A0A087YIU8_POEFO Loading...

EEF1A lysine methyltransferase 2

Protein-lysine methyltransferase that selectively catalyzes the trimethylation of EEF1A at 'Lys-318'.

AlphaFold DB , UniProt , Accession A0A087YIU8, Species POEFO (Poecilia formosa, Amazon molly), Gene EEF1AKMT2, Length 237 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	32.1	Very low	240 Å²	240	149.4 Å²	149.4	100%	1.182	84%	0.842	S	S	*	*				0	94.6	0	-71.1	176.8	173.4	0	0	105.2
2	A	31.1	Very low	32	Very low	98 Å²	98	142.6 Å²	142.6	81%	0.81	83%	0.83	S	S	*	*				71.3	132.2	101.7	0	0	0	0	0	109.9
3	D	29.9	Very low	32.2	Very low	158 Å²	158	142.9 Å²	142.9	85%	0.845	83%	0.826	S	S	*	*			cis	-162.5	164.4	26.5	-151.6	-15.6	0	0	0	110.7
4	A	33.3	Very low	33	Very low	79 Å²	79	142.4 Å²	142.4	65%	0.653	83%	0.833	S	S	*	*			trans	-60.5	147.4	179.1	0	0	0	0	0	113.6	Q6	A4-Q6 PolarHBondContact O-N 3.35Å
5	R	31.7	Very low	33.4	Very low	252 Å²	252	138.5 Å²	138.5	95%	0.951	82%	0.816	S	S	*	*			trans	-73.9	113.4	164.2	-67.7	179.5	-179.1	-178.7	-0.7	108.1
6	Q	32.8	Very low	34	Very low	185 Å²	185	139.9 Å²	139.9	86%	0.864	82%	0.819	S	S	*	*			trans	-80.5	121.6	163.1	-84.8	176.8	-10.3	0	0	108.8	A4 S8	A4-Q6 PolarHBondContact O-N 3.35Å; Q6-S8 PolarHBondContact O-N 3.37Å
7	D	31.3	Very low	34.6	Very low	146 Å²	146	138.5 Å²	138.5	78%	0.781	82%	0.819	S	S	*	*			trans	-75.3	107.2	160.8	-86.3	-41.6	0	0	0	108.7
8	S	30.7	Very low	34.9	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	81%	0.814	S	S	*	*			trans	-108.3	90.4	162.2	61.3	0	0	0	0	108.1	Q6 G10	Q6-S8 PolarHBondContact O-N 3.37Å; S8-G10 PolarHBondContact O-N 3.49Å; S8-G10 VanDerWaalsContact O-N 3.16Å
9	H	36	Very low	35.3	Very low	177 Å²	177	142.1 Å²	142.1	82%	0.819	82%	0.817	S	S	*	*			trans	-78.7	99.4	165.8	-81.4	58.6	0	0	0	108
10	G	30.2	Very low	35.8	Very low	69 Å²	69	139.9 Å²	139.9	71%	0.711	80%	0.803	S	S	*	*			trans	-62.5	147.3	-178.7	0	0	0	0	0	113.3	S8 G12	S8-G10 PolarHBondContact O-N 3.49Å; S8-G10 VanDerWaalsContact O-N 3.16Å; G10-G12 PolarHBondContact O-N 3.36Å
11	C	32.2	Very low	36.4	Very low	131 Å²	131	140.2 Å²	140.2	89%	0.885	80%	0.795	S	S	*	*			trans	-41.2	118.8	166.1	-157.9	0	0	0	0	111.3	N13	C11-N13 PolarHBondContact O-N 2.81Å
12	G	30.4	Very low	37.3	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	76%	0.757	S	S	*	*			trans	-70.3	108.3	171.2	0	0	0	0	0	109.6	G10 C14	G10-G12 PolarHBondContact O-N 3.36Å; G12-C14 PolarHBondContact O-N 3.16Å
13	N	34.2	Very low	38.3	Very low	147 Å²	147	132.5 Å²	132.5	79%	0.786	74%	0.744	S	S	*	*			trans	-60	110.7	175.4	-141.5	30.8	0	0	0	109.8	C11 S15	C11-N13 PolarHBondContact O-N 2.81Å; N13-S15 PolarHBondContact O-N 3.08Å
14	C	43.9	Very low	39.6	Very low	135 Å²	135	125.9 Å²	125.9	91%	0.912	71%	0.709	S	S	*	*			trans	-78.5	99.1	164.5	-74.3	0	0	0	0	108.3	G12	G12-C14 PolarHBondContact O-N 3.16Å
15	S	39.8	Very low	40.9	Very low	84 Å²	84	128.7 Å²	128.7	59%	0.587	71%	0.713	S	S	*	*			trans	-142.7	110.2	164.6	62.1	0	0	0	0	111.2	N13	N13-S15 PolarHBondContact O-N 3.08Å
16	N	42.7	Very low	42.5	Very low	161 Å²	161	118.6 Å²	118.6	86%	0.861	68%	0.678	S	S	*	*	S	Bend	trans	50.7	100.4	151.4	-70.1	-3.1	0	0	0	119
17	S	43.1	Very low	44.8	Very low	117 Å²	117	111.7 Å²	111.7	82%	0.818	65%	0.645	S	S	*	*				170.3	81.2	112.8	61.4	0	0	0	0	110.5
18	E	40.1	Very low	47.2	Very low	155 Å²	155	113.3 Å²	113.3	72%	0.724	65%	0.648	S	S	*	*			trans	-132.2	100.3	151.9	-71.5	-158	176.3	0	0	105	D20 K21	E18-D20 PolarHBondContact O-N 3.05Å; E18-K21 IonicContact OE1-NZ 2.82Å; E18-K21 IonicContact OE2-NZ 2.81Å; E18-K21 PolarHBondContact OE2-NZ 3.3Å
19	E	43.3	Very low	49.9	Very low	189 Å²	189	112.5 Å²	112.5	88%	0.883	64%	0.639	S	S	*	*			trans	-54.2	132.9	165.5	-70.9	172.4	156.2	0	0	108	K21	E19-K21 PolarHBondContact O-N 3.38Å
20	D	45.8	Very low	52.5	Low	99 Å²	99	106 Å²	106	53%	0.529	61%	0.613	S	S	.	*			trans	-13.2	107.7	172.4	-58.2	-33.1	0	0	0	112.4	E18 Y22 K167	E18-D20 PolarHBondContact O-N 3.05Å; D20-Y22 PolarHBondContact O-N 2.98Å; D20-K167 IonicContact OD2-NZ 2.9Å; D20-K167 PolarHBondContact OD2-NZ 2.96Å
21	K	48.5	Very low	55.4	Low	146 Å²	146	109.3 Å²	109.3	64%	0.635	61%	0.608	S	S	*	*	S	Bend	trans	-70.7	-6.8	-171.6	-133.2	171.5	-167.6	140.4	0	112.5	E18 E19 E201	E18-K21 IonicContact OE1-NZ 2.82Å; E18-K21 IonicContact OE2-NZ 2.81Å; E18-K21 PolarHBondContact OE2-NZ 3.3Å; E19-K21 PolarHBondContact O-N 3.38Å; K21-E201 PolarHBondContact N-OE1 2.91Å
22	Y	51.9	Low	58.2	Low	99 Å²	99	105.2 Å²	105.2	39%	0.388	58%	0.577	S	S	.	*	S	Bend	trans	-125	129.5	172.4	-62.4	-90.2	0	0	0	109.3	D20 D24 Q198 E201	D20-Y22 PolarHBondContact O-N 2.98Å; Y22-D24 PolarHBondContact O-N 2.76Å; Y22-Q198 HydrophobicContact CD1-CG 3.95Å; Y22-Q198 HydrophobicContact CE1-CG 4.14Å; Y22-Q198 HydrophobicContact CG-CG 4.32Å; Y22-E201 VanDerWaalsContact CD2-CD 3.49Å; Y22-E201 WeakPolarHBondContact CD2-OE2 3.33Å; Y22-E201 WeakPolarHBondContact CE2-OE2 3.32Å
23	S	53.1	Low	61.1	Low	77 Å²	77	102.4 Å²	102.4	54%	0.538	55%	0.548	S	S	.	.			trans	-66.5	132.2	-177.8	57	0	0	0	0	110.5	D25 D26	S23-D25 PolarHBondContact O-N 3.36Å; S23-D26 PolarHBondContact O-N 3.16Å; S23-D26 VanDerWaalsContact O-N 3.16Å
24	D	57.4	Low	63.9	Low	19 Å²	19	96.9 Å²	96.9	10%	0.102	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-4.9	175.9	-90.7	-50.5	0	0	0	115.5	Y22 D26 K167 K170 R202	Y22-D24 PolarHBondContact O-N 2.76Å; D24-D26 VanDerWaalsContact C-N 3.27Å; D24-D26 PolarHBondContact O-N 2.73Å; D24-K167 HydrophobicContact CB-CB 4.12Å; D24-K167 HydrophobicContact CB-CD 3.98Å; D24-K167 HydrophobicContact CB-CG 4.09Å; D24-K167 WeakPolarHBondContact OD2-CD 3.22Å; D24-K167 WeakPolarHBondContact OD2-CE 3.42Å; D24-K167 VanDerWaalsContact OD2-CG 3.24Å; D24-K167 WeakPolarHBondContact OD2-CG 3.34Å; D24-K167 IonicContact OD2-NZ 2.75Å; D24-K167 PolarHBondContact OD2-NZ 3.35Å; D24-K170 PolarHBondContact O-NZ 3.44Å; D24-K170 WeakPolarHBondContact OD1-CE 3.44Å; D24-K170 IonicContact OD1-NZ 3.48Å; D24-K170 PolarHBondContact OD1-NZ 2.99Å; D24-R202 IonicContact OD1-CZ 2.84Å; D24-R202 IonicContact OD1-NH1 2.74Å; D24-R202 IonicContact OD1-NH2 3.89Å; D24-R202 PolarHBondContact OD1-NH2 2.89Å
25	D	60.3	Low	66.2	Low	139 Å²	139	94.9 Å²	94.9	74%	0.743	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	30.8	170.5	-67.9	-30.1	0	0	0	112.9	S23 F27	S23-D25 PolarHBondContact O-N 3.36Å; D25-F27 PolarHBondContact O-N 3.4Å
26	D	65.6	Low	68.9	Low	40 Å²	40	96.9 Å²	96.9	21%	0.214	50%	0.496	C	S	.	.			trans	-59.6	-20.3	-172.5	-77.1	-41.8	0	0	0	114.8	S23 D24	S23-D26 PolarHBondContact O-N 3.16Å; S23-D26 VanDerWaalsContact O-N 3.16Å; D24-D26 VanDerWaalsContact C-N 3.27Å; D24-D26 PolarHBondContact O-N 2.73Å
27	F	79.6	Confident	71.4	Confident	39 Å²	39	92 Å²	92	17%	0.171	47%	0.466	C	S	.	.	S	Bend	trans	-137.4	138.8	-174.8	-51.7	-69.1	0	0	0	113.3	D25 L161 N193 W194	D25-F27 PolarHBondContact O-N 3.4Å; F27-L161 HydrophobicContact CB-CD2 3.93Å; F27-N193 HydrophobicContact CD1-CB 3.97Å; F27-N193 HydrophobicContact CE1-CB 3.6Å; F27-N193 WeakPolarHBondContact CE1-O 3.39Å; F27-N193 HydrophobicContact CE2-CB 4.3Å; F27-N193 HydrophobicContact CG-CB 4.48Å; F27-N193 HydrophobicContact CZ-CB 3.78Å; F27-N193 WeakPolarHBondContact CZ-O 3.3Å; F27-W194 HydrophobicContact CD2-CZ2 4.41Å; F27-W194 AromaticContact CE2-CD2 3.99Å; F27-W194 HydrophobicContact CE2-CD2 3.99Å; F27-W194 AromaticContact CE2-CE2 3.45Å; F27-W194 VanDerWaalsContact CE2-CE2 3.45Å; F27-W194 HydrophobicContact CE2-CG 4.37Å; F27-W194 HydrophobicContact CE2-CH2 4.24Å; F27-W194 AromaticContact CE2-CZ2 3.61Å; F27-W194 HydrophobicContact CE2-CZ2 3.61Å; F27-W194 AromaticContact CE2-NE1 3.59Å; F27-W194 HydrophobicContact CZ-CD2 4.15Å; F27-W194 HydrophobicContact CZ-CG 4.23Å
28	E	82.8	Confident	73.9	Confident	180 Å²	180	87.4 Å²	87.4	84%	0.841	43%	0.43	S	S	*	.			trans	-64.9	137.4	168	-66.8	-174.8	173.8	0	0	110.1	L161	E28-L161 WeakPolarHBondContact O-CD2 3.23Å
29	T	87.6	Confident	76.6	Confident	91 Å²	91	82.4 Å²	82.4	56%	0.558	41%	0.407	S	S	*	.			trans	-61.1	144.4	177.3	63	0	0	0	0	110.6	L161 P163	T29-L161 VanDerWaalsContact CA-O 3.3Å; T29-L161 WeakPolarHBondContact CA-O 3.3Å; T29-P163 HydrophobicContact CG2-CB 4.31Å
30	S	90.4	Very high	79.1	Confident	41 Å²	41	79 Å²	79	29%	0.287	39%	0.391	S	S	.	.			trans	-138.6	158.7	-179.7	177.8	0	0	0	0	110.9	L32 G33 L161	S30-L32 PolarHBondContact O-N 3.25Å; S30-L32 VanDerWaalsContact O-N 3.16Å; S30-L32 PolarHBondContact OG-N 2.77Å; S30-G33 PolarHBondContact O-N 2.74Å; S30-L161 PolarHBondContact N-O 3.13Å
31	K	91.3	Very high	81.6	Confident	138 Å²	138	75.3 Å²	75.3	60%	0.6	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-55.2	-28.5	167.5	67.8	-179.6	-175.2	177.2	0	112	G33 T34 Y37	K31-G33 PolarHBondContact O-N 2.69Å; K31-G33 VanDerWaalsContact O-N 3.13Å; K31-T34 PolarHBondContact O-N 3.14Å; K31-T34 PolarHBondContact O-OG1 2.84Å; K31-T34 VanDerWaalsContact O-OG1 3.13Å; K31-Y37 HydrophobicContact CB-CD2 4.3Å; K31-Y37 HydrophobicContact CB-CG 4.41Å; K31-Y37 HydrophobicContact CD-CD2 3.83Å; K31-Y37 HydrophobicContact CD-CE2 3.98Å; K31-Y37 HydrophobicContact CG-CD2 3.94Å; K31-Y37 HydrophobicContact CG-CE2 4.29Å; K31-Y37 HydrophobicContact CG-CG 4.31Å; K31-Y37 WeakPolarHBondContact O-CB 3.49Å
32	L	90.8	Very high	84	Confident	45 Å²	45	69.3 Å²	69.3	24%	0.236	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-63.8	-13.3	174.5	-64.6	174.4	0	0	0	113.1	S30 Y37 W38 W59 L161	S30-L32 PolarHBondContact O-N 3.25Å; S30-L32 VanDerWaalsContact O-N 3.16Å; S30-L32 PolarHBondContact OG-N 2.77Å; L32-Y37 HydrophobicContact CD2-CD1 3.95Å; L32-Y37 HydrophobicContact CD2-CE1 3.22Å; L32-Y37 HydrophobicContact CG-CE1 4.46Å; L32-W38 PolarHBondContact O-NE1 3.34Å; L32-W59 HydrophobicContact CD1-CH2 4.12Å; L32-W59 HydrophobicContact CD2-CH2 3.85Å; L32-W59 HydrophobicContact CD2-CZ2 4.01Å; L32-W59 HydrophobicContact CG-CH2 4.45Å; L32-L161 HydrophobicContact CB-CD1 3.8Å; L32-L161 HydrophobicContact CD1-CD1 4.33Å
33	G	90.7	Very high	86.2	Confident	9 Å²	9	68.6 Å²	68.6	9%	0.093	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-95.5	3.8	173.1	0	0	0	0	0	114.5	S30 K31 A158	S30-G33 PolarHBondContact O-N 2.74Å; K31-G33 PolarHBondContact O-N 2.69Å; K31-G33 VanDerWaalsContact O-N 3.13Å; G33-A158 VanDerWaalsContact CA-O 3.23Å; G33-A158 WeakPolarHBondContact CA-O 3.36Å
34	T	92.5	Very high	88.3	Confident	32 Å²	32	70.7 Å²	70.7	20%	0.196	35%	0.348	C	S	.	.			trans	-107.2	139.6	-176.7	79.1	0	0	0	0	112	K31 E36 Y37 W38 P163	K31-T34 PolarHBondContact O-N 3.14Å; K31-T34 PolarHBondContact O-OG1 2.84Å; K31-T34 VanDerWaalsContact O-OG1 3.13Å; T34-E36 WeakPolarHBondContact CB-OE2 3.43Å; T34-E36 PolarHBondContact O-N 3.33Å; T34-Y37 PolarHBondContact O-N 3.12Å; T34-Y37 PolarHBondContact OG1-N 3.06Å; T34-W38 VanDerWaalsContact O-CD1 3.25Å; T34-W38 PolarHBondContact O-N 3.15Å; T34-P163 HydrophobicContact CG2-CG 3.85Å
35	K	93.3	Very high	90.2	Very high	92 Å²	92	71.3 Å²	71.3	40%	0.4	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-37.2	178.2	-175.7	174.2	-177.2	169.9	0	111.2	Y37 W38 E39 Y110	K35-Y37 VanDerWaalsContact C-N 3.34Å; K35-Y37 PolarHBondContact O-N 3.44Å; K35-W38 PolarHBondContact O-N 3.46Å; K35-E39 WeakPolarHBondContact O-CB 3.33Å; K35-E39 PolarHBondContact O-N 3.09Å; K35-Y110 HydrophobicContact CB-CE2 4.33Å; K35-Y110 WeakPolarHBondContact CE-O 3.31Å; K35-Y110 HydrophobicContact CG-CE1 4.35Å; K35-Y110 HydrophobicContact CG-CE2 4.41Å; K35-Y110 PolarHBondContact NZ-O 3.13Å
36	E	95.6	Very high	92	Very high	126 Å²	126	64.8 Å²	64.8	59%	0.589	32%	0.315	S	S	*	.	H	α-helix	trans	-60.1	-42.8	-179.2	-62.7	71.4	-154.9	0	0	111.8	T34 E40	T34-E36 WeakPolarHBondContact CB-OE2 3.43Å; T34-E36 PolarHBondContact O-N 3.33Å; E36-E40 WeakPolarHBondContact O-CG 3.15Å; E36-E40 PolarHBondContact O-N 3.25Å
37	Y	95.6	Very high	93.6	Very high	60 Å²	60	68.2 Å²	68.2	24%	0.235	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-47.1	178.1	169.7	-96.5	0	0	0	111.5	K31 L32 T34 K35 E40 A41	K31-Y37 HydrophobicContact CB-CD2 4.3Å; K31-Y37 HydrophobicContact CB-CG 4.41Å; K31-Y37 HydrophobicContact CD-CD2 3.83Å; K31-Y37 HydrophobicContact CD-CE2 3.98Å; K31-Y37 HydrophobicContact CG-CD2 3.94Å; K31-Y37 HydrophobicContact CG-CE2 4.29Å; K31-Y37 HydrophobicContact CG-CG 4.31Å; K31-Y37 WeakPolarHBondContact O-CB 3.49Å; L32-Y37 HydrophobicContact CD2-CD1 3.95Å; L32-Y37 HydrophobicContact CD2-CE1 3.22Å; L32-Y37 HydrophobicContact CG-CE1 4.46Å; T34-Y37 PolarHBondContact O-N 3.12Å; T34-Y37 PolarHBondContact OG1-N 3.06Å; K35-Y37 VanDerWaalsContact C-N 3.34Å; K35-Y37 PolarHBondContact O-N 3.44Å; Y37-E40 PolarHBondContact O-N 2.68Å; Y37-A41 WeakPolarHBondContact O-CB 3.23Å; Y37-A41 PolarHBondContact O-N 2.9Å
38	W	96.3	Very high	94.5	Very high	19 Å²	19	69 Å²	69	7%	0.072	34%	0.338	C	S	.	.	H	α-helix	trans	-67.3	-41.7	-178.7	-74	105.2	0	0	0	112	L32 T34 K35 E40 A41 Y42 W59 Y110 A158	L32-W38 PolarHBondContact O-NE1 3.34Å; T34-W38 VanDerWaalsContact O-CD1 3.25Å; T34-W38 PolarHBondContact O-N 3.15Å; K35-W38 PolarHBondContact O-N 3.46Å; W38-E40 VanDerWaalsContact C-N 3.33Å; W38-E40 PolarHBondContact O-N 3.13Å; W38-A41 PolarHBondContact O-N 3.39Å; W38-Y42 HydrophobicContact CB-CD2 4.24Å; W38-Y42 HydrophobicContact CB-CE2 4.03Å; W38-Y42 HydrophobicContact CD2-CE2 4.37Å; W38-Y42 HydrophobicContact CE3-CE1 4.43Å; W38-Y42 AromaticContact CE3-CE2 3.74Å; W38-Y42 HydrophobicContact CE3-CE2 3.74Å; W38-Y42 AromaticContact CE3-CZ 3.67Å; W38-Y42 WeakPolarHBondContact O-CB 3.37Å; W38-Y42 WeakPolarHBondContact O-CD2 3.47Å; W38-Y42 PolarHBondContact O-N 3.21Å; W38-W59 AromaticContact CH2-CD2 3.96Å; W38-W59 HydrophobicContact CH2-CD2 3.96Å; W38-W59 AromaticContact CH2-CE2 3.32Å; W38-W59 HydrophobicContact CH2-CE3 4.34Å; W38-W59 AromaticContact CH2-CH2 3.57Å; W38-W59 HydrophobicContact CH2-CH2 3.57Å; W38-W59 AromaticContact CH2-CZ2 3.12Å; W38-W59 HydrophobicContact CH2-CZ2 3.12Å; W38-W59 HydrophobicContact CH2-CZ3 4.16Å; W38-W59 AromaticContact CH2-NE1 3.75Å; W38-W59 AromaticContact CZ2-CH2 3.69Å; W38-W59 HydrophobicContact CZ2-CH2 3.69Å; W38-W59 AromaticContact CZ2-CZ2 3.7Å; W38-W59 HydrophobicContact CZ2-CZ2 3.7Å; W38-W59 HydrophobicContact CZ2-CZ3 4.32Å; W38-W59 AromaticContact CZ3-CE2 3.96Å; W38-W59 AromaticContact CZ3-CZ2 3.95Å; W38-W59 HydrophobicContact CZ3-CZ2 3.95Å; W38-W59 AromaticContact CZ3-NE1 3.92Å; W38-Y110 HydrophobicContact CB-CE1 3.95Å; W38-Y110 HydrophobicContact CG-CE1 4.37Å; W38-A158 HydrophobicContact CZ2-CB 4.15Å
39	E	96.1	Very high	95.2	Very high	50 Å²	50	61.9 Å²	61.9	23%	0.234	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-45.8	175.1	-167.7	65.1	-159.9	0	0	111.3	K35 A41 Q43 S111 P112 A113	K35-E39 WeakPolarHBondContact O-CB 3.33Å; K35-E39 PolarHBondContact O-N 3.09Å; E39-A41 PolarHBondContact O-N 2.91Å; E39-Q43 VanDerWaalsContact O-CB 3.28Å; E39-Q43 WeakPolarHBondContact O-CB 3.37Å; E39-Q43 PolarHBondContact O-N 2.96Å; E39-S111 WeakPolarHBondContact OE2-CA 3.36Å; E39-S111 WeakPolarHBondContact OE2-CB 3.26Å; E39-S111 PolarHBondContact OE2-OG 2.94Å; E39-P112 WeakPolarHBondContact OE2-CD 3.36Å; E39-A113 WeakPolarHBondContact OE1-CB 3.36Å; E39-A113 PolarHBondContact OE1-N 3.27Å
40	E	97.2	Very high	95.6	Very high	117 Å²	117	63.4 Å²	63.4	55%	0.547	30%	0.303	S	S	.	.	H	α-helix	trans	-64.9	-37.1	176.6	-74.6	-177.9	-167.2	0	0	113.3	E36 Y37 W38 K44	E36-E40 WeakPolarHBondContact O-CG 3.15Å; E36-E40 PolarHBondContact O-N 3.25Å; Y37-E40 PolarHBondContact O-N 2.68Å; W38-E40 VanDerWaalsContact C-N 3.33Å; W38-E40 PolarHBondContact O-N 3.13Å; E40-K44 WeakPolarHBondContact O-CD 3.48Å; E40-K44 WeakPolarHBondContact O-CG 3.46Å; E40-K44 PolarHBondContact O-N 3.49Å
41	A	97.1	Very high	96	Very high	22 Å²	22	68 Å²	68	18%	0.182	32%	0.324	C	S	.	.	H	α-helix	trans	-65.5	-52.2	177.1	0	0	0	0	0	110.4	Y37 W38 E39 Q43 K44 E45	Y37-A41 WeakPolarHBondContact O-CB 3.23Å; Y37-A41 PolarHBondContact O-N 2.9Å; W38-A41 PolarHBondContact O-N 3.39Å; E39-A41 PolarHBondContact O-N 2.91Å; A41-Q43 VanDerWaalsContact C-N 3.32Å; A41-Q43 PolarHBondContact O-N 3.17Å; A41-K44 WeakPolarHBondContact O-CB 3.3Å; A41-K44 PolarHBondContact O-N 2.88Å; A41-K44 VanDerWaalsContact O-N 3.14Å; A41-E45 WeakPolarHBondContact O-CG 3.41Å; A41-E45 PolarHBondContact O-N 3.44Å
42	Y	98.3	Very high	96.3	Very high	20 Å²	20	67.1 Å²	67.1	8%	0.078	33%	0.325	C	S	.	.	H	α-helix	trans	-66.5	-32.3	-179.2	-66.9	-50.7	0	0	0	113.1	W38 K44 E45 L46 G89 S114 L117	W38-Y42 HydrophobicContact CB-CD2 4.24Å; W38-Y42 HydrophobicContact CB-CE2 4.03Å; W38-Y42 HydrophobicContact CD2-CE2 4.37Å; W38-Y42 HydrophobicContact CE3-CE1 4.43Å; W38-Y42 AromaticContact CE3-CE2 3.74Å; W38-Y42 HydrophobicContact CE3-CE2 3.74Å; W38-Y42 AromaticContact CE3-CZ 3.67Å; W38-Y42 WeakPolarHBondContact O-CB 3.37Å; W38-Y42 WeakPolarHBondContact O-CD2 3.47Å; W38-Y42 PolarHBondContact O-N 3.21Å; Y42-K44 VanDerWaalsContact C-N 3.32Å; Y42-K44 PolarHBondContact O-N 3.03Å; Y42-E45 WeakPolarHBondContact CD1-OE2 3.5Å; Y42-E45 PolarHBondContact O-N 2.73Å; Y42-L46 WeakPolarHBondContact O-CB 3.48Å; Y42-L46 PolarHBondContact O-N 3.36Å; Y42-G89 VanDerWaalsContact OH-CA 3.23Å; Y42-G89 WeakPolarHBondContact OH-CA 3.32Å; Y42-S114 VanDerWaalsContact CD2-CB 3.46Å; Y42-L117 HydrophobicContact CD1-CD2 4.37Å
43	Q	98.1	Very high	96.5	Very high	84 Å²	84	67 Å²	67	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-61	-42.8	173.4	-170.2	69.2	36.8	0	0	111.3	E39 A41 L46 E47 A113	E39-Q43 VanDerWaalsContact O-CB 3.28Å; E39-Q43 WeakPolarHBondContact O-CB 3.37Å; E39-Q43 PolarHBondContact O-N 2.96Å; A41-Q43 VanDerWaalsContact C-N 3.32Å; A41-Q43 PolarHBondContact O-N 3.17Å; Q43-L46 PolarHBondContact O-N 2.92Å; Q43-E47 WeakPolarHBondContact O-CG 3.37Å; Q43-E47 PolarHBondContact O-N 2.83Å; Q43-A113 HydrophobicContact CB-CB 4.5Å
44	K	97.9	Very high	96.8	Very high	122 Å²	122	70.4 Å²	70.4	53%	0.53	35%	0.351	S	S	.	.	H	α-helix	trans	-68.2	-42.1	177.6	-68.7	165.7	-170	160.2	0	111.7	E40 A41 Y42 E47 T48	E40-K44 WeakPolarHBondContact O-CD 3.48Å; E40-K44 WeakPolarHBondContact O-CG 3.46Å; E40-K44 PolarHBondContact O-N 3.49Å; A41-K44 WeakPolarHBondContact O-CB 3.3Å; A41-K44 PolarHBondContact O-N 2.88Å; A41-K44 VanDerWaalsContact O-N 3.14Å; Y42-K44 VanDerWaalsContact C-N 3.32Å; Y42-K44 PolarHBondContact O-N 3.03Å; K44-E47 PolarHBondContact O-N 2.86Å; K44-T48 WeakPolarHBondContact O-CB 3.27Å; K44-T48 PolarHBondContact O-N 3.09Å; K44-T48 PolarHBondContact O-OG1 3.23Å
45	E	98.1	Very high	96.9	Very high	32 Å²	32	71 Å²	71	15%	0.15	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-41.5	176.8	-69.3	-178.3	159.6	0	0	111.2	A41 Y42 E47 T48 F49 E57 L117	A41-E45 WeakPolarHBondContact O-CG 3.41Å; A41-E45 PolarHBondContact O-N 3.44Å; Y42-E45 WeakPolarHBondContact CD1-OE2 3.5Å; Y42-E45 PolarHBondContact O-N 2.73Å; E45-E47 PolarHBondContact O-N 3.15Å; E45-T48 PolarHBondContact O-N 3.44Å; E45-F49 WeakPolarHBondContact O-CB 3.09Å; E45-F49 PolarHBondContact O-N 3.35Å; E45-E57 PolarHBondContact OE1-N 3.44Å; E45-L117 HydrophobicContact CB-CD2 3.67Å
46	L	98.1	Very high	96.9	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-60.4	-43.4	174.8	177.9	61.5	0	0	0	112.7	Y42 Q43 K50 E116 L117 N120	Y42-L46 WeakPolarHBondContact O-CB 3.48Å; Y42-L46 PolarHBondContact O-N 3.36Å; Q43-L46 PolarHBondContact O-N 2.92Å; L46-K50 HydrophobicContact CD1-CD 4.36Å; L46-K50 HydrophobicContact CG-CD 4.39Å; L46-K50 VanDerWaalsContact O-CG 3.3Å; L46-K50 WeakPolarHBondContact O-CG 3.34Å; L46-K50 PolarHBondContact O-N 3.33Å; L46-E116 HydrophobicContact CD1-CB 4.45Å; L46-E116 HydrophobicContact CD1-CG 4.14Å; L46-E116 HydrophobicContact CD2-CB 4.11Å; L46-E116 HydrophobicContact CD2-CG 4.14Å; L46-L117 HydrophobicContact CB-CB 4.37Å; L46-L117 HydrophobicContact CD1-CB 4.18Å; L46-N120 WeakPolarHBondContact CD1-ND2 3.45Å
47	E	98.1	Very high	96.7	Very high	113 Å²	113	67.1 Å²	67.1	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-63.7	-44.1	174.6	-74.3	171.9	-171.5	0	0	111.3	Q43 K44 E45 K50 D51	Q43-E47 WeakPolarHBondContact O-CG 3.37Å; Q43-E47 PolarHBondContact O-N 2.83Å; K44-E47 PolarHBondContact O-N 2.86Å; E45-E47 PolarHBondContact O-N 3.15Å; E47-K50 PolarHBondContact O-N 3.4Å; E47-D51 PolarHBondContact O-N 2.71Å
48	T	97.8	Very high	96.5	Very high	55 Å²	55	66.1 Å²	66.1	34%	0.337	34%	0.342	S	S	.	.	H	α-helix	trans	-64.7	-41.8	178.6	-52.2	0	0	0	0	111.3	K44 E45 K50 D51 I52 D54	K44-T48 WeakPolarHBondContact O-CB 3.27Å; K44-T48 PolarHBondContact O-N 3.09Å; K44-T48 PolarHBondContact O-OG1 3.23Å; E45-T48 PolarHBondContact O-N 3.44Å; T48-K50 VanDerWaalsContact C-N 3.33Å; T48-K50 PolarHBondContact O-N 3.23Å; T48-D51 PolarHBondContact O-N 2.86Å; T48-I52 HydrophobicContact CG2-CD1 3.9Å; T48-I52 HydrophobicContact CG2-CG1 3.86Å; T48-I52 VanDerWaalsContact O-CG1 3.32Å; T48-I52 WeakPolarHBondContact O-CG1 3.44Å; T48-I52 PolarHBondContact O-N 2.81Å; T48-D54 HydrophobicContact CG2-CB 3.85Å
49	F	98.1	Very high	96	Very high	30 Å²	30	67.4 Å²	67.4	13%	0.132	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-43.6	174.7	-177	-96	0	0	0	111.5	E45 D51 G53 D54 V55 L117 N120 V121 A124	E45-F49 WeakPolarHBondContact O-CB 3.09Å; E45-F49 PolarHBondContact O-N 3.35Å; F49-D51 VanDerWaalsContact C-N 3.28Å; F49-D51 PolarHBondContact O-N 2.82Å; F49-G53 WeakPolarHBondContact O-CA 3.45Å; F49-G53 PolarHBondContact O-N 2.83Å; F49-D54 WeakPolarHBondContact CA-O 3.47Å; F49-D54 VanDerWaalsContact CB-O 3.24Å; F49-D54 WeakPolarHBondContact CB-O 3.38Å; F49-D54 WeakPolarHBondContact CD2-O 3.47Å; F49-D54 PolarHBondContact N-O 2.81Å; F49-V55 HydrophobicContact CD2-CG1 4.14Å; F49-V55 HydrophobicContact CE2-CG1 4.01Å; F49-L117 HydrophobicContact CB-CD1 3.7Å; F49-L117 HydrophobicContact CD1-CD1 4.48Å; F49-L117 HydrophobicContact CD2-CD1 4.42Å; F49-L117 HydrophobicContact CG-CD1 3.93Å; F49-N120 HydrophobicContact CD1-CB 3.93Å; F49-N120 HydrophobicContact CE1-CB 3.63Å; F49-V121 HydrophobicContact CD2-CG2 3.93Å; F49-V121 HydrophobicContact CE2-CB 4.48Å; F49-V121 HydrophobicContact CE2-CG2 3.71Å; F49-V121 HydrophobicContact CZ-CG2 4.1Å; F49-A124 HydrophobicContact CZ-CB 3.84Å
50	K	97.1	Very high	95.4	Very high	124 Å²	124	67.7 Å²	67.7	54%	0.539	35%	0.347	S	S	.	.	H	α-helix	trans	-65.6	-31	177.8	-75	170.4	179.1	168.8	0	112.8	L46 E47 T48 E116	L46-K50 HydrophobicContact CD1-CD 4.36Å; L46-K50 HydrophobicContact CG-CD 4.39Å; L46-K50 VanDerWaalsContact O-CG 3.3Å; L46-K50 WeakPolarHBondContact O-CG 3.34Å; L46-K50 PolarHBondContact O-N 3.33Å; E47-K50 PolarHBondContact O-N 3.4Å; T48-K50 VanDerWaalsContact C-N 3.33Å; T48-K50 PolarHBondContact O-N 3.23Å; K50-E116 WeakPolarHBondContact CE-OE1 3.29Å; K50-E116 IonicContact NZ-OE1 2.77Å; K50-E116 PolarHBondContact NZ-OE1 2.74Å
51	D	97.5	Very high	95	Very high	137 Å²	137	63.4 Å²	63.4	73%	0.733	34%	0.335	S	S	*	.	H	α-helix	trans	-81.8	-51.9	-179.2	-170	38.4	0	0	0	112.4	E47 T48 F49	E47-D51 PolarHBondContact O-N 2.71Å; T48-D51 PolarHBondContact O-N 2.86Å; F49-D51 VanDerWaalsContact C-N 3.28Å; F49-D51 PolarHBondContact O-N 2.82Å
52	I	97.4	Very high	94.7	Very high	119 Å²	119	68.2 Å²	68.2	61%	0.61	35%	0.353	S	S	*	.	H	α-helix	trans	-127.1	-0.9	-169.7	62.5	166.3	0	0	0	114.9	T48 D54	T48-I52 HydrophobicContact CG2-CD1 3.9Å; T48-I52 HydrophobicContact CG2-CG1 3.86Å; T48-I52 VanDerWaalsContact O-CG1 3.32Å; T48-I52 WeakPolarHBondContact O-CG1 3.44Å; T48-I52 PolarHBondContact O-N 2.81Å; I52-D54 VanDerWaalsContact C-N 3.31Å; I52-D54 HydrophobicContact CD1-CB 3.99Å; I52-D54 HydrophobicContact CG1-CB 3.98Å
53	G	95.9	Very high	94.3	Very high	43 Å²	43	71.6 Å²	71.6	44%	0.443	37%	0.37	S	S	.	.			trans	76.7	13.3	-179.1	0	0	0	0	0	114.9	F49 V55	F49-G53 WeakPolarHBondContact O-CA 3.45Å; F49-G53 PolarHBondContact O-N 2.83Å; G53-V55 PolarHBondContact O-N 3.19Å
54	D	96.6	Very high	94.1	Very high	81 Å²	81	67.7 Å²	67.7	43%	0.433	35%	0.352	S	S	.	.			trans	-72.5	124.9	173.3	-172.2	-8.2	0	0	0	110	T48 F49 I52 G56	T48-D54 HydrophobicContact CG2-CB 3.85Å; F49-D54 WeakPolarHBondContact CA-O 3.47Å; F49-D54 VanDerWaalsContact CB-O 3.24Å; F49-D54 WeakPolarHBondContact CB-O 3.38Å; F49-D54 WeakPolarHBondContact CD2-O 3.47Å; F49-D54 PolarHBondContact N-O 2.81Å; I52-D54 VanDerWaalsContact C-N 3.31Å; I52-D54 HydrophobicContact CD1-CB 3.99Å; I52-D54 HydrophobicContact CG1-CB 3.98Å; D54-G56 VanDerWaalsContact C-N 3.26Å; D54-G56 PolarHBondContact O-N 2.86Å; D54-G56 PolarHBondContact OD1-N 3.32Å
55	V	94.4	Very high	94	Very high	44 Å²	44	62.1 Å²	62.1	27%	0.267	33%	0.328	S	S	.	.			trans	-80.4	-5.8	-175.3	-57.5	0	0	0	0	113.1	F49 G53 N90 V121	F49-V55 HydrophobicContact CD2-CG1 4.14Å; F49-V55 HydrophobicContact CE2-CG1 4.01Å; G53-V55 PolarHBondContact O-N 3.19Å; V55-N90 WeakPolarHBondContact O-CB 3.47Å; V55-N90 PolarHBondContact O-ND2 3.21Å; V55-V121 HydrophobicContact CB-CG2 4.22Å; V55-V121 HydrophobicContact CG1-CG1 4.11Å; V55-V121 HydrophobicContact CG1-CG2 3.98Å
56	G	94	Very high	93.9	Very high	22 Å²	22	62.8 Å²	62.8	23%	0.227	33%	0.332	C	S	.	.			trans	82	-164	-178.8	0	0	0	0	0	113.6	D54 I58	D54-G56 VanDerWaalsContact C-N 3.26Å; D54-G56 PolarHBondContact O-N 2.86Å; D54-G56 PolarHBondContact OD1-N 3.32Å; G56-I58 PolarHBondContact O-N 3.16Å
57	E	92.1	Very high	93.8	Very high	114 Å²	114	63.7 Å²	63.7	53%	0.533	34%	0.336	S	S	.	.			trans	-76.3	125.3	-170.5	-172.3	176.3	-169.1	0	0	113	E45 W59	E45-E57 PolarHBondContact OE1-N 3.44Å; E57-W59 PolarHBondContact OE2-NE1 2.78Å
58	I	91.1	Very high	93.8	Very high	39 Å²	39	58.4 Å²	58.4	20%	0.2	31%	0.311	C	S	.	.			trans	-93.8	98.7	168.7	-57.4	176.1	0	0	0	109	G56 F60 G61 E62 M65 A92	G56-I58 PolarHBondContact O-N 3.16Å; I58-F60 PolarHBondContact O-N 2.94Å; I58-G61 WeakPolarHBondContact O-CA 3.31Å; I58-G61 PolarHBondContact O-N 2.87Å; I58-E62 HydrophobicContact CD1-CG 3.98Å; I58-M65 HydrophobicContact CD1-CE 4.4Å; I58-M65 HydrophobicContact CG2-CE 3.98Å; I58-M65 HydrophobicContact CG2-SD 4.36Å; I58-A92 HydrophobicContact CD1-CB 3.99Å; I58-A92 HydrophobicContact CG1-CB 4.06Å
59	W	85.6	Confident	93.8	Very high	46 Å²	46	55.9 Å²	55.9	17%	0.174	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	132.8	-179.7	-83.9	54	0	0	0	112.4	L32 W38 E57 G61 K153	L32-W59 HydrophobicContact CD1-CH2 4.12Å; L32-W59 HydrophobicContact CD2-CH2 3.85Å; L32-W59 HydrophobicContact CD2-CZ2 4.01Å; L32-W59 HydrophobicContact CG-CH2 4.45Å; W38-W59 AromaticContact CH2-CD2 3.96Å; W38-W59 HydrophobicContact CH2-CD2 3.96Å; W38-W59 AromaticContact CH2-CE2 3.32Å; W38-W59 HydrophobicContact CH2-CE3 4.34Å; W38-W59 AromaticContact CH2-CH2 3.57Å; W38-W59 HydrophobicContact CH2-CH2 3.57Å; W38-W59 AromaticContact CH2-CZ2 3.12Å; W38-W59 HydrophobicContact CH2-CZ2 3.12Å; W38-W59 HydrophobicContact CH2-CZ3 4.16Å; W38-W59 AromaticContact CH2-NE1 3.75Å; W38-W59 AromaticContact CZ2-CH2 3.69Å; W38-W59 HydrophobicContact CZ2-CH2 3.69Å; W38-W59 AromaticContact CZ2-CZ2 3.7Å; W38-W59 HydrophobicContact CZ2-CZ2 3.7Å; W38-W59 HydrophobicContact CZ2-CZ3 4.32Å; W38-W59 AromaticContact CZ3-CE2 3.96Å; W38-W59 AromaticContact CZ3-CZ2 3.95Å; W38-W59 HydrophobicContact CZ3-CZ2 3.95Å; W38-W59 AromaticContact CZ3-NE1 3.92Å; E57-W59 PolarHBondContact OE2-NE1 2.78Å; W59-G61 PolarHBondContact O-N 2.87Å; W59-G61 VanDerWaalsContact O-N 3.16Å; W59-K153 VanDerWaalsContact CB-NZ 3.33Å; W59-K153 WeakPolarHBondContact O-CD 3.27Å; W59-K153 VanDerWaalsContact O-CE 3.24Å; W59-K153 WeakPolarHBondContact O-CE 3.3Å; W59-K153 PolarHBondContact O-NZ 3.22Å
60	F	83	Confident	93.8	Very high	56 Å²	56	60 Å²	60	25%	0.246	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	5.3	-172.2	-42.3	-45.6	0	0	0	115.8	I58 K153 D157 T190 C192 V228	I58-F60 PolarHBondContact O-N 2.94Å; F60-K153 HydrophobicContact CD2-CD 4.34Å; F60-K153 HydrophobicContact CD2-CG 3.55Å; F60-K153 HydrophobicContact CE2-CG 4.12Å; F60-D157 WeakPolarHBondContact CZ-OD2 3.35Å; F60-T190 HydrophobicContact CB-CG2 4.4Å; F60-T190 HydrophobicContact CD2-CG2 3.46Å; F60-T190 VanDerWaalsContact CD2-CG2 3.46Å; F60-T190 HydrophobicContact CE2-CG2 3.99Å; F60-T190 WeakPolarHBondContact CE2-O 3.49Å; F60-T190 HydrophobicContact CG-CG2 4.11Å; F60-C192 HydrophobicContact CD1-CB 4.5Å; F60-C192 HydrophobicContact CE1-CB 3.69Å; F60-C192 HydrophobicContact CZ-CB 4.21Å; F60-V228 HydrophobicContact CD1-CG2 4.29Å
61	G	88	Confident	93.9	Very high	28 Å²	28	55.3 Å²	55.3	29%	0.289	29%	0.289	S	S	.	.			trans	72.1	166.6	176.1	0	0	0	0	0	115.1	I58 W59 E63 S64	I58-G61 WeakPolarHBondContact O-CA 3.31Å; I58-G61 PolarHBondContact O-N 2.87Å; W59-G61 PolarHBondContact O-N 2.87Å; W59-G61 VanDerWaalsContact O-N 3.16Å; G61-E63 PolarHBondContact O-N 2.8Å; G61-S64 WeakPolarHBondContact O-CB 3.49Å; G61-S64 PolarHBondContact O-N 2.89Å
62	E	90.7	Very high	93.9	Very high	123 Å²	123	48.8 Å²	48.8	58%	0.575	25%	0.254	S	S	*	.	H	α-helix	trans	-59.2	-33.2	-178.5	-64.7	177	-171.4	0	0	113.3	I58 S64 M65 N66	I58-E62 HydrophobicContact CD1-CG 3.98Å; E62-S64 PolarHBondContact O-N 2.85Å; E62-S64 VanDerWaalsContact O-N 3.15Å; E62-M65 HydrophobicContact CB-CE 4.16Å; E62-M65 HydrophobicContact CG-CE 3.99Å; E62-M65 WeakPolarHBondContact O-CB 3.38Å; E62-M65 PolarHBondContact O-N 2.86Å; E62-N66 PolarHBondContact O-N 2.8Å
63	E	91.6	Very high	93.9	Very high	91 Å²	91	47.6 Å²	47.6	43%	0.425	25%	0.246	S	C	.	.	H	α-helix	trans	-63.3	-24.3	179	-176.4	51.2	-153.8	0	0	112.3	G61 R67 R70	G61-E63 PolarHBondContact O-N 2.8Å; E63-R67 WeakPolarHBondContact O-CB 3.32Å; E63-R67 PolarHBondContact O-N 2.84Å; E63-R67 VanDerWaalsContact O-N 3.09Å; E63-R70 IonicContact OE1-CZ 3.81Å; E63-R70 IonicContact OE1-NH1 2.74Å; E63-R70 PolarHBondContact OE1-NH1 2.86Å; E63-R70 IonicContact OE1-NH2 2.76Å; E63-R70 PolarHBondContact OE1-NH2 2.89Å; E63-R70 IonicContact OE2-NH1 2.73Å; E63-R70 PolarHBondContact OE2-NH1 3.28Å
64	S	92.3	Very high	94	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.014	26%	0.26	C	S	.	.	H	α-helix	trans	-68.8	-42.8	172.2	-156.2	0	0	0	0	112.8	G61 E62 R67 V68 T190	G61-S64 WeakPolarHBondContact O-CB 3.49Å; G61-S64 PolarHBondContact O-N 2.89Å; E62-S64 PolarHBondContact O-N 2.85Å; E62-S64 VanDerWaalsContact O-N 3.15Å; S64-R67 WeakPolarHBondContact O-CB 3.29Å; S64-R67 PolarHBondContact O-N 3.03Å; S64-R67 PolarHBondContact OG-NH1 2.91Å; S64-V68 PolarHBondContact O-N 2.86Å; S64-T190 VanDerWaalsContact OG-CG2 3.29Å; S64-T190 WeakPolarHBondContact OG-CG2 3.36Å; S64-T190 PolarHBondContact OG-OG1 2.79Å
65	M	96.2	Very high	94.1	Very high	4 Å²	4	52 Å²	52	2%	0.02	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-46.8	174.8	-57.1	-171.2	-66.9	0	0	110.5	I58 E62 R67 V68 L69 A92 F93 E96 K153	I58-M65 HydrophobicContact CD1-CE 4.4Å; I58-M65 HydrophobicContact CG2-CE 3.98Å; I58-M65 HydrophobicContact CG2-SD 4.36Å; E62-M65 HydrophobicContact CB-CE 4.16Å; E62-M65 HydrophobicContact CG-CE 3.99Å; E62-M65 WeakPolarHBondContact O-CB 3.38Å; E62-M65 PolarHBondContact O-N 2.86Å; M65-R67 PolarHBondContact O-N 2.92Å; M65-V68 PolarHBondContact O-N 3.28Å; M65-V68 VanDerWaalsContact O-N 3.13Å; M65-L69 WeakPolarHBondContact O-CG 3.47Å; M65-L69 PolarHBondContact O-N 3.19Å; M65-A92 HydrophobicContact CE-CB 4.38Å; M65-A92 HydrophobicContact SD-CB 4.38Å; M65-F93 HydrophobicContact CB-CD2 3.77Å; M65-F93 HydrophobicContact CB-CE1 4.5Å; M65-F93 HydrophobicContact CB-CE2 3.82Å; M65-F93 HydrophobicContact CB-CG 4.21Å; M65-F93 HydrophobicContact CB-CZ 4.21Å; M65-F93 HydrophobicContact CG-CB 4.22Å; M65-F93 HydrophobicContact CG-CD1 4.06Å; M65-F93 HydrophobicContact CG-CD2 3.88Å; M65-F93 HydrophobicContact CG-CE1 4.4Å; M65-F93 HydrophobicContact CG-CE2 4.32Å; M65-F93 HydrophobicContact CG-CG 3.8Å; M65-F93 WeakPolarHBondContact SD-CA 3.44Å; M65-F93 HydrophobicContact SD-CB 3.56Å; M65-F93 VanDerWaalsContact SD-CB 3.56Å; M65-F93 HydrophobicContact SD-CD2 3.94Å; M65-F93 HydrophobicContact SD-CG 3.77Å; M65-E96 HydrophobicContact CE-CG 3.93Å; M65-E96 HydrophobicContact SD-CG 4.48Å; M65-K153 HydrophobicContact CG-CD 4.31Å
66	N	96	Very high	94.3	Very high	47 Å²	47	58.4 Å²	58.4	25%	0.251	28%	0.283	S	S	.	.	H	α-helix	trans	-57.8	-35.9	178.4	-69.7	-25	0	0	0	112.4	E62 L69 R70	E62-N66 PolarHBondContact O-N 2.8Å; N66-L69 PolarHBondContact O-N 2.8Å; N66-R70 WeakPolarHBondContact O-CB 3.37Å; N66-R70 VanDerWaalsContact O-CG 3.23Å; N66-R70 WeakPolarHBondContact O-CG 3.42Å; N66-R70 PolarHBondContact O-N 2.86Å
67	R	96.2	Very high	94.5	Very high	19 Å²	19	58.7 Å²	58.7	7%	0.072	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-46.2	177.9	-171.6	-175.9	-57.5	103.4	11.1	112.2	E63 S64 M65 W71 L213 P214	E63-R67 WeakPolarHBondContact O-CB 3.32Å; E63-R67 PolarHBondContact O-N 2.84Å; E63-R67 VanDerWaalsContact O-N 3.09Å; S64-R67 WeakPolarHBondContact O-CB 3.29Å; S64-R67 PolarHBondContact O-N 3.03Å; S64-R67 PolarHBondContact OG-NH1 2.91Å; M65-R67 PolarHBondContact O-N 2.92Å; R67-W71 PolarHBondContact O-N 3.35Å; R67-W71 VanDerWaalsContact O-N 3.14Å; R67-L213 HydrophobicContact CG-CB 3.65Å; R67-L213 HydrophobicContact CG-CD1 3.9Å; R67-L213 HydrophobicContact CG-CG 4.4Å; R67-P214 VanDerWaalsContact CD-O 3.27Å; R67-P214 WeakPolarHBondContact CD-O 3.49Å; R67-P214 PolarHBondContact NE-O 3.25Å
68	V	97.8	Very high	94.8	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-66.9	-44.3	177.2	176.4	0	0	0	0	110	S64 M65 R70 W71 M72 F93 I151 A188 L213	S64-V68 PolarHBondContact O-N 2.86Å; M65-V68 PolarHBondContact O-N 3.28Å; M65-V68 VanDerWaalsContact O-N 3.13Å; V68-R70 PolarHBondContact O-N 3.12Å; V68-W71 WeakPolarHBondContact O-CA 3.38Å; V68-W71 WeakPolarHBondContact O-CB 3.25Å; V68-W71 PolarHBondContact O-N 3.47Å; V68-W71 VanDerWaalsContact O-N 3.12Å; V68-M72 HydrophobicContact CG1-CG 4.29Å; V68-M72 HydrophobicContact CG1-SD 3.97Å; V68-M72 WeakPolarHBondContact O-CG 3.45Å; V68-M72 PolarHBondContact O-N 3.24Å; V68-F93 HydrophobicContact CB-CE1 4.4Å; V68-F93 HydrophobicContact CB-CZ 3.8Å; V68-F93 HydrophobicContact CG1-CE1 4.42Å; V68-F93 HydrophobicContact CG1-CZ 3.83Å; V68-F93 HydrophobicContact CG2-CZ 4.49Å; V68-I151 HydrophobicContact CG1-CD1 4.4Å; V68-A188 HydrophobicContact CG1-CB 3.97Å; V68-L213 HydrophobicContact CG2-CD1 4.1Å
69	L	98.3	Very high	95.1	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-57.5	-49.1	176.3	-76.6	161.8	0	0	0	113	M65 N66 W71 M72 Q73 F93 E96 L97 H100 Y102	M65-L69 WeakPolarHBondContact O-CG 3.47Å; M65-L69 PolarHBondContact O-N 3.19Å; N66-L69 PolarHBondContact O-N 2.8Å; L69-W71 PolarHBondContact O-N 3.04Å; L69-M72 PolarHBondContact O-N 2.96Å; L69-M72 VanDerWaalsContact O-N 3.15Å; L69-Q73 WeakPolarHBondContact O-CG 3.41Å; L69-Q73 PolarHBondContact O-N 3.27Å; L69-F93 HydrophobicContact CD1-CE2 4.16Å; L69-F93 HydrophobicContact CD2-CE2 4.42Å; L69-F93 HydrophobicContact CG-CE2 3.96Å; L69-E96 HydrophobicContact CD1-CB 3.95Å; L69-L97 HydrophobicContact CD2-CD2 3.7Å; L69-L97 HydrophobicContact CD2-CG 4.35Å; L69-H100 HydrophobicContact CD2-CB 4.1Å; L69-Y102 HydrophobicContact CD2-CE2 4.21Å
70	R	98.1	Very high	95.7	Very high	117 Å²	117	62.4 Å²	62.4	44%	0.442	31%	0.307	S	S	.	.	H	α-helix	trans	-59.8	-38.2	176.6	-73.9	-176.4	-53.6	-111.4	3.9	111.6	E63 N66 V68 K74	E63-R70 IonicContact OE1-CZ 3.81Å; E63-R70 IonicContact OE1-NH1 2.74Å; E63-R70 PolarHBondContact OE1-NH1 2.86Å; E63-R70 IonicContact OE1-NH2 2.76Å; E63-R70 PolarHBondContact OE1-NH2 2.89Å; E63-R70 IonicContact OE2-NH1 2.73Å; E63-R70 PolarHBondContact OE2-NH1 3.28Å; N66-R70 WeakPolarHBondContact O-CB 3.37Å; N66-R70 VanDerWaalsContact O-CG 3.23Å; N66-R70 WeakPolarHBondContact O-CG 3.42Å; N66-R70 PolarHBondContact O-N 2.86Å; V68-R70 PolarHBondContact O-N 3.12Å; R70-K74 WeakPolarHBondContact O-CB 3.5Å; R70-K74 PolarHBondContact O-N 3.24Å; R70-K74 VanDerWaalsContact O-N 3.08Å
71	W	98.5	Very high	96.5	Very high	24 Å²	24	60 Å²	60	9%	0.091	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-48.7	174.3	178.3	88.5	0	0	0	111.3	R67 V68 L69 Q73 K74 A75 I77 I186 L213 I232	R67-W71 PolarHBondContact O-N 3.35Å; R67-W71 VanDerWaalsContact O-N 3.14Å; V68-W71 WeakPolarHBondContact O-CA 3.38Å; V68-W71 WeakPolarHBondContact O-CB 3.25Å; V68-W71 PolarHBondContact O-N 3.47Å; V68-W71 VanDerWaalsContact O-N 3.12Å; L69-W71 PolarHBondContact O-N 3.04Å; W71-Q73 VanDerWaalsContact C-N 3.34Å; W71-Q73 PolarHBondContact O-N 3.15Å; W71-K74 PolarHBondContact O-N 3.43Å; W71-K74 VanDerWaalsContact O-N 3.16Å; W71-A75 HydrophobicContact CD2-CB 4.39Å; W71-A75 HydrophobicContact CE3-CB 4.47Å; W71-A75 HydrophobicContact CH2-CB 3.92Å; W71-A75 HydrophobicContact CZ2-CB 3.83Å; W71-A75 HydrophobicContact CZ3-CB 4.25Å; W71-A75 VanDerWaalsContact O-CB 3.32Å; W71-A75 WeakPolarHBondContact O-CB 3.45Å; W71-A75 PolarHBondContact O-N 3.13Å; W71-I77 HydrophobicContact CH2-CD1 4.45Å; W71-I77 HydrophobicContact CZ3-CD1 4.4Å; W71-I77 HydrophobicContact CZ3-CG1 4.31Å; W71-I186 HydrophobicContact CH2-CD1 4.41Å; W71-I186 HydrophobicContact CH2-CG1 4.23Å; W71-I186 HydrophobicContact CH2-CG2 3.64Å; W71-I186 HydrophobicContact CZ3-CG2 3.8Å; W71-L213 HydrophobicContact CB-CD1 4.27Å; W71-L213 HydrophobicContact CB-CD2 3.85Å; W71-L213 VanDerWaalsContact CD1-CD2 3.46Å; W71-L213 HydrophobicContact CG-CD2 3.71Å; W71-I232 HydrophobicContact CD2-CD1 3.9Å; W71-I232 HydrophobicContact CD2-CG1 3.81Å; W71-I232 HydrophobicContact CE3-CD1 3.87Å; W71-I232 HydrophobicContact CE3-CG1 4.24Å; W71-I232 HydrophobicContact CG-CD1 4.39Å; W71-I232 HydrophobicContact CG-CG1 4.16Å; W71-I232 HydrophobicContact CH2-CG2 3.68Å; W71-I232 HydrophobicContact CZ2-CB 4.34Å; W71-I232 HydrophobicContact CZ2-CG1 4.21Å; W71-I232 HydrophobicContact CZ2-CG2 3.48Å; W71-I232 VanDerWaalsContact CZ2-CG2 3.48Å; W71-I232 HydrophobicContact CZ3-CD1 4.26Å; W71-I232 HydrophobicContact CZ3-CG2 4.28Å
72	M	98.6	Very high	97	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-43.6	180	-68.9	174	70.5	0	0	111.9	V68 L69 A75 K76 I77 I83 L97 Y102 V149 I151	V68-M72 HydrophobicContact CG1-CG 4.29Å; V68-M72 HydrophobicContact CG1-SD 3.97Å; V68-M72 WeakPolarHBondContact O-CG 3.45Å; V68-M72 PolarHBondContact O-N 3.24Å; L69-M72 PolarHBondContact O-N 2.96Å; L69-M72 VanDerWaalsContact O-N 3.15Å; M72-A75 CarbonylContact O-C 3.6Å; M72-A75 PolarHBondContact O-N 3.34Å; M72-K76 PolarHBondContact O-N 3.03Å; M72-I77 HydrophobicContact CB-CB 4.22Å; M72-I77 HydrophobicContact CB-CG1 3.91Å; M72-I77 HydrophobicContact CE-CB 4.39Å; M72-I77 HydrophobicContact CE-CG2 4.03Å; M72-I77 HydrophobicContact CG-CG1 4.17Å; M72-I77 PolarHBondContact O-N 2.96Å; M72-I83 HydrophobicContact CE-CD1 3.71Å; M72-I83 HydrophobicContact CE-CG1 4.26Å; M72-L97 HydrophobicContact CE-CD2 4.04Å; M72-L97 HydrophobicContact SD-CD2 4.02Å; M72-Y102 WeakPolarHBondContact CB-OH 3.36Å; M72-Y102 HydrophobicContact CE-CE1 4.01Å; M72-Y102 HydrophobicContact CE-CE2 4.1Å; M72-V149 HydrophobicContact CE-CG2 4.46Å; M72-I151 HydrophobicContact SD-CD1 4.3Å
73	Q	98.1	Very high	97.4	Very high	94 Å²	94	53.1 Å²	53.1	44%	0.439	26%	0.259	S	S	.	.	H	α-helix	trans	-62.4	-44.9	175.5	-71.2	171.8	-21.8	0	0	112	L69 W71 A75 K76 H100	L69-Q73 WeakPolarHBondContact O-CG 3.41Å; L69-Q73 PolarHBondContact O-N 3.27Å; W71-Q73 VanDerWaalsContact C-N 3.34Å; W71-Q73 PolarHBondContact O-N 3.15Å; Q73-A75 VanDerWaalsContact C-N 3.34Å; Q73-K76 WeakPolarHBondContact O-CA 3.42Å; Q73-K76 PolarHBondContact O-N 3.45Å; Q73-H100 PolarHBondContact NE2-CD2 2.85Å; Q73-H100 VanDerWaalsContact NE2-CD2 3.3Å
74	K	98.1	Very high	97.8	Very high	167 Å²	167	48.8 Å²	48.8	73%	0.726	24%	0.239	S	C	*	.	H	α-helix	trans	-64.6	-39.6	177.1	-176.8	-177.9	177.4	-173.9	0	111.9	R70 W71 K76	R70-K74 WeakPolarHBondContact O-CB 3.5Å; R70-K74 PolarHBondContact O-N 3.24Å; R70-K74 VanDerWaalsContact O-N 3.08Å; W71-K74 PolarHBondContact O-N 3.43Å; W71-K74 VanDerWaalsContact O-N 3.16Å; K74-K76 PolarHBondContact O-N 3.08Å
75	A	97.9	Very high	98.1	Very high	49 Å²	49	49 Å²	49	41%	0.405	24%	0.239	S	C	.	.	H	α-helix	trans	-72.1	-8.7	174.4	0	0	0	0	0	112.7	W71 M72 Q73 I77	W71-A75 HydrophobicContact CD2-CB 4.39Å; W71-A75 HydrophobicContact CE3-CB 4.47Å; W71-A75 HydrophobicContact CH2-CB 3.92Å; W71-A75 HydrophobicContact CZ2-CB 3.83Å; W71-A75 HydrophobicContact CZ3-CB 4.25Å; W71-A75 VanDerWaalsContact O-CB 3.32Å; W71-A75 WeakPolarHBondContact O-CB 3.45Å; W71-A75 PolarHBondContact O-N 3.13Å; M72-A75 CarbonylContact O-C 3.6Å; M72-A75 PolarHBondContact O-N 3.34Å; Q73-A75 VanDerWaalsContact C-N 3.34Å; A75-I77 VanDerWaalsContact C-N 3.32Å; A75-I77 HydrophobicContact CB-CD1 4.39Å; A75-I77 HydrophobicContact CB-CG1 4.34Å; A75-I77 PolarHBondContact O-N 3.49Å
76	K	98.1	Very high	98.2	Very high	180 Å²	180	48.8 Å²	48.8	78%	0.783	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	43.2	-178.1	-54.3	179.4	-179.7	-179.9	0	112.2	M72 Q73 K74 P78	M72-K76 PolarHBondContact O-N 3.03Å; Q73-K76 WeakPolarHBondContact O-CA 3.42Å; Q73-K76 PolarHBondContact O-N 3.45Å; K74-K76 PolarHBondContact O-N 3.08Å; K76-P78 WeakPolarHBondContact O-CD 3.36Å
77	I	98.5	Very high	98.3	Very high	28 Å²	28	47.5 Å²	47.5	14%	0.144	24%	0.236	C	C	.	.			trans	-57.8	124.5	170.2	-59.4	-58.3	0	0	0	108	W71 M72 A75 A81 Y102 V149 I186	W71-I77 HydrophobicContact CH2-CD1 4.45Å; W71-I77 HydrophobicContact CZ3-CD1 4.4Å; W71-I77 HydrophobicContact CZ3-CG1 4.31Å; M72-I77 HydrophobicContact CB-CB 4.22Å; M72-I77 HydrophobicContact CB-CG1 3.91Å; M72-I77 HydrophobicContact CE-CB 4.39Å; M72-I77 HydrophobicContact CE-CG2 4.03Å; M72-I77 HydrophobicContact CG-CG1 4.17Å; M72-I77 PolarHBondContact O-N 2.96Å; A75-I77 VanDerWaalsContact C-N 3.32Å; A75-I77 HydrophobicContact CB-CD1 4.39Å; A75-I77 HydrophobicContact CB-CG1 4.34Å; A75-I77 PolarHBondContact O-N 3.49Å; I77-A81 HydrophobicContact CG2-CB 3.72Å; I77-Y102 HydrophobicContact CB-CE1 4.26Å; I77-Y102 HydrophobicContact CG2-CE1 3.97Å; I77-V149 HydrophobicContact CD1-CG2 4.42Å; I77-V149 HydrophobicContact CG2-CG2 3.92Å; I77-I186 HydrophobicContact CD1-CG1 4.47Å
78	P	98.4	Very high	98.4	Very high	72 Å²	72	47 Å²	47	47%	0.468	24%	0.235	S	C	.	.			trans	-58	143.9	180	-25.2	34.4	0	0	0	112.5	K76 D80 A81 Y102	K76-P78 WeakPolarHBondContact O-CD 3.36Å; P78-D80 WeakPolarHBondContact CB-OD1 3.28Å; P78-D80 PolarHBondContact O-N 2.74Å; P78-A81 HydrophobicContact CB-CB 4.4Å; P78-A81 WeakPolarHBondContact O-CB 3.35Å; P78-A81 PolarHBondContact O-N 3.21Å; P78-Y102 WeakPolarHBondContact O-CE1 3.27Å
79	E	98.3	Very high	98.4	Very high	100 Å²	100	47.1 Å²	47.1	47%	0.467	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.7	178.1	-70.5	176.5	-175.2	0	0	113.5	G101 Y102 R103	E79-G101 WeakPolarHBondContact CB-O 3.44Å; E79-Y102 CarbonylContact O-C 3.52Å; E79-Y102 VanDerWaalsContact O-CA 3.31Å; E79-Y102 WeakPolarHBondContact O-CA 2.88Å; E79-R103 PolarHBondContact O-N 3.49Å; E79-R103 IonicContact OE2-CZ 3.98Å; E79-R103 IonicContact OE2-NH1 3.85Å; E79-R103 PolarHBondContact OE2-NH1 2.85Å; E79-R103 IonicContact OE2-NH2 3.98Å
80	D	98.3	Very high	98.4	Very high	105 Å²	105	47.6 Å²	47.6	56%	0.561	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	3.2	175.3	64.6	-25.8	0	0	0	113.5	P78 A82	P78-D80 WeakPolarHBondContact CB-OD1 3.28Å; P78-D80 PolarHBondContact O-N 2.74Å; D80-A82 PolarHBondContact O-N 3.04Å
81	A	98.7	Very high	98.4	Very high	4 Å²	4	42 Å²	42	3%	0.033	22%	0.219	C	C	.	.	S	Bend	trans	-56	135.1	173.5	0	0	0	0	0	110.5	I77 P78 I83 D148	I77-A81 HydrophobicContact CG2-CB 3.72Å; P78-A81 HydrophobicContact CB-CB 4.4Å; P78-A81 WeakPolarHBondContact O-CB 3.35Å; P78-A81 PolarHBondContact O-N 3.21Å; A81-I83 PolarHBondContact O-N 3.47Å; A81-D148 HydrophobicContact CB-CB 3.95Å
82	A	98.8	Very high	98.4	Very high	8 Å²	8	41.3 Å²	41.3	7%	0.066	22%	0.218	C	C	.	.			trans	-72.7	113.2	175.2	0	0	0	0	0	109.4	D80 N104 F147 D148 V149	D80-A82 PolarHBondContact O-N 3.04Å; A82-N104 WeakPolarHBondContact CB-ND2 3.29Å; A82-F147 HydrophobicContact CB-CD1 4.06Å; A82-F147 CarbonylContact O-C 3.49Å; A82-D148 PolarHBondContact N-OD2 2.81Å; A82-D148 PolarHBondContact O-N 3.39Å; A82-V149 PolarHBondContact O-N 2.87Å; A82-V149 VanDerWaalsContact O-N 3.12Å
83	I	98.9	Very high	98.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.8	-176.5	-60.3	156.8	0	0	0	109.7	M72 A81 L97 Y102 N104 L105 T106 V149 I151	M72-I83 HydrophobicContact CE-CD1 3.71Å; M72-I83 HydrophobicContact CE-CG1 4.26Å; A81-I83 PolarHBondContact O-N 3.47Å; I83-L97 HydrophobicContact CD1-CD2 4.39Å; I83-L97 HydrophobicContact CG2-CD1 4.04Å; I83-Y102 HydrophobicContact CD1-CD1 3.46Å; I83-Y102 VanDerWaalsContact CD1-CD1 3.46Å; I83-Y102 HydrophobicContact CD1-CD2 4.44Å; I83-Y102 HydrophobicContact CD1-CE1 4.14Å; I83-Y102 HydrophobicContact CD1-CG 3.66Å; I83-N104 PolarHBondContact N-O 3.21Å; I83-L105 HydrophobicContact CB-CD2 3.88Å; I83-L105 HydrophobicContact CD1-CD2 3.78Å; I83-L105 HydrophobicContact CG1-CD2 4.39Å; I83-L105 HydrophobicContact CG2-CD2 4.38Å; I83-T106 PolarHBondContact O-N 3Å; I83-V149 CarbonylContact C-O 3.55Å; I83-V149 WeakPolarHBondContact CA-O 3.33Å; I83-V149 HydrophobicContact CG1-CB 4.08Å; I83-V149 HydrophobicContact CG1-CG2 4.35Å; I83-V149 HydrophobicContact CG2-CB 4.45Å; I83-I151 HydrophobicContact CG2-CD1 3.81Å; I83-I151 HydrophobicContact CG2-CG1 4.34Å
84	L	98.9	Very high	98.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.4	172.8	-179.8	64.1	0	0	0	110.4	I86 T106 I108 F137 L144 F147 V149 C150 I151 A180	L84-I86 HydrophobicContact CD2-CD1 4.33Å; L84-I86 HydrophobicContact CD2-CG1 3.83Å; L84-I86 HydrophobicContact CG-CG1 3.89Å; L84-T106 CarbonylContact C-O 3.59Å; L84-T106 WeakPolarHBondContact CA-O 3.21Å; L84-T106 HydrophobicContact CD1-CG2 3.9Å; L84-I108 HydrophobicContact CD1-CD1 4.2Å; L84-I108 HydrophobicContact CD1-CG1 4.08Å; L84-I108 HydrophobicContact CD1-CG2 3.96Å; L84-I108 HydrophobicContact CD2-CD1 4.42Å; L84-F137 HydrophobicContact CD2-CE2 4.38Å; L84-L144 HydrophobicContact CD2-CD1 4.29Å; L84-F147 HydrophobicContact CB-CB 4.32Å; L84-F147 HydrophobicContact CB-CD1 3.62Å; L84-F147 HydrophobicContact CB-CD2 4Å; L84-F147 HydrophobicContact CB-CE1 3.83Å; L84-F147 HydrophobicContact CB-CE2 4.2Å; L84-F147 HydrophobicContact CB-CG 3.7Å; L84-F147 HydrophobicContact CB-CZ 4.12Å; L84-F147 HydrophobicContact CD1-CE1 4.33Å; L84-F147 HydrophobicContact CD1-CE2 4.31Å; L84-F147 HydrophobicContact CD1-CZ 4.01Å; L84-F147 HydrophobicContact CD2-CD2 3.99Å; L84-F147 HydrophobicContact CD2-CE2 3.96Å; L84-F147 HydrophobicContact CD2-CZ 4.45Å; L84-F147 HydrophobicContact CG-CE2 4.4Å; L84-F147 HydrophobicContact CG-CZ 4.43Å; L84-V149 PolarHBondContact N-O 3.01Å; L84-C150 CarbonylContact O-C 3.51Å; L84-C150 WeakPolarHBondContact O-CA 3.22Å; L84-I151 PolarHBondContact O-N 3.32Å; L84-A180 HydrophobicContact CD2-CB 4.31Å
85	D	98.9	Very high	98.4	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.027	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	107	168.1	-172.2	28.8	0	0	0	109.1	T88 L94 T106 I108	D85-T88 WeakPolarHBondContact OD2-CA 3.44Å; D85-T88 VanDerWaalsContact OD2-CB 3.31Å; D85-T88 WeakPolarHBondContact OD2-CB 3.37Å; D85-T88 PolarHBondContact OD2-OG1 3.47Å; D85-L94 HydrophobicContact CB-CD2 3.83Å; D85-L94 HydrophobicContact CB-CG 4.32Å; D85-T106 PolarHBondContact N-O 3.25Å; D85-I108 PolarHBondContact O-N 2.77Å
86	I	98.8	Very high	98.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.5	-175.8	-57.8	168	0	0	0	108.3	L84 I108 F137 C150 I151 T155 Y173 L177	L84-I86 HydrophobicContact CD2-CD1 4.33Å; L84-I86 HydrophobicContact CD2-CG1 3.83Å; L84-I86 HydrophobicContact CG-CG1 3.89Å; I86-I108 HydrophobicContact CG1-CD1 4.47Å; I86-I108 HydrophobicContact CG2-CD1 4.37Å; I86-F137 HydrophobicContact CD1-CE1 4.01Å; I86-F137 HydrophobicContact CD1-CE2 4Å; I86-F137 HydrophobicContact CD1-CZ 3.64Å; I86-F137 HydrophobicContact CG1-CE2 4.25Å; I86-F137 HydrophobicContact CG1-CZ 4.36Å; I86-F137 HydrophobicContact CG2-CB 4.19Å; I86-F137 HydrophobicContact CG2-CD1 3.87Å; I86-F137 HydrophobicContact CG2-CD2 4.18Å; I86-F137 HydrophobicContact CG2-CE1 4.27Å; I86-F137 HydrophobicContact CG2-CG 3.8Å; I86-C150 HydrophobicContact CD1-CB 4.11Å; I86-I151 WeakPolarHBondContact CB-O 3.46Å; I86-I151 PolarHBondContact N-O 3.39Å; I86-T155 HydrophobicContact CG2-CG2 4.17Å; I86-T155 PolarHBondContact O-OG1 3.41Å; I86-Y173 HydrophobicContact CG2-CE2 4.25Å; I86-L177 HydrophobicContact CD1-CD1 3.93Å
87	G	98.3	Very high	98.5	Very high	20 Å²	20	20.9 Å²	20.9	21%	0.206	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	58.1	-173.7	0	0	0	0	0	111.5	G89 I108 D109 T155	G87-G89 PolarHBondContact O-N 3.06Å; G87-G89 VanDerWaalsContact O-N 3.15Å; G87-I108 CarbonylContact C-O 3.51Å; G87-I108 WeakPolarHBondContact CA-O 3.26Å; G87-I108 PolarHBondContact N-O 3.21Å; G87-D109 WeakPolarHBondContact CA-OD2 3.37Å; G87-T155 WeakPolarHBondContact CA-OG1 3.14Å
88	T	98.5	Very high	98.5	Very high	9 Å²	9	20.6 Å²	20.6	6%	0.055	12%	0.122	C	C	.	.			trans	-65.4	-17.3	-170.4	-162.7	0	0	0	0	113.8	D85 N90 G91 L94 I108 D109 A118 V132	D85-T88 WeakPolarHBondContact OD2-CA 3.44Å; D85-T88 VanDerWaalsContact OD2-CB 3.31Å; D85-T88 WeakPolarHBondContact OD2-CB 3.37Å; D85-T88 PolarHBondContact OD2-OG1 3.47Å; T88-N90 PolarHBondContact O-N 3.29Å; T88-G91 PolarHBondContact O-N 3.42Å; T88-L94 VanDerWaalsContact OG1-CD1 3.26Å; T88-L94 WeakPolarHBondContact OG1-CD1 3.44Å; T88-I108 PolarHBondContact N-O 3.08Å; T88-D109 HydrophobicContact CG2-CB 4.39Å; T88-A118 HydrophobicContact CG2-CB 4.35Å; T88-V132 HydrophobicContact CG2-CG1 4.23Å
89	G	98.3	Very high	98.5	Very high	6 Å²	6	22.6 Å²	22.6	6%	0.062	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	-118.6	178.7	0	0	0	0	0	112.4	Y42 G87 G91 D109 S114	Y42-G89 VanDerWaalsContact OH-CA 3.23Å; Y42-G89 WeakPolarHBondContact OH-CA 3.32Å; G87-G89 PolarHBondContact O-N 3.06Å; G87-G89 VanDerWaalsContact O-N 3.15Å; G89-G91 PolarHBondContact O-N 3.1Å; G89-D109 PolarHBondContact N-OD2 3.42Å; G89-S114 WeakPolarHBondContact CA-OG 3.47Å; G89-S114 PolarHBondContact O-OG 3.12Å
90	N	97.9	Very high	98.4	Very high	11 Å²	11	21.2 Å²	21.2	6%	0.059	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.3	178.1	69	2.3	0	0	0	114.5	V55 T88 A92 L117 A118	V55-N90 WeakPolarHBondContact O-CB 3.47Å; V55-N90 PolarHBondContact O-ND2 3.21Å; T88-N90 PolarHBondContact O-N 3.29Å; N90-A92 VanDerWaalsContact C-N 3.3Å; N90-A92 PolarHBondContact O-N 3.12Å; N90-A92 VanDerWaalsContact OD1-CB 3.24Å; N90-A92 WeakPolarHBondContact OD1-CB 3.3Å; N90-A92 PolarHBondContact OD1-N 3.38Å; N90-L117 HydrophobicContact CB-CD2 3.71Å; N90-L117 HydrophobicContact CB-CG 4.05Å; N90-A118 WeakPolarHBondContact O-CA 3.43Å
91	G	98.3	Very high	98.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.102	C	C	.	.			trans	75.7	9.5	178.4	0	0	0	0	0	115.2	T88 G89 F93 L94 V95	T88-G91 PolarHBondContact O-N 3.42Å; G89-G91 PolarHBondContact O-N 3.1Å; G91-F93 PolarHBondContact O-N 3.29Å; G91-L94 WeakPolarHBondContact O-CB 3.45Å; G91-L94 PolarHBondContact O-N 3.43Å; G91-L94 VanDerWaalsContact O-N 3.08Å; G91-V95 PolarHBondContact O-N 3.01Å; G91-V95 VanDerWaalsContact O-N 3.13Å
92	A	98.1	Very high	98.4	Very high	10 Å²	10	17.8 Å²	17.8	8%	0.083	10%	0.103	C	C	.	.	H	α-helix	trans	-57.2	-35.3	-178.9	0	0	0	0	0	112.8	I58 M65 N90 V95 E96	I58-A92 HydrophobicContact CD1-CB 3.99Å; I58-A92 HydrophobicContact CG1-CB 4.06Å; M65-A92 HydrophobicContact CE-CB 4.38Å; M65-A92 HydrophobicContact SD-CB 4.38Å; N90-A92 VanDerWaalsContact C-N 3.3Å; N90-A92 PolarHBondContact O-N 3.12Å; N90-A92 VanDerWaalsContact OD1-CB 3.24Å; N90-A92 WeakPolarHBondContact OD1-CB 3.3Å; N90-A92 PolarHBondContact OD1-N 3.38Å; A92-V95 WeakPolarHBondContact O-CB 3.42Å; A92-V95 PolarHBondContact O-N 2.6Å; A92-E96 PolarHBondContact O-N 2.76Å; A92-E96 VanDerWaalsContact O-N 3.08Å
93	F	98.5	Very high	98.4	Very high	6 Å²	6	24.4 Å²	24.4	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-71.6	-35.5	178.6	-156	174.4	0	0	0	112.2	M65 V68 L69 G91 V95 E96 L97 I151	M65-F93 HydrophobicContact CB-CD2 3.77Å; M65-F93 HydrophobicContact CB-CE1 4.5Å; M65-F93 HydrophobicContact CB-CE2 3.82Å; M65-F93 HydrophobicContact CB-CG 4.21Å; M65-F93 HydrophobicContact CB-CZ 4.21Å; M65-F93 HydrophobicContact CG-CB 4.22Å; M65-F93 HydrophobicContact CG-CD1 4.06Å; M65-F93 HydrophobicContact CG-CD2 3.88Å; M65-F93 HydrophobicContact CG-CE1 4.4Å; M65-F93 HydrophobicContact CG-CE2 4.32Å; M65-F93 HydrophobicContact CG-CG 3.8Å; M65-F93 WeakPolarHBondContact SD-CA 3.44Å; M65-F93 HydrophobicContact SD-CB 3.56Å; M65-F93 VanDerWaalsContact SD-CB 3.56Å; M65-F93 HydrophobicContact SD-CD2 3.94Å; M65-F93 HydrophobicContact SD-CG 3.77Å; V68-F93 HydrophobicContact CB-CE1 4.4Å; V68-F93 HydrophobicContact CB-CZ 3.8Å; V68-F93 HydrophobicContact CG1-CE1 4.42Å; V68-F93 HydrophobicContact CG1-CZ 3.83Å; V68-F93 HydrophobicContact CG2-CZ 4.49Å; L69-F93 HydrophobicContact CD1-CE2 4.16Å; L69-F93 HydrophobicContact CD2-CE2 4.42Å; L69-F93 HydrophobicContact CG-CE2 3.96Å; G91-F93 PolarHBondContact O-N 3.29Å; F93-V95 VanDerWaalsContact C-N 3.3Å; F93-V95 PolarHBondContact O-N 2.88Å; F93-E96 HydrophobicContact CD2-CB 4.46Å; F93-E96 PolarHBondContact O-N 3.2Å; F93-L97 HydrophobicContact CD2-CD1 4.15Å; F93-L97 HydrophobicContact CD2-CG 3.94Å; F93-L97 HydrophobicContact CE2-CD1 4.31Å; F93-L97 HydrophobicContact CE2-CD2 4.17Å; F93-L97 HydrophobicContact CE2-CG 3.93Å; F93-L97 WeakPolarHBondContact O-CB 3.02Å; F93-L97 VanDerWaalsContact O-CG 3.3Å; F93-L97 WeakPolarHBondContact O-CG 3.32Å; F93-L97 PolarHBondContact O-N 3.45Å; F93-I151 HydrophobicContact CD1-CG2 3.81Å; F93-I151 HydrophobicContact CE1-CD1 4.09Å; F93-I151 HydrophobicContact CE1-CG2 3.37Å; F93-I151 HydrophobicContact CZ-CD1 4.03Å; F93-I151 HydrophobicContact CZ-CG2 4.27Å
94	L	98.8	Very high	98.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-40	172.7	-62	169.3	0	0	0	111.8	D85 T88 G91 L97 A98 L105 L122 V130 V132	D85-L94 HydrophobicContact CB-CD2 3.83Å; D85-L94 HydrophobicContact CB-CG 4.32Å; T88-L94 VanDerWaalsContact OG1-CD1 3.26Å; T88-L94 WeakPolarHBondContact OG1-CD1 3.44Å; G91-L94 WeakPolarHBondContact O-CB 3.45Å; G91-L94 PolarHBondContact O-N 3.43Å; G91-L94 VanDerWaalsContact O-N 3.08Å; L94-L97 PolarHBondContact O-N 3.42Å; L94-A98 WeakPolarHBondContact O-CB 3.38Å; L94-A98 PolarHBondContact O-N 3Å; L94-L105 HydrophobicContact CD2-CB 4.18Å; L94-L105 WeakPolarHBondContact O-CD1 3.49Å; L94-L122 HydrophobicContact CB-CD2 4.06Å; L94-L122 HydrophobicContact CD1-CD1 4.21Å; L94-V130 HydrophobicContact CB-CG1 4.12Å; L94-V130 HydrophobicContact CD1-CG1 3.91Å; L94-V130 HydrophobicContact CD2-CG1 4.26Å; L94-V130 HydrophobicContact CG-CG1 4.35Å; L94-V132 HydrophobicContact CD1-CG2 4.02Å
95	V	98.4	Very high	98.4	Very high	7 Å²	7	28.2 Å²	28.2	4%	0.042	15%	0.146	C	C	.	.	H	α-helix	trans	-58.7	-49.7	173.9	172.5	0	0	0	0	110.3	G91 A92 F93 A98 K99 V121 L122 E125 L127	G91-V95 PolarHBondContact O-N 3.01Å; G91-V95 VanDerWaalsContact O-N 3.13Å; A92-V95 WeakPolarHBondContact O-CB 3.42Å; A92-V95 PolarHBondContact O-N 2.6Å; F93-V95 VanDerWaalsContact C-N 3.3Å; F93-V95 PolarHBondContact O-N 2.88Å; V95-A98 PolarHBondContact O-N 3.01Å; V95-K99 HydrophobicContact CG1-CD 3.95Å; V95-K99 HydrophobicContact CG1-CG 4.47Å; V95-K99 WeakPolarHBondContact O-CG 3.32Å; V95-K99 PolarHBondContact O-N 2.84Å; V95-V121 HydrophobicContact CG2-CG1 3.97Å; V95-L122 HydrophobicContact CG2-CD2 3.84Å; V95-L122 HydrophobicContact CG2-CG 4.44Å; V95-E125 HydrophobicContact CG1-CB 4.4Å; V95-E125 HydrophobicContact CG1-CG 3.85Å; V95-E125 HydrophobicContact CG2-CG 4.12Å; V95-L127 HydrophobicContact CB-CD1 4.24Å; V95-L127 HydrophobicContact CG1-CD1 4.21Å; V95-L127 HydrophobicContact CG2-CD1 4.15Å
96	E	98.3	Very high	98.4	Very high	47 Å²	47	28.5 Å²	28.5	22%	0.22	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-40.7	-179.3	-72.3	-55.1	123.4	0	0	112.4	M65 L69 A92 F93 A98 K99 H100	M65-E96 HydrophobicContact CE-CG 3.93Å; M65-E96 HydrophobicContact SD-CG 4.48Å; L69-E96 HydrophobicContact CD1-CB 3.95Å; A92-E96 PolarHBondContact O-N 2.76Å; A92-E96 VanDerWaalsContact O-N 3.08Å; F93-E96 HydrophobicContact CD2-CB 4.46Å; F93-E96 PolarHBondContact O-N 3.2Å; E96-A98 VanDerWaalsContact C-N 3.33Å; E96-A98 PolarHBondContact O-N 3.24Å; E96-K99 PolarHBondContact O-N 3.49Å; E96-K99 IonicContact OE1-NZ 2.7Å; E96-H100 PolarHBondContact O-N 3.49Å; E96-H100 VanDerWaalsContact O-N 3.09Å; E96-H100 PolarHBondContact O-ND1 2.89Å; E96-H100 IonicContact OE2-CE1 3.32Å
97	L	98.6	Very high	98.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.3	-46.1	173.1	-73.7	163.2	0	0	0	111.3	L69 M72 I83 F93 L94 H100 G101 Y102 L105 I151	L69-L97 HydrophobicContact CD2-CD2 3.7Å; L69-L97 HydrophobicContact CD2-CG 4.35Å; M72-L97 HydrophobicContact CE-CD2 4.04Å; M72-L97 HydrophobicContact SD-CD2 4.02Å; I83-L97 HydrophobicContact CD1-CD2 4.39Å; I83-L97 HydrophobicContact CG2-CD1 4.04Å; F93-L97 HydrophobicContact CD2-CD1 4.15Å; F93-L97 HydrophobicContact CD2-CG 3.94Å; F93-L97 HydrophobicContact CE2-CD1 4.31Å; F93-L97 HydrophobicContact CE2-CD2 4.17Å; F93-L97 HydrophobicContact CE2-CG 3.93Å; F93-L97 WeakPolarHBondContact O-CB 3.02Å; F93-L97 VanDerWaalsContact O-CG 3.3Å; F93-L97 WeakPolarHBondContact O-CG 3.32Å; F93-L97 PolarHBondContact O-N 3.45Å; L94-L97 PolarHBondContact O-N 3.42Å; L97-H100 CarbonylContact O-C 3.49Å; L97-H100 PolarHBondContact O-N 2.87Å; L97-G101 PolarHBondContact O-N 2.8Å; L97-Y102 HydrophobicContact CB-CD2 4.34Å; L97-Y102 HydrophobicContact CD2-CD2 3.8Å; L97-Y102 HydrophobicContact CD2-CE2 4.21Å; L97-Y102 HydrophobicContact CD2-CG 4.43Å; L97-Y102 WeakPolarHBondContact O-CB 3.23Å; L97-Y102 WeakPolarHBondContact O-CD2 3.46Å; L97-Y102 PolarHBondContact O-N 3.19Å; L97-Y102 VanDerWaalsContact O-N 3.15Å; L97-L105 HydrophobicContact CB-CD1 3.8Å; L97-L105 HydrophobicContact CB-CD2 3.94Å; L97-L105 HydrophobicContact CD1-CD2 4.2Å; L97-I151 HydrophobicContact CD1-CD1 4.09Å; L97-I151 HydrophobicContact CD2-CD1 4.44Å
98	A	98.5	Very high	98.4	Very high	22 Å²	22	27.6 Å²	27.6	18%	0.182	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-42.6	179	0	0	0	0	0	112.3	L94 V95 E96 H100 G101 L105 L127	L94-A98 WeakPolarHBondContact O-CB 3.38Å; L94-A98 PolarHBondContact O-N 3Å; V95-A98 PolarHBondContact O-N 3.01Å; E96-A98 VanDerWaalsContact C-N 3.33Å; E96-A98 PolarHBondContact O-N 3.24Å; A98-H100 PolarHBondContact O-N 2.86Å; A98-G101 PolarHBondContact O-N 2.64Å; A98-L105 HydrophobicContact CB-CD1 3.84Å; A98-L127 HydrophobicContact CB-CD1 3.66Å; A98-L127 HydrophobicContact CB-CD2 3.75Å; A98-L127 HydrophobicContact CB-CG 4.31Å
99	K	97.8	Very high	98.4	Very high	115 Å²	115	27.6 Å²	27.6	50%	0.5	14%	0.138	S	C	.	.	H	α-helix	trans	-60.5	-27.6	175	-75.7	175.7	178	169.3	0	112.8	V95 E96 G101 E125	V95-K99 HydrophobicContact CG1-CD 3.95Å; V95-K99 HydrophobicContact CG1-CG 4.47Å; V95-K99 WeakPolarHBondContact O-CG 3.32Å; V95-K99 PolarHBondContact O-N 2.84Å; E96-K99 PolarHBondContact O-N 3.49Å; E96-K99 IonicContact OE1-NZ 2.7Å; K99-G101 VanDerWaalsContact C-N 3.32Å; K99-E125 WeakPolarHBondContact CE-OE2 2.99Å; K99-E125 IonicContact NZ-OE2 3.26Å; K99-E125 PolarHBondContact NZ-OE2 2.78Å
100	H	98.1	Very high	98.3	Very high	71 Å²	71	30 Å²	30	33%	0.329	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	9.5	175.2	-70.2	87.5	0	0	0	114.1	L69 Q73 E96 L97 A98 Y102	L69-H100 HydrophobicContact CD2-CB 4.1Å; Q73-H100 PolarHBondContact NE2-CD2 2.85Å; Q73-H100 VanDerWaalsContact NE2-CD2 3.3Å; E96-H100 PolarHBondContact O-N 3.49Å; E96-H100 VanDerWaalsContact O-N 3.09Å; E96-H100 PolarHBondContact O-ND1 2.89Å; E96-H100 IonicContact OE2-CE1 3.32Å; L97-H100 CarbonylContact O-C 3.49Å; L97-H100 PolarHBondContact O-N 2.87Å; A98-H100 PolarHBondContact O-N 2.86Å; H100-Y102 HydrophobicContact CB-CD2 4.37Å; H100-Y102 HydrophobicContact CB-CE2 4.42Å
101	G	97.8	Very high	98.3	Very high	25 Å²	25	29.5 Å²	29.5	26%	0.258	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.3	-2.5	169.9	0	0	0	0	0	115.3	E79 L97 A98 K99 R103	E79-G101 WeakPolarHBondContact CB-O 3.44Å; L97-G101 PolarHBondContact O-N 2.8Å; A98-G101 PolarHBondContact O-N 2.64Å; K99-G101 VanDerWaalsContact C-N 3.32Å; G101-R103 WeakPolarHBondContact O-CG 3.46Å; G101-R103 PolarHBondContact O-NH1 2.84Å
102	Y	98.6	Very high	98.3	Very high	11 Å²	11	32.1 Å²	32.1	4%	0.043	16%	0.16	C	C	.	.			trans	-71.9	131.1	176.8	-64.4	-75.3	0	0	0	111.2	L69 M72 I77 P78 E79 I83 L97 H100	L69-Y102 HydrophobicContact CD2-CE2 4.21Å; M72-Y102 WeakPolarHBondContact CB-OH 3.36Å; M72-Y102 HydrophobicContact CE-CE1 4.01Å; M72-Y102 HydrophobicContact CE-CE2 4.1Å; I77-Y102 HydrophobicContact CB-CE1 4.26Å; I77-Y102 HydrophobicContact CG2-CE1 3.97Å; P78-Y102 WeakPolarHBondContact O-CE1 3.27Å; E79-Y102 CarbonylContact O-C 3.52Å; E79-Y102 VanDerWaalsContact O-CA 3.31Å; E79-Y102 WeakPolarHBondContact O-CA 2.88Å; I83-Y102 HydrophobicContact CD1-CD1 3.46Å; I83-Y102 VanDerWaalsContact CD1-CD1 3.46Å; I83-Y102 HydrophobicContact CD1-CD2 4.44Å; I83-Y102 HydrophobicContact CD1-CE1 4.14Å; I83-Y102 HydrophobicContact CD1-CG 3.66Å; L97-Y102 HydrophobicContact CB-CD2 4.34Å; L97-Y102 HydrophobicContact CD2-CD2 3.8Å; L97-Y102 HydrophobicContact CD2-CE2 4.21Å; L97-Y102 HydrophobicContact CD2-CG 4.43Å; L97-Y102 WeakPolarHBondContact O-CB 3.23Å; L97-Y102 WeakPolarHBondContact O-CD2 3.46Å; L97-Y102 PolarHBondContact O-N 3.19Å; L97-Y102 VanDerWaalsContact O-N 3.15Å; H100-Y102 HydrophobicContact CB-CD2 4.37Å; H100-Y102 HydrophobicContact CB-CE2 4.42Å
103	R	98	Very high	98.3	Very high	148 Å²	148	31.8 Å²	31.8	56%	0.558	16%	0.158	S	C	*	.			trans	-114	-23.4	-169.5	-64.6	-178.1	-64.2	-82.2	0.6	114.8	E79 G101 L105	E79-R103 PolarHBondContact O-N 3.49Å; E79-R103 IonicContact OE2-CZ 3.98Å; E79-R103 IonicContact OE2-NH1 3.85Å; E79-R103 PolarHBondContact OE2-NH1 2.85Å; E79-R103 IonicContact OE2-NH2 3.98Å; G101-R103 WeakPolarHBondContact O-CG 3.46Å; G101-R103 PolarHBondContact O-NH1 2.84Å; R103-L105 PolarHBondContact O-N 2.81Å
104	N	98.6	Very high	98.3	Very high	77 Å²	77	31.5 Å²	31.5	41%	0.412	16%	0.156	S	C	.	.			trans	-103.6	74.6	-177.2	-171.4	3.1	0	0	0	110	A82 I83	A82-N104 WeakPolarHBondContact CB-ND2 3.29Å; I83-N104 PolarHBondContact N-O 3.21Å
105	L	98.8	Very high	98.3	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.1	-170.1	-58.7	-177.2	0	0	0	111	I83 L94 L97 A98 R103 V130 T131	I83-L105 HydrophobicContact CB-CD2 3.88Å; I83-L105 HydrophobicContact CD1-CD2 3.78Å; I83-L105 HydrophobicContact CG1-CD2 4.39Å; I83-L105 HydrophobicContact CG2-CD2 4.38Å; L94-L105 HydrophobicContact CD2-CB 4.18Å; L94-L105 WeakPolarHBondContact O-CD1 3.49Å; L97-L105 HydrophobicContact CB-CD1 3.8Å; L97-L105 HydrophobicContact CB-CD2 3.94Å; L97-L105 HydrophobicContact CD1-CD2 4.2Å; A98-L105 HydrophobicContact CB-CD1 3.84Å; R103-L105 PolarHBondContact O-N 2.81Å; L105-V130 HydrophobicContact CB-CG1 3.96Å; L105-V130 HydrophobicContact CB-CG2 4.21Å; L105-V130 HydrophobicContact CD1-CG2 4.08Å; L105-T131 PolarHBondContact O-N 2.87Å
106	T	98.8	Very high	98.4	Very high	12 Å²	12	35.3 Å²	35.3	7%	0.074	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125.7	171.1	-60.4	0	0	0	0	110	I83 L84 D85 I108 T131 F147	I83-T106 PolarHBondContact O-N 3Å; L84-T106 CarbonylContact C-O 3.59Å; L84-T106 WeakPolarHBondContact CA-O 3.21Å; L84-T106 HydrophobicContact CD1-CG2 3.9Å; D85-T106 PolarHBondContact N-O 3.25Å; T106-I108 HydrophobicContact CG2-CG2 4.33Å; T106-T131 CarbonylContact C-O 3.35Å; T106-T131 VanDerWaalsContact CA-O 3.23Å; T106-T131 WeakPolarHBondContact CA-O 3.27Å; T106-T131 HydrophobicContact CG2-CG2 4.24Å; T106-F147 HydrophobicContact CG2-CZ 4.31Å
107	G	98.8	Very high	98.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	144.5	165.4	0	0	0	0	0	111.6	T131 V132 K133	G107-T131 PolarHBondContact N-O 2.93Å; G107-V132 CarbonylContact O-C 3.6Å; G107-V132 VanDerWaalsContact O-CA 3.3Å; G107-V132 WeakPolarHBondContact O-CA 3.32Å; G107-K133 PolarHBondContact O-N 3.16Å
108	I	98.8	Very high	98.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	145	171	61.2	173.3	0	0	0	111	L84 D85 I86 G87 T88 T106 K133 F137 L144	L84-I108 HydrophobicContact CD1-CD1 4.2Å; L84-I108 HydrophobicContact CD1-CG1 4.08Å; L84-I108 HydrophobicContact CD1-CG2 3.96Å; L84-I108 HydrophobicContact CD2-CD1 4.42Å; D85-I108 PolarHBondContact O-N 2.77Å; I86-I108 HydrophobicContact CG1-CD1 4.47Å; I86-I108 HydrophobicContact CG2-CD1 4.37Å; G87-I108 CarbonylContact C-O 3.51Å; G87-I108 WeakPolarHBondContact CA-O 3.26Å; G87-I108 PolarHBondContact N-O 3.21Å; T88-I108 PolarHBondContact N-O 3.08Å; T106-I108 HydrophobicContact CG2-CG2 4.33Å; I108-K133 WeakPolarHBondContact CA-O 3.44Å; I108-K133 HydrophobicContact CG2-CB 4.35Å; I108-F137 HydrophobicContact CD1-CB 4.13Å; I108-F137 HydrophobicContact CD1-CD2 3.5Å; I108-F137 VanDerWaalsContact CD1-CD2 3.5Å; I108-F137 HydrophobicContact CD1-CE2 4.3Å; I108-F137 HydrophobicContact CD1-CG 4.17Å; I108-L144 HydrophobicContact CD1-CD1 3.56Å; I108-L144 HydrophobicContact CG2-CD2 4.36Å
109	D	98.6	Very high	98.4	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.043	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	150.8	167.4	-155.9	-72.4	0	0	0	109.1	G87 T88 G89 S111 S114 V115 K133 E134 T135	G87-D109 WeakPolarHBondContact CA-OD2 3.37Å; T88-D109 HydrophobicContact CG2-CB 4.39Å; G89-D109 PolarHBondContact N-OD2 3.42Å; D109-S111 PolarHBondContact O-N 3.39Å; D109-S111 WeakPolarHBondContact OD1-CB 3.43Å; D109-S111 PolarHBondContact OD1-N 3.11Å; D109-S111 VanDerWaalsContact OD1-N 3.11Å; D109-S114 WeakPolarHBondContact CB-OG 3.47Å; D109-S114 PolarHBondContact OD2-OG 3.2Å; D109-V115 HydrophobicContact CB-CG2 4.24Å; D109-K133 PolarHBondContact N-O 3.04Å; D109-E134 CarbonylContact O-C 3.58Å; D109-E134 VanDerWaalsContact O-CA 3.27Å; D109-E134 WeakPolarHBondContact O-CA 3.43Å; D109-T135 CarbonylContact C-O 3.52Å; D109-T135 PolarHBondContact O-N 2.9Å
110	Y	97.1	Very high	98.4	Very high	58 Å²	58	34.8 Å²	34.8	23%	0.227	17%	0.165	C	C	.	.	S	Bend	trans	-79.9	-4.9	179.4	66.2	3	0	0	0	113.7	K35 W38 T135	K35-Y110 HydrophobicContact CB-CE2 4.33Å; K35-Y110 WeakPolarHBondContact CE-O 3.31Å; K35-Y110 HydrophobicContact CG-CE1 4.35Å; K35-Y110 HydrophobicContact CG-CE2 4.41Å; K35-Y110 PolarHBondContact NZ-O 3.13Å; W38-Y110 HydrophobicContact CB-CE1 3.95Å; W38-Y110 HydrophobicContact CG-CE1 4.37Å; Y110-T135 PolarHBondContact N-O 3.02Å
111	S	98.1	Very high	98.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.151	C	C	.	.			trans	-105.9	117.3	-171.3	167.3	0	0	0	0	108.5	E39 D109 A113 S114 V115	E39-S111 WeakPolarHBondContact OE2-CA 3.36Å; E39-S111 WeakPolarHBondContact OE2-CB 3.26Å; E39-S111 PolarHBondContact OE2-OG 2.94Å; D109-S111 PolarHBondContact O-N 3.39Å; D109-S111 WeakPolarHBondContact OD1-CB 3.43Å; D109-S111 PolarHBondContact OD1-N 3.11Å; D109-S111 VanDerWaalsContact OD1-N 3.11Å; S111-A113 PolarHBondContact O-N 3.33Å; S111-A113 PolarHBondContact OG-N 3.4Å; S111-S114 PolarHBondContact O-N 3.47Å; S111-S114 PolarHBondContact OG-N 2.95Å; S111-V115 WeakPolarHBondContact O-CG2 3.39Å; S111-V115 PolarHBondContact O-N 3.32Å; S111-V115 VanDerWaalsContact O-N 3.07Å
112	P	98.2	Very high	98.5	Very high	55 Å²	55	30.6 Å²	30.6	36%	0.357	14%	0.14	S	C	.	.	H	α-helix	trans	-53.5	-41.2	172.9	-25.1	31.3	0	0	0	112.8	E39 V115 E116	E39-P112 WeakPolarHBondContact OE2-CD 3.36Å; P112-V115 PolarHBondContact O-N 2.9Å; P112-E116 PolarHBondContact O-N 3.28Å
113	A	98.3	Very high	98.5	Very high	3 Å²	3	37.3 Å²	37.3	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-63.1	-43.1	178.6	0	0	0	0	0	112.5	E39 Q43 S111 E116 L117	E39-A113 WeakPolarHBondContact OE1-CB 3.36Å; E39-A113 PolarHBondContact OE1-N 3.27Å; Q43-A113 HydrophobicContact CB-CB 4.5Å; S111-A113 PolarHBondContact O-N 3.33Å; S111-A113 PolarHBondContact OG-N 3.4Å; A113-E116 PolarHBondContact O-N 2.75Å; A113-L117 WeakPolarHBondContact O-CB 3.39Å; A113-L117 PolarHBondContact O-N 3.28Å
114	S	98.5	Very high	98.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.8	-47.1	173.3	156.7	0	0	0	0	111.5	Y42 G89 D109 S111 E116 L117 A118	Y42-S114 VanDerWaalsContact CD2-CB 3.46Å; G89-S114 WeakPolarHBondContact CA-OG 3.47Å; G89-S114 PolarHBondContact O-OG 3.12Å; D109-S114 WeakPolarHBondContact CB-OG 3.47Å; D109-S114 PolarHBondContact OD2-OG 3.2Å; S111-S114 PolarHBondContact O-N 3.47Å; S111-S114 PolarHBondContact OG-N 2.95Å; S114-E116 VanDerWaalsContact C-N 3.3Å; S114-E116 PolarHBondContact O-N 3.06Å; S114-L117 WeakPolarHBondContact O-CB 3.38Å; S114-L117 PolarHBondContact O-N 3.04Å; S114-L117 VanDerWaalsContact O-N 3.16Å; S114-A118 WeakPolarHBondContact O-CB 3.24Å; S114-A118 PolarHBondContact O-N 3.45Å
115	V	98.7	Very high	98.4	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-40.8	-179.1	170.3	0	0	0	0	111.2	D109 S111 P112 R119 V132 K133 E134	D109-V115 HydrophobicContact CB-CG2 4.24Å; S111-V115 WeakPolarHBondContact O-CG2 3.39Å; S111-V115 PolarHBondContact O-N 3.32Å; S111-V115 VanDerWaalsContact O-N 3.07Å; P112-V115 PolarHBondContact O-N 2.9Å; V115-R119 VanDerWaalsContact CG1-CZ 3.42Å; V115-R119 WeakPolarHBondContact O-CB 3.44Å; V115-R119 WeakPolarHBondContact O-CD 3.4Å; V115-R119 VanDerWaalsContact O-CG 3.22Å; V115-R119 WeakPolarHBondContact O-CG 3.26Å; V115-R119 PolarHBondContact O-N 3.3Å; V115-R119 VanDerWaalsContact O-N 3.12Å; V115-V132 HydrophobicContact CB-CG1 4.42Å; V115-V132 HydrophobicContact CG1-CG1 4.05Å; V115-V132 HydrophobicContact CG2-CG1 4.37Å; V115-K133 WeakPolarHBondContact CG2-O 3.25Å; V115-E134 HydrophobicContact CG2-CB 4.12Å
116	E	98.6	Very high	98.4	Very high	83 Å²	83	37.2 Å²	37.2	39%	0.388	20%	0.2	S	C	.	.	H	α-helix	trans	-65.6	-45.2	174.5	-168.7	-176.4	147.9	0	0	111.6	L46 K50 P112 A113 S114 R119 N120	L46-E116 HydrophobicContact CD1-CB 4.45Å; L46-E116 HydrophobicContact CD1-CG 4.14Å; L46-E116 HydrophobicContact CD2-CB 4.11Å; L46-E116 HydrophobicContact CD2-CG 4.14Å; K50-E116 WeakPolarHBondContact CE-OE1 3.29Å; K50-E116 IonicContact NZ-OE1 2.77Å; K50-E116 PolarHBondContact NZ-OE1 2.74Å; P112-E116 PolarHBondContact O-N 3.28Å; A113-E116 PolarHBondContact O-N 2.75Å; S114-E116 VanDerWaalsContact C-N 3.3Å; S114-E116 PolarHBondContact O-N 3.06Å; E116-R119 PolarHBondContact O-N 3.49Å; E116-N120 WeakPolarHBondContact O-CB 3.32Å; E116-N120 PolarHBondContact O-N 3.41Å; E116-N120 PolarHBondContact O-ND2 3.42Å
117	L	98.7	Very high	98.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-53.5	176.7	174.2	59.6	0	0	0	111.2	Y42 E45 L46 F49 N90 A113 S114 R119 N120 V121	Y42-L117 HydrophobicContact CD1-CD2 4.37Å; E45-L117 HydrophobicContact CB-CD2 3.67Å; L46-L117 HydrophobicContact CB-CB 4.37Å; L46-L117 HydrophobicContact CD1-CB 4.18Å; F49-L117 HydrophobicContact CB-CD1 3.7Å; F49-L117 HydrophobicContact CD1-CD1 4.48Å; F49-L117 HydrophobicContact CD2-CD1 4.42Å; F49-L117 HydrophobicContact CG-CD1 3.93Å; N90-L117 HydrophobicContact CB-CD2 3.71Å; N90-L117 HydrophobicContact CB-CG 4.05Å; A113-L117 WeakPolarHBondContact O-CB 3.39Å; A113-L117 PolarHBondContact O-N 3.28Å; S114-L117 WeakPolarHBondContact O-CB 3.38Å; S114-L117 PolarHBondContact O-N 3.04Å; S114-L117 VanDerWaalsContact O-N 3.16Å; L117-R119 VanDerWaalsContact C-N 3.32Å; L117-R119 PolarHBondContact O-N 3.37Å; L117-N120 WeakPolarHBondContact O-CA 3.31Å; L117-N120 WeakPolarHBondContact O-CB 3.4Å; L117-N120 PolarHBondContact O-N 3.2Å; L117-V121 HydrophobicContact CD1-CG2 3.92Å; L117-V121 HydrophobicContact CG-CG2 4.39Å; L117-V121 WeakPolarHBondContact O-CG2 3.23Å; L117-V121 PolarHBondContact O-N 3.04Å
118	A	98.7	Very high	98	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.9	-43.7	179.1	0	0	0	0	0	112.5	T88 N90 S114 N120 V121 L122 V132	T88-A118 HydrophobicContact CG2-CB 4.35Å; N90-A118 WeakPolarHBondContact O-CA 3.43Å; S114-A118 WeakPolarHBondContact O-CB 3.24Å; S114-A118 PolarHBondContact O-N 3.45Å; A118-N120 VanDerWaalsContact C-N 3.32Å; A118-N120 PolarHBondContact O-N 3.03Å; A118-V121 PolarHBondContact O-N 3.48Å; A118-L122 WeakPolarHBondContact O-CB 3.4Å; A118-L122 WeakPolarHBondContact O-CD1 3.34Å; A118-L122 VanDerWaalsContact O-CG 3.22Å; A118-L122 WeakPolarHBondContact O-CG 3.22Å; A118-L122 PolarHBondContact O-N 2.86Å; A118-V132 HydrophobicContact CB-CG1 4.1Å; A118-V132 HydrophobicContact CB-CG2 4.49Å
119	R	98.7	Very high	97.8	Very high	129 Å²	129	50.6 Å²	50.6	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-39	175.3	-73.4	171.2	179.6	164.7	0.9	112.1	V115 E116 L117 K123 V132	V115-R119 VanDerWaalsContact CG1-CZ 3.42Å; V115-R119 WeakPolarHBondContact O-CB 3.44Å; V115-R119 WeakPolarHBondContact O-CD 3.4Å; V115-R119 VanDerWaalsContact O-CG 3.22Å; V115-R119 WeakPolarHBondContact O-CG 3.26Å; V115-R119 PolarHBondContact O-N 3.3Å; V115-R119 VanDerWaalsContact O-N 3.12Å; E116-R119 PolarHBondContact O-N 3.49Å; L117-R119 VanDerWaalsContact C-N 3.32Å; L117-R119 PolarHBondContact O-N 3.37Å; R119-K123 WeakPolarHBondContact O-CB 3.21Å; R119-K123 PolarHBondContact O-N 2.85Å; R119-V132 HydrophobicContact CG-CB 3.97Å; R119-V132 HydrophobicContact CG-CG2 4.28Å; R119-V132 PolarHBondContact NE-O 3.15Å; R119-V132 PolarHBondContact NH2-O 2.87Å
120	N	98.4	Very high	97.8	Very high	43 Å²	43	51.3 Å²	51.3	23%	0.23	28%	0.28	C	S	.	.	H	α-helix	trans	-68.8	-42.1	178.3	-72.4	-19	0	0	0	111.8	L46 F49 E116 L117 A118 K123 A124	L46-N120 WeakPolarHBondContact CD1-ND2 3.45Å; F49-N120 HydrophobicContact CD1-CB 3.93Å; F49-N120 HydrophobicContact CE1-CB 3.63Å; E116-N120 WeakPolarHBondContact O-CB 3.32Å; E116-N120 PolarHBondContact O-N 3.41Å; E116-N120 PolarHBondContact O-ND2 3.42Å; L117-N120 WeakPolarHBondContact O-CA 3.31Å; L117-N120 WeakPolarHBondContact O-CB 3.4Å; L117-N120 PolarHBondContact O-N 3.2Å; A118-N120 VanDerWaalsContact C-N 3.32Å; A118-N120 PolarHBondContact O-N 3.03Å; N120-K123 PolarHBondContact O-N 3.33Å; N120-A124 WeakPolarHBondContact O-CB 3.24Å; N120-A124 PolarHBondContact O-N 3.45Å
121	V	98.6	Very high	97.8	Very high	6 Å²	6	51.4 Å²	51.4	4%	0.036	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-52.1	174.4	172.9	0	0	0	0	110.4	F49 V55 V95 L117 A118 K123 A124 E125	F49-V121 HydrophobicContact CD2-CG2 3.93Å; F49-V121 HydrophobicContact CE2-CB 4.48Å; F49-V121 HydrophobicContact CE2-CG2 3.71Å; F49-V121 HydrophobicContact CZ-CG2 4.1Å; V55-V121 HydrophobicContact CB-CG2 4.22Å; V55-V121 HydrophobicContact CG1-CG1 4.11Å; V55-V121 HydrophobicContact CG1-CG2 3.98Å; V95-V121 HydrophobicContact CG2-CG1 3.97Å; L117-V121 HydrophobicContact CD1-CG2 3.92Å; L117-V121 HydrophobicContact CG-CG2 4.39Å; L117-V121 WeakPolarHBondContact O-CG2 3.23Å; L117-V121 PolarHBondContact O-N 3.04Å; A118-V121 PolarHBondContact O-N 3.48Å; V121-K123 VanDerWaalsContact C-N 3.31Å; V121-K123 PolarHBondContact O-N 3.01Å; V121-A124 PolarHBondContact O-N 2.57Å; V121-A124 VanDerWaalsContact O-N 3.13Å; V121-E125 PolarHBondContact O-N 2.97Å; V121-E125 VanDerWaalsContact O-N 3.11Å
122	L	98.6	Very high	97.9	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-56.3	-44.6	176.8	-74.6	164.1	0	0	0	112	L94 V95 A118 A124 E125 G126 L127 V130 V132	L94-L122 HydrophobicContact CB-CD2 4.06Å; L94-L122 HydrophobicContact CD1-CD1 4.21Å; V95-L122 HydrophobicContact CG2-CD2 3.84Å; V95-L122 HydrophobicContact CG2-CG 4.44Å; A118-L122 WeakPolarHBondContact O-CB 3.4Å; A118-L122 WeakPolarHBondContact O-CD1 3.34Å; A118-L122 VanDerWaalsContact O-CG 3.22Å; A118-L122 WeakPolarHBondContact O-CG 3.22Å; A118-L122 PolarHBondContact O-N 2.86Å; L122-A124 PolarHBondContact O-N 3.13Å; L122-E125 CarbonylContact O-C 3.53Å; L122-E125 PolarHBondContact O-N 3.44Å; L122-G126 PolarHBondContact O-N 3.3Å; L122-L127 HydrophobicContact CB-CB 4.31Å; L122-L127 HydrophobicContact CD2-CB 3.98Å; L122-L127 HydrophobicContact CD2-CD1 3.86Å; L122-L127 WeakPolarHBondContact O-CB 2.98Å; L122-L127 PolarHBondContact O-N 2.91Å; L122-V130 HydrophobicContact CD1-CB 3.95Å; L122-V130 HydrophobicContact CD1-CG1 3.68Å; L122-V130 HydrophobicContact CD2-CB 4.03Å; L122-V130 HydrophobicContact CD2-CG1 4.07Å; L122-V130 HydrophobicContact CD2-CG2 3.97Å; L122-V132 HydrophobicContact CD1-CG2 3.42Å; L122-V132 VanDerWaalsContact CD1-CG2 3.42Å
123	K	98.3	Very high	97.8	Very high	152 Å²	152	53.8 Å²	53.8	66%	0.661	29%	0.292	S	S	*	.	H	α-helix	trans	-64	-39.1	177.9	-177.3	-180	177.3	-176	0	112.5	R119 N120 V121 E125 G126	R119-K123 WeakPolarHBondContact O-CB 3.21Å; R119-K123 PolarHBondContact O-N 2.85Å; N120-K123 PolarHBondContact O-N 3.33Å; V121-K123 VanDerWaalsContact C-N 3.31Å; V121-K123 PolarHBondContact O-N 3.01Å; K123-E125 PolarHBondContact O-N 2.55Å; K123-G126 PolarHBondContact O-N 2.97Å
124	A	97.9	Very high	97.8	Very high	71 Å²	71	59 Å²	59	59%	0.587	32%	0.316	S	S	*	.	H	α-helix	trans	-64.5	-31.2	176.4	0	0	0	0	0	112.1	F49 N120 V121 L122 G126	F49-A124 HydrophobicContact CZ-CB 3.84Å; N120-A124 WeakPolarHBondContact O-CB 3.24Å; N120-A124 PolarHBondContact O-N 3.45Å; V121-A124 PolarHBondContact O-N 2.57Å; V121-A124 VanDerWaalsContact O-N 3.13Å; L122-A124 PolarHBondContact O-N 3.13Å; A124-G126 VanDerWaalsContact C-N 3.26Å; A124-G126 PolarHBondContact O-N 3.39Å
125	E	97.9	Very high	97.8	Very high	94 Å²	94	59.8 Å²	59.8	44%	0.439	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	0.6	173	-64.2	-70.7	137.9	0	0	113.4	V95 K99 V121 L122 K123 L127	V95-E125 HydrophobicContact CG1-CB 4.4Å; V95-E125 HydrophobicContact CG1-CG 3.85Å; V95-E125 HydrophobicContact CG2-CG 4.12Å; K99-E125 WeakPolarHBondContact CE-OE2 2.99Å; K99-E125 IonicContact NZ-OE2 3.26Å; K99-E125 PolarHBondContact NZ-OE2 2.78Å; V121-E125 PolarHBondContact O-N 2.97Å; V121-E125 VanDerWaalsContact O-N 3.11Å; L122-E125 CarbonylContact O-C 3.53Å; L122-E125 PolarHBondContact O-N 3.44Å; K123-E125 PolarHBondContact O-N 2.55Å; E125-L127 VanDerWaalsContact C-N 3.31Å; E125-L127 HydrophobicContact CB-CD1 4.02Å; E125-L127 HydrophobicContact CB-CG 4.08Å; E125-L127 PolarHBondContact O-N 2.91Å
126	G	97.8	Very high	97.7	Very high	59 Å²	59	62.5 Å²	62.5	61%	0.608	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	16.7	-178.2	0	0	0	0	0	114.6	L122 K123 A124 T128	L122-G126 PolarHBondContact O-N 3.3Å; K123-G126 PolarHBondContact O-N 2.97Å; A124-G126 VanDerWaalsContact C-N 3.26Å; A124-G126 PolarHBondContact O-N 3.39Å; G126-T128 PolarHBondContact O-N 2.9Å
127	L	97.6	Very high	97.6	Very high	42 Å²	42	59.1 Å²	59.1	22%	0.22	32%	0.319	C	S	.	.			trans	-95.9	90.4	-177.3	-59.8	174	0	0	0	110.6	V95 A98 L122 E125 V130	V95-L127 HydrophobicContact CB-CD1 4.24Å; V95-L127 HydrophobicContact CG1-CD1 4.21Å; V95-L127 HydrophobicContact CG2-CD1 4.15Å; A98-L127 HydrophobicContact CB-CD1 3.66Å; A98-L127 HydrophobicContact CB-CD2 3.75Å; A98-L127 HydrophobicContact CB-CG 4.31Å; L122-L127 HydrophobicContact CB-CB 4.31Å; L122-L127 HydrophobicContact CD2-CB 3.98Å; L122-L127 HydrophobicContact CD2-CD1 3.86Å; L122-L127 WeakPolarHBondContact O-CB 2.98Å; L122-L127 PolarHBondContact O-N 2.91Å; E125-L127 VanDerWaalsContact C-N 3.31Å; E125-L127 HydrophobicContact CB-CD1 4.02Å; E125-L127 HydrophobicContact CB-CG 4.08Å; E125-L127 PolarHBondContact O-N 2.91Å; L127-V130 HydrophobicContact CB-CG2 4.37Å
128	T	92.1	Very high	97.5	Very high	112 Å²	112	60.1 Å²	60.1	69%	0.687	32%	0.324	S	S	*	.			trans	-95.1	-14.2	-177.2	54.5	0	0	0	0	114.7	G126	G126-T128 PolarHBondContact O-N 2.9Å
129	D	94.1	Very high	97.2	Very high	140 Å²	140	65.7 Å²	65.7	75%	0.749	35%	0.354	S	S	*	.	S	Bend	trans	-92.8	-2	-173.4	-60.5	-27.9	0	0	0	113.2
130	V	98.3	Very high	96.9	Very high	23 Å²	23	60 Å²	60	14%	0.139	33%	0.334	C	S	.	.			trans	-80.8	128.9	177	178.4	0	0	0	0	109.8	L94 L105 L122 L127 V132	L94-V130 HydrophobicContact CB-CG1 4.12Å; L94-V130 HydrophobicContact CD1-CG1 3.91Å; L94-V130 HydrophobicContact CD2-CG1 4.26Å; L94-V130 HydrophobicContact CG-CG1 4.35Å; L105-V130 HydrophobicContact CB-CG1 3.96Å; L105-V130 HydrophobicContact CB-CG2 4.21Å; L105-V130 HydrophobicContact CD1-CG2 4.08Å; L122-V130 HydrophobicContact CD1-CB 3.95Å; L122-V130 HydrophobicContact CD1-CG1 3.68Å; L122-V130 HydrophobicContact CD2-CB 4.03Å; L122-V130 HydrophobicContact CD2-CG1 4.07Å; L122-V130 HydrophobicContact CD2-CG2 3.97Å; L127-V130 HydrophobicContact CB-CG2 4.37Å; V130-V132 HydrophobicContact CG1-CG2 4.36Å
131	T	98.4	Very high	96.2	Very high	61 Å²	61	61.5 Å²	61.5	37%	0.374	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.6	177.3	-64.3	0	0	0	0	110.1	L105 T106 G107 K133	L105-T131 PolarHBondContact O-N 2.87Å; T106-T131 CarbonylContact C-O 3.35Å; T106-T131 VanDerWaalsContact CA-O 3.23Å; T106-T131 WeakPolarHBondContact CA-O 3.27Å; T106-T131 HydrophobicContact CG2-CG2 4.24Å; G107-T131 PolarHBondContact N-O 2.93Å; T131-K133 HydrophobicContact CG2-CD 4.29Å; T131-K133 HydrophobicContact CG2-CG 3.96Å
132	V	98.6	Very high	95.2	Very high	7 Å²	7	63.7 Å²	63.7	4%	0.042	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.5	171	-171.3	0	0	0	0	109.1	T88 L94 G107 V115 A118 R119 L122 V130	T88-V132 HydrophobicContact CG2-CG1 4.23Å; L94-V132 HydrophobicContact CD1-CG2 4.02Å; G107-V132 CarbonylContact O-C 3.6Å; G107-V132 VanDerWaalsContact O-CA 3.3Å; G107-V132 WeakPolarHBondContact O-CA 3.32Å; V115-V132 HydrophobicContact CB-CG1 4.42Å; V115-V132 HydrophobicContact CG1-CG1 4.05Å; V115-V132 HydrophobicContact CG2-CG1 4.37Å; A118-V132 HydrophobicContact CB-CG1 4.1Å; A118-V132 HydrophobicContact CB-CG2 4.49Å; R119-V132 HydrophobicContact CG-CB 3.97Å; R119-V132 HydrophobicContact CG-CG2 4.28Å; R119-V132 PolarHBondContact NE-O 3.15Å; R119-V132 PolarHBondContact NH2-O 2.87Å; L122-V132 HydrophobicContact CD1-CG2 3.42Å; L122-V132 VanDerWaalsContact CD1-CG2 3.42Å; V130-V132 HydrophobicContact CG1-CG2 4.36Å
133	K	98	Very high	94.6	Very high	97 Å²	97	71.1 Å²	71.1	42%	0.422	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.6	-176.1	-60.1	178.1	-177.2	177	0	111.8	G107 I108 D109 V115 T131 T135	G107-K133 PolarHBondContact O-N 3.16Å; I108-K133 WeakPolarHBondContact CA-O 3.44Å; I108-K133 HydrophobicContact CG2-CB 4.35Å; D109-K133 PolarHBondContact N-O 3.04Å; V115-K133 WeakPolarHBondContact CG2-O 3.25Å; T131-K133 HydrophobicContact CG2-CD 4.29Å; T131-K133 HydrophobicContact CG2-CG 3.96Å; K133-T135 PolarHBondContact O-N 2.91Å
134	E	97.9	Very high	94.4	Very high	112 Å²	112	64.2 Å²	64.2	52%	0.523	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	116	163.3	-172.1	-172.8	161.2	0	0	108	D109 V115	D109-E134 CarbonylContact O-C 3.58Å; D109-E134 VanDerWaalsContact O-CA 3.27Å; D109-E134 WeakPolarHBondContact O-CA 3.43Å; V115-E134 HydrophobicContact CG2-CB 4.12Å
135	T	97.7	Very high	94.4	Very high	17 Å²	17	64 Å²	64	10%	0.104	39%	0.387	C	S	.	.			trans	-153.9	122.3	-178.4	-55.7	0	0	0	0	109.6	D109 Y110 K133 F137 C140 L144	D109-T135 CarbonylContact C-O 3.52Å; D109-T135 PolarHBondContact O-N 2.9Å; Y110-T135 PolarHBondContact N-O 3.02Å; K133-T135 PolarHBondContact O-N 2.91Å; T135-F137 PolarHBondContact O-N 2.95Å; T135-C140 HydrophobicContact CG2-CB 3.7Å; T135-L144 HydrophobicContact CG2-CD1 4.19Å
136	D	96.6	Very high	94.3	Very high	62 Å²	62	61.1 Å²	61.1	33%	0.332	38%	0.383	S	S	.	.			trans	-75.9	107.2	164.5	-179.5	-8.8	0	0	0	108.8	L138 N139 C140	D136-L138 PolarHBondContact O-N 3.4Å; D136-L138 PolarHBondContact OD1-N 3.18Å; D136-N139 HydrophobicContact CB-CB 4.28Å; D136-N139 CarbonylContact O-C 3.27Å; D136-N139 VanDerWaalsContact O-C 3.27Å; D136-N139 PolarHBondContact O-N 2.93Å; D136-N139 PolarHBondContact OD2-ND2 3.39Å; D136-C140 WeakPolarHBondContact O-CA 3.29Å; D136-C140 WeakPolarHBondContact O-CB 3.43Å; D136-C140 PolarHBondContact O-N 2.67Å
137	F	97.3	Very high	94.4	Very high	12 Å²	12	59.2 Å²	59.2	5%	0.053	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-62.4	-25	-176.7	-170.7	-112.1	0	0	0	113.4	L84 I86 I108 T135 L144 Y173 N176 L177	L84-F137 HydrophobicContact CD2-CE2 4.38Å; I86-F137 HydrophobicContact CD1-CE1 4.01Å; I86-F137 HydrophobicContact CD1-CE2 4Å; I86-F137 HydrophobicContact CD1-CZ 3.64Å; I86-F137 HydrophobicContact CG1-CE2 4.25Å; I86-F137 HydrophobicContact CG1-CZ 4.36Å; I86-F137 HydrophobicContact CG2-CB 4.19Å; I86-F137 HydrophobicContact CG2-CD1 3.87Å; I86-F137 HydrophobicContact CG2-CD2 4.18Å; I86-F137 HydrophobicContact CG2-CE1 4.27Å; I86-F137 HydrophobicContact CG2-CG 3.8Å; I108-F137 HydrophobicContact CD1-CB 4.13Å; I108-F137 HydrophobicContact CD1-CD2 3.5Å; I108-F137 VanDerWaalsContact CD1-CD2 3.5Å; I108-F137 HydrophobicContact CD1-CE2 4.3Å; I108-F137 HydrophobicContact CD1-CG 4.17Å; T135-F137 PolarHBondContact O-N 2.95Å; F137-L144 HydrophobicContact CD2-CD1 3.62Å; F137-L144 HydrophobicContact CE2-CD1 3.81Å; F137-Y173 AromaticContact CD1-CD2 3.57Å; F137-Y173 HydrophobicContact CD1-CD2 3.57Å; F137-Y173 AromaticContact CD1-CE2 3.72Å; F137-Y173 HydrophobicContact CD1-CE2 3.72Å; F137-Y173 HydrophobicContact CD1-CG 4.4Å; F137-Y173 AromaticContact CE1-CD2 3.67Å; F137-Y173 HydrophobicContact CE1-CD2 3.67Å; F137-Y173 AromaticContact CE1-CE2 3.69Å; F137-Y173 HydrophobicContact CE1-CE2 3.69Å; F137-Y173 HydrophobicContact CE1-CG 4.16Å; F137-N176 HydrophobicContact CE1-CB 4.13Å; F137-N176 HydrophobicContact CE2-CB 4.39Å; F137-N176 HydrophobicContact CZ-CB 4.02Å; F137-N176 PolarHBondContact O-ND2 2.84Å; F137-L177 HydrophobicContact CE1-CB 4.4Å; F137-L177 HydrophobicContact CZ-CB 4.2Å
138	L	95.2	Very high	94.4	Very high	20 Å²	20	59.6 Å²	59.6	11%	0.105	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-77.4	-25.7	175.7	-62.2	-176.6	0	0	0	112.1	D136 I159 G169 L172 N176	D136-L138 PolarHBondContact O-N 3.4Å; D136-L138 PolarHBondContact OD1-N 3.18Å; L138-I159 HydrophobicContact CD1-CD1 4.43Å; L138-I159 HydrophobicContact CD1-CG1 4.32Å; L138-I159 HydrophobicContact CD1-CG2 4.12Å; L138-I159 HydrophobicContact CD2-CD1 4.04Å; L138-I159 HydrophobicContact CG-CD1 4.25Å; L138-G169 VanDerWaalsContact CD2-O 3.26Å; L138-G169 WeakPolarHBondContact CD2-O 3.47Å; L138-L172 HydrophobicContact CD2-CB 4.18Å; L138-N176 PolarHBondContact O-ND2 3.22Å; L138-N176 VanDerWaalsContact O-ND2 3.11Å
139	N	93.9	Very high	94.7	Very high	117 Å²	117	54.3 Å²	54.3	63%	0.626	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-122	33.5	-174.7	-62.9	-65.7	0	0	0	112.5	D136 G141	D136-N139 HydrophobicContact CB-CB 4.28Å; D136-N139 CarbonylContact O-C 3.27Å; D136-N139 VanDerWaalsContact O-C 3.27Å; D136-N139 PolarHBondContact O-N 2.93Å; D136-N139 PolarHBondContact OD2-ND2 3.39Å; N139-G141 VanDerWaalsContact C-N 3.29Å; N139-G141 PolarHBondContact O-N 2.74Å
140	C	91.3	Very high	95	Very high	10 Å²	10	47.6 Å²	47.6	7%	0.068	29%	0.292	C	S	.	.			trans	-82.4	3.8	-172.1	67.9	0	0	0	0	115.1	T135 D136 G142 E143 L144	T135-C140 HydrophobicContact CG2-CB 3.7Å; D136-C140 WeakPolarHBondContact O-CA 3.29Å; D136-C140 WeakPolarHBondContact O-CB 3.43Å; D136-C140 PolarHBondContact O-N 2.67Å; C140-G142 PolarHBondContact O-N 3.33Å; C140-E143 WeakPolarHBondContact O-CB 3.4Å; C140-E143 WeakPolarHBondContact O-CG 3.48Å; C140-E143 PolarHBondContact O-N 3.48Å; C140-L144 HydrophobicContact CB-CD1 4.15Å; C140-L144 HydrophobicContact CB-CG 4.46Å
141	G	83.7	Confident	95	Very high	75 Å²	75	46.6 Å²	46.6	77%	0.773	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	21.4	170.8	0	0	0	0	0	116.4	N139 E143	N139-G141 VanDerWaalsContact C-N 3.29Å; N139-G141 PolarHBondContact O-N 2.74Å; G141-E143 VanDerWaalsContact C-N 3.3Å; G141-E143 PolarHBondContact O-N 2.87Å
142	G	78.2	Confident	95	Very high	52 Å²	52	43.7 Å²	43.7	54%	0.536	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	15.1	-175.1	0	0	0	0	0	114.9	C140 L144	C140-G142 PolarHBondContact O-N 3.33Å; G142-L144 PolarHBondContact O-N 2.83Å
143	E	85.9	Confident	94.9	Very high	158 Å²	158	44.9 Å²	44.9	74%	0.738	27%	0.272	S	S	*	.			trans	-72	-13	178.8	-65.3	-174.9	170	0	0	113.7	C140 G141	C140-E143 WeakPolarHBondContact O-CB 3.4Å; C140-E143 WeakPolarHBondContact O-CG 3.48Å; C140-E143 PolarHBondContact O-N 3.48Å; G141-E143 VanDerWaalsContact C-N 3.3Å; G141-E143 PolarHBondContact O-N 2.87Å
144	L	94.7	Very high	94.8	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.042	25%	0.254	C	S	.	.			trans	-105.2	116.3	178.4	-58.7	174.7	0	0	0	108.5	L84 I108 T135 F137 C140 G142 F147 A180	L84-L144 HydrophobicContact CD2-CD1 4.29Å; I108-L144 HydrophobicContact CD1-CD1 3.56Å; I108-L144 HydrophobicContact CG2-CD2 4.36Å; T135-L144 HydrophobicContact CG2-CD1 4.19Å; F137-L144 HydrophobicContact CD2-CD1 3.62Å; F137-L144 HydrophobicContact CE2-CD1 3.81Å; C140-L144 HydrophobicContact CB-CD1 4.15Å; C140-L144 HydrophobicContact CB-CG 4.46Å; G142-L144 PolarHBondContact O-N 2.83Å; L144-F147 HydrophobicContact CB-CE2 4.19Å; L144-F147 HydrophobicContact CD2-CE2 4.28Å; L144-A180 HydrophobicContact CB-CB 4.18Å; L144-A180 VanDerWaalsContact O-CA 3.3Å; L144-A180 WeakPolarHBondContact O-CA 3.49Å
145	A	96.5	Very high	94.7	Very high	66 Å²	66	36.5 Å²	36.5	55%	0.545	24%	0.238	S	C	.	.			trans	-157.7	156.2	178	0	0	0	0	0	110.6	A180	A145-A180 CarbonylContact C-O 3.56Å; A145-A180 WeakPolarHBondContact CA-O 3.34Å
146	G	97.1	Very high	94.7	Very high	34 Å²	34	35.7 Å²	35.7	35%	0.351	23%	0.233	S	C	.	.			trans	81.1	25.5	171.3	0	0	0	0	0	114.5	A180 K182	G146-A180 PolarHBondContact N-O 3.47Å; G146-K182 WeakPolarHBondContact O-CE 3.34Å
147	F	98.7	Very high	94.6	Very high	18 Å²	18	32.9 Å²	32.9	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	136.1	172.3	-65	-78.2	0	0	0	111.5	A82 L84 T106 L144 A180 L181 K182	A82-F147 HydrophobicContact CB-CD1 4.06Å; A82-F147 CarbonylContact O-C 3.49Å; L84-F147 HydrophobicContact CB-CB 4.32Å; L84-F147 HydrophobicContact CB-CD1 3.62Å; L84-F147 HydrophobicContact CB-CD2 4Å; L84-F147 HydrophobicContact CB-CE1 3.83Å; L84-F147 HydrophobicContact CB-CE2 4.2Å; L84-F147 HydrophobicContact CB-CG 3.7Å; L84-F147 HydrophobicContact CB-CZ 4.12Å; L84-F147 HydrophobicContact CD1-CE1 4.33Å; L84-F147 HydrophobicContact CD1-CE2 4.31Å; L84-F147 HydrophobicContact CD1-CZ 4.01Å; L84-F147 HydrophobicContact CD2-CD2 3.99Å; L84-F147 HydrophobicContact CD2-CE2 3.96Å; L84-F147 HydrophobicContact CD2-CZ 4.45Å; L84-F147 HydrophobicContact CG-CE2 4.4Å; L84-F147 HydrophobicContact CG-CZ 4.43Å; T106-F147 HydrophobicContact CG2-CZ 4.31Å; L144-F147 HydrophobicContact CB-CE2 4.19Å; L144-F147 HydrophobicContact CD2-CE2 4.28Å; F147-A180 HydrophobicContact CD2-CB 4.35Å; F147-A180 WeakPolarHBondContact CD2-O 3.41Å; F147-A180 PolarHBondContact N-O 2.77Å; F147-L181 CarbonylContact O-C 3.53Å; F147-L181 WeakPolarHBondContact O-CA 3.06Å; F147-K182 PolarHBondContact O-N 3.23Å
148	D	98.8	Very high	94.4	Very high	50 Å²	50	32.8 Å²	32.8	27%	0.267	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-33.2	172.8	-63.9	-68.8	0	0	0	111	A81 A82 K182 G185 I186	A81-D148 HydrophobicContact CB-CB 3.95Å; A82-D148 PolarHBondContact N-OD2 2.81Å; A82-D148 PolarHBondContact O-N 3.39Å; D148-K182 WeakPolarHBondContact OD1-CD 3.15Å; D148-K182 WeakPolarHBondContact OD1-CE 3.38Å; D148-K182 IonicContact OD1-NZ 2.68Å; D148-K182 PolarHBondContact OD1-NZ 3.44Å; D148-K182 IonicContact OD2-NZ 3.63Å; D148-K182 PolarHBondContact OD2-NZ 3.06Å; D148-G185 CarbonylContact O-C 3.37Å; D148-G185 WeakPolarHBondContact O-CA 3.27Å; D148-I186 PolarHBondContact O-N 3.44Å
149	V	98.9	Very high	94.3	Very high	1 Å²	1	33 Å²	33	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	132	178.3	-171.3	0	0	0	0	109.9	M72 I77 A82 I83 L84 I151 I186	M72-V149 HydrophobicContact CE-CG2 4.46Å; I77-V149 HydrophobicContact CD1-CG2 4.42Å; I77-V149 HydrophobicContact CG2-CG2 3.92Å; A82-V149 PolarHBondContact O-N 2.87Å; A82-V149 VanDerWaalsContact O-N 3.12Å; I83-V149 CarbonylContact C-O 3.55Å; I83-V149 WeakPolarHBondContact CA-O 3.33Å; I83-V149 HydrophobicContact CG1-CB 4.08Å; I83-V149 HydrophobicContact CG1-CG2 4.35Å; I83-V149 HydrophobicContact CG2-CB 4.45Å; L84-V149 PolarHBondContact N-O 3.01Å; V149-I151 HydrophobicContact CG1-CD1 4.49Å; V149-I151 HydrophobicContact CG1-CG1 3.99Å; V149-I186 CarbonylContact C-O 3.57Å; V149-I186 VanDerWaalsContact CA-O 3.27Å; V149-I186 WeakPolarHBondContact CA-O 3.19Å; V149-I186 HydrophobicContact CG1-CB 4.38Å; V149-I186 HydrophobicContact CG1-CG2 4.42Å; V149-I186 HydrophobicContact CG2-CB 4.33Å
150	C	98.9	Very high	94.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139	165.4	-71.1	0	0	0	0	108.6	L84 I86 L177 L181 I186 F187 A188	L84-C150 CarbonylContact O-C 3.51Å; L84-C150 WeakPolarHBondContact O-CA 3.22Å; I86-C150 HydrophobicContact CD1-CB 4.11Å; C150-L177 HydrophobicContact CB-CD1 3.57Å; C150-L181 HydrophobicContact CB-CD1 4.3Å; C150-L181 HydrophobicContact CB-CD2 3.89Å; C150-L181 HydrophobicContact CB-CG 4.1Å; C150-L181 VanDerWaalsContact SG-CD2 3.5Å; C150-L181 VanDerWaalsContact SG-CG 3.58Å; C150-I186 PolarHBondContact N-O 3.26Å; C150-F187 HydrophobicContact CB-CD2 4.3Å; C150-F187 CarbonylContact O-C 3.51Å; C150-F187 WeakPolarHBondContact O-CA 3.43Å; C150-A188 PolarHBondContact O-N 2.89Å
151	I	98.8	Very high	94.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.1	-178.1	-60.4	178.3	0	0	0	107.7	V68 M72 I83 L84 I86 F93 L97 V149 A188	V68-I151 HydrophobicContact CG1-CD1 4.4Å; M72-I151 HydrophobicContact SD-CD1 4.3Å; I83-I151 HydrophobicContact CG2-CD1 3.81Å; I83-I151 HydrophobicContact CG2-CG1 4.34Å; L84-I151 PolarHBondContact O-N 3.32Å; I86-I151 WeakPolarHBondContact CB-O 3.46Å; I86-I151 PolarHBondContact N-O 3.39Å; F93-I151 HydrophobicContact CD1-CG2 3.81Å; F93-I151 HydrophobicContact CE1-CD1 4.09Å; F93-I151 HydrophobicContact CE1-CG2 3.37Å; F93-I151 HydrophobicContact CZ-CD1 4.03Å; F93-I151 HydrophobicContact CZ-CG2 4.27Å; L97-I151 HydrophobicContact CD1-CD1 4.09Å; L97-I151 HydrophobicContact CD2-CD1 4.44Å; V149-I151 HydrophobicContact CG1-CD1 4.49Å; V149-I151 HydrophobicContact CG1-CG1 3.99Å; I151-A188 CarbonylContact C-O 3.59Å; I151-A188 WeakPolarHBondContact CA-O 3.48Å; I151-A188 HydrophobicContact CG1-CB 4.43Å
152	D	98.5	Very high	94.4	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.8	168.7	-176.9	-53.1	0	0	0	109.2	G154 T155 F156 Y173 F187 A188 I189 T190	D152-G154 PolarHBondContact OD1-N 3.12Å; D152-T155 PolarHBondContact OD1-N 3.5Å; D152-T155 WeakPolarHBondContact OD2-CB 3.24Å; D152-F156 PolarHBondContact OD1-N 3.05Å; D152-F156 PolarHBondContact OD2-N 3.42Å; D152-Y173 WeakPolarHBondContact CB-OH 3.47Å; D152-Y173 VanDerWaalsContact CG-OH 3.26Å; D152-Y173 WeakPolarHBondContact OD2-CE2 3.22Å; D152-Y173 VanDerWaalsContact OD2-CZ 3.28Å; D152-Y173 PolarHBondContact OD2-OH 3.05Å; D152-F187 HydrophobicContact CB-CE2 3.79Å; D152-F187 HydrophobicContact CB-CZ 4.15Å; D152-A188 PolarHBondContact N-O 2.65Å; D152-I189 HydrophobicContact CB-CG1 4.33Å; D152-I189 CarbonylContact O-C 3.47Å; D152-I189 WeakPolarHBondContact O-CA 3.33Å; D152-T190 PolarHBondContact O-N 2.77Å
153	K	96.7	Very high	94.1	Very high	32 Å²	32	28.4 Å²	28.4	14%	0.139	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	66.5	176.6	-167	-164.6	57.4	48.1	0	110.7	W59 F60 M65	W59-K153 VanDerWaalsContact CB-NZ 3.33Å; W59-K153 WeakPolarHBondContact O-CD 3.27Å; W59-K153 VanDerWaalsContact O-CE 3.24Å; W59-K153 WeakPolarHBondContact O-CE 3.3Å; W59-K153 PolarHBondContact O-NZ 3.22Å; F60-K153 HydrophobicContact CD2-CD 4.34Å; F60-K153 HydrophobicContact CD2-CG 3.55Å; F60-K153 HydrophobicContact CE2-CG 4.12Å; M65-K153 HydrophobicContact CG-CD 4.31Å
154	G	94.9	Very high	93.1	Very high	4 Å²	4	28 Å²	28	4%	0.041	17%	0.167	C	C	.	.	S	Bend	trans	106	3.5	170.9	0	0	0	0	0	113.9	D152 D157 A158 T190	D152-G154 PolarHBondContact OD1-N 3.12Å; G154-D157 WeakPolarHBondContact O-CB 3.43Å; G154-D157 PolarHBondContact O-N 2.88Å; G154-A158 PolarHBondContact O-N 3.2Å; G154-T190 PolarHBondContact N-O 3.05Å
155	T	97.1	Very high	91.7	Very high	29 Å²	29	31.6 Å²	31.6	18%	0.178	19%	0.186	C	C	.	.	H	α-helix	trans	-76.6	-41.8	-179.6	-49.7	0	0	0	0	110.5	I86 G87 D152 D157 A158 I159	I86-T155 HydrophobicContact CG2-CG2 4.17Å; I86-T155 PolarHBondContact O-OG1 3.41Å; G87-T155 WeakPolarHBondContact CA-OG1 3.14Å; D152-T155 PolarHBondContact OD1-N 3.5Å; D152-T155 WeakPolarHBondContact OD2-CB 3.24Å; T155-D157 PolarHBondContact O-N 3.41Å; T155-A158 PolarHBondContact O-N 3.36Å; T155-I159 HydrophobicContact CG2-CD1 4.21Å; T155-I159 WeakPolarHBondContact O-CG1 3.48Å; T155-I159 PolarHBondContact O-N 3.04Å
156	F	96.4	Very high	90.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-34.4	171.2	-167.2	-115.4	0	0	0	112.2	D152 S160 K170 Y173 I189 W194 L199 R202 F203	D152-F156 PolarHBondContact OD1-N 3.05Å; D152-F156 PolarHBondContact OD2-N 3.42Å; F156-S160 WeakPolarHBondContact O-CB 3.18Å; F156-S160 PolarHBondContact O-N 3.25Å; F156-S160 PolarHBondContact O-OG 3.44Å; F156-K170 HydrophobicContact CE2-CB 4.16Å; F156-K170 HydrophobicContact CE2-CG 4.07Å; F156-K170 HydrophobicContact CZ-CB 4.16Å; F156-K170 HydrophobicContact CZ-CD 4.43Å; F156-K170 HydrophobicContact CZ-CG 3.96Å; F156-Y173 HydrophobicContact CB-CE1 4.43Å; F156-Y173 HydrophobicContact CB-CE2 4.3Å; F156-Y173 AromaticContact CD2-CD1 3.42Å; F156-Y173 HydrophobicContact CD2-CD1 3.42Å; F156-Y173 VanDerWaalsContact CD2-CD1 3.42Å; F156-Y173 AromaticContact CD2-CD2 3.89Å; F156-Y173 HydrophobicContact CD2-CD2 3.89Å; F156-Y173 AromaticContact CD2-CE1 3.78Å; F156-Y173 HydrophobicContact CD2-CE1 3.78Å; F156-Y173 HydrophobicContact CD2-CE2 4.15Å; F156-Y173 AromaticContact CD2-CG 3.51Å; F156-Y173 HydrophobicContact CD2-CG 3.51Å; F156-Y173 AromaticContact CE2-CD1 3.71Å; F156-Y173 HydrophobicContact CE2-CD1 3.71Å; F156-Y173 HydrophobicContact CE2-CE1 4.41Å; F156-Y173 AromaticContact CE2-CG 3.86Å; F156-Y173 HydrophobicContact CE2-CG 3.86Å; F156-Y173 HydrophobicContact CG-CD1 4.36Å; F156-Y173 HydrophobicContact CG-CE1 4.31Å; F156-I189 HydrophobicContact CB-CD1 4.03Å; F156-I189 HydrophobicContact CD1-CD1 4.09Å; F156-I189 HydrophobicContact CG-CD1 4.32Å; F156-W194 AromaticContact CD1-CD1 4Å; F156-W194 AromaticContact CD1-NE1 3.66Å; F156-W194 AromaticContact CE1-CD2 3.98Å; F156-W194 HydrophobicContact CE1-CD2 3.98Å; F156-W194 AromaticContact CE1-CE2 3.46Å; F156-W194 VanDerWaalsContact CE1-CE2 3.46Å; F156-W194 HydrophobicContact CE1-CG 4.42Å; F156-W194 HydrophobicContact CE1-CH2 4.42Å; F156-W194 AromaticContact CE1-CZ2 3.71Å; F156-W194 HydrophobicContact CE1-CZ2 3.71Å; F156-W194 AromaticContact CE1-NE1 3.55Å; F156-W194 HydrophobicContact CZ-CZ2 4.09Å; F156-L199 HydrophobicContact CD1-CD2 4.47Å; F156-R202 HydrophobicContact CE1-CG 4.11Å; F156-R202 HydrophobicContact CZ-CG 3.74Å; F156-F203 HydrophobicContact CD1-CE2 4.39Å; F156-F203 HydrophobicContact CD1-CZ 4.31Å; F156-F203 HydrophobicContact CE1-CE2 4.17Å; F156-F203 HydrophobicContact CE1-CZ 4.22Å; F156-F203 HydrophobicContact CE2-CZ 4.44Å; F156-F203 HydrophobicContact CG-CZ 4.45Å; F156-F203 HydrophobicContact CZ-CZ 4.31Å
157	D	94.6	Very high	89.7	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.011	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-49.5	172.2	-71.7	-43.7	0	0	0	111.3	F60 G154 T155 I159 S160 L161 S191 C192 N193	F60-D157 WeakPolarHBondContact CZ-OD2 3.35Å; G154-D157 WeakPolarHBondContact O-CB 3.43Å; G154-D157 PolarHBondContact O-N 2.88Å; T155-D157 PolarHBondContact O-N 3.41Å; D157-I159 PolarHBondContact O-N 3.46Å; D157-S160 WeakPolarHBondContact O-CB 3.39Å; D157-S160 PolarHBondContact O-N 3.43Å; D157-S160 VanDerWaalsContact O-N 3.13Å; D157-L161 WeakPolarHBondContact O-CG 3.29Å; D157-L161 PolarHBondContact O-N 3.45Å; D157-S191 WeakPolarHBondContact OD1-CB 3.37Å; D157-S191 PolarHBondContact OD1-OG 3.47Å; D157-S191 WeakPolarHBondContact OD2-CA 3.45Å; D157-S191 PolarHBondContact OD2-OG 2.9Å; D157-C192 PolarHBondContact OD2-N 3.45Å; D157-N193 VanDerWaalsContact OD1-CB 3.29Å; D157-N193 WeakPolarHBondContact OD1-CB 3.44Å; D157-N193 PolarHBondContact OD1-N 3.16Å; D157-N193 VanDerWaalsContact OD1-N 3.13Å
158	A	94.1	Very high	89.2	Confident	11 Å²	11	35 Å²	35	9%	0.091	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-45.2	178.2	0	0	0	0	0	111.8	G33 W38 G154 T155 S160 L161	G33-A158 VanDerWaalsContact CA-O 3.23Å; G33-A158 WeakPolarHBondContact CA-O 3.36Å; W38-A158 HydrophobicContact CZ2-CB 4.15Å; G154-A158 PolarHBondContact O-N 3.2Å; T155-A158 PolarHBondContact O-N 3.36Å; A158-S160 PolarHBondContact O-N 2.94Å; A158-L161 PolarHBondContact O-N 2.97Å; A158-L161 VanDerWaalsContact O-N 3.08Å
159	I	93.6	Very high	88.8	Confident	23 Å²	23	32.8 Å²	32.8	12%	0.118	17%	0.17	C	C	.	.	H	α-helix	trans	-57.9	-39.5	175.9	-70.3	163.8	0	0	0	111.1	L138 T155 D157 L161 K162 Y173	L138-I159 HydrophobicContact CD1-CD1 4.43Å; L138-I159 HydrophobicContact CD1-CG1 4.32Å; L138-I159 HydrophobicContact CD1-CG2 4.12Å; L138-I159 HydrophobicContact CD2-CD1 4.04Å; L138-I159 HydrophobicContact CG-CD1 4.25Å; T155-I159 HydrophobicContact CG2-CD1 4.21Å; T155-I159 WeakPolarHBondContact O-CG1 3.48Å; T155-I159 PolarHBondContact O-N 3.04Å; D157-I159 PolarHBondContact O-N 3.46Å; I159-L161 PolarHBondContact O-N 2.68Å; I159-K162 WeakPolarHBondContact O-CB 3.49Å; I159-K162 PolarHBondContact O-N 3.25Å; I159-Y173 HydrophobicContact CD1-CD2 3.53Å; I159-Y173 HydrophobicContact CD1-CE2 4.1Å; I159-Y173 HydrophobicContact CD1-CG 4.49Å
160	S	91.9	Very high	88.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.1	-179.2	-56.7	0	0	0	0	114	F156 D157 A158 N166 W194	F156-S160 WeakPolarHBondContact O-CB 3.18Å; F156-S160 PolarHBondContact O-N 3.25Å; F156-S160 PolarHBondContact O-OG 3.44Å; D157-S160 WeakPolarHBondContact O-CB 3.39Å; D157-S160 PolarHBondContact O-N 3.43Å; D157-S160 VanDerWaalsContact O-N 3.13Å; A158-S160 PolarHBondContact O-N 2.94Å; S160-N166 PolarHBondContact O-ND2 2.84Å; S160-N166 PolarHBondContact O-OD1 2.82Å; S160-W194 PolarHBondContact OG-NE1 3.37Å
161	L	90.7	Very high	88.2	Confident	18 Å²	18	37.1 Å²	37.1	9%	0.094	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	2	178.9	-63.3	173.6	0	0	0	113.1	F27 E28 T29 S30 L32 D157 A158 I159	F27-L161 HydrophobicContact CB-CD2 3.93Å; E28-L161 WeakPolarHBondContact O-CD2 3.23Å; T29-L161 VanDerWaalsContact CA-O 3.3Å; T29-L161 WeakPolarHBondContact CA-O 3.3Å; S30-L161 PolarHBondContact N-O 3.13Å; L32-L161 HydrophobicContact CB-CD1 3.8Å; L32-L161 HydrophobicContact CD1-CD1 4.33Å; D157-L161 WeakPolarHBondContact O-CG 3.29Å; D157-L161 PolarHBondContact O-N 3.45Å; A158-L161 PolarHBondContact O-N 2.97Å; A158-L161 VanDerWaalsContact O-N 3.08Å; I159-L161 PolarHBondContact O-N 2.68Å
162	K	86.4	Confident	88	Confident	85 Å²	85	40.2 Å²	40.2	37%	0.37	21%	0.205	S	C	.	.			trans	-65	132.5	-174.2	-170.6	178.3	176.5	-169.2	0	111.7	I159 D164	I159-K162 WeakPolarHBondContact O-CB 3.49Å; I159-K162 PolarHBondContact O-N 3.25Å; K162-D164 PolarHBondContact O-N 3.26Å
163	P	72.9	Confident	87.9	Confident	55 Å²	55	40.2 Å²	40.2	36%	0.357	21%	0.205	S	C	.	.	S	Bend	trans	-68.7	127.5	170.6	-12.3	26.7	0	0	0	110.5	T29 T34	T29-P163 HydrophobicContact CG2-CB 4.31Å; T34-P163 HydrophobicContact CG2-CG 3.85Å
164	D	65.6	Low	87.9	Confident	151 Å²	151	39.4 Å²	39.4	81%	0.807	20%	0.203	S	C	*	.	S	Bend	trans	57.2	113	-177.3	-57.5	-39.5	0	0	0	113.5	K162	K162-D164 PolarHBondContact O-N 3.26Å
165	D	63.6	Low	87.9	Confident	82 Å²	82	43.2 Å²	43.2	44%	0.439	22%	0.219	S	C	.	.			trans	93.2	44.5	-178.3	-159.7	20.3	0	0	0	117.1	K167 E168	D165-K167 VanDerWaalsContact C-N 3.35Å; D165-E168 WeakPolarHBondContact OD1-CB 3.36Å; D165-E168 WeakPolarHBondContact OD1-CG 3.49Å; D165-E168 PolarHBondContact OD1-N 3.33Å; D165-E168 VanDerWaalsContact OD1-N 3.13Å
166	N	70.1	Confident	87.9	Confident	20 Å²	20	42.6 Å²	42.6	11%	0.107	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-41.1	170.8	-161.5	-11.6	0	0	0	111.1	S160 K170	S160-N166 PolarHBondContact O-ND2 2.84Å; S160-N166 PolarHBondContact O-OD1 2.82Å; N166-K170 WeakPolarHBondContact O-CE 3.24Å; N166-K170 VanDerWaalsContact O-CG 3.22Å; N166-K170 WeakPolarHBondContact O-CG 3.22Å; N166-K170 PolarHBondContact O-N 3.48Å; N166-K170 VanDerWaalsContact OD1-CD 3.28Å; N166-K170 WeakPolarHBondContact OD1-CD 3.45Å; N166-K170 WeakPolarHBondContact OD1-CE 3.19Å; N166-K170 PolarHBondContact OD1-NZ 2.69Å
167	K	82	Confident	88	Confident	78 Å²	78	42.6 Å²	42.6	34%	0.339	22%	0.215	S	C	.	.	H	α-helix	trans	-70.8	-50.8	-172.4	-173.5	165.5	-176.6	129.1	0	113.6	D20 D24 D165 K171	D20-K167 IonicContact OD2-NZ 2.9Å; D20-K167 PolarHBondContact OD2-NZ 2.96Å; D24-K167 HydrophobicContact CB-CB 4.12Å; D24-K167 HydrophobicContact CB-CD 3.98Å; D24-K167 HydrophobicContact CB-CG 4.09Å; D24-K167 WeakPolarHBondContact OD2-CD 3.22Å; D24-K167 WeakPolarHBondContact OD2-CE 3.42Å; D24-K167 VanDerWaalsContact OD2-CG 3.24Å; D24-K167 WeakPolarHBondContact OD2-CG 3.34Å; D24-K167 IonicContact OD2-NZ 2.75Å; D24-K167 PolarHBondContact OD2-NZ 3.35Å; D165-K167 VanDerWaalsContact C-N 3.35Å; K167-K171 WeakPolarHBondContact O-CG 3.32Å; K167-K171 PolarHBondContact O-N 2.73Å
168	E	88	Confident	88.1	Confident	92 Å²	92	46.5 Å²	46.5	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-74.6	-35.6	-176.1	-57.3	-67.7	112.3	0	0	111.4	D165 K170 K171 L172	D165-E168 WeakPolarHBondContact OD1-CB 3.36Å; D165-E168 WeakPolarHBondContact OD1-CG 3.49Å; D165-E168 PolarHBondContact OD1-N 3.33Å; D165-E168 VanDerWaalsContact OD1-N 3.13Å; E168-K170 VanDerWaalsContact C-N 3.33Å; E168-K170 PolarHBondContact O-N 3.39Å; E168-K171 PolarHBondContact O-N 3.11Å; E168-K171 VanDerWaalsContact O-N 3.13Å; E168-K171 IonicContact OE1-NZ 3.7Å; E168-K171 PolarHBondContact OE1-NZ 3.49Å; E168-L172 WeakPolarHBondContact O-CB 3.36Å; E168-L172 WeakPolarHBondContact O-CG 3.44Å; E168-L172 PolarHBondContact O-N 2.95Å
169	G	91.5	Very high	88.2	Confident	4 Å²	4	48.7 Å²	48.7	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-55.4	-45.7	173.3	0	0	0	0	0	112.8	L138 K171 L172 Y173	L138-G169 VanDerWaalsContact CD2-O 3.26Å; L138-G169 WeakPolarHBondContact CD2-O 3.47Å; G169-K171 PolarHBondContact O-N 2.98Å; G169-L172 PolarHBondContact O-N 2.97Å; G169-Y173 WeakPolarHBondContact O-CB 3.28Å; G169-Y173 PolarHBondContact O-N 2.95Å
170	K	92.2	Very high	88.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-39.4	176.2	-70.1	177.5	-66.2	-178.4	0	112.7	D24 F156 N166 E168 V174 W194 R202	D24-K170 PolarHBondContact O-NZ 3.44Å; D24-K170 WeakPolarHBondContact OD1-CE 3.44Å; D24-K170 IonicContact OD1-NZ 3.48Å; D24-K170 PolarHBondContact OD1-NZ 2.99Å; F156-K170 HydrophobicContact CE2-CB 4.16Å; F156-K170 HydrophobicContact CE2-CG 4.07Å; F156-K170 HydrophobicContact CZ-CB 4.16Å; F156-K170 HydrophobicContact CZ-CD 4.43Å; F156-K170 HydrophobicContact CZ-CG 3.96Å; N166-K170 WeakPolarHBondContact O-CE 3.24Å; N166-K170 VanDerWaalsContact O-CG 3.22Å; N166-K170 WeakPolarHBondContact O-CG 3.22Å; N166-K170 PolarHBondContact O-N 3.48Å; N166-K170 VanDerWaalsContact OD1-CD 3.28Å; N166-K170 WeakPolarHBondContact OD1-CD 3.45Å; N166-K170 WeakPolarHBondContact OD1-CE 3.19Å; N166-K170 PolarHBondContact OD1-NZ 2.69Å; E168-K170 VanDerWaalsContact C-N 3.33Å; E168-K170 PolarHBondContact O-N 3.39Å; K170-V174 WeakPolarHBondContact O-CG2 3.36Å; K170-V174 PolarHBondContact O-N 3.36Å; K170-W194 HydrophobicContact CD-CH2 3.84Å; K170-W194 HydrophobicContact CD-CZ2 3.55Å; K170-R202 VanDerWaalsContact CB-NH1 3.3Å
171	K	92.6	Very high	88.7	Confident	91 Å²	91	47.7 Å²	47.7	40%	0.396	24%	0.235	S	C	.	.	H	α-helix	trans	-67.6	-44.9	176.8	-70	175.7	-173.9	167.4	0	112	K167 E168 G169 Y173 V174 H175	K167-K171 WeakPolarHBondContact O-CG 3.32Å; K167-K171 PolarHBondContact O-N 2.73Å; E168-K171 PolarHBondContact O-N 3.11Å; E168-K171 VanDerWaalsContact O-N 3.13Å; E168-K171 IonicContact OE1-NZ 3.7Å; E168-K171 PolarHBondContact OE1-NZ 3.49Å; G169-K171 PolarHBondContact O-N 2.98Å; K171-Y173 VanDerWaalsContact C-N 3.28Å; K171-Y173 PolarHBondContact O-N 3.2Å; K171-V174 PolarHBondContact O-N 3.37Å; K171-H175 WeakPolarHBondContact O-CB 3.47Å; K171-H175 PolarHBondContact O-N 3.21Å
172	L	94.4	Very high	89	Confident	67 Å²	67	50.9 Å²	50.9	35%	0.351	25%	0.248	S	C	.	.	H	α-helix	trans	-60.1	-40.5	176.4	-75.7	173.1	0	0	0	111	L138 E168 G169 H175 N176	L138-L172 HydrophobicContact CD2-CB 4.18Å; E168-L172 WeakPolarHBondContact O-CB 3.36Å; E168-L172 WeakPolarHBondContact O-CG 3.44Å; E168-L172 PolarHBondContact O-N 2.95Å; G169-L172 PolarHBondContact O-N 2.97Å; L172-H175 PolarHBondContact O-N 3.44Å; L172-N176 WeakPolarHBondContact O-CB 3.19Å; L172-N176 PolarHBondContact O-N 3.26Å; L172-N176 PolarHBondContact O-ND2 3.46Å
173	Y	96.4	Very high	89.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.2	-51.9	174.4	-177.7	-81.7	0	0	0	111.9	I86 F137 D152 F156 I159 G169 K171 H175 N176 L177 F187 F203	I86-Y173 HydrophobicContact CG2-CE2 4.25Å; F137-Y173 AromaticContact CD1-CD2 3.57Å; F137-Y173 HydrophobicContact CD1-CD2 3.57Å; F137-Y173 AromaticContact CD1-CE2 3.72Å; F137-Y173 HydrophobicContact CD1-CE2 3.72Å; F137-Y173 HydrophobicContact CD1-CG 4.4Å; F137-Y173 AromaticContact CE1-CD2 3.67Å; F137-Y173 HydrophobicContact CE1-CD2 3.67Å; F137-Y173 AromaticContact CE1-CE2 3.69Å; F137-Y173 HydrophobicContact CE1-CE2 3.69Å; F137-Y173 HydrophobicContact CE1-CG 4.16Å; D152-Y173 WeakPolarHBondContact CB-OH 3.47Å; D152-Y173 VanDerWaalsContact CG-OH 3.26Å; D152-Y173 WeakPolarHBondContact OD2-CE2 3.22Å; D152-Y173 VanDerWaalsContact OD2-CZ 3.28Å; D152-Y173 PolarHBondContact OD2-OH 3.05Å; F156-Y173 HydrophobicContact CB-CE1 4.43Å; F156-Y173 HydrophobicContact CB-CE2 4.3Å; F156-Y173 AromaticContact CD2-CD1 3.42Å; F156-Y173 HydrophobicContact CD2-CD1 3.42Å; F156-Y173 VanDerWaalsContact CD2-CD1 3.42Å; F156-Y173 AromaticContact CD2-CD2 3.89Å; F156-Y173 HydrophobicContact CD2-CD2 3.89Å; F156-Y173 AromaticContact CD2-CE1 3.78Å; F156-Y173 HydrophobicContact CD2-CE1 3.78Å; F156-Y173 HydrophobicContact CD2-CE2 4.15Å; F156-Y173 AromaticContact CD2-CG 3.51Å; F156-Y173 HydrophobicContact CD2-CG 3.51Å; F156-Y173 AromaticContact CE2-CD1 3.71Å; F156-Y173 HydrophobicContact CE2-CD1 3.71Å; F156-Y173 HydrophobicContact CE2-CE1 4.41Å; F156-Y173 AromaticContact CE2-CG 3.86Å; F156-Y173 HydrophobicContact CE2-CG 3.86Å; F156-Y173 HydrophobicContact CG-CD1 4.36Å; F156-Y173 HydrophobicContact CG-CE1 4.31Å; I159-Y173 HydrophobicContact CD1-CD2 3.53Å; I159-Y173 HydrophobicContact CD1-CE2 4.1Å; I159-Y173 HydrophobicContact CD1-CG 4.49Å; G169-Y173 WeakPolarHBondContact O-CB 3.28Å; G169-Y173 PolarHBondContact O-N 2.95Å; K171-Y173 VanDerWaalsContact C-N 3.28Å; K171-Y173 PolarHBondContact O-N 3.2Å; Y173-H175 VanDerWaalsContact C-N 3.29Å; Y173-H175 PolarHBondContact O-N 3.3Å; Y173-N176 PolarHBondContact O-N 3.41Å; Y173-L177 HydrophobicContact CE1-CB 4.38Å; Y173-L177 HydrophobicContact CE1-CD2 4.1Å; Y173-L177 VanDerWaalsContact O-CB 3.24Å; Y173-L177 WeakPolarHBondContact O-CB 3.44Å; Y173-L177 PolarHBondContact O-N 3.4Å; Y173-F187 HydrophobicContact CE1-CZ 4.14Å; Y173-F203 HydrophobicContact CD1-CE1 4.08Å; Y173-F203 HydrophobicContact CD1-CZ 4.18Å; Y173-F203 AromaticContact CE1-CE1 3.88Å; Y173-F203 HydrophobicContact CE1-CE1 3.88Å; Y173-F203 AromaticContact CE1-CZ 3.89Å; Y173-F203 HydrophobicContact CE1-CZ 3.89Å
174	V	96.3	Very high	90.6	Very high	15 Å²	15	51.1 Å²	51.1	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-41.3	-179.9	177.3	0	0	0	0	110.8	K170 K171 R178 R202 F203 F207	K170-V174 WeakPolarHBondContact O-CG2 3.36Å; K170-V174 PolarHBondContact O-N 3.36Å; K171-V174 PolarHBondContact O-N 3.37Å; V174-R178 WeakPolarHBondContact O-CB 3.4Å; V174-R178 PolarHBondContact O-N 3.31Å; V174-R202 HydrophobicContact CG2-CG 4.07Å; V174-F203 HydrophobicContact CG1-CD1 4.4Å; V174-F203 HydrophobicContact CG2-CD1 3.96Å; V174-F203 HydrophobicContact CG2-CE1 3.78Å; V174-F203 HydrophobicContact CG2-CZ 4.45Å; V174-F207 HydrophobicContact CG1-CE2 4.24Å
175	H	95.6	Very high	92.2	Very high	84 Å²	84	44.1 Å²	44.1	39%	0.389	22%	0.22	S	C	.	.	H	α-helix	trans	-61.3	-52.3	176.5	-176.8	76.6	0	0	0	112.4	K171 L172 Y173 L177 R178 D179	K171-H175 WeakPolarHBondContact O-CB 3.47Å; K171-H175 PolarHBondContact O-N 3.21Å; L172-H175 PolarHBondContact O-N 3.44Å; Y173-H175 VanDerWaalsContact C-N 3.29Å; Y173-H175 PolarHBondContact O-N 3.3Å; H175-L177 VanDerWaalsContact C-N 3.34Å; H175-L177 PolarHBondContact O-N 3.39Å; H175-R178 PolarHBondContact CE1-NH2 3.39Å; H175-R178 PolarHBondContact ND1-NH2 3.37Å; H175-R178 WeakPolarHBondContact O-CB 3.45Å; H175-R178 PolarHBondContact O-N 3.11Å; H175-D179 IonicContact CD2-OD2 2.65Å; H175-D179 IonicContact CE1-OD2 2.71Å; H175-D179 IonicContact NE2-OD2 2.89Å; H175-D179 PolarHBondContact NE2-OD2 2.97Å; H175-D179 PolarHBondContact O-N 3.43Å
176	N	97.3	Very high	93.8	Very high	17 Å²	17	41.2 Å²	41.2	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-35.3	-178.5	-66.4	-14.6	0	0	0	111.8	F137 L138 L172 Y173 R178 D179 A180	F137-N176 HydrophobicContact CE1-CB 4.13Å; F137-N176 HydrophobicContact CE2-CB 4.39Å; F137-N176 HydrophobicContact CZ-CB 4.02Å; F137-N176 PolarHBondContact O-ND2 2.84Å; L138-N176 PolarHBondContact O-ND2 3.22Å; L138-N176 VanDerWaalsContact O-ND2 3.11Å; L172-N176 WeakPolarHBondContact O-CB 3.19Å; L172-N176 PolarHBondContact O-N 3.26Å; L172-N176 PolarHBondContact O-ND2 3.46Å; Y173-N176 PolarHBondContact O-N 3.41Å; N176-R178 VanDerWaalsContact C-N 3.35Å; N176-D179 PolarHBondContact O-N 3.38Å; N176-A180 VanDerWaalsContact O-CB 3.27Å; N176-A180 WeakPolarHBondContact O-CB 3.34Å; N176-A180 PolarHBondContact O-N 3.49Å
177	L	97.9	Very high	95.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-44.5	172.6	176.5	67.4	0	0	0	111.6	I86 F137 C150 Y173 H175 D179 A180 L181 F187 F203 F207	I86-L177 HydrophobicContact CD1-CD1 3.93Å; F137-L177 HydrophobicContact CE1-CB 4.4Å; F137-L177 HydrophobicContact CZ-CB 4.2Å; C150-L177 HydrophobicContact CB-CD1 3.57Å; Y173-L177 HydrophobicContact CE1-CB 4.38Å; Y173-L177 HydrophobicContact CE1-CD2 4.1Å; Y173-L177 VanDerWaalsContact O-CB 3.24Å; Y173-L177 WeakPolarHBondContact O-CB 3.44Å; Y173-L177 PolarHBondContact O-N 3.4Å; H175-L177 VanDerWaalsContact C-N 3.34Å; H175-L177 PolarHBondContact O-N 3.39Å; L177-D179 VanDerWaalsContact C-N 3.32Å; L177-D179 PolarHBondContact O-N 2.97Å; L177-A180 PolarHBondContact O-N 3.27Å; L177-L181 HydrophobicContact CD1-CD1 3.96Å; L177-L181 HydrophobicContact CG-CD1 4.17Å; L177-L181 PolarHBondContact O-N 3.07Å; L177-F187 HydrophobicContact CD1-CD2 3.66Å; L177-F187 HydrophobicContact CD1-CE2 3.93Å; L177-F187 HydrophobicContact CD1-CG 4.14Å; L177-F187 HydrophobicContact CD2-CB 4.3Å; L177-F187 HydrophobicContact CD2-CD1 3.52Å; L177-F187 HydrophobicContact CD2-CD2 3.77Å; L177-F187 HydrophobicContact CD2-CE1 3.54Å; L177-F187 HydrophobicContact CD2-CE2 3.79Å; L177-F187 HydrophobicContact CD2-CG 3.61Å; L177-F187 HydrophobicContact CD2-CZ 3.65Å; L177-F187 HydrophobicContact CG-CD2 4.33Å; L177-F187 HydrophobicContact CG-CG 4.4Å; L177-F203 HydrophobicContact CD2-CD1 4.08Å; L177-F203 HydrophobicContact CD2-CE1 3.7Å; L177-F207 HydrophobicContact CB-CZ 4.33Å; L177-F207 HydrophobicContact CD2-CE1 4.09Å; L177-F207 HydrophobicContact CD2-CE2 4.12Å; L177-F207 HydrophobicContact CD2-CZ 3.65Å; L177-F207 HydrophobicContact CG-CE1 4.19Å; L177-F207 HydrophobicContact CG-CE2 4.46Å; L177-F207 HydrophobicContact CG-CZ 3.67Å
178	R	96.6	Very high	96	Very high	83 Å²	83	36.7 Å²	36.7	31%	0.313	18%	0.183	S	C	.	.	H	α-helix	trans	-60.2	-46.9	176.2	-172.3	-167.7	68	-173.5	-2	110	V174 H175 N176 A180 L181 F207 R235	V174-R178 WeakPolarHBondContact O-CB 3.4Å; V174-R178 PolarHBondContact O-N 3.31Å; H175-R178 PolarHBondContact CE1-NH2 3.39Å; H175-R178 PolarHBondContact ND1-NH2 3.37Å; H175-R178 WeakPolarHBondContact O-CB 3.45Å; H175-R178 PolarHBondContact O-N 3.11Å; N176-R178 VanDerWaalsContact C-N 3.35Å; R178-A180 PolarHBondContact O-N 3.16Å; R178-L181 PolarHBondContact O-N 2.9Å; R178-F207 HydrophobicContact CB-CE2 4.19Å; R178-F207 HydrophobicContact CB-CZ 4.06Å; R178-R235 HydrophobicContact CG-CG 4.35Å; R178-R235 WeakPolarHBondContact O-CD 3.45Å; R178-R235 PolarHBondContact O-NE 3.3Å; R178-R235 PolarHBondContact O-NH1 3.47Å
179	D	96.1	Very high	96.5	Very high	58 Å²	58	32.4 Å²	32.4	31%	0.31	16%	0.163	S	C	.	.	H	α-helix	trans	-69.3	-32.4	-177.5	-70.8	5.2	0	0	0	112.7	H175 N176 L177	H175-D179 IonicContact CD2-OD2 2.65Å; H175-D179 IonicContact CE1-OD2 2.71Å; H175-D179 IonicContact NE2-OD2 2.89Å; H175-D179 PolarHBondContact NE2-OD2 2.97Å; H175-D179 PolarHBondContact O-N 3.43Å; N176-D179 PolarHBondContact O-N 3.38Å; L177-D179 VanDerWaalsContact C-N 3.32Å; L177-D179 PolarHBondContact O-N 2.97Å
180	A	97.9	Very high	96.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-40.1	175.8	0	0	0	0	0	113.4	L84 L144 A145 G146 F147 N176 L177 R178	L84-A180 HydrophobicContact CD2-CB 4.31Å; L144-A180 HydrophobicContact CB-CB 4.18Å; L144-A180 VanDerWaalsContact O-CA 3.3Å; L144-A180 WeakPolarHBondContact O-CA 3.49Å; A145-A180 CarbonylContact C-O 3.56Å; A145-A180 WeakPolarHBondContact CA-O 3.34Å; G146-A180 PolarHBondContact N-O 3.47Å; F147-A180 HydrophobicContact CD2-CB 4.35Å; F147-A180 WeakPolarHBondContact CD2-O 3.41Å; F147-A180 PolarHBondContact N-O 2.77Å; N176-A180 VanDerWaalsContact O-CB 3.27Å; N176-A180 WeakPolarHBondContact O-CB 3.34Å; N176-A180 PolarHBondContact O-N 3.49Å; L177-A180 PolarHBondContact O-N 3.27Å; R178-A180 PolarHBondContact O-N 3.16Å
181	L	98.3	Very high	96.9	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	152.9	-178	-77.3	165	0	0	0	112.3	F147 C150 L177 R178 I186 F187 F207 R235	F147-L181 CarbonylContact O-C 3.53Å; F147-L181 WeakPolarHBondContact O-CA 3.06Å; C150-L181 HydrophobicContact CB-CD1 4.3Å; C150-L181 HydrophobicContact CB-CD2 3.89Å; C150-L181 HydrophobicContact CB-CG 4.1Å; C150-L181 VanDerWaalsContact SG-CD2 3.5Å; C150-L181 VanDerWaalsContact SG-CG 3.58Å; L177-L181 HydrophobicContact CD1-CD1 3.96Å; L177-L181 HydrophobicContact CG-CD1 4.17Å; L177-L181 PolarHBondContact O-N 3.07Å; R178-L181 PolarHBondContact O-N 2.9Å; L181-I186 VanDerWaalsContact CD2-O 3.28Å; L181-I186 WeakPolarHBondContact CD2-O 3.38Å; L181-F187 HydrophobicContact CD1-CB 4.05Å; L181-F207 HydrophobicContact CD1-CE1 3.61Å; L181-F207 HydrophobicContact CD1-CZ 4.25Å; L181-R235 HydrophobicContact CB-CB 4.38Å; L181-R235 HydrophobicContact CD1-CB 4.46Å; L181-R235 PolarHBondContact O-NH1 3.32Å
182	K	97.7	Very high	96.9	Very high	84 Å²	84	30.6 Å²	30.6	37%	0.365	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	163.3	162	-64.8	179.8	-160.6	164.9	0	110.4	G146 F147 D148 S184 G185 R235	G146-K182 WeakPolarHBondContact O-CE 3.34Å; F147-K182 PolarHBondContact O-N 3.23Å; D148-K182 WeakPolarHBondContact OD1-CD 3.15Å; D148-K182 WeakPolarHBondContact OD1-CE 3.38Å; D148-K182 IonicContact OD1-NZ 2.68Å; D148-K182 PolarHBondContact OD1-NZ 3.44Å; D148-K182 IonicContact OD2-NZ 3.63Å; D148-K182 PolarHBondContact OD2-NZ 3.06Å; K182-S184 PolarHBondContact O-N 3.2Å; K182-G185 WeakPolarHBondContact O-CA 3.47Å; K182-G185 PolarHBondContact O-N 3.04Å; K182-R235 WeakPolarHBondContact O-CD 3.38Å
183	D	95.9	Very high	96.7	Very high	74 Å²	74	29.9 Å²	29.9	40%	0.396	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.9	132.2	162.8	-79.6	-1.2	0	0	0	109.6	G185 R237	D183-G185 PolarHBondContact O-N 2.89Å; D183-R237 IonicContact OD2-CZ 2.68Å; D183-R237 VanDerWaalsContact OD2-CZ 3.26Å; D183-R237 IonicContact OD2-NE 3.44Å; D183-R237 PolarHBondContact OD2-NE 3.06Å; D183-R237 IonicContact OD2-NH2 3.61Å; D183-R237 PolarHBondContact OD2-NH2 2.7Å
184	S	96.8	Very high	96.5	Very high	72 Å²	72	30.2 Å²	30.2	50%	0.503	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	62	12.2	-174.4	-58.7	0	0	0	0	115.8	K182 K234 R235	K182-S184 PolarHBondContact O-N 3.2Å; S184-K234 WeakPolarHBondContact OG-CE 3.43Å; S184-R235 WeakPolarHBondContact CA-O 3.04Å; S184-R235 PolarHBondContact N-O 3.35Å
185	G	98.4	Very high	96.2	Very high	4 Å²	4	32.7 Å²	32.7	4%	0.041	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	156.4	171.8	0	0	0	0	0	112	D148 K182 D183 K234 R235	D148-G185 CarbonylContact O-C 3.37Å; D148-G185 WeakPolarHBondContact O-CA 3.27Å; K182-G185 WeakPolarHBondContact O-CA 3.47Å; K182-G185 PolarHBondContact O-N 3.04Å; D183-G185 PolarHBondContact O-N 2.89Å; G185-K234 CarbonylContact O-C 3.57Å; G185-K234 WeakPolarHBondContact O-CA 3.38Å; G185-R235 PolarHBondContact O-N 3.13Å
186	I	98.8	Very high	96.2	Very high	21 Å²	21	31.1 Å²	31.1	11%	0.108	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	137.9	-174.4	-60.1	-58.5	0	0	0	110.6	W71 I77 D148 V149 C150 L181 I232 F233 K234	W71-I186 HydrophobicContact CH2-CD1 4.41Å; W71-I186 HydrophobicContact CH2-CG1 4.23Å; W71-I186 HydrophobicContact CH2-CG2 3.64Å; W71-I186 HydrophobicContact CZ3-CG2 3.8Å; I77-I186 HydrophobicContact CD1-CG1 4.47Å; D148-I186 PolarHBondContact O-N 3.44Å; V149-I186 CarbonylContact C-O 3.57Å; V149-I186 VanDerWaalsContact CA-O 3.27Å; V149-I186 WeakPolarHBondContact CA-O 3.19Å; V149-I186 HydrophobicContact CG1-CB 4.38Å; V149-I186 HydrophobicContact CG1-CG2 4.42Å; V149-I186 HydrophobicContact CG2-CB 4.33Å; C150-I186 PolarHBondContact N-O 3.26Å; L181-I186 VanDerWaalsContact CD2-O 3.28Å; L181-I186 WeakPolarHBondContact CD2-O 3.38Å; I186-I232 HydrophobicContact CG2-CG2 3.81Å; I186-F233 WeakPolarHBondContact CA-O 3.3Å; I186-K234 HydrophobicContact CD1-CB 3.99Å; I186-K234 HydrophobicContact CD1-CD 4.27Å; I186-K234 HydrophobicContact CD1-CG 4.25Å
187	F	98.8	Very high	96	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.1	168.4	172.4	-132	0	0	0	110.1	C150 D152 Y173 L177 L181 I189 F203 F207 I232 F233	C150-F187 HydrophobicContact CB-CD2 4.3Å; C150-F187 CarbonylContact O-C 3.51Å; C150-F187 WeakPolarHBondContact O-CA 3.43Å; D152-F187 HydrophobicContact CB-CE2 3.79Å; D152-F187 HydrophobicContact CB-CZ 4.15Å; Y173-F187 HydrophobicContact CE1-CZ 4.14Å; L177-F187 HydrophobicContact CD1-CD2 3.66Å; L177-F187 HydrophobicContact CD1-CE2 3.93Å; L177-F187 HydrophobicContact CD1-CG 4.14Å; L177-F187 HydrophobicContact CD2-CB 4.3Å; L177-F187 HydrophobicContact CD2-CD1 3.52Å; L177-F187 HydrophobicContact CD2-CD2 3.77Å; L177-F187 HydrophobicContact CD2-CE1 3.54Å; L177-F187 HydrophobicContact CD2-CE2 3.79Å; L177-F187 HydrophobicContact CD2-CG 3.61Å; L177-F187 HydrophobicContact CD2-CZ 3.65Å; L177-F187 HydrophobicContact CG-CD2 4.33Å; L177-F187 HydrophobicContact CG-CG 4.4Å; L181-F187 HydrophobicContact CD1-CB 4.05Å; F187-I189 HydrophobicContact CE1-CB 3.74Å; F187-I189 HydrophobicContact CE1-CD1 4.17Å; F187-I189 HydrophobicContact CE1-CG2 3.95Å; F187-I189 HydrophobicContact CE2-CB 4.14Å; F187-I189 HydrophobicContact CZ-CB 3.55Å; F187-I189 HydrophobicContact CZ-CD1 3.84Å; F187-I189 HydrophobicContact CZ-CG1 4.1Å; F187-I189 HydrophobicContact CZ-CG2 4.29Å; F187-F203 HydrophobicContact CD1-CD1 4.38Å; F187-F203 HydrophobicContact CD1-CE1 4.36Å; F187-F203 AromaticContact CE1-CD1 3.94Å; F187-F203 HydrophobicContact CE1-CD1 3.94Å; F187-F203 HydrophobicContact CE1-CD2 4.36Å; F187-F203 AromaticContact CE1-CE1 3.55Å; F187-F203 HydrophobicContact CE1-CE1 3.55Å; F187-F203 HydrophobicContact CE1-CE2 4.04Å; F187-F203 HydrophobicContact CE1-CG 4.34Å; F187-F203 AromaticContact CE1-CZ 3.62Å; F187-F203 HydrophobicContact CE1-CZ 3.62Å; F187-F203 HydrophobicContact CZ-CE1 4.11Å; F187-F203 HydrophobicContact CZ-CZ 4.01Å; F187-F207 HydrophobicContact CB-CD1 4.46Å; F187-F207 HydrophobicContact CB-CE1 4.32Å; F187-I232 CarbonylContact O-C 3.56Å; F187-I232 WeakPolarHBondContact O-CA 3.48Å; F187-F233 HydrophobicContact CB-CB 4.18Å; F187-F233 HydrophobicContact CD1-CB 4.21Å; F187-F233 AromaticContact CD1-CD2 3.83Å; F187-F233 HydrophobicContact CD1-CD2 3.83Å; F187-F233 HydrophobicContact CD1-CG 4.34Å; F187-F233 HydrophobicContact CE1-CD2 4.36Å; F187-F233 PolarHBondContact N-O 3.49Å; F187-F233 PolarHBondContact O-N 2.75Å
188	A	98.8	Very high	95.8	Very high	2 Å²	2	36.4 Å²	36.4	2%	0.017	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.6	172.4	0	0	0	0	0	109.3	V68 C150 I151 D152 L231 I232	V68-A188 HydrophobicContact CG1-CB 3.97Å; C150-A188 PolarHBondContact O-N 2.89Å; I151-A188 CarbonylContact C-O 3.59Å; I151-A188 WeakPolarHBondContact CA-O 3.48Å; I151-A188 HydrophobicContact CG1-CB 4.43Å; D152-A188 PolarHBondContact N-O 2.65Å; A188-L231 WeakPolarHBondContact CA-O 3.35Å; A188-I232 HydrophobicContact CB-CD1 3.54Å
189	I	98.5	Very high	95.8	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.7	177.7	-175.6	162.3	0	0	0	110.8	D152 F156 F187 L199 F203 A230 L231 F233	D152-I189 HydrophobicContact CB-CG1 4.33Å; D152-I189 CarbonylContact O-C 3.47Å; D152-I189 WeakPolarHBondContact O-CA 3.33Å; F156-I189 HydrophobicContact CB-CD1 4.03Å; F156-I189 HydrophobicContact CD1-CD1 4.09Å; F156-I189 HydrophobicContact CG-CD1 4.32Å; F187-I189 HydrophobicContact CE1-CB 3.74Å; F187-I189 HydrophobicContact CE1-CD1 4.17Å; F187-I189 HydrophobicContact CE1-CG2 3.95Å; F187-I189 HydrophobicContact CE2-CB 4.14Å; F187-I189 HydrophobicContact CZ-CB 3.55Å; F187-I189 HydrophobicContact CZ-CD1 3.84Å; F187-I189 HydrophobicContact CZ-CG1 4.1Å; F187-I189 HydrophobicContact CZ-CG2 4.29Å; I189-L199 HydrophobicContact CD1-CD2 3.88Å; I189-L199 HydrophobicContact CG2-CD1 4.28Å; I189-F203 HydrophobicContact CD1-CE2 4Å; I189-F203 HydrophobicContact CD1-CZ 4.13Å; I189-A230 CarbonylContact O-C 3.56Å; I189-A230 VanDerWaalsContact O-CA 3.26Å; I189-A230 WeakPolarHBondContact O-CA 3.43Å; I189-L231 HydrophobicContact CG2-CB 3.98Å; I189-L231 PolarHBondContact N-O 3.39Å; I189-L231 PolarHBondContact O-N 3.43Å; I189-F233 HydrophobicContact CG2-CD2 4.17Å; I189-F233 HydrophobicContact CG2-CE2 3.83Å
190	T	97.2	Very high	95.8	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.5	164.7	-56.1	0	0	0	0	108.7	F60 S64 D152 G154 V228 A229	F60-T190 HydrophobicContact CB-CG2 4.4Å; F60-T190 HydrophobicContact CD2-CG2 3.46Å; F60-T190 VanDerWaalsContact CD2-CG2 3.46Å; F60-T190 HydrophobicContact CE2-CG2 3.99Å; F60-T190 WeakPolarHBondContact CE2-O 3.49Å; F60-T190 HydrophobicContact CG-CG2 4.11Å; S64-T190 VanDerWaalsContact OG-CG2 3.29Å; S64-T190 WeakPolarHBondContact OG-CG2 3.36Å; S64-T190 PolarHBondContact OG-OG1 2.79Å; D152-T190 PolarHBondContact O-N 2.77Å; G154-T190 PolarHBondContact N-O 3.05Å; T190-V228 HydrophobicContact CG2-CG1 3.23Å; T190-A229 CarbonylContact C-O 3.49Å; T190-A229 WeakPolarHBondContact CA-O 3.41Å
191	S	95.3	Very high	95.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.7	-177.4	167.1	0	0	0	0	112.6	D157 N193 W194 V228 A229	D157-S191 WeakPolarHBondContact OD1-CB 3.37Å; D157-S191 PolarHBondContact OD1-OG 3.47Å; D157-S191 WeakPolarHBondContact OD2-CA 3.45Å; D157-S191 PolarHBondContact OD2-OG 2.9Å; S191-N193 PolarHBondContact OG-N 2.89Å; S191-W194 WeakPolarHBondContact OG-CB 3.4Å; S191-W194 PolarHBondContact OG-N 3.3Å; S191-V228 CarbonylContact O-C 3.54Å; S191-V228 VanDerWaalsContact O-CA 3.31Å; S191-V228 WeakPolarHBondContact O-CA 3.48Å; S191-V228 VanDerWaalsContact O-CG1 3.26Å; S191-V228 WeakPolarHBondContact O-CG1 3.43Å; S191-A229 PolarHBondContact N-O 3.36Å; S191-A229 PolarHBondContact O-N 3.14Å
192	C	91.3	Very high	95.5	Very high	55 Å²	55	37.7 Å²	37.7	37%	0.372	20%	0.197	S	C	.	.	S	Bend	trans	-104.6	-17.9	173.4	67.4	0	0	0	0	114.2	F60 D157 V228	F60-C192 HydrophobicContact CD1-CB 4.5Å; F60-C192 HydrophobicContact CE1-CB 3.69Å; F60-C192 HydrophobicContact CZ-CB 4.21Å; D157-C192 PolarHBondContact OD2-N 3.45Å; C192-V228 HydrophobicContact CB-CG2 4.26Å
193	N	90.1	Very high	95.5	Very high	51 Å²	51	33.7 Å²	33.7	27%	0.273	18%	0.18	S	C	.	.	S	Bend	trans	-89	-32	177	-67	-35.1	0	0	0	111.6	F27 D157 S191	F27-N193 HydrophobicContact CD1-CB 3.97Å; F27-N193 HydrophobicContact CE1-CB 3.6Å; F27-N193 WeakPolarHBondContact CE1-O 3.39Å; F27-N193 HydrophobicContact CE2-CB 4.3Å; F27-N193 HydrophobicContact CG-CB 4.48Å; F27-N193 HydrophobicContact CZ-CB 3.78Å; F27-N193 WeakPolarHBondContact CZ-O 3.3Å; D157-N193 VanDerWaalsContact OD1-CB 3.29Å; D157-N193 WeakPolarHBondContact OD1-CB 3.44Å; D157-N193 PolarHBondContact OD1-N 3.16Å; D157-N193 VanDerWaalsContact OD1-N 3.13Å; S191-N193 PolarHBondContact OG-N 2.89Å
194	W	92.2	Very high	95.4	Very high	8 Å²	8	34 Å²	34	3%	0.03	19%	0.187	C	C	.	.	S	Bend	trans	-96.5	132.1	-174.9	-63.1	76.9	0	0	0	112.4	F27 F156 S160 K170 S191 Q198 L199 R202 A229	F27-W194 HydrophobicContact CD2-CZ2 4.41Å; F27-W194 AromaticContact CE2-CD2 3.99Å; F27-W194 HydrophobicContact CE2-CD2 3.99Å; F27-W194 AromaticContact CE2-CE2 3.45Å; F27-W194 VanDerWaalsContact CE2-CE2 3.45Å; F27-W194 HydrophobicContact CE2-CG 4.37Å; F27-W194 HydrophobicContact CE2-CH2 4.24Å; F27-W194 AromaticContact CE2-CZ2 3.61Å; F27-W194 HydrophobicContact CE2-CZ2 3.61Å; F27-W194 AromaticContact CE2-NE1 3.59Å; F27-W194 HydrophobicContact CZ-CD2 4.15Å; F27-W194 HydrophobicContact CZ-CG 4.23Å; F156-W194 AromaticContact CD1-CD1 4Å; F156-W194 AromaticContact CD1-NE1 3.66Å; F156-W194 AromaticContact CE1-CD2 3.98Å; F156-W194 HydrophobicContact CE1-CD2 3.98Å; F156-W194 AromaticContact CE1-CE2 3.46Å; F156-W194 VanDerWaalsContact CE1-CE2 3.46Å; F156-W194 HydrophobicContact CE1-CG 4.42Å; F156-W194 HydrophobicContact CE1-CH2 4.42Å; F156-W194 AromaticContact CE1-CZ2 3.71Å; F156-W194 HydrophobicContact CE1-CZ2 3.71Å; F156-W194 AromaticContact CE1-NE1 3.55Å; F156-W194 HydrophobicContact CZ-CZ2 4.09Å; S160-W194 PolarHBondContact OG-NE1 3.37Å; K170-W194 HydrophobicContact CD-CH2 3.84Å; K170-W194 HydrophobicContact CD-CZ2 3.55Å; S191-W194 WeakPolarHBondContact OG-CB 3.4Å; S191-W194 PolarHBondContact OG-N 3.3Å; W194-Q198 HydrophobicContact CE3-CB 3.5Å; W194-Q198 HydrophobicContact CZ3-CB 3.92Å; W194-L199 HydrophobicContact CB-CD1 4.23Å; W194-L199 HydrophobicContact CB-CD2 3.54Å; W194-L199 HydrophobicContact CB-CG 3.6Å; W194-L199 HydrophobicContact CD2-CD2 4.27Å; W194-L199 HydrophobicContact CG-CD2 3.85Å; W194-L199 HydrophobicContact CG-CG 4.41Å; W194-R202 HydrophobicContact CZ3-CB 4.4Å; W194-A229 WeakPolarHBondContact O-CB 3.32Å
195	T	91.8	Very high	95.1	Very high	67 Å²	67	38.2 Å²	38.2	41%	0.411	20%	0.199	S	C	.	.			trans	-70.2	162.8	165.6	62.6	0	0	0	0	110.7	E197 Q198 L199	T195-E197 VanDerWaalsContact C-N 3.29Å; T195-E197 PolarHBondContact O-N 3.13Å; T195-Q198 PolarHBondContact O-N 3.02Å; T195-Q198 VanDerWaalsContact OG1-CG 3.25Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.45Å; T195-Q198 PolarHBondContact OG1-N 3.13Å; T195-Q198 PolarHBondContact OG1-OE1 3.27Å; T195-L199 WeakPolarHBondContact O-CG 3.41Å; T195-L199 PolarHBondContact O-N 3.22Å
196	K	93.8	Very high	95	Very high	50 Å²	50	38.7 Å²	38.7	22%	0.217	20%	0.204	C	C	.	.	H	α-helix	trans	-54.4	-48.7	172.9	171.7	-179.4	-176.8	177.6	0	111.3	Q198 L199 L200 E212 L231	K196-Q198 VanDerWaalsContact C-N 3.34Å; K196-Q198 PolarHBondContact O-N 3.05Å; K196-L199 PolarHBondContact O-N 3.35Å; K196-L200 HydrophobicContact CG-CD1 4.04Å; K196-L200 HydrophobicContact CG-CG 4.21Å; K196-L200 VanDerWaalsContact O-CG 3.29Å; K196-L200 WeakPolarHBondContact O-CG 3.02Å; K196-L200 PolarHBondContact O-N 3.01Å; K196-E212 VanDerWaalsContact CD-OE2 3.29Å; K196-E212 WeakPolarHBondContact CD-OE2 2.94Å; K196-E212 WeakPolarHBondContact CE-OE2 3.01Å; K196-E212 IonicContact NZ-OE2 3.03Å; K196-E212 PolarHBondContact NZ-OE2 3.3Å; K196-L231 HydrophobicContact CB-CD1 4.5Å; K196-L231 HydrophobicContact CB-CD2 4.37Å; K196-L231 HydrophobicContact CD-CD2 4.39Å; K196-L231 HydrophobicContact CG-CD1 4.09Å; K196-L231 HydrophobicContact CG-CD2 3.99Å
197	E	94.1	Very high	95	Very high	104 Å²	104	38.2 Å²	38.2	49%	0.486	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-43.1	-175.7	-68.4	66.1	-145.5	0	0	111.4	T195 L200 E201	T195-E197 VanDerWaalsContact C-N 3.29Å; T195-E197 PolarHBondContact O-N 3.13Å; E197-L200 PolarHBondContact O-N 3.32Å; E197-E201 PolarHBondContact O-N 3.02Å
198	Q	93.9	Very high	94.9	Very high	25 Å²	25	42.1 Å²	42.1	12%	0.117	22%	0.219	C	C	.	.	H	α-helix	trans	-67.8	-36.6	177	-65.5	164.8	-61	0	0	112.2	Y22 W194 T195 K196 E201 R202	Y22-Q198 HydrophobicContact CD1-CG 3.95Å; Y22-Q198 HydrophobicContact CE1-CG 4.14Å; Y22-Q198 HydrophobicContact CG-CG 4.32Å; W194-Q198 HydrophobicContact CE3-CB 3.5Å; W194-Q198 HydrophobicContact CZ3-CB 3.92Å; T195-Q198 PolarHBondContact O-N 3.02Å; T195-Q198 VanDerWaalsContact OG1-CG 3.25Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.45Å; T195-Q198 PolarHBondContact OG1-N 3.13Å; T195-Q198 PolarHBondContact OG1-OE1 3.27Å; K196-Q198 VanDerWaalsContact C-N 3.34Å; K196-Q198 PolarHBondContact O-N 3.05Å; Q198-E201 PolarHBondContact O-N 3.08Å; Q198-R202 VanDerWaalsContact O-CB 3.29Å; Q198-R202 WeakPolarHBondContact O-CB 3.24Å; Q198-R202 PolarHBondContact O-N 2.73Å
199	L	96.1	Very high	94.9	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-42.7	172.6	-69.2	173.9	0	0	0	111.4	F156 I189 W194 T195 K196 E201 R202 F203 A229 L231 F233	F156-L199 HydrophobicContact CD1-CD2 4.47Å; I189-L199 HydrophobicContact CD1-CD2 3.88Å; I189-L199 HydrophobicContact CG2-CD1 4.28Å; W194-L199 HydrophobicContact CB-CD1 4.23Å; W194-L199 HydrophobicContact CB-CD2 3.54Å; W194-L199 HydrophobicContact CB-CG 3.6Å; W194-L199 HydrophobicContact CD2-CD2 4.27Å; W194-L199 HydrophobicContact CG-CD2 3.85Å; W194-L199 HydrophobicContact CG-CG 4.41Å; T195-L199 WeakPolarHBondContact O-CG 3.41Å; T195-L199 PolarHBondContact O-N 3.22Å; K196-L199 PolarHBondContact O-N 3.35Å; L199-E201 VanDerWaalsContact C-N 3.31Å; L199-E201 PolarHBondContact O-N 3.26Å; L199-R202 PolarHBondContact O-N 3.13Å; L199-F203 HydrophobicContact CB-CD2 4.49Å; L199-F203 HydrophobicContact CD2-CD2 4.32Å; L199-F203 HydrophobicContact CD2-CE2 3.82Å; L199-F203 VanDerWaalsContact O-CD2 3.27Å; L199-F203 WeakPolarHBondContact O-CD2 2.97Å; L199-F203 PolarHBondContact O-N 2.8Å; L199-A229 HydrophobicContact CD1-CB 3.97Å; L199-L231 HydrophobicContact CB-CD1 3.64Å; L199-L231 HydrophobicContact CD1-CD1 3.72Å; L199-L231 HydrophobicContact CD1-CG 4Å; L199-L231 HydrophobicContact CG-CD1 4.34Å; L199-F233 HydrophobicContact CB-CZ 4.33Å
200	L	96.8	Very high	94.9	Very high	52 Å²	52	49.1 Å²	49.1	27%	0.272	26%	0.255	S	S	.	.	H	α-helix	trans	-58.8	-44.1	177.3	-69.4	179.3	0	0	0	111.4	K196 E197 C204 F209 L231 F233	K196-L200 HydrophobicContact CG-CD1 4.04Å; K196-L200 HydrophobicContact CG-CG 4.21Å; K196-L200 VanDerWaalsContact O-CG 3.29Å; K196-L200 WeakPolarHBondContact O-CG 3.02Å; K196-L200 PolarHBondContact O-N 3.01Å; E197-L200 PolarHBondContact O-N 3.32Å; L200-C204 VanDerWaalsContact O-CB 3.32Å; L200-C204 WeakPolarHBondContact O-CB 3.36Å; L200-C204 PolarHBondContact O-N 2.95Å; L200-C204 VanDerWaalsContact O-N 3.12Å; L200-F209 HydrophobicContact CD2-CB 3.49Å; L200-F209 VanDerWaalsContact CD2-CB 3.49Å; L200-F209 HydrophobicContact CD2-CD1 4.35Å; L200-F209 HydrophobicContact CD2-CD2 3.51Å; L200-F209 HydrophobicContact CD2-CE2 4.3Å; L200-F209 HydrophobicContact CD2-CG 3.52Å; L200-L231 HydrophobicContact CD2-CD1 4.45Å; L200-F233 HydrophobicContact CD2-CE1 3.82Å; L200-F233 HydrophobicContact CD2-CZ 4.04Å
201	E	94.9	Very high	94.9	Very high	73 Å²	73	52.3 Å²	52.3	34%	0.341	27%	0.27	S	S	.	.	H	α-helix	trans	-66.8	-47.2	176.1	-175.7	162.8	155.9	0	0	111.8	K21 Y22 E197 Q198 L199 F203 C204	K21-E201 PolarHBondContact N-OE1 2.91Å; Y22-E201 VanDerWaalsContact CD2-CD 3.49Å; Y22-E201 WeakPolarHBondContact CD2-OE2 3.33Å; Y22-E201 WeakPolarHBondContact CE2-OE2 3.32Å; E197-E201 PolarHBondContact O-N 3.02Å; Q198-E201 PolarHBondContact O-N 3.08Å; L199-E201 VanDerWaalsContact C-N 3.31Å; L199-E201 PolarHBondContact O-N 3.26Å; E201-F203 VanDerWaalsContact C-N 3.3Å; E201-F203 PolarHBondContact O-N 3.16Å; E201-C204 PolarHBondContact O-N 3.41Å; E201-C204 PolarHBondContact O-SG 2.89Å
202	R	95.2	Very high	95	Very high	44 Å²	44	55.3 Å²	55.3	17%	0.166	28%	0.283	C	S	.	.	H	α-helix	trans	-57.9	-41.1	-178.7	178.7	55.6	56.4	163.9	-2.1	113.1	D24 F156 K170 V174 W194 Q198 L199	D24-R202 IonicContact OD1-CZ 2.84Å; D24-R202 IonicContact OD1-NH1 2.74Å; D24-R202 IonicContact OD1-NH2 3.89Å; D24-R202 PolarHBondContact OD1-NH2 2.89Å; F156-R202 HydrophobicContact CE1-CG 4.11Å; F156-R202 HydrophobicContact CZ-CG 3.74Å; K170-R202 VanDerWaalsContact CB-NH1 3.3Å; V174-R202 HydrophobicContact CG2-CG 4.07Å; W194-R202 HydrophobicContact CZ3-CB 4.4Å; Q198-R202 VanDerWaalsContact O-CB 3.29Å; Q198-R202 WeakPolarHBondContact O-CB 3.24Å; Q198-R202 PolarHBondContact O-N 2.73Å; L199-R202 PolarHBondContact O-N 3.13Å
203	F	96.8	Very high	95.3	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-97.4	0.2	-174.9	-67.9	-78.5	0	0	0	113.3	F156 Y173 V174 L177 F187 I189 L199 E201 E205 F207 F233	F156-F203 HydrophobicContact CD1-CE2 4.39Å; F156-F203 HydrophobicContact CD1-CZ 4.31Å; F156-F203 HydrophobicContact CE1-CE2 4.17Å; F156-F203 HydrophobicContact CE1-CZ 4.22Å; F156-F203 HydrophobicContact CE2-CZ 4.44Å; F156-F203 HydrophobicContact CG-CZ 4.45Å; F156-F203 HydrophobicContact CZ-CZ 4.31Å; Y173-F203 HydrophobicContact CD1-CE1 4.08Å; Y173-F203 HydrophobicContact CD1-CZ 4.18Å; Y173-F203 AromaticContact CE1-CE1 3.88Å; Y173-F203 HydrophobicContact CE1-CE1 3.88Å; Y173-F203 AromaticContact CE1-CZ 3.89Å; Y173-F203 HydrophobicContact CE1-CZ 3.89Å; V174-F203 HydrophobicContact CG1-CD1 4.4Å; V174-F203 HydrophobicContact CG2-CD1 3.96Å; V174-F203 HydrophobicContact CG2-CE1 3.78Å; V174-F203 HydrophobicContact CG2-CZ 4.45Å; L177-F203 HydrophobicContact CD2-CD1 4.08Å; L177-F203 HydrophobicContact CD2-CE1 3.7Å; F187-F203 HydrophobicContact CD1-CD1 4.38Å; F187-F203 HydrophobicContact CD1-CE1 4.36Å; F187-F203 AromaticContact CE1-CD1 3.94Å; F187-F203 HydrophobicContact CE1-CD1 3.94Å; F187-F203 HydrophobicContact CE1-CD2 4.36Å; F187-F203 AromaticContact CE1-CE1 3.55Å; F187-F203 HydrophobicContact CE1-CE1 3.55Å; F187-F203 HydrophobicContact CE1-CE2 4.04Å; F187-F203 HydrophobicContact CE1-CG 4.34Å; F187-F203 AromaticContact CE1-CZ 3.62Å; F187-F203 HydrophobicContact CE1-CZ 3.62Å; F187-F203 HydrophobicContact CZ-CE1 4.11Å; F187-F203 HydrophobicContact CZ-CZ 4.01Å; I189-F203 HydrophobicContact CD1-CE2 4Å; I189-F203 HydrophobicContact CD1-CZ 4.13Å; L199-F203 HydrophobicContact CB-CD2 4.49Å; L199-F203 HydrophobicContact CD2-CD2 4.32Å; L199-F203 HydrophobicContact CD2-CE2 3.82Å; L199-F203 VanDerWaalsContact O-CD2 3.27Å; L199-F203 WeakPolarHBondContact O-CD2 2.97Å; L199-F203 PolarHBondContact O-N 2.8Å; E201-F203 VanDerWaalsContact C-N 3.3Å; E201-F203 PolarHBondContact O-N 3.16Å; F203-E205 PolarHBondContact O-N 2.94Å; F203-E205 VanDerWaalsContact O-N 3.12Å; F203-F207 HydrophobicContact CB-CB 4.31Å; F203-F207 HydrophobicContact CB-CD2 4.28Å; F203-F207 HydrophobicContact CD1-CD2 4.23Å; F203-F207 HydrophobicContact CD1-CE2 4.43Å; F203-F207 VanDerWaalsContact O-CB 3.23Å; F203-F207 WeakPolarHBondContact O-CB 3.38Å; F203-F207 WeakPolarHBondContact O-CD2 3.41Å; F203-F207 PolarHBondContact O-N 2.89Å; F203-F233 HydrophobicContact CB-CD1 4.31Å; F203-F233 HydrophobicContact CB-CE1 4.03Å; F203-F233 HydrophobicContact CB-CZ 4.21Å; F203-F233 HydrophobicContact CD2-CE2 4.36Å; F203-F233 HydrophobicContact CD2-CZ 4.36Å
204	C	94.3	Very high	95.3	Very high	80 Å²	80	55.5 Å²	55.5	54%	0.541	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-27.1	-176.8	72.5	0	0	0	0	113.6	L200 E201 G206	L200-C204 VanDerWaalsContact O-CB 3.32Å; L200-C204 WeakPolarHBondContact O-CB 3.36Å; L200-C204 PolarHBondContact O-N 2.95Å; L200-C204 VanDerWaalsContact O-N 3.12Å; E201-C204 PolarHBondContact O-N 3.41Å; E201-C204 PolarHBondContact O-SG 2.89Å; C204-G206 PolarHBondContact O-N 3.43Å; C204-G206 VanDerWaalsContact O-N 3.1Å
205	E	90.9	Very high	95.1	Very high	162 Å²	162	56 Å²	56	76%	0.757	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	88.9	174.2	-65.5	-167.8	172	0	0	110.8	F203	F203-E205 PolarHBondContact O-N 2.94Å; F203-E205 VanDerWaalsContact O-N 3.12Å
206	G	95.3	Very high	94.5	Very high	14 Å²	14	56.3 Å²	56.3	14%	0.144	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.8	0.3	175.1	0	0	0	0	0	114.7	C204 R235 V236	C204-G206 PolarHBondContact O-N 3.43Å; C204-G206 VanDerWaalsContact O-N 3.1Å; G206-R235 WeakPolarHBondContact O-CA 3.26Å; G206-V236 VanDerWaalsContact C-CG2 3.43Å; G206-V236 WeakPolarHBondContact O-CG2 3.38Å; G206-V236 PolarHBondContact O-N 3.02Å
207	F	98.3	Very high	93.6	Very high	10 Å²	10	57.2 Å²	57.2	4%	0.044	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.6	174	-56.9	-93.6	0	0	0	113.3	V174 L177 R178 L181 F187 F203 F233 K234 R235	V174-F207 HydrophobicContact CG1-CE2 4.24Å; L177-F207 HydrophobicContact CB-CZ 4.33Å; L177-F207 HydrophobicContact CD2-CE1 4.09Å; L177-F207 HydrophobicContact CD2-CE2 4.12Å; L177-F207 HydrophobicContact CD2-CZ 3.65Å; L177-F207 HydrophobicContact CG-CE1 4.19Å; L177-F207 HydrophobicContact CG-CE2 4.46Å; L177-F207 HydrophobicContact CG-CZ 3.67Å; R178-F207 HydrophobicContact CB-CE2 4.19Å; R178-F207 HydrophobicContact CB-CZ 4.06Å; L181-F207 HydrophobicContact CD1-CE1 3.61Å; L181-F207 HydrophobicContact CD1-CZ 4.25Å; F187-F207 HydrophobicContact CB-CD1 4.46Å; F187-F207 HydrophobicContact CB-CE1 4.32Å; F203-F207 HydrophobicContact CB-CB 4.31Å; F203-F207 HydrophobicContact CB-CD2 4.28Å; F203-F207 HydrophobicContact CD1-CD2 4.23Å; F203-F207 HydrophobicContact CD1-CE2 4.43Å; F203-F207 VanDerWaalsContact O-CB 3.23Å; F203-F207 WeakPolarHBondContact O-CB 3.38Å; F203-F207 WeakPolarHBondContact O-CD2 3.41Å; F203-F207 PolarHBondContact O-N 2.89Å; F207-F233 HydrophobicContact CB-CB 4.07Å; F207-F233 HydrophobicContact CB-CD1 4.12Å; F207-F233 HydrophobicContact CB-CG 4.42Å; F207-F233 HydrophobicContact CD1-CB 4.29Å; F207-K234 CarbonylContact C-O 3.58Å; F207-K234 WeakPolarHBondContact CA-O 3.36Å; F207-R235 HydrophobicContact CD1-CB 4.19Å; F207-R235 HydrophobicContact CE1-CB 3.95Å; F207-R235 HydrophobicContact CE1-CG 4.4Å
208	E	98	Very high	92.6	Very high	82 Å²	82	59.1 Å²	59.1	38%	0.383	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.9	167.4	67.8	-176.4	170.5	0	0	110.1	F233 K234 V236	E208-F233 CarbonylContact O-C 3.53Å; E208-F233 VanDerWaalsContact O-CA 3.25Å; E208-F233 WeakPolarHBondContact O-CA 3.13Å; E208-K234 HydrophobicContact CG-CB 3.78Å; E208-K234 HydrophobicContact CG-CG 4.29Å; E208-K234 PolarHBondContact N-O 3.22Å; E208-K234 PolarHBondContact O-N 2.97Å; E208-K234 VanDerWaalsContact OE1-CD 3.3Å; E208-K234 WeakPolarHBondContact OE1-CD 3.23Å; E208-K234 WeakPolarHBondContact OE1-CE 3.19Å; E208-K234 IonicContact OE1-NZ 3.59Å; E208-K234 PolarHBondContact OE1-NZ 3.28Å; E208-V236 HydrophobicContact CB-CG1 3.82Å; E208-V236 HydrophobicContact CG-CG1 3.74Å
209	F	98.5	Very high	91.5	Very high	84 Å²	84	64.6 Å²	64.6	37%	0.368	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	132.2	172.2	171	-107.9	0	0	0	111	L200 Q211 E212 L231 F233	L200-F209 HydrophobicContact CD2-CB 3.49Å; L200-F209 VanDerWaalsContact CD2-CB 3.49Å; L200-F209 HydrophobicContact CD2-CD1 4.35Å; L200-F209 HydrophobicContact CD2-CD2 3.51Å; L200-F209 HydrophobicContact CD2-CE2 4.3Å; L200-F209 HydrophobicContact CD2-CG 3.52Å; F209-Q211 WeakPolarHBondContact CE2-O 3.43Å; F209-E212 HydrophobicContact CE2-CB 4.29Å; F209-E212 HydrophobicContact CZ-CB 4.01Å; F209-E212 VanDerWaalsContact CZ-N 3.26Å; F209-L231 HydrophobicContact CE2-CD2 4.14Å; F209-F233 HydrophobicContact CB-CD1 4.32Å; F209-F233 HydrophobicContact CB-CE1 4.22Å; F209-F233 HydrophobicContact CD2-CE1 4.44Å
210	V	98.3	Very high	89.8	Confident	68 Å²	68	73.6 Å²	73.6	41%	0.412	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-54.1	179.2	178.2	0	0	0	0	110.8	I232 K234	V210-I232 HydrophobicContact CB-CB 4.26Å; V210-I232 HydrophobicContact CB-CG2 3.87Å; V210-I232 WeakPolarHBondContact CB-O 3.03Å; V210-I232 HydrophobicContact CG1-CG2 4.21Å; V210-I232 HydrophobicContact CG2-CG2 4.33Å; V210-I232 PolarHBondContact N-O 2.94Å; V210-K234 HydrophobicContact CG2-CB 3.63Å
211	Q	98.1	Very high	88.8	Confident	70 Å²	70	75 Å²	75	33%	0.327	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	144.7	-172.6	-167.6	-178.2	-28.5	0	0	112	F209 L213 I232	F209-Q211 WeakPolarHBondContact CE2-O 3.43Å; Q211-L213 HydrophobicContact CG-CD2 4.47Å; Q211-I232 HydrophobicContact CB-CB 4.41Å; Q211-I232 PolarHBondContact N-O 2.54Å; Q211-I232 PolarHBondContact O-N 3.05Å
212	E	97.4	Very high	87.6	Confident	62 Å²	62	74.3 Å²	74.3	29%	0.29	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130.1	163.2	176	175.7	-158	0	0	108.9	K196 F209 L231	K196-E212 VanDerWaalsContact CD-OE2 3.29Å; K196-E212 WeakPolarHBondContact CD-OE2 2.94Å; K196-E212 WeakPolarHBondContact CE-OE2 3.01Å; K196-E212 IonicContact NZ-OE2 3.03Å; K196-E212 PolarHBondContact NZ-OE2 3.3Å; F209-E212 HydrophobicContact CE2-CB 4.29Å; F209-E212 HydrophobicContact CZ-CB 4.01Å; F209-E212 VanDerWaalsContact CZ-N 3.26Å; E212-L231 HydrophobicContact CB-CD2 3.77Å; E212-L231 HydrophobicContact CG-CD2 3.75Å
213	L	96.3	Very high	85.7	Confident	4 Å²	4	82.3 Å²	82.3	2%	0.021	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-87.7	135.8	178.4	-50.7	-174.3	0	0	0	109.7	R67 V68 W71 Q211 T215 A230 I232	R67-L213 HydrophobicContact CG-CB 3.65Å; R67-L213 HydrophobicContact CG-CD1 3.9Å; R67-L213 HydrophobicContact CG-CG 4.4Å; V68-L213 HydrophobicContact CG2-CD1 4.1Å; W71-L213 HydrophobicContact CB-CD1 4.27Å; W71-L213 HydrophobicContact CB-CD2 3.85Å; W71-L213 VanDerWaalsContact CD1-CD2 3.46Å; W71-L213 HydrophobicContact CG-CD2 3.71Å; Q211-L213 HydrophobicContact CG-CD2 4.47Å; L213-T215 PolarHBondContact O-N 3.31Å; L213-A230 HydrophobicContact CB-CB 4.01Å; L213-A230 PolarHBondContact N-O 3.45Å; L213-I232 HydrophobicContact CD1-CD1 3.97Å; L213-I232 HydrophobicContact CD1-CG1 4.24Å; L213-I232 HydrophobicContact CD2-CD1 4.4Å; L213-I232 HydrophobicContact CD2-CG1 3.79Å; L213-I232 HydrophobicContact CG-CD1 4.32Å; L213-I232 HydrophobicContact CG-CG1 4.04Å
214	P	91.4	Very high	84.1	Confident	106 Å²	106	87.9 Å²	87.9	69%	0.688	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-62.2	119.5	-176.7	-22	31.9	0	0	0	112.7	R67	R67-P214 VanDerWaalsContact CD-O 3.27Å; R67-P214 WeakPolarHBondContact CD-O 3.49Å; R67-P214 PolarHBondContact NE-O 3.25Å
215	T	87.9	Confident	82.5	Confident	20 Å²	20	86 Å²	86	12%	0.123	47%	0.47	C	S	.	.			trans	-107.8	161.3	175.6	57	0	0	0	0	111.6	L213 S217 V228 A230	L213-T215 PolarHBondContact O-N 3.31Å; T215-S217 PolarHBondContact O-N 3.22Å; T215-V228 WeakPolarHBondContact CB-O 3.37Å; T215-V228 WeakPolarHBondContact CG2-O 3.2Å; T215-V228 PolarHBondContact OG1-O 3.47Å; T215-A230 HydrophobicContact CG2-CB 3.71Å
216	P	79.3	Confident	81.2	Confident	73 Å²	73	81.9 Å²	81.9	47%	0.474	45%	0.454	S	S	.	.			trans	-55.9	128.7	171.8	-23.8	34.7	0	0	0	110.3
217	S	74.5	Confident	80.4	Confident	69 Å²	69	84.2 Å²	84.2	48%	0.483	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	143.4	179.6	63.5	0	0	0	0	110.1	T215 G225 N226	T215-S217 PolarHBondContact O-N 3.22Å; S217-G225 WeakPolarHBondContact CA-O 3.36Å; S217-N226 WeakPolarHBondContact CB-OD1 3.17Å
218	F	73.5	Confident	79.9	Confident	143 Å²	143	84.8 Å²	84.8	63%	0.627	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.7	174	-60.6	-84.5	0	0	0	108.5	G225	F218-G225 PolarHBondContact N-O 3.38Å; F218-G225 PolarHBondContact O-N 2.93Å
219	Q	70.2	Confident	79.7	Confident	141 Å²	141	81.2 Å²	81.2	66%	0.659	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	120.8	177.1	-167.2	178.8	11.9	0	0	109.6	R223 I224	Q219-R223 WeakPolarHBondContact CA-O 3.28Å; Q219-I224 HydrophobicContact CG-CG1 4.22Å
220	F	60.8	Low	79.6	Confident	189 Å²	189	77.2 Å²	77.2	83%	0.829	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.8	124.7	173.5	-166.2	-95	0	0	0	109.8	G222 R223	F220-G222 PolarHBondContact O-N 3.39Å; F220-R223 PolarHBondContact N-O 3.01Å; F220-R223 PolarHBondContact O-N 3.46Å; F220-R223 VanDerWaalsContact O-N 3.16Å
221	G	75.1	Confident	79.6	Confident	81 Å²	81	74 Å²	74	84%	0.835	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	29	179.9	0	0	0	0	0	114.8	R223	G221-R223 VanDerWaalsContact C-N 3.3Å; G221-R223 PolarHBondContact O-N 2.82Å
222	G	70	Confident	79.6	Confident	59 Å²	59	70.7 Å²	70.7	61%	0.608	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-3	-179.4	0	0	0	0	0	115.1	F220	F220-G222 PolarHBondContact O-N 3.39Å
223	R	54.5	Low	79.7	Confident	212 Å²	212	67.8 Å²	67.8	80%	0.8	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	135.7	172	-63.3	-175.7	-179	-176.9	-0.5	109.9	Q219 F220 G221	Q219-R223 WeakPolarHBondContact CA-O 3.28Å; F220-R223 PolarHBondContact N-O 3.01Å; F220-R223 PolarHBondContact O-N 3.46Å; F220-R223 VanDerWaalsContact O-N 3.16Å; G221-R223 VanDerWaalsContact C-N 3.3Å; G221-R223 PolarHBondContact O-N 2.82Å
224	I	63.1	Low	79.8	Confident	116 Å²	116	70.6 Å²	70.6	60%	0.595	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.3	174.6	-59.6	177.1	0	0	0	107.1	Q219	Q219-I224 HydrophobicContact CG-CG1 4.22Å
225	G	60.8	Low	80.1	Confident	40 Å²	40	67.5 Å²	67.5	41%	0.412	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138	171.9	0	0	0	0	0	110.1	S217 F218	S217-G225 WeakPolarHBondContact CA-O 3.36Å; F218-G225 PolarHBondContact N-O 3.38Å; F218-G225 PolarHBondContact O-N 2.93Å
226	N	64.6	Low	80.5	Confident	76 Å²	76	68.8 Å²	68.8	41%	0.406	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	139.8	172	-62.8	-25.2	0	0	0	108.5	S217	S217-N226 WeakPolarHBondContact CB-OD1 3.17Å
227	S	77.5	Confident	80.4	Confident	63 Å²	63	77.8 Å²	77.8	44%	0.441	41%	0.41	S	S	.	.	S	Bend	trans	-77	-16	173.3	57.8	0	0	0	0	112.7
228	V	88.4	Confident	80.7	Confident	22 Å²	22	78.2 Å²	78.2	13%	0.133	41%	0.406	C	S	.	.	S	Bend	trans	-151.6	138.4	-175.9	180	0	0	0	0	108.8	F60 T190 S191 C192 T215	F60-V228 HydrophobicContact CD1-CG2 4.29Å; T190-V228 HydrophobicContact CG2-CG1 3.23Å; S191-V228 CarbonylContact O-C 3.54Å; S191-V228 VanDerWaalsContact O-CA 3.31Å; S191-V228 WeakPolarHBondContact O-CA 3.48Å; S191-V228 VanDerWaalsContact O-CG1 3.26Å; S191-V228 WeakPolarHBondContact O-CG1 3.43Å; C192-V228 HydrophobicContact CB-CG2 4.26Å; T215-V228 WeakPolarHBondContact CB-O 3.37Å; T215-V228 WeakPolarHBondContact CG2-O 3.2Å; T215-V228 PolarHBondContact OG1-O 3.47Å
229	A	93.1	Very high	81.1	Confident	7 Å²	7	74.8 Å²	74.8	6%	0.058	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.4	166.1	0	0	0	0	0	109.9	T190 S191 W194 L199	T190-A229 CarbonylContact C-O 3.49Å; T190-A229 WeakPolarHBondContact CA-O 3.41Å; S191-A229 PolarHBondContact N-O 3.36Å; S191-A229 PolarHBondContact O-N 3.14Å; W194-A229 WeakPolarHBondContact O-CB 3.32Å; L199-A229 HydrophobicContact CD1-CB 3.97Å
230	A	97.1	Very high	81.7	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.008	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	108.1	175.9	0	0	0	0	0	109.5	I189 L213 T215	I189-A230 CarbonylContact O-C 3.56Å; I189-A230 VanDerWaalsContact O-CA 3.26Å; I189-A230 WeakPolarHBondContact O-CA 3.43Å; L213-A230 HydrophobicContact CB-CB 4.01Å; L213-A230 PolarHBondContact N-O 3.45Å; T215-A230 HydrophobicContact CG2-CB 3.71Å
231	L	98.4	Very high	82.9	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	149	-171.4	-53.7	-170.8	0	0	0	111.6	A188 I189 K196 L199 L200 F209 E212 F233	A188-L231 WeakPolarHBondContact CA-O 3.35Å; I189-L231 HydrophobicContact CG2-CB 3.98Å; I189-L231 PolarHBondContact N-O 3.39Å; I189-L231 PolarHBondContact O-N 3.43Å; K196-L231 HydrophobicContact CB-CD1 4.5Å; K196-L231 HydrophobicContact CB-CD2 4.37Å; K196-L231 HydrophobicContact CD-CD2 4.39Å; K196-L231 HydrophobicContact CG-CD1 4.09Å; K196-L231 HydrophobicContact CG-CD2 3.99Å; L199-L231 HydrophobicContact CB-CD1 3.64Å; L199-L231 HydrophobicContact CD1-CD1 3.72Å; L199-L231 HydrophobicContact CD1-CG 4Å; L199-L231 HydrophobicContact CG-CD1 4.34Å; L200-L231 HydrophobicContact CD2-CD1 4.45Å; F209-L231 HydrophobicContact CE2-CD2 4.14Å; E212-L231 HydrophobicContact CB-CD2 3.77Å; E212-L231 HydrophobicContact CG-CD2 3.75Å; L231-F233 HydrophobicContact CB-CD2 4.14Å; L231-F233 HydrophobicContact CB-CE2 3.55Å; L231-F233 HydrophobicContact CB-CZ 4.2Å; L231-F233 HydrophobicContact CD1-CE2 3.78Å; L231-F233 HydrophobicContact CD1-CZ 3.65Å; L231-F233 HydrophobicContact CG-CE2 4.31Å
232	I	98.8	Very high	83.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.8	169.1	-56	-58.3	0	0	0	108.4	W71 I186 F187 A188 V210 Q211 L213	W71-I232 HydrophobicContact CD2-CD1 3.9Å; W71-I232 HydrophobicContact CD2-CG1 3.81Å; W71-I232 HydrophobicContact CE3-CD1 3.87Å; W71-I232 HydrophobicContact CE3-CG1 4.24Å; W71-I232 HydrophobicContact CG-CD1 4.39Å; W71-I232 HydrophobicContact CG-CG1 4.16Å; W71-I232 HydrophobicContact CH2-CG2 3.68Å; W71-I232 HydrophobicContact CZ2-CB 4.34Å; W71-I232 HydrophobicContact CZ2-CG1 4.21Å; W71-I232 HydrophobicContact CZ2-CG2 3.48Å; W71-I232 VanDerWaalsContact CZ2-CG2 3.48Å; W71-I232 HydrophobicContact CZ3-CD1 4.26Å; W71-I232 HydrophobicContact CZ3-CG2 4.28Å; I186-I232 HydrophobicContact CG2-CG2 3.81Å; F187-I232 CarbonylContact O-C 3.56Å; F187-I232 WeakPolarHBondContact O-CA 3.48Å; A188-I232 HydrophobicContact CB-CD1 3.54Å; V210-I232 HydrophobicContact CB-CB 4.26Å; V210-I232 HydrophobicContact CB-CG2 3.87Å; V210-I232 WeakPolarHBondContact CB-O 3.03Å; V210-I232 HydrophobicContact CG1-CG2 4.21Å; V210-I232 HydrophobicContact CG2-CG2 4.33Å; V210-I232 PolarHBondContact N-O 2.94Å; Q211-I232 HydrophobicContact CB-CB 4.41Å; Q211-I232 PolarHBondContact N-O 2.54Å; Q211-I232 PolarHBondContact O-N 3.05Å; L213-I232 HydrophobicContact CD1-CD1 3.97Å; L213-I232 HydrophobicContact CD1-CG1 4.24Å; L213-I232 HydrophobicContact CD2-CD1 4.4Å; L213-I232 HydrophobicContact CD2-CG1 3.79Å; L213-I232 HydrophobicContact CG-CD1 4.32Å; L213-I232 HydrophobicContact CG-CG1 4.04Å
233	F	98.8	Very high	84.3	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.009	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	160.9	172.8	-66.2	-89.8	0	0	0	110.5	I186 F187 I189 L199 L200 F203 F207 E208 F209 L231	I186-F233 WeakPolarHBondContact CA-O 3.3Å; F187-F233 HydrophobicContact CB-CB 4.18Å; F187-F233 HydrophobicContact CD1-CB 4.21Å; F187-F233 AromaticContact CD1-CD2 3.83Å; F187-F233 HydrophobicContact CD1-CD2 3.83Å; F187-F233 HydrophobicContact CD1-CG 4.34Å; F187-F233 HydrophobicContact CE1-CD2 4.36Å; F187-F233 PolarHBondContact N-O 3.49Å; F187-F233 PolarHBondContact O-N 2.75Å; I189-F233 HydrophobicContact CG2-CD2 4.17Å; I189-F233 HydrophobicContact CG2-CE2 3.83Å; L199-F233 HydrophobicContact CB-CZ 4.33Å; L200-F233 HydrophobicContact CD2-CE1 3.82Å; L200-F233 HydrophobicContact CD2-CZ 4.04Å; F203-F233 HydrophobicContact CB-CD1 4.31Å; F203-F233 HydrophobicContact CB-CE1 4.03Å; F203-F233 HydrophobicContact CB-CZ 4.21Å; F203-F233 HydrophobicContact CD2-CE2 4.36Å; F203-F233 HydrophobicContact CD2-CZ 4.36Å; F207-F233 HydrophobicContact CB-CB 4.07Å; F207-F233 HydrophobicContact CB-CD1 4.12Å; F207-F233 HydrophobicContact CB-CG 4.42Å; F207-F233 HydrophobicContact CD1-CB 4.29Å; E208-F233 CarbonylContact O-C 3.53Å; E208-F233 VanDerWaalsContact O-CA 3.25Å; E208-F233 WeakPolarHBondContact O-CA 3.13Å; F209-F233 HydrophobicContact CB-CD1 4.32Å; F209-F233 HydrophobicContact CB-CE1 4.22Å; F209-F233 HydrophobicContact CD2-CE1 4.44Å; L231-F233 HydrophobicContact CB-CD2 4.14Å; L231-F233 HydrophobicContact CB-CE2 3.55Å; L231-F233 HydrophobicContact CB-CZ 4.2Å; L231-F233 HydrophobicContact CD1-CE2 3.78Å; L231-F233 HydrophobicContact CD1-CZ 3.65Å; L231-F233 HydrophobicContact CG-CE2 4.31Å
234	K	98.5	Very high	86.5	Confident	62 Å²	62	52.8 Å²	52.8	27%	0.27	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.1	171.5	171.5	165.5	160.6	-111.4	0	109.4	S184 G185 I186 F207 E208 V210 V236	S184-K234 WeakPolarHBondContact OG-CE 3.43Å; G185-K234 CarbonylContact O-C 3.57Å; G185-K234 WeakPolarHBondContact O-CA 3.38Å; I186-K234 HydrophobicContact CD1-CB 3.99Å; I186-K234 HydrophobicContact CD1-CD 4.27Å; I186-K234 HydrophobicContact CD1-CG 4.25Å; F207-K234 CarbonylContact C-O 3.58Å; F207-K234 WeakPolarHBondContact CA-O 3.36Å; E208-K234 HydrophobicContact CG-CB 3.78Å; E208-K234 HydrophobicContact CG-CG 4.29Å; E208-K234 PolarHBondContact N-O 3.22Å; E208-K234 PolarHBondContact O-N 2.97Å; E208-K234 VanDerWaalsContact OE1-CD 3.3Å; E208-K234 WeakPolarHBondContact OE1-CD 3.23Å; E208-K234 WeakPolarHBondContact OE1-CE 3.19Å; E208-K234 IonicContact OE1-NZ 3.59Å; E208-K234 PolarHBondContact OE1-NZ 3.28Å; V210-K234 HydrophobicContact CG2-CB 3.63Å; K234-V236 PolarHBondContact O-N 3.42Å
235	R	98.1	Very high	88.2	Confident	41 Å²	41	47.9 Å²	47.9	16%	0.155	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	129	177.4	-179	179.2	168.1	-171.8	4.5	109.8	R178 L181 K182 S184 G185 G206 F207	R178-R235 HydrophobicContact CG-CG 4.35Å; R178-R235 WeakPolarHBondContact O-CD 3.45Å; R178-R235 PolarHBondContact O-NE 3.3Å; R178-R235 PolarHBondContact O-NH1 3.47Å; L181-R235 HydrophobicContact CB-CB 4.38Å; L181-R235 HydrophobicContact CD1-CB 4.46Å; L181-R235 PolarHBondContact O-NH1 3.32Å; K182-R235 WeakPolarHBondContact O-CD 3.38Å; S184-R235 WeakPolarHBondContact CA-O 3.04Å; S184-R235 PolarHBondContact N-O 3.35Å; G185-R235 PolarHBondContact O-N 3.13Å; G206-R235 WeakPolarHBondContact O-CA 3.26Å; F207-R235 HydrophobicContact CD1-CB 4.19Å; F207-R235 HydrophobicContact CE1-CB 3.95Å; F207-R235 HydrophobicContact CE1-CG 4.4Å
236	V	95.1	Very high	90.5	Very high	47 Å²	47	48.6 Å²	48.6	29%	0.285	23%	0.229	S	C	.	.			trans	-107.8	161.1	169.6	-62.7	0	0	0	0	110.2	G206 E208 K234	G206-V236 VanDerWaalsContact C-CG2 3.43Å; G206-V236 WeakPolarHBondContact O-CG2 3.38Å; G206-V236 PolarHBondContact O-N 3.02Å; E208-V236 HydrophobicContact CB-CG1 3.82Å; E208-V236 HydrophobicContact CG-CG1 3.74Å; K234-V236 PolarHBondContact O-N 3.42Å
237	R	78.1	Confident	92.9	Very high	262 Å²	262	46.1 Å²	46.1	99%	0.989	21%	0.213	S	C	*	.			trans	-75.7	0	178	-78.3	-172.9	177	167.7	0.8	112	D183	D183-R237 IonicContact OD2-CZ 2.68Å; D183-R237 VanDerWaalsContact OD2-CZ 3.26Å; D183-R237 IonicContact OD2-NE 3.44Å; D183-R237 PolarHBondContact OD2-NE 3.06Å; D183-R237 IonicContact OD2-NH2 3.61Å; D183-R237 PolarHBondContact OD2-NH2 2.7Å

Retrieved 237 of 237 residues in 369.5 ms (Link to these results)

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