.			trans	-84.3	113.1	175.9	-178.7	-3.6	0	0	0	110.1	S306 N307 R310 C312	D304-S306 PolarHBondContact OD1-N 3.47Å; D304-S306 VanDerWaalsContact OD1-N 3.07Å; D304-S306 PolarHBondContact OD1-OG 3Å; D304-N307 WeakPolarHBondContact OD2-CB 3.35Å; D304-R310 IonicContact OD2-NH1 3.73Å; D304-R310 PolarHBondContact OD2-NH1 3.15Å; D304-C312 PolarHBondContact N-SG 3.5Å; D304-C312 VanDerWaalsContact O-CB 3.27Å; D304-C312 WeakPolarHBondContact O-CB 3.39Å; D304-C312 PolarHBondContact O-SG 2.89Å; D304-C312 VanDerWaalsContact O-SG 3.38Å
305	P	91.3	Very high	94.8	Very high	110 Å²	110	45 Å²	45	71%	0.714	27%	0.266	S	S	*	.	S	Bend	trans	-83.7	-11.1	-175.7	34.5	-36	0	0	0	113.8	T303 L315	T303-P305 VanDerWaalsContact O-CD 3.32Å; T303-P305 WeakPolarHBondContact O-CD 3.36Å; P305-L315 HydrophobicContact CB-CD2 4.04Å
306	S	88.6	Confident	95.1	Very high	105 Å²	105	44.3 Å²	44.3	73%	0.734	26%	0.261	S	S	*	.	S	Bend	trans	-113.9	-4.3	-159.4	63.3	0	0	0	0	115	D304	D304-S306 PolarHBondContact OD1-N 3.47Å; D304-S306 VanDerWaalsContact OD1-N 3.07Å; D304-S306 PolarHBondContact OD1-OG 3Å
307	N	88	Confident	95.3	Very high	55 Å²	55	48.5 Å²	48.5	29%	0.294	29%	0.29	S	S	.	.			trans	-94.2	115.5	-171.9	-173	-33.3	0	0	0	111.5	D304 E309 R310	D304-N307 WeakPolarHBondContact OD2-CB 3.35Å; N307-E309 PolarHBondContact O-N 2.79Å; N307-E309 VanDerWaalsContact O-N 3.16Å; N307-E309 WeakPolarHBondContact OD1-CA 3.41Å; N307-E309 WeakPolarHBondContact OD1-CB 3.46Å; N307-E309 PolarHBondContact OD1-N 2.87Å; N307-R310 HydrophobicContact CB-CB 4.02Å; N307-R310 HydrophobicContact CB-CG 4.27Å; N307-R310 WeakPolarHBondContact ND2-CD 3.25Å; N307-R310 PolarHBondContact O-N 2.94Å; N307-R310 PolarHBondContact OD1-N 2.62Å
308	S	89	Confident	95.3	Very high	69 Å²	69	49.5 Å²	49.5	48%	0.483	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-10.5	179.9	58.4	0	0	0	0	114.8	F290	F290-S308 WeakPolarHBondContact CZ-O 3.41Å
309	E	92.1	Very high	95.3	Very high	82 Å²	82	55 Å²	55	38%	0.383	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.6	173.5	-62.6	177.3	-170	0	0	112	Q294 L297 T298 N307	Q294-E309 HydrophobicContact CB-CG 4.1Å; Q294-E309 HydrophobicContact CG-CG 3.84Å; L297-E309 CarbonylContact C-O 3.47Å; L297-E309 VanDerWaalsContact CA-O 3.25Å; L297-E309 WeakPolarHBondContact CA-O 3.44Å; T298-E309 PolarHBondContact N-O 3.16Å; N307-E309 PolarHBondContact O-N 2.79Å; N307-E309 VanDerWaalsContact O-N 3.16Å; N307-E309 WeakPolarHBondContact OD1-CA 3.41Å; N307-E309 WeakPolarHBondContact OD1-CB 3.46Å; N307-E309 PolarHBondContact OD1-N 2.87Å
310	R	96	Very high	95.2	Very high	66 Å²	66	60.2 Å²	60.2	25%	0.249	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	117.7	-177	-60.2	178.8	64.4	-152.8	-0	112	T298 D300 D304 N307 C312	T298-R310 CarbonylContact O-C 3.45Å; T298-R310 VanDerWaalsContact O-CA 3.28Å; T298-R310 WeakPolarHBondContact O-CA 3.29Å; D300-R310 IonicContact OD1-NH2 3.13Å; D300-R310 PolarHBondContact OD1-NH2 3.4Å; D300-R310 IonicContact OD2-CZ 3.88Å; D300-R310 VanDerWaalsContact OD2-CZ 3.23Å; D300-R310 IonicContact OD2-NE 3.27Å; D300-R310 PolarHBondContact OD2-NE 3.26Å; D300-R310 IonicContact OD2-NH2 3.89Å; D300-R310 PolarHBondContact OD2-NH2 2.79Å; D304-R310 IonicContact OD2-NH1 3.73Å; D304-R310 PolarHBondContact OD2-NH1 3.15Å; N307-R310 HydrophobicContact CB-CB 4.02Å; N307-R310 HydrophobicContact CB-CG 4.27Å; N307-R310 WeakPolarHBondContact ND2-CD 3.25Å; N307-R310 PolarHBondContact O-N 2.94Å; N307-R310 PolarHBondContact OD1-N 2.62Å; R310-C312 PolarHBondContact O-N 2.76Å
311	F	97.3	Very high	95.2	Very high	14 Å²	14	63 Å²	63	6%	0.061	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	93	167.3	-173.8	-159.6	0	0	0	109.4	I277 F290 T298 V299 D300 L313 L316	I277-F311 HydrophobicContact CB-CD1 4.1Å; I277-F311 HydrophobicContact CB-CE1 4.13Å; I277-F311 HydrophobicContact CG2-CD1 4.07Å; I277-F311 HydrophobicContact CG2-CE1 4.04Å; F290-F311 HydrophobicContact CB-CB 4.21Å; F290-F311 HydrophobicContact CB-CD1 3.69Å; F290-F311 HydrophobicContact CB-CD2 3.85Å; F290-F311 HydrophobicContact CB-CE1 3.91Å; F290-F311 HydrophobicContact CB-CE2 4.08Å; F290-F311 HydrophobicContact CB-CG 3.66Å; F290-F311 HydrophobicContact CB-CZ 4.1Å; F290-F311 HydrophobicContact CD1-CB 4.15Å; F290-F311 HydrophobicContact CD2-CB 3.72Å; F290-F311 AromaticContact CD2-CD2 3.89Å; F290-F311 HydrophobicContact CD2-CD2 3.89Å; F290-F311 AromaticContact CD2-CG 3.88Å; F290-F311 HydrophobicContact CD2-CG 3.88Å; F290-F311 HydrophobicContact CE1-CB 4.45Å; F290-F311 HydrophobicContact CE2-CB 4.05Å; F290-F311 HydrophobicContact CG-CB 3.76Å; F290-F311 HydrophobicContact CG-CD1 4.17Å; F290-F311 HydrophobicContact CG-CD2 4.11Å; F290-F311 AromaticContact CG-CG 3.77Å; F290-F311 HydrophobicContact CG-CG 3.77Å; F290-F311 HydrophobicContact CZ-CB 4.39Å; T298-F311 PolarHBondContact O-N 2.9Å; V299-F311 WeakPolarHBondContact CA-O 3.46Å; V299-F311 HydrophobicContact CB-CB 4.45Å; V299-F311 HydrophobicContact CG1-CB 4.28Å; V299-F311 HydrophobicContact CG1-CD1 3.92Å; V299-F311 HydrophobicContact CG1-CG 4.35Å; V299-F311 HydrophobicContact CG2-CB 4.14Å; V299-F311 HydrophobicContact CG2-CD1 4.23Å; D300-F311 PolarHBondContact N-O 2.88Å; F311-L313 HydrophobicContact CD1-CD2 3.98Å; F311-L313 HydrophobicContact CD2-CD2 4.23Å; F311-L313 HydrophobicContact CE1-CD2 3.75Å; F311-L313 HydrophobicContact CE2-CD2 4.01Å; F311-L313 HydrophobicContact CG-CD2 4.22Å; F311-L313 HydrophobicContact CZ-CD2 3.77Å; F311-L313 PolarHBondContact O-N 2.9Å; F311-L316 HydrophobicContact CE2-CD1 4.08Å; F311-L316 HydrophobicContact CZ-CD1 4.25Å
312	C	97.4	Very high	95.2	Very high	4 Å²	4	65.3 Å²	65.3	3%	0.027	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	100.7	-175.9	-76.3	0	0	0	0	111.6	D300 F302 D304 R310 G314 L315	D300-C312 PolarHBondContact OD1-SG 2.99Å; F302-C312 VanDerWaalsContact O-CB 3.3Å; F302-C312 WeakPolarHBondContact O-CB 3.48Å; D304-C312 PolarHBondContact N-SG 3.5Å; D304-C312 VanDerWaalsContact O-CB 3.27Å; D304-C312 WeakPolarHBondContact O-CB 3.39Å; D304-C312 PolarHBondContact O-SG 2.89Å; D304-C312 VanDerWaalsContact O-SG 3.38Å; R310-C312 PolarHBondContact O-N 2.76Å; C312-G314 VanDerWaalsContact C-N 3.27Å; C312-G314 PolarHBondContact O-N 2.9Å; C312-L315 HydrophobicContact CB-CD2 3.77Å; C312-L315 WeakPolarHBondContact O-CD2 3.1Å; C312-L315 WeakPolarHBondContact O-CG 3.17Å
313	L	97.9	Very high	95.2	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-71	-23.4	-178.2	-55.4	-178.6	0	0	0	112.7	Y279 V299 D300 F311 L315 L316 R329 I332 F418	Y279-L313 HydrophobicContact CD1-CD2 4.13Å; Y279-L313 HydrophobicContact CD2-CD1 3.77Å; Y279-L313 HydrophobicContact CD2-CD2 3.86Å; Y279-L313 HydrophobicContact CD2-CG 4.37Å; Y279-L313 HydrophobicContact CE2-CD1 3.75Å; Y279-L313 HydrophobicContact CE2-CD2 4.46Å; Y279-L313 HydrophobicContact CG-CD1 4.42Å; Y279-L313 HydrophobicContact CG-CD2 3.67Å; V299-L313 HydrophobicContact CG1-CD1 3.69Å; V299-L313 HydrophobicContact CG1-CD2 3.93Å; V299-L313 HydrophobicContact CG1-CG 3.76Å; D300-L313 WeakPolarHBondContact O-CB 3.43Å; D300-L313 WeakPolarHBondContact O-CG 3.47Å; D300-L313 PolarHBondContact O-N 3.16Å; F311-L313 HydrophobicContact CD1-CD2 3.98Å; F311-L313 HydrophobicContact CD2-CD2 4.23Å; F311-L313 HydrophobicContact CE1-CD2 3.75Å; F311-L313 HydrophobicContact CE2-CD2 4.01Å; F311-L313 HydrophobicContact CG-CD2 4.22Å; F311-L313 HydrophobicContact CZ-CD2 3.77Å; F311-L313 PolarHBondContact O-N 2.9Å; L313-L315 VanDerWaalsContact C-N 3.29Å; L313-L315 PolarHBondContact O-N 2.76Å; L313-L316 HydrophobicContact CD2-CD1 3.96Å; L313-L316 WeakPolarHBondContact O-CB 3.31Å; L313-L316 PolarHBondContact O-N 2.97Å; L313-L316 VanDerWaalsContact O-N 3.16Å; L313-R329 VanDerWaalsContact O-CZ 3.31Å; L313-R329 PolarHBondContact O-NH1 3.49Å; L313-R329 PolarHBondContact O-NH2 3.34Å; L313-I332 HydrophobicContact CD1-CD1 4.02Å; L313-F418 HydrophobicContact CD1-CD2 4.43Å; L313-F418 HydrophobicContact CD1-CE2 3.75Å; L313-F418 HydrophobicContact CD1-CZ 4.1Å
314	G	97.1	Very high	95.2	Very high	26 Å²	26	63.1 Å²	63.1	27%	0.268	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-62.3	-31.4	-174	0	0	0	0	0	114.1	G301 F302 C312 R329	G301-G314 WeakPolarHBondContact O-CA 3.5Å; F302-G314 WeakPolarHBondContact O-CA 3.36Å; F302-G314 PolarHBondContact O-N 3.46Å; C312-G314 VanDerWaalsContact C-N 3.27Å; C312-G314 PolarHBondContact O-N 2.9Å; G314-R329 VanDerWaalsContact C-NH2 3.32Å; G314-R329 VanDerWaalsContact CA-NH2 3.33Å; G314-R329 PolarHBondContact O-NH2 3.19Å
315	L	96	Very high	95.4	Very high	71 Å²	71	61.2 Å²	61.2	37%	0.372	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-80.1	-17.7	178.4	68.4	97.3	0	0	0	113.7	T303 P305 C312 L313 S317	T303-L315 HydrophobicContact CG2-CB 4.46Å; P305-L315 HydrophobicContact CB-CD2 4.04Å; C312-L315 HydrophobicContact CB-CD2 3.77Å; C312-L315 WeakPolarHBondContact O-CD2 3.1Å; C312-L315 WeakPolarHBondContact O-CG 3.17Å; L313-L315 VanDerWaalsContact C-N 3.29Å; L313-L315 PolarHBondContact O-N 2.76Å; L315-S317 PolarHBondContact O-N 2.98Å
316	L	97	Very high	95.7	Very high	23 Å²	23	60.2 Å²	60.2	12%	0.12	35%	0.352	C	S	.	.			trans	-70.3	126.2	-177	-55.1	178.6	0	0	0	110.4	Y279 V286 F311 L313 R321 R329	Y279-L316 HydrophobicContact CD1-CD1 3.58Å; Y279-L316 HydrophobicContact CE1-CD1 4.29Å; Y279-L316 HydrophobicContact CG-CD1 4.25Å; V286-L316 HydrophobicContact CG1-CB 3.98Å; F311-L316 HydrophobicContact CE2-CD1 4.08Å; F311-L316 HydrophobicContact CZ-CD1 4.25Å; L313-L316 HydrophobicContact CD2-CD1 3.96Å; L313-L316 WeakPolarHBondContact O-CB 3.31Å; L313-L316 PolarHBondContact O-N 2.97Å; L313-L316 VanDerWaalsContact O-N 3.16Å; L316-R321 PolarHBondContact O-NH1 2.98Å; L316-R321 PolarHBondContact O-NH2 3.23Å; L316-R329 PolarHBondContact O-NH2 2.96Å
317	S	96.7	Very high	96.2	Very high	109 Å²	109	61 Å²	61	76%	0.762	35%	0.345	S	S	*	.			trans	-92.9	145.8	178.8	-66.4	0	0	0	0	111.3	L315	L315-S317 PolarHBondContact O-N 2.98Å
318	N	96.8	Very high	96.7	Very high	23 Å²	23	58.5 Å²	58.5	12%	0.123	33%	0.333	C	S	.	.			trans	-146.4	118.7	172.2	177.8	12.1	0	0	0	108.5	E281 Q284 V286 N320 R321	E281-N318 WeakPolarHBondContact OE2-CB 3.32Å; E281-N318 PolarHBondContact OE2-ND2 2.92Å; Q284-N318 PolarHBondContact OE1-OD1 3.45Å; V286-N318 HydrophobicContact CG1-CB 4.05Å; V286-N318 HydrophobicContact CG2-CB 3.96Å; N318-N320 VanDerWaalsContact C-N 3.27Å; N318-N320 PolarHBondContact O-N 2.83Å; N318-N320 PolarHBondContact OD1-N 3.2Å; N318-R321 HydrophobicContact CB-CB 4.19Å; N318-R321 VanDerWaalsContact O-CB 3.24Å; N318-R321 WeakPolarHBondContact O-CB 3.35Å; N318-R321 PolarHBondContact O-N 3.16Å
319	V	97.2	Very high	97.1	Very high	140 Å²	140	56.4 Å²	56.4	85%	0.848	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.5	-179.2	-63.7	0	0	0	0	112.9	R321	V319-R321 VanDerWaalsContact C-N 3.31Å
320	N	96.5	Very high	97.4	Very high	108 Å²	108	60 Å²	60	58%	0.578	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	9.6	179.2	-60.1	-34.9	0	0	0	112.7	Q284 N318 N322	Q284-N320 PolarHBondContact NE2-ND2 3.29Å; Q284-N320 PolarHBondContact OE1-ND2 2.86Å; N318-N320 VanDerWaalsContact C-N 3.27Å; N318-N320 PolarHBondContact O-N 2.83Å; N318-N320 PolarHBondContact OD1-N 3.2Å; N320-N322 PolarHBondContact O-N 3.28Å
321	R	97.6	Very high	97.5	Very high	64 Å²	64	61.6 Å²	61.6	24%	0.242	33%	0.334	C	S	.	.			trans	-67.4	121.3	-176.1	-174.9	175	-66.2	147.4	0.3	110.8	E281 L316 N318 V319 V325 E326 R329	E281-R321 IonicContact OE1-CZ 3.66Å; E281-R321 VanDerWaalsContact OE1-CZ 3.27Å; E281-R321 IonicContact OE1-NE 3.36Å; E281-R321 PolarHBondContact OE1-NE 3.23Å; E281-R321 IonicContact OE1-NH2 3.36Å; E281-R321 PolarHBondContact OE1-NH2 3.19Å; E281-R321 IonicContact OE2-CZ 3.62Å; E281-R321 IonicContact OE2-NE 3.23Å; E281-R321 PolarHBondContact OE2-NE 3.41Å; E281-R321 IonicContact OE2-NH2 2.74Å; L316-R321 PolarHBondContact O-NH1 2.98Å; L316-R321 PolarHBondContact O-NH2 3.23Å; N318-R321 HydrophobicContact CB-CB 4.19Å; N318-R321 VanDerWaalsContact O-CB 3.24Å; N318-R321 WeakPolarHBondContact O-CB 3.35Å; N318-R321 PolarHBondContact O-N 3.16Å; V319-R321 VanDerWaalsContact C-N 3.31Å; R321-V325 HydrophobicContact CG-CB 3.89Å; R321-V325 HydrophobicContact CG-CG1 3.73Å; R321-E326 HydrophobicContact CG-CB 4.47Å; R321-R329 VanDerWaalsContact CZ-CZ 3.5Å; R321-R329 VanDerWaalsContact CZ-NE 3.29Å; R321-R329 VanDerWaalsContact NH2-CZ 3.27Å
322	N	97.7	Very high	97.5	Very high	66 Å²	66	61 Å²	61	35%	0.353	33%	0.331	S	S	.	.			trans	-90.9	168.8	174.6	71.8	40.5	0	0	0	112.5	N320 T324 V325 E326	N320-N322 PolarHBondContact O-N 3.28Å; N322-T324 VanDerWaalsContact C-N 3.26Å; N322-T324 PolarHBondContact O-N 2.73Å; N322-T324 WeakPolarHBondContact OD1-CA 3.42Å; N322-T324 WeakPolarHBondContact OD1-CB 3.46Å; N322-T324 PolarHBondContact OD1-N 3.11Å; N322-V325 PolarHBondContact O-N 3.06Å; N322-V325 VanDerWaalsContact O-N 3.13Å; N322-V325 WeakPolarHBondContact OD1-CG2 3.32Å; N322-V325 PolarHBondContact OD1-N 3.35Å; N322-E326 PolarHBondContact O-N 3.09Å
323	A	98.1	Very high	97.5	Very high	75 Å²	75	61.7 Å²	61.7	62%	0.62	34%	0.34	S	S	*	.	H	α-helix	trans	-58.5	-32.5	-178.1	0	0	0	0	0	114.1	E326 M327	A323-E326 PolarHBondContact O-N 2.94Å; A323-M327 WeakPolarHBondContact O-CB 3.26Å; A323-M327 PolarHBondContact O-N 3.26Å
324	T	97.8	Very high	97.5	Very high	73 Å²	73	67.5 Å²	67.5	45%	0.448	36%	0.362	S	S	.	.	H	α-helix	trans	-69.4	-41.5	178.2	-62.7	0	0	0	0	111.2	N322 T328 P435	N322-T324 VanDerWaalsContact C-N 3.26Å; N322-T324 PolarHBondContact O-N 2.73Å; N322-T324 WeakPolarHBondContact OD1-CA 3.42Å; N322-T324 WeakPolarHBondContact OD1-CB 3.46Å; N322-T324 PolarHBondContact OD1-N 3.11Å; T324-T328 WeakPolarHBondContact O-CB 3.35Å; T324-T328 PolarHBondContact O-N 2.96Å; T324-T328 PolarHBondContact O-OG1 3.12Å; T324-P435 HydrophobicContact CG2-CB 4.41Å; T324-P435 HydrophobicContact CG2-CG 3.86Å
325	V	98.3	Very high	97.5	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.012	35%	0.349	C	S	.	.	H	α-helix	trans	-64.2	-46.8	174.5	177.1	0	0	0	0	109.9	E281 L282 R321 N322 M327 T328 R329 P435	E281-V325 HydrophobicContact CB-CG1 4.02Å; E281-V325 VanDerWaalsContact CD-CG1 3.44Å; E281-V325 HydrophobicContact CG-CG1 3.71Å; E281-V325 WeakPolarHBondContact OE2-CG1 3.12Å; L282-V325 HydrophobicContact CD1-CG2 4.43Å; L282-V325 HydrophobicContact CG-CG2 4.27Å; R321-V325 HydrophobicContact CG-CB 3.89Å; R321-V325 HydrophobicContact CG-CG1 3.73Å; N322-V325 PolarHBondContact O-N 3.06Å; N322-V325 VanDerWaalsContact O-N 3.13Å; N322-V325 WeakPolarHBondContact OD1-CG2 3.32Å; N322-V325 PolarHBondContact OD1-N 3.35Å; V325-M327 VanDerWaalsContact C-N 3.34Å; V325-M327 PolarHBondContact O-N 3.23Å; V325-T328 PolarHBondContact O-N 3.11Å; V325-T328 VanDerWaalsContact O-N 3.1Å; V325-R329 HydrophobicContact CG1-CG 4.34Å; V325-R329 WeakPolarHBondContact O-CG 3.28Å; V325-R329 PolarHBondContact O-N 2.72Å; V325-P435 HydrophobicContact CB-CB 4.32Å; V325-P435 HydrophobicContact CG2-CB 3.84Å
326	E	97.7	Very high	97.6	Very high	89 Å²	89	62.9 Å²	62.9	42%	0.416	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-41.2	179.1	-154.8	-166.1	144.5	0	0	112.6	R321 N322 A323 R330	R321-E326 HydrophobicContact CG-CB 4.47Å; N322-E326 PolarHBondContact O-N 3.09Å; A323-E326 PolarHBondContact O-N 2.94Å; E326-R330 PolarHBondContact O-N 3.33Å; E326-R330 PolarHBondContact O-NH1 3.12Å; E326-R330 IonicContact OE1-CZ 3.43Å; E326-R330 IonicContact OE1-NH1 3.46Å; E326-R330 PolarHBondContact OE1-NH1 2.99Å; E326-R330 IonicContact OE1-NH2 2.67Å; E326-R330 PolarHBondContact OE1-NH2 2.94Å
327	M	97.6	Very high	97.6	Very high	120 Å²	120	64.1 Å²	64.1	59%	0.591	33%	0.334	S	S	*	.	H	α-helix	trans	-65.9	-39.2	174.2	-175	-179.6	-73.8	0	0	111.9	A323 V325 R330 H331	A323-M327 WeakPolarHBondContact O-CB 3.26Å; A323-M327 PolarHBondContact O-N 3.26Å; V325-M327 VanDerWaalsContact C-N 3.34Å; V325-M327 PolarHBondContact O-N 3.23Å; M327-R330 PolarHBondContact O-N 3.38Å; M327-H331 PolarHBondContact O-ND1 3.18Å
328	T	98.2	Very high	97.7	Very high	4 Å²	4	59 Å²	59	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-42.7	179	-58.8	0	0	0	0	111.4	T324 V325 R330 H331 I332 V419 P435 C436	T324-T328 WeakPolarHBondContact O-CB 3.35Å; T324-T328 PolarHBondContact O-N 2.96Å; T324-T328 PolarHBondContact O-OG1 3.12Å; V325-T328 PolarHBondContact O-N 3.11Å; V325-T328 VanDerWaalsContact O-N 3.1Å; T328-R330 VanDerWaalsContact C-N 3.26Å; T328-R330 PolarHBondContact O-N 3.45Å; T328-H331 PolarHBondContact O-N 3.36Å; T328-I332 PolarHBondContact O-N 3.36Å; T328-V419 HydrophobicContact CG2-CB 3.93Å; T328-V419 HydrophobicContact CG2-CG2 3.93Å; T328-P435 HydrophobicContact CG2-CB 4.07Å; T328-P435 HydrophobicContact CG2-CG 4.36Å; T328-C436 HydrophobicContact CG2-CB 4.05Å
329	R	98.4	Very high	97.6	Very high	24 Å²	24	58 Å²	58	9%	0.091	29%	0.293	C	S	.	.	H	α-helix	trans	-55.8	-38.5	177	-72.6	170.1	60.8	79.8	3.6	112.9	Y279 E281 L313 G314 L316 R321 V325 H331 I332 C436	Y279-R329 PolarHBondContact OH-NH1 3.08Å; Y279-R329 VanDerWaalsContact OH-NH1 3.14Å; E281-R329 WeakPolarHBondContact OE1-CD 3.4Å; E281-R329 IonicContact OE1-CZ 3.68Å; E281-R329 IonicContact OE1-NE 3.82Å; E281-R329 IonicContact OE1-NH1 3.01Å; E281-R329 PolarHBondContact OE1-NH1 3.37Å; L313-R329 VanDerWaalsContact O-CZ 3.31Å; L313-R329 PolarHBondContact O-NH1 3.49Å; L313-R329 PolarHBondContact O-NH2 3.34Å; G314-R329 VanDerWaalsContact C-NH2 3.32Å; G314-R329 VanDerWaalsContact CA-NH2 3.33Å; G314-R329 PolarHBondContact O-NH2 3.19Å; L316-R329 PolarHBondContact O-NH2 2.96Å; R321-R329 VanDerWaalsContact CZ-CZ 3.5Å; R321-R329 VanDerWaalsContact CZ-NE 3.29Å; R321-R329 VanDerWaalsContact NH2-CZ 3.27Å; V325-R329 HydrophobicContact CG1-CG 4.34Å; V325-R329 WeakPolarHBondContact O-CG 3.28Å; V325-R329 PolarHBondContact O-N 2.72Å; R329-H331 PolarHBondContact O-N 2.86Å; R329-I332 HydrophobicContact CG-CD1 4.5Å; R329-I332 WeakPolarHBondContact O-CB 3.45Å; R329-I332 PolarHBondContact O-N 2.74Å; R329-C436 VanDerWaalsContact CG-SG 3.53Å
330	R	97.8	Very high	97.4	Very high	159 Å²	159	52.7 Å²	52.7	60%	0.6	26%	0.258	S	S	*	.	H	α-helix	trans	-61	-30.5	176.3	-67.8	176.1	-179.9	92.6	-5.9	113.2	E326 M327 T328	E326-R330 PolarHBondContact O-N 3.33Å; E326-R330 PolarHBondContact O-NH1 3.12Å; E326-R330 IonicContact OE1-CZ 3.43Å; E326-R330 IonicContact OE1-NH1 3.46Å; E326-R330 PolarHBondContact OE1-NH1 2.99Å; E326-R330 IonicContact OE1-NH2 2.67Å; E326-R330 PolarHBondContact OE1-NH2 2.94Å; M327-R330 PolarHBondContact O-N 3.38Å; T328-R330 VanDerWaalsContact C-N 3.26Å; T328-R330 PolarHBondContact O-N 3.45Å
331	H	97.9	Very high	97.1	Very high	98 Å²	98	48.3 Å²	48.3	45%	0.454	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.2	-177.9	-67.3	85.8	0	0	0	113.4	M327 T328 R329 G333 S351 V419	M327-H331 PolarHBondContact O-ND1 3.18Å; T328-H331 PolarHBondContact O-N 3.36Å; R329-H331 PolarHBondContact O-N 2.86Å; H331-G333 VanDerWaalsContact C-N 3.32Å; H331-S351 PolarHBondContact O-OG 2.9Å; H331-V419 HydrophobicContact CB-CG1 4.32Å; H331-V419 HydrophobicContact CB-CG2 3.7Å
332	I	98.3	Very high	96.6	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-47.3	171.7	-61.2	177.8	0	0	0	108.7	L313 T328 R329 R334 G335 S351 F418 C436	L313-I332 HydrophobicContact CD1-CD1 4.02Å; T328-I332 PolarHBondContact O-N 3.36Å; R329-I332 HydrophobicContact CG-CD1 4.5Å; R329-I332 WeakPolarHBondContact O-CB 3.45Å; R329-I332 PolarHBondContact O-N 2.74Å; I332-R334 PolarHBondContact O-N 3.38Å; I332-G335 WeakPolarHBondContact O-CA 3.3Å; I332-G335 PolarHBondContact O-N 3.49Å; I332-S351 WeakPolarHBondContact O-CB 3.34Å; I332-S351 PolarHBondContact O-OG 3.23Å; I332-F418 HydrophobicContact CD1-CB 4.39Å; I332-F418 HydrophobicContact CD1-CD2 4.28Å; I332-F418 HydrophobicContact CD1-CG 4.25Å; I332-F418 HydrophobicContact CG1-CB 3.92Å; I332-F418 HydrophobicContact CG1-CD1 4.36Å; I332-F418 HydrophobicContact CG1-CG 4.05Å; I332-F418 HydrophobicContact CG2-CD1 3.92Å; I332-F418 HydrophobicContact CG2-CE1 4.07Å; I332-F418 HydrophobicContact CG2-CG 4.39Å; I332-C436 HydrophobicContact CD1-CB 4.21Å
333	G	97	Very high	96.2	Very high	20 Å²	20	42.9 Å²	42.9	21%	0.206	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	-123.2	178.5	0	0	0	0	0	111	D300 G301 H331 G335	D300-G333 WeakPolarHBondContact CB-O 3.35Å; G301-G333 PolarHBondContact N-O 3.07Å; H331-G333 VanDerWaalsContact C-N 3.32Å; G333-G335 PolarHBondContact O-N 2.73Å
334	R	97	Very high	96.1	Very high	122 Å²	122	41.2 Å²	41.2	46%	0.46	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-9.1	176.1	-61.4	172.4	61.3	-149	-5.2	114.3	T298 F302 I332 L350	T298-R334 WeakPolarHBondContact CG2-O 3.27Å; F302-R334 HydrophobicContact CE2-CG 4.07Å; F302-R334 HydrophobicContact CZ-CG 4.29Å; I332-R334 PolarHBondContact O-N 3.38Å; R334-L350 HydrophobicContact CB-CB 3.72Å; R334-L350 WeakPolarHBondContact CB-O 3.28Å
335	G	98	Very high	96.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.172	C	C	.	.			trans	62.6	-130.9	170.1	0	0	0	0	0	114.9	V299 I332 G333 L350 S351	V299-G335 CarbonylContact O-C 3.56Å; V299-G335 VanDerWaalsContact O-CA 3.27Å; V299-G335 WeakPolarHBondContact O-CA 3.49Å; I332-G335 WeakPolarHBondContact O-CA 3.3Å; I332-G335 PolarHBondContact O-N 3.49Å; G333-G335 PolarHBondContact O-N 2.73Å; G335-L350 CarbonylContact O-C 3.58Å; G335-L350 WeakPolarHBondContact O-CA 3.45Å; G335-L350 PolarHBondContact O-N 3.44Å; G335-S351 PolarHBondContact O-N 2.87Å
336	V	98.5	Very high	96	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.3	-177.5	61.3	0	0	0	0	110.1	T298 V299 L338 A347 E348 I355 F418 I438	T298-V336 CarbonylContact C-O 3.56Å; T298-V336 WeakPolarHBondContact CA-O 3.33Å; V299-V336 HydrophobicContact CB-CG1 3.91Å; V299-V336 HydrophobicContact CG2-CG1 4.33Å; V299-V336 PolarHBondContact N-O 3.34Å; V299-V336 PolarHBondContact O-N 3.03Å; V336-L338 HydrophobicContact CG2-CD2 3.89Å; V336-L338 HydrophobicContact CG2-CG 4.43Å; V336-A347 HydrophobicContact CG2-CB 4Å; V336-E348 WeakPolarHBondContact CA-O 3.39Å; V336-I355 HydrophobicContact CB-CD1 3.84Å; V336-I355 HydrophobicContact CG2-CD1 3.43Å; V336-I355 VanDerWaalsContact CG2-CD1 3.43Å; V336-F418 HydrophobicContact CB-CE1 4.3Å; V336-F418 HydrophobicContact CG1-CE1 3.82Å; V336-F418 HydrophobicContact CG1-CZ 3.94Å; V336-I438 HydrophobicContact CG1-CD1 4.33Å
337	R	97.6	Very high	96	Very high	50 Å²	50	35 Å²	35	19%	0.189	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129.3	165.2	178.5	-177.6	-66.7	153	-12.3	109.5	L297 Y339 A347 E348 L350	L297-R337 WeakPolarHBondContact O-CA 3.43Å; L297-R337 WeakPolarHBondContact O-CG 3.49Å; R337-Y339 HydrophobicContact CG-CD1 4.27Å; R337-A347 WeakPolarHBondContact O-CA 3.28Å; R337-E348 HydrophobicContact CB-CB 4.29Å; R337-E348 WeakPolarHBondContact CD-OE2 3.47Å; R337-E348 IonicContact CZ-OE2 3.18Å; R337-E348 PolarHBondContact N-O 2.84Å; R337-E348 IonicContact NE-OE2 2.74Å; R337-E348 IonicContact NH1-OE2 2.74Å; R337-E348 PolarHBondContact NH1-OE2 2.88Å; R337-E348 PolarHBondContact O-N 2.61Å; R337-L350 HydrophobicContact CB-CD1 3.77Å; R337-L350 HydrophobicContact CB-CG 4.1Å
338	L	97.6	Very high	96	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.1	172.9	-56.5	175.3	0	0	0	108.4	W274 I277 S296 L297 V336 F346 A347 I384 M416 L440	W274-L338 HydrophobicContact CH2-CB 4.06Å; W274-L338 HydrophobicContact CZ2-CB 4.48Å; I277-L338 HydrophobicContact CD1-CD1 4.01Å; S296-L338 WeakPolarHBondContact CA-O 3.36Å; L297-L338 HydrophobicContact CD1-CD1 4.45Å; L297-L338 HydrophobicContact CD2-CB 4.41Å; L297-L338 HydrophobicContact CG-CB 4.2Å; L297-L338 PolarHBondContact N-O 3.29Å; L297-L338 PolarHBondContact O-N 2.97Å; V336-L338 HydrophobicContact CG2-CD2 3.89Å; V336-L338 HydrophobicContact CG2-CG 4.43Å; L338-F346 WeakPolarHBondContact CA-O 3.23Å; L338-A347 HydrophobicContact CD2-CB 3.78Å; L338-I384 HydrophobicContact CD2-CD1 4.22Å; L338-M416 HydrophobicContact CD1-CE 4.13Å; L338-M416 HydrophobicContact CD2-CE 3.62Å; L338-M416 HydrophobicContact CD2-SD 4.05Å; L338-L440 HydrophobicContact CD1-CD1 3.64Å; L338-L440 HydrophobicContact CD1-CD2 4.03Å
339	Y	94.3	Very high	96	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.016	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	137.9	175.6	56.4	-91	0	0	0	111.7	H141 P295 R337 I341 V345 F346 E348	H141-Y339 HydrophobicContact CB-CD2 4.23Å; H141-Y339 HydrophobicContact CB-CE2 3.87Å; H141-Y339 AromaticContact CD2-CE1 3.66Å; H141-Y339 AromaticContact CD2-CE2 3.54Å; H141-Y339 AromaticContact CD2-CZ 3.36Å; H141-Y339 AromaticContact CE1-CZ 3.83Å; H141-Y339 PolarHBondContact CE1-OH 2.91Å; H141-Y339 AromaticContact CG-CE2 3.63Å; H141-Y339 AromaticContact CG-CZ 3.78Å; H141-Y339 AromaticContact NE2-CE1 3.65Å; H141-Y339 AromaticContact NE2-CZ 3.45Å; H141-Y339 PolarHBondContact NE2-OH 3.11Å; P295-Y339 CarbonylContact O-C 3.44Å; P295-Y339 WeakPolarHBondContact O-CA 3.3Å; R337-Y339 HydrophobicContact CG-CD1 4.27Å; Y339-I341 HydrophobicContact CD2-CD1 3.42Å; Y339-I341 VanDerWaalsContact CD2-CD1 3.42Å; Y339-I341 HydrophobicContact CD2-CG1 3.94Å; Y339-I341 HydrophobicContact CE2-CD1 4.04Å; Y339-I341 HydrophobicContact CG-CD1 4.26Å; Y339-V345 WeakPolarHBondContact O-CA 3.28Å; Y339-F346 HydrophobicContact CD1-CB 4.17Å; Y339-F346 HydrophobicContact CD2-CB 3.84Å; Y339-F346 AromaticContact CD2-CD2 3.79Å; Y339-F346 HydrophobicContact CD2-CD2 3.79Å; Y339-F346 HydrophobicContact CD2-CG 4.12Å; Y339-F346 HydrophobicContact CE1-CB 3.64Å; Y339-F346 HydrophobicContact CE1-CG 4.49Å; Y339-F346 HydrophobicContact CE2-CB 3.3Å; Y339-F346 HydrophobicContact CE2-CD1 4.21Å; Y339-F346 AromaticContact CE2-CD2 3.28Å; Y339-F346 HydrophobicContact CE2-CD2 3.28Å; Y339-F346 HydrophobicContact CE2-CE2 4.09Å; Y339-F346 AromaticContact CE2-CG 3.35Å; Y339-F346 HydrophobicContact CE2-CG 3.35Å; Y339-F346 HydrophobicContact CG-CB 4.27Å; Y339-F346 AromaticContact CZ-CG 3.56Å; Y339-F346 PolarHBondContact N-O 2.67Å; Y339-F346 VanDerWaalsContact N-O 3.16Å; Y339-F346 PolarHBondContact O-N 3.19Å; Y339-F346 VanDerWaalsContact OH-CB 3.32Å; Y339-F346 WeakPolarHBondContact OH-CB 3.36Å; Y339-F346 WeakPolarHBondContact OH-CG 3.39Å; Y339-E348 HydrophobicContact CE1-CB 4.2Å
340	Y	94.1	Very high	95.9	Very high	28 Å²	28	30.3 Å²	30.3	11%	0.11	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	113	178.6	177.6	-123.4	0	0	0	109.5	E270 W274 P295 E344 V345 N387	E270-Y340 VanDerWaalsContact CD-OH 3.27Å; E270-Y340 PolarHBondContact OE1-OH 2.94Å; E270-Y340 VanDerWaalsContact OE1-OH 3.13Å; E270-Y340 PolarHBondContact OE2-OH 2.91Å; W274-Y340 HydrophobicContact CB-CD1 4.13Å; W274-Y340 HydrophobicContact CD2-CG 4.34Å; W274-Y340 HydrophobicContact CE3-CG 4.33Å; W274-Y340 HydrophobicContact CG-CD1 4.3Å; W274-Y340 HydrophobicContact CG-CG 4.47Å; P295-Y340 PolarHBondContact O-N 2.83Å; Y340-E344 CarbonylContact C-O 3.59Å; Y340-E344 WeakPolarHBondContact CA-O 3.42Å; Y340-E344 WeakPolarHBondContact CD2-O 3.27Å; Y340-V345 HydrophobicContact CD2-CG2 3.79Å; Y340-V345 HydrophobicContact CE2-CG2 4.5Å; Y340-N387 PolarHBondContact OH-ND2 2.88Å
341	I	89.8	Confident	95.9	Very high	16 Å²	16	22.9 Å²	22.9	8%	0.082	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	126.6	-173.4	-59.3	176.7	0	0	0	109	H141 E142 V170 Y339 G343 E344	H141-I341 HydrophobicContact CB-CD1 3.18Å; E142-I341 HydrophobicContact CG-CD1 3.85Å; E142-I341 HydrophobicContact CG-CG1 4.05Å; E142-I341 HydrophobicContact CG-CG2 4.25Å; V170-I341 HydrophobicContact CB-CG2 3.93Å; V170-I341 HydrophobicContact CG1-CG2 3.91Å; V170-I341 HydrophobicContact CG2-CG2 4.47Å; Y339-I341 HydrophobicContact CD2-CD1 3.42Å; Y339-I341 VanDerWaalsContact CD2-CD1 3.42Å; Y339-I341 HydrophobicContact CD2-CG1 3.94Å; Y339-I341 HydrophobicContact CE2-CD1 4.04Å; Y339-I341 HydrophobicContact CG-CD1 4.26Å; I341-G343 VanDerWaalsContact C-N 3.25Å; I341-G343 PolarHBondContact O-N 3.41Å; I341-E344 PolarHBondContact N-O 3.16Å; I341-E344 WeakPolarHBondContact O-CB 3.48Å; I341-E344 PolarHBondContact O-N 3.22Å
342	G	86.1	Confident	95.9	Very high	13 Å²	13	25.5 Å²	25.5	13%	0.134	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	28.9	173.6	0	0	0	0	0	114.4	P173 E344	P173-G342 WeakPolarHBondContact CD-O 3.42Å; G342-E344 VanDerWaalsContact C-N 3.31Å
343	G	91.1	Very high	95.9	Very high	3 Å²	3	26.7 Å²	26.7	3%	0.031	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	11.6	-174.4	0	0	0	0	0	114.3	I341 N387	I341-G343 VanDerWaalsContact C-N 3.25Å; I341-G343 PolarHBondContact O-N 3.41Å; G343-N387 VanDerWaalsContact O-CB 3.29Å; G343-N387 WeakPolarHBondContact O-CB 3.38Å; G343-N387 VanDerWaalsContact O-CG 3.28Å; G343-N387 PolarHBondContact O-N 2.93Å
344	E	95.3	Very high	96	Very high	40 Å²	40	26.4 Å²	26.4	19%	0.187	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143	179	-50.8	-167	128.2	0	0	110.8	Y340 I341 G342 F346 K383 F385 N386	Y340-E344 CarbonylContact C-O 3.59Å; Y340-E344 WeakPolarHBondContact CA-O 3.42Å; Y340-E344 WeakPolarHBondContact CD2-O 3.27Å; I341-E344 PolarHBondContact N-O 3.16Å; I341-E344 WeakPolarHBondContact O-CB 3.48Å; I341-E344 PolarHBondContact O-N 3.22Å; G342-E344 VanDerWaalsContact C-N 3.31Å; E344-F346 HydrophobicContact CB-CD2 4.35Å; E344-F346 HydrophobicContact CB-CE2 3.66Å; E344-F346 HydrophobicContact CB-CZ 4.29Å; E344-F346 WeakPolarHBondContact OE2-CZ 3.3Å; E344-K383 HydrophobicContact CB-CD 4.49Å; E344-K383 VanDerWaalsContact CD-CE 3.43Å; E344-K383 WeakPolarHBondContact OE1-CD 3.43Å; E344-K383 VanDerWaalsContact OE1-CE 3.28Å; E344-K383 WeakPolarHBondContact OE1-CE 3.42Å; E344-K383 IonicContact OE1-NZ 3.84Å; E344-K383 PolarHBondContact OE1-NZ 3.39Å; E344-K383 WeakPolarHBondContact OE2-CE 3.39Å; E344-K383 IonicContact OE2-NZ 3.8Å; E344-K383 PolarHBondContact OE2-NZ 3.02Å; E344-F385 WeakPolarHBondContact CA-O 3.32Å; E344-N386 PolarHBondContact OE1-ND2 2.87Å
345	V	97	Very high	96	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.012	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.5	174.6	-172.2	0	0	0	0	109	W274 Y339 Y340 K383 I384 F385 L442	W274-V345 HydrophobicContact CE3-CG2 4.43Å; W274-V345 HydrophobicContact CH2-CG1 4.01Å; W274-V345 HydrophobicContact CZ3-CG1 3.77Å; W274-V345 HydrophobicContact CZ3-CG2 3.98Å; Y339-V345 WeakPolarHBondContact O-CA 3.28Å; Y340-V345 HydrophobicContact CD2-CG2 3.79Å; Y340-V345 HydrophobicContact CE2-CG2 4.5Å; V345-K383 CarbonylContact O-C 3.5Å; V345-I384 HydrophobicContact CB-CD1 4.48Å; V345-I384 HydrophobicContact CB-CG1 3.99Å; V345-I384 HydrophobicContact CG1-CD1 3.76Å; V345-I384 HydrophobicContact CG1-CG1 3.78Å; V345-I384 WeakPolarHBondContact O-CG1 3.42Å; V345-I384 PolarHBondContact O-N 2.84Å; V345-F385 HydrophobicContact CB-CB 3.88Å; V345-F385 HydrophobicContact CG2-CB 4.04Å; V345-F385 PolarHBondContact N-O 2.78Å; V345-F385 PolarHBondContact O-N 2.88Å; V345-F385 VanDerWaalsContact O-N 3.16Å; V345-L442 HydrophobicContact CG2-CD1 4.42Å; V345-L442 HydrophobicContact CG2-CD2 4.07Å
346	F	97.1	Very high	96.1	Very high	32 Å²	32	21 Å²	21	14%	0.14	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	149	176.9	-63.8	-101.9	0	0	0	111.3	L338 Y339 E344 L382 K383	L338-F346 WeakPolarHBondContact CA-O 3.23Å; Y339-F346 HydrophobicContact CD1-CB 4.17Å; Y339-F346 HydrophobicContact CD2-CB 3.84Å; Y339-F346 AromaticContact CD2-CD2 3.79Å; Y339-F346 HydrophobicContact CD2-CD2 3.79Å; Y339-F346 HydrophobicContact CD2-CG 4.12Å; Y339-F346 HydrophobicContact CE1-CB 3.64Å; Y339-F346 HydrophobicContact CE1-CG 4.49Å; Y339-F346 HydrophobicContact CE2-CB 3.3Å; Y339-F346 HydrophobicContact CE2-CD1 4.21Å; Y339-F346 AromaticContact CE2-CD2 3.28Å; Y339-F346 HydrophobicContact CE2-CD2 3.28Å; Y339-F346 HydrophobicContact CE2-CE2 4.09Å; Y339-F346 AromaticContact CE2-CG 3.35Å; Y339-F346 HydrophobicContact CE2-CG 3.35Å; Y339-F346 HydrophobicContact CG-CB 4.27Å; Y339-F346 AromaticContact CZ-CG 3.56Å; Y339-F346 PolarHBondContact N-O 2.67Å; Y339-F346 VanDerWaalsContact N-O 3.16Å; Y339-F346 PolarHBondContact O-N 3.19Å; Y339-F346 VanDerWaalsContact OH-CB 3.32Å; Y339-F346 WeakPolarHBondContact OH-CB 3.36Å; Y339-F346 WeakPolarHBondContact OH-CG 3.39Å; E344-F346 HydrophobicContact CB-CD2 4.35Å; E344-F346 HydrophobicContact CB-CE2 3.66Å; E344-F346 HydrophobicContact CB-CZ 4.29Å; E344-F346 WeakPolarHBondContact OE2-CZ 3.3Å; F346-L382 CarbonylContact C-O 3.55Å; F346-L382 VanDerWaalsContact CA-O 3.26Å; F346-L382 WeakPolarHBondContact CA-O 3.42Å; F346-K383 HydrophobicContact CD1-CB 3.84Å; F346-K383 HydrophobicContact CD1-CG 4.34Å; F346-K383 HydrophobicContact CE1-CB 3.64Å; F346-K383 HydrophobicContact CE1-CG 3.98Å; F346-K383 HydrophobicContact CZ-CB 4.28Å; F346-K383 HydrophobicContact CZ-CD 4.38Å; F346-K383 HydrophobicContact CZ-CG 4.12Å
347	A	98	Very high	96	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.3	167.9	0	0	0	0	0	110	V336 R337 L338 I376 N381 L382 I384 M416	V336-A347 HydrophobicContact CG2-CB 4Å; R337-A347 WeakPolarHBondContact O-CA 3.28Å; L338-A347 HydrophobicContact CD2-CB 3.78Å; A347-I376 HydrophobicContact CB-CD1 3.92Å; A347-N381 CarbonylContact O-C 3.47Å; A347-N381 WeakPolarHBondContact O-CA 3.32Å; A347-L382 PolarHBondContact N-O 3.31Å; A347-L382 PolarHBondContact O-N 3.22Å; A347-I384 HydrophobicContact CB-CD1 4.21Å; A347-I384 HydrophobicContact CB-CG2 3.78Å; A347-M416 HydrophobicContact CB-SD 4.28Å
348	E	97.6	Very high	96.1	Very high	34 Å²	34	19.1 Å²	19.1	16%	0.159	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.1	174.1	179.6	-171.2	-161.2	0	0	109.4	V336 R337 Y339 L350 N381	V336-E348 WeakPolarHBondContact CA-O 3.39Å; R337-E348 HydrophobicContact CB-CB 4.29Å; R337-E348 WeakPolarHBondContact CD-OE2 3.47Å; R337-E348 IonicContact CZ-OE2 3.18Å; R337-E348 PolarHBondContact N-O 2.84Å; R337-E348 IonicContact NE-OE2 2.74Å; R337-E348 IonicContact NH1-OE2 2.74Å; R337-E348 PolarHBondContact NH1-OE2 2.88Å; R337-E348 PolarHBondContact O-N 2.61Å; Y339-E348 HydrophobicContact CE1-CB 4.2Å; E348-L350 HydrophobicContact CG-CD2 3.87Å; E348-L350 PolarHBondContact O-N 3.19Å; E348-N381 HydrophobicContact CB-CB 4.03Å; E348-N381 HydrophobicContact CG-CB 4.35Å
349	C	97.7	Very high	96.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	105.4	178	-172.9	0	0	0	0	110.1	S353 I355 I376 P377 G379 C380	C349-S353 PolarHBondContact SG-O 3.07Å; C349-I355 HydrophobicContact CB-CD1 4.08Å; C349-I355 HydrophobicContact CB-CG1 4.09Å; C349-I376 HydrophobicContact CB-CB 4.47Å; C349-I376 HydrophobicContact CB-CG2 3.82Å; C349-P377 VanDerWaalsContact CB-O 3.3Å; C349-P377 WeakPolarHBondContact CB-O 3.03Å; C349-G379 WeakPolarHBondContact O-CA 3.38Å; C349-G379 PolarHBondContact O-N 3.07Å; C349-C380 PolarHBondContact N-O 3.37Å
350	L	97.1	Very high	96.2	Very high	15 Å²	15	19.9 Å²	19.9	8%	0.079	11%	0.109	C	C	.	.			trans	-92.6	-18.1	176.4	-59.8	-173.9	0	0	0	113.1	T298 R334 G335 R337 E348	T298-L350 HydrophobicContact CG2-CD1 4.08Å; R334-L350 HydrophobicContact CB-CB 3.72Å; R334-L350 WeakPolarHBondContact CB-O 3.28Å; G335-L350 CarbonylContact O-C 3.58Å; G335-L350 WeakPolarHBondContact O-CA 3.45Å; G335-L350 PolarHBondContact O-N 3.44Å; R337-L350 HydrophobicContact CB-CD1 3.77Å; R337-L350 HydrophobicContact CB-CG 4.1Å; E348-L350 HydrophobicContact CG-CD2 3.87Å; E348-L350 PolarHBondContact O-N 3.19Å
351	S	97.6	Very high	96.4	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.021	11%	0.105	C	C	.	.	S	Bend	trans	-65.4	148.9	174	-177.6	0	0	0	0	111.4	H331 I332 G335 S353 P378	H331-S351 PolarHBondContact O-OG 2.9Å; I332-S351 WeakPolarHBondContact O-CB 3.34Å; I332-S351 PolarHBondContact O-OG 3.23Å; G335-S351 PolarHBondContact O-N 2.87Å; S351-S353 VanDerWaalsContact CB-O 3.27Å; S351-S353 WeakPolarHBondContact CB-O 3.25Å; S351-S353 PolarHBondContact O-N 3.32Å; S351-S353 PolarHBondContact OG-N 2.89Å; S351-S353 PolarHBondContact OG-O 3.1Å; S351-P378 VanDerWaalsContact O-CB 3.31Å; S351-P378 WeakPolarHBondContact O-CB 3.43Å
352	D	97.7	Very high	96.7	Very high	153 Å²	153	18.1 Å²	18.1	82%	0.818	10%	0.102	S	C	*	.	S	Bend	trans	-71.5	-9.8	168.8	-56.9	-42.3	0	0	0	111.9	P378	D352-P378 VanDerWaalsContact C-CG 3.49Å; D352-P378 WeakPolarHBondContact O-CG 3.37Å
353	S	97.9	Very high	97.2	Very high	26 Å²	26	17.5 Å²	17.5	18%	0.182	10%	0.095	C	C	.	.	S	Bend	trans	-108.1	146.7	171.7	-67.4	0	0	0	0	111	C349 S351	C349-S353 PolarHBondContact SG-O 3.07Å; S351-S353 VanDerWaalsContact CB-O 3.27Å; S351-S353 WeakPolarHBondContact CB-O 3.25Å; S351-S353 PolarHBondContact O-N 3.32Å; S351-S353 PolarHBondContact OG-N 2.89Å; S351-S353 PolarHBondContact OG-O 3.1Å
354	A	98.2	Very high	97.4	Very high	13 Å²	13	22.2 Å²	22.2	11%	0.107	12%	0.117	C	C	.	.			trans	-64.3	152.7	178.4	0	0	0	0	0	112.6	F356 K375 I376 V419	A354-F356 HydrophobicContact CB-CE2 4.25Å; A354-F356 HydrophobicContact CB-CZ 4.21Å; A354-K375 HydrophobicContact CB-CD 4.41Å; A354-K375 HydrophobicContact CB-CG 4.02Å; A354-I376 WeakPolarHBondContact CA-O 3.36Å; A354-V419 WeakPolarHBondContact O-CA 3.49Å; A354-V419 PolarHBondContact O-N 2.92Å
355	I	98.6	Very high	97.4	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	158.4	166.8	64.5	179.6	0	0	0	109.9	V336 C349 I376 S417 F418	V336-I355 HydrophobicContact CB-CD1 3.84Å; V336-I355 HydrophobicContact CG2-CD1 3.43Å; V336-I355 VanDerWaalsContact CG2-CD1 3.43Å; C349-I355 HydrophobicContact CB-CD1 4.08Å; C349-I355 HydrophobicContact CB-CG1 4.09Å; I355-I376 HydrophobicContact CD1-CB 4.26Å; I355-I376 HydrophobicContact CD1-CD1 4.04Å; I355-I376 HydrophobicContact CG1-CB 3.7Å; I355-I376 HydrophobicContact CG1-CD1 4.18Å; I355-I376 HydrophobicContact CG1-CG1 4.28Å; I355-I376 HydrophobicContact CG1-CG2 4.42Å; I355-I376 PolarHBondContact N-O 3.44Å; I355-I376 VanDerWaalsContact N-O 3.08Å; I355-I376 PolarHBondContact O-N 3.29Å; I355-S417 WeakPolarHBondContact CA-O 3.43Å; I355-F418 HydrophobicContact CG2-CD1 3.88Å; I355-F418 HydrophobicContact CG2-CE1 4.34Å
356	F	98.5	Very high	97.3	Very high	9 Å²	9	28.5 Å²	28.5	4%	0.039	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	124.6	-175.4	-59.2	-94.1	0	0	0	108.2	A354 V373 C374 K375 M416 S417 V419 K420 G421 W422 Y426	A354-F356 HydrophobicContact CB-CE2 4.25Å; A354-F356 HydrophobicContact CB-CZ 4.21Å; F356-V373 HydrophobicContact CB-CG1 3.72Å; F356-C374 CarbonylContact C-O 3.41Å; F356-C374 WeakPolarHBondContact CA-O 3.48Å; F356-K375 HydrophobicContact CD1-CB 3.94Å; F356-K375 HydrophobicContact CD1-CG 4.05Å; F356-K375 HydrophobicContact CE1-CB 3.9Å; F356-K375 HydrophobicContact CE1-CD 3.82Å; F356-K375 HydrophobicContact CE1-CG 3.61Å; F356-K375 HydrophobicContact CZ-CD 4.28Å; F356-K375 HydrophobicContact CZ-CG 4.17Å; F356-M416 CarbonylContact O-C 3.1Å; F356-M416 WeakPolarHBondContact O-CA 3.43Å; F356-S417 PolarHBondContact N-O 3.4Å; F356-S417 PolarHBondContact O-N 3.35Å; F356-V419 WeakPolarHBondContact CE2-O 3.48Å; F356-K420 VanDerWaalsContact CD2-C 3.42Å; F356-K420 WeakPolarHBondContact CD2-O 3.26Å; F356-K420 VanDerWaalsContact CE2-C 3.43Å; F356-G421 VanDerWaalsContact CD1-CA 3.41Å; F356-G421 VanDerWaalsContact CE2-N 3.26Å; F356-W422 HydrophobicContact CB-CE3 4.05Å; F356-W422 HydrophobicContact CB-CZ3 3.66Å; F356-W422 WeakPolarHBondContact O-CH2 3.15Å; F356-W422 VanDerWaalsContact O-CZ3 3.24Å; F356-W422 WeakPolarHBondContact O-CZ3 3.27Å; F356-Y426 HydrophobicContact CD1-CE1 4.48Å; F356-Y426 HydrophobicContact CD1-CE2 4.31Å; F356-Y426 AromaticContact CD1-CZ 3.92Å; F356-Y426 AromaticContact CE1-CE1 3.81Å; F356-Y426 HydrophobicContact CE1-CE1 3.81Å; F356-Y426 HydrophobicContact CE1-CE2 4.38Å; F356-Y426 AromaticContact CE1-CZ 3.55Å; F356-Y426 VanDerWaalsContact CE1-OH 3.24Å; F356-Y426 WeakPolarHBondContact CE1-OH 3.43Å; F356-Y426 HydrophobicContact CZ-CE1 4.46Å
357	V	98.2	Very high	97.2	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.1	-169.2	-179	0	0	0	0	110	V373 C374 I376 I384 I414 R415 M416	V357-V373 CarbonylContact O-C 3.57Å; V357-V373 WeakPolarHBondContact O-CA 3.32Å; V357-C374 PolarHBondContact N-O 3.24Å; V357-C374 PolarHBondContact O-N 2.55Å; V357-I376 HydrophobicContact CB-CD1 4.45Å; V357-I376 HydrophobicContact CG2-CD1 3.53Å; V357-I376 HydrophobicContact CG2-CG1 4.19Å; V357-I384 HydrophobicContact CG1-CB 4.5Å; V357-I384 HydrophobicContact CG1-CG2 3.91Å; V357-I414 HydrophobicContact CG1-CG2 3.74Å; V357-R415 WeakPolarHBondContact CA-O 3.13Å; V357-M416 HydrophobicContact CB-CG 4.31Å; V357-M416 HydrophobicContact CG1-CG 4.07Å; V357-M416 HydrophobicContact CG1-SD 4.49Å; V357-M416 HydrophobicContact CG2-CB 4.34Å; V357-M416 HydrophobicContact CG2-CG 3.8Å; V357-M416 HydrophobicContact CG2-SD 3.9Å
358	Q	98.2	Very high	97.1	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.037	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	104.5	166.2	-178.4	-176.8	69.6	0	0	107.6	N203 A371 V373 R415 W422	N203-Q358 PolarHBondContact ND2-NE2 2.85Å; N203-Q358 PolarHBondContact OD1-NE2 2.76Å; Q358-A371 PolarHBondContact NE2-O 2.8Å; Q358-V373 HydrophobicContact CB-CG2 4.34Å; Q358-R415 PolarHBondContact N-O 3.03Å; Q358-R415 PolarHBondContact O-N 3.22Å; Q358-W422 HydrophobicContact CB-CH2 4.06Å; Q358-W422 HydrophobicContact CB-CZ2 3.54Å
359	S	98	Very high	97	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.007	20%	0.204	C	C	.	.			trans	-121.5	111.9	172.2	168.9	0	0	0	0	108.9	N361 C362 N363 I384	S359-N361 VanDerWaalsContact C-N 3.25Å; S359-N361 PolarHBondContact O-N 3.33Å; S359-C362 WeakPolarHBondContact O-CB 3.13Å; S359-C362 PolarHBondContact O-N 3.13Å; S359-C362 VanDerWaalsContact O-N 3.15Å; S359-C362 PolarHBondContact OG-N 2.91Å; S359-N363 WeakPolarHBondContact O-CB 3.41Å; S359-N363 PolarHBondContact O-N 3.27Å; S359-N363 PolarHBondContact O-ND2 3.2Å; S359-I384 VanDerWaalsContact CB-O 3.32Å; S359-I384 WeakPolarHBondContact CB-O 3.32Å; S359-I384 PolarHBondContact OG-O 3.49Å
360	P	97	Very high	96.7	Very high	19 Å²	19	43 Å²	43	12%	0.123	23%	0.227	C	C	.	.	H	α-helix	trans	-57.5	-37	177	-29.2	38.8	0	0	0	113.2	N363 Q364 M411	P360-N363 PolarHBondContact O-N 3.29Å; P360-Q364 WeakPolarHBondContact O-CB 3.32Å; P360-Q364 PolarHBondContact O-N 3.27Å; P360-M411 HydrophobicContact CB-CE 4.41Å; P360-M411 HydrophobicContact CB-SD 3.4Å; P360-M411 WeakPolarHBondContact CB-SD 3.24Å
361	N	97.4	Very high	96.6	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.027	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-46.2	174.6	-178.9	-92.6	0	0	0	112.4	S359 R365 F385 N386 M411	S359-N361 VanDerWaalsContact C-N 3.25Å; S359-N361 PolarHBondContact O-N 3.33Å; N361-R365 PolarHBondContact O-N 2.88Å; N361-R365 VanDerWaalsContact O-N 3.13Å; N361-R365 PolarHBondContact OD1-NH2 3.15Å; N361-R365 VanDerWaalsContact OD1-NH2 3.12Å; N361-F385 HydrophobicContact CB-CD2 3.44Å; N361-F385 VanDerWaalsContact CB-CD2 3.44Å; N361-F385 HydrophobicContact CB-CE2 3.65Å; N361-F385 HydrophobicContact CB-CG 4.36Å; N361-F385 WeakPolarHBondContact OD1-CA 3.48Å; N361-N386 PolarHBondContact OD1-N 2.93Å; N361-M411 VanDerWaalsContact CA-CE 3.4Å; N361-M411 HydrophobicContact CB-CE 3.95Å
362	C	96.1	Very high	96.5	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-43.7	175.3	-176.2	0	0	0	0	111.6	S359 Q364 R365 Y366	S359-C362 WeakPolarHBondContact O-CB 3.13Å; S359-C362 PolarHBondContact O-N 3.13Å; S359-C362 VanDerWaalsContact O-N 3.15Å; S359-C362 PolarHBondContact OG-N 2.91Å; C362-Q364 PolarHBondContact O-N 3.09Å; C362-R365 WeakPolarHBondContact O-CB 3.27Å; C362-R365 PolarHBondContact O-N 3.31Å; C362-Y366 WeakPolarHBondContact O-CD2 3.4Å; C362-Y366 PolarHBondContact O-N 3.38Å
363	N	96.5	Very high	96.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-43.6	-178.8	-69.6	-18.4	0	0	0	111.2	S359 P360 R365 Y366 G367 W368 H369 P370 T372	S359-N363 WeakPolarHBondContact O-CB 3.41Å; S359-N363 PolarHBondContact O-N 3.27Å; S359-N363 PolarHBondContact O-ND2 3.2Å; P360-N363 PolarHBondContact O-N 3.29Å; N363-R365 PolarHBondContact O-N 2.86Å; N363-Y366 PolarHBondContact O-N 3.42Å; N363-G367 PolarHBondContact O-N 3.03Å; N363-G367 VanDerWaalsContact O-N 3.09Å; N363-W368 HydrophobicContact CB-CB 4.29Å; N363-W368 PolarHBondContact O-N 3.37Å; N363-H369 PolarHBondContact ND2-O 3.32Å; N363-P370 PolarHBondContact ND2-O 2.97Å; N363-T372 PolarHBondContact ND2-N 3.1Å; N363-T372 PolarHBondContact ND2-O 2.71Å
364	Q	95.6	Very high	96.5	Very high	102 Å²	102	38 Å²	38	48%	0.477	20%	0.203	S	C	.	.	H	α-helix	trans	-62.2	-42.6	175.6	-176.9	169.4	-14.9	0	0	112.3	P360 C362 Y366 G367 M411	P360-Q364 WeakPolarHBondContact O-CB 3.32Å; P360-Q364 PolarHBondContact O-N 3.27Å; C362-Q364 PolarHBondContact O-N 3.09Å; Q364-Y366 VanDerWaalsContact C-N 3.25Å; Q364-Y366 PolarHBondContact O-N 3.3Å; Q364-G367 PolarHBondContact O-N 3.49Å; Q364-G367 VanDerWaalsContact O-N 3.1Å; Q364-M411 HydrophobicContact CB-CE 4.43Å; Q364-M411 VanDerWaalsContact OE1-CE 3.22Å
365	R	95.4	Very high	96.5	Very high	63 Å²	63	43.2 Å²	43.2	24%	0.238	22%	0.223	C	C	.	.	H	α-helix	trans	-55.5	-40.2	176.9	-175.3	-167.4	-61.4	127.4	14.7	112.6	N361 C362 N363 K383 N386 E389	N361-R365 PolarHBondContact O-N 2.88Å; N361-R365 VanDerWaalsContact O-N 3.13Å; N361-R365 PolarHBondContact OD1-NH2 3.15Å; N361-R365 VanDerWaalsContact OD1-NH2 3.12Å; C362-R365 WeakPolarHBondContact O-CB 3.27Å; C362-R365 PolarHBondContact O-N 3.31Å; N363-R365 PolarHBondContact O-N 2.86Å; R365-K383 PolarHBondContact NH1-O 2.67Å; R365-N386 VanDerWaalsContact NH2-CB 3.32Å; R365-E389 WeakPolarHBondContact CD-OE1 3.46Å; R365-E389 IonicContact CZ-OE1 3.37Å; R365-E389 IonicContact CZ-OE2 3.86Å; R365-E389 IonicContact NE-OE1 2.86Å; R365-E389 PolarHBondContact NE-OE1 2.9Å; R365-E389 IonicContact NE-OE2 2.67Å; R365-E389 PolarHBondContact NE-OE2 2.8Å; R365-E389 IonicContact NH2-OE1 2.97Å; R365-E389 IonicContact NH2-OE2 2.67Å; R365-E389 PolarHBondContact NH2-OE2 3.24Å
366	Y	94.6	Very high	96.4	Very high	111 Å²	111	43.3 Å²	43.3	44%	0.435	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	3.4	-178.9	-65.3	-65.4	0	0	0	113.9	C362 N363 Q364 W368	C362-Y366 WeakPolarHBondContact O-CD2 3.4Å; C362-Y366 PolarHBondContact O-N 3.38Å; N363-Y366 PolarHBondContact O-N 3.42Å; Q364-Y366 VanDerWaalsContact C-N 3.25Å; Q364-Y366 PolarHBondContact O-N 3.3Å; Y366-W368 VanDerWaalsContact C-N 3.26Å; Y366-W368 HydrophobicContact CD2-CE3 4.13Å; Y366-W368 AromaticContact CD2-CH2 3.82Å; Y366-W368 HydrophobicContact CD2-CH2 3.82Å; Y366-W368 HydrophobicContact CD2-CZ2 4.48Å; Y366-W368 AromaticContact CD2-CZ3 3.6Å; Y366-W368 HydrophobicContact CD2-CZ3 3.6Å; Y366-W368 HydrophobicContact CE2-CH2 4.47Å; Y366-W368 HydrophobicContact CE2-CZ3 4.4Å; Y366-W368 HydrophobicContact CG-CE3 4.36Å; Y366-W368 AromaticContact CG-CH2 3.93Å; Y366-W368 HydrophobicContact CG-CH2 3.93Å; Y366-W368 HydrophobicContact CG-CZ2 4.15Å; Y366-W368 HydrophobicContact CG-CZ3 4.02Å; Y366-W368 PolarHBondContact O-N 3.16Å
367	G	95.3	Very high	96.4	Very high	69 Å²	69	45.6 Å²	45.6	71%	0.711	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	24.8	-177.6	0	0	0	0	0	113.8	N363 Q364	N363-G367 PolarHBondContact O-N 3.03Å; N363-G367 VanDerWaalsContact O-N 3.09Å; Q364-G367 PolarHBondContact O-N 3.49Å; Q364-G367 VanDerWaalsContact O-N 3.1Å
368	W	95.2	Very high	96.3	Very high	117 Å²	117	48.6 Å²	48.6	44%	0.443	26%	0.259	S	S	.	.			trans	-88.2	157.3	174.9	-61.5	-27.2	0	0	0	111.2	N363 Y366 T372 C374	N363-W368 HydrophobicContact CB-CB 4.29Å; N363-W368 PolarHBondContact O-N 3.37Å; Y366-W368 VanDerWaalsContact C-N 3.26Å; Y366-W368 HydrophobicContact CD2-CE3 4.13Å; Y366-W368 AromaticContact CD2-CH2 3.82Å; Y366-W368 HydrophobicContact CD2-CH2 3.82Å; Y366-W368 HydrophobicContact CD2-CZ2 4.48Å; Y366-W368 AromaticContact CD2-CZ3 3.6Å; Y366-W368 HydrophobicContact CD2-CZ3 3.6Å; Y366-W368 HydrophobicContact CE2-CH2 4.47Å; Y366-W368 HydrophobicContact CE2-CZ3 4.4Å; Y366-W368 HydrophobicContact CG-CE3 4.36Å; Y366-W368 AromaticContact CG-CH2 3.93Å; Y366-W368 HydrophobicContact CG-CH2 3.93Å; Y366-W368 HydrophobicContact CG-CZ2 4.15Å; Y366-W368 HydrophobicContact CG-CZ3 4.02Å; Y366-W368 PolarHBondContact O-N 3.16Å; W368-T372 HydrophobicContact CB-CG2 4.15Å; W368-T372 HydrophobicContact CD2-CG2 4.29Å; W368-T372 HydrophobicContact CE3-CG2 4.09Å; W368-T372 HydrophobicContact CG-CG2 4.36Å; W368-C374 WeakPolarHBondContact CZ3-SG 3.47Å
369	H	95.3	Very high	96.1	Very high	110 Å²	110	51.1 Å²	51.1	51%	0.509	29%	0.287	S	S	.	.			trans	-52.9	137.4	171.7	-171	-91.9	0	0	0	110.4	N363 A371 T372	N363-H369 PolarHBondContact ND2-O 3.32Å; H369-A371 WeakPolarHBondContact ND1-CB 3.47Å; H369-A371 PolarHBondContact ND1-N 3.38Å; H369-A371 PolarHBondContact O-N 2.94Å; H369-T372 VanDerWaalsContact O-CB 3.24Å; H369-T372 WeakPolarHBondContact O-CB 3.41Å; H369-T372 PolarHBondContact O-N 2.92Å; H369-T372 PolarHBondContact O-OG1 2.94Å
370	P	93.4	Very high	95.9	Very high	75 Å²	75	53.7 Å²	53.7	49%	0.487	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.8	-176.1	-29.1	35.8	0	0	0	114.4	N363	N363-P370 PolarHBondContact ND2-O 2.97Å
371	A	94.4	Very high	95.8	Very high	10 Å²	10	57 Å²	57	8%	0.083	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-5	178.3	0	0	0	0	0	115.9	P201 N203 Q358 H369	P201-A371 HydrophobicContact CB-CB 3.21Å; P201-A371 HydrophobicContact CG-CB 3.46Å; P201-A371 VanDerWaalsContact CG-CB 3.46Å; N203-A371 PolarHBondContact ND2-O 3.08Å; Q358-A371 PolarHBondContact NE2-O 2.8Å; H369-A371 WeakPolarHBondContact ND1-CB 3.47Å; H369-A371 PolarHBondContact ND1-N 3.38Å; H369-A371 PolarHBondContact O-N 2.94Å
372	T	95.8	Very high	95.7	Very high	45 Å²	45	58.2 Å²	58.2	28%	0.276	33%	0.327	S	S	.	.			trans	-57.7	139.3	-175.5	-68.5	0	0	0	0	111.1	N363 W368 H369	N363-T372 PolarHBondContact ND2-N 3.1Å; N363-T372 PolarHBondContact ND2-O 2.71Å; W368-T372 HydrophobicContact CB-CG2 4.15Å; W368-T372 HydrophobicContact CD2-CG2 4.29Å; W368-T372 HydrophobicContact CE3-CG2 4.09Å; W368-T372 HydrophobicContact CG-CG2 4.36Å; H369-T372 VanDerWaalsContact O-CB 3.24Å; H369-T372 WeakPolarHBondContact O-CB 3.41Å; H369-T372 PolarHBondContact O-N 2.92Å; H369-T372 PolarHBondContact O-OG1 2.94Å
373	V	97.8	Very high	95.7	Very high	21 Å²	21	61 Å²	61	13%	0.127	34%	0.339	C	S	.	.			trans	-111.3	109.4	179.5	-178.5	0	0	0	0	108.7	F356 V357 Q358 W422	F356-V373 HydrophobicContact CB-CG1 3.72Å; V357-V373 CarbonylContact O-C 3.57Å; V357-V373 WeakPolarHBondContact O-CA 3.32Å; Q358-V373 HydrophobicContact CB-CG2 4.34Å; V373-W422 WeakPolarHBondContact CB-O 3.49Å; V373-W422 HydrophobicContact CG1-CD2 4.03Å; V373-W422 HydrophobicContact CG1-CE3 3.81Å; V373-W422 HydrophobicContact CG1-CH2 3.95Å; V373-W422 HydrophobicContact CG1-CZ2 4.18Å; V373-W422 HydrophobicContact CG1-CZ3 3.76Å; V373-W422 HydrophobicContact CG2-CD2 3.9Å; V373-W422 VanDerWaalsContact CG2-CE2 3.47Å; V373-W422 HydrophobicContact CG2-CG 4.25Å; V373-W422 HydrophobicContact CG2-CH2 4.4Å; V373-W422 HydrophobicContact CG2-CZ2 3.79Å; V373-W422 VanDerWaalsContact CG2-O 3.3Å; V373-W422 WeakPolarHBondContact CG2-O 3.21Å
374	C	96.6	Very high	95.8	Very high	16 Å²	16	61 Å²	61	11%	0.108	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.4	-179.6	-54.3	0	0	0	0	110.4	F356 V357 W368 L382	F356-C374 CarbonylContact C-O 3.41Å; F356-C374 WeakPolarHBondContact CA-O 3.48Å; V357-C374 PolarHBondContact N-O 3.24Å; V357-C374 PolarHBondContact O-N 2.55Å; W368-C374 WeakPolarHBondContact CZ3-SG 3.47Å; C374-L382 HydrophobicContact CB-CD2 3.94Å
375	K	97.8	Very high	95.9	Very high	121 Å²	121	56.1 Å²	56.1	53%	0.526	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	128.8	171.8	-177.7	-179.5	-179.6	-178.2	0	110.1	A354 F356	A354-K375 HydrophobicContact CB-CD 4.41Å; A354-K375 HydrophobicContact CB-CG 4.02Å; F356-K375 HydrophobicContact CD1-CB 3.94Å; F356-K375 HydrophobicContact CD1-CG 4.05Å; F356-K375 HydrophobicContact CE1-CB 3.9Å; F356-K375 HydrophobicContact CE1-CD 3.82Å; F356-K375 HydrophobicContact CE1-CG 3.61Å; F356-K375 HydrophobicContact CZ-CD 4.28Å; F356-K375 HydrophobicContact CZ-CG 4.17Å
376	I	97.4	Very high	95.9	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	107.2	170	-51.1	176.3	0	0	0	107.7	A347 C349 A354 I355 V357 C380 L382	A347-I376 HydrophobicContact CB-CD1 3.92Å; C349-I376 HydrophobicContact CB-CB 4.47Å; C349-I376 HydrophobicContact CB-CG2 3.82Å; A354-I376 WeakPolarHBondContact CA-O 3.36Å; I355-I376 HydrophobicContact CD1-CB 4.26Å; I355-I376 HydrophobicContact CD1-CD1 4.04Å; I355-I376 HydrophobicContact CG1-CB 3.7Å; I355-I376 HydrophobicContact CG1-CD1 4.18Å; I355-I376 HydrophobicContact CG1-CG1 4.28Å; I355-I376 HydrophobicContact CG1-CG2 4.42Å; I355-I376 PolarHBondContact N-O 3.44Å; I355-I376 VanDerWaalsContact N-O 3.08Å; I355-I376 PolarHBondContact O-N 3.29Å; V357-I376 HydrophobicContact CB-CD1 4.45Å; V357-I376 HydrophobicContact CG2-CD1 3.53Å; V357-I376 HydrophobicContact CG2-CG1 4.19Å; I376-C380 HydrophobicContact CG2-CB 3.89Å; I376-C380 WeakPolarHBondContact CG2-O 3.11Å; I376-L382 HydrophobicContact CD1-CB 3.57Å; I376-L382 HydrophobicContact CD1-CD2 4.06Å; I376-L382 HydrophobicContact CD1-CG 4.47Å; I376-L382 HydrophobicContact CG1-CB 3.99Å; I376-L382 HydrophobicContact CG1-CD2 4.16Å
377	P	97.6	Very high	95.9	Very high	57 Å²	57	48.5 Å²	48.5	37%	0.37	29%	0.288	S	S	.	.			trans	-65.5	161.8	176.9	-21.2	33.5	0	0	0	113.2	C349 G379 C380	C349-P377 VanDerWaalsContact CB-O 3.3Å; C349-P377 WeakPolarHBondContact CB-O 3.03Å; P377-G379 PolarHBondContact O-N 2.78Å; P377-C380 VanDerWaalsContact O-CB 3.3Å; P377-C380 WeakPolarHBondContact O-CB 3.1Å; P377-C380 PolarHBondContact O-N 2.92Å
378	P	97.6	Very high	95.9	Very high	64 Å²	64	49.9 Å²	49.9	42%	0.416	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	130.4	172.9	-29.6	37.6	0	0	0	113	S351 D352 C380	S351-P378 VanDerWaalsContact O-CB 3.31Å; S351-P378 WeakPolarHBondContact O-CB 3.43Å; D352-P378 VanDerWaalsContact C-CG 3.49Å; D352-P378 WeakPolarHBondContact O-CG 3.37Å; P378-C380 PolarHBondContact O-N 2.85Å
379	G	92.7	Very high	95.8	Very high	61 Å²	61	47.5 Å²	47.5	63%	0.629	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-4.2	-179.3	0	0	0	0	0	115.3	C349 P377	C349-G379 WeakPolarHBondContact O-CA 3.38Å; C349-G379 PolarHBondContact O-N 3.07Å; P377-G379 PolarHBondContact O-N 2.78Å
380	C	95	Very high	95.9	Very high	56 Å²	56	42.3 Å²	42.3	38%	0.378	25%	0.246	S	C	.	.			trans	-89.2	160	174.3	-61.1	0	0	0	0	111.7	C349 I376 P377 P378	C349-C380 PolarHBondContact N-O 3.37Å; I376-C380 HydrophobicContact CG2-CB 3.89Å; I376-C380 WeakPolarHBondContact CG2-O 3.11Å; P377-C380 VanDerWaalsContact O-CB 3.3Å; P377-C380 WeakPolarHBondContact O-CB 3.1Å; P377-C380 PolarHBondContact O-N 2.92Å; P378-C380 PolarHBondContact O-N 2.85Å
381	N	94.9	Very high	95.9	Very high	87 Å²	87	39 Å²	39	47%	0.465	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	158.2	171.4	64.8	85.8	0	0	0	111.2	A347 E348	A347-N381 CarbonylContact O-C 3.47Å; A347-N381 WeakPolarHBondContact O-CA 3.32Å; E348-N381 HydrophobicContact CB-CB 4.03Å; E348-N381 HydrophobicContact CG-CB 4.35Å
382	L	95	Very high	95.9	Very high	31 Å²	31	40.9 Å²	40.9	16%	0.162	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	138.8	177.9	-178.2	64.3	0	0	0	109.8	F346 A347 C374 I376 I384	F346-L382 CarbonylContact C-O 3.55Å; F346-L382 VanDerWaalsContact CA-O 3.26Å; F346-L382 WeakPolarHBondContact CA-O 3.42Å; A347-L382 PolarHBondContact N-O 3.31Å; A347-L382 PolarHBondContact O-N 3.22Å; C374-L382 HydrophobicContact CB-CD2 3.94Å; I376-L382 HydrophobicContact CD1-CB 3.57Å; I376-L382 HydrophobicContact CD1-CD2 4.06Å; I376-L382 HydrophobicContact CD1-CG 4.47Å; I376-L382 HydrophobicContact CG1-CB 3.99Å; I376-L382 HydrophobicContact CG1-CD2 4.16Å; L382-I384 HydrophobicContact CB-CG2 4.37Å; L382-I384 HydrophobicContact CD2-CG2 4.33Å; L382-I384 HydrophobicContact CG-CG2 4.29Å; L382-I384 PolarHBondContact O-N 2.67Å
383	K	96.9	Very high	95.8	Very high	60 Å²	60	39.8 Å²	39.8	26%	0.261	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	101	168.8	-174.1	-176	-60.9	-174.5	0	109.2	E344 V345 F346 R365	E344-K383 HydrophobicContact CB-CD 4.49Å; E344-K383 VanDerWaalsContact CD-CE 3.43Å; E344-K383 WeakPolarHBondContact OE1-CD 3.43Å; E344-K383 VanDerWaalsContact OE1-CE 3.28Å; E344-K383 WeakPolarHBondContact OE1-CE 3.42Å; E344-K383 IonicContact OE1-NZ 3.84Å; E344-K383 PolarHBondContact OE1-NZ 3.39Å; E344-K383 WeakPolarHBondContact OE2-CE 3.39Å; E344-K383 IonicContact OE2-NZ 3.8Å; E344-K383 PolarHBondContact OE2-NZ 3.02Å; V345-K383 CarbonylContact O-C 3.5Å; F346-K383 HydrophobicContact CD1-CB 3.84Å; F346-K383 HydrophobicContact CD1-CG 4.34Å; F346-K383 HydrophobicContact CE1-CB 3.64Å; F346-K383 HydrophobicContact CE1-CG 3.98Å; F346-K383 HydrophobicContact CZ-CB 4.28Å; F346-K383 HydrophobicContact CZ-CD 4.38Å; F346-K383 HydrophobicContact CZ-CG 4.12Å; R365-K383 PolarHBondContact NH1-O 2.67Å
384	I	97.7	Very high	95.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-18.7	-173.8	65.2	173.5	0	0	0	112.7	L338 V345 A347 V357 S359 L382 I414 M416 L440	L338-I384 HydrophobicContact CD2-CD1 4.22Å; V345-I384 HydrophobicContact CB-CD1 4.48Å; V345-I384 HydrophobicContact CB-CG1 3.99Å; V345-I384 HydrophobicContact CG1-CD1 3.76Å; V345-I384 HydrophobicContact CG1-CG1 3.78Å; V345-I384 WeakPolarHBondContact O-CG1 3.42Å; V345-I384 PolarHBondContact O-N 2.84Å; A347-I384 HydrophobicContact CB-CD1 4.21Å; A347-I384 HydrophobicContact CB-CG2 3.78Å; V357-I384 HydrophobicContact CG1-CB 4.5Å; V357-I384 HydrophobicContact CG1-CG2 3.91Å; S359-I384 VanDerWaalsContact CB-O 3.32Å; S359-I384 WeakPolarHBondContact CB-O 3.32Å; S359-I384 PolarHBondContact OG-O 3.49Å; L382-I384 HydrophobicContact CB-CG2 4.37Å; L382-I384 HydrophobicContact CD2-CG2 4.33Å; L382-I384 HydrophobicContact CG-CG2 4.29Å; L382-I384 PolarHBondContact O-N 2.67Å; I384-I414 HydrophobicContact CB-CD1 4.19Å; I384-I414 HydrophobicContact CD1-CD1 3.85Å; I384-I414 HydrophobicContact CD1-CG2 4.34Å; I384-I414 HydrophobicContact CG1-CD1 3.92Å; I384-M416 HydrophobicContact CD1-CE 3.62Å; I384-L440 HydrophobicContact CD1-CD2 4.44Å
385	F	98	Very high	95.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	148.6	177.8	-161.7	-94.9	0	0	0	112.3	E344 V345 N361 N387 F390 M411 I414 L442 P445	E344-F385 WeakPolarHBondContact CA-O 3.32Å; V345-F385 HydrophobicContact CB-CB 3.88Å; V345-F385 HydrophobicContact CG2-CB 4.04Å; V345-F385 PolarHBondContact N-O 2.78Å; V345-F385 PolarHBondContact O-N 2.88Å; V345-F385 VanDerWaalsContact O-N 3.16Å; N361-F385 HydrophobicContact CB-CD2 3.44Å; N361-F385 VanDerWaalsContact CB-CD2 3.44Å; N361-F385 HydrophobicContact CB-CE2 3.65Å; N361-F385 HydrophobicContact CB-CG 4.36Å; N361-F385 WeakPolarHBondContact OD1-CA 3.48Å; F385-N387 WeakPolarHBondContact CD1-OD1 3.48Å; F385-N387 WeakPolarHBondContact CE1-OD1 3.24Å; F385-F390 HydrophobicContact CE1-CB 3.99Å; F385-F390 HydrophobicContact CE1-CG 4.43Å; F385-F390 HydrophobicContact CE2-CB 4.49Å; F385-F390 HydrophobicContact CZ-CB 3.59Å; F385-F390 HydrophobicContact CZ-CD1 4.43Å; F385-F390 AromaticContact CZ-CD2 3.97Å; F385-F390 HydrophobicContact CZ-CD2 3.97Å; F385-F390 AromaticContact CZ-CG 3.74Å; F385-F390 HydrophobicContact CZ-CG 3.74Å; F385-M411 VanDerWaalsContact CE2-O 3.3Å; F385-M411 WeakPolarHBondContact CE2-O 3.29Å; F385-I414 HydrophobicContact CB-CD1 4.13Å; F385-I414 HydrophobicContact CD2-CD1 4.32Å; F385-L442 HydrophobicContact CB-CD1 3.75Å; F385-L442 HydrophobicContact CD1-CD1 3.53Å; F385-L442 HydrophobicContact CD2-CD1 3.32Å; F385-L442 HydrophobicContact CE1-CD1 3.88Å; F385-L442 HydrophobicContact CE2-CD1 3.68Å; F385-L442 HydrophobicContact CG-CD1 3.23Å; F385-L442 HydrophobicContact CZ-CD1 3.94Å; F385-P445 HydrophobicContact CE1-CB 4.36Å; F385-P445 HydrophobicContact CE1-CG 3.52Å; F385-P445 HydrophobicContact CZ-CB 3.99Å; F385-P445 HydrophobicContact CZ-CG 3.64Å
386	N	95.9	Very high	95.3	Very high	9 Å²	9	39.9 Å²	39.9	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	124.6	170.1	175.1	-59.4	0	0	0	110.1	E344 N361 R365 Q388 E389 F390	E344-N386 PolarHBondContact OE1-ND2 2.87Å; N361-N386 PolarHBondContact OD1-N 2.93Å; R365-N386 VanDerWaalsContact NH2-CB 3.32Å; N386-Q388 PolarHBondContact O-N 2.88Å; N386-Q388 WeakPolarHBondContact OD1-CA 3.27Å; N386-Q388 VanDerWaalsContact OD1-CB 3.3Å; N386-Q388 WeakPolarHBondContact OD1-CB 3.21Å; N386-Q388 PolarHBondContact OD1-N 2.88Å; N386-E389 HydrophobicContact CB-CB 4.29Å; N386-E389 HydrophobicContact CB-CG 4.11Å; N386-E389 PolarHBondContact O-N 2.86Å; N386-E389 PolarHBondContact OD1-N 2.83Å; N386-F390 PolarHBondContact O-N 2.88Å; N386-F390 VanDerWaalsContact O-N 3.14Å
387	N	94.3	Very high	95.1	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.027	24%	0.24	C	C	.	.	H	α-helix	trans	-67.2	-32.1	-177.3	-76.6	-1.8	0	0	0	113.5	L175 Y268 Y340 G343 F385 F390 A391	L175-N387 HydrophobicContact CD1-CB 3.89Å; L175-N387 HydrophobicContact CD2-CB 4.37Å; Y268-N387 PolarHBondContact OH-ND2 2.99Å; Y340-N387 PolarHBondContact OH-ND2 2.88Å; G343-N387 VanDerWaalsContact O-CB 3.29Å; G343-N387 WeakPolarHBondContact O-CB 3.38Å; G343-N387 VanDerWaalsContact O-CG 3.28Å; G343-N387 PolarHBondContact O-N 2.93Å; F385-N387 WeakPolarHBondContact CD1-OD1 3.48Å; F385-N387 WeakPolarHBondContact CE1-OD1 3.24Å; N387-F390 PolarHBondContact O-N 2.88Å; N387-A391 VanDerWaalsContact O-CB 3.28Å; N387-A391 WeakPolarHBondContact O-CB 3.34Å; N387-A391 PolarHBondContact O-N 2.86Å
388	Q	93.8	Very high	94.9	Very high	99 Å²	99	37.5 Å²	37.5	46%	0.463	22%	0.224	S	C	.	.	H	α-helix	trans	-69	-40.4	177.9	-63.6	-179.5	-36.3	0	0	111.3	P173 L175 N386 F390 A391 A392	P173-Q388 HydrophobicContact CG-CG 4.01Å; L175-Q388 HydrophobicContact CD2-CB 4.31Å; L175-Q388 HydrophobicContact CD2-CG 3.67Å; N386-Q388 PolarHBondContact O-N 2.88Å; N386-Q388 WeakPolarHBondContact OD1-CA 3.27Å; N386-Q388 VanDerWaalsContact OD1-CB 3.3Å; N386-Q388 WeakPolarHBondContact OD1-CB 3.21Å; N386-Q388 PolarHBondContact OD1-N 2.88Å; Q388-F390 VanDerWaalsContact C-N 3.35Å; Q388-A391 WeakPolarHBondContact O-CB 3.49Å; Q388-A391 PolarHBondContact O-N 3.28Å; Q388-A392 PolarHBondContact O-N 2.89Å
389	E	94.8	Very high	94.4	Very high	66 Å²	66	40.3 Å²	40.3	31%	0.308	24%	0.236	S	C	.	.	H	α-helix	trans	-64	-42.6	174.8	-68.7	170.2	-171.9	0	0	111	R365 N386 A392 L393	R365-E389 WeakPolarHBondContact CD-OE1 3.46Å; R365-E389 IonicContact CZ-OE1 3.37Å; R365-E389 IonicContact CZ-OE2 3.86Å; R365-E389 IonicContact NE-OE1 2.86Å; R365-E389 PolarHBondContact NE-OE1 2.9Å; R365-E389 IonicContact NE-OE2 2.67Å; R365-E389 PolarHBondContact NE-OE2 2.8Å; R365-E389 IonicContact NH2-OE1 2.97Å; R365-E389 IonicContact NH2-OE2 2.67Å; R365-E389 PolarHBondContact NH2-OE2 3.24Å; N386-E389 HydrophobicContact CB-CB 4.29Å; N386-E389 HydrophobicContact CB-CG 4.11Å; N386-E389 PolarHBondContact O-N 2.86Å; N386-E389 PolarHBondContact OD1-N 2.83Å; E389-A392 PolarHBondContact O-N 2.85Å; E389-L393 WeakPolarHBondContact O-CB 3.27Å; E389-L393 PolarHBondContact O-N 3.04Å; E389-L393 VanDerWaalsContact O-N 3.09Å
390	F	96.2	Very high	94.3	Very high	1 Å²	1	42.9 Å²	42.9	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-42.5	174	-179.9	-101.9	0	0	0	112.3	F385 N386 N387 Q388 A392 L393 L394 L408 M411 C412 P445 W448 L449	F385-F390 HydrophobicContact CE1-CB 3.99Å; F385-F390 HydrophobicContact CE1-CG 4.43Å; F385-F390 HydrophobicContact CE2-CB 4.49Å; F385-F390 HydrophobicContact CZ-CB 3.59Å; F385-F390 HydrophobicContact CZ-CD1 4.43Å; F385-F390 AromaticContact CZ-CD2 3.97Å; F385-F390 HydrophobicContact CZ-CD2 3.97Å; F385-F390 AromaticContact CZ-CG 3.74Å; F385-F390 HydrophobicContact CZ-CG 3.74Å; N386-F390 PolarHBondContact O-N 2.88Å; N386-F390 VanDerWaalsContact O-N 3.14Å; N387-F390 PolarHBondContact O-N 2.88Å; Q388-F390 VanDerWaalsContact C-N 3.35Å; F390-A392 PolarHBondContact O-N 3.37Å; F390-L393 PolarHBondContact O-N 3.15Å; F390-L394 HydrophobicContact CE1-CD2 4.13Å; F390-L394 WeakPolarHBondContact O-CB 3.14Å; F390-L394 PolarHBondContact O-N 2.97Å; F390-L408 HydrophobicContact CE2-CB 4.24Å; F390-M411 HydrophobicContact CD2-CB 4.03Å; F390-M411 HydrophobicContact CE2-CB 3.94Å; F390-C412 VanDerWaalsContact CZ-SG 3.57Å; F390-P445 HydrophobicContact CD1-CB 3.88Å; F390-P445 HydrophobicContact CD1-CG 4.47Å; F390-P445 HydrophobicContact CE1-CB 3.66Å; F390-P445 HydrophobicContact CG-CB 4.44Å; F390-P445 HydrophobicContact CZ-CB 4.03Å; F390-W448 HydrophobicContact CD1-CE3 4.42Å; F390-L449 HydrophobicContact CZ-CB 4.5Å
391	A	94.1	Very high	94.1	Very high	6 Å²	6	41.2 Å²	41.2	5%	0.05	22%	0.224	C	C	.	.	H	α-helix	trans	-57.3	-47.7	176.4	0	0	0	0	0	112.1	L175 N387 Q388 L393 L394 A395 W448	L175-A391 HydrophobicContact CD2-CB 4.29Å; N387-A391 VanDerWaalsContact O-CB 3.28Å; N387-A391 WeakPolarHBondContact O-CB 3.34Å; N387-A391 PolarHBondContact O-N 2.86Å; Q388-A391 WeakPolarHBondContact O-CB 3.49Å; Q388-A391 PolarHBondContact O-N 3.28Å; A391-L393 VanDerWaalsContact C-N 3.34Å; A391-L394 PolarHBondContact O-N 3.32Å; A391-A395 WeakPolarHBondContact O-CB 3.25Å; A391-A395 PolarHBondContact O-N 3.03Å; A391-W448 HydrophobicContact CB-CH2 3.39Å; A391-W448 HydrophobicContact CB-CZ3 3.43Å; A391-W448 VanDerWaalsContact CB-CZ3 3.43Å
392	A	94.2	Very high	93.8	Very high	50 Å²	50	39 Å²	39	41%	0.413	21%	0.21	S	C	.	.	H	α-helix	trans	-62.8	-42.9	179.3	0	0	0	0	0	111.2	Q388 E389 F390 A395 Q396	Q388-A392 PolarHBondContact O-N 2.89Å; E389-A392 PolarHBondContact O-N 2.85Å; F390-A392 PolarHBondContact O-N 3.37Å; A392-A395 PolarHBondContact O-N 2.71Å; A392-Q396 VanDerWaalsContact O-CG 3.27Å; A392-Q396 WeakPolarHBondContact O-CG 3.41Å; A392-Q396 PolarHBondContact O-N 2.9Å; A392-Q396 VanDerWaalsContact O-N 3.08Å
393	L	94.5	Very high	93.7	Very high	22 Å²	22	42.4 Å²	42.4	12%	0.115	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-45.2	176.3	-177.3	60.7	0	0	0	111.9	E389 F390 A391 A395 Q396 S397 L408 M411	E389-L393 WeakPolarHBondContact O-CB 3.27Å; E389-L393 PolarHBondContact O-N 3.04Å; E389-L393 VanDerWaalsContact O-N 3.09Å; F390-L393 PolarHBondContact O-N 3.15Å; A391-L393 VanDerWaalsContact C-N 3.34Å; L393-A395 PolarHBondContact O-N 3.03Å; L393-Q396 PolarHBondContact O-N 2.87Å; L393-Q396 VanDerWaalsContact O-N 3.15Å; L393-S397 WeakPolarHBondContact O-CB 3.3Å; L393-S397 PolarHBondContact O-N 3.22Å; L393-S397 PolarHBondContact O-OG 2.81Å; L393-L408 HydrophobicContact CD2-CD2 3.49Å; L393-L408 VanDerWaalsContact CD2-CD2 3.49Å; L393-L408 HydrophobicContact CG-CD1 4.43Å; L393-L408 HydrophobicContact CG-CD2 3.7Å; L393-M411 HydrophobicContact CD2-CE 3.65Å; L393-M411 HydrophobicContact CD2-CG 4.19Å; L393-M411 HydrophobicContact CD2-SD 4.36Å
394	L	94.9	Very high	93.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.2	-47.4	177	179.1	57.3	0	0	0	111.5	V178 F390 A391 Q396 S397 V398 V405 L408 W448 L449 V452	V178-L394 HydrophobicContact CG1-CG 4.47Å; V178-L394 HydrophobicContact CG2-CD2 3.99Å; V178-L394 HydrophobicContact CG2-CG 4Å; F390-L394 HydrophobicContact CE1-CD2 4.13Å; F390-L394 WeakPolarHBondContact O-CB 3.14Å; F390-L394 PolarHBondContact O-N 2.97Å; A391-L394 PolarHBondContact O-N 3.32Å; L394-Q396 VanDerWaalsContact C-N 3.28Å; L394-Q396 PolarHBondContact O-N 2.78Å; L394-S397 PolarHBondContact O-N 2.94Å; L394-V398 WeakPolarHBondContact O-CG2 3.49Å; L394-V398 PolarHBondContact O-N 2.89Å; L394-V398 VanDerWaalsContact O-N 3.11Å; L394-V405 HydrophobicContact CD1-CG1 4Å; L394-L408 HydrophobicContact CB-CD1 4.13Å; L394-L408 HydrophobicContact CD1-CD1 3.79Å; L394-W448 HydrophobicContact CD2-CD2 3.92Å; L394-W448 HydrophobicContact CD2-CE3 4.28Å; L394-W448 HydrophobicContact CD2-CG 4Å; L394-L449 HydrophobicContact CD1-CD1 3.58Å; L394-V452 HydrophobicContact CD1-CB 4.38Å; L394-V452 HydrophobicContact CD1-CG1 4.2Å; L394-V452 HydrophobicContact CD1-CG2 4.35Å; L394-V452 HydrophobicContact CD2-CG2 4.07Å; L394-V452 HydrophobicContact CG-CG2 4.36Å
395	A	93.1	Very high	93.3	Very high	43 Å²	43	40.5 Å²	40.5	36%	0.355	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-35.3	176.8	0	0	0	0	0	112.9	V178 A391 A392 L393 N399	V178-A395 HydrophobicContact CG2-CB 4.4Å; A391-A395 WeakPolarHBondContact O-CB 3.25Å; A391-A395 PolarHBondContact O-N 3.03Å; A392-A395 PolarHBondContact O-N 2.71Å; L393-A395 PolarHBondContact O-N 3.03Å; A395-N399 PolarHBondContact O-ND2 3.43Å
396	Q	93.2	Very high	93	Very high	116 Å²	116	46.5 Å²	46.5	54%	0.542	25%	0.245	S	C	.	.	H	α-helix	trans	-71.1	-44.9	175.3	-71.8	171	12.9	0	0	111.9	A392 L393 L394 V398 N399	A392-Q396 VanDerWaalsContact O-CG 3.27Å; A392-Q396 WeakPolarHBondContact O-CG 3.41Å; A392-Q396 PolarHBondContact O-N 2.9Å; A392-Q396 VanDerWaalsContact O-N 3.08Å; L393-Q396 PolarHBondContact O-N 2.87Å; L393-Q396 VanDerWaalsContact O-N 3.15Å; L394-Q396 VanDerWaalsContact C-N 3.28Å; L394-Q396 PolarHBondContact O-N 2.78Å; Q396-V398 VanDerWaalsContact C-N 3.3Å; Q396-V398 PolarHBondContact O-N 3.32Å; Q396-N399 PolarHBondContact O-N 2.74Å
397	S	93.6	Very high	92.8	Very high	5 Å²	5	48.7 Å²	48.7	4%	0.035	26%	0.255	C	S	.	.	H	α-helix	trans	-67.3	-26.1	-177.5	-65.5	0	0	0	0	113.6	L393 L394 N399 Q400 G401	L393-S397 WeakPolarHBondContact O-CB 3.3Å; L393-S397 PolarHBondContact O-N 3.22Å; L393-S397 PolarHBondContact O-OG 2.81Å; L394-S397 PolarHBondContact O-N 2.94Å; S397-N399 PolarHBondContact O-N 2.84Å; S397-Q400 WeakPolarHBondContact O-CB 3.42Å; S397-Q400 PolarHBondContact O-N 3.49Å; S397-G401 PolarHBondContact O-N 2.95Å
398	V	91.8	Very high	92.8	Very high	6 Å²	6	49 Å²	49	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-55.1	-37.4	172.5	165.8	0	0	0	0	111.7	V178 L394 Q396 Q400 G401 V405 V452 M456	V178-V398 HydrophobicContact CG1-CG2 3.7Å; L394-V398 WeakPolarHBondContact O-CG2 3.49Å; L394-V398 PolarHBondContact O-N 2.89Å; L394-V398 VanDerWaalsContact O-N 3.11Å; Q396-V398 VanDerWaalsContact C-N 3.3Å; Q396-V398 PolarHBondContact O-N 3.32Å; V398-Q400 PolarHBondContact O-N 2.66Å; V398-G401 PolarHBondContact O-N 3.05Å; V398-V405 HydrophobicContact CG2-CG2 4.09Å; V398-V452 HydrophobicContact CG2-CG1 3.51Å; V398-M456 HydrophobicContact CG1-SD 3.92Å; V398-M456 WeakPolarHBondContact O-CE 3.36Å
399	N	88.7	Confident	92.9	Very high	124 Å²	124	46.7 Å²	46.7	66%	0.663	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-11.9	178.6	-57.2	-59	0	0	0	113.6	A395 Q396 S397	A395-N399 PolarHBondContact O-ND2 3.43Å; Q396-N399 PolarHBondContact O-N 2.74Å; S397-N399 PolarHBondContact O-N 2.84Å
400	Q	90.2	Very high	92.8	Very high	114 Å²	114	47.9 Å²	47.9	53%	0.533	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-8	178.8	-61.5	173.9	6.4	0	0	112.4	S397 V398 A404	S397-Q400 WeakPolarHBondContact O-CB 3.42Å; S397-Q400 PolarHBondContact O-N 3.49Å; V398-Q400 PolarHBondContact O-N 2.66Å; Q400-A404 HydrophobicContact CB-CB 3.49Å; Q400-A404 VanDerWaalsContact CB-CB 3.49Å
401	G	89.3	Confident	92.7	Very high	22 Å²	22	48.7 Å²	48.7	23%	0.227	25%	0.254	C	S	.	.			trans	100.3	178.7	176.9	0	0	0	0	0	114.5	S397 V398 E403 A404 V405 M456	S397-G401 PolarHBondContact O-N 2.95Å; V398-G401 PolarHBondContact O-N 3.05Å; G401-E403 PolarHBondContact O-N 3.12Å; G401-A404 PolarHBondContact O-N 2.82Å; G401-V405 PolarHBondContact O-N 2.85Å; G401-M456 VanDerWaalsContact C-CE 3.45Å
402	F	90.4	Very high	92.9	Very high	40 Å²	40	48.4 Å²	48.4	18%	0.175	25%	0.252	C	S	.	.	H	α-helix	trans	-56.3	-46	-171.2	-176.6	-84.2	0	0	0	113.4	A404 V405 Y406 L453 M456 G457 P459	F402-A404 PolarHBondContact O-N 3.41Å; F402-V405 PolarHBondContact O-N 3.43Å; F402-Y406 HydrophobicContact CE1-CD2 4.27Å; F402-Y406 HydrophobicContact CE1-CG 4.4Å; F402-Y406 WeakPolarHBondContact O-CB 3.17Å; F402-Y406 PolarHBondContact O-N 3.31Å; F402-L453 HydrophobicContact CD2-CD2 4.08Å; F402-L453 HydrophobicContact CE1-CD2 4.48Å; F402-L453 HydrophobicContact CE2-CD2 3.79Å; F402-L453 HydrophobicContact CZ-CD2 4.01Å; F402-M456 HydrophobicContact CD2-CB 4Å; F402-G457 WeakPolarHBondContact CD2-O 3.39Å; F402-G457 VanDerWaalsContact CE2-O 3.23Å; F402-G457 WeakPolarHBondContact CE2-O 3.5Å; F402-P459 HydrophobicContact CD1-CB 4.47Å; F402-P459 HydrophobicContact CD1-CG 3.68Å; F402-P459 HydrophobicContact CE1-CG 3.65Å; F402-P459 HydrophobicContact CZ-CG 4.45Å
403	E	91.2	Very high	93	Very high	102 Å²	102	47 Å²	47	48%	0.477	24%	0.238	S	C	.	.	H	α-helix	trans	-63.1	-42.6	-176.2	-174.1	58.3	-149.6	0	0	111.8	G401 V405 Y406 Q407	G401-E403 PolarHBondContact O-N 3.12Å; E403-V405 VanDerWaalsContact C-N 3.33Å; E403-V405 PolarHBondContact O-N 3.4Å; E403-Y406 PolarHBondContact O-N 2.75Å; E403-Q407 VanDerWaalsContact O-CG 3.27Å; E403-Q407 WeakPolarHBondContact O-CG 3.43Å; E403-Q407 PolarHBondContact O-N 2.99Å; E403-Q407 PolarHBondContact OE1-NE2 3.31Å
404	A	92.6	Very high	93.2	Very high	21 Å²	21	45.9 Å²	45.9	17%	0.174	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-42.1	178.2	0	0	0	0	0	111.8	Q400 G401 F402	Q400-A404 HydrophobicContact CB-CB 3.49Å; Q400-A404 VanDerWaalsContact CB-CB 3.49Å; G401-A404 PolarHBondContact O-N 2.82Å; F402-A404 PolarHBondContact O-N 3.41Å
405	V	93.3	Very high	93.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-46.7	173.9	-179.6	0	0	0	0	110.2	L394 V398 G401 F402 E403 Q407 L408 L449 V452 L453 M456	L394-V405 HydrophobicContact CD1-CG1 4Å; V398-V405 HydrophobicContact CG2-CG2 4.09Å; G401-V405 PolarHBondContact O-N 2.85Å; F402-V405 PolarHBondContact O-N 3.43Å; E403-V405 VanDerWaalsContact C-N 3.33Å; E403-V405 PolarHBondContact O-N 3.4Å; V405-Q407 VanDerWaalsContact C-N 3.27Å; V405-Q407 PolarHBondContact O-N 3.24Å; V405-L408 VanDerWaalsContact O-CB 3.23Å; V405-L408 WeakPolarHBondContact O-CB 3.36Å; V405-L408 PolarHBondContact O-N 3.02Å; V405-L449 HydrophobicContact CG1-CD1 3.49Å; V405-L449 VanDerWaalsContact CG1-CD1 3.49Å; V405-L449 WeakPolarHBondContact O-CD1 3.46Å; V405-V452 HydrophobicContact CG1-CG1 3.95Å; V405-L453 HydrophobicContact CB-CD2 3.94Å; V405-L453 HydrophobicContact CG1-CD2 3.58Å; V405-L453 HydrophobicContact CG1-CG 3.81Å; V405-M456 HydrophobicContact CG2-CE 4.25Å
406	Y	92.4	Very high	93.6	Very high	125 Å²	125	45.8 Å²	45.8	49%	0.49	22%	0.223	S	C	.	.	H	α-helix	trans	-58.1	-39.3	-179.3	-173.8	-98.7	0	0	0	112.4	F402 E403 L408 T409 L453	F402-Y406 HydrophobicContact CE1-CD2 4.27Å; F402-Y406 HydrophobicContact CE1-CG 4.4Å; F402-Y406 WeakPolarHBondContact O-CB 3.17Å; F402-Y406 PolarHBondContact O-N 3.31Å; E403-Y406 PolarHBondContact O-N 2.75Å; Y406-L408 PolarHBondContact O-N 3.22Å; Y406-T409 VanDerWaalsContact O-CB 3.28Å; Y406-T409 WeakPolarHBondContact O-CB 3.45Å; Y406-T409 PolarHBondContact O-N 3.01Å; Y406-T409 VanDerWaalsContact O-N 3.09Å; Y406-T409 PolarHBondContact O-OG1 3.12Å; Y406-L453 HydrophobicContact CD2-CD1 4.19Å
407	Q	92.6	Very high	93.9	Very high	56 Å²	56	40.2 Å²	40.2	26%	0.262	20%	0.197	S	C	.	.	H	α-helix	trans	-61.8	-25.2	175.6	-69	-64.3	-20.9	0	0	113.6	E403 V405 T409 R410	E403-Q407 VanDerWaalsContact O-CG 3.27Å; E403-Q407 WeakPolarHBondContact O-CG 3.43Å; E403-Q407 PolarHBondContact O-N 2.99Å; E403-Q407 PolarHBondContact OE1-NE2 3.31Å; V405-Q407 VanDerWaalsContact C-N 3.27Å; V405-Q407 PolarHBondContact O-N 3.24Å; Q407-T409 PolarHBondContact O-N 2.69Å; Q407-T409 VanDerWaalsContact O-N 3.11Å; Q407-R410 WeakPolarHBondContact O-CB 3.33Å; Q407-R410 PolarHBondContact O-N 3.01Å
408	L	94.5	Very high	94.1	Very high	11 Å²	11	40.1 Å²	40.1	6%	0.058	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-65.1	-12	175	-60.8	-177.5	0	0	0	113.5	F390 L393 L394 V405 Y406 R410 M411 L449	F390-L408 HydrophobicContact CE2-CB 4.24Å; L393-L408 HydrophobicContact CD2-CD2 3.49Å; L393-L408 VanDerWaalsContact CD2-CD2 3.49Å; L393-L408 HydrophobicContact CG-CD1 4.43Å; L393-L408 HydrophobicContact CG-CD2 3.7Å; L394-L408 HydrophobicContact CB-CD1 4.13Å; L394-L408 HydrophobicContact CD1-CD1 3.79Å; V405-L408 VanDerWaalsContact O-CB 3.23Å; V405-L408 WeakPolarHBondContact O-CB 3.36Å; V405-L408 PolarHBondContact O-N 3.02Å; Y406-L408 PolarHBondContact O-N 3.22Å; L408-R410 PolarHBondContact O-N 3.14Å; L408-M411 HydrophobicContact CD2-CG 3.89Å; L408-M411 VanDerWaalsContact O-CB 3.28Å; L408-M411 WeakPolarHBondContact O-CB 3.3Å; L408-M411 PolarHBondContact O-N 2.8Å; L408-L449 HydrophobicContact CB-CD1 3.91Å; L408-L449 HydrophobicContact CB-CD2 4.31Å; L408-L449 HydrophobicContact CD1-CD1 4.41Å
409	T	94.8	Very high	94.4	Very high	50 Å²	50	41.1 Å²	41.1	31%	0.307	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-52.9	-37.8	168.7	-53.7	0	0	0	0	110.5	Y406 Q407 M411 C412 L446 L449	Y406-T409 VanDerWaalsContact O-CB 3.28Å; Y406-T409 WeakPolarHBondContact O-CB 3.45Å; Y406-T409 PolarHBondContact O-N 3.01Å; Y406-T409 VanDerWaalsContact O-N 3.09Å; Y406-T409 PolarHBondContact O-OG1 3.12Å; Q407-T409 PolarHBondContact O-N 2.69Å; Q407-T409 VanDerWaalsContact O-N 3.11Å; T409-M411 VanDerWaalsContact C-N 3.28Å; T409-M411 PolarHBondContact O-N 3.01Å; T409-C412 WeakPolarHBondContact O-CB 3.48Å; T409-C412 PolarHBondContact O-N 3.07Å; T409-C412 VanDerWaalsContact O-N 3.11Å; T409-L446 HydrophobicContact CG2-CD2 4.09Å; T409-L449 VanDerWaalsContact N-CD2 3.31Å; T409-L449 WeakPolarHBondContact OG1-CD2 3.45Å
410	R	93.1	Very high	94.9	Very high	92 Å²	92	39 Å²	39	35%	0.347	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-64.5	-30.9	177.5	-61.4	-179.6	-177.5	164.5	11.4	112.8	S199 Q407 L408 C412 T413	S199-R410 PolarHBondContact O-NH1 3.29Å; S199-R410 PolarHBondContact OG-NH1 3.22Å; Q407-R410 WeakPolarHBondContact O-CB 3.33Å; Q407-R410 PolarHBondContact O-N 3.01Å; L408-R410 PolarHBondContact O-N 3.14Å; R410-C412 PolarHBondContact O-N 2.9Å; R410-T413 PolarHBondContact O-N 3.04Å
411	M	94.9	Very high	95.2	Very high	17 Å²	17	33.9 Å²	33.9	8%	0.084	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-65.5	-27	176.9	-61.4	-66.5	-74.2	0	0	111.8	P360 N361 Q364 F385 F390 L393 L408 T409 T413	P360-M411 HydrophobicContact CB-CE 4.41Å; P360-M411 HydrophobicContact CB-SD 3.4Å; P360-M411 WeakPolarHBondContact CB-SD 3.24Å; N361-M411 VanDerWaalsContact CA-CE 3.4Å; N361-M411 HydrophobicContact CB-CE 3.95Å; Q364-M411 HydrophobicContact CB-CE 4.43Å; Q364-M411 VanDerWaalsContact OE1-CE 3.22Å; F385-M411 VanDerWaalsContact CE2-O 3.3Å; F385-M411 WeakPolarHBondContact CE2-O 3.29Å; F390-M411 HydrophobicContact CD2-CB 4.03Å; F390-M411 HydrophobicContact CE2-CB 3.94Å; L393-M411 HydrophobicContact CD2-CE 3.65Å; L393-M411 HydrophobicContact CD2-CG 4.19Å; L393-M411 HydrophobicContact CD2-SD 4.36Å; L408-M411 HydrophobicContact CD2-CG 3.89Å; L408-M411 VanDerWaalsContact O-CB 3.28Å; L408-M411 WeakPolarHBondContact O-CB 3.3Å; L408-M411 PolarHBondContact O-N 2.8Å; T409-M411 VanDerWaalsContact C-N 3.28Å; T409-M411 PolarHBondContact O-N 3.01Å; M411-T413 VanDerWaalsContact C-N 3.3Å
412	C	96.9	Very high	95.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-84.9	-3.8	-178	-52	0	0	0	0	113.6	F390 T409 R410 L442 P445 L446	F390-C412 VanDerWaalsContact CZ-SG 3.57Å; T409-C412 WeakPolarHBondContact O-CB 3.48Å; T409-C412 PolarHBondContact O-N 3.07Å; T409-C412 VanDerWaalsContact O-N 3.11Å; R410-C412 PolarHBondContact O-N 2.9Å; C412-L442 PolarHBondContact O-N 2.67Å; C412-P445 HydrophobicContact CB-CB 4.32Å; C412-P445 VanDerWaalsContact SG-CB 3.59Å; C412-L446 HydrophobicContact CB-CD1 4.44Å; C412-L446 HydrophobicContact CB-CD2 3.53Å; C412-L446 HydrophobicContact CB-CG 3.58Å
413	T	97.5	Very high	95.8	Very high	20 Å²	20	31 Å²	31	12%	0.123	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.6	178.7	-60.8	0	0	0	0	110.6	R410 M411 E439 L440 H441	R410-T413 PolarHBondContact O-N 3.04Å; M411-T413 VanDerWaalsContact C-N 3.3Å; T413-E439 HydrophobicContact CG2-CG 3.55Å; T413-L440 CarbonylContact C-O 3.55Å; T413-L440 VanDerWaalsContact CA-O 3.32Å; T413-L440 WeakPolarHBondContact CA-O 3.38Å; T413-H441 PolarHBondContact OG1-CD2 3.3Å; T413-H441 PolarHBondContact OG1-NE2 3.43Å
414	I	98.4	Very high	95.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.5	177.3	-57.9	173.6	0	0	0	108.9	V357 I384 F385 M416 L440 L442	V357-I414 HydrophobicContact CG1-CG2 3.74Å; I384-I414 HydrophobicContact CB-CD1 4.19Å; I384-I414 HydrophobicContact CD1-CD1 3.85Å; I384-I414 HydrophobicContact CD1-CG2 4.34Å; I384-I414 HydrophobicContact CG1-CD1 3.92Å; F385-I414 HydrophobicContact CB-CD1 4.13Å; F385-I414 HydrophobicContact CD2-CD1 4.32Å; I414-M416 HydrophobicContact CG2-CE 3.92Å; I414-M416 HydrophobicContact CG2-CG 4.28Å; I414-L440 HydrophobicContact CB-CB 4.23Å; I414-L440 PolarHBondContact N-O 2.84Å; I414-L440 WeakPolarHBondContact O-CB 3.47Å; I414-L440 PolarHBondContact O-N 2.85Å; I414-L442 HydrophobicContact CD1-CD1 4.1Å
415	R	98.5	Very high	95.6	Very high	39 Å²	39	37.4 Å²	37.4	15%	0.147	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137.3	178.6	-61.3	-173.9	-178.7	113.7	0.6	110.7	T204 V357 Q358 W422 V431 W437 I438 E439	T204-R415 VanDerWaalsContact CG2-NH1 3.31Å; V357-R415 WeakPolarHBondContact CA-O 3.13Å; Q358-R415 PolarHBondContact N-O 3.03Å; Q358-R415 PolarHBondContact O-N 3.22Å; R415-W422 HydrophobicContact CB-CH2 4.45Å; R415-W422 HydrophobicContact CB-CZ2 4.36Å; R415-V431 HydrophobicContact CB-CG2 4.46Å; R415-W437 HydrophobicContact CG-CZ3 4.3Å; R415-I438 WeakPolarHBondContact CA-O 3.5Å; R415-E439 HydrophobicContact CG-CG 4.31Å; R415-E439 IonicContact CZ-OE2 2.69Å; R415-E439 IonicContact NE-OE2 3.07Å; R415-E439 PolarHBondContact NE-OE2 2.95Å; R415-E439 IonicContact NH2-OE2 3.01Å; R415-E439 PolarHBondContact NH2-OE2 3.19Å
416	M	98.5	Very high	95.7	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125.7	179.2	-49.3	-173.9	-136.6	0	0	111.7	L338 A347 F356 V357 I384 I414 W437 I438 L440	L338-M416 HydrophobicContact CD1-CE 4.13Å; L338-M416 HydrophobicContact CD2-CE 3.62Å; L338-M416 HydrophobicContact CD2-SD 4.05Å; A347-M416 HydrophobicContact CB-SD 4.28Å; F356-M416 CarbonylContact O-C 3.1Å; F356-M416 WeakPolarHBondContact O-CA 3.43Å; V357-M416 HydrophobicContact CB-CG 4.31Å; V357-M416 HydrophobicContact CG1-CG 4.07Å; V357-M416 HydrophobicContact CG1-SD 4.49Å; V357-M416 HydrophobicContact CG2-CB 4.34Å; V357-M416 HydrophobicContact CG2-CG 3.8Å; V357-M416 HydrophobicContact CG2-SD 3.9Å; I384-M416 HydrophobicContact CD1-CE 3.62Å; I414-M416 HydrophobicContact CG2-CE 3.92Å; I414-M416 HydrophobicContact CG2-CG 4.28Å; M416-W437 CarbonylContact O-C 3.59Å; M416-W437 WeakPolarHBondContact O-CA 3.13Å; M416-W437 VanDerWaalsContact O-CB 3.25Å; M416-W437 WeakPolarHBondContact O-CB 3.34Å; M416-I438 HydrophobicContact CB-CD1 4.34Å; M416-I438 HydrophobicContact CB-CG1 3.88Å; M416-I438 PolarHBondContact N-O 3.08Å; M416-I438 PolarHBondContact O-N 3.18Å; M416-L440 HydrophobicContact CE-CB 4.39Å; M416-L440 HydrophobicContact CE-CD2 4Å
417	S	98.7	Very high	95.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	141.6	173.2	176.4	0	0	0	0	111	I355 F356 K420 T434 C436	I355-S417 WeakPolarHBondContact CA-O 3.43Å; F356-S417 PolarHBondContact N-O 3.4Å; F356-S417 PolarHBondContact O-N 3.35Å; S417-K420 VanDerWaalsContact CB-O 3.32Å; S417-K420 WeakPolarHBondContact CB-O 3.41Å; S417-K420 PolarHBondContact OG-O 3.39Å; S417-T434 VanDerWaalsContact OG-CB 3.3Å; S417-T434 WeakPolarHBondContact OG-CB 3.33Å; S417-T434 PolarHBondContact OG-OG1 3.27Å; S417-C436 PolarHBondContact OG-O 2.86Å
418	F	98.7	Very high	96	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.009	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.9	173.9	-61.2	-85.1	0	0	0	110.5	V299 L313 I332 V336 I355 K420 C436 I438	V299-F418 HydrophobicContact CB-CZ 4.32Å; V299-F418 HydrophobicContact CG1-CZ 3.9Å; L313-F418 HydrophobicContact CD1-CD2 4.43Å; L313-F418 HydrophobicContact CD1-CE2 3.75Å; L313-F418 HydrophobicContact CD1-CZ 4.1Å; I332-F418 HydrophobicContact CD1-CB 4.39Å; I332-F418 HydrophobicContact CD1-CD2 4.28Å; I332-F418 HydrophobicContact CD1-CG 4.25Å; I332-F418 HydrophobicContact CG1-CB 3.92Å; I332-F418 HydrophobicContact CG1-CD1 4.36Å; I332-F418 HydrophobicContact CG1-CG 4.05Å; I332-F418 HydrophobicContact CG2-CD1 3.92Å; I332-F418 HydrophobicContact CG2-CE1 4.07Å; I332-F418 HydrophobicContact CG2-CG 4.39Å; V336-F418 HydrophobicContact CB-CE1 4.3Å; V336-F418 HydrophobicContact CG1-CE1 3.82Å; V336-F418 HydrophobicContact CG1-CZ 3.94Å; I355-F418 HydrophobicContact CG2-CD1 3.88Å; I355-F418 HydrophobicContact CG2-CE1 4.34Å; F418-K420 PolarHBondContact O-N 2.94Å; F418-C436 HydrophobicContact CB-CB 4.41Å; F418-C436 HydrophobicContact CD2-CB 4.35Å; F418-C436 PolarHBondContact N-O 3.38Å; F418-I438 HydrophobicContact CE2-CD1 4.44Å; F418-I438 HydrophobicContact CE2-CG1 4.18Å; F418-I438 HydrophobicContact CE2-CG2 4Å; F418-I438 HydrophobicContact CZ-CD1 4.2Å; F418-I438 HydrophobicContact CZ-CG1 4.42Å
419	V	98.3	Very high	96	Very high	28 Å²	28	51.9 Å²	51.9	17%	0.17	24%	0.244	C	C	.	.	S	Bend	trans	67.8	-40	171.1	-168.9	0	0	0	0	114.9	T328 H331 A354 F356	T328-V419 HydrophobicContact CG2-CB 3.93Å; T328-V419 HydrophobicContact CG2-CG2 3.93Å; H331-V419 HydrophobicContact CB-CG1 4.32Å; H331-V419 HydrophobicContact CB-CG2 3.7Å; A354-V419 WeakPolarHBondContact O-CA 3.49Å; A354-V419 PolarHBondContact O-N 2.92Å; F356-V419 WeakPolarHBondContact CE2-O 3.48Å
420	K	97.9	Very high	96.1	Very high	79 Å²	79	50.9 Å²	50.9	34%	0.343	24%	0.238	S	C	.	.			trans	-114	123.9	-174.6	-55.3	-56.5	-177.8	-173	0	110.9	F356 S417 F418 P435	F356-K420 VanDerWaalsContact CD2-C 3.42Å; F356-K420 WeakPolarHBondContact CD2-O 3.26Å; F356-K420 VanDerWaalsContact CE2-C 3.43Å; S417-K420 VanDerWaalsContact CB-O 3.32Å; S417-K420 WeakPolarHBondContact CB-O 3.41Å; S417-K420 PolarHBondContact OG-O 3.39Å; F418-K420 PolarHBondContact O-N 2.94Å; K420-P435 HydrophobicContact CG-CG 3.99Å
421	G	96.4	Very high	96.3	Very high	6 Å²	6	46.6 Å²	46.6	6%	0.062	22%	0.222	C	C	.	.			trans	-77.5	162.4	172.6	0	0	0	0	0	113.3	F356	F356-G421 VanDerWaalsContact CD1-CA 3.41Å; F356-G421 VanDerWaalsContact CE2-N 3.26Å
422	W	98	Very high	96.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.224	C	C	.	.			trans	-142.6	170.6	171.5	81.8	98.8	0	0	0	110.2	F356 Q358 V373 R415 Y426 R428 V431 T434	F356-W422 HydrophobicContact CB-CE3 4.05Å; F356-W422 HydrophobicContact CB-CZ3 3.66Å; F356-W422 WeakPolarHBondContact O-CH2 3.15Å; F356-W422 VanDerWaalsContact O-CZ3 3.24Å; F356-W422 WeakPolarHBondContact O-CZ3 3.27Å; Q358-W422 HydrophobicContact CB-CH2 4.06Å; Q358-W422 HydrophobicContact CB-CZ2 3.54Å; V373-W422 WeakPolarHBondContact CB-O 3.49Å; V373-W422 HydrophobicContact CG1-CD2 4.03Å; V373-W422 HydrophobicContact CG1-CE3 3.81Å; V373-W422 HydrophobicContact CG1-CH2 3.95Å; V373-W422 HydrophobicContact CG1-CZ2 4.18Å; V373-W422 HydrophobicContact CG1-CZ3 3.76Å; V373-W422 HydrophobicContact CG2-CD2 3.9Å; V373-W422 VanDerWaalsContact CG2-CE2 3.47Å; V373-W422 HydrophobicContact CG2-CG 4.25Å; V373-W422 HydrophobicContact CG2-CH2 4.4Å; V373-W422 HydrophobicContact CG2-CZ2 3.79Å; V373-W422 VanDerWaalsContact CG2-O 3.3Å; V373-W422 WeakPolarHBondContact CG2-O 3.21Å; R415-W422 HydrophobicContact CB-CH2 4.45Å; R415-W422 HydrophobicContact CB-CZ2 4.36Å; W422-Y426 WeakPolarHBondContact O-CD2 3.49Å; W422-R428 CarbonylContact C-O 3.47Å; W422-R428 WeakPolarHBondContact CA-O 3.34Å; W422-R428 HydrophobicContact CB-CB 3.95Å; W422-R428 WeakPolarHBondContact CB-O 3.33Å; W422-V431 VanDerWaalsContact CD1-N 3.33Å; W422-V431 HydrophobicContact CD2-CB 4.14Å; W422-V431 HydrophobicContact CD2-CG2 4.15Å; W422-V431 HydrophobicContact CE3-CG2 4.37Å; W422-V431 HydrophobicContact CG-CB 4.37Å; W422-V431 HydrophobicContact CH2-CG2 4.13Å; W422-V431 HydrophobicContact CZ2-CB 4.07Å; W422-V431 HydrophobicContact CZ2-CG2 3.87Å; W422-V431 HydrophobicContact CZ3-CG2 4.36Å; W422-T434 HydrophobicContact CB-CG2 3.77Å; W422-T434 HydrophobicContact CD2-CG2 4.29Å; W422-T434 HydrophobicContact CE3-CG2 4.02Å; W422-T434 HydrophobicContact CG-CG2 4.23Å
423	G	94.8	Very high	96.5	Very high	3 Å²	3	49.2 Å²	49.2	3%	0.031	24%	0.241	C	C	.	.	S	Bend	trans	99.6	-169.3	-178.2	0	0	0	0	0	112.4	E425 Y426 R428 Q429	G423-E425 PolarHBondContact O-N 3.27Å; G423-Y426 PolarHBondContact O-N 3.04Å; G423-R428 PolarHBondContact N-O 2.65Å; G423-Q429 PolarHBondContact N-O 3.47Å
424	A	90.9	Very high	96.5	Very high	90 Å²	90	48.2 Å²	48.2	74%	0.744	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-36	-169	0	0	0	0	0	114.4	Y426	A424-Y426 VanDerWaalsContact C-N 3.33Å; A424-Y426 PolarHBondContact O-N 3.17Å
425	E	88.7	Confident	96.5	Very high	166 Å²	166	48.3 Å²	48.3	78%	0.776	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	3.1	-176.8	-57	-55.3	138	0	0	114.3	G423	G423-E425 PolarHBondContact O-N 3.27Å
426	Y	94.6	Very high	96.5	Very high	71 Å²	71	46.4 Å²	46.4	28%	0.278	23%	0.228	S	C	.	.	S	Bend	trans	-132.6	154.5	-173	-58.5	-84.5	0	0	0	111.8	F356 W422 G423 A424 R428 Q429	F356-Y426 HydrophobicContact CD1-CE1 4.48Å; F356-Y426 HydrophobicContact CD1-CE2 4.31Å; F356-Y426 AromaticContact CD1-CZ 3.92Å; F356-Y426 AromaticContact CE1-CE1 3.81Å; F356-Y426 HydrophobicContact CE1-CE1 3.81Å; F356-Y426 HydrophobicContact CE1-CE2 4.38Å; F356-Y426 AromaticContact CE1-CZ 3.55Å; F356-Y426 VanDerWaalsContact CE1-OH 3.24Å; F356-Y426 WeakPolarHBondContact CE1-OH 3.43Å; F356-Y426 HydrophobicContact CZ-CE1 4.46Å; W422-Y426 WeakPolarHBondContact O-CD2 3.49Å; G423-Y426 PolarHBondContact O-N 3.04Å; A424-Y426 VanDerWaalsContact C-N 3.33Å; A424-Y426 PolarHBondContact O-N 3.17Å; Y426-R428 PolarHBondContact O-N 2.72Å; Y426-Q429 PolarHBondContact O-NE2 2.87Å
427	R	94.9	Very high	96.5	Very high	246 Å²	246	46.4 Å²	46.4	93%	0.928	23%	0.228	S	C	*	.	S	Bend	trans	-56.7	-33.3	173.2	-179.4	178.6	172.8	-172.5	-0.9	112.8
428	R	96.1	Very high	96.5	Very high	75 Å²	75	46.4 Å²	46.4	28%	0.283	23%	0.228	S	C	.	.			trans	-82.9	114.1	178.4	-70.4	175	175.6	76	6.9	108.3	W422 G423 Y426 S433	W422-R428 CarbonylContact C-O 3.47Å; W422-R428 WeakPolarHBondContact CA-O 3.34Å; W422-R428 HydrophobicContact CB-CB 3.95Å; W422-R428 WeakPolarHBondContact CB-O 3.33Å; G423-R428 PolarHBondContact N-O 2.65Å; Y426-R428 PolarHBondContact O-N 2.72Å; R428-S433 WeakPolarHBondContact CD-O 3.31Å; R428-S433 PolarHBondContact NE-O 2.93Å
429	Q	95.9	Very high	96.5	Very high	105 Å²	105	47.1 Å²	47.1	49%	0.491	23%	0.231	S	C	.	.			trans	-78.2	-43.2	178.1	-64.3	-52.7	-43.8	0	0	111.2	N203 G423 Y426	N203-Q429 WeakPolarHBondContact CB-O 3.48Å; G423-Q429 PolarHBondContact N-O 3.47Å; Y426-Q429 PolarHBondContact O-NE2 2.87Å
430	T	96.5	Very high	96.5	Very high	29 Å²	29	45.8 Å²	45.8	18%	0.178	22%	0.223	C	C	.	.	S	Bend	trans	-99.7	153.8	-177.5	66.3	0	0	0	0	113.5	N203 T432 S433	N203-T430 VanDerWaalsContact O-CA 3.26Å; N203-T430 WeakPolarHBondContact O-CA 3.49Å; N203-T430 WeakPolarHBondContact O-CB 3.29Å; T430-T432 WeakPolarHBondContact CB-OG1 3.33Å; T430-T432 PolarHBondContact O-N 2.74Å; T430-T432 PolarHBondContact OG1-OG1 2.62Å; T430-S433 WeakPolarHBondContact O-CB 3.42Å; T430-S433 PolarHBondContact O-N 2.85Å; T430-S433 VanDerWaalsContact O-N 3.13Å; T430-S433 PolarHBondContact OG1-N 2.95Å; T430-S433 PolarHBondContact OG1-OG 3.08Å
431	V	97.3	Very high	96.5	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-62.6	-33.6	172	70.1	0	0	0	0	111.5	N203 R415 W422 S433 T434 W437	N203-V431 PolarHBondContact O-N 3.11Å; N203-V431 VanDerWaalsContact O-N 3.16Å; R415-V431 HydrophobicContact CB-CG2 4.46Å; W422-V431 VanDerWaalsContact CD1-N 3.33Å; W422-V431 HydrophobicContact CD2-CB 4.14Å; W422-V431 HydrophobicContact CD2-CG2 4.15Å; W422-V431 HydrophobicContact CE3-CG2 4.37Å; W422-V431 HydrophobicContact CG-CB 4.37Å; W422-V431 HydrophobicContact CH2-CG2 4.13Å; W422-V431 HydrophobicContact CZ2-CB 4.07Å; W422-V431 HydrophobicContact CZ2-CG2 3.87Å; W422-V431 HydrophobicContact CZ3-CG2 4.36Å; V431-S433 PolarHBondContact O-N 2.94Å; V431-S433 VanDerWaalsContact O-N 3.11Å; V431-T434 VanDerWaalsContact O-CB 3.29Å; V431-T434 WeakPolarHBondContact O-CB 3.41Å; V431-T434 WeakPolarHBondContact O-CG2 3.3Å; V431-T434 PolarHBondContact O-N 3.44Å; V431-T434 PolarHBondContact O-OG1 3.34Å; V431-W437 HydrophobicContact CG1-CD2 4.48Å; V431-W437 HydrophobicContact CG1-CE3 4.4Å; V431-W437 HydrophobicContact CG1-CH2 4.2Å; V431-W437 HydrophobicContact CG1-CZ2 4.26Å; V431-W437 HydrophobicContact CG1-CZ3 4.25Å; V431-W437 HydrophobicContact CG2-CB 4.1Å; V431-W437 HydrophobicContact CG2-CD2 3.57Å; V431-W437 HydrophobicContact CG2-CE3 3.67Å; V431-W437 HydrophobicContact CG2-CG 3.78Å; V431-W437 HydrophobicContact CG2-CZ3 4.32Å
432	T	97.8	Very high	96.6	Very high	22 Å²	22	44.8 Å²	44.8	14%	0.135	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-65.3	-12.1	176.4	52.4	0	0	0	0	113.7	F206 L282 N283 T430 W437	F206-T432 HydrophobicContact CD1-CG2 4.45Å; F206-T432 HydrophobicContact CE1-CG2 4.49Å; L282-T432 CarbonylContact C-O 3.54Å; L282-T432 WeakPolarHBondContact CA-O 3.36Å; L282-T432 WeakPolarHBondContact O-CA 3.32Å; N283-T432 HydrophobicContact CB-CG2 4.22Å; T430-T432 WeakPolarHBondContact CB-OG1 3.33Å; T430-T432 PolarHBondContact O-N 2.74Å; T430-T432 PolarHBondContact OG1-OG1 2.62Å; T432-W437 HydrophobicContact CG2-CZ2 4.18Å
433	S	97.5	Very high	96.5	Very high	50 Å²	50	46.6 Å²	46.6	35%	0.35	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-86.2	-8.1	170.8	-60	0	0	0	0	113	R428 T430 V431	R428-S433 WeakPolarHBondContact CD-O 3.31Å; R428-S433 PolarHBondContact NE-O 2.93Å; T430-S433 WeakPolarHBondContact O-CB 3.42Å; T430-S433 PolarHBondContact O-N 2.85Å; T430-S433 VanDerWaalsContact O-N 3.13Å; T430-S433 PolarHBondContact OG1-N 2.95Å; T430-S433 PolarHBondContact OG1-OG 3.08Å; V431-S433 PolarHBondContact O-N 2.94Å; V431-S433 VanDerWaalsContact O-N 3.11Å
434	T	98.1	Very high	96.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-83.1	140.4	179.5	70.5	0	0	0	0	110.6	L282 S417 W422 V431 C436 W437	L282-T434 WeakPolarHBondContact CA-O 3.36Å; L282-T434 PolarHBondContact N-O 3.11Å; S417-T434 VanDerWaalsContact OG-CB 3.3Å; S417-T434 WeakPolarHBondContact OG-CB 3.33Å; S417-T434 PolarHBondContact OG-OG1 3.27Å; W422-T434 HydrophobicContact CB-CG2 3.77Å; W422-T434 HydrophobicContact CD2-CG2 4.29Å; W422-T434 HydrophobicContact CE3-CG2 4.02Å; W422-T434 HydrophobicContact CG-CG2 4.23Å; V431-T434 VanDerWaalsContact O-CB 3.29Å; V431-T434 WeakPolarHBondContact O-CB 3.41Å; V431-T434 WeakPolarHBondContact O-CG2 3.3Å; V431-T434 PolarHBondContact O-N 3.44Å; V431-T434 PolarHBondContact O-OG1 3.34Å; T434-C436 VanDerWaalsContact C-N 3.33Å; T434-C436 PolarHBondContact O-N 3Å; T434-W437 WeakPolarHBondContact OG1-CB 3.39Å
435	P	98.3	Very high	96.7	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	19%	0.193	C	C	.	.	S	Bend	trans	-69.7	-30.2	-173	-18.3	31.9	0	0	0	113.6	E281 T324 V325 T328 K420	E281-P435 WeakPolarHBondContact CA-O 3.2Å; T324-P435 HydrophobicContact CG2-CB 4.41Å; T324-P435 HydrophobicContact CG2-CG 3.86Å; V325-P435 HydrophobicContact CB-CB 4.32Å; V325-P435 HydrophobicContact CG2-CB 3.84Å; T328-P435 HydrophobicContact CG2-CB 4.07Å; T328-P435 HydrophobicContact CG2-CG 4.36Å; K420-P435 HydrophobicContact CG-CG 3.99Å
436	C	98.7	Very high	97.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-146.2	117.1	-176.9	-59.5	0	0	0	0	109.3	Y279 T328 R329 I332 S417 F418 T434	Y279-C436 HydrophobicContact CE2-CB 4.05Å; Y279-C436 PolarHBondContact OH-SG 3.16Å; Y279-C436 VanDerWaalsContact OH-SG 3.35Å; T328-C436 HydrophobicContact CG2-CB 4.05Å; R329-C436 VanDerWaalsContact CG-SG 3.53Å; I332-C436 HydrophobicContact CD1-CB 4.21Å; S417-C436 PolarHBondContact OG-O 2.86Å; F418-C436 HydrophobicContact CB-CB 4.41Å; F418-C436 HydrophobicContact CD2-CB 4.35Å; F418-C436 PolarHBondContact N-O 3.38Å; T434-C436 VanDerWaalsContact C-N 3.33Å; T434-C436 PolarHBondContact O-N 3Å
437	W	98.8	Very high	97.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	161.6	177.4	62.6	-78.8	0	0	0	111.4	F206 Y279 Y280 L282 R415 M416 V431 T432 T434 E439	F206-W437 AromaticContact CE1-CH2 3.95Å; F206-W437 HydrophobicContact CE1-CH2 3.95Å; F206-W437 HydrophobicContact CE1-CZ2 4.28Å; F206-W437 AromaticContact CZ-CH2 3.71Å; F206-W437 HydrophobicContact CZ-CH2 3.71Å; F206-W437 HydrophobicContact CZ-CZ2 4.46Å; Y279-W437 VanDerWaalsContact CD2-O 3.24Å; Y279-W437 WeakPolarHBondContact CD2-O 3.24Å; Y280-W437 VanDerWaalsContact CB-CZ2 3.44Å; Y280-W437 HydrophobicContact CD1-CH2 4.06Å; Y280-W437 AromaticContact CD1-CZ2 3.76Å; Y280-W437 HydrophobicContact CD1-CZ2 3.76Å; Y280-W437 HydrophobicContact CD2-CD2 4.33Å; Y280-W437 HydrophobicContact CD2-CE3 4.12Å; Y280-W437 AromaticContact CD2-CH2 3.55Å; Y280-W437 HydrophobicContact CD2-CH2 3.55Å; Y280-W437 AromaticContact CD2-CZ2 3.8Å; Y280-W437 HydrophobicContact CD2-CZ2 3.8Å; Y280-W437 AromaticContact CD2-CZ3 3.75Å; Y280-W437 HydrophobicContact CD2-CZ3 3.75Å; Y280-W437 HydrophobicContact CE1-CH2 4.37Å; Y280-W437 HydrophobicContact CE1-CZ2 4.45Å; Y280-W437 AromaticContact CE2-CH2 3.88Å; Y280-W437 HydrophobicContact CE2-CH2 3.88Å; Y280-W437 HydrophobicContact CE2-CZ2 4.47Å; Y280-W437 HydrophobicContact CE2-CZ3 4.12Å; Y280-W437 HydrophobicContact CG-CD2 4.3Å; Y280-W437 AromaticContact CG-CE2 3.76Å; Y280-W437 AromaticContact CG-CH2 3.66Å; Y280-W437 HydrophobicContact CG-CH2 3.66Å; Y280-W437 AromaticContact CG-CZ2 3.41Å; Y280-W437 HydrophobicContact CG-CZ2 3.41Å; Y280-W437 VanDerWaalsContact CG-CZ2 3.41Å; Y280-W437 HydrophobicContact CG-CZ3 4.24Å; Y280-W437 PolarHBondContact N-O 2.82Å; Y280-W437 PolarHBondContact O-N 3.34Å; L282-W437 PolarHBondContact O-NE1 2.95Å; R415-W437 HydrophobicContact CG-CZ3 4.3Å; M416-W437 CarbonylContact O-C 3.59Å; M416-W437 WeakPolarHBondContact O-CA 3.13Å; M416-W437 VanDerWaalsContact O-CB 3.25Å; M416-W437 WeakPolarHBondContact O-CB 3.34Å; V431-W437 HydrophobicContact CG1-CD2 4.48Å; V431-W437 HydrophobicContact CG1-CE3 4.4Å; V431-W437 HydrophobicContact CG1-CH2 4.2Å; V431-W437 HydrophobicContact CG1-CZ2 4.26Å; V431-W437 HydrophobicContact CG1-CZ3 4.25Å; V431-W437 HydrophobicContact CG2-CB 4.1Å; V431-W437 HydrophobicContact CG2-CD2 3.57Å; V431-W437 HydrophobicContact CG2-CE3 3.67Å; V431-W437 HydrophobicContact CG2-CG 3.78Å; V431-W437 HydrophobicContact CG2-CZ3 4.32Å; T432-W437 HydrophobicContact CG2-CZ2 4.18Å; T434-W437 WeakPolarHBondContact OG1-CB 3.39Å; W437-E439 HydrophobicContact CZ3-CB 4.01Å
438	I	98.8	Very high	97	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	149.3	177.5	53.9	170.4	0	0	0	110.6	I277 A278 Y279 V299 V336 R415 M416 F418	I277-I438 HydrophobicContact CG2-CB 3.83Å; I277-I438 HydrophobicContact CG2-CD1 4.02Å; I277-I438 HydrophobicContact CG2-CG1 4.46Å; I277-I438 HydrophobicContact CG2-CG2 4.06Å; A278-I438 CarbonylContact O-C 3.53Å; A278-I438 WeakPolarHBondContact O-CA 3.48Å; Y279-I438 HydrophobicContact CD2-CG2 3.92Å; V299-I438 HydrophobicContact CB-CD1 4.47Å; V299-I438 HydrophobicContact CG1-CD1 4.41Å; V299-I438 HydrophobicContact CG1-CG2 4.34Å; V299-I438 HydrophobicContact CG2-CD1 4.14Å; V336-I438 HydrophobicContact CG1-CD1 4.33Å; R415-I438 WeakPolarHBondContact CA-O 3.5Å; M416-I438 HydrophobicContact CB-CD1 4.34Å; M416-I438 HydrophobicContact CB-CG1 3.88Å; M416-I438 PolarHBondContact N-O 3.08Å; M416-I438 PolarHBondContact O-N 3.18Å; F418-I438 HydrophobicContact CE2-CD1 4.44Å; F418-I438 HydrophobicContact CE2-CG1 4.18Å; F418-I438 HydrophobicContact CE2-CG2 4Å; F418-I438 HydrophobicContact CZ-CD1 4.2Å; F418-I438 HydrophobicContact CZ-CG1 4.42Å
439	E	98.7	Very high	96.9	Very high	17 Å²	17	21.9 Å²	21.9	8%	0.079	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123.5	170.1	-169.5	165.5	59.6	0	0	108.8	I277 A278 Y280 T413 R415 W437 H441	I277-E439 WeakPolarHBondContact CA-O 3.18Å; A278-E439 PolarHBondContact N-O 2.66Å; A278-E439 PolarHBondContact O-N 3.33Å; Y280-E439 HydrophobicContact CD2-CB 4.5Å; Y280-E439 HydrophobicContact CE2-CB 3.96Å; T413-E439 HydrophobicContact CG2-CG 3.55Å; R415-E439 HydrophobicContact CG-CG 4.31Å; R415-E439 IonicContact CZ-OE2 2.69Å; R415-E439 IonicContact NE-OE2 3.07Å; R415-E439 PolarHBondContact NE-OE2 2.95Å; R415-E439 IonicContact NH2-OE2 3.01Å; R415-E439 PolarHBondContact NH2-OE2 3.19Å; W437-E439 HydrophobicContact CZ3-CB 4.01Å; E439-H441 IonicContact OE1-NE2 3.55Å
440	L	98.2	Very high	96.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124	-179.7	-158.4	78.7	0	0	0	108.9	C275 I277 L338 I384 T413 I414 M416 L442	C275-L440 HydrophobicContact CB-CD1 4.26Å; C275-L440 HydrophobicContact CB-CG 4.18Å; I277-L440 HydrophobicContact CB-CD1 4.13Å; I277-L440 HydrophobicContact CD1-CD1 3.48Å; I277-L440 VanDerWaalsContact CD1-CD1 3.48Å; I277-L440 HydrophobicContact CG1-CD1 3.43Å; I277-L440 VanDerWaalsContact CG1-CD1 3.43Å; I277-L440 HydrophobicContact CG2-CD1 4.05Å; L338-L440 HydrophobicContact CD1-CD1 3.64Å; L338-L440 HydrophobicContact CD1-CD2 4.03Å; I384-L440 HydrophobicContact CD1-CD2 4.44Å; T413-L440 CarbonylContact C-O 3.55Å; T413-L440 VanDerWaalsContact CA-O 3.32Å; T413-L440 WeakPolarHBondContact CA-O 3.38Å; I414-L440 HydrophobicContact CB-CB 4.23Å; I414-L440 PolarHBondContact N-O 2.84Å; I414-L440 WeakPolarHBondContact O-CB 3.47Å; I414-L440 PolarHBondContact O-N 2.85Å; M416-L440 HydrophobicContact CE-CB 4.39Å; M416-L440 HydrophobicContact CE-CD2 4Å; L440-L442 HydrophobicContact CD2-CD2 3.98Å; L440-L442 HydrophobicContact CG-CD2 4.49Å
441	H	98.1	Very high	96.5	Very high	61 Å²	61	23.1 Å²	23.1	28%	0.282	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.9	170.1	-67.4	169.8	0	0	0	109.8	C275 S276 T413 E439 N443 L446	C275-H441 CarbonylContact C-O 3.46Å; C275-H441 WeakPolarHBondContact CA-O 3.36Å; C275-H441 WeakPolarHBondContact CB-O 2.88Å; S276-H441 PolarHBondContact N-O 3.22Å; S276-H441 PolarHBondContact O-N 3.36Å; T413-H441 PolarHBondContact OG1-CD2 3.3Å; T413-H441 PolarHBondContact OG1-NE2 3.43Å; E439-H441 IonicContact OE1-NE2 3.55Å; H441-N443 PolarHBondContact O-N 3.35Å; H441-L446 HydrophobicContact CB-CD1 3.9Å
442	L	97.7	Very high	96.3	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	104.1	177.4	-59.1	-179.3	0	0	0	109.6	W274 C275 V345 F385 C412 I414 L440 G444 P445 L446	W274-L442 HydrophobicContact CE3-CD2 4.18Å; W274-L442 HydrophobicContact CZ3-CD2 3.93Å; C275-L442 HydrophobicContact CB-CD2 4.11Å; V345-L442 HydrophobicContact CG2-CD1 4.42Å; V345-L442 HydrophobicContact CG2-CD2 4.07Å; F385-L442 HydrophobicContact CB-CD1 3.75Å; F385-L442 HydrophobicContact CD1-CD1 3.53Å; F385-L442 HydrophobicContact CD2-CD1 3.32Å; F385-L442 HydrophobicContact CE1-CD1 3.88Å; F385-L442 HydrophobicContact CE2-CD1 3.68Å; F385-L442 HydrophobicContact CG-CD1 3.23Å; F385-L442 HydrophobicContact CZ-CD1 3.94Å; C412-L442 PolarHBondContact O-N 2.67Å; I414-L442 HydrophobicContact CD1-CD1 4.1Å; L440-L442 HydrophobicContact CD2-CD2 3.98Å; L440-L442 HydrophobicContact CG-CD2 4.49Å; L442-G444 VanDerWaalsContact C-N 3.34Å; L442-G444 PolarHBondContact O-N 3.28Å; L442-P445 HydrophobicContact CB-CB 4.38Å; L442-P445 HydrophobicContact CB-CG 3.88Å; L442-P445 WeakPolarHBondContact O-CD 3.3Å; L442-L446 WeakPolarHBondContact O-CB 3.18Å; L442-L446 WeakPolarHBondContact O-CG 3.24Å; L442-L446 PolarHBondContact O-N 3.47Å; L442-L446 VanDerWaalsContact O-N 3.08Å
443	N	96.8	Very high	95.9	Very high	38 Å²	38	23.2 Å²	23.2	20%	0.203	12%	0.12	C	C	.	.	H	α-helix	trans	-68	-33.5	-168.7	-66.2	-24	0	0	0	112.7	P271 F273 W274 H441 Q447	P271-N443 HydrophobicContact CB-CB 4.26Å; P271-N443 HydrophobicContact CG-CB 3.8Å; F273-N443 VanDerWaalsContact O-CB 3.27Å; F273-N443 WeakPolarHBondContact O-CB 3.33Å; F273-N443 PolarHBondContact O-ND2 3.46Å; W274-N443 PolarHBondContact O-N 2.77Å; H441-N443 PolarHBondContact O-N 3.35Å; N443-Q447 VanDerWaalsContact O-CB 3.28Å; N443-Q447 WeakPolarHBondContact O-CB 3.47Å; N443-Q447 PolarHBondContact O-N 3.49Å
444	G	94.5	Very high	95.5	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-64.7	-57.8	179	0	0	0	0	0	111.8	Y268 L442 L446 Q447 W448	Y268-G444 VanDerWaalsContact CE2-C 3.49Å; Y268-G444 WeakPolarHBondContact OH-CA 3.47Å; L442-G444 VanDerWaalsContact C-N 3.34Å; L442-G444 PolarHBondContact O-N 3.28Å; G444-L446 VanDerWaalsContact C-N 3.31Å; G444-L446 PolarHBondContact O-N 2.88Å; G444-Q447 PolarHBondContact O-N 3.38Å; G444-W448 PolarHBondContact O-N 2.94Å
445	P	95.6	Very high	95	Very high	4 Å²	4	29 Å²	29	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-51.4	-44.2	170.9	-31.8	37.9	0	0	0	114	F385 F390 C412 L442 W448 L449	F385-P445 HydrophobicContact CE1-CB 4.36Å; F385-P445 HydrophobicContact CE1-CG 3.52Å; F385-P445 HydrophobicContact CZ-CB 3.99Å; F385-P445 HydrophobicContact CZ-CG 3.64Å; F390-P445 HydrophobicContact CD1-CB 3.88Å; F390-P445 HydrophobicContact CD1-CG 4.47Å; F390-P445 HydrophobicContact CE1-CB 3.66Å; F390-P445 HydrophobicContact CG-CB 4.44Å; F390-P445 HydrophobicContact CZ-CB 4.03Å; C412-P445 HydrophobicContact CB-CB 4.32Å; C412-P445 VanDerWaalsContact SG-CB 3.59Å; L442-P445 HydrophobicContact CB-CB 4.38Å; L442-P445 HydrophobicContact CB-CG 3.88Å; L442-P445 WeakPolarHBondContact O-CD 3.3Å; P445-W448 PolarHBondContact O-N 3.1Å; P445-L449 WeakPolarHBondContact O-CB 3.12Å; P445-L449 PolarHBondContact O-N 3.26Å
446	L	96.1	Very high	94.3	Very high	46 Å²	46	29.2 Å²	29.2	24%	0.241	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-45.9	176.5	-76.2	171.1	0	0	0	112.6	T409 C412 H441 L442 G444 W448 L449 D450	T409-L446 HydrophobicContact CG2-CD2 4.09Å; C412-L446 HydrophobicContact CB-CD1 4.44Å; C412-L446 HydrophobicContact CB-CD2 3.53Å; C412-L446 HydrophobicContact CB-CG 3.58Å; H441-L446 HydrophobicContact CB-CD1 3.9Å; L442-L446 WeakPolarHBondContact O-CB 3.18Å; L442-L446 WeakPolarHBondContact O-CG 3.24Å; L442-L446 PolarHBondContact O-N 3.47Å; L442-L446 VanDerWaalsContact O-N 3.08Å; G444-L446 VanDerWaalsContact C-N 3.31Å; G444-L446 PolarHBondContact O-N 2.88Å; L446-W448 VanDerWaalsContact C-N 3.29Å; L446-W448 PolarHBondContact O-N 2.98Å; L446-L449 WeakPolarHBondContact O-CB 3.4Å; L446-L449 PolarHBondContact O-N 2.85Å; L446-D450 WeakPolarHBondContact O-CB 3.34Å; L446-D450 PolarHBondContact O-N 2.98Å
447	Q	94	Very high	93.5	Very high	74 Å²	74	31.8 Å²	31.8	35%	0.346	18%	0.175	S	C	.	.	H	α-helix	trans	-63.3	-38.3	178.2	-177.4	-179.5	58.6	0	0	111.4	S269 N443 G444 K451	S269-Q447 PolarHBondContact O-OE1 2.99Å; S269-Q447 VanDerWaalsContact O-OE1 3.1Å; S269-Q447 PolarHBondContact OG-OE1 3.42Å; N443-Q447 VanDerWaalsContact O-CB 3.28Å; N443-Q447 WeakPolarHBondContact O-CB 3.47Å; N443-Q447 PolarHBondContact O-N 3.49Å; G444-Q447 PolarHBondContact O-N 3.38Å; Q447-K451 WeakPolarHBondContact O-CG 3.35Å; Q447-K451 PolarHBondContact O-N 3.31Å; Q447-K451 VanDerWaalsContact O-N 3.15Å
448	W	93.6	Very high	92.8	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.011	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-42.3	176.9	-162.6	6.4	0	0	0	111.6	L175 P176 V178 V266 Y268 F390 A391 L394 G444 P445 L446 K451 V452	L175-W448 HydrophobicContact CB-CH2 3.73Å; L175-W448 HydrophobicContact CB-CZ3 4.19Å; L175-W448 HydrophobicContact CD1-CE3 4.46Å; L175-W448 HydrophobicContact CD1-CH2 4.09Å; L175-W448 HydrophobicContact CD1-CZ3 3.65Å; L175-W448 HydrophobicContact CG-CH2 4.44Å; L175-W448 HydrophobicContact CG-CZ3 4.43Å; P176-W448 WeakPolarHBondContact O-CZ2 3.35Å; V178-W448 HydrophobicContact CG2-CH2 4.4Å; V178-W448 HydrophobicContact CG2-CZ2 3.62Å; V266-W448 PolarHBondContact O-NE1 3.14Å; V266-W448 VanDerWaalsContact O-NE1 3.15Å; Y268-W448 HydrophobicContact CD2-CB 3.91Å; Y268-W448 AromaticContact CD2-CD2 3.69Å; Y268-W448 HydrophobicContact CD2-CD2 3.69Å; Y268-W448 AromaticContact CD2-CE3 3.38Å; Y268-W448 HydrophobicContact CD2-CE3 3.38Å; Y268-W448 AromaticContact CD2-CG 3.98Å; Y268-W448 HydrophobicContact CD2-CG 3.98Å; Y268-W448 HydrophobicContact CD2-CZ3 4.02Å; Y268-W448 HydrophobicContact CE2-CB 4.49Å; Y268-W448 HydrophobicContact CE2-CE3 4.19Å; Y268-W448 HydrophobicContact CG-CD2 4.32Å; Y268-W448 HydrophobicContact CG-CE3 4.15Å; Y268-W448 HydrophobicContact CG-CZ3 4.46Å; F390-W448 HydrophobicContact CD1-CE3 4.42Å; A391-W448 HydrophobicContact CB-CH2 3.39Å; A391-W448 HydrophobicContact CB-CZ3 3.43Å; A391-W448 VanDerWaalsContact CB-CZ3 3.43Å; L394-W448 HydrophobicContact CD2-CD2 3.92Å; L394-W448 HydrophobicContact CD2-CE3 4.28Å; L394-W448 HydrophobicContact CD2-CG 4Å; G444-W448 PolarHBondContact O-N 2.94Å; P445-W448 PolarHBondContact O-N 3.1Å; L446-W448 VanDerWaalsContact C-N 3.29Å; L446-W448 PolarHBondContact O-N 2.98Å; W448-K451 PolarHBondContact O-N 2.87Å; W448-V452 WeakPolarHBondContact O-CG2 3.37Å; W448-V452 PolarHBondContact O-N 3.44Å; W448-V452 VanDerWaalsContact O-N 3.15Å
449	L	94.3	Very high	92.1	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-45.9	175.7	-173.2	67.5	0	0	0	112	F390 L394 V405 L408 T409 P445 L446 K451 V452 L453	F390-L449 HydrophobicContact CZ-CB 4.5Å; L394-L449 HydrophobicContact CD1-CD1 3.58Å; V405-L449 HydrophobicContact CG1-CD1 3.49Å; V405-L449 VanDerWaalsContact CG1-CD1 3.49Å; V405-L449 WeakPolarHBondContact O-CD1 3.46Å; L408-L449 HydrophobicContact CB-CD1 3.91Å; L408-L449 HydrophobicContact CB-CD2 4.31Å; L408-L449 HydrophobicContact CD1-CD1 4.41Å; T409-L449 VanDerWaalsContact N-CD2 3.31Å; T409-L449 WeakPolarHBondContact OG1-CD2 3.45Å; P445-L449 WeakPolarHBondContact O-CB 3.12Å; P445-L449 PolarHBondContact O-N 3.26Å; L446-L449 WeakPolarHBondContact O-CB 3.4Å; L446-L449 PolarHBondContact O-N 2.85Å; L449-K451 PolarHBondContact O-N 3.12Å; L449-V452 PolarHBondContact O-N 2.98Å; L449-V452 VanDerWaalsContact O-N 3.09Å; L449-L453 HydrophobicContact CD2-CD1 4.48Å; L449-L453 HydrophobicContact CG-CD1 4.02Å; L449-L453 HydrophobicContact CG-CG 4.48Å; L449-L453 WeakPolarHBondContact O-CG 3.19Å; L449-L453 PolarHBondContact O-N 2.74Å
450	D	92.6	Very high	91.3	Very high	97 Å²	97	44.3 Å²	44.3	52%	0.519	26%	0.264	S	S	.	.	H	α-helix	trans	-58.2	-45.4	177.4	-179.5	70.7	0	0	0	112	L446 V452 L453 T454	L446-D450 WeakPolarHBondContact O-CB 3.34Å; L446-D450 PolarHBondContact O-N 2.98Å; D450-V452 VanDerWaalsContact C-N 3.27Å; D450-V452 PolarHBondContact O-N 2.91Å; D450-L453 PolarHBondContact O-N 3.13Å; D450-T454 VanDerWaalsContact O-CG2 3.32Å; D450-T454 WeakPolarHBondContact O-CG2 3.24Å; D450-T454 PolarHBondContact O-N 2.85Å; D450-T454 PolarHBondContact O-OG1 3.03Å
451	K	91.8	Very high	90.7	Very high	64 Å²	64	50 Å²	50	28%	0.278	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-30.4	174.9	-69.8	178.2	-175	176.2	0	113.6	V266 S269 Q447 W448 L449 T454 Q455	V266-K451 HydrophobicContact CG1-CB 3.46Å; V266-K451 VanDerWaalsContact CG1-CB 3.46Å; V266-K451 HydrophobicContact CG1-CD 4.26Å; S269-K451 PolarHBondContact OG-NZ 3.46Å; Q447-K451 WeakPolarHBondContact O-CG 3.35Å; Q447-K451 PolarHBondContact O-N 3.31Å; Q447-K451 VanDerWaalsContact O-N 3.15Å; W448-K451 PolarHBondContact O-N 2.87Å; L449-K451 PolarHBondContact O-N 3.12Å; K451-T454 VanDerWaalsContact C-OG1 3.31Å; K451-T454 WeakPolarHBondContact CA-OG1 3.15Å; K451-T454 PolarHBondContact O-OG1 3Å; K451-Q455 WeakPolarHBondContact O-CG 3.26Å
452	V	91.8	Very high	90.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-76.1	-46.8	175.1	170.8	0	0	0	0	110.2	V178 V180 V266 L394 V398 V405 W448 L449 D450 T454 Q455 M456	V178-V452 HydrophobicContact CB-CG2 4.14Å; V178-V452 HydrophobicContact CG1-CG2 3.94Å; V180-V452 HydrophobicContact CG2-CB 4.44Å; V180-V452 HydrophobicContact CG2-CG1 3.9Å; V180-V452 HydrophobicContact CG2-CG2 4.32Å; V266-V452 HydrophobicContact CB-CG2 4.18Å; V266-V452 HydrophobicContact CG1-CG2 4Å; V266-V452 HydrophobicContact CG2-CG2 4.5Å; L394-V452 HydrophobicContact CD1-CB 4.38Å; L394-V452 HydrophobicContact CD1-CG1 4.2Å; L394-V452 HydrophobicContact CD1-CG2 4.35Å; L394-V452 HydrophobicContact CD2-CG2 4.07Å; L394-V452 HydrophobicContact CG-CG2 4.36Å; V398-V452 HydrophobicContact CG2-CG1 3.51Å; V405-V452 HydrophobicContact CG1-CG1 3.95Å; W448-V452 WeakPolarHBondContact O-CG2 3.37Å; W448-V452 PolarHBondContact O-N 3.44Å; W448-V452 VanDerWaalsContact O-N 3.15Å; L449-V452 PolarHBondContact O-N 2.98Å; L449-V452 VanDerWaalsContact O-N 3.09Å; D450-V452 VanDerWaalsContact C-N 3.27Å; D450-V452 PolarHBondContact O-N 2.91Å; V452-T454 VanDerWaalsContact C-N 3.31Å; V452-T454 PolarHBondContact O-N 2.93Å; V452-Q455 PolarHBondContact O-N 3.2Å; V452-M456 HydrophobicContact CG1-CG 4.2Å; V452-M456 WeakPolarHBondContact O-CG 3.11Å; V452-M456 PolarHBondContact O-N 3.13Å
453	L	91.1	Very high	89.6	Confident	24 Å²	24	64 Å²	64	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-60.2	-39.8	179.5	-76.4	170.2	0	0	0	112.4	F402 V405 Y406 L449 D450 Q455 M456	F402-L453 HydrophobicContact CD2-CD2 4.08Å; F402-L453 HydrophobicContact CE1-CD2 4.48Å; F402-L453 HydrophobicContact CE2-CD2 3.79Å; F402-L453 HydrophobicContact CZ-CD2 4.01Å; V405-L453 HydrophobicContact CB-CD2 3.94Å; V405-L453 HydrophobicContact CG1-CD2 3.58Å; V405-L453 HydrophobicContact CG1-CG 3.81Å; Y406-L453 HydrophobicContact CD2-CD1 4.19Å; L449-L453 HydrophobicContact CD2-CD1 4.48Å; L449-L453 HydrophobicContact CG-CD1 4.02Å; L449-L453 HydrophobicContact CG-CG 4.48Å; L449-L453 WeakPolarHBondContact O-CG 3.19Å; L449-L453 PolarHBondContact O-N 2.74Å; D450-L453 PolarHBondContact O-N 3.13Å; L453-Q455 PolarHBondContact O-N 3Å; L453-Q455 VanDerWaalsContact O-N 3.14Å; L453-M456 PolarHBondContact O-N 3.19Å; L453-M456 VanDerWaalsContact O-N 3.1Å
454	T	88.7	Confident	89.2	Confident	97 Å²	97	65.3 Å²	65.3	60%	0.595	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20	175.6	47	0	0	0	0	113.7	D450 K451 V452	D450-T454 VanDerWaalsContact O-CG2 3.32Å; D450-T454 WeakPolarHBondContact O-CG2 3.24Å; D450-T454 PolarHBondContact O-N 2.85Å; D450-T454 PolarHBondContact O-OG1 3.03Å; K451-T454 VanDerWaalsContact C-OG1 3.31Å; K451-T454 WeakPolarHBondContact CA-OG1 3.15Å; K451-T454 PolarHBondContact O-OG1 3Å; V452-T454 VanDerWaalsContact C-N 3.31Å; V452-T454 PolarHBondContact O-N 2.93Å
455	Q	86.8	Confident	89	Confident	76 Å²	76	71.2 Å²	71.2	36%	0.355	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-16.3	176.8	-61.2	-71.5	-20.3	0	0	113.3	V180 V266 K451 V452 L453	V180-Q455 HydrophobicContact CB-CB 4.09Å; V180-Q455 HydrophobicContact CG1-CB 3.72Å; V180-Q455 HydrophobicContact CG2-CB 4.34Å; V266-Q455 HydrophobicContact CG2-CG 4.17Å; K451-Q455 WeakPolarHBondContact O-CG 3.26Å; V452-Q455 PolarHBondContact O-N 3.2Å; L453-Q455 PolarHBondContact O-N 3Å; L453-Q455 VanDerWaalsContact O-N 3.14Å
456	M	83.8	Confident	88.6	Confident	5 Å²	5	79.4 Å²	79.4	3%	0.025	46%	0.459	C	S	.	.	S	Bend	trans	-84.8	-2.7	-173.5	-75.8	-74.6	-68.8	0	0	114.5	V180 H183 V398 G401 F402 V405 V452 L453	V180-M456 HydrophobicContact CG1-CG 3.89Å; V180-M456 HydrophobicContact CG1-SD 3.63Å; H183-M456 PolarHBondContact CD2-O 2.95Å; V398-M456 HydrophobicContact CG1-SD 3.92Å; V398-M456 WeakPolarHBondContact O-CE 3.36Å; G401-M456 VanDerWaalsContact C-CE 3.45Å; F402-M456 HydrophobicContact CD2-CB 4Å; V405-M456 HydrophobicContact CG2-CE 4.25Å; V452-M456 HydrophobicContact CG1-CG 4.2Å; V452-M456 WeakPolarHBondContact O-CG 3.11Å; V452-M456 PolarHBondContact O-N 3.13Å; L453-M456 PolarHBondContact O-N 3.19Å; L453-M456 VanDerWaalsContact O-N 3.1Å
457	G	82.7	Confident	87.4	Confident	53 Å²	53	84.5 Å²	84.5	55%	0.546	50%	0.498	S	S	.	.			trans	77.9	-141.4	-175.7	0	0	0	0	0	112.9	F402	F402-G457 WeakPolarHBondContact CD2-O 3.39Å; F402-G457 VanDerWaalsContact CE2-O 3.23Å; F402-G457 WeakPolarHBondContact CE2-O 3.5Å
458	S	82.6	Confident	87.1	Confident	96 Å²	96	85 Å²	85	67%	0.671	51%	0.506	S	S	*	.			trans	-121.7	162.6	-176.6	64.7	0	0	0	0	112
459	P	84	Confident	86.8	Confident	62 Å²	62	89.3 Å²	89.3	40%	0.403	53%	0.532	S	S	.	.			trans	-52.2	147.8	169.6	-24.3	32.6	0	0	0	112.4	F402 V461	F402-P459 HydrophobicContact CD1-CB 4.47Å; F402-P459 HydrophobicContact CD1-CG 3.68Å; F402-P459 HydrophobicContact CE1-CG 3.65Å; F402-P459 HydrophobicContact CZ-CG 4.45Å; P459-V461 VanDerWaalsContact C-N 3.34Å
460	S	82.8	Confident	86.4	Confident	123 Å²	123	94.1 Å²	94.1	86%	0.86	56%	0.561	S	S	*	*	S	Bend	trans	-67.8	-34.7	177.4	54.2	0	0	0	0	112.4
461	V	84.9	Confident	86	Confident	118 Å²	118	93.9 Å²	93.9	72%	0.715	56%	0.563	S	S	*	*	S	Bend	trans	-85.4	118	176.9	-176.2	0	0	0	0	109.2	P459	P459-V461 VanDerWaalsContact C-N 3.34Å
462	R	86.9	Confident	85.6	Confident	236 Å²	236	95.8 Å²	95.8	89%	0.891	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-70.4	137.4	173.1	-65.2	-174.7	-177.1	178.4	1.1	109.9
463	C	87	Confident	85.2	Confident	123 Å²	123	102.2 Å²	102.2	83%	0.831	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-77.3	137.9	172.7	-167.7	0	0	0	0	110.3
464	S	88.1	Confident	84.8	Confident	66 Å²	66	107.8 Å²	107.8	46%	0.462	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-75.5	141	172.5	173.9	0	0	0	0	109.9	M466 S467	S464-M466 PolarHBondContact O-N 3.44Å; S464-M466 PolarHBondContact OG-N 3.49Å; S464-M466 VanDerWaalsContact OG-N 3.07Å; S464-S467 PolarHBondContact OG-N 3.36Å
465	S	91	Very high	84.5	Confident	126 Å²	126	108.6 Å²	108.6	88%	0.881	66%	0.659	S	S	*	*	S	Bend	trans	-83.3	6.1	171.1	62.4	0	0	0	0	113.3
466	M	85.7	Confident	84.3	Confident	175 Å²	175	111.3 Å²	111.3	86%	0.862	69%	0.685	S	S	*	*			trans	-130.8	-9.4	-173.9	-57.8	-174.1	78.8	0	0	114.8	S464	S464-M466 PolarHBondContact O-N 3.44Å; S464-M466 PolarHBondContact OG-N 3.49Å; S464-M466 VanDerWaalsContact OG-N 3.07Å
467	S	72.4	Confident	84.4	Confident	153 Å²	153	121 Å²	121	100%	1.07	75%	0.745	S	S	*	*			trans	-78.8	0	-174.5	57.4	0	0	0	0	113.5	S464	S464-S467 PolarHBondContact OG-N 3.36Å

Retrieved 467 of 467 residues in 282.5 ms (Link to these results)

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