A0A096MAD2_POEFO Loading...

Protein arginine methyltransferase 7

AlphaFold DB , UniProt , Accession A0A096MAD2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 577 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	K	37.5	Very low	50.9	Low	267 Å²	267	152.7 Å²	152.7	100%	1.161	80%	0.802	S	S	*	*				0	85.4	0	-82.1	174.1	174.2	174.8	0	107.5
2	S	41.6	Very low	52.9	Low	124 Å²	124	149.8 Å²	149.8	87%	0.867	80%	0.804	S	S	*	*			trans	-85.7	113.3	170.2	168.3	0	0	0	0	106.8
3	R	39	Very low	54.8	Low	223 Å²	223	145.2 Å²	145.2	84%	0.842	77%	0.773	S	S	*	*			trans	-157.3	117.6	170.3	-101.7	-172	-165.1	-166.6	2.9	108.5
4	Y	42.5	Very low	56.8	Low	185 Å²	185	149.2 Å²	149.2	73%	0.725	78%	0.784	S	S	*	*			trans	68.3	96.1	165.2	-60.4	-82	0	0	0	118.9
5	F	40.8	Very low	58.3	Low	181 Å²	181	146.6 Å²	146.6	79%	0.794	76%	0.764	S	S	*	*			trans	-144.9	84.6	130.6	-81.1	-63.6	0	0	0	107.8	F8	F5-F8 HydrophobicContact CB-CE2 3.86Å; F5-F8 HydrophobicContact CB-CZ 4.14Å; F5-F8 AromaticContact CD1-CE1 3.69Å; F5-F8 HydrophobicContact CD1-CE1 3.69Å; F5-F8 AromaticContact CD1-CE2 3.62Å; F5-F8 HydrophobicContact CD1-CE2 3.62Å; F5-F8 AromaticContact CD1-CZ 2.98Å; F5-F8 HydrophobicContact CD1-CZ 2.98Å; F5-F8 HydrophobicContact CD2-CZ 4.48Å; F5-F8 AromaticContact CE1-CE1 3.82Å; F5-F8 HydrophobicContact CE1-CE1 3.82Å; F5-F8 HydrophobicContact CE1-CE2 4.36Å; F5-F8 AromaticContact CE1-CZ 3.34Å; F5-F8 HydrophobicContact CE1-CZ 3.34Å; F5-F8 AromaticContact CG-CE2 3.85Å; F5-F8 HydrophobicContact CG-CE2 3.85Å; F5-F8 AromaticContact CG-CZ 3.63Å; F5-F8 HydrophobicContact CG-CZ 3.63Å; F5-F8 HydrophobicContact CZ-CZ 4.23Å
6	S	40.5	Very low	59	Low	93 Å²	93	145.1 Å²	145.1	65%	0.65	75%	0.746	S	S	*	*			trans	-92.1	118.4	171.2	47.8	0	0	0	0	108.1
7	S	47	Very low	59.1	Low	114 Å²	114	138.8 Å²	138.8	80%	0.797	72%	0.718	S	S	*	*			trans	48.6	105.7	172.7	62.4	0	0	0	0	116.6
8	F	53.3	Low	59.1	Low	160 Å²	160	132.9 Å²	132.9	70%	0.702	70%	0.697	S	S	*	*			trans	-89.2	132.2	160.5	-64.5	-83.1	0	0	0	109.2	F5	F5-F8 HydrophobicContact CB-CE2 3.86Å; F5-F8 HydrophobicContact CB-CZ 4.14Å; F5-F8 AromaticContact CD1-CE1 3.69Å; F5-F8 HydrophobicContact CD1-CE1 3.69Å; F5-F8 AromaticContact CD1-CE2 3.62Å; F5-F8 HydrophobicContact CD1-CE2 3.62Å; F5-F8 AromaticContact CD1-CZ 2.98Å; F5-F8 HydrophobicContact CD1-CZ 2.98Å; F5-F8 HydrophobicContact CD2-CZ 4.48Å; F5-F8 AromaticContact CE1-CE1 3.82Å; F5-F8 HydrophobicContact CE1-CE1 3.82Å; F5-F8 HydrophobicContact CE1-CE2 4.36Å; F5-F8 AromaticContact CE1-CZ 3.34Å; F5-F8 HydrophobicContact CE1-CZ 3.34Å; F5-F8 AromaticContact CG-CE2 3.85Å; F5-F8 HydrophobicContact CG-CE2 3.85Å; F5-F8 AromaticContact CG-CZ 3.63Å; F5-F8 HydrophobicContact CG-CZ 3.63Å; F5-F8 HydrophobicContact CZ-CZ 4.23Å
9	S	68.6	Low	59.7	Low	120 Å²	120	130.2 Å²	130.2	84%	0.839	69%	0.689	S	S	*	*			trans	-107.8	126.8	171.1	54.6	0	0	0	0	109
10	V	77.3	Confident	60.3	Low	141 Å²	141	124.4 Å²	124.4	86%	0.855	66%	0.659	S	S	*	*			trans	-111.1	124.5	174.6	-178.4	0	0	0	0	108.1
11	A	71.6	Confident	60.9	Low	72 Å²	72	123.7 Å²	123.7	60%	0.595	65%	0.654	S	S	*	*			trans	-106.2	129.4	168.5	0	0	0	0	0	108.3	F13	A11-F13 HydrophobicContact CB-CE2 3.92Å; A11-F13 HydrophobicContact CB-CZ 3.98Å
12	S	75.8	Confident	62.1	Low	117 Å²	117	113 Å²	113	82%	0.818	61%	0.612	S	S	*	*			trans	-108.1	132.8	176.9	-179.1	0	0	0	0	109.8
13	F	77.4	Confident	63.1	Low	91 Å²	91	114.8 Å²	114.8	40%	0.399	61%	0.612	S	S	.	*			trans	-117.8	121.4	178.2	-57.8	-83.4	0	0	0	109.1	A11 K15 D25	A11-F13 HydrophobicContact CB-CE2 3.92Å; A11-F13 HydrophobicContact CB-CZ 3.98Å; F13-K15 PolarHBondContact O-N 3.12Å; F13-D25 HydrophobicContact CD1-CB 4.03Å; F13-D25 HydrophobicContact CE1-CB 3.87Å; F13-D25 WeakPolarHBondContact CE1-O 3.26Å; F13-D25 HydrophobicContact CZ-CB 4.36Å; F13-D25 WeakPolarHBondContact CZ-O 3.38Å
14	H	81.7	Confident	64.7	Low	201 Å²	201	107.4 Å²	107.4	93%	0.931	61%	0.605	S	S	*	*			trans	-83.5	69.5	173.6	-172.2	-161.4	0	0	0	110.1
15	K	80.2	Confident	66.5	Low	110 Å²	110	100.2 Å²	100.2	48%	0.478	58%	0.579	S	S	.	*	S	Bend	trans	-145.4	149.4	-178.9	-70.1	179.7	174.4	173.9	0	110.6	F13 V20 D25	F13-K15 PolarHBondContact O-N 3.12Å; K15-V20 HydrophobicContact CB-CG2 4.33Å; K15-D25 IonicContact NZ-OD1 3.79Å; K15-D25 PolarHBondContact NZ-OD1 3.45Å; K15-D25 IonicContact NZ-OD2 2.7Å; K15-D25 PolarHBondContact NZ-OD2 2.77Å
16	Y	69.6	Low	68.6	Low	123 Å²	123	93.8 Å²	93.8	48%	0.482	55%	0.552	S	S	.	*			trans	-66.1	141.3	164.1	-179.4	-108.6	0	0	0	109.9	G18 C19	Y16-G18 VanDerWaalsContact CD1-N 3.28Å; Y16-G18 PolarHBondContact O-N 3.26Å; Y16-C19 WeakPolarHBondContact O-CB 3.39Å; Y16-C19 PolarHBondContact O-N 2.78Å
17	S	60.6	Low	70.7	Confident	38 Å²	38	99 Å²	99	27%	0.266	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-57.6	-36	-174.5	59.9	0	0	0	0	112.9	C19 V20 H53	S17-C19 PolarHBondContact O-N 2.88Å; S17-C19 VanDerWaalsContact O-N 3.09Å; S17-V20 WeakPolarHBondContact O-CB 3.37Å; S17-V20 PolarHBondContact O-N 2.74Å; S17-V20 VanDerWaalsContact O-N 3.1Å; S17-H53 PolarHBondContact O-CE1 3.35Å; S17-H53 PolarHBondContact O-ND1 3.31Å
18	G	58.4	Low	72.7	Confident	33 Å²	33	101.1 Å²	101.1	34%	0.34	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-65.1	-6.5	174.6	0	0	0	0	0	115.2	Y16	Y16-G18 VanDerWaalsContact CD1-N 3.28Å; Y16-G18 PolarHBondContact O-N 3.26Å
19	C	70.4	Confident	74.6	Confident	80 Å²	80	97.6 Å²	97.6	54%	0.541	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-109.9	1.5	176.8	-59.2	0	0	0	0	112.9	Y16 S17	Y16-C19 WeakPolarHBondContact O-CB 3.39Å; Y16-C19 PolarHBondContact O-N 2.78Å; S17-C19 PolarHBondContact O-N 2.88Å; S17-C19 VanDerWaalsContact O-N 3.09Å
20	V	71.4	Confident	75.8	Confident	15 Å²	15	93.5 Å²	93.5	9%	0.091	52%	0.521	C	S	.	.			trans	-85.5	132.8	-179.8	179.2	0	0	0	0	109.3	K15 S17 D25 M26 L58	K15-V20 HydrophobicContact CB-CG2 4.33Å; S17-V20 WeakPolarHBondContact O-CB 3.37Å; S17-V20 PolarHBondContact O-N 2.74Å; S17-V20 VanDerWaalsContact O-N 3.1Å; V20-D25 HydrophobicContact CG1-CB 3.86Å; V20-M26 HydrophobicContact CG1-CG 4.31Å; V20-M26 HydrophobicContact CG1-SD 4.17Å; V20-L58 HydrophobicContact CB-CD1 4.36Å; V20-L58 HydrophobicContact CB-CD2 4.24Å; V20-L58 HydrophobicContact CG1-CD1 4.48Å; V20-L58 HydrophobicContact CG1-CD2 3.94Å
21	L	72.9	Confident	76.7	Confident	109 Å²	109	92.4 Å²	92.4	57%	0.571	51%	0.511	S	S	*	.			trans	-123.1	144.3	-179.3	-60.1	174	0	0	0	111.1	D23 D25 M26	L21-D23 PolarHBondContact O-N 2.89Å; L21-D25 PolarHBondContact O-N 3.19Å; L21-D25 VanDerWaalsContact O-N 3.09Å; L21-M26 PolarHBondContact O-N 3.28Å
22	T	63.5	Low	77.9	Confident	43 Å²	43	92.8 Å²	92.8	26%	0.264	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-9.3	175.5	49.8	0	0	0	0	114.1	M26 K29 N57 L58	T22-M26 CarbonylContact C-O 3.56Å; T22-K29 HydrophobicContact CG2-CG 3.98Å; T22-N57 WeakPolarHBondContact CG2-O 3.44Å; T22-L58 HydrophobicContact CG2-CD2 4.49Å
23	D	62.1	Low	78.9	Confident	162 Å²	162	88.4 Å²	88.4	87%	0.866	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	48	175.8	-67.3	-20.3	0	0	0	110.3	L21	L21-D23 PolarHBondContact O-N 2.89Å
24	G	72.4	Confident	79.9	Confident	68 Å²	68	89.6 Å²	89.6	70%	0.701	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	177.8	-57.7	177	0	0	0	0	0	113.6
25	D	80.9	Confident	80.6	Confident	33 Å²	33	81.3 Å²	81.3	18%	0.176	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-43.4	-173.7	-64.3	-53.3	0	0	0	111.8	F13 K15 V20 L21	F13-D25 HydrophobicContact CD1-CB 4.03Å; F13-D25 HydrophobicContact CE1-CB 3.87Å; F13-D25 WeakPolarHBondContact CE1-O 3.26Å; F13-D25 HydrophobicContact CZ-CB 4.36Å; F13-D25 WeakPolarHBondContact CZ-O 3.38Å; K15-D25 IonicContact NZ-OD1 3.79Å; K15-D25 PolarHBondContact NZ-OD1 3.45Å; K15-D25 IonicContact NZ-OD2 2.7Å; K15-D25 PolarHBondContact NZ-OD2 2.77Å; V20-D25 HydrophobicContact CG1-CB 3.86Å; L21-D25 PolarHBondContact O-N 3.19Å; L21-D25 VanDerWaalsContact O-N 3.09Å
26	M	83.9	Confident	81.4	Confident	46 Å²	46	81.3 Å²	81.3	23%	0.227	44%	0.444	C	S	.	.			trans	-107	139.5	176.8	-66	174.7	63.5	0	0	110.4	V20 L21 T22 E28 A30 L58	V20-M26 HydrophobicContact CG1-CG 4.31Å; V20-M26 HydrophobicContact CG1-SD 4.17Å; L21-M26 PolarHBondContact O-N 3.28Å; T22-M26 CarbonylContact C-O 3.56Å; M26-E28 WeakPolarHBondContact CE-O 3.47Å; M26-A30 HydrophobicContact CE-CB 3.99Å; M26-L58 HydrophobicContact SD-CB 4.32Å; M26-L58 HydrophobicContact SD-CD2 4.03Å
27	Q	85.6	Confident	82.7	Confident	203 Å²	203	78.2 Å²	78.2	95%	0.949	44%	0.435	S	S	*	.	S	Bend	trans	-78.1	-28.1	176.5	-68	-173.3	-16.2	0	0	112.9
28	E	89.8	Confident	84.5	Confident	158 Å²	158	76.5 Å²	76.5	74%	0.738	42%	0.423	S	S	*	.	S	Bend	trans	-152.1	165	178.1	63.2	-177.3	172	0	0	110.1	M26	M26-E28 WeakPolarHBondContact CE-O 3.47Å
29	K	92.6	Very high	86.3	Confident	87 Å²	87	76.2 Å²	76.2	38%	0.378	41%	0.414	S	S	.	.			trans	-70.1	140.6	176.1	-66.9	-163.2	178.4	-160.7	0	111.1	T22 Q56 N57 L58 V59 T60	T22-K29 HydrophobicContact CG2-CG 3.98Å; K29-Q56 PolarHBondContact NZ-O 3.23Å; K29-N57 WeakPolarHBondContact CE-O 3.3Å; K29-L58 CarbonylContact C-O 3.56Å; K29-L58 VanDerWaalsContact CA-O 3.23Å; K29-L58 WeakPolarHBondContact CA-O 3.39Å; K29-L58 WeakPolarHBondContact CB-O 3.19Å; K29-V59 VanDerWaalsContact CD-O 3.28Å; K29-V59 WeakPolarHBondContact CD-O 3.5Å; K29-T60 HydrophobicContact CB-CG2 3.98Å
30	A	94.6	Very high	87.7	Confident	34 Å²	34	73 Å²	73	28%	0.281	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	149.5	177.2	0	0	0	0	0	112	M26 L58 V59 T60	M26-A30 HydrophobicContact CE-CB 3.99Å; A30-L58 PolarHBondContact N-O 2.76Å; A30-V59 HydrophobicContact CB-CG1 4.34Å; A30-V59 CarbonylContact O-C 3.37Å; A30-V59 WeakPolarHBondContact O-CA 3.35Å; A30-V59 WeakPolarHBondContact O-CB 3.38Å; A30-T60 PolarHBondContact O-N 2.7Å; A30-T60 PolarHBondContact O-OG1 3.02Å
31	N	95.8	Very high	88.9	Confident	118 Å²	118	73.3 Å²	73.3	63%	0.631	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	-1.8	175.7	63.5	-7.7	0	0	0	113.6	T60 C63 E64	N31-T60 WeakPolarHBondContact CA-OG1 3.46Å; N31-C63 CarbonylContact O-C 3.49Å; N31-C63 VanDerWaalsContact O-CA 3.28Å; N31-C63 WeakPolarHBondContact O-CA 3.41Å; N31-C63 WeakPolarHBondContact O-CB 3.16Å; N31-E64 PolarHBondContact O-N 2.77Å
32	L	96.6	Very high	90.1	Very high	80 Å²	80	68.2 Å²	68.2	42%	0.419	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	122.2	175.5	176.6	63.9	0	0	0	108.5	I34 E64 V66	L32-I34 HydrophobicContact CD1-CG1 4.35Å; L32-I34 HydrophobicContact CD2-CD1 3.88Å; L32-I34 HydrophobicContact CD2-CG1 4.15Å; L32-I34 HydrophobicContact CG-CD1 4.2Å; L32-I34 HydrophobicContact CG-CG1 3.89Å; L32-E64 CarbonylContact C-O 3.56Å; L32-E64 WeakPolarHBondContact CA-O 3.48Å; L32-E64 HydrophobicContact CD1-CB 3.63Å; L32-V66 HydrophobicContact CD1-CG2 4.22Å
33	L	97.3	Very high	91.7	Very high	24 Å²	24	66.2 Å²	66.2	13%	0.126	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	109.7	179.1	-178.8	55.5	0	0	0	109.8	T35 Y51 A54 V59 E64 A65 V66	L33-T35 HydrophobicContact CD1-CG2 3.91Å; L33-T35 HydrophobicContact CG-CG2 4.15Å; L33-Y51 HydrophobicContact CD2-CD1 3.43Å; L33-Y51 VanDerWaalsContact CD2-CD1 3.43Å; L33-Y51 HydrophobicContact CD2-CE1 3.47Å; L33-Y51 VanDerWaalsContact CD2-CE1 3.47Å; L33-Y51 HydrophobicContact CG-CD1 4.37Å; L33-Y51 HydrophobicContact CG-CE1 3.95Å; L33-A54 HydrophobicContact CD1-CB 4.3Å; L33-A54 HydrophobicContact CD2-CB 4.02Å; L33-V59 HydrophobicContact CB-CG1 4.21Å; L33-V59 HydrophobicContact CD1-CG1 4.37Å; L33-V59 HydrophobicContact CD2-CG1 4.43Å; L33-E64 PolarHBondContact N-O 3.13Å; L33-A65 HydrophobicContact CB-CB 4.5Å; L33-A65 CarbonylContact O-C 3.46Å; L33-A65 VanDerWaalsContact O-CA 3.25Å; L33-A65 WeakPolarHBondContact O-CA 3.42Å; L33-V66 PolarHBondContact O-N 3.2Å
34	I	97.8	Very high	93.4	Very high	116 Å²	116	59.7 Å²	59.7	60%	0.595	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.5	177.8	-50.9	-179.4	0	0	0	108.3	L32 V66	L32-I34 HydrophobicContact CD1-CG1 4.35Å; L32-I34 HydrophobicContact CD2-CD1 3.88Å; L32-I34 HydrophobicContact CD2-CG1 4.15Å; L32-I34 HydrophobicContact CG-CD1 4.2Å; L32-I34 HydrophobicContact CG-CG1 3.89Å; I34-V66 VanDerWaalsContact CA-O 3.31Å; I34-V66 WeakPolarHBondContact CA-O 3.48Å; I34-V66 HydrophobicContact CG1-CB 4.28Å; I34-V66 HydrophobicContact CG2-CB 4.33Å
35	T	96.7	Very high	94.5	Very high	28 Å²	28	62.6 Å²	62.6	17%	0.172	32%	0.32	C	S	.	.			trans	-141.7	152	175.8	83.3	0	0	0	0	111.8	L33 L37 Y51 V66 P67	L33-T35 HydrophobicContact CD1-CG2 3.91Å; L33-T35 HydrophobicContact CG-CG2 4.15Å; T35-L37 HydrophobicContact CG2-CD1 4.32Å; T35-Y51 HydrophobicContact CG2-CE1 4.28Å; T35-Y51 HydrophobicContact CG2-CE2 4.3Å; T35-Y51 VanDerWaalsContact OG1-CE2 3.3Å; T35-Y51 WeakPolarHBondContact OG1-CE2 3.17Å; T35-Y51 PolarHBondContact OG1-OH 3.38Å; T35-V66 PolarHBondContact N-O 3.19Å; T35-P67 VanDerWaalsContact O-CD 3.29Å; T35-P67 WeakPolarHBondContact O-CD 3.32Å
36	E	97.1	Very high	95.2	Very high	110 Å²	110	61 Å²	61	51%	0.514	31%	0.311	S	S	.	.			trans	-132.3	93.9	160.9	-162.6	-67.6	87.4	0	0	104	F38 W202	E36-F38 PolarHBondContact OE1-N 3.02Å; E36-W202 VanDerWaalsContact CD-CZ2 3.47Å; E36-W202 HydrophobicContact CG-CH2 4.09Å; E36-W202 HydrophobicContact CG-CZ2 3.83Å; E36-W202 WeakPolarHBondContact OE1-CZ2 3.42Å
37	L	95.9	Very high	95.8	Very high	57 Å²	57	58.9 Å²	58.9	30%	0.298	30%	0.301	S	S	.	.			trans	-130.6	26.6	-176.6	-65.9	175.1	0	0	0	109.9	T35	T35-L37 HydrophobicContact CG2-CD1 4.32Å
38	F	98	Very high	96.3	Very high	3 Å²	3	49.3 Å²	49.3	1%	0.013	26%	0.257	C	S	.	.			trans	-103.8	145.2	-169.1	-49.5	-68.8	0	0	0	109	E36 L42 A47 Y51 P67 F140 W170 L172 W202	E36-F38 PolarHBondContact OE1-N 3.02Å; F38-L42 WeakPolarHBondContact CA-O 3.46Å; F38-L42 HydrophobicContact CB-CD1 4.31Å; F38-L42 HydrophobicContact CD1-CD1 3.47Å; F38-L42 VanDerWaalsContact CD1-CD1 3.47Å; F38-L42 HydrophobicContact CD1-CG 4.28Å; F38-L42 WeakPolarHBondContact CD1-O 3.3Å; F38-L42 HydrophobicContact CE1-CD1 4.08Å; F38-L42 HydrophobicContact CG-CD1 4.07Å; F38-A47 HydrophobicContact CD1-CB 4.12Å; F38-A47 HydrophobicContact CE1-CB 4.16Å; F38-Y51 HydrophobicContact CE1-CE2 4.14Å; F38-Y51 HydrophobicContact CZ-CE2 4.06Å; F38-P67 HydrophobicContact CE1-CG 4.47Å; F38-P67 HydrophobicContact CE2-CG 3.47Å; F38-P67 VanDerWaalsContact CE2-CG 3.47Å; F38-P67 HydrophobicContact CZ-CG 3.35Å; F38-F140 HydrophobicContact CE1-CE1 4.25Å; F38-F140 AromaticContact CE1-CE2 3.97Å; F38-F140 HydrophobicContact CE1-CE2 3.97Å; F38-F140 AromaticContact CE1-CZ 3.58Å; F38-F140 HydrophobicContact CE1-CZ 3.58Å; F38-F140 HydrophobicContact CZ-CE2 4.02Å; F38-F140 HydrophobicContact CZ-CZ 4.07Å; F38-W170 HydrophobicContact CB-CH2 4.08Å; F38-W170 HydrophobicContact CB-CZ2 4.02Å; F38-L172 HydrophobicContact CD2-CD1 3.83Å; F38-L172 HydrophobicContact CE2-CD1 3.94Å; F38-L172 HydrophobicContact CE2-CD2 4.46Å; F38-L172 HydrophobicContact CG-CD1 4.49Å; F38-L172 HydrophobicContact CZ-CD2 4.41Å; F38-W202 HydrophobicContact CB-CZ2 4.15Å; F38-W202 HydrophobicContact CD2-CZ2 4.34Å; F38-W202 PolarHBondContact O-NE1 3.08Å
39	D	97.9	Very high	96.7	Very high	27 Å²	27	43 Å²	43	14%	0.144	23%	0.229	C	C	.	.			trans	-118.5	-172.2	171.6	74	-30.1	0	0	0	110.2	E41 L42 I43 G44 E45 W170	D39-E41 PolarHBondContact O-N 3.44Å; D39-E41 VanDerWaalsContact O-N 3.17Å; D39-E41 VanDerWaalsContact OD1-C 3.29Å; D39-E41 WeakPolarHBondContact OD1-CA 3.27Å; D39-E41 PolarHBondContact OD1-N 2.78Å; D39-E41 VanDerWaalsContact OD1-N 3.16Å; D39-L42 WeakPolarHBondContact O-CA 3.41Å; D39-L42 PolarHBondContact O-N 3.36Å; D39-L42 VanDerWaalsContact OD1-C 3.24Å; D39-L42 PolarHBondContact OD1-N 3.32Å; D39-I43 PolarHBondContact OD1-N 3.46Å; D39-G44 PolarHBondContact OD1-N 3.17Å; D39-G44 VanDerWaalsContact OD2-CA 3.26Å; D39-G44 WeakPolarHBondContact OD2-CA 3.37Å; D39-E45 HydrophobicContact CB-CB 4.49Å; D39-E45 HydrophobicContact CB-CG 3.91Å; D39-W170 WeakPolarHBondContact O-CZ2 3.41Å; D39-W170 PolarHBondContact O-NE1 2.85Å
40	T	98.1	Very high	96.9	Very high	13 Å²	13	39.2 Å²	39.2	8%	0.08	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.4	175.3	-66.2	0	0	0	0	112.5	D115 W170 M203 S205	T40-D115 HydrophobicContact CG2-CB 4.04Å; T40-W170 PolarHBondContact O-NE1 3.34Å; T40-W170 VanDerWaalsContact O-NE1 3.14Å; T40-M203 HydrophobicContact CG2-CB 4.11Å; T40-M203 PolarHBondContact OG1-N 2.78Å; T40-S205 WeakPolarHBondContact CG2-OG 3.47Å; T40-S205 PolarHBondContact O-OG 3.14Å
41	E	97.4	Very high	97	Very high	21 Å²	21	37.7 Å²	37.7	10%	0.098	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	5.4	173.7	-69.1	-161.1	84.6	0	0	114.4	D39 I43 V113 Y207 L232	D39-E41 PolarHBondContact O-N 3.44Å; D39-E41 VanDerWaalsContact O-N 3.17Å; D39-E41 VanDerWaalsContact OD1-C 3.29Å; D39-E41 WeakPolarHBondContact OD1-CA 3.27Å; D39-E41 PolarHBondContact OD1-N 2.78Å; D39-E41 VanDerWaalsContact OD1-N 3.16Å; E41-I43 PolarHBondContact O-N 2.93Å; E41-V113 VanDerWaalsContact CD-CB 3.44Å; E41-V113 HydrophobicContact CG-CB 3.84Å; E41-V113 HydrophobicContact CG-CG1 3.81Å; E41-V113 HydrophobicContact CG-CG2 3.9Å; E41-V113 VanDerWaalsContact OE2-CB 3.32Å; E41-V113 WeakPolarHBondContact OE2-CB 3.34Å; E41-V113 WeakPolarHBondContact OE2-CG1 3.19Å; E41-Y207 VanDerWaalsContact CD-OH 3.32Å; E41-Y207 WeakPolarHBondContact CG-OH 3.2Å; E41-Y207 PolarHBondContact OE1-OH 3.15Å; E41-L232 HydrophobicContact CB-CD1 3.72Å; E41-L232 HydrophobicContact CG-CD1 4.3Å; E41-L232 WeakPolarHBondContact O-CD1 3.44Å; E41-L232 PolarHBondContact OE1-N 2.67Å
42	L	98.4	Very high	97.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	18%	0.18	C	C	.	.	S	Bend	trans	67.7	-47.3	-170.1	-177.5	70.8	0	0	0	113.6	F38 D39 A70 V72 W170 L172	F38-L42 WeakPolarHBondContact CA-O 3.46Å; F38-L42 HydrophobicContact CB-CD1 4.31Å; F38-L42 HydrophobicContact CD1-CD1 3.47Å; F38-L42 VanDerWaalsContact CD1-CD1 3.47Å; F38-L42 HydrophobicContact CD1-CG 4.28Å; F38-L42 WeakPolarHBondContact CD1-O 3.3Å; F38-L42 HydrophobicContact CE1-CD1 4.08Å; F38-L42 HydrophobicContact CG-CD1 4.07Å; D39-L42 WeakPolarHBondContact O-CA 3.41Å; D39-L42 PolarHBondContact O-N 3.36Å; D39-L42 VanDerWaalsContact OD1-C 3.24Å; D39-L42 PolarHBondContact OD1-N 3.32Å; L42-A70 HydrophobicContact CD1-CB 3.76Å; L42-A70 HydrophobicContact CD2-CB 3.56Å; L42-A70 HydrophobicContact CG-CB 4.3Å; L42-V72 HydrophobicContact CD2-CG2 3.68Å; L42-W170 HydrophobicContact CB-CD2 4.34Å; L42-W170 HydrophobicContact CB-CG 3.9Å; L42-W170 HydrophobicContact CD1-CD2 3.9Å; L42-W170 HydrophobicContact CD1-CE3 4.2Å; L42-W170 HydrophobicContact CD1-CG 4.11Å; L42-W170 HydrophobicContact CG-CG 4.47Å; L42-L172 HydrophobicContact CD1-CD2 4.14Å
43	I	97.7	Very high	97	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.167	C	C	.	.	S	Bend	trans	-108.8	-5.5	-168.1	64.6	171.5	0	0	0	114	D39 E41 E45 G46 L48 H227 L232	D39-I43 PolarHBondContact OD1-N 3.46Å; E41-I43 PolarHBondContact O-N 2.93Å; I43-E45 PolarHBondContact O-N 2.91Å; I43-G46 PolarHBondContact O-N 3.22Å; I43-L48 HydrophobicContact CB-CD1 4.26Å; I43-L48 HydrophobicContact CB-CG 4.07Å; I43-L48 HydrophobicContact CD1-CD1 4.03Å; I43-L48 HydrophobicContact CG2-CD1 3.94Å; I43-L48 HydrophobicContact CG2-CD2 3.92Å; I43-L48 HydrophobicContact CG2-CG 3.63Å; I43-H227 HydrophobicContact CD1-CB 3.94Å; I43-L232 HydrophobicContact CD1-CD1 4.03Å; I43-L232 HydrophobicContact CD1-CG 4.28Å; I43-L232 HydrophobicContact CG1-CD1 3.89Å
44	G	96.1	Very high	97	Very high	26 Å²	26	31 Å²	31	27%	0.268	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-14.4	-169.9	0	0	0	0	0	115.2	D39 Y230	D39-G44 PolarHBondContact OD1-N 3.17Å; D39-G44 VanDerWaalsContact OD2-CA 3.26Å; D39-G44 WeakPolarHBondContact OD2-CA 3.37Å; G44-Y230 WeakPolarHBondContact CA-O 3.48Å; G44-Y230 WeakPolarHBondContact O-CD1 3.16Å
45	E	95.6	Very high	96.9	Very high	128 Å²	128	26.8 Å²	26.8	60%	0.598	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	13.3	171.6	-75.9	-178.6	-175.2	0	0	113.5	D39 I43	D39-E45 HydrophobicContact CB-CB 4.49Å; D39-E45 HydrophobicContact CB-CG 3.91Å; I43-E45 PolarHBondContact O-N 2.91Å
46	G	95.6	Very high	96.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	82.9	32	173.8	0	0	0	0	0	113.8	I43 P49 S50	I43-G46 PolarHBondContact O-N 3.22Å; G46-P49 WeakPolarHBondContact O-CD 3.44Å; G46-P49 WeakPolarHBondContact O-CG 3.49Å; G46-S50 VanDerWaalsContact O-CB 3.23Å; G46-S50 WeakPolarHBondContact O-CB 3.34Å; G46-S50 PolarHBondContact O-N 2.97Å; G46-S50 VanDerWaalsContact O-N 3.13Å; G46-S50 PolarHBondContact O-OG 3.25Å
47	A	96.5	Very high	96.6	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-55.7	-52.1	173.9	0	0	0	0	0	111.1	F38 S50 Y51	F38-A47 HydrophobicContact CD1-CB 4.12Å; F38-A47 HydrophobicContact CE1-CB 4.16Å; A47-S50 PolarHBondContact O-N 3.43Å; A47-Y51 HydrophobicContact CB-CD2 4.47Å; A47-Y51 VanDerWaalsContact O-CD2 3.27Å; A47-Y51 WeakPolarHBondContact O-CD2 3.41Å; A47-Y51 PolarHBondContact O-N 3Å
48	L	97.8	Very high	96.6	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-57.5	-54.9	-176.9	-58.2	-177.8	0	0	0	113.6	I43 S50 Y51 E52 V138 V144	I43-L48 HydrophobicContact CB-CD1 4.26Å; I43-L48 HydrophobicContact CB-CG 4.07Å; I43-L48 HydrophobicContact CD1-CD1 4.03Å; I43-L48 HydrophobicContact CG2-CD1 3.94Å; I43-L48 HydrophobicContact CG2-CD2 3.92Å; I43-L48 HydrophobicContact CG2-CG 3.63Å; L48-S50 VanDerWaalsContact C-N 3.29Å; L48-S50 PolarHBondContact O-N 3.28Å; L48-Y51 PolarHBondContact O-N 3.23Å; L48-E52 WeakPolarHBondContact O-CB 3.34Å; L48-E52 PolarHBondContact O-N 2.99Å; L48-V138 HydrophobicContact CD2-CG1 4.36Å; L48-V138 HydrophobicContact CD2-CG2 4.31Å; L48-V144 HydrophobicContact CB-CG1 4.48Å; L48-V144 HydrophobicContact CD2-CG1 3.85Å
49	P	97.1	Very high	96.5	Very high	25 Å²	25	26.7 Å²	26.7	16%	0.162	14%	0.141	C	C	.	.	H	α-helix	trans	-64.5	-32.3	178.2	23.8	-33.7	0	0	0	112.8	G46 H53 Y230	G46-P49 WeakPolarHBondContact O-CD 3.44Å; G46-P49 WeakPolarHBondContact O-CG 3.49Å; P49-H53 WeakPolarHBondContact O-CB 3.48Å; P49-H53 PolarHBondContact O-N 2.83Å; P49-Y230 HydrophobicContact CG-CE2 4.38Å
50	S	96.4	Very high	96.4	Very high	8 Å²	8	28 Å²	28	6%	0.056	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-46	176.3	-65.7	0	0	0	0	112.2	G46 A47 L48 A54	G46-S50 VanDerWaalsContact O-CB 3.23Å; G46-S50 WeakPolarHBondContact O-CB 3.34Å; G46-S50 PolarHBondContact O-N 2.97Å; G46-S50 VanDerWaalsContact O-N 3.13Å; G46-S50 PolarHBondContact O-OG 3.25Å; A47-S50 PolarHBondContact O-N 3.43Å; L48-S50 VanDerWaalsContact C-N 3.29Å; L48-S50 PolarHBondContact O-N 3.28Å; S50-A54 WeakPolarHBondContact O-CB 3.28Å; S50-A54 PolarHBondContact O-N 2.92Å
51	Y	97.3	Very high	96.2	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-41.7	175.8	-87.8	-81.2	0	0	0	111.8	L33 T35 F38 A47 L48 H53 A54 H55 F140 V144	L33-Y51 HydrophobicContact CD2-CD1 3.43Å; L33-Y51 VanDerWaalsContact CD2-CD1 3.43Å; L33-Y51 HydrophobicContact CD2-CE1 3.47Å; L33-Y51 VanDerWaalsContact CD2-CE1 3.47Å; L33-Y51 HydrophobicContact CG-CD1 4.37Å; L33-Y51 HydrophobicContact CG-CE1 3.95Å; T35-Y51 HydrophobicContact CG2-CE1 4.28Å; T35-Y51 HydrophobicContact CG2-CE2 4.3Å; T35-Y51 VanDerWaalsContact OG1-CE2 3.3Å; T35-Y51 WeakPolarHBondContact OG1-CE2 3.17Å; T35-Y51 PolarHBondContact OG1-OH 3.38Å; F38-Y51 HydrophobicContact CE1-CE2 4.14Å; F38-Y51 HydrophobicContact CZ-CE2 4.06Å; A47-Y51 HydrophobicContact CB-CD2 4.47Å; A47-Y51 VanDerWaalsContact O-CD2 3.27Å; A47-Y51 WeakPolarHBondContact O-CD2 3.41Å; A47-Y51 PolarHBondContact O-N 3Å; L48-Y51 PolarHBondContact O-N 3.23Å; Y51-H53 PolarHBondContact O-N 3.45Å; Y51-A54 PolarHBondContact O-N 3.11Å; Y51-H55 PolarHBondContact O-CD2 2.89Å; Y51-H55 VanDerWaalsContact O-CD2 3.25Å; Y51-H55 PolarHBondContact O-N 2.53Å; Y51-F140 HydrophobicContact CD1-CB 4.06Å; Y51-F140 AromaticContact CD1-CD1 3.79Å; Y51-F140 HydrophobicContact CD1-CD1 3.79Å; Y51-F140 HydrophobicContact CD1-CG 4.27Å; Y51-F140 AromaticContact CD2-CD1 3.71Å; Y51-F140 HydrophobicContact CD2-CD1 3.71Å; Y51-F140 AromaticContact CD2-CE1 3.86Å; Y51-F140 HydrophobicContact CD2-CE1 3.86Å; Y51-F140 HydrophobicContact CE1-CB 3.51Å; Y51-F140 AromaticContact CE1-CD1 3.67Å; Y51-F140 HydrophobicContact CE1-CD1 3.67Å; Y51-F140 AromaticContact CE1-CG 3.76Å; Y51-F140 HydrophobicContact CE1-CG 3.76Å; Y51-F140 AromaticContact CE2-CD1 3.57Å; Y51-F140 HydrophobicContact CE2-CD1 3.57Å; Y51-F140 AromaticContact CE2-CE1 3.72Å; Y51-F140 HydrophobicContact CE2-CE1 3.72Å; Y51-F140 HydrophobicContact CE2-CG 4.15Å; Y51-F140 HydrophobicContact CE2-CZ 4.39Å; Y51-F140 AromaticContact CG-CD1 3.81Å; Y51-F140 HydrophobicContact CG-CD1 3.81Å; Y51-F140 HydrophobicContact CG-CE1 4.36Å; Y51-F140 AromaticContact CZ-CD1 3.51Å; Y51-F140 AromaticContact CZ-CG 3.64Å; Y51-V144 HydrophobicContact CG-CG2 4.42Å
52	E	97.1	Very high	95.9	Very high	42 Å²	42	34.9 Å²	34.9	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-49.3	175.7	179.9	171.4	-122.3	0	0	111.1	L48 A54 H55 Q56 V144 S145 S146	L48-E52 WeakPolarHBondContact O-CB 3.34Å; L48-E52 PolarHBondContact O-N 2.99Å; E52-A54 PolarHBondContact O-N 3.49Å; E52-H55 PolarHBondContact O-N 3.42Å; E52-Q56 VanDerWaalsContact O-CG 3.28Å; E52-Q56 WeakPolarHBondContact O-CG 3.44Å; E52-Q56 PolarHBondContact O-N 3.44Å; E52-Q56 VanDerWaalsContact O-N 3.14Å; E52-V144 WeakPolarHBondContact CA-O 3.28Å; E52-V144 WeakPolarHBondContact CB-O 3.49Å; E52-V144 WeakPolarHBondContact CG-O 3.07Å; E52-S145 WeakPolarHBondContact OE1-CA 3.31Å; E52-S145 PolarHBondContact OE1-OG 3.09Å; E52-S146 PolarHBondContact OE1-N 3.07Å; E52-S146 VanDerWaalsContact OE2-CB 3.31Å; E52-S146 WeakPolarHBondContact OE2-CB 3.41Å; E52-S146 PolarHBondContact OE2-N 3.17Å; E52-S146 PolarHBondContact OE2-OG 3.18Å
53	H	95.8	Very high	95.8	Very high	33 Å²	33	34.9 Å²	34.9	15%	0.153	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-44	175.5	175.6	-90.4	0	0	0	112.2	S17 P49 Y51 H55 Q56 N57	S17-H53 PolarHBondContact O-CE1 3.35Å; S17-H53 PolarHBondContact O-ND1 3.31Å; P49-H53 WeakPolarHBondContact O-CB 3.48Å; P49-H53 PolarHBondContact O-N 2.83Å; Y51-H53 PolarHBondContact O-N 3.45Å; H53-H55 PolarHBondContact O-N 3.5Å; H53-Q56 PolarHBondContact O-N 3.27Å; H53-N57 PolarHBondContact CD2-ND2 3.07Å; H53-N57 PolarHBondContact NE2-ND2 3.07Å; H53-N57 WeakPolarHBondContact O-CB 3.29Å; H53-N57 PolarHBondContact O-N 2.85Å; H53-N57 PolarHBondContact O-ND2 3.28Å; H53-N57 VanDerWaalsContact O-ND2 3.09Å
54	A	95.8	Very high	95.8	Very high	7 Å²	7	39.7 Å²	39.7	6%	0.058	24%	0.24	C	C	.	.	I	π-helix	trans	-60.5	-46.2	180	0	0	0	0	0	111.7	L33 S50 Y51 E52 Q56 N57 L58 V59	L33-A54 HydrophobicContact CD1-CB 4.3Å; L33-A54 HydrophobicContact CD2-CB 4.02Å; S50-A54 WeakPolarHBondContact O-CB 3.28Å; S50-A54 PolarHBondContact O-N 2.92Å; Y51-A54 PolarHBondContact O-N 3.11Å; E52-A54 PolarHBondContact O-N 3.49Å; A54-Q56 VanDerWaalsContact C-N 3.33Å; A54-Q56 PolarHBondContact O-N 2.83Å; A54-N57 PolarHBondContact O-N 3.3Å; A54-L58 HydrophobicContact CB-CB 4.47Å; A54-L58 HydrophobicContact CB-CD1 4.43Å; A54-L58 CarbonylContact O-C 3.59Å; A54-L58 WeakPolarHBondContact O-CA 3.46Å; A54-L58 PolarHBondContact O-N 3.48Å; A54-V59 WeakPolarHBondContact O-CG2 3.28Å; A54-V59 PolarHBondContact O-N 2.87Å
55	H	96.5	Very high	95.9	Very high	28 Å²	28	38.5 Å²	38.5	13%	0.13	23%	0.228	C	C	.	.	I	π-helix	trans	-62.2	-37.4	176.9	-85.5	-75.6	0	0	0	113.4	Y51 E52 H53 F140 K142	Y51-H55 PolarHBondContact O-CD2 2.89Å; Y51-H55 VanDerWaalsContact O-CD2 3.25Å; Y51-H55 PolarHBondContact O-N 2.53Å; E52-H55 PolarHBondContact O-N 3.42Å; H53-H55 PolarHBondContact O-N 3.5Å; H55-F140 PolarHBondContact CE1-O 3.42Å; H55-F140 PolarHBondContact NE2-O 3.08Å; H55-K142 PolarHBondContact CD2-O 3.33Å; H55-K142 VanDerWaalsContact CE1-C 3.44Å; H55-K142 PolarHBondContact CE1-O 2.85Å; H55-K142 VanDerWaalsContact CE1-O 3.29Å; H55-K142 PolarHBondContact NE2-O 2.86Å
56	Q	95.2	Very high	96	Very high	117 Å²	117	34.9 Å²	34.9	55%	0.547	22%	0.215	S	C	.	.	I	π-helix	trans	-71.5	-43.4	177.9	-69.3	171.6	11.7	0	0	111.7	K29 E52 H53 A54	K29-Q56 PolarHBondContact NZ-O 3.23Å; E52-Q56 VanDerWaalsContact O-CG 3.28Å; E52-Q56 WeakPolarHBondContact O-CG 3.44Å; E52-Q56 PolarHBondContact O-N 3.44Å; E52-Q56 VanDerWaalsContact O-N 3.14Å; H53-Q56 PolarHBondContact O-N 3.27Å; A54-Q56 VanDerWaalsContact C-N 3.33Å; A54-Q56 PolarHBondContact O-N 2.83Å
57	N	93.4	Very high	96.1	Very high	57 Å²	57	35 Å²	35	31%	0.305	22%	0.216	S	C	.	.	I	π-helix	trans	-115.6	-36.1	-162.5	-58.6	-66	0	0	0	114.2	T22 K29 H53 A54	T22-N57 WeakPolarHBondContact CG2-O 3.44Å; K29-N57 WeakPolarHBondContact CE-O 3.3Å; H53-N57 PolarHBondContact CD2-ND2 3.07Å; H53-N57 PolarHBondContact NE2-ND2 3.07Å; H53-N57 WeakPolarHBondContact O-CB 3.29Å; H53-N57 PolarHBondContact O-N 2.85Å; H53-N57 PolarHBondContact O-ND2 3.28Å; H53-N57 VanDerWaalsContact O-ND2 3.09Å; A54-N57 PolarHBondContact O-N 3.3Å
58	L	94.8	Very high	96.2	Very high	18 Å²	18	35.7 Å²	35.7	9%	0.094	22%	0.218	C	C	.	.	I	π-helix	trans	-108.6	-21.8	-162.2	-52.9	-177.9	0	0	0	114.7	V20 T22 M26 K29 A30 A54	V20-L58 HydrophobicContact CB-CD1 4.36Å; V20-L58 HydrophobicContact CB-CD2 4.24Å; V20-L58 HydrophobicContact CG1-CD1 4.48Å; V20-L58 HydrophobicContact CG1-CD2 3.94Å; T22-L58 HydrophobicContact CG2-CD2 4.49Å; M26-L58 HydrophobicContact SD-CB 4.32Å; M26-L58 HydrophobicContact SD-CD2 4.03Å; K29-L58 CarbonylContact C-O 3.56Å; K29-L58 VanDerWaalsContact CA-O 3.23Å; K29-L58 WeakPolarHBondContact CA-O 3.39Å; K29-L58 WeakPolarHBondContact CB-O 3.19Å; A30-L58 PolarHBondContact N-O 2.76Å; A54-L58 HydrophobicContact CB-CB 4.47Å; A54-L58 HydrophobicContact CB-CD1 4.43Å; A54-L58 CarbonylContact O-C 3.59Å; A54-L58 WeakPolarHBondContact O-CA 3.46Å; A54-L58 PolarHBondContact O-N 3.48Å
59	V	96.1	Very high	96.2	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	153.5	-174.9	-55	0	0	0	0	114.4	K29 A30 L33 A54 C63	K29-V59 VanDerWaalsContact CD-O 3.28Å; K29-V59 WeakPolarHBondContact CD-O 3.5Å; A30-V59 HydrophobicContact CB-CG1 4.34Å; A30-V59 CarbonylContact O-C 3.37Å; A30-V59 WeakPolarHBondContact O-CA 3.35Å; A30-V59 WeakPolarHBondContact O-CB 3.38Å; L33-V59 HydrophobicContact CB-CG1 4.21Å; L33-V59 HydrophobicContact CD1-CG1 4.37Å; L33-V59 HydrophobicContact CD2-CG1 4.43Å; A54-V59 WeakPolarHBondContact O-CG2 3.28Å; A54-V59 PolarHBondContact O-N 2.87Å; V59-C63 HydrophobicContact CB-CB 4.05Å; V59-C63 HydrophobicContact CG2-CB 4.31Å
60	T	95.9	Very high	96.3	Very high	54 Å²	54	37.3 Å²	37.3	33%	0.331	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	151	174.5	58.5	0	0	0	0	111.2	K29 A30 N31 G62 C63	K29-T60 HydrophobicContact CB-CG2 3.98Å; A30-T60 PolarHBondContact O-N 2.7Å; A30-T60 PolarHBondContact O-OG1 3.02Å; N31-T60 WeakPolarHBondContact CA-OG1 3.46Å; T60-G62 PolarHBondContact O-N 3.46Å; T60-C63 WeakPolarHBondContact O-CB 3.29Å; T60-C63 PolarHBondContact O-N 3.04Å; T60-C63 VanDerWaalsContact O-N 3.13Å
61	A	93.4	Very high	96.4	Very high	109 Å²	109	37.5 Å²	37.5	90%	0.901	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.1	130.6	171	0	0	0	0	0	110.9
62	G	91	Very high	96.5	Very high	69 Å²	69	37.5 Å²	37.5	71%	0.711	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	73.1	29.1	-176.4	0	0	0	0	0	113.8	T60	T60-G62 PolarHBondContact O-N 3.46Å
63	C	96.3	Very high	96.6	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.014	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	149.2	171.3	70.2	0	0	0	0	111	N31 V59 T60 S141	N31-C63 CarbonylContact O-C 3.49Å; N31-C63 VanDerWaalsContact O-CA 3.28Å; N31-C63 WeakPolarHBondContact O-CA 3.41Å; N31-C63 WeakPolarHBondContact O-CB 3.16Å; V59-C63 HydrophobicContact CB-CB 4.05Å; V59-C63 HydrophobicContact CG2-CB 4.31Å; T60-C63 WeakPolarHBondContact O-CB 3.29Å; T60-C63 PolarHBondContact O-N 3.04Å; T60-C63 VanDerWaalsContact O-N 3.13Å; C63-S141 WeakPolarHBondContact O-CB 3.46Å
64	E	97.6	Very high	96.7	Very high	101 Å²	101	36.3 Å²	36.3	47%	0.472	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	151	165	-65.3	-61.9	159.9	0	0	109.5	N31 L32 L33	N31-E64 PolarHBondContact O-N 2.77Å; L32-E64 CarbonylContact C-O 3.56Å; L32-E64 WeakPolarHBondContact CA-O 3.48Å; L32-E64 HydrophobicContact CD1-CB 3.63Å; L33-E64 PolarHBondContact N-O 3.13Å
65	A	98	Very high	96.9	Very high	2 Å²	2	37 Å²	37	2%	0.017	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141.7	177.3	0	0	0	0	0	111.1	L33 P67 H68 F140	L33-A65 HydrophobicContact CB-CB 4.5Å; L33-A65 CarbonylContact O-C 3.46Å; L33-A65 VanDerWaalsContact O-CA 3.25Å; L33-A65 WeakPolarHBondContact O-CA 3.42Å; A65-P67 CarbonylContact C-O 3.53Å; A65-P67 VanDerWaalsContact C-O 3.26Å; A65-P67 WeakPolarHBondContact CB-O 3.47Å; A65-P67 CarbonylContact O-C 3.59Å; A65-H68 VanDerWaalsContact O-CA 3.29Å; A65-H68 WeakPolarHBondContact O-CA 3.22Å; A65-H68 PolarHBondContact O-N 2.8Å; A65-F140 VanDerWaalsContact CB-C 3.5Å; A65-F140 HydrophobicContact CB-CB 3.86Å; A65-F140 WeakPolarHBondContact CB-O 3.33Å
66	V	98.3	Very high	96.9	Very high	51 Å²	51	35.7 Å²	35.7	31%	0.309	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	111.3	172.5	-176.9	0	0	0	0	108.3	L32 L33 I34 T35 M174	L32-V66 HydrophobicContact CD1-CG2 4.22Å; L33-V66 PolarHBondContact O-N 3.2Å; I34-V66 VanDerWaalsContact CA-O 3.31Å; I34-V66 WeakPolarHBondContact CA-O 3.48Å; I34-V66 HydrophobicContact CG1-CB 4.28Å; I34-V66 HydrophobicContact CG2-CB 4.33Å; T35-V66 PolarHBondContact N-O 3.19Å; V66-M174 HydrophobicContact CG1-SD 4.31Å
67	P	98.3	Very high	97.1	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.019	19%	0.185	C	C	.	.	S	Bend	cis	-64.1	155	-2.3	30.2	-37.1	0	0	0	112.6	T35 F38 A65 F140 L172 M174	T35-P67 VanDerWaalsContact O-CD 3.29Å; T35-P67 WeakPolarHBondContact O-CD 3.32Å; F38-P67 HydrophobicContact CE1-CG 4.47Å; F38-P67 HydrophobicContact CE2-CG 3.47Å; F38-P67 VanDerWaalsContact CE2-CG 3.47Å; F38-P67 HydrophobicContact CZ-CG 3.35Å; A65-P67 CarbonylContact C-O 3.53Å; A65-P67 VanDerWaalsContact C-O 3.26Å; A65-P67 WeakPolarHBondContact CB-O 3.47Å; A65-P67 CarbonylContact O-C 3.59Å; P67-F140 HydrophobicContact CB-CD2 4.4Å; P67-F140 HydrophobicContact CG-CD2 3.87Å; P67-F140 HydrophobicContact CG-CE2 3.89Å; P67-F140 WeakPolarHBondContact O-CB 3.26Å; P67-F140 WeakPolarHBondContact O-CD2 3.39Å; P67-L172 HydrophobicContact CB-CB 3.98Å; P67-L172 HydrophobicContact CB-CD1 4.28Å; P67-L172 HydrophobicContact CB-CD2 3.96Å; P67-L172 HydrophobicContact CB-CG 4.27Å; P67-L172 HydrophobicContact CG-CD1 4.1Å; P67-L172 HydrophobicContact CG-CD2 3.8Å; P67-L172 HydrophobicContact CG-CG 4.37Å; P67-M174 HydrophobicContact CB-SD 3.98Å
68	H	98.4	Very high	97.3	Very high	15 Å²	15	29.1 Å²	29.1	7%	0.069	18%	0.179	C	C	.	.			trans	-78.9	-42.6	177.8	178.3	77.8	0	0	0	111	A65 D139 F140 D173	A65-H68 VanDerWaalsContact O-CA 3.29Å; A65-H68 WeakPolarHBondContact O-CA 3.22Å; A65-H68 PolarHBondContact O-N 2.8Å; H68-D139 IonicContact CE1-OD1 3.58Å; H68-F140 PolarHBondContact O-N 2.82Å; H68-D173 WeakPolarHBondContact CB-O 3.44Å; H68-D173 PolarHBondContact N-O 3.34Å
69	R	98.5	Very high	97.5	Very high	61 Å²	61	28.3 Å²	28.3	23%	0.23	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	143.3	-178.7	174.3	172.4	54.9	-104.9	-3.1	111.7	V138 L172 D173	R69-V138 CarbonylContact C-O 3.58Å; R69-V138 WeakPolarHBondContact CA-O 3.3Å; R69-V138 WeakPolarHBondContact CG-O 3.47Å; R69-L172 CarbonylContact O-C 3.49Å; R69-L172 WeakPolarHBondContact O-CA 3.37Å; R69-D173 HydrophobicContact CB-CB 4.28Å; R69-D173 IonicContact CZ-OD2 2.64Å; R69-D173 PolarHBondContact N-O 3.19Å; R69-D173 IonicContact NE-OD2 3.43Å; R69-D173 PolarHBondContact NE-OD2 2.89Å; R69-D173 IonicContact NH2-OD2 2.71Å; R69-D173 PolarHBondContact NH2-OD2 2.94Å; R69-D173 PolarHBondContact O-N 3.34Å
70	A	98.6	Very high	97.5	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.5	164.2	0	0	0	0	0	110.7	L42 S137 V138 F140 D171 L172	L42-A70 HydrophobicContact CD1-CB 3.76Å; L42-A70 HydrophobicContact CD2-CB 3.56Å; L42-A70 HydrophobicContact CG-CB 4.3Å; A70-S137 CarbonylContact O-C 3.54Å; A70-S137 WeakPolarHBondContact O-CA 3.46Å; A70-S137 VanDerWaalsContact O-CB 3.3Å; A70-S137 WeakPolarHBondContact O-CB 3.49Å; A70-V138 PolarHBondContact N-O 3.1Å; A70-V138 PolarHBondContact O-N 3.45Å; A70-F140 HydrophobicContact CB-CE2 3.59Å; A70-F140 HydrophobicContact CB-CZ 3.74Å; A70-D171 CarbonylContact C-O 3.59Å; A70-D171 VanDerWaalsContact CA-O 3.26Å; A70-D171 WeakPolarHBondContact CA-O 3.26Å; A70-L172 HydrophobicContact CB-CD2 3.62Å
71	T	98.8	Very high	97.5	Very high	12 Å²	12	31.6 Å²	31.6	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124.9	167.9	-59.6	0	0	0	0	109.8	Y73 A134 F136 S137 W170 D171	T71-Y73 HydrophobicContact CG2-CD1 4.44Å; T71-Y73 HydrophobicContact CG2-CD2 4.45Å; T71-Y73 HydrophobicContact CG2-CE1 3.89Å; T71-Y73 HydrophobicContact CG2-CE2 3.88Å; T71-Y73 WeakPolarHBondContact O-CE2 3.43Å; T71-A134 HydrophobicContact CG2-CB 4.15Å; T71-F136 WeakPolarHBondContact CA-O 3.46Å; T71-S137 PolarHBondContact OG1-OG 3.41Å; T71-W170 CarbonylContact O-C 3.58Å; T71-W170 WeakPolarHBondContact O-CA 3.37Å; T71-W170 WeakPolarHBondContact O-CB 3.49Å; T71-D171 PolarHBondContact N-O 3.03Å; T71-D171 PolarHBondContact O-N 3.22Å
72	V	98.8	Very high	97.7	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.012	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	131.1	174.9	179	0	0	0	0	109.5	L42 M135 F136 W170 L232	L42-V72 HydrophobicContact CD2-CG2 3.68Å; V72-M135 PolarHBondContact O-N 3.39Å; V72-F136 HydrophobicContact CB-CD1 3.94Å; V72-F136 HydrophobicContact CB-CE1 3.58Å; V72-F136 HydrophobicContact CB-CZ 3.99Å; V72-F136 HydrophobicContact CG1-CE1 3.95Å; V72-F136 HydrophobicContact CG2-CD1 4.27Å; V72-F136 HydrophobicContact CG2-CE1 3.57Å; V72-F136 HydrophobicContact CG2-CE2 4.01Å; V72-F136 HydrophobicContact CG2-CZ 3.42Å; V72-F136 VanDerWaalsContact CG2-CZ 3.42Å; V72-F136 PolarHBondContact N-O 2.9Å; V72-W170 HydrophobicContact CG2-CB 4.15Å; V72-L232 HydrophobicContact CG1-CD2 4.25Å
73	Y	98.8	Very high	98	Very high	50 Å²	50	23.5 Å²	23.5	20%	0.196	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	149.5	178.1	-57.6	-87.5	0	0	0	111.5	T71 L132 C133 A134 S168 W169 D171	T71-Y73 HydrophobicContact CG2-CD1 4.44Å; T71-Y73 HydrophobicContact CG2-CD2 4.45Å; T71-Y73 HydrophobicContact CG2-CE1 3.89Å; T71-Y73 HydrophobicContact CG2-CE2 3.88Å; T71-Y73 WeakPolarHBondContact O-CE2 3.43Å; Y73-L132 HydrophobicContact CD1-CD2 4.13Å; Y73-L132 HydrophobicContact CD1-CG 4.1Å; Y73-L132 HydrophobicContact CG-CD2 4.44Å; Y73-L132 HydrophobicContact CG-CG 4.44Å; Y73-C133 CarbonylContact C-O 3.37Å; Y73-C133 VanDerWaalsContact CA-O 3.24Å; Y73-C133 WeakPolarHBondContact CA-O 3.43Å; Y73-A134 HydrophobicContact CD1-CB 4.03Å; Y73-A134 HydrophobicContact CE1-CB 3.91Å; Y73-S168 VanDerWaalsContact O-CA 3.24Å; Y73-S168 WeakPolarHBondContact O-CA 3.37Å; Y73-S168 PolarHBondContact O-OG 3.3Å; Y73-W169 PolarHBondContact N-O 2.72Å; Y73-W169 PolarHBondContact O-N 3.33Å; Y73-W169 VanDerWaalsContact O-N 3.15Å; Y73-D171 HydrophobicContact CE2-CB 3.89Å; Y73-D171 VanDerWaalsContact CE2-CG 3.48Å; Y73-D171 VanDerWaalsContact CE2-OD2 3.3Å; Y73-D171 WeakPolarHBondContact CE2-OD2 3.38Å; Y73-D171 PolarHBondContact OH-OD2 3.45Å
74	A	98.6	Very high	98	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.6	175.3	0	0	0	0	0	112.2	C133 M135 V166 L167 L223 Y234	A74-C133 PolarHBondContact N-O 2.88Å; A74-C133 PolarHBondContact O-N 3.26Å; A74-M135 HydrophobicContact CB-CG 3.52Å; A74-M135 HydrophobicContact CB-SD 3.86Å; A74-V166 HydrophobicContact CB-CG1 3.73Å; A74-L167 CarbonylContact C-O 3.47Å; A74-L167 VanDerWaalsContact CA-O 3.29Å; A74-L167 WeakPolarHBondContact CA-O 3.31Å; A74-L223 HydrophobicContact CB-CD2 3.8Å; A74-Y234 HydrophobicContact CB-CD1 4.45Å; A74-Y234 HydrophobicContact CB-CE1 3.56Å
75	Q	98.5	Very high	97.9	Very high	22 Å²	22	20 Å²	20	10%	0.103	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	121.5	173.3	-174.2	169.2	47.4	0	0	110.5	V77 S130 L132 V166 L167	Q75-V77 HydrophobicContact CG-CG1 4.14Å; Q75-S130 PolarHBondContact NE2-O 3.45Å; Q75-L132 HydrophobicContact CB-CD1 4.32Å; Q75-V166 WeakPolarHBondContact O-CA 3.45Å; Q75-L167 PolarHBondContact N-O 3.46Å; Q75-L167 PolarHBondContact O-N 2.67Å
76	L	98.6	Very high	97.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.3	174.1	-177.4	70.1	0	0	0	109.9	L129 S130 F155 A163 V166 L209 L236	L76-L129 HydrophobicContact CD2-CB 4.1Å; L76-L129 HydrophobicContact CD2-CD1 4.42Å; L76-L129 HydrophobicContact CG-CB 4.16Å; L76-L129 HydrophobicContact CG-CD1 4.38Å; L76-L129 PolarHBondContact O-N 3.38Å; L76-S130 PolarHBondContact N-OG 3.12Å; L76-S130 PolarHBondContact O-N 2.91Å; L76-F155 HydrophobicContact CD2-CZ 3.95Å; L76-A163 HydrophobicContact CD1-CB 4.05Å; L76-A163 HydrophobicContact CD2-CB 3.9Å; L76-A163 HydrophobicContact CG-CB 4.28Å; L76-V166 HydrophobicContact CD1-CG2 4.07Å; L76-L209 HydrophobicContact CD1-CD1 3.73Å; L76-L209 HydrophobicContact CD1-CG 4.46Å; L76-L236 HydrophobicContact CD1-CD2 4.49Å; L76-L236 HydrophobicContact CD2-CD1 3.98Å; L76-L236 HydrophobicContact CD2-CD2 3.79Å
77	V	98.5	Very high	97.7	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	152.7	-179.3	-51.2	0	0	0	0	112.3	Q75 F126 T127 Q164 V165 L167	Q75-V77 HydrophobicContact CG-CG1 4.14Å; V77-F126 HydrophobicContact CB-CB 4.27Å; V77-F126 HydrophobicContact CB-CD2 4.26Å; V77-F126 HydrophobicContact CG1-CD2 3.93Å; V77-F126 HydrophobicContact CG1-CE2 4.49Å; V77-F126 HydrophobicContact CG2-CB 4.24Å; V77-T127 VanDerWaalsContact CA-O 3.31Å; V77-T127 WeakPolarHBondContact CA-O 3.5Å; V77-Q164 PolarHBondContact O-N 3.42Å; V77-V165 HydrophobicContact CG2-CB 3.78Å; V77-V165 HydrophobicContact CG2-CG1 4Å; V77-V165 PolarHBondContact N-O 3.25Å; V77-V165 PolarHBondContact O-N 3.18Å; V77-V165 VanDerWaalsContact O-N 3.16Å; V77-L167 HydrophobicContact CG1-CD1 3.79Å; V77-L167 HydrophobicContact CG1-CG 4.05Å; V77-L167 HydrophobicContact CG2-CD1 4.24Å; V77-L167 HydrophobicContact CG2-CD2 4.38Å; V77-L167 HydrophobicContact CG2-CG 4.01Å
78	E	98.4	Very high	97.5	Very high	35 Å²	35	18.5 Å²	18.5	16%	0.164	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.4	157.3	177	177.3	147.1	0	0	108.2	F126 T127 L129 G161 R162	E78-F126 CarbonylContact O-C 3.52Å; E78-F126 WeakPolarHBondContact O-CA 3.29Å; E78-F126 WeakPolarHBondContact O-CB 3.39Å; E78-T127 PolarHBondContact N-O 2.78Å; E78-T127 PolarHBondContact O-N 2.81Å; E78-L129 HydrophobicContact CB-CD1 4.32Å; E78-L129 HydrophobicContact CB-CD2 4.48Å; E78-L129 HydrophobicContact CB-CG 4.48Å; E78-G161 WeakPolarHBondContact OE2-CA 3.41Å; E78-R162 VanDerWaalsContact CA-O 3.28Å; E78-R162 WeakPolarHBondContact CA-O 3.42Å; E78-R162 VanDerWaalsContact CB-O 3.26Å; E78-R162 WeakPolarHBondContact CB-O 3.27Å; E78-R162 VanDerWaalsContact CD-NH1 3.27Å; E78-R162 HydrophobicContact CG-CB 4.19Å; E78-R162 IonicContact OE1-CZ 3.19Å; E78-R162 IonicContact OE1-NH1 2.77Å; E78-R162 PolarHBondContact OE1-NH1 2.97Å; E78-R162 IonicContact OE1-NH2 3.39Å; E78-R162 PolarHBondContact OE1-NH2 3.44Å; E78-R162 IonicContact OE2-CZ 2.71Å; E78-R162 PolarHBondContact OE2-N 2.81Å; E78-R162 IonicContact OE2-NH1 3.13Å; E78-R162 PolarHBondContact OE2-NH1 2.84Å
79	S	97.8	Very high	97.3	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.014	9%	0.094	C	C	.	.			trans	-156.6	108.3	174.8	-176	0	0	0	0	111.4	L81 L82 W83 S125 Q164	S79-L81 VanDerWaalsContact C-N 3.26Å; S79-L81 PolarHBondContact O-N 2.94Å; S79-L82 PolarHBondContact O-N 3.46Å; S79-L82 PolarHBondContact OG-N 3.09Å; S79-W83 WeakPolarHBondContact O-CB 3.32Å; S79-W83 PolarHBondContact O-N 3.35Å; S79-S125 PolarHBondContact OG-O 2.64Å; S79-Q164 PolarHBondContact O-OE1 3.29Å
80	E	96.3	Very high	97.1	Very high	84 Å²	84	18.7 Å²	18.7	39%	0.393	9%	0.092	S	C	.	.	H	α-helix	trans	-62.4	-35.6	174.4	-69.6	-60	127.3	0	0	112.2	S84 R162 Q164	E80-S84 VanDerWaalsContact O-CB 3.31Å; E80-S84 WeakPolarHBondContact O-CB 3.17Å; E80-S84 PolarHBondContact O-N 2.9Å; E80-R162 IonicContact OE1-CZ 3.2Å; E80-R162 IonicContact OE1-NE 2.7Å; E80-R162 PolarHBondContact OE1-NE 3.29Å; E80-R162 IonicContact OE1-NH2 3.04Å; E80-R162 PolarHBondContact OE1-NH2 3.38Å; E80-Q164 PolarHBondContact OE1-NE2 2.75Å; E80-Q164 VanDerWaalsContact OE1-NE2 3.12Å
81	L	96.6	Very high	96.9	Very high	43 Å²	43	19.3 Å²	19.3	23%	0.225	10%	0.097	C	C	.	.	H	α-helix	trans	-61.3	-55.6	177.3	172.9	62	0	0	0	111	S79 S84 W85 V121	S79-L81 VanDerWaalsContact C-N 3.26Å; S79-L81 PolarHBondContact O-N 2.94Å; L81-S84 WeakPolarHBondContact O-CB 3.17Å; L81-S84 PolarHBondContact O-N 2.83Å; L81-S84 PolarHBondContact O-OG 2.8Å; L81-W85 HydrophobicContact CD1-CZ2 4.47Å; L81-V121 HydrophobicContact CD2-CG1 4.38Å
82	L	97.4	Very high	96.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-70.5	-41	-177.3	-62.9	175.3	0	0	0	111	S79 S84 W85 V121 V165 L167 V206 F208	S79-L82 PolarHBondContact O-N 3.46Å; S79-L82 PolarHBondContact OG-N 3.09Å; L82-S84 PolarHBondContact O-N 3.02Å; L82-W85 HydrophobicContact CD2-CD2 4.49Å; L82-W85 HydrophobicContact CD2-CE3 3.87Å; L82-W85 HydrophobicContact CD2-CH2 3.64Å; L82-W85 HydrophobicContact CD2-CZ2 4.27Å; L82-W85 HydrophobicContact CD2-CZ3 3.41Å; L82-W85 VanDerWaalsContact CD2-CZ3 3.41Å; L82-W85 WeakPolarHBondContact O-CB 3.35Å; L82-W85 PolarHBondContact O-N 3.09Å; L82-V121 HydrophobicContact CD2-CG1 4.5Å; L82-V121 HydrophobicContact CD2-CG2 4.41Å; L82-V165 HydrophobicContact CB-CG1 4.32Å; L82-V165 HydrophobicContact CB-CG2 3.95Å; L82-V165 HydrophobicContact CD1-CG1 3.99Å; L82-L167 HydrophobicContact CD1-CD2 3.71Å; L82-V206 HydrophobicContact CD1-CG1 4.33Å; L82-F208 WeakPolarHBondContact O-CE1 3.34Å
83	W	96.7	Very high	96	Very high	8 Å²	8	24 Å²	24	3%	0.03	12%	0.118	C	C	.	.	H	α-helix	trans	-60.5	-30.6	177.5	-167.6	-121.4	0	0	0	112.7	S79 W85 A86 Q87 Q164 V165 F208 L209 E212	S79-W83 WeakPolarHBondContact O-CB 3.32Å; S79-W83 PolarHBondContact O-N 3.35Å; W83-W85 PolarHBondContact O-N 3.02Å; W83-W85 VanDerWaalsContact O-N 3.11Å; W83-A86 PolarHBondContact O-N 3.19Å; W83-Q87 HydrophobicContact CD2-CG 4.05Å; W83-Q87 HydrophobicContact CH2-CG 4.09Å; W83-Q87 HydrophobicContact CZ2-CG 3.39Å; W83-Q87 PolarHBondContact O-N 3.36Å; W83-Q164 HydrophobicContact CB-CB 4.34Å; W83-Q164 HydrophobicContact CB-CG 4.43Å; W83-Q164 HydrophobicContact CD2-CB 3.79Å; W83-Q164 HydrophobicContact CD2-CG 3.82Å; W83-Q164 HydrophobicContact CE3-CB 3.62Å; W83-Q164 HydrophobicContact CE3-CG 4.16Å; W83-Q164 HydrophobicContact CG-CB 4.13Å; W83-Q164 HydrophobicContact CG-CG 3.95Å; W83-Q164 HydrophobicContact CZ3-CB 4.16Å; W83-Q164 WeakPolarHBondContact CZ3-O 3.45Å; W83-V165 HydrophobicContact CE3-CG2 4.18Å; W83-F208 HydrophobicContact CE3-CD1 4.03Å; W83-F208 HydrophobicContact CZ3-CB 4.1Å; W83-F208 HydrophobicContact CZ3-CD1 4.28Å; W83-L209 WeakPolarHBondContact CH2-O 3.03Å; W83-E212 HydrophobicContact CZ2-CB 3.96Å
84	S	96.4	Very high	95.2	Very high	16 Å²	16	27.1 Å²	27.1	11%	0.112	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.5	173.2	82.2	0	0	0	0	114.5	E80 L81 L82 F268 G269 N272	E80-S84 VanDerWaalsContact O-CB 3.31Å; E80-S84 WeakPolarHBondContact O-CB 3.17Å; E80-S84 PolarHBondContact O-N 2.9Å; L81-S84 WeakPolarHBondContact O-CB 3.17Å; L81-S84 PolarHBondContact O-N 2.83Å; L81-S84 PolarHBondContact O-OG 2.8Å; L82-S84 PolarHBondContact O-N 3.02Å; S84-F268 CarbonylContact O-C 3.52Å; S84-F268 WeakPolarHBondContact O-CB 3.04Å; S84-G269 PolarHBondContact O-N 3.38Å; S84-N272 PolarHBondContact O-ND2 3.16Å
85	W	96.6	Very high	94.4	Very high	12 Å²	12	30.7 Å²	30.7	5%	0.045	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-9.3	175.8	-58.1	-11.1	0	0	0	113.3	L81 L82 W83 V116 F208 R265 F268 W456	L81-W85 HydrophobicContact CD1-CZ2 4.47Å; L82-W85 HydrophobicContact CD2-CD2 4.49Å; L82-W85 HydrophobicContact CD2-CE3 3.87Å; L82-W85 HydrophobicContact CD2-CH2 3.64Å; L82-W85 HydrophobicContact CD2-CZ2 4.27Å; L82-W85 HydrophobicContact CD2-CZ3 3.41Å; L82-W85 VanDerWaalsContact CD2-CZ3 3.41Å; L82-W85 WeakPolarHBondContact O-CB 3.35Å; L82-W85 PolarHBondContact O-N 3.09Å; W83-W85 PolarHBondContact O-N 3.02Å; W83-W85 VanDerWaalsContact O-N 3.11Å; W85-V116 HydrophobicContact CH2-CG2 4.47Å; W85-F208 HydrophobicContact CB-CZ 4.24Å; W85-R265 HydrophobicContact CB-CB 4Å; W85-R265 HydrophobicContact CB-CG 4.2Å; W85-F268 WeakPolarHBondContact O-CB 3.44Å; W85-W456 AromaticContact CH2-CH2 3.69Å; W85-W456 HydrophobicContact CH2-CH2 3.69Å; W85-W456 AromaticContact CH2-CZ2 3.58Å; W85-W456 HydrophobicContact CH2-CZ2 3.58Å; W85-W456 HydrophobicContact CZ2-CH2 4.28Å; W85-W456 HydrophobicContact CZ2-CZ2 4.04Å
86	A	95.1	Very high	94	Very high	3 Å²	3	31.8 Å²	31.8	3%	0.025	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-20	179.2	0	0	0	0	0	113.2	W83 F208 H260	W83-A86 PolarHBondContact O-N 3.19Å; A86-F208 HydrophobicContact CB-CB 4.04Å; A86-F208 HydrophobicContact CB-CD1 3.45Å; A86-F208 VanDerWaalsContact CB-CD1 3.45Å; A86-F208 HydrophobicContact CB-CD2 3.82Å; A86-F208 HydrophobicContact CB-CE1 3.81Å; A86-F208 HydrophobicContact CB-CE2 4.13Å; A86-F208 HydrophobicContact CB-CG 3.46Å; A86-F208 VanDerWaalsContact CB-CG 3.46Å; A86-F208 HydrophobicContact CB-CZ 4.13Å; A86-H260 PolarHBondContact O-CD2 3.48Å; A86-H260 PolarHBondContact O-NE2 2.94Å
87	Q	95	Very high	93.7	Very high	15 Å²	15	39 Å²	39	7%	0.07	21%	0.212	C	C	.	.	S	Bend	trans	-125.3	139.7	-179.9	-68.8	-61.9	-33.5	0	0	111.1	W83 I104 N272	W83-Q87 HydrophobicContact CD2-CG 4.05Å; W83-Q87 HydrophobicContact CH2-CG 4.09Å; W83-Q87 HydrophobicContact CZ2-CG 3.39Å; W83-Q87 PolarHBondContact O-N 3.36Å; Q87-I104 PolarHBondContact NE2-O 3.29Å; Q87-I104 PolarHBondContact OE1-O 2.87Å; Q87-N272 PolarHBondContact O-ND2 3.18Å
88	L	95.6	Very high	93.5	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.042	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-77.3	126.9	169.2	-177.7	66.5	0	0	0	108.6	P100 I104 W263 F268 L271 L302	L88-P100 HydrophobicContact CB-CB 3.92Å; L88-P100 HydrophobicContact CD2-CB 4.06Å; L88-P100 HydrophobicContact CG-CB 4.04Å; L88-P100 VanDerWaalsContact O-CB 3.27Å; L88-P100 WeakPolarHBondContact O-CB 3.33Å; L88-P100 VanDerWaalsContact O-CG 3.31Å; L88-P100 WeakPolarHBondContact O-CG 3.44Å; L88-I104 HydrophobicContact CB-CD1 4.25Å; L88-I104 HydrophobicContact CB-CG2 4.42Å; L88-I104 HydrophobicContact CD2-CD1 4.31Å; L88-W263 HydrophobicContact CD2-CH2 4.44Å; L88-W263 HydrophobicContact CD2-CZ3 4.26Å; L88-F268 HydrophobicContact CB-CE1 4.32Å; L88-L271 HydrophobicContact CD1-CB 4.06Å; L88-L302 HydrophobicContact CD1-CD1 4.33Å
89	Q	93.8	Very high	93.4	Very high	51 Å²	51	40.1 Å²	40.1	24%	0.238	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-94.4	155.4	179.6	-62.6	-65.4	-26.2	0	0	110.4	A91 N272	Q89-A91 PolarHBondContact O-N 3.49Å; Q89-N272 VanDerWaalsContact CB-OD1 3.29Å; Q89-N272 WeakPolarHBondContact CB-OD1 3.28Å; Q89-N272 HydrophobicContact CG-CB 4.48Å; Q89-N272 PolarHBondContact N-OD1 2.86Å
90	P	94.5	Very high	93.3	Very high	29 Å²	29	41.7 Å²	41.7	19%	0.188	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-60	137.1	173.2	-22.9	33.8	0	0	0	112	R97 L98	P90-R97 HydrophobicContact CB-CG 4.24Å; P90-L98 CarbonylContact C-O 3.58Å; P90-L98 WeakPolarHBondContact CA-O 3.49Å
91	A	93.6	Very high	93.2	Very high	14 Å²	14	37.9 Å²	37.9	12%	0.116	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.1	175.6	0	0	0	0	0	110.7	Q89 L98	Q89-A91 PolarHBondContact O-N 3.49Å; A91-L98 HydrophobicContact CB-CB 4.35Å; A91-L98 PolarHBondContact N-O 3.25Å; A91-L98 PolarHBondContact O-N 3.47Å
92	E	90.9	Very high	93.1	Very high	110 Å²	110	39.5 Å²	39.5	51%	0.514	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.3	178.2	-65.9	-64.4	159.4	0	0	110.1	R97	E92-R97 WeakPolarHBondContact OE1-CD 3.29Å; E92-R97 VanDerWaalsContact OE1-CG 3.26Å; E92-R97 WeakPolarHBondContact OE1-CG 3.4Å; E92-R97 IonicContact OE1-NE 3.83Å
93	V	89.3	Confident	92.8	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	109.8	178.9	-176.9	0	0	0	0	108.4	G95 A96 V281 F306 M309 L310	V93-G95 PolarHBondContact O-N 3.05Å; V93-A96 PolarHBondContact N-O 3.28Å; V93-A96 WeakPolarHBondContact O-CA 3.41Å; V93-A96 WeakPolarHBondContact O-CB 3.27Å; V93-A96 PolarHBondContact O-N 3Å; V93-V281 HydrophobicContact CG1-CG1 4.16Å; V93-V281 HydrophobicContact CG1-CG2 4.08Å; V93-V281 HydrophobicContact CG2-CG2 4.11Å; V93-F306 HydrophobicContact CG2-CD1 3.56Å; V93-F306 HydrophobicContact CG2-CE1 3.79Å; V93-F306 HydrophobicContact CG2-CG 4.26Å; V93-M309 HydrophobicContact CB-CE 3.82Å; V93-M309 HydrophobicContact CB-SD 4.48Å; V93-M309 HydrophobicContact CG1-CB 4.32Å; V93-M309 HydrophobicContact CG1-CE 4.49Å; V93-M309 HydrophobicContact CG2-CE 4.29Å; V93-L310 HydrophobicContact CG1-CD2 3.93Å; V93-L310 HydrophobicContact CG1-CG 4.16Å
94	E	81.2	Confident	92.7	Very high	116 Å²	116	40.5 Å²	40.5	54%	0.542	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	34.3	-178.2	-74.4	-75.7	-158.3	0	0	114.2	A96 R285 L310	E94-A96 PolarHBondContact O-N 3.06Å; E94-R285 VanDerWaalsContact CG-CZ 3.46Å; E94-R285 VanDerWaalsContact OE1-CD 3.3Å; E94-R285 WeakPolarHBondContact OE1-CD 3.31Å; E94-R285 IonicContact OE1-CZ 2.77Å; E94-R285 IonicContact OE1-NE 3.01Å; E94-R285 PolarHBondContact OE1-NE 3.41Å; E94-R285 IonicContact OE1-NH1 2.74Å; E94-R285 PolarHBondContact OE1-NH1 2.9Å; E94-R285 IonicContact OE1-NH2 3.28Å; E94-R285 PolarHBondContact OE1-NH2 2.92Å; E94-R285 IonicContact OE2-CZ 3.03Å; E94-R285 IonicContact OE2-NE 3.93Å; E94-R285 IonicContact OE2-NH1 2.88Å; E94-R285 PolarHBondContact OE2-NH1 2.92Å; E94-R285 IonicContact OE2-NH2 2.77Å; E94-R285 PolarHBondContact OE2-NH2 2.99Å; E94-L310 HydrophobicContact CB-CD2 4.44Å; E94-L310 HydrophobicContact CG-CD2 3.45Å; E94-L310 VanDerWaalsContact CG-CD2 3.45Å
95	G	82.4	Confident	92.3	Very high	75 Å²	75	41.7 Å²	41.7	77%	0.773	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	1.9	-176.4	0	0	0	0	0	114.4	V93	V93-G95 PolarHBondContact O-N 3.05Å
96	A	89.1	Confident	91.9	Very high	44 Å²	44	49.9 Å²	49.9	36%	0.364	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.2	164.5	0	0	0	0	0	110.1	V93 E94 M309	V93-A96 PolarHBondContact N-O 3.28Å; V93-A96 WeakPolarHBondContact O-CA 3.41Å; V93-A96 WeakPolarHBondContact O-CB 3.27Å; V93-A96 PolarHBondContact O-N 3Å; E94-A96 PolarHBondContact O-N 3.06Å; A96-M309 HydrophobicContact CB-CE 3.57Å
97	R	93.4	Very high	91.8	Very high	153 Å²	153	49.7 Å²	49.7	58%	0.577	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.1	-178.8	-172.2	172.4	-174.4	-150.6	2.9	110.8	P90 E92 V99	P90-R97 HydrophobicContact CB-CG 4.24Å; E92-R97 WeakPolarHBondContact OE1-CD 3.29Å; E92-R97 VanDerWaalsContact OE1-CG 3.26Å; E92-R97 WeakPolarHBondContact OE1-CG 3.4Å; E92-R97 IonicContact OE1-NE 3.83Å; R97-V99 HydrophobicContact CG-CG1 4.25Å
98	L	94.4	Very high	91.5	Very high	5 Å²	5	50 Å²	50	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.8	167.7	-170.3	81.1	0	0	0	108.6	P90 A91 L302 V305 F306 M309 V331 N335	P90-L98 CarbonylContact C-O 3.58Å; P90-L98 WeakPolarHBondContact CA-O 3.49Å; A91-L98 HydrophobicContact CB-CB 4.35Å; A91-L98 PolarHBondContact N-O 3.25Å; A91-L98 PolarHBondContact O-N 3.47Å; L98-L302 HydrophobicContact CD2-CD1 4.24Å; L98-V305 HydrophobicContact CD1-CG1 3.75Å; L98-F306 HydrophobicContact CD2-CE1 3.92Å; L98-M309 HydrophobicContact CD1-SD 4.02Å; L98-V331 HydrophobicContact CD1-CG1 4.22Å; L98-V331 HydrophobicContact CD2-CG1 4.18Å; L98-V331 HydrophobicContact CG-CG1 4.48Å; L98-N335 WeakPolarHBondContact CA-OD1 3.33Å; L98-N335 HydrophobicContact CD1-CB 3.95Å; L98-N335 WeakPolarHBondContact CD1-ND2 3.5Å
99	V	95.4	Very high	91.3	Very high	53 Å²	53	49.8 Å²	49.8	32%	0.321	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-97.4	148.3	178.1	-62.4	0	0	0	0	111.3	R97 N335	R97-V99 HydrophobicContact CG-CG1 4.25Å; V99-N335 WeakPolarHBondContact CG2-OD1 3.19Å; V99-N335 PolarHBondContact N-OD1 2.96Å; V99-N335 PolarHBondContact O-ND2 3.19Å
100	P	94.6	Very high	91.1	Very high	35 Å²	35	48.4 Å²	48.4	23%	0.227	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-66.6	150.7	175.2	29.2	-36.8	0	0	0	111.6	L88	L88-P100 HydrophobicContact CB-CB 3.92Å; L88-P100 HydrophobicContact CD2-CB 4.06Å; L88-P100 HydrophobicContact CG-CB 4.04Å; L88-P100 VanDerWaalsContact O-CB 3.27Å; L88-P100 WeakPolarHBondContact O-CB 3.33Å; L88-P100 VanDerWaalsContact O-CG 3.31Å; L88-P100 WeakPolarHBondContact O-CG 3.44Å
101	P	95.4	Very high	90.7	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.019	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-54.6	134.1	169.8	-23.9	30.7	0	0	0	111.8	A103 I104 E330 V331 A334	P101-A103 PolarHBondContact O-N 2.84Å; P101-I104 HydrophobicContact CB-CD1 4.37Å; P101-I104 HydrophobicContact CB-CG1 4.16Å; P101-I104 HydrophobicContact CG-CD1 3.95Å; P101-I104 HydrophobicContact CG-CG1 4.29Å; P101-I104 PolarHBondContact O-N 3.26Å; P101-E330 HydrophobicContact CB-CB 4.12Å; P101-E330 HydrophobicContact CG-CB 4.07Å; P101-V331 HydrophobicContact CG-CB 4.37Å; P101-V331 HydrophobicContact CG-CG2 3.69Å; P101-A334 HydrophobicContact CB-CB 4.43Å
102	P	93.3	Very high	90.5	Very high	78 Å²	78	54.5 Å²	54.5	51%	0.506	31%	0.313	S	S	.	.	H	α-helix	trans	-58.2	-24.5	178.8	-26.7	34.4	0	0	0	114.1	R106	P102-R106 VanDerWaalsContact CB-NH1 3.34Å; P102-R106 PolarHBondContact O-N 3.49Å; P102-R106 PolarHBondContact O-NH1 3.15Å
103	A	92.8	Very high	90.6	Very high	28 Å²	28	50.3 Å²	50.3	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-65.1	-37.7	175.9	0	0	0	0	0	112.3	P101 R106 C107 C257	P101-A103 PolarHBondContact O-N 2.84Å; A103-R106 PolarHBondContact O-N 3.39Å; A103-C107 WeakPolarHBondContact O-CB 3.17Å; A103-C107 PolarHBondContact O-N 2.86Å; A103-C107 VanDerWaalsContact O-N 3.17Å; A103-C257 HydrophobicContact CB-CB 3.87Å
104	I	93.4	Very high	90.9	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-45.8	178.1	-58.2	-174.9	0	0	0	110.1	Q87 L88 P101 R106 C107 C257 A259 W263 F268	Q87-I104 PolarHBondContact NE2-O 3.29Å; Q87-I104 PolarHBondContact OE1-O 2.87Å; L88-I104 HydrophobicContact CB-CD1 4.25Å; L88-I104 HydrophobicContact CB-CG2 4.42Å; L88-I104 HydrophobicContact CD2-CD1 4.31Å; P101-I104 HydrophobicContact CB-CD1 4.37Å; P101-I104 HydrophobicContact CB-CG1 4.16Å; P101-I104 HydrophobicContact CG-CD1 3.95Å; P101-I104 HydrophobicContact CG-CG1 4.29Å; P101-I104 PolarHBondContact O-N 3.26Å; I104-R106 PolarHBondContact O-N 2.9Å; I104-C107 WeakPolarHBondContact O-CB 3.11Å; I104-C107 PolarHBondContact O-N 2.89Å; I104-C257 HydrophobicContact CG1-CB 4.24Å; I104-A259 HydrophobicContact CD1-CB 3.61Å; I104-A259 HydrophobicContact CG1-CB 3.88Å; I104-W263 HydrophobicContact CD1-CZ3 4.05Å; I104-F268 HydrophobicContact CG2-CE1 4.28Å
105	G	88.8	Confident	91.6	Very high	41 Å²	41	49.5 Å²	49.5	42%	0.423	30%	0.295	S	S	.	.	H	α-helix	trans	-65.8	-16.3	179.8	0	0	0	0	0	115.4
106	R	88.9	Confident	92.4	Very high	183 Å²	183	46 Å²	46	69%	0.691	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-4.1	174.7	-65.5	-170.3	-60.5	-88.5	-0.6	113.4	P102 A103 I104	P102-R106 VanDerWaalsContact CB-NH1 3.34Å; P102-R106 PolarHBondContact O-N 3.49Å; P102-R106 PolarHBondContact O-NH1 3.15Å; A103-R106 PolarHBondContact O-N 3.39Å; I104-R106 PolarHBondContact O-N 2.9Å
107	C	92.3	Very high	92.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.			trans	-83.6	136.9	-174.4	-176.1	0	0	0	0	110.2	A103 I104 G109 C255 T256 C257 H260	A103-C107 WeakPolarHBondContact O-CB 3.17Å; A103-C107 PolarHBondContact O-N 2.86Å; A103-C107 VanDerWaalsContact O-N 3.17Å; I104-C107 WeakPolarHBondContact O-CB 3.11Å; I104-C107 PolarHBondContact O-N 2.89Å; C107-G109 PolarHBondContact O-N 3.28Å; C107-G109 VanDerWaalsContact O-N 3.12Å; C107-C255 VanDerWaalsContact SG-CA 3.6Å; C107-T256 PolarHBondContact SG-N 2.94Å; C107-C257 HydrophobicContact CB-CB 3.9Å; C107-H260 PolarHBondContact SG-ND1 2.85Å
108	A	88.9	Confident	93	Very high	21 Å²	21	36.9 Å²	36.9	17%	0.174	22%	0.215	C	C	.	.			trans	-71	-5.4	-179.9	0	0	0	0	0	114.1	P210 P253	A108-P210 HydrophobicContact CB-CB 3.81Å; A108-P210 HydrophobicContact CB-CG 4.27Å; A108-P253 HydrophobicContact CB-CB 3.75Å
109	G	91.6	Very high	93.2	Very high	4 Å²	4	38 Å²	38	4%	0.041	22%	0.223	C	C	.	.			trans	92.7	-168.9	-179.1	0	0	0	0	0	113.7	C107 C254 C255	C107-G109 PolarHBondContact O-N 3.28Å; C107-G109 VanDerWaalsContact O-N 3.12Å; G109-C254 CarbonylContact O-C 3.22Å; G109-C255 WeakPolarHBondContact O-CA 3.41Å; G109-C255 PolarHBondContact O-N 2.92Å; G109-C255 VanDerWaalsContact O-N 3.17Å
110	A	89.4	Confident	93.3	Very high	22 Å²	22	38.6 Å²	38.6	18%	0.182	22%	0.222	C	C	.	.			trans	-76.1	150.4	171.3	0	0	0	0	0	111	S112 H260	A110-S112 VanDerWaalsContact C-N 3.28Å; A110-S112 PolarHBondContact O-N 2.89Å; A110-H260 HydrophobicContact CB-CB 4.14Å
111	H	85.6	Confident	93.4	Very high	108 Å²	108	37 Å²	37	50%	0.5	21%	0.212	S	C	.	.	S	Bend	trans	-85.6	5.7	-175.2	63.8	-87.9	0	0	0	114.2	R252 P253	H111-R252 PolarHBondContact O-NH2 3.34Å; H111-P253 WeakPolarHBondContact CB-O 3.32Å
112	S	89.8	Confident	93.4	Very high	62 Å²	62	39.7 Å²	39.7	43%	0.434	23%	0.231	S	C	.	.	S	Bend	trans	-100	152.3	177.9	55.1	0	0	0	0	111	A110 R265	A110-S112 VanDerWaalsContact C-N 3.28Å; A110-S112 PolarHBondContact O-N 2.89Å; S112-R265 PolarHBondContact O-NH2 3.27Å; S112-R265 PolarHBondContact OG-NH1 3.04Å
113	V	91.8	Very high	93.5	Very high	23 Å²	23	39.2 Å²	39.2	14%	0.139	23%	0.227	C	C	.	.			trans	-63.8	159.1	170.1	67	0	0	0	0	111.7	E41 S205 Y207 R265	E41-V113 VanDerWaalsContact CD-CB 3.44Å; E41-V113 HydrophobicContact CG-CB 3.84Å; E41-V113 HydrophobicContact CG-CG1 3.81Å; E41-V113 HydrophobicContact CG-CG2 3.9Å; E41-V113 VanDerWaalsContact OE2-CB 3.32Å; E41-V113 WeakPolarHBondContact OE2-CB 3.34Å; E41-V113 WeakPolarHBondContact OE2-CG1 3.19Å; V113-S205 VanDerWaalsContact CG2-CB 3.5Å; V113-Y207 HydrophobicContact CB-CE1 4.35Å; V113-Y207 HydrophobicContact CG2-CE1 4.12Å; V113-Y207 HydrophobicContact CG2-CE2 4.32Å; V113-R265 PolarHBondContact O-NH1 3.25Å
114	C	96.3	Very high	93.7	Very high	11 Å²	11	43.1 Å²	43.1	7%	0.074	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	92.4	162.4	-176.5	0	0	0	0	107.5	V206 F208 R265	C114-V206 HydrophobicContact CB-CB 4.1Å; C114-V206 WeakPolarHBondContact CB-O 3.28Å; C114-V206 PolarHBondContact N-O 3.29Å; C114-V206 PolarHBondContact O-N 3.36Å; C114-F208 HydrophobicContact CB-CE2 4.11Å; C114-R265 HydrophobicContact CB-CG 4.5Å
115	D	96.7	Very high	93.9	Very high	90 Å²	90	44.6 Å²	44.6	48%	0.481	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	132.1	170.1	54.6	-37	0	0	0	109.9	T40 M203	T40-D115 HydrophobicContact CG2-CB 4.04Å; D115-M203 HydrophobicContact CB-SD 4.35Å
116	V	97.7	Very high	94.3	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	148.6	-177.4	66.5	0	0	0	0	109.6	W85 L118 Q204 V206 W456 E457	W85-V116 HydrophobicContact CH2-CG2 4.47Å; V116-L118 HydrophobicContact CG1-CB 4.07Å; V116-L118 HydrophobicContact CG1-CD1 4.38Å; V116-L118 PolarHBondContact O-N 3.23Å; V116-Q204 PolarHBondContact N-O 3.42Å; V116-Q204 VanDerWaalsContact N-O 3.08Å; V116-Q204 PolarHBondContact O-N 3.4Å; V116-V206 HydrophobicContact CG1-CG2 3.58Å; V116-W456 HydrophobicContact CG2-CH2 3.54Å; V116-W456 HydrophobicContact CG2-CZ2 3.65Å; V116-E457 WeakPolarHBondContact CA-OE2 3.36Å; V116-E457 HydrophobicContact CG2-CG 4.26Å; V116-E457 WeakPolarHBondContact CG2-OE2 3.49Å
117	Q	98.3	Very high	94.7	Very high	5 Å²	5	37.8 Å²	37.8	2%	0.023	23%	0.233	C	C	.	.			trans	-69.3	77.4	165.3	-70.9	-63.2	-14.9	0	0	107.2	S119 Q120 R199 D200 M203 E457 Y458	Q117-S119 PolarHBondContact O-N 2.91Å; Q117-Q120 HydrophobicContact CB-CG 4.18Å; Q117-Q120 PolarHBondContact O-N 3.35Å; Q117-R199 PolarHBondContact NE2-O 3.44Å; Q117-D200 PolarHBondContact NE2-OD1 3.25Å; Q117-M203 HydrophobicContact CB-CE 4.11Å; Q117-M203 HydrophobicContact CG-CE 3.42Å; Q117-M203 VanDerWaalsContact CG-CE 3.42Å; Q117-E457 HydrophobicContact CB-CB 3.92Å; Q117-E457 HydrophobicContact CB-CG 4.45Å; Q117-E457 HydrophobicContact CG-CB 4.04Å; Q117-E457 PolarHBondContact N-OE2 3.35Å; Q117-Y458 HydrophobicContact CG-CD1 4.31Å; Q117-Y458 HydrophobicContact CG-CE1 3.74Å
118	L	98.1	Very high	95	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-56.3	-34.3	-171.2	-178.2	59.6	0	0	0	109.3	V116 Q120 V121 L167 P186 W188 Q204 V206	V116-L118 HydrophobicContact CG1-CB 4.07Å; V116-L118 HydrophobicContact CG1-CD1 4.38Å; V116-L118 PolarHBondContact O-N 3.23Å; L118-Q120 PolarHBondContact O-N 3.29Å; L118-V121 HydrophobicContact CD1-CB 4.03Å; L118-V121 HydrophobicContact CD1-CG2 3.96Å; L118-V121 WeakPolarHBondContact O-CA 3.36Å; L118-V121 WeakPolarHBondContact O-CB 3.39Å; L118-V121 PolarHBondContact O-N 3.08Å; L118-L167 HydrophobicContact CD1-CD1 4.44Å; L118-L167 HydrophobicContact CD1-CD2 3.91Å; L118-L167 HydrophobicContact CD2-CB 4.05Å; L118-L167 HydrophobicContact CD2-CD1 4.23Å; L118-L167 HydrophobicContact CD2-CD2 4.16Å; L118-L167 HydrophobicContact CD2-CG 4.37Å; L118-P186 HydrophobicContact CB-CB 4.45Å; L118-P186 HydrophobicContact CD2-CB 4.48Å; L118-P186 HydrophobicContact CD2-CG 4.22Å; L118-P186 HydrophobicContact CG-CB 4.36Å; L118-W188 VanDerWaalsContact C-CZ3 3.45Å; L118-W188 HydrophobicContact CB-CH2 4.31Å; L118-W188 HydrophobicContact CD1-CH2 3.94Å; L118-W188 HydrophobicContact CD1-CZ2 4.28Å; L118-W188 HydrophobicContact CD2-CH2 4.46Å; L118-W188 HydrophobicContact CD2-CZ2 4.16Å; L118-W188 HydrophobicContact CG-CH2 3.52Å; L118-W188 HydrophobicContact CG-CZ2 3.7Å; L118-W188 WeakPolarHBondContact O-CH2 3.16Å; L118-W188 WeakPolarHBondContact O-CZ3 3.36Å; L118-Q204 HydrophobicContact CB-CB 3.51Å; L118-Q204 HydrophobicContact CB-CG 3.9Å; L118-Q204 HydrophobicContact CD2-CB 3.79Å; L118-Q204 HydrophobicContact CD2-CG 4.17Å; L118-Q204 HydrophobicContact CG-CB 4.3Å; L118-Q204 VanDerWaalsContact N-OE1 3.12Å; L118-V206 HydrophobicContact CD1-CG2 4.33Å
119	S	98	Very high	95.4	Very high	28 Å²	28	38.9 Å²	38.9	20%	0.196	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-44.1	-22.2	169.4	-63.6	0	0	0	0	116.6	Q117 S187	Q117-S119 PolarHBondContact O-N 2.91Å; S119-S187 PolarHBondContact OG-N 3.09Å
120	Q	97.4	Very high	95.7	Very high	66 Å²	66	38.7 Å²	38.7	31%	0.308	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-95.4	-6.9	175.5	-55.6	-44.4	-49.4	0	0	114.7	Q117 L118 S122 W456 E457 P459	Q117-Q120 HydrophobicContact CB-CG 4.18Å; Q117-Q120 PolarHBondContact O-N 3.35Å; L118-Q120 PolarHBondContact O-N 3.29Å; Q120-S122 PolarHBondContact O-N 3.36Å; Q120-W456 HydrophobicContact CB-CE3 4.46Å; Q120-W456 HydrophobicContact CB-CZ3 4.21Å; Q120-E457 WeakPolarHBondContact CG-O 3.37Å; Q120-P459 VanDerWaalsContact OE1-CG 3.25Å
121	V	97.2	Very high	96.1	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	24%	0.238	C	C	.	.	S	Bend	trans	-80.4	109.6	170.8	-178.8	0	0	0	0	108.4	L81 L82 L118 S125 F126 W188 W456	L81-V121 HydrophobicContact CD2-CG1 4.38Å; L82-V121 HydrophobicContact CD2-CG1 4.5Å; L82-V121 HydrophobicContact CD2-CG2 4.41Å; L118-V121 HydrophobicContact CD1-CB 4.03Å; L118-V121 HydrophobicContact CD1-CG2 3.96Å; L118-V121 WeakPolarHBondContact O-CA 3.36Å; L118-V121 WeakPolarHBondContact O-CB 3.39Å; L118-V121 PolarHBondContact O-N 3.08Å; V121-S125 VanDerWaalsContact CG1-OG 3.31Å; V121-S125 WeakPolarHBondContact CG1-OG 3.49Å; V121-F126 HydrophobicContact CG1-CD1 4.09Å; V121-F126 HydrophobicContact CG1-CE1 4.21Å; V121-W188 HydrophobicContact CB-CH2 4.35Å; V121-W188 VanDerWaalsContact O-CH2 3.32Å; V121-W188 WeakPolarHBondContact O-CH2 3.4Å; V121-W188 WeakPolarHBondContact O-CZ3 3.48Å; V121-W456 HydrophobicContact CG2-CH2 3.8Å; V121-W456 HydrophobicContact CG2-CZ3 3.98Å
122	S	95.4	Very high	96.7	Very high	59 Å²	59	37.8 Å²	37.8	41%	0.413	23%	0.234	S	C	.	.			trans	-53.6	130.9	-179	177.8	0	0	0	0	111.5	Q120 S124 S125	Q120-S122 PolarHBondContact O-N 3.36Å; S122-S124 PolarHBondContact O-N 2.7Å; S122-S124 PolarHBondContact OG-N 2.67Å; S122-S124 PolarHBondContact OG-OG 2.81Å; S122-S125 WeakPolarHBondContact O-CB 3.43Å; S122-S125 PolarHBondContact O-N 3.4Å; S122-S125 PolarHBondContact O-OG 2.93Å
123	P	95.6	Very high	97.1	Very high	67 Å²	67	35.1 Å²	35.1	44%	0.435	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-56.6	-18.6	171.9	-28.2	36.5	0	0	0	114.6	S125 F126 W188	P123-S125 PolarHBondContact O-N 2.85Å; P123-F126 HydrophobicContact CB-CZ 4.29Å; P123-F126 VanDerWaalsContact O-O 3.07Å; P123-W188 HydrophobicContact CG-CB 3.91Å; P123-W188 HydrophobicContact CG-CD2 4.01Å; P123-W188 HydrophobicContact CG-CE3 4.13Å; P123-W188 HydrophobicContact CG-CG 3.92Å
124	S	96.8	Very high	97.4	Very high	110 Å²	110	36.7 Å²	36.7	77%	0.769	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-76	-9.7	173.3	71.1	0	0	0	0	113.9	S122	S122-S124 PolarHBondContact O-N 2.7Å; S122-S124 PolarHBondContact OG-N 2.67Å; S122-S124 PolarHBondContact OG-OG 2.81Å
125	S	96.8	Very high	97.5	Very high	33 Å²	33	36.6 Å²	36.6	23%	0.231	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-94.1	1.3	-178.3	71.4	0	0	0	0	113.7	S79 V121 S122 P123	S79-S125 PolarHBondContact OG-O 2.64Å; V121-S125 VanDerWaalsContact CG1-OG 3.31Å; V121-S125 WeakPolarHBondContact CG1-OG 3.49Å; S122-S125 WeakPolarHBondContact O-CB 3.43Å; S122-S125 PolarHBondContact O-N 3.4Å; S122-S125 PolarHBondContact O-OG 2.93Å; P123-S125 PolarHBondContact O-N 2.85Å
126	F	97.9	Very high	97.6	Very high	14 Å²	14	32.9 Å²	32.9	6%	0.061	21%	0.209	C	C	.	.			trans	-148.1	155.2	176.1	61.8	-95.4	0	0	0	111.8	V77 E78 V121 P123 P128 L167 W188	V77-F126 HydrophobicContact CB-CB 4.27Å; V77-F126 HydrophobicContact CB-CD2 4.26Å; V77-F126 HydrophobicContact CG1-CD2 3.93Å; V77-F126 HydrophobicContact CG1-CE2 4.49Å; V77-F126 HydrophobicContact CG2-CB 4.24Å; E78-F126 CarbonylContact O-C 3.52Å; E78-F126 WeakPolarHBondContact O-CA 3.29Å; E78-F126 WeakPolarHBondContact O-CB 3.39Å; V121-F126 HydrophobicContact CG1-CD1 4.09Å; V121-F126 HydrophobicContact CG1-CE1 4.21Å; P123-F126 HydrophobicContact CB-CZ 4.29Å; P123-F126 VanDerWaalsContact O-O 3.07Å; F126-P128 HydrophobicContact CD2-CG 4.39Å; F126-P128 HydrophobicContact CE2-CG 4.34Å; F126-L167 HydrophobicContact CD2-CD1 4.33Å; F126-L167 HydrophobicContact CE2-CD1 4.09Å; F126-L167 HydrophobicContact CZ-CD1 4.21Å; F126-W188 HydrophobicContact CE1-CH2 4.2Å; F126-W188 HydrophobicContact CE1-CZ2 4.1Å; F126-W188 HydrophobicContact CZ-CH2 4.33Å; F126-W188 AromaticContact CZ-CZ2 3.78Å; F126-W188 HydrophobicContact CZ-CZ2 3.78Å
127	T	98.1	Very high	97.6	Very high	66 Å²	66	36 Å²	36	41%	0.405	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	117.3	176.1	-60.2	0	0	0	0	109.5	V77 E78 L129 A159	V77-T127 VanDerWaalsContact CA-O 3.31Å; V77-T127 WeakPolarHBondContact CA-O 3.5Å; E78-T127 PolarHBondContact N-O 2.78Å; E78-T127 PolarHBondContact O-N 2.81Å; T127-L129 PolarHBondContact O-N 3.21Å; T127-A159 HydrophobicContact CG2-CB 4.27Å
128	P	97.9	Very high	97.6	Very high	45 Å²	45	36.7 Å²	36.7	29%	0.292	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	120.7	174.6	-23.8	34.8	0	0	0	112.6	F126	F126-P128 HydrophobicContact CD2-CG 4.39Å; F126-P128 HydrophobicContact CE2-CG 4.34Å
129	L	98.3	Very high	97.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.244	C	C	.	.			trans	-95.9	-28.6	176.1	-56.8	-178.8	0	0	0	111.8	L76 E78 T127 A157 R158 A159 A163	L76-L129 HydrophobicContact CD2-CB 4.1Å; L76-L129 HydrophobicContact CD2-CD1 4.42Å; L76-L129 HydrophobicContact CG-CB 4.16Å; L76-L129 HydrophobicContact CG-CD1 4.38Å; L76-L129 PolarHBondContact O-N 3.38Å; E78-L129 HydrophobicContact CB-CD1 4.32Å; E78-L129 HydrophobicContact CB-CD2 4.48Å; E78-L129 HydrophobicContact CB-CG 4.48Å; T127-L129 PolarHBondContact O-N 3.21Å; L129-A157 CarbonylContact O-C 3.44Å; L129-A157 VanDerWaalsContact O-CA 3.31Å; L129-A157 WeakPolarHBondContact O-CA 3.42Å; L129-R158 PolarHBondContact O-N 3.36Å; L129-A159 HydrophobicContact CD2-CB 4.3Å; L129-A163 HydrophobicContact CD1-CB 4.04Å
130	S	98	Very high	97.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	-110.5	161.2	174.7	75.9	0	0	0	0	112.6	Q75 L76	Q75-S130 PolarHBondContact NE2-O 3.45Å; L76-S130 PolarHBondContact N-OG 3.12Å; L76-S130 PolarHBondContact O-N 2.91Å
131	P	97.4	Very high	97.6	Very high	33 Å²	33	35 Å²	35	21%	0.214	23%	0.227	C	C	.	.			trans	-59.4	168.1	153.4	30.7	-35.8	0	0	0	111.8	C133 F155	P131-C133 PolarHBondContact O-N 3.34Å; P131-F155 HydrophobicContact CG-CB 3.78Å; P131-F155 HydrophobicContact CG-CG 4.37Å
132	L	97.7	Very high	97.6	Very high	78 Å²	78	40.6 Å²	40.6	41%	0.408	25%	0.252	S	S	.	.			trans	-68.1	115.2	164.6	-174.6	65	0	0	0	107.8	Y73 Q75 W169	Y73-L132 HydrophobicContact CD1-CD2 4.13Å; Y73-L132 HydrophobicContact CD1-CG 4.1Å; Y73-L132 HydrophobicContact CG-CD2 4.44Å; Y73-L132 HydrophobicContact CG-CG 4.44Å; Q75-L132 HydrophobicContact CB-CD1 4.32Å; L132-W169 HydrophobicContact CD1-CH2 3.52Å; L132-W169 HydrophobicContact CD1-CZ2 3.29Å; L132-W169 HydrophobicContact CD1-CZ3 4.45Å; L132-W169 HydrophobicContact CD2-CZ2 3.93Å; L132-W169 HydrophobicContact CG-CZ2 4.26Å
133	C	98.1	Very high	97.6	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.034	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	126.9	-179.2	-63.2	0	0	0	0	109.2	Y73 A74 P131 M135 T153	Y73-C133 CarbonylContact C-O 3.37Å; Y73-C133 VanDerWaalsContact CA-O 3.24Å; Y73-C133 WeakPolarHBondContact CA-O 3.43Å; A74-C133 PolarHBondContact N-O 2.88Å; A74-C133 PolarHBondContact O-N 3.26Å; P131-C133 PolarHBondContact O-N 3.34Å; C133-M135 HydrophobicContact CB-SD 3.55Å; C133-M135 VanDerWaalsContact CB-SD 3.55Å; C133-M135 PolarHBondContact O-N 3.31Å; C133-T153 HydrophobicContact CB-CG2 4Å
134	A	98.1	Very high	97.7	Very high	56 Å²	56	40.8 Å²	40.8	46%	0.463	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	106.3	166.4	0	0	0	0	0	107.9	T71 Y73	T71-A134 HydrophobicContact CG2-CB 4.15Å; Y73-A134 HydrophobicContact CD1-CB 4.03Å; Y73-A134 HydrophobicContact CE1-CB 3.91Å
135	M	98.2	Very high	97.7	Very high	9 Å²	9	37.8 Å²	37.8	4%	0.044	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-49.9	-166.2	-61.9	-56.6	-60.4	0	0	112.3	V72 A74 C133 H151 L223 V225 Y234	V72-M135 PolarHBondContact O-N 3.39Å; A74-M135 HydrophobicContact CB-CG 3.52Å; A74-M135 HydrophobicContact CB-SD 3.86Å; C133-M135 HydrophobicContact CB-SD 3.55Å; C133-M135 VanDerWaalsContact CB-SD 3.55Å; C133-M135 PolarHBondContact O-N 3.31Å; M135-H151 WeakPolarHBondContact O-CB 3.32Å; M135-L223 HydrophobicContact CE-CB 4.36Å; M135-L223 HydrophobicContact CE-CD2 4.15Å; M135-L223 HydrophobicContact CE-CG 3.95Å; M135-L223 WeakPolarHBondContact CE-O 3.42Å; M135-L223 HydrophobicContact SD-CD2 3.97Å; M135-L223 HydrophobicContact SD-CG 4.4Å; M135-V225 HydrophobicContact CB-CB 4.46Å; M135-V225 HydrophobicContact CB-CG1 3.73Å; M135-V225 HydrophobicContact CE-CB 3.93Å; M135-V225 HydrophobicContact CE-CG1 3.89Å; M135-V225 HydrophobicContact CG-CG1 4.46Å; M135-Y234 HydrophobicContact CE-CE1 4.24Å; M135-Y234 HydrophobicContact CG-CE1 4.25Å
136	F	98.1	Very high	97.7	Very high	13 Å²	13	37.6 Å²	37.6	6%	0.057	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	162.6	173.1	69.4	-80.9	0	0	0	110.5	T71 V72 V138 H151 V225 L232	T71-F136 WeakPolarHBondContact CA-O 3.46Å; V72-F136 HydrophobicContact CB-CD1 3.94Å; V72-F136 HydrophobicContact CB-CE1 3.58Å; V72-F136 HydrophobicContact CB-CZ 3.99Å; V72-F136 HydrophobicContact CG1-CE1 3.95Å; V72-F136 HydrophobicContact CG2-CD1 4.27Å; V72-F136 HydrophobicContact CG2-CE1 3.57Å; V72-F136 HydrophobicContact CG2-CE2 4.01Å; V72-F136 HydrophobicContact CG2-CZ 3.42Å; V72-F136 VanDerWaalsContact CG2-CZ 3.42Å; V72-F136 PolarHBondContact N-O 2.9Å; F136-V138 HydrophobicContact CD2-CG2 4Å; F136-V138 HydrophobicContact CE2-CG2 3.82Å; F136-H151 HydrophobicContact CB-CB 4.16Å; F136-H151 AromaticContact CG-CD2 3.85Å; F136-V225 HydrophobicContact CD1-CG1 3.78Å; F136-V225 HydrophobicContact CE1-CG1 4.21Å; F136-V225 HydrophobicContact CE1-CG2 4.46Å; F136-L232 HydrophobicContact CE1-CD2 3.72Å; F136-L232 HydrophobicContact CZ-CD2 3.91Å
137	S	98.1	Very high	97.6	Very high	67 Å²	67	39.4 Å²	39.4	47%	0.469	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.1	174.3	-56.7	0	0	0	0	110.5	A70 T71	A70-S137 CarbonylContact O-C 3.54Å; A70-S137 WeakPolarHBondContact O-CA 3.46Å; A70-S137 VanDerWaalsContact O-CB 3.3Å; A70-S137 WeakPolarHBondContact O-CB 3.49Å; T71-S137 PolarHBondContact OG1-OG 3.41Å
138	V	98.2	Very high	97.5	Very high	20 Å²	20	40.6 Å²	40.6	12%	0.121	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	117.9	174	-173.7	0	0	0	0	108.1	L48 R69 A70 F136 F140 V144	L48-V138 HydrophobicContact CD2-CG1 4.36Å; L48-V138 HydrophobicContact CD2-CG2 4.31Å; R69-V138 CarbonylContact C-O 3.58Å; R69-V138 WeakPolarHBondContact CA-O 3.3Å; R69-V138 WeakPolarHBondContact CG-O 3.47Å; A70-V138 PolarHBondContact N-O 3.1Å; A70-V138 PolarHBondContact O-N 3.45Å; F136-V138 HydrophobicContact CD2-CG2 4Å; F136-V138 HydrophobicContact CE2-CG2 3.82Å; V138-F140 HydrophobicContact CB-CE1 3.97Å; V138-F140 HydrophobicContact CB-CZ 4.12Å; V138-F140 HydrophobicContact CG1-CD1 3.76Å; V138-F140 HydrophobicContact CG1-CE1 3.48Å; V138-F140 VanDerWaalsContact CG1-CE1 3.48Å; V138-F140 HydrophobicContact CG1-CZ 4.14Å; V138-V144 HydrophobicContact CG1-CG1 4.13Å; V138-V144 HydrophobicContact CG1-CG2 4Å
139	D	98.1	Very high	97.3	Very high	34 Å²	34	41.9 Å²	41.9	18%	0.182	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	103.2	174.4	-177.4	-17.8	0	0	0	108.7	H68 S141 K142	H68-D139 IonicContact CE1-OD1 3.58Å; D139-S141 PolarHBondContact O-N 2.76Å; D139-S141 PolarHBondContact OD1-N 2.87Å; D139-S141 VanDerWaalsContact OD1-N 3.11Å; D139-S141 PolarHBondContact OD1-OG 2.95Å; D139-K142 HydrophobicContact CB-CD 4.45Å; D139-K142 PolarHBondContact O-N 3.14Å; D139-K142 WeakPolarHBondContact OD2-CD 3.31Å; D139-K142 VanDerWaalsContact OD2-CE 3.28Å; D139-K142 WeakPolarHBondContact OD2-CE 3.42Å; D139-K142 IonicContact OD2-NZ 3.48Å; D139-K142 PolarHBondContact OD2-NZ 2.96Å
140	F	98.3	Very high	97.2	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.009	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-12	-173.9	-63.9	-57.9	0	0	0	113.1	F38 Y51 H55 A65 P67 H68 A70 V138 K142 V144 L172	F38-F140 HydrophobicContact CE1-CE1 4.25Å; F38-F140 AromaticContact CE1-CE2 3.97Å; F38-F140 HydrophobicContact CE1-CE2 3.97Å; F38-F140 AromaticContact CE1-CZ 3.58Å; F38-F140 HydrophobicContact CE1-CZ 3.58Å; F38-F140 HydrophobicContact CZ-CE2 4.02Å; F38-F140 HydrophobicContact CZ-CZ 4.07Å; Y51-F140 HydrophobicContact CD1-CB 4.06Å; Y51-F140 AromaticContact CD1-CD1 3.79Å; Y51-F140 HydrophobicContact CD1-CD1 3.79Å; Y51-F140 HydrophobicContact CD1-CG 4.27Å; Y51-F140 AromaticContact CD2-CD1 3.71Å; Y51-F140 HydrophobicContact CD2-CD1 3.71Å; Y51-F140 AromaticContact CD2-CE1 3.86Å; Y51-F140 HydrophobicContact CD2-CE1 3.86Å; Y51-F140 HydrophobicContact CE1-CB 3.51Å; Y51-F140 AromaticContact CE1-CD1 3.67Å; Y51-F140 HydrophobicContact CE1-CD1 3.67Å; Y51-F140 AromaticContact CE1-CG 3.76Å; Y51-F140 HydrophobicContact CE1-CG 3.76Å; Y51-F140 AromaticContact CE2-CD1 3.57Å; Y51-F140 HydrophobicContact CE2-CD1 3.57Å; Y51-F140 AromaticContact CE2-CE1 3.72Å; Y51-F140 HydrophobicContact CE2-CE1 3.72Å; Y51-F140 HydrophobicContact CE2-CG 4.15Å; Y51-F140 HydrophobicContact CE2-CZ 4.39Å; Y51-F140 AromaticContact CG-CD1 3.81Å; Y51-F140 HydrophobicContact CG-CD1 3.81Å; Y51-F140 HydrophobicContact CG-CE1 4.36Å; Y51-F140 AromaticContact CZ-CD1 3.51Å; Y51-F140 AromaticContact CZ-CG 3.64Å; H55-F140 PolarHBondContact CE1-O 3.42Å; H55-F140 PolarHBondContact NE2-O 3.08Å; A65-F140 VanDerWaalsContact CB-C 3.5Å; A65-F140 HydrophobicContact CB-CB 3.86Å; A65-F140 WeakPolarHBondContact CB-O 3.33Å; P67-F140 HydrophobicContact CB-CD2 4.4Å; P67-F140 HydrophobicContact CG-CD2 3.87Å; P67-F140 HydrophobicContact CG-CE2 3.89Å; P67-F140 WeakPolarHBondContact O-CB 3.26Å; P67-F140 WeakPolarHBondContact O-CD2 3.39Å; H68-F140 PolarHBondContact O-N 2.82Å; A70-F140 HydrophobicContact CB-CE2 3.59Å; A70-F140 HydrophobicContact CB-CZ 3.74Å; V138-F140 HydrophobicContact CB-CE1 3.97Å; V138-F140 HydrophobicContact CB-CZ 4.12Å; V138-F140 HydrophobicContact CG1-CD1 3.76Å; V138-F140 HydrophobicContact CG1-CE1 3.48Å; V138-F140 VanDerWaalsContact CG1-CE1 3.48Å; V138-F140 HydrophobicContact CG1-CZ 4.14Å; F140-K142 PolarHBondContact O-N 3.07Å; F140-V144 HydrophobicContact CD1-CG2 4.24Å; F140-L172 HydrophobicContact CE2-CD2 4.22Å
141	S	97.1	Very high	97.1	Very high	22 Å²	22	46.9 Å²	46.9	15%	0.154	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-4.2	174.3	101.6	0	0	0	0	112.3	C63 D139	C63-S141 WeakPolarHBondContact O-CB 3.46Å; D139-S141 PolarHBondContact O-N 2.76Å; D139-S141 PolarHBondContact OD1-N 2.87Å; D139-S141 VanDerWaalsContact OD1-N 3.11Å; D139-S141 PolarHBondContact OD1-OG 2.95Å
142	K	97.1	Very high	97	Very high	120 Å²	120	48.1 Å²	48.1	52%	0.522	29%	0.287	S	S	.	.	S	Bend	trans	-119.2	162.5	179	-68.1	-179.6	-174.8	134.9	0	110.9	H55 D139 F140 V144	H55-K142 PolarHBondContact CD2-O 3.33Å; H55-K142 VanDerWaalsContact CE1-C 3.44Å; H55-K142 PolarHBondContact CE1-O 2.85Å; H55-K142 VanDerWaalsContact CE1-O 3.29Å; H55-K142 PolarHBondContact NE2-O 2.86Å; D139-K142 HydrophobicContact CB-CD 4.45Å; D139-K142 PolarHBondContact O-N 3.14Å; D139-K142 WeakPolarHBondContact OD2-CD 3.31Å; D139-K142 VanDerWaalsContact OD2-CE 3.28Å; D139-K142 WeakPolarHBondContact OD2-CE 3.42Å; D139-K142 IonicContact OD2-NZ 3.48Å; D139-K142 PolarHBondContact OD2-NZ 2.96Å; F140-K142 PolarHBondContact O-N 3.07Å; K142-V144 PolarHBondContact O-N 2.91Å
143	P	96.8	Very high	96.8	Very high	115 Å²	115	46.2 Å²	46.2	75%	0.747	28%	0.278	S	S	*	.			trans	-52.2	117.1	173.8	-27.7	36	0	0	0	111.8
144	V	96.8	Very high	96.7	Very high	15 Å²	15	48.7 Å²	48.7	9%	0.091	30%	0.296	C	S	.	.			trans	-89.9	148.4	175.9	177.8	0	0	0	0	109	L48 Y51 E52 V138 F140 K142	L48-V144 HydrophobicContact CB-CG1 4.48Å; L48-V144 HydrophobicContact CD2-CG1 3.85Å; Y51-V144 HydrophobicContact CG-CG2 4.42Å; E52-V144 WeakPolarHBondContact CA-O 3.28Å; E52-V144 WeakPolarHBondContact CB-O 3.49Å; E52-V144 WeakPolarHBondContact CG-O 3.07Å; V138-V144 HydrophobicContact CG1-CG1 4.13Å; V138-V144 HydrophobicContact CG1-CG2 4Å; F140-V144 HydrophobicContact CD1-CG2 4.24Å; K142-V144 PolarHBondContact O-N 2.91Å
145	S	96.6	Very high	96.7	Very high	47 Å²	47	46.8 Å²	46.8	33%	0.329	28%	0.277	S	S	.	.			trans	-118.5	138.8	171.7	-173	0	0	0	0	111.1	E52 A147	E52-S145 WeakPolarHBondContact OE1-CA 3.31Å; E52-S145 PolarHBondContact OE1-OG 3.09Å; S145-A147 VanDerWaalsContact C-N 3.35Å; S145-A147 WeakPolarHBondContact OG-CB 3.47Å; S145-A147 PolarHBondContact OG-N 3.36Å
146	S	96.4	Very high	96.6	Very high	28 Å²	28	50.1 Å²	50.1	20%	0.196	30%	0.298	C	S	.	.			trans	-89.1	-1.1	172	65.7	0	0	0	0	113.3	E52	E52-S146 PolarHBondContact OE1-N 3.07Å; E52-S146 VanDerWaalsContact OE2-CB 3.31Å; E52-S146 WeakPolarHBondContact OE2-CB 3.41Å; E52-S146 PolarHBondContact OE2-N 3.17Å; E52-S146 PolarHBondContact OE2-OG 3.18Å
147	A	96.4	Very high	96.6	Very high	53 Å²	53	49.6 Å²	49.6	44%	0.438	30%	0.296	S	S	.	.	S	Bend	trans	-64.5	153.8	179.4	0	0	0	0	0	111.8	S145 Q149	S145-A147 VanDerWaalsContact C-N 3.35Å; S145-A147 WeakPolarHBondContact OG-CB 3.47Å; S145-A147 PolarHBondContact OG-N 3.36Å; A147-Q149 PolarHBondContact O-N 3.33Å
148	F	95.8	Very high	96.5	Very high	91 Å²	91	53.5 Å²	53.5	40%	0.399	30%	0.3	S	S	.	.			trans	-52	133.3	174	173.3	-93.3	0	0	0	112.3	C226 H227 W233 P249	F148-C226 HydrophobicContact CE2-CB 3.96Å; F148-C226 HydrophobicContact CZ-CB 4.11Å; F148-H227 WeakPolarHBondContact CA-O 3.49Å; F148-H227 VanDerWaalsContact CD2-O 3.25Å; F148-H227 WeakPolarHBondContact CD2-O 3.46Å; F148-W233 AromaticContact CD2-CH2 3.98Å; F148-W233 HydrophobicContact CD2-CH2 3.98Å; F148-W233 HydrophobicContact CD2-CZ2 4.25Å; F148-W233 AromaticContact CE2-CH2 3.65Å; F148-W233 HydrophobicContact CE2-CH2 3.65Å; F148-W233 AromaticContact CE2-CZ2 3.49Å; F148-W233 HydrophobicContact CE2-CZ2 3.49Å; F148-W233 VanDerWaalsContact CE2-CZ2 3.49Å; F148-W233 HydrophobicContact CZ-CZ2 4.42Å; F148-P249 HydrophobicContact CE1-CB 3.62Å; F148-P249 HydrophobicContact CE1-CG 3.59Å; F148-P249 HydrophobicContact CZ-CB 3.5Å; F148-P249 VanDerWaalsContact CZ-CB 3.5Å; F148-P249 HydrophobicContact CZ-CG 3.81Å
149	Q	94.8	Very high	96.4	Very high	72 Å²	72	53.8 Å²	53.8	34%	0.336	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	159.7	172.9	-56.1	-176.1	-0.1	0	0	112.4	A147 H151 C226 H227	A147-Q149 PolarHBondContact O-N 3.33Å; Q149-H151 PolarHBondContact OE1-CE1 2.93Å; Q149-H151 PolarHBondContact OE1-NE2 2.93Å; Q149-H151 VanDerWaalsContact OE1-NE2 3.09Å; Q149-C226 WeakPolarHBondContact O-CA 3.47Å; Q149-H227 PolarHBondContact N-O 3.22Å; Q149-H227 PolarHBondContact O-N 2.82Å
150	S	95	Very high	96.3	Very high	52 Å²	52	54.2 Å²	54.2	36%	0.364	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	132.3	175.4	-176.2	0	0	0	0	110	T224 V225 C226	S150-T224 WeakPolarHBondContact OG-CG2 3.4Å; S150-V225 WeakPolarHBondContact CA-O 3.13Å; S150-C226 PolarHBondContact OG-SG 3.35Å
151	H	95.3	Very high	96.3	Very high	52 Å²	52	54.6 Å²	54.6	24%	0.241	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	131.1	-178	-55.4	-83.6	0	0	0	109.3	M135 F136 Q149 T224 V225 H227	M135-H151 WeakPolarHBondContact O-CB 3.32Å; F136-H151 HydrophobicContact CB-CB 4.16Å; F136-H151 AromaticContact CG-CD2 3.85Å; Q149-H151 PolarHBondContact OE1-CE1 2.93Å; Q149-H151 PolarHBondContact OE1-NE2 2.93Å; Q149-H151 VanDerWaalsContact OE1-NE2 3.09Å; H151-T224 CarbonylContact O-C 3.53Å; H151-T224 VanDerWaalsContact O-CA 3.31Å; H151-T224 WeakPolarHBondContact O-CA 3.35Å; H151-V225 HydrophobicContact CB-CG1 3.95Å; H151-V225 PolarHBondContact N-O 3.18Å; H151-V225 PolarHBondContact O-N 2.52Å; H151-H227 AromaticContact NE2-NE2 3.73Å
152	S	95.1	Very high	96.3	Very high	60 Å²	60	56.5 Å²	56.5	42%	0.42	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.2	-176.8	-63	0	0	0	0	111.1	L223 T224	S152-L223 WeakPolarHBondContact CA-O 3.46Å; S152-T224 WeakPolarHBondContact OG-CG2 3.22Å; S152-T224 PolarHBondContact OG-OG1 2.78Å
153	T	95.4	Very high	96.3	Very high	38 Å²	38	50.8 Å²	50.8	23%	0.233	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.6	174.5	-63.6	0	0	0	0	109.9	C133 S222 L223	C133-T153 HydrophobicContact CB-CG2 4Å; T153-S222 WeakPolarHBondContact O-CA 3.41Å; T153-L223 PolarHBondContact N-O 3.48Å; T153-L223 PolarHBondContact O-N 3.49Å
154	S	95.7	Very high	96.2	Very high	57 Å²	57	45.4 Å²	45.4	40%	0.399	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	140	174.1	-57.7	0	0	0	0	111	L221	S154-L221 CarbonylContact C-O 3.55Å; S154-L221 VanDerWaalsContact CA-O 3.28Å; S154-L221 WeakPolarHBondContact CA-O 3.43Å
155	F	96.5	Very high	96.3	Very high	15 Å²	15	44.7 Å²	44.7	7%	0.066	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	162.3	177.3	65.9	-85.4	0	0	0	111.5	L76 P131 L221 L223 L236	L76-F155 HydrophobicContact CD2-CZ 3.95Å; P131-F155 HydrophobicContact CG-CB 3.78Å; P131-F155 HydrophobicContact CG-CG 4.37Å; F155-L221 HydrophobicContact CE1-CB 3.9Å; F155-L221 HydrophobicContact CE2-CB 3.97Å; F155-L221 HydrophobicContact CE2-CD1 3.93Å; F155-L221 HydrophobicContact CE2-CG 4.48Å; F155-L221 HydrophobicContact CZ-CB 3.61Å; F155-L221 HydrophobicContact CZ-CD1 3.88Å; F155-L221 HydrophobicContact CZ-CG 4.38Å; F155-L221 PolarHBondContact N-O 3.11Å; F155-L221 PolarHBondContact O-N 3.11Å; F155-L223 HydrophobicContact CE1-CB 3.84Å; F155-L236 HydrophobicContact CE1-CD1 4.34Å; F155-L236 HydrophobicContact CZ-CD1 4.17Å
156	V	97.3	Very high	96.4	Very high	79 Å²	79	42.4 Å²	42.4	48%	0.479	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.5	171.9	178.8	0	0	0	0	108.4	R158 R218 E220	V156-R158 PolarHBondContact O-N 3.21Å; V156-R218 HydrophobicContact CG1-CB 4.08Å; V156-E220 HydrophobicContact CG2-CG 4.28Å
157	A	97.3	Very high	96.5	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.025	24%	0.236	C	C	.	.			trans	-59.4	130	-179.4	0	0	0	0	0	111.4	L129 V215 A216 R218 E219 L221	L129-A157 CarbonylContact O-C 3.44Å; L129-A157 VanDerWaalsContact O-CA 3.31Å; L129-A157 WeakPolarHBondContact O-CA 3.42Å; A157-V215 HydrophobicContact CB-CG1 3.49Å; A157-V215 VanDerWaalsContact CB-CG1 3.49Å; A157-A216 WeakPolarHBondContact CB-O 3.16Å; A157-R218 WeakPolarHBondContact O-CA 3.47Å; A157-R218 PolarHBondContact O-N 3.27Å; A157-E219 HydrophobicContact CB-CB 4.39Å; A157-E219 WeakPolarHBondContact CB-O 3.44Å; A157-E219 PolarHBondContact N-O 3.08Å; A157-L221 HydrophobicContact CB-CD1 4.24Å
158	R	96.6	Very high	96.6	Very high	149 Å²	149	38.8 Å²	38.8	56%	0.562	22%	0.217	S	C	*	.	S	Bend	trans	-77.8	-25.8	-176.9	-68.2	-175.3	169	-171.5	-3.3	113.5	L129 V156	L129-R158 PolarHBondContact O-N 3.36Å; V156-R158 PolarHBondContact O-N 3.21Å
159	A	96.1	Very high	96.7	Very high	25 Å²	25	34.7 Å²	34.7	21%	0.207	20%	0.199	C	C	.	.	S	Bend	trans	-150.3	155.3	-177.8	0	0	0	0	0	109.1	T127 L129	T127-A159 HydrophobicContact CG2-CB 4.27Å; L129-A159 HydrophobicContact CD2-CB 4.3Å
160	G	96.8	Very high	96.9	Very high	44 Å²	44	31.4 Å²	31.4	45%	0.454	18%	0.183	S	C	.	.			trans	-78.3	145.2	165.4	0	0	0	0	0	110.8	V215	G160-V215 CarbonylContact C-O 3.56Å; G160-V215 WeakPolarHBondContact CA-O 3.18Å
161	G	97	Very high	97.1	Very high	10 Å²	10	30.1 Å²	30.1	10%	0.103	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.4	-170	-178	0	0	0	0	0	114.2	E78 Q214 V215	E78-G161 WeakPolarHBondContact OE2-CA 3.41Å; G161-Q214 PolarHBondContact O-OE1 3.02Å; G161-V215 PolarHBondContact N-O 2.79Å; G161-V215 PolarHBondContact O-N 2.73Å
162	R	97	Very high	97.2	Very high	62 Å²	62	27.7 Å²	27.7	23%	0.234	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	107.4	176	-67.6	178.8	-58.8	-52.1	-2.3	109.9	E78 E80 Q164 E212	E78-R162 VanDerWaalsContact CA-O 3.28Å; E78-R162 WeakPolarHBondContact CA-O 3.42Å; E78-R162 VanDerWaalsContact CB-O 3.26Å; E78-R162 WeakPolarHBondContact CB-O 3.27Å; E78-R162 VanDerWaalsContact CD-NH1 3.27Å; E78-R162 HydrophobicContact CG-CB 4.19Å; E78-R162 IonicContact OE1-CZ 3.19Å; E78-R162 IonicContact OE1-NH1 2.77Å; E78-R162 PolarHBondContact OE1-NH1 2.97Å; E78-R162 IonicContact OE1-NH2 3.39Å; E78-R162 PolarHBondContact OE1-NH2 3.44Å; E78-R162 IonicContact OE2-CZ 2.71Å; E78-R162 PolarHBondContact OE2-N 2.81Å; E78-R162 IonicContact OE2-NH1 3.13Å; E78-R162 PolarHBondContact OE2-NH1 2.84Å; E80-R162 IonicContact OE1-CZ 3.2Å; E80-R162 IonicContact OE1-NE 2.7Å; E80-R162 PolarHBondContact OE1-NE 3.29Å; E80-R162 IonicContact OE1-NH2 3.04Å; E80-R162 PolarHBondContact OE1-NH2 3.38Å; R162-Q164 HydrophobicContact CB-CG 3.96Å; R162-Q164 WeakPolarHBondContact O-CG 3.3Å; R162-Q164 PolarHBondContact O-N 3.4Å; R162-Q164 VanDerWaalsContact O-N 3.16Å; R162-E212 VanDerWaalsContact CD-OE2 3.28Å; R162-E212 WeakPolarHBondContact CD-OE2 3.07Å
163	A	97.1	Very high	97.4	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	110	168	0	0	0	0	0	109.7	L76 L129 L209 E212 R213 V215 L236	L76-A163 HydrophobicContact CD1-CB 4.05Å; L76-A163 HydrophobicContact CD2-CB 3.9Å; L76-A163 HydrophobicContact CG-CB 4.28Å; L129-A163 HydrophobicContact CD1-CB 4.04Å; A163-L209 HydrophobicContact CB-CD1 4.04Å; A163-E212 WeakPolarHBondContact O-CA 3.42Å; A163-R213 HydrophobicContact CB-CB 4.42Å; A163-R213 WeakPolarHBondContact CB-O 3.48Å; A163-R213 PolarHBondContact N-O 3.33Å; A163-R213 PolarHBondContact O-N 2.96Å; A163-R213 VanDerWaalsContact O-N 3.08Å; A163-V215 HydrophobicContact CB-CG2 3.72Å; A163-L236 HydrophobicContact CB-CD2 3.54Å
164	Q	95.7	Very high	97.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	-49.9	-172.1	-73	168.6	-24.3	0	0	111.3	V77 S79 E80 W83 R162 L209 E212	V77-Q164 PolarHBondContact O-N 3.42Å; S79-Q164 PolarHBondContact O-OE1 3.29Å; E80-Q164 PolarHBondContact OE1-NE2 2.75Å; E80-Q164 VanDerWaalsContact OE1-NE2 3.12Å; W83-Q164 HydrophobicContact CB-CB 4.34Å; W83-Q164 HydrophobicContact CB-CG 4.43Å; W83-Q164 HydrophobicContact CD2-CB 3.79Å; W83-Q164 HydrophobicContact CD2-CG 3.82Å; W83-Q164 HydrophobicContact CE3-CB 3.62Å; W83-Q164 HydrophobicContact CE3-CG 4.16Å; W83-Q164 HydrophobicContact CG-CB 4.13Å; W83-Q164 HydrophobicContact CG-CG 3.95Å; W83-Q164 HydrophobicContact CZ3-CB 4.16Å; W83-Q164 WeakPolarHBondContact CZ3-O 3.45Å; R162-Q164 HydrophobicContact CB-CG 3.96Å; R162-Q164 WeakPolarHBondContact O-CG 3.3Å; R162-Q164 PolarHBondContact O-N 3.4Å; R162-Q164 VanDerWaalsContact O-N 3.16Å; Q164-L209 PolarHBondContact O-N 2.86Å; Q164-E212 HydrophobicContact CG-CB 4.25Å
165	V	97.8	Very high	97.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.7	-164.8	175.3	0	0	0	0	110.5	V77 L82 W83 L167 V206 Y207 F208	V77-V165 HydrophobicContact CG2-CB 3.78Å; V77-V165 HydrophobicContact CG2-CG1 4Å; V77-V165 PolarHBondContact N-O 3.25Å; V77-V165 PolarHBondContact O-N 3.18Å; V77-V165 VanDerWaalsContact O-N 3.16Å; L82-V165 HydrophobicContact CB-CG1 4.32Å; L82-V165 HydrophobicContact CB-CG2 3.95Å; L82-V165 HydrophobicContact CD1-CG1 3.99Å; W83-V165 HydrophobicContact CE3-CG2 4.18Å; V165-L167 HydrophobicContact CG1-CD2 3.93Å; V165-V206 HydrophobicContact CG1-CG1 3.55Å; V165-Y207 WeakPolarHBondContact CA-O 3.49Å; V165-F208 HydrophobicContact CG2-CD1 3.93Å; V165-F208 HydrophobicContact CG2-CE1 4.06Å
166	V	98.3	Very high	97.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	115	170.7	-178.7	0	0	0	0	108.5	A74 Q75 L76 Y207 L209 L223 Y234	A74-V166 HydrophobicContact CB-CG1 3.73Å; Q75-V166 WeakPolarHBondContact O-CA 3.45Å; L76-V166 HydrophobicContact CD1-CG2 4.07Å; V166-Y207 PolarHBondContact N-O 3.4Å; V166-Y207 PolarHBondContact O-N 2.87Å; V166-L209 HydrophobicContact CG2-CD2 4.05Å; V166-L209 HydrophobicContact CG2-CG 4.39Å; V166-L223 HydrophobicContact CG1-CD2 4.34Å; V166-L223 HydrophobicContact CG2-CD1 4.04Å; V166-Y234 HydrophobicContact CB-CD2 4.38Å; V166-Y234 HydrophobicContact CB-CG 4.22Å; V166-Y234 HydrophobicContact CG1-CD1 3.86Å; V166-Y234 HydrophobicContact CG1-CD2 4.09Å; V166-Y234 HydrophobicContact CG1-CE1 3.97Å; V166-Y234 HydrophobicContact CG1-CE2 4.22Å; V166-Y234 HydrophobicContact CG1-CG 3.9Å; V166-Y234 HydrophobicContact CG2-CG 4.25Å
167	L	98.8	Very high	97.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.3	170.2	-53.3	-178.4	0	0	0	108.1	A74 Q75 V77 L82 L118 F126 V165 W169 V206	A74-L167 CarbonylContact C-O 3.47Å; A74-L167 VanDerWaalsContact CA-O 3.29Å; A74-L167 WeakPolarHBondContact CA-O 3.31Å; Q75-L167 PolarHBondContact N-O 3.46Å; Q75-L167 PolarHBondContact O-N 2.67Å; V77-L167 HydrophobicContact CG1-CD1 3.79Å; V77-L167 HydrophobicContact CG1-CG 4.05Å; V77-L167 HydrophobicContact CG2-CD1 4.24Å; V77-L167 HydrophobicContact CG2-CD2 4.38Å; V77-L167 HydrophobicContact CG2-CG 4.01Å; L82-L167 HydrophobicContact CD1-CD2 3.71Å; L118-L167 HydrophobicContact CD1-CD1 4.44Å; L118-L167 HydrophobicContact CD1-CD2 3.91Å; L118-L167 HydrophobicContact CD2-CB 4.05Å; L118-L167 HydrophobicContact CD2-CD1 4.23Å; L118-L167 HydrophobicContact CD2-CD2 4.16Å; L118-L167 HydrophobicContact CD2-CG 4.37Å; F126-L167 HydrophobicContact CD2-CD1 4.33Å; F126-L167 HydrophobicContact CE2-CD1 4.09Å; F126-L167 HydrophobicContact CZ-CD1 4.21Å; V165-L167 HydrophobicContact CG1-CD2 3.93Å; L167-W169 HydrophobicContact CB-CZ3 4.13Å; L167-V206 HydrophobicContact CD2-CG2 4Å
168	S	98.7	Very high	97.5	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.028	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.7	-173.7	-177.3	0	0	0	0	111.2	Y73 S205 Y234	Y73-S168 VanDerWaalsContact O-CA 3.24Å; Y73-S168 WeakPolarHBondContact O-CA 3.37Å; Y73-S168 PolarHBondContact O-OG 3.3Å; S168-S205 PolarHBondContact N-O 2.95Å; S168-S205 PolarHBondContact O-N 2.87Å; S168-Y234 PolarHBondContact OG-OH 3.25Å
169	W	98.8	Very high	97.5	Very high	6 Å²	6	26.5 Å²	26.5	2%	0.023	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	176.4	174.3	61.1	87.2	0	0	0	109.1	Y73 L132 L167 M184 P186 T189 Q204	Y73-W169 PolarHBondContact N-O 2.72Å; Y73-W169 PolarHBondContact O-N 3.33Å; Y73-W169 VanDerWaalsContact O-N 3.15Å; L132-W169 HydrophobicContact CD1-CH2 3.52Å; L132-W169 HydrophobicContact CD1-CZ2 3.29Å; L132-W169 HydrophobicContact CD1-CZ3 4.45Å; L132-W169 HydrophobicContact CD2-CZ2 3.93Å; L132-W169 HydrophobicContact CG-CZ2 4.26Å; L167-W169 HydrophobicContact CB-CZ3 4.13Å; W169-M184 HydrophobicContact CB-CB 4.02Å; W169-P186 HydrophobicContact CE3-CG 4.44Å; W169-P186 HydrophobicContact CH2-CG 4.39Å; W169-P186 HydrophobicContact CZ3-CG 4.23Å; W169-T189 HydrophobicContact CZ2-CG2 4.39Å; W169-Q204 HydrophobicContact CB-CG 4.06Å
170	W	98.8	Very high	97.6	Very high	3 Å²	3	30.2 Å²	30.2	1%	0.011	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	159.5	-178.5	50.4	-99.6	0	0	0	112.6	F38 D39 T40 L42 T71 V72 L172 M184 W202	F38-W170 HydrophobicContact CB-CH2 4.08Å; F38-W170 HydrophobicContact CB-CZ2 4.02Å; D39-W170 WeakPolarHBondContact O-CZ2 3.41Å; D39-W170 PolarHBondContact O-NE1 2.85Å; T40-W170 PolarHBondContact O-NE1 3.34Å; T40-W170 VanDerWaalsContact O-NE1 3.14Å; L42-W170 HydrophobicContact CB-CD2 4.34Å; L42-W170 HydrophobicContact CB-CG 3.9Å; L42-W170 HydrophobicContact CD1-CD2 3.9Å; L42-W170 HydrophobicContact CD1-CE3 4.2Å; L42-W170 HydrophobicContact CD1-CG 4.11Å; L42-W170 HydrophobicContact CG-CG 4.47Å; T71-W170 CarbonylContact O-C 3.58Å; T71-W170 WeakPolarHBondContact O-CA 3.37Å; T71-W170 WeakPolarHBondContact O-CB 3.49Å; V72-W170 HydrophobicContact CG2-CB 4.15Å; W170-L172 HydrophobicContact CE3-CD1 4.39Å; W170-L172 HydrophobicContact CE3-CD2 4.3Å; W170-L172 HydrophobicContact CE3-CG 3.84Å; W170-L172 HydrophobicContact CH2-CD1 4.16Å; W170-L172 HydrophobicContact CH2-CG 4.49Å; W170-L172 HydrophobicContact CZ3-CD1 3.57Å; W170-L172 HydrophobicContact CZ3-CD2 4.27Å; W170-L172 HydrophobicContact CZ3-CG 3.5Å; W170-L172 VanDerWaalsContact CZ3-CG 3.5Å; W170-M184 HydrophobicContact CD2-CG 3.84Å; W170-M184 HydrophobicContact CE3-CG 3.8Å; W170-M184 HydrophobicContact CH2-CG 3.85Å; W170-M184 HydrophobicContact CH2-SD 4.35Å; W170-M184 HydrophobicContact CZ2-CG 3.87Å; W170-M184 HydrophobicContact CZ3-CG 3.77Å; W170-M184 VanDerWaalsContact O-CB 3.22Å; W170-M184 WeakPolarHBondContact O-CB 3.43Å; W170-M184 WeakPolarHBondContact O-CG 3.35Å; W170-M184 PolarHBondContact O-N 3.32Å; W170-W202 AromaticContact CH2-CD2 3.53Å; W170-W202 HydrophobicContact CH2-CD2 3.53Å; W170-W202 AromaticContact CH2-CE2 3.7Å; W170-W202 AromaticContact CH2-CE3 3.63Å; W170-W202 HydrophobicContact CH2-CE3 3.63Å; W170-W202 HydrophobicContact CH2-CG 4.01Å; W170-W202 HydrophobicContact CH2-CH2 4.11Å; W170-W202 AromaticContact CH2-CZ2 3.94Å; W170-W202 HydrophobicContact CH2-CZ2 3.94Å; W170-W202 AromaticContact CH2-CZ3 3.97Å; W170-W202 HydrophobicContact CH2-CZ3 3.97Å; W170-W202 HydrophobicContact CZ2-CB 4.36Å; W170-W202 AromaticContact CZ2-CD2 3.9Å; W170-W202 HydrophobicContact CZ2-CD2 3.9Å; W170-W202 HydrophobicContact CZ2-CE3 4.39Å; W170-W202 AromaticContact CZ2-CG 3.87Å; W170-W202 HydrophobicContact CZ2-CG 3.87Å; W170-W202 HydrophobicContact CZ3-CE3 4.42Å
171	D	98.5	Very high	97.6	Very high	24 Å²	24	31.4 Å²	31.4	13%	0.128	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.3	171.5	-63.3	-11	0	0	0	110.2	A70 T71 Y73 V181 C182 S183	A70-D171 CarbonylContact C-O 3.59Å; A70-D171 VanDerWaalsContact CA-O 3.26Å; A70-D171 WeakPolarHBondContact CA-O 3.26Å; T71-D171 PolarHBondContact N-O 3.03Å; T71-D171 PolarHBondContact O-N 3.22Å; Y73-D171 HydrophobicContact CE2-CB 3.89Å; Y73-D171 VanDerWaalsContact CE2-CG 3.48Å; Y73-D171 VanDerWaalsContact CE2-OD2 3.3Å; Y73-D171 WeakPolarHBondContact CE2-OD2 3.38Å; Y73-D171 PolarHBondContact OH-OD2 3.45Å; D171-V181 HydrophobicContact CB-CG1 3.99Å; D171-C182 WeakPolarHBondContact CA-O 3.47Å; D171-S183 WeakPolarHBondContact OD1-CA 3.38Å; D171-S183 WeakPolarHBondContact OD1-CB 3.22Å; D171-S183 PolarHBondContact OD1-OG 3.02Å
172	L	98.7	Very high	97.7	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.2	171.3	-65.2	175.6	0	0	0	110.5	F38 L42 P67 R69 A70 F140 W170 M174 V181 C182 W202	F38-L172 HydrophobicContact CD2-CD1 3.83Å; F38-L172 HydrophobicContact CE2-CD1 3.94Å; F38-L172 HydrophobicContact CE2-CD2 4.46Å; F38-L172 HydrophobicContact CG-CD1 4.49Å; F38-L172 HydrophobicContact CZ-CD2 4.41Å; L42-L172 HydrophobicContact CD1-CD2 4.14Å; P67-L172 HydrophobicContact CB-CB 3.98Å; P67-L172 HydrophobicContact CB-CD1 4.28Å; P67-L172 HydrophobicContact CB-CD2 3.96Å; P67-L172 HydrophobicContact CB-CG 4.27Å; P67-L172 HydrophobicContact CG-CD1 4.1Å; P67-L172 HydrophobicContact CG-CD2 3.8Å; P67-L172 HydrophobicContact CG-CG 4.37Å; R69-L172 CarbonylContact O-C 3.49Å; R69-L172 WeakPolarHBondContact O-CA 3.37Å; A70-L172 HydrophobicContact CB-CD2 3.62Å; F140-L172 HydrophobicContact CE2-CD2 4.22Å; W170-L172 HydrophobicContact CE3-CD1 4.39Å; W170-L172 HydrophobicContact CE3-CD2 4.3Å; W170-L172 HydrophobicContact CE3-CG 3.84Å; W170-L172 HydrophobicContact CH2-CD1 4.16Å; W170-L172 HydrophobicContact CH2-CG 4.49Å; W170-L172 HydrophobicContact CZ3-CD1 3.57Å; W170-L172 HydrophobicContact CZ3-CD2 4.27Å; W170-L172 HydrophobicContact CZ3-CG 3.5Å; W170-L172 VanDerWaalsContact CZ3-CG 3.5Å; L172-M174 HydrophobicContact CB-CE 4.08Å; L172-M174 HydrophobicContact CD1-CE 4.15Å; L172-M174 PolarHBondContact O-N 3.23Å; L172-V181 CarbonylContact O-C 3.58Å; L172-V181 VanDerWaalsContact O-CA 3.29Å; L172-V181 WeakPolarHBondContact O-CA 3.27Å; L172-C182 HydrophobicContact CB-CB 4.42Å; L172-C182 PolarHBondContact N-O 3.03Å; L172-C182 PolarHBondContact O-N 3.02Å; L172-W202 HydrophobicContact CD1-CH2 4.49Å
173	D	98.6	Very high	97.7	Very high	25 Å²	25	31 Å²	31	13%	0.134	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	111	163.5	-63.3	-26.6	0	0	0	107.6	H68 R69 D175	H68-D173 WeakPolarHBondContact CB-O 3.44Å; H68-D173 PolarHBondContact N-O 3.34Å; R69-D173 HydrophobicContact CB-CB 4.28Å; R69-D173 IonicContact CZ-OD2 2.64Å; R69-D173 PolarHBondContact N-O 3.19Å; R69-D173 IonicContact NE-OD2 3.43Å; R69-D173 PolarHBondContact NE-OD2 2.89Å; R69-D173 IonicContact NH2-OD2 2.71Å; R69-D173 PolarHBondContact NH2-OD2 2.94Å; R69-D173 PolarHBondContact O-N 3.34Å; D173-D175 VanDerWaalsContact C-N 3.26Å; D173-D175 PolarHBondContact O-N 3.13Å
174	M	98.3	Very high	97.8	Very high	46 Å²	46	31.2 Å²	31.2	23%	0.227	20%	0.199	C	C	.	.	S	Bend	trans	-76.1	-17.1	-177.2	-64.4	-63.6	-179.1	0	0	112.9	V66 P67 L172 I180 C182	V66-M174 HydrophobicContact CG1-SD 4.31Å; P67-M174 HydrophobicContact CB-SD 3.98Å; L172-M174 HydrophobicContact CB-CE 4.08Å; L172-M174 HydrophobicContact CD1-CE 4.15Å; L172-M174 PolarHBondContact O-N 3.23Å; M174-I180 HydrophobicContact CB-CB 4.01Å; M174-I180 HydrophobicContact CB-CG2 3.81Å; M174-I180 WeakPolarHBondContact CB-O 3.49Å; M174-I180 HydrophobicContact CG-CG2 3.97Å; M174-I180 PolarHBondContact N-O 3.01Å; M174-C182 HydrophobicContact CE-CB 3.69Å; M174-C182 WeakPolarHBondContact CE-SG 3.04Å
175	D	97.5	Very high	97.9	Very high	32 Å²	32	31.9 Å²	31.9	17%	0.171	21%	0.205	C	C	.	.	S	Bend	trans	-137.3	159	-177.7	78.6	-72.7	0	0	0	111.8	D173 S177 G178 A179 I180	D173-D175 VanDerWaalsContact C-N 3.26Å; D173-D175 PolarHBondContact O-N 3.13Å; D175-S177 PolarHBondContact O-N 3.14Å; D175-S177 VanDerWaalsContact O-N 3.09Å; D175-S177 VanDerWaalsContact OD2-CB 3.31Å; D175-S177 WeakPolarHBondContact OD2-CB 3.37Å; D175-S177 PolarHBondContact OD2-N 3.16Å; D175-S177 PolarHBondContact OD2-OG 3.36Å; D175-G178 PolarHBondContact O-N 3.12Å; D175-A179 PolarHBondContact OD1-N 2.87Å; D175-I180 PolarHBondContact OD1-N 3.37Å
176	P	96.9	Very high	97.9	Very high	76 Å²	76	31.9 Å²	31.9	49%	0.494	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-27.8	-177.3	-27	35	0	0	0	115
177	S	96.8	Very high	97.8	Very high	92 Å²	92	33 Å²	33	64%	0.643	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-14	-179.6	79.3	0	0	0	0	113.6	D175 A179	D175-S177 PolarHBondContact O-N 3.14Å; D175-S177 VanDerWaalsContact O-N 3.09Å; D175-S177 VanDerWaalsContact OD2-CB 3.31Å; D175-S177 WeakPolarHBondContact OD2-CB 3.37Å; D175-S177 PolarHBondContact OD2-N 3.16Å; D175-S177 PolarHBondContact OD2-OG 3.36Å; S177-A179 VanDerWaalsContact C-N 3.26Å; S177-A179 VanDerWaalsContact OG-CB 3.31Å; S177-A179 WeakPolarHBondContact OG-CB 3.4Å; S177-A179 PolarHBondContact OG-N 3.45Å
178	G	94.8	Very high	97.7	Very high	24 Å²	24	35.8 Å²	35.8	25%	0.247	22%	0.223	C	C	.	.	S	Bend	trans	68.1	25	-173.7	0	0	0	0	0	113.1	D175 V181	D175-G178 PolarHBondContact O-N 3.12Å; G178-V181 WeakPolarHBondContact O-CG2 3.28Å
179	A	97.1	Very high	97.5	Very high	81 Å²	81	38.6 Å²	38.6	67%	0.669	24%	0.241	S	C	*	.			trans	-79.3	-25.8	179.1	0	0	0	0	0	112	D175 S177	D175-A179 PolarHBondContact OD1-N 2.87Å; S177-A179 VanDerWaalsContact C-N 3.26Å; S177-A179 VanDerWaalsContact OG-CB 3.31Å; S177-A179 WeakPolarHBondContact OG-CB 3.4Å; S177-A179 PolarHBondContact OG-N 3.45Å
180	I	97.9	Very high	97.2	Very high	104 Å²	104	41.2 Å²	41.2	53%	0.533	25%	0.251	S	S	.	.	S	Bend	trans	-114.1	109.8	178.9	-55.5	171.6	0	0	0	108.1	M174 D175	M174-I180 HydrophobicContact CB-CB 4.01Å; M174-I180 HydrophobicContact CB-CG2 3.81Å; M174-I180 WeakPolarHBondContact CB-O 3.49Å; M174-I180 HydrophobicContact CG-CG2 3.97Å; M174-I180 PolarHBondContact N-O 3.01Å; D175-I180 PolarHBondContact OD1-N 3.37Å
181	V	97.6	Very high	97	Very high	69 Å²	69	47.4 Å²	47.4	42%	0.418	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.5	-175	-177.2	0	0	0	0	111	D171 L172 G178	D171-V181 HydrophobicContact CB-CG1 3.99Å; L172-V181 CarbonylContact O-C 3.58Å; L172-V181 VanDerWaalsContact O-CA 3.29Å; L172-V181 WeakPolarHBondContact O-CA 3.27Å; G178-V181 WeakPolarHBondContact O-CG2 3.28Å
182	C	97.8	Very high	96.7	Very high	41 Å²	41	51.5 Å²	51.5	28%	0.277	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.7	162.9	-72.6	0	0	0	0	109.2	D171 L172 M174	D171-C182 WeakPolarHBondContact CA-O 3.47Å; L172-C182 HydrophobicContact CB-CB 4.42Å; L172-C182 PolarHBondContact N-O 3.03Å; L172-C182 PolarHBondContact O-N 3.02Å; M174-C182 HydrophobicContact CE-CB 3.69Å; M174-C182 WeakPolarHBondContact CE-SG 3.04Å
183	S	97.5	Very high	96.4	Very high	21 Å²	21	54.6 Å²	54.6	15%	0.147	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.5	-176.7	178.6	0	0	0	0	112.7	D171 A185 R199	D171-S183 WeakPolarHBondContact OD1-CA 3.38Å; D171-S183 WeakPolarHBondContact OD1-CB 3.22Å; D171-S183 PolarHBondContact OD1-OG 3.02Å; S183-A185 VanDerWaalsContact C-N 3.3Å; S183-A185 VanDerWaalsContact OG-CB 3.26Å; S183-A185 WeakPolarHBondContact OG-CB 3.33Å; S183-A185 PolarHBondContact OG-N 3.3Å; S183-A185 VanDerWaalsContact OG-N 3.09Å; S183-R199 PolarHBondContact O-NH2 3.06Å
184	M	98.3	Very high	95.9	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.025	37%	0.365	C	S	.	.			trans	-91.3	12	170.2	-62.9	-50.6	-52.7	0	0	113.2	W169 W170 R199 W202 M203 Q204	W169-M184 HydrophobicContact CB-CB 4.02Å; W170-M184 HydrophobicContact CD2-CG 3.84Å; W170-M184 HydrophobicContact CE3-CG 3.8Å; W170-M184 HydrophobicContact CH2-CG 3.85Å; W170-M184 HydrophobicContact CH2-SD 4.35Å; W170-M184 HydrophobicContact CZ2-CG 3.87Å; W170-M184 HydrophobicContact CZ3-CG 3.77Å; W170-M184 VanDerWaalsContact O-CB 3.22Å; W170-M184 WeakPolarHBondContact O-CB 3.43Å; W170-M184 WeakPolarHBondContact O-CG 3.35Å; W170-M184 PolarHBondContact O-N 3.32Å; M184-R199 HydrophobicContact CE-CG 4.17Å; M184-R199 PolarHBondContact SD-NE 3.26Å; M184-R199 PolarHBondContact SD-NH2 3.11Å; M184-W202 HydrophobicContact CE-CB 3.37Å; M184-W202 WeakPolarHBondContact CE-O 3.47Å; M184-W202 HydrophobicContact CG-CB 4.45Å; M184-W202 HydrophobicContact SD-CB 3.59Å; M184-W202 VanDerWaalsContact SD-CB 3.59Å; M184-W202 HydrophobicContact SD-CD2 4.32Å; M184-W202 HydrophobicContact SD-CE3 3.8Å; M184-W202 HydrophobicContact SD-CG 4.3Å; M184-M203 VanDerWaalsContact CE-O 3.31Å; M184-M203 WeakPolarHBondContact CE-O 3.42Å; M184-Q204 VanDerWaalsContact O-CG 3.28Å; M184-Q204 WeakPolarHBondContact O-CG 3.36Å; M184-Q204 PolarHBondContact O-NE2 2.89Å
185	A	97.8	Very high	95.5	Very high	15 Å²	15	63.4 Å²	63.4	12%	0.124	39%	0.385	C	S	.	.			trans	-58.6	139.3	177.8	0	0	0	0	0	111.1	S183 T189 Y190	S183-A185 VanDerWaalsContact C-N 3.3Å; S183-A185 VanDerWaalsContact OG-CB 3.26Å; S183-A185 WeakPolarHBondContact OG-CB 3.33Å; S183-A185 PolarHBondContact OG-N 3.3Å; S183-A185 VanDerWaalsContact OG-N 3.09Å; A185-T189 HydrophobicContact CB-CG2 4.26Å; A185-T189 VanDerWaalsContact CB-OG1 3.27Å; A185-T189 WeakPolarHBondContact CB-OG1 3.18Å; A185-Y190 HydrophobicContact CB-CE2 4.43Å; A185-Y190 WeakPolarHBondContact O-CE2 3.48Å
186	P	97.6	Very high	95.3	Very high	0 Å²	0	63 Å²	63	0%	0	39%	0.386	C	S	.	.			trans	-67.7	156.9	-179.2	26.4	-33.1	0	0	0	111.6	L118 W169 W188 T189	L118-P186 HydrophobicContact CB-CB 4.45Å; L118-P186 HydrophobicContact CD2-CB 4.48Å; L118-P186 HydrophobicContact CD2-CG 4.22Å; L118-P186 HydrophobicContact CG-CB 4.36Å; W169-P186 HydrophobicContact CE3-CG 4.44Å; W169-P186 HydrophobicContact CH2-CG 4.39Å; W169-P186 HydrophobicContact CZ3-CG 4.23Å; P186-W188 VanDerWaalsContact C-N 3.27Å; P186-W188 HydrophobicContact CB-CD2 3.91Å; P186-W188 HydrophobicContact CB-CE3 4.09Å; P186-W188 HydrophobicContact CB-CH2 3.92Å; P186-W188 HydrophobicContact CB-CZ2 3.57Å; P186-W188 HydrophobicContact CB-CZ3 4.13Å; P186-W188 HydrophobicContact CG-CD2 4.11Å; P186-W188 HydrophobicContact CG-CH2 4.32Å; P186-W188 HydrophobicContact CG-CZ2 3.48Å; P186-W188 VanDerWaalsContact CG-CZ2 3.48Å; P186-W188 PolarHBondContact O-N 3.33Å; P186-W188 VanDerWaalsContact O-N 3.08Å; P186-T189 HydrophobicContact CG-CG2 3.94Å; P186-T189 WeakPolarHBondContact O-CB 3.27Å; P186-T189 WeakPolarHBondContact O-CG2 3.4Å; P186-T189 PolarHBondContact O-N 2.78Å; P186-T189 PolarHBondContact O-OG1 3.27Å
187	S	97.2	Very high	95.3	Very high	23 Å²	23	63.4 Å²	63.4	16%	0.161	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-55	-34.6	-168.1	66.5	0	0	0	0	114.7	S119 T189 Y190 P193	S119-S187 PolarHBondContact OG-N 3.09Å; S187-T189 PolarHBondContact O-N 3.37Å; S187-Y190 WeakPolarHBondContact O-CB 3.38Å; S187-Y190 PolarHBondContact O-N 3.16Å; S187-Y190 VanDerWaalsContact O-N 3.08Å; S187-P193 WeakPolarHBondContact O-CA 3.23Å; S187-P193 WeakPolarHBondContact O-CB 3.31Å
188	W	95.6	Very high	95.3	Very high	59 Å²	59	61.7 Å²	61.7	22%	0.223	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-69.7	-8.3	178.7	57.9	79.9	0	0	0	114.7	L118 V121 P123 F126 P186 Y190	L118-W188 VanDerWaalsContact C-CZ3 3.45Å; L118-W188 HydrophobicContact CB-CH2 4.31Å; L118-W188 HydrophobicContact CD1-CH2 3.94Å; L118-W188 HydrophobicContact CD1-CZ2 4.28Å; L118-W188 HydrophobicContact CD2-CH2 4.46Å; L118-W188 HydrophobicContact CD2-CZ2 4.16Å; L118-W188 HydrophobicContact CG-CH2 3.52Å; L118-W188 HydrophobicContact CG-CZ2 3.7Å; L118-W188 WeakPolarHBondContact O-CH2 3.16Å; L118-W188 WeakPolarHBondContact O-CZ3 3.36Å; V121-W188 HydrophobicContact CB-CH2 4.35Å; V121-W188 VanDerWaalsContact O-CH2 3.32Å; V121-W188 WeakPolarHBondContact O-CH2 3.4Å; V121-W188 WeakPolarHBondContact O-CZ3 3.48Å; P123-W188 HydrophobicContact CG-CB 3.91Å; P123-W188 HydrophobicContact CG-CD2 4.01Å; P123-W188 HydrophobicContact CG-CE3 4.13Å; P123-W188 HydrophobicContact CG-CG 3.92Å; F126-W188 HydrophobicContact CE1-CH2 4.2Å; F126-W188 HydrophobicContact CE1-CZ2 4.1Å; F126-W188 HydrophobicContact CZ-CH2 4.33Å; F126-W188 AromaticContact CZ-CZ2 3.78Å; F126-W188 HydrophobicContact CZ-CZ2 3.78Å; P186-W188 VanDerWaalsContact C-N 3.27Å; P186-W188 HydrophobicContact CB-CD2 3.91Å; P186-W188 HydrophobicContact CB-CE3 4.09Å; P186-W188 HydrophobicContact CB-CH2 3.92Å; P186-W188 HydrophobicContact CB-CZ2 3.57Å; P186-W188 HydrophobicContact CB-CZ3 4.13Å; P186-W188 HydrophobicContact CG-CD2 4.11Å; P186-W188 HydrophobicContact CG-CH2 4.32Å; P186-W188 HydrophobicContact CG-CZ2 3.48Å; P186-W188 VanDerWaalsContact CG-CZ2 3.48Å; P186-W188 PolarHBondContact O-N 3.33Å; P186-W188 VanDerWaalsContact O-N 3.08Å; W188-Y190 VanDerWaalsContact C-N 3.31Å
189	T	94.8	Very high	95.4	Very high	64 Å²	64	62.5 Å²	62.5	39%	0.393	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-80.3	-17.1	171.9	65.8	0	0	0	0	112.1	W169 A185 P186 S187	W169-T189 HydrophobicContact CZ2-CG2 4.39Å; A185-T189 HydrophobicContact CB-CG2 4.26Å; A185-T189 VanDerWaalsContact CB-OG1 3.27Å; A185-T189 WeakPolarHBondContact CB-OG1 3.18Å; P186-T189 HydrophobicContact CG-CG2 3.94Å; P186-T189 WeakPolarHBondContact O-CB 3.27Å; P186-T189 WeakPolarHBondContact O-CG2 3.4Å; P186-T189 PolarHBondContact O-N 2.78Å; P186-T189 PolarHBondContact O-OG1 3.27Å; S187-T189 PolarHBondContact O-N 3.37Å
190	Y	94.1	Very high	95.5	Very high	61 Å²	61	60.4 Å²	60.4	24%	0.239	34%	0.342	C	S	.	.	S	Bend	trans	-83.7	145.8	-179.7	-69.3	-103.5	0	0	0	111.1	A185 S187 W188 Q192 A196	A185-Y190 HydrophobicContact CB-CE2 4.43Å; A185-Y190 WeakPolarHBondContact O-CE2 3.48Å; S187-Y190 WeakPolarHBondContact O-CB 3.38Å; S187-Y190 PolarHBondContact O-N 3.16Å; S187-Y190 VanDerWaalsContact O-N 3.08Å; W188-Y190 VanDerWaalsContact C-N 3.31Å; Y190-Q192 PolarHBondContact O-N 3.1Å; Y190-Q192 VanDerWaalsContact O-N 3.15Å; Y190-A196 HydrophobicContact CD2-CB 3.72Å; Y190-A196 HydrophobicContact CE2-CB 3.93Å; Y190-A196 HydrophobicContact CG-CB 4.06Å
191	P	93.1	Very high	95.4	Very high	133 Å²	133	61.2 Å²	61.2	86%	0.864	34%	0.343	S	S	*	.	S	Bend	trans	-57.9	-28.7	172.7	-24.9	33.9	0	0	0	113.5
192	Q	92.4	Very high	95.4	Very high	109 Å²	109	58.8 Å²	58.8	51%	0.509	33%	0.326	S	S	.	.	S	Bend	trans	-128.8	91.4	174.8	-66.1	-178.5	8.1	0	0	108.3	Y190 A194 K195	Y190-Q192 PolarHBondContact O-N 3.1Å; Y190-Q192 VanDerWaalsContact O-N 3.15Å; Q192-A194 PolarHBondContact O-N 3.18Å; Q192-A194 VanDerWaalsContact O-N 3.14Å; Q192-K195 HydrophobicContact CB-CB 4.31Å; Q192-K195 HydrophobicContact CB-CD 4.28Å; Q192-K195 HydrophobicContact CB-CG 4.22Å; Q192-K195 PolarHBondContact O-N 3.1Å
193	P	91.8	Very high	95.4	Very high	66 Å²	66	57.4 Å²	57.4	43%	0.429	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-55.1	-34.7	-175.1	-29.9	36.8	0	0	0	114.1	S187 K195 A196	S187-P193 WeakPolarHBondContact O-CA 3.23Å; S187-P193 WeakPolarHBondContact O-CB 3.31Å; P193-K195 PolarHBondContact O-N 2.89Å; P193-K195 VanDerWaalsContact O-N 3.13Å; P193-A196 VanDerWaalsContact O-CB 3.26Å; P193-A196 WeakPolarHBondContact O-CB 3.35Å; P193-A196 PolarHBondContact O-N 2.78Å
194	A	88.7	Confident	95.5	Very high	105 Å²	105	56.8 Å²	56.8	87%	0.868	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-65.8	-11.1	176.7	0	0	0	0	0	114.6	Q192	Q192-A194 PolarHBondContact O-N 3.18Å; Q192-A194 VanDerWaalsContact O-N 3.14Å
195	K	89.8	Confident	95.5	Very high	152 Å²	152	56.6 Å²	56.6	66%	0.661	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-103.4	1.9	175	-66.3	-169.6	178.4	166	0	113.1	Q192 P193	Q192-K195 HydrophobicContact CB-CB 4.31Å; Q192-K195 HydrophobicContact CB-CD 4.28Å; Q192-K195 HydrophobicContact CB-CG 4.22Å; Q192-K195 PolarHBondContact O-N 3.1Å; P193-K195 PolarHBondContact O-N 2.89Å; P193-K195 VanDerWaalsContact O-N 3.13Å
196	A	94.3	Very high	95.5	Very high	23 Å²	23	56 Å²	56	19%	0.19	30%	0.304	C	S	.	.	S	Bend	trans	-61	132.6	174.9	0	0	0	0	0	109.4	Y190 P193 W198	Y190-A196 HydrophobicContact CD2-CB 3.72Å; Y190-A196 HydrophobicContact CE2-CB 3.93Å; Y190-A196 HydrophobicContact CG-CB 4.06Å; P193-A196 VanDerWaalsContact O-CB 3.26Å; P193-A196 WeakPolarHBondContact O-CB 3.35Å; P193-A196 PolarHBondContact O-N 2.78Å; A196-W198 PolarHBondContact O-N 3.22Å
197	P	95.7	Very high	95.5	Very high	85 Å²	85	56.7 Å²	56.7	55%	0.552	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-62.1	131	175.7	-18.5	30.3	0	0	0	110.4
198	W	97.5	Very high	95.4	Very high	56 Å²	56	56.8 Å²	56.8	21%	0.212	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-100.5	143.2	174.9	-176.5	94.2	0	0	0	111.3	A196 D200 D415 R418 I419 Y458	A196-W198 PolarHBondContact O-N 3.22Å; W198-D200 HydrophobicContact CH2-CB 3.7Å; W198-D200 HydrophobicContact CZ2-CB 4Å; W198-D200 HydrophobicContact CZ3-CB 4.38Å; W198-D415 HydrophobicContact CB-CB 4.24Å; W198-D415 HydrophobicContact CD2-CB 3.21Å; W198-D415 VanDerWaalsContact CE2-CB 3.47Å; W198-D415 HydrophobicContact CE3-CB 3.5Å; W198-D415 VanDerWaalsContact CE3-CB 3.5Å; W198-D415 HydrophobicContact CG-CB 3.56Å; W198-D415 HydrophobicContact CH2-CB 4.15Å; W198-D415 WeakPolarHBondContact CH2-O 3.12Å; W198-D415 HydrophobicContact CZ2-CB 3.94Å; W198-D415 HydrophobicContact CZ3-CB 3.96Å; W198-D415 WeakPolarHBondContact CZ3-O 3.36Å; W198-R418 HydrophobicContact CZ3-CB 4.18Å; W198-I419 HydrophobicContact CH2-CG2 4.01Å; W198-Y458 HydrophobicContact CZ2-CD1 4.03Å; W198-Y458 AromaticContact CZ2-CE1 3.98Å; W198-Y458 HydrophobicContact CZ2-CE1 3.98Å
199	R	97.4	Very high	95.3	Very high	40 Å²	40	54.2 Å²	54.2	15%	0.151	30%	0.295	C	S	.	.			trans	-161	163.2	173	56.2	-166.1	138.5	-175.3	0.2	109.5	Q117 S183 M184 W202	Q117-R199 PolarHBondContact NE2-O 3.44Å; S183-R199 PolarHBondContact O-NH2 3.06Å; M184-R199 HydrophobicContact CE-CG 4.17Å; M184-R199 PolarHBondContact SD-NE 3.26Å; M184-R199 PolarHBondContact SD-NH2 3.11Å; R199-W202 HydrophobicContact CG-CB 4.49Å; R199-W202 WeakPolarHBondContact CG-O 3.33Å
200	D	97.9	Very high	94.7	Very high	38 Å²	38	53.5 Å²	53.5	20%	0.203	29%	0.292	C	S	.	.	S	Bend	trans	-122.3	-23.4	-176.9	-158.4	54.5	0	0	0	113.7	Q117 W198 W202 I419 Y458	Q117-D200 PolarHBondContact NE2-OD1 3.25Å; W198-D200 HydrophobicContact CH2-CB 3.7Å; W198-D200 HydrophobicContact CZ2-CB 4Å; W198-D200 HydrophobicContact CZ3-CB 4.38Å; D200-W202 PolarHBondContact O-N 2.97Å; D200-I419 HydrophobicContact CB-CG2 3.89Å; D200-Y458 WeakPolarHBondContact OD1-CE1 3.33Å; D200-Y458 PolarHBondContact OD1-OH 2.98Å
201	H	96.8	Very high	94.3	Very high	121 Å²	121	53.3 Å²	53.3	56%	0.56	30%	0.303	S	S	*	.	S	Bend	trans	-67.6	-26.1	173.7	60.7	-91.9	0	0	0	112.2
202	W	98.1	Very high	94.1	Very high	18 Å²	18	51.8 Å²	51.8	7%	0.068	29%	0.285	C	S	.	.	S	Bend	trans	-124.4	136	168.4	-57.8	-33.9	0	0	0	109.6	E36 F38 W170 L172 M184 R199 D200	E36-W202 VanDerWaalsContact CD-CZ2 3.47Å; E36-W202 HydrophobicContact CG-CH2 4.09Å; E36-W202 HydrophobicContact CG-CZ2 3.83Å; E36-W202 WeakPolarHBondContact OE1-CZ2 3.42Å; F38-W202 HydrophobicContact CB-CZ2 4.15Å; F38-W202 HydrophobicContact CD2-CZ2 4.34Å; F38-W202 PolarHBondContact O-NE1 3.08Å; W170-W202 AromaticContact CH2-CD2 3.53Å; W170-W202 HydrophobicContact CH2-CD2 3.53Å; W170-W202 AromaticContact CH2-CE2 3.7Å; W170-W202 AromaticContact CH2-CE3 3.63Å; W170-W202 HydrophobicContact CH2-CE3 3.63Å; W170-W202 HydrophobicContact CH2-CG 4.01Å; W170-W202 HydrophobicContact CH2-CH2 4.11Å; W170-W202 AromaticContact CH2-CZ2 3.94Å; W170-W202 HydrophobicContact CH2-CZ2 3.94Å; W170-W202 AromaticContact CH2-CZ3 3.97Å; W170-W202 HydrophobicContact CH2-CZ3 3.97Å; W170-W202 HydrophobicContact CZ2-CB 4.36Å; W170-W202 AromaticContact CZ2-CD2 3.9Å; W170-W202 HydrophobicContact CZ2-CD2 3.9Å; W170-W202 HydrophobicContact CZ2-CE3 4.39Å; W170-W202 AromaticContact CZ2-CG 3.87Å; W170-W202 HydrophobicContact CZ2-CG 3.87Å; W170-W202 HydrophobicContact CZ3-CE3 4.42Å; L172-W202 HydrophobicContact CD1-CH2 4.49Å; M184-W202 HydrophobicContact CE-CB 3.37Å; M184-W202 WeakPolarHBondContact CE-O 3.47Å; M184-W202 HydrophobicContact CG-CB 4.45Å; M184-W202 HydrophobicContact SD-CB 3.59Å; M184-W202 VanDerWaalsContact SD-CB 3.59Å; M184-W202 HydrophobicContact SD-CD2 4.32Å; M184-W202 HydrophobicContact SD-CE3 3.8Å; M184-W202 HydrophobicContact SD-CG 4.3Å; R199-W202 HydrophobicContact CG-CB 4.49Å; R199-W202 WeakPolarHBondContact CG-O 3.33Å; D200-W202 PolarHBondContact O-N 2.97Å
203	M	97.9	Very high	94.1	Very high	12 Å²	12	49.1 Å²	49.1	6%	0.059	27%	0.27	C	S	.	.			trans	-130.2	-147.3	-179.9	-52.9	171.1	87.2	0	0	109.6	T40 D115 Q117 M184	T40-M203 HydrophobicContact CG2-CB 4.11Å; T40-M203 PolarHBondContact OG1-N 2.78Å; D115-M203 HydrophobicContact CB-SD 4.35Å; Q117-M203 HydrophobicContact CB-CE 4.11Å; Q117-M203 HydrophobicContact CG-CE 3.42Å; Q117-M203 VanDerWaalsContact CG-CE 3.42Å; M184-M203 VanDerWaalsContact CE-O 3.31Å; M184-M203 WeakPolarHBondContact CE-O 3.42Å
204	Q	98.6	Very high	94.4	Very high	8 Å²	8	52 Å²	52	4%	0.037	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160	170.4	-64	77.9	61.5	0	0	109.6	V116 L118 W169 M184	V116-Q204 PolarHBondContact N-O 3.42Å; V116-Q204 VanDerWaalsContact N-O 3.08Å; V116-Q204 PolarHBondContact O-N 3.4Å; L118-Q204 HydrophobicContact CB-CB 3.51Å; L118-Q204 HydrophobicContact CB-CG 3.9Å; L118-Q204 HydrophobicContact CD2-CB 3.79Å; L118-Q204 HydrophobicContact CD2-CG 4.17Å; L118-Q204 HydrophobicContact CG-CB 4.3Å; L118-Q204 VanDerWaalsContact N-OE1 3.12Å; W169-Q204 HydrophobicContact CB-CG 4.06Å; M184-Q204 VanDerWaalsContact O-CG 3.28Å; M184-Q204 WeakPolarHBondContact O-CG 3.36Å; M184-Q204 PolarHBondContact O-NE2 2.89Å
205	S	98.2	Very high	94.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.007	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	135	-174.9	-57.7	0	0	0	0	111.4	T40 V113 S168	T40-S205 WeakPolarHBondContact CG2-OG 3.47Å; T40-S205 PolarHBondContact O-OG 3.14Å; V113-S205 VanDerWaalsContact CG2-CB 3.5Å; S168-S205 PolarHBondContact N-O 2.95Å; S168-S205 PolarHBondContact O-N 2.87Å
206	V	98.3	Very high	95	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.9	169.8	179.8	0	0	0	0	108.8	L82 C114 V116 L118 V165 L167 F208	L82-V206 HydrophobicContact CD1-CG1 4.33Å; C114-V206 HydrophobicContact CB-CB 4.1Å; C114-V206 WeakPolarHBondContact CB-O 3.28Å; C114-V206 PolarHBondContact N-O 3.29Å; C114-V206 PolarHBondContact O-N 3.36Å; V116-V206 HydrophobicContact CG1-CG2 3.58Å; L118-V206 HydrophobicContact CD1-CG2 4.33Å; V165-V206 HydrophobicContact CG1-CG1 3.55Å; L167-V206 HydrophobicContact CD2-CG2 4Å; V206-F208 HydrophobicContact CG1-CE1 4Å; V206-F208 HydrophobicContact CG1-CE2 4.41Å; V206-F208 HydrophobicContact CG1-CZ 3.81Å
207	Y	97.7	Very high	95.1	Very high	16 Å²	16	47.4 Å²	47.4	6%	0.063	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	149.5	173.1	-61.3	-91.7	0	0	0	110.6	E41 V113 V165 V166 L232 Y234	E41-Y207 VanDerWaalsContact CD-OH 3.32Å; E41-Y207 WeakPolarHBondContact CG-OH 3.2Å; E41-Y207 PolarHBondContact OE1-OH 3.15Å; V113-Y207 HydrophobicContact CB-CE1 4.35Å; V113-Y207 HydrophobicContact CG2-CE1 4.12Å; V113-Y207 HydrophobicContact CG2-CE2 4.32Å; V165-Y207 WeakPolarHBondContact CA-O 3.49Å; V166-Y207 PolarHBondContact N-O 3.4Å; V166-Y207 PolarHBondContact O-N 2.87Å; Y207-L232 HydrophobicContact CE1-CB 4.27Å; Y207-L232 VanDerWaalsContact CE1-O 3.22Å; Y207-L232 WeakPolarHBondContact CE1-O 3.43Å; Y207-Y234 HydrophobicContact CD1-CD2 4.12Å; Y207-Y234 HydrophobicContact CD1-CE2 4.38Å; Y207-Y234 AromaticContact CD2-CD2 3.68Å; Y207-Y234 HydrophobicContact CD2-CD2 3.68Å; Y207-Y234 AromaticContact CD2-CE2 3.41Å; Y207-Y234 HydrophobicContact CD2-CE2 3.41Å; Y207-Y234 VanDerWaalsContact CD2-CE2 3.41Å; Y207-Y234 HydrophobicContact CE2-CD2 4.23Å; Y207-Y234 AromaticContact CE2-CE2 3.59Å; Y207-Y234 HydrophobicContact CE2-CE2 3.59Å; Y207-Y234 AromaticContact CG-CD2 3.61Å; Y207-Y234 HydrophobicContact CG-CD2 3.61Å; Y207-Y234 AromaticContact CG-CE2 3.84Å; Y207-Y234 HydrophobicContact CG-CE2 3.84Å
208	F	95.6	Very high	95.1	Very high	24 Å²	24	52.3 Å²	52.3	11%	0.105	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.6	180	-57.4	-75.7	0	0	0	109.3	L82 W83 W85 A86 C114 V165 V206 R265	L82-F208 WeakPolarHBondContact O-CE1 3.34Å; W83-F208 HydrophobicContact CE3-CD1 4.03Å; W83-F208 HydrophobicContact CZ3-CB 4.1Å; W83-F208 HydrophobicContact CZ3-CD1 4.28Å; W85-F208 HydrophobicContact CB-CZ 4.24Å; A86-F208 HydrophobicContact CB-CB 4.04Å; A86-F208 HydrophobicContact CB-CD1 3.45Å; A86-F208 VanDerWaalsContact CB-CD1 3.45Å; A86-F208 HydrophobicContact CB-CD2 3.82Å; A86-F208 HydrophobicContact CB-CE1 3.81Å; A86-F208 HydrophobicContact CB-CE2 4.13Å; A86-F208 HydrophobicContact CB-CG 3.46Å; A86-F208 VanDerWaalsContact CB-CG 3.46Å; A86-F208 HydrophobicContact CB-CZ 4.13Å; C114-F208 HydrophobicContact CB-CE2 4.11Å; V165-F208 HydrophobicContact CG2-CD1 3.93Å; V165-F208 HydrophobicContact CG2-CE1 4.06Å; V206-F208 HydrophobicContact CG1-CE1 4Å; V206-F208 HydrophobicContact CG1-CE2 4.41Å; V206-F208 HydrophobicContact CG1-CZ 3.81Å; F208-R265 HydrophobicContact CE2-CG 4.41Å
209	L	92.4	Very high	95	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.026	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	146.5	171.9	-68.8	-178.7	0	0	0	109.8	L76 W83 A163 Q164 V166 A211 L236	L76-L209 HydrophobicContact CD1-CD1 3.73Å; L76-L209 HydrophobicContact CD1-CG 4.46Å; W83-L209 WeakPolarHBondContact CH2-O 3.03Å; A163-L209 HydrophobicContact CB-CD1 4.04Å; Q164-L209 PolarHBondContact O-N 2.86Å; V166-L209 HydrophobicContact CG2-CD2 4.05Å; V166-L209 HydrophobicContact CG2-CG 4.39Å; L209-A211 PolarHBondContact O-N 3.47Å; L209-A211 VanDerWaalsContact O-N 3.11Å; L209-L236 HydrophobicContact CD1-CB 3.96Å; L209-L236 HydrophobicContact CD1-CD2 4.01Å; L209-L236 HydrophobicContact CD2-CB 4.19Å
210	P	82.9	Confident	95	Very high	50 Å²	50	55.8 Å²	55.8	33%	0.325	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	-26.7	-177.7	-27.9	35.5	0	0	0	115.1	A108	A108-P210 HydrophobicContact CB-CB 3.81Å; A108-P210 HydrophobicContact CB-CG 4.27Å
211	A	84.6	Confident	94.9	Very high	57 Å²	57	54 Å²	54	47%	0.471	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	146.1	173.3	0	0	0	0	0	108.8	L209	L209-A211 PolarHBondContact O-N 3.47Å; L209-A211 VanDerWaalsContact O-N 3.11Å
212	E	90.4	Very high	94.8	Very high	101 Å²	101	48.3 Å²	48.3	47%	0.472	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	143.8	169.3	72	175.4	115.4	0	0	110.2	W83 R162 A163 Q164	W83-E212 HydrophobicContact CZ2-CB 3.96Å; R162-E212 VanDerWaalsContact CD-OE2 3.28Å; R162-E212 WeakPolarHBondContact CD-OE2 3.07Å; A163-E212 WeakPolarHBondContact O-CA 3.42Å; Q164-E212 HydrophobicContact CG-CB 4.25Å
213	R	92.5	Very high	94.7	Very high	53 Å²	53	47.4 Å²	47.4	20%	0.2	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	133.8	175.8	173.5	175.5	166	-157.4	-2.8	110.5	A163 E219 Q237 P238	A163-R213 HydrophobicContact CB-CB 4.42Å; A163-R213 WeakPolarHBondContact CB-O 3.48Å; A163-R213 PolarHBondContact N-O 3.33Å; A163-R213 PolarHBondContact O-N 2.96Å; A163-R213 VanDerWaalsContact O-N 3.08Å; R213-E219 IonicContact CZ-OE1 2.92Å; R213-E219 IonicContact NH2-OE1 2.98Å; R213-E219 PolarHBondContact NH2-OE1 3.33Å; R213-Q237 VanDerWaalsContact NH1-C 3.29Å; R213-P238 VanDerWaalsContact NH1-CD 3.35Å; R213-P238 VanDerWaalsContact NH1-N 3.15Å
214	Q	96.6	Very high	94.6	Very high	127 Å²	127	47.1 Å²	47.1	59%	0.593	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	131.7	169.2	-66.4	-65.5	-8.3	0	0	110.1	G161	G161-Q214 PolarHBondContact O-OE1 3.02Å
215	V	96.3	Very high	94.5	Very high	7 Å²	7	46.8 Å²	46.8	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.8	178.8	170.3	0	0	0	0	108.5	A157 G160 G161 A163 E219 L221	A157-V215 HydrophobicContact CB-CG1 3.49Å; A157-V215 VanDerWaalsContact CB-CG1 3.49Å; G160-V215 CarbonylContact C-O 3.56Å; G160-V215 WeakPolarHBondContact CA-O 3.18Å; G161-V215 PolarHBondContact N-O 2.79Å; G161-V215 PolarHBondContact O-N 2.73Å; A163-V215 HydrophobicContact CB-CG2 3.72Å; V215-E219 WeakPolarHBondContact CA-OE2 3.43Å; V215-E219 HydrophobicContact CG1-CB 4.43Å; V215-L221 HydrophobicContact CB-CD1 4.4Å; V215-L221 HydrophobicContact CG1-CD1 3.68Å; V215-L221 HydrophobicContact CG2-CD1 3.77Å
216	A	96.4	Very high	94.4	Very high	57 Å²	57	46.7 Å²	46.7	47%	0.471	23%	0.232	S	C	.	.			trans	-86.7	149	170.8	0	0	0	0	0	110.9	A157 R218 E219	A157-A216 WeakPolarHBondContact CB-O 3.16Å; A216-R218 PolarHBondContact O-N 3.12Å; A216-E219 HydrophobicContact CB-CB 4.29Å; A216-E219 PolarHBondContact N-OE2 3.29Å; A216-E219 WeakPolarHBondContact O-CB 3.41Å; A216-E219 PolarHBondContact O-N 3.45Å; A216-E219 VanDerWaalsContact O-N 3.08Å
217	E	95.6	Very high	94.3	Very high	118 Å²	118	46.8 Å²	46.8	55%	0.551	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	135.8	170	-165.1	-164.4	142.1	0	0	109.2	E219	E217-E219 PolarHBondContact O-N 2.89Å
218	R	95.8	Very high	94.1	Very high	188 Å²	188	47.6 Å²	47.6	71%	0.709	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	10.4	-176.5	-45.2	-175.9	178.4	-165.5	-4.9	115.9	V156 A157 A216	V156-R218 HydrophobicContact CG1-CB 4.08Å; A157-R218 WeakPolarHBondContact O-CA 3.47Å; A157-R218 PolarHBondContact O-N 3.27Å; A216-R218 PolarHBondContact O-N 3.12Å
219	E	95.9	Very high	94.1	Very high	54 Å²	54	49.5 Å²	49.5	25%	0.252	25%	0.249	S	C	.	.			trans	-63.6	136.2	169.5	-170.8	175.8	171.2	0	0	110.6	A157 R213 V215 A216 E217 L221	A157-E219 HydrophobicContact CB-CB 4.39Å; A157-E219 WeakPolarHBondContact CB-O 3.44Å; A157-E219 PolarHBondContact N-O 3.08Å; R213-E219 IonicContact CZ-OE1 2.92Å; R213-E219 IonicContact NH2-OE1 2.98Å; R213-E219 PolarHBondContact NH2-OE1 3.33Å; V215-E219 WeakPolarHBondContact CA-OE2 3.43Å; V215-E219 HydrophobicContact CG1-CB 4.43Å; A216-E219 HydrophobicContact CB-CB 4.29Å; A216-E219 PolarHBondContact N-OE2 3.29Å; A216-E219 WeakPolarHBondContact O-CB 3.41Å; A216-E219 PolarHBondContact O-N 3.45Å; A216-E219 VanDerWaalsContact O-N 3.08Å; E217-E219 PolarHBondContact O-N 2.89Å; E219-L221 HydrophobicContact CG-CD2 3.93Å; E219-L221 HydrophobicContact CG-CG 4.26Å
220	E	96.6	Very high	94.3	Very high	116 Å²	116	53.5 Å²	53.5	54%	0.542	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	118.2	175.2	-70.6	-177.6	-177.4	0	0	110.4	V156 H239	V156-E220 HydrophobicContact CG2-CG 4.28Å; E220-H239 HydrophobicContact CB-CB 3.96Å; E220-H239 PolarHBondContact O-N 3.15Å; E220-H239 VanDerWaalsContact O-N 3.14Å; E220-H239 IonicContact OE2-CD2 4Å
221	L	95.6	Very high	94.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153.9	-173.6	-62.1	177	0	0	0	110.3	S154 F155 A157 V215 E219 L236	S154-L221 CarbonylContact C-O 3.55Å; S154-L221 VanDerWaalsContact CA-O 3.28Å; S154-L221 WeakPolarHBondContact CA-O 3.43Å; F155-L221 HydrophobicContact CE1-CB 3.9Å; F155-L221 HydrophobicContact CE2-CB 3.97Å; F155-L221 HydrophobicContact CE2-CD1 3.93Å; F155-L221 HydrophobicContact CE2-CG 4.48Å; F155-L221 HydrophobicContact CZ-CB 3.61Å; F155-L221 HydrophobicContact CZ-CD1 3.88Å; F155-L221 HydrophobicContact CZ-CG 4.38Å; F155-L221 PolarHBondContact N-O 3.11Å; F155-L221 PolarHBondContact O-N 3.11Å; A157-L221 HydrophobicContact CB-CD1 4.24Å; V215-L221 HydrophobicContact CB-CD1 4.4Å; V215-L221 HydrophobicContact CG1-CD1 3.68Å; V215-L221 HydrophobicContact CG2-CD1 3.77Å; E219-L221 HydrophobicContact CG-CD2 3.93Å; E219-L221 HydrophobicContact CG-CG 4.26Å; L221-L236 HydrophobicContact CB-CD1 4.16Å; L221-L236 HydrophobicContact CD1-CD1 4.37Å; L221-L236 HydrophobicContact CD1-CD2 4.5Å
222	S	95.4	Very high	95.4	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.1	168	177.3	0	0	0	0	109.4	T153 Q237 Q242	T153-S222 WeakPolarHBondContact O-CA 3.41Å; S222-Q237 PolarHBondContact N-O 3.27Å; S222-Q237 PolarHBondContact O-N 3.32Å; S222-Q242 PolarHBondContact OG-NE2 2.69Å
223	L	96	Very high	95.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.6	167.8	-177.6	67.3	0	0	0	108	A74 M135 S152 T153 F155 V166 Y234 L236	A74-L223 HydrophobicContact CB-CD2 3.8Å; M135-L223 HydrophobicContact CE-CB 4.36Å; M135-L223 HydrophobicContact CE-CD2 4.15Å; M135-L223 HydrophobicContact CE-CG 3.95Å; M135-L223 WeakPolarHBondContact CE-O 3.42Å; M135-L223 HydrophobicContact SD-CD2 3.97Å; M135-L223 HydrophobicContact SD-CG 4.4Å; S152-L223 WeakPolarHBondContact CA-O 3.46Å; T153-L223 PolarHBondContact N-O 3.48Å; T153-L223 PolarHBondContact O-N 3.49Å; F155-L223 HydrophobicContact CE1-CB 3.84Å; V166-L223 HydrophobicContact CG1-CD2 4.34Å; V166-L223 HydrophobicContact CG2-CD1 4.04Å; L223-Y234 HydrophobicContact CD1-CD1 4.09Å; L223-Y234 HydrophobicContact CD2-CD1 4.25Å; L223-Y234 HydrophobicContact CD2-CE1 4.48Å; L223-Y234 HydrophobicContact CG-CD1 4.13Å; L223-L236 HydrophobicContact CD1-CD1 4.45Å
224	T	95.6	Very high	95.8	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.037	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.7	178.3	-57.9	0	0	0	0	109	S150 H151 S152 Y234 S235 P250	S150-T224 WeakPolarHBondContact OG-CG2 3.4Å; H151-T224 CarbonylContact O-C 3.53Å; H151-T224 VanDerWaalsContact O-CA 3.31Å; H151-T224 WeakPolarHBondContact O-CA 3.35Å; S152-T224 WeakPolarHBondContact OG-CG2 3.22Å; S152-T224 PolarHBondContact OG-OG1 2.78Å; T224-Y234 CarbonylContact O-C 3.49Å; T224-Y234 WeakPolarHBondContact O-CA 3.36Å; T224-S235 PolarHBondContact N-O 3.14Å; T224-S235 PolarHBondContact O-N 3.19Å; T224-P250 HydrophobicContact CG2-CG 4.49Å
225	V	96.4	Very high	95.7	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	138.7	164.7	67.7	0	0	0	0	108.9	M135 F136 S150 H151 L232 W233 Y234	M135-V225 HydrophobicContact CB-CB 4.46Å; M135-V225 HydrophobicContact CB-CG1 3.73Å; M135-V225 HydrophobicContact CE-CB 3.93Å; M135-V225 HydrophobicContact CE-CG1 3.89Å; M135-V225 HydrophobicContact CG-CG1 4.46Å; F136-V225 HydrophobicContact CD1-CG1 3.78Å; F136-V225 HydrophobicContact CE1-CG1 4.21Å; F136-V225 HydrophobicContact CE1-CG2 4.46Å; S150-V225 WeakPolarHBondContact CA-O 3.13Å; H151-V225 HydrophobicContact CB-CG1 3.95Å; H151-V225 PolarHBondContact N-O 3.18Å; H151-V225 PolarHBondContact O-N 2.52Å; V225-L232 HydrophobicContact CG2-CB 4.32Å; V225-L232 HydrophobicContact CG2-CD2 4.01Å; V225-W233 WeakPolarHBondContact CA-O 3.49Å; V225-Y234 HydrophobicContact CB-CD1 3.88Å; V225-Y234 HydrophobicContact CB-CE1 3.53Å; V225-Y234 HydrophobicContact CG2-CD1 4.13Å; V225-Y234 HydrophobicContact CG2-CE1 3.64Å; V225-Y234 HydrophobicContact CG2-CE2 4.08Å
226	C	95.8	Very high	95.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.3	169.1	-75	0	0	0	0	108.4	F148 Q149 S150 L232 W233 P250	F148-C226 HydrophobicContact CE2-CB 3.96Å; F148-C226 HydrophobicContact CZ-CB 4.11Å; Q149-C226 WeakPolarHBondContact O-CA 3.47Å; S150-C226 PolarHBondContact OG-SG 3.35Å; C226-L232 CarbonylContact O-C 3.56Å; C226-L232 WeakPolarHBondContact O-CA 3.39Å; C226-W233 HydrophobicContact CB-CD2 3.78Å; C226-W233 HydrophobicContact CB-CE3 4.44Å; C226-W233 HydrophobicContact CB-CG 4.18Å; C226-W233 HydrophobicContact CB-CH2 4.24Å; C226-W233 HydrophobicContact CB-CZ2 3.55Å; C226-W233 VanDerWaalsContact CB-NE1 3.32Å; C226-W233 PolarHBondContact N-O 3.12Å; C226-W233 PolarHBondContact O-N 2.92Å; C226-P250 WeakPolarHBondContact SG-CG 3.49Å
227	H	96.1	Very high	95.2	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.014	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	146	169.8	70.4	82.8	0	0	0	111.3	I43 F148 Q149 H151 S231 L232	I43-H227 HydrophobicContact CD1-CB 3.94Å; F148-H227 WeakPolarHBondContact CA-O 3.49Å; F148-H227 VanDerWaalsContact CD2-O 3.25Å; F148-H227 WeakPolarHBondContact CD2-O 3.46Å; Q149-H227 PolarHBondContact N-O 3.22Å; Q149-H227 PolarHBondContact O-N 2.82Å; H151-H227 AromaticContact NE2-NE2 3.73Å; H227-S231 WeakPolarHBondContact CA-O 3.27Å; H227-S231 WeakPolarHBondContact CB-O 3.46Å; H227-L232 HydrophobicContact CB-CG 4.19Å
228	D	94.8	Very high	94.7	Very high	32 Å²	32	34.8 Å²	34.8	17%	0.171	16%	0.161	C	C	.	.			trans	-93.2	-152.1	161.2	57.4	29	0	0	0	108.9	Y230 S231 W233 R252	D228-Y230 VanDerWaalsContact C-N 3.3Å; D228-Y230 PolarHBondContact OD1-N 2.92Å; D228-S231 PolarHBondContact N-O 2.81Å; D228-S231 WeakPolarHBondContact OD1-CA 3.39Å; D228-S231 WeakPolarHBondContact OD1-CB 3.47Å; D228-S231 PolarHBondContact OD1-N 3.35Å; D228-W233 HydrophobicContact CB-CH2 4.34Å; D228-W233 HydrophobicContact CB-CZ3 4.31Å; D228-R252 IonicContact OD2-NH1 3.43Å; D228-R252 PolarHBondContact OD2-NH1 2.92Å
229	D	94.6	Very high	93.7	Very high	65 Å²	65	29 Å²	29	35%	0.348	14%	0.142	S	C	.	.	S	Bend	trans	-74.3	-16.4	178.4	49.2	-14.3	0	0	0	113.8
230	Y	95.8	Very high	92.5	Very high	89 Å²	89	30.9 Å²	30.9	35%	0.349	16%	0.161	S	C	.	.	S	Bend	trans	-138.8	-13.7	-173.1	-72.2	-86.2	0	0	0	116	G44 P49 D228	G44-Y230 WeakPolarHBondContact CA-O 3.48Å; G44-Y230 WeakPolarHBondContact O-CD1 3.16Å; P49-Y230 HydrophobicContact CG-CE2 4.38Å; D228-Y230 VanDerWaalsContact C-N 3.3Å; D228-Y230 PolarHBondContact OD1-N 2.92Å
231	S	95.8	Very high	91	Very high	14 Å²	14	28.6 Å²	28.6	10%	0.098	15%	0.152	C	C	.	.			trans	-138.7	146.5	-166.6	-64	0	0	0	0	112.4	H227 D228 R252	H227-S231 WeakPolarHBondContact CA-O 3.27Å; H227-S231 WeakPolarHBondContact CB-O 3.46Å; D228-S231 PolarHBondContact N-O 2.81Å; D228-S231 WeakPolarHBondContact OD1-CA 3.39Å; D228-S231 WeakPolarHBondContact OD1-CB 3.47Å; D228-S231 PolarHBondContact OD1-N 3.35Å; S231-R252 VanDerWaalsContact CB-CZ 3.44Å; S231-R252 VanDerWaalsContact CB-NH2 3.35Å; S231-R252 VanDerWaalsContact OG-CZ 3.29Å; S231-R252 PolarHBondContact OG-NH1 3.44Å; S231-R252 VanDerWaalsContact OG-NH1 3.16Å; S231-R252 PolarHBondContact OG-NH2 2.92Å
232	L	96.3	Very high	89.2	Confident	10 Å²	10	31.2 Å²	31.2	5%	0.052	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	151.3	173.9	-56	92.9	0	0	0	111.8	E41 I43 V72 F136 Y207 V225 C226 H227	E41-L232 HydrophobicContact CB-CD1 3.72Å; E41-L232 HydrophobicContact CG-CD1 4.3Å; E41-L232 WeakPolarHBondContact O-CD1 3.44Å; E41-L232 PolarHBondContact OE1-N 2.67Å; I43-L232 HydrophobicContact CD1-CD1 4.03Å; I43-L232 HydrophobicContact CD1-CG 4.28Å; I43-L232 HydrophobicContact CG1-CD1 3.89Å; V72-L232 HydrophobicContact CG1-CD2 4.25Å; F136-L232 HydrophobicContact CE1-CD2 3.72Å; F136-L232 HydrophobicContact CZ-CD2 3.91Å; Y207-L232 HydrophobicContact CE1-CB 4.27Å; Y207-L232 VanDerWaalsContact CE1-O 3.22Å; Y207-L232 WeakPolarHBondContact CE1-O 3.43Å; V225-L232 HydrophobicContact CG2-CB 4.32Å; V225-L232 HydrophobicContact CG2-CD2 4.01Å; C226-L232 CarbonylContact O-C 3.56Å; C226-L232 WeakPolarHBondContact O-CA 3.39Å; H227-L232 HydrophobicContact CB-CG 4.19Å
233	W	95.9	Very high	87.1	Confident	18 Å²	18	38.4 Å²	38.4	7%	0.068	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	157.2	167.4	61.4	99.4	0	0	0	111.6	F148 V225 C226 D228 P250 R252 P253	F148-W233 AromaticContact CD2-CH2 3.98Å; F148-W233 HydrophobicContact CD2-CH2 3.98Å; F148-W233 HydrophobicContact CD2-CZ2 4.25Å; F148-W233 AromaticContact CE2-CH2 3.65Å; F148-W233 HydrophobicContact CE2-CH2 3.65Å; F148-W233 AromaticContact CE2-CZ2 3.49Å; F148-W233 HydrophobicContact CE2-CZ2 3.49Å; F148-W233 VanDerWaalsContact CE2-CZ2 3.49Å; F148-W233 HydrophobicContact CZ-CZ2 4.42Å; V225-W233 WeakPolarHBondContact CA-O 3.49Å; C226-W233 HydrophobicContact CB-CD2 3.78Å; C226-W233 HydrophobicContact CB-CE3 4.44Å; C226-W233 HydrophobicContact CB-CG 4.18Å; C226-W233 HydrophobicContact CB-CH2 4.24Å; C226-W233 HydrophobicContact CB-CZ2 3.55Å; C226-W233 VanDerWaalsContact CB-NE1 3.32Å; C226-W233 PolarHBondContact N-O 3.12Å; C226-W233 PolarHBondContact O-N 2.92Å; D228-W233 HydrophobicContact CB-CH2 4.34Å; D228-W233 HydrophobicContact CB-CZ3 4.31Å; W233-P250 PolarHBondContact NE1-O 3.29Å; W233-R252 HydrophobicContact CD2-CB 4.11Å; W233-R252 HydrophobicContact CD2-CG 4.15Å; W233-R252 HydrophobicContact CE3-CB 4.28Å; W233-R252 HydrophobicContact CE3-CG 4.01Å; W233-R252 HydrophobicContact CH2-CB 4.22Å; W233-R252 HydrophobicContact CZ2-CB 4.01Å; W233-R252 HydrophobicContact CZ3-CB 4.35Å; W233-R252 HydrophobicContact CZ3-CG 4.3Å; W233-P253 VanDerWaalsContact CB-CD 3.45Å; W233-P253 HydrophobicContact CB-CG 3.98Å; W233-P253 HydrophobicContact CG-CG 4.46Å
234	Y	95.1	Very high	85	Confident	6 Å²	6	42.1 Å²	42.1	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.9	-172.4	-69.6	-91.5	0	0	0	112.1	A74 M135 V166 S168 Y207 L223 T224 V225	A74-Y234 HydrophobicContact CB-CD1 4.45Å; A74-Y234 HydrophobicContact CB-CE1 3.56Å; M135-Y234 HydrophobicContact CE-CE1 4.24Å; M135-Y234 HydrophobicContact CG-CE1 4.25Å; V166-Y234 HydrophobicContact CB-CD2 4.38Å; V166-Y234 HydrophobicContact CB-CG 4.22Å; V166-Y234 HydrophobicContact CG1-CD1 3.86Å; V166-Y234 HydrophobicContact CG1-CD2 4.09Å; V166-Y234 HydrophobicContact CG1-CE1 3.97Å; V166-Y234 HydrophobicContact CG1-CE2 4.22Å; V166-Y234 HydrophobicContact CG1-CG 3.9Å; V166-Y234 HydrophobicContact CG2-CG 4.25Å; S168-Y234 PolarHBondContact OG-OH 3.25Å; Y207-Y234 HydrophobicContact CD1-CD2 4.12Å; Y207-Y234 HydrophobicContact CD1-CE2 4.38Å; Y207-Y234 AromaticContact CD2-CD2 3.68Å; Y207-Y234 HydrophobicContact CD2-CD2 3.68Å; Y207-Y234 AromaticContact CD2-CE2 3.41Å; Y207-Y234 HydrophobicContact CD2-CE2 3.41Å; Y207-Y234 VanDerWaalsContact CD2-CE2 3.41Å; Y207-Y234 HydrophobicContact CE2-CD2 4.23Å; Y207-Y234 AromaticContact CE2-CE2 3.59Å; Y207-Y234 HydrophobicContact CE2-CE2 3.59Å; Y207-Y234 AromaticContact CG-CD2 3.61Å; Y207-Y234 HydrophobicContact CG-CD2 3.61Å; Y207-Y234 AromaticContact CG-CE2 3.84Å; Y207-Y234 HydrophobicContact CG-CE2 3.84Å; L223-Y234 HydrophobicContact CD1-CD1 4.09Å; L223-Y234 HydrophobicContact CD2-CD1 4.25Å; L223-Y234 HydrophobicContact CD2-CE1 4.48Å; L223-Y234 HydrophobicContact CG-CD1 4.13Å; T224-Y234 CarbonylContact O-C 3.49Å; T224-Y234 WeakPolarHBondContact O-CA 3.36Å; V225-Y234 HydrophobicContact CB-CD1 3.88Å; V225-Y234 HydrophobicContact CB-CE1 3.53Å; V225-Y234 HydrophobicContact CG2-CD1 4.13Å; V225-Y234 HydrophobicContact CG2-CE1 3.64Å; V225-Y234 HydrophobicContact CG2-CE2 4.08Å
235	S	93.8	Very high	82.8	Confident	13 Å²	13	47.9 Å²	47.9	9%	0.091	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	154.2	170	70.9	0	0	0	0	110.6	T224 P250	T224-S235 PolarHBondContact N-O 3.14Å; T224-S235 PolarHBondContact O-N 3.19Å; S235-P250 WeakPolarHBondContact OG-CG 3.42Å
236	L	93.4	Very high	80.6	Confident	27 Å²	27	52 Å²	52	14%	0.141	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.8	-177	-176.2	71.8	0	0	0	110	L76 F155 A163 L209 L221 L223	L76-L236 HydrophobicContact CD1-CD2 4.49Å; L76-L236 HydrophobicContact CD2-CD1 3.98Å; L76-L236 HydrophobicContact CD2-CD2 3.79Å; F155-L236 HydrophobicContact CE1-CD1 4.34Å; F155-L236 HydrophobicContact CZ-CD1 4.17Å; A163-L236 HydrophobicContact CB-CD2 3.54Å; L209-L236 HydrophobicContact CD1-CB 3.96Å; L209-L236 HydrophobicContact CD1-CD2 4.01Å; L209-L236 HydrophobicContact CD2-CB 4.19Å; L221-L236 HydrophobicContact CB-CD1 4.16Å; L221-L236 HydrophobicContact CD1-CD1 4.37Å; L221-L236 HydrophobicContact CD1-CD2 4.5Å; L223-L236 HydrophobicContact CD1-CD1 4.45Å
237	Q	90.1	Very high	78.6	Confident	54 Å²	54	61 Å²	61	25%	0.252	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149.3	179	-61.9	-177.6	3	0	0	111	R213 S222	R213-Q237 VanDerWaalsContact NH1-C 3.29Å; S222-Q237 PolarHBondContact N-O 3.27Å; S222-Q237 PolarHBondContact O-N 3.32Å
238	P	84.1	Confident	77.1	Confident	34 Å²	34	66.6 Å²	66.6	22%	0.221	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	142.5	165.5	-7	19.8	0	0	0	109.7	R213 S240 L241	R213-P238 VanDerWaalsContact NH1-CD 3.35Å; R213-P238 VanDerWaalsContact NH1-N 3.15Å; P238-S240 PolarHBondContact O-N 2.8Å; P238-L241 HydrophobicContact CG-CD1 3.79Å; P238-L241 HydrophobicContact CG-CG 4.21Å; P238-L241 PolarHBondContact O-N 2.84Å; P238-L241 VanDerWaalsContact O-N 3.1Å
239	H	75.8	Confident	76	Confident	67 Å²	67	68.2 Å²	68.2	31%	0.31	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-55.6	-38	179.8	-172.3	-32.2	0	0	0	112.1	E220 L241 Q242	E220-H239 HydrophobicContact CB-CB 3.96Å; E220-H239 PolarHBondContact O-N 3.15Å; E220-H239 VanDerWaalsContact O-N 3.14Å; E220-H239 IonicContact OE2-CD2 4Å; H239-L241 PolarHBondContact O-N 3.17Å; H239-L241 VanDerWaalsContact O-N 3.1Å; H239-Q242 VanDerWaalsContact O-CB 3.32Å; H239-Q242 WeakPolarHBondContact O-CB 3.18Å; H239-Q242 PolarHBondContact O-N 3.17Å; H239-Q242 VanDerWaalsContact O-N 3.16Å
240	S	68.9	Low	75.2	Confident	94 Å²	94	66.4 Å²	66.4	66%	0.657	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-63.2	-18.1	-178.1	61.6	0	0	0	0	114.9	P238	P238-S240 PolarHBondContact O-N 2.8Å
241	L	65.1	Low	74.6	Confident	68 Å²	68	67.5 Å²	67.5	36%	0.356	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-94.7	-7.5	-179.5	-67.1	-178.5	0	0	0	113.3	P238 H239 D243 A244 Q245	P238-L241 HydrophobicContact CG-CD1 3.79Å; P238-L241 HydrophobicContact CG-CG 4.21Å; P238-L241 PolarHBondContact O-N 2.84Å; P238-L241 VanDerWaalsContact O-N 3.1Å; H239-L241 PolarHBondContact O-N 3.17Å; H239-L241 VanDerWaalsContact O-N 3.1Å; L241-D243 PolarHBondContact O-N 3.28Å; L241-A244 PolarHBondContact O-N 3Å; L241-A244 VanDerWaalsContact O-N 3.15Å; L241-Q245 PolarHBondContact O-N 3.31Å
242	Q	57.9	Low	74.2	Confident	55 Å²	55	71 Å²	71	26%	0.257	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-34.2	180	-148.7	170.4	27.3	0	0	111.7	S222 H239	S222-Q242 PolarHBondContact OG-NE2 2.69Å; H239-Q242 VanDerWaalsContact O-CB 3.32Å; H239-Q242 WeakPolarHBondContact O-CB 3.18Å; H239-Q242 PolarHBondContact O-N 3.17Å; H239-Q242 VanDerWaalsContact O-N 3.16Å
243	D	52.2	Low	73.7	Confident	152 Å²	152	71.3 Å²	71.3	81%	0.813	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.4	178.4	-67.6	-35.5	0	0	0	114.1	L241	L241-D243 PolarHBondContact O-N 3.28Å
244	A	52.4	Low	73.4	Confident	77 Å²	77	74.1 Å²	74.1	64%	0.636	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-13	-169.9	0	0	0	0	0	114.9	L241	L241-A244 PolarHBondContact O-N 3Å; L241-A244 VanDerWaalsContact O-N 3.15Å
245	Q	49.4	Very low	73.3	Confident	128 Å²	128	74.9 Å²	74.9	60%	0.598	43%	0.433	S	S	*	.	S	Bend	trans	-127.5	17.9	-178.3	-74.4	-172.6	-18.4	0	0	114.5	L241 E247	L241-Q245 PolarHBondContact O-N 3.31Å; Q245-E247 VanDerWaalsContact C-N 3.27Å; Q245-E247 PolarHBondContact O-N 3.06Å
246	A	50.1	Low	73.3	Confident	85 Å²	85	79.3 Å²	79.3	70%	0.702	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	49	-174	0	0	0	0	0	115.6
247	E	53.8	Low	73.4	Confident	191 Å²	191	78 Å²	78	89%	0.893	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-24	170.2	-76.1	-167.1	171.6	0	0	114.3	Q245	Q245-E247 VanDerWaalsContact C-N 3.27Å; Q245-E247 PolarHBondContact O-N 3.06Å
248	T	64.1	Low	73.6	Confident	120 Å²	120	77.8 Å²	77.8	74%	0.736	45%	0.452	S	S	*	.	S	Bend	trans	-135.2	131.4	179.1	51.9	0	0	0	0	113.1
249	P	72.2	Confident	74.2	Confident	66 Å²	66	76.1 Å²	76.1	43%	0.429	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-64.4	151.9	174.9	25.9	-32.1	0	0	0	111	F148	F148-P249 HydrophobicContact CE1-CB 3.62Å; F148-P249 HydrophobicContact CE1-CG 3.59Å; F148-P249 HydrophobicContact CZ-CB 3.5Å; F148-P249 VanDerWaalsContact CZ-CB 3.5Å; F148-P249 HydrophobicContact CZ-CG 3.81Å
250	P	78.1	Confident	75.1	Confident	26 Å²	26	73.7 Å²	73.7	17%	0.169	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-61	129.1	178.1	26.8	-34.6	0	0	0	109.6	T224 C226 W233 S235	T224-P250 HydrophobicContact CG2-CG 4.49Å; C226-P250 WeakPolarHBondContact SG-CG 3.49Å; W233-P250 PolarHBondContact NE1-O 3.29Å; S235-P250 WeakPolarHBondContact OG-CG 3.42Å
251	P	82.4	Confident	76.3	Confident	113 Å²	113	73.9 Å²	73.9	73%	0.734	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-65.6	151.2	-178.7	28.7	-34.9	0	0	0	110.3
252	R	87.9	Confident	77.7	Confident	87 Å²	87	71.9 Å²	71.9	33%	0.328	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-56.3	129.3	171.9	-175	174.6	177.2	161.6	1.5	109.6	H111 D228 S231 W233 C254	H111-R252 PolarHBondContact O-NH2 3.34Å; D228-R252 IonicContact OD2-NH1 3.43Å; D228-R252 PolarHBondContact OD2-NH1 2.92Å; S231-R252 VanDerWaalsContact CB-CZ 3.44Å; S231-R252 VanDerWaalsContact CB-NH2 3.35Å; S231-R252 VanDerWaalsContact OG-CZ 3.29Å; S231-R252 PolarHBondContact OG-NH1 3.44Å; S231-R252 VanDerWaalsContact OG-NH1 3.16Å; S231-R252 PolarHBondContact OG-NH2 2.92Å; W233-R252 HydrophobicContact CD2-CB 4.11Å; W233-R252 HydrophobicContact CD2-CG 4.15Å; W233-R252 HydrophobicContact CE3-CB 4.28Å; W233-R252 HydrophobicContact CE3-CG 4.01Å; W233-R252 HydrophobicContact CH2-CB 4.22Å; W233-R252 HydrophobicContact CZ2-CB 4.01Å; W233-R252 HydrophobicContact CZ3-CB 4.35Å; W233-R252 HydrophobicContact CZ3-CG 4.3Å; R252-C254 PolarHBondContact O-N 2.87Å
253	P	85.2	Confident	79.5	Confident	17 Å²	17	69.6 Å²	69.6	11%	0.11	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-52.6	128.7	175.3	-29.9	36.8	0	0	0	111.3	A108 H111 W233	A108-P253 HydrophobicContact CB-CB 3.75Å; H111-P253 WeakPolarHBondContact CB-O 3.32Å; W233-P253 VanDerWaalsContact CB-CD 3.45Å; W233-P253 HydrophobicContact CB-CG 3.98Å; W233-P253 HydrophobicContact CG-CG 4.46Å
254	C	89.3	Confident	81.6	Confident	76 Å²	76	65.9 Å²	65.9	51%	0.514	39%	0.386	S	S	.	.			trans	-132.3	145.2	172.4	68.1	0	0	0	0	110.1	G109 R252 T256	G109-C254 CarbonylContact O-C 3.22Å; R252-C254 PolarHBondContact O-N 2.87Å; C254-T256 PolarHBondContact O-N 3.23Å
255	C	93.8	Very high	83.7	Confident	23 Å²	23	64 Å²	64	16%	0.155	36%	0.362	C	S	.	.			trans	-72.6	126.5	179.7	179.4	0	0	0	0	110.1	C107 G109 Q258 H260 L261	C107-C255 VanDerWaalsContact SG-CA 3.6Å; G109-C255 WeakPolarHBondContact O-CA 3.41Å; G109-C255 PolarHBondContact O-N 2.92Å; G109-C255 VanDerWaalsContact O-N 3.17Å; C255-Q258 PolarHBondContact SG-N 3.39Å; C255-Q258 VanDerWaalsContact SG-N 3.37Å; C255-H260 HydrophobicContact CB-CB 4.05Å; C255-L261 HydrophobicContact CB-CD1 4.41Å; C255-L261 HydrophobicContact CB-CD2 3.93Å; C255-L261 HydrophobicContact CB-CG 3.89Å
256	T	93.8	Very high	85.9	Confident	105 Å²	105	60.3 Å²	60.3	64%	0.644	35%	0.349	S	S	*	.	S	Bend	trans	-117.6	-0.2	175.6	61.4	0	0	0	0	113.3	C107 C254	C107-T256 PolarHBondContact SG-N 2.94Å; C254-T256 PolarHBondContact O-N 3.23Å
257	C	94.1	Very high	88.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.316	C	S	.	.	S	Bend	trans	-110.4	2.1	-178.1	73.9	0	0	0	0	114	A103 I104 C107 A259 H260	A103-C257 HydrophobicContact CB-CB 3.87Å; I104-C257 HydrophobicContact CG1-CB 4.24Å; C107-C257 HydrophobicContact CB-CB 3.9Å; C257-A259 PolarHBondContact O-N 2.89Å; C257-H260 VanDerWaalsContact SG-CE1 3.55Å; C257-H260 PolarHBondContact SG-ND1 2.92Å
258	Q	94.9	Very high	90.2	Very high	49 Å²	49	47.2 Å²	47.2	23%	0.229	27%	0.274	C	S	.	.	S	Bend	trans	64.3	-30.3	-174.1	-45.8	-175.3	8.5	0	0	116.1	C255 H260 L261 V262 Q326 V327	C255-Q258 PolarHBondContact SG-N 3.39Å; C255-Q258 VanDerWaalsContact SG-N 3.37Å; Q258-H260 VanDerWaalsContact C-N 3.32Å; Q258-H260 PolarHBondContact O-N 3.12Å; Q258-L261 WeakPolarHBondContact O-CA 3.34Å; Q258-L261 WeakPolarHBondContact O-CB 3.07Å; Q258-L261 PolarHBondContact O-N 3.37Å; Q258-V262 PolarHBondContact O-N 3.31Å; Q258-Q326 VanDerWaalsContact OE1-CB 3.24Å; Q258-V327 HydrophobicContact CB-CG2 3.8Å
259	A	96	Very high	91.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-54.9	-44.1	-178.2	0	0	0	0	0	112.5	I104 C257 L261 V262 W263 F268 V327	I104-A259 HydrophobicContact CD1-CB 3.61Å; I104-A259 HydrophobicContact CG1-CB 3.88Å; C257-A259 PolarHBondContact O-N 2.89Å; A259-L261 PolarHBondContact O-N 3.01Å; A259-L261 VanDerWaalsContact O-N 3.17Å; A259-V262 WeakPolarHBondContact O-CG2 3.32Å; A259-V262 PolarHBondContact O-N 2.59Å; A259-W263 HydrophobicContact CB-CE3 3.84Å; A259-W263 HydrophobicContact CB-CZ3 3.98Å; A259-W263 PolarHBondContact O-N 3.5Å; A259-F268 HydrophobicContact CB-CZ 3.89Å; A259-V327 HydrophobicContact CB-CG1 4.18Å; A259-V327 HydrophobicContact CB-CG2 4.3Å
260	H	95.8	Very high	93	Very high	15 Å²	15	38.9 Å²	38.9	7%	0.069	22%	0.221	C	C	.	.	H	α-helix	trans	-72.1	-3.8	177.2	-49.4	97.4	0	0	0	115.1	A86 C107 A110 C255 C257 Q258 F268	A86-H260 PolarHBondContact O-CD2 3.48Å; A86-H260 PolarHBondContact O-NE2 2.94Å; C107-H260 PolarHBondContact SG-ND1 2.85Å; A110-H260 HydrophobicContact CB-CB 4.14Å; C255-H260 HydrophobicContact CB-CB 4.05Å; C257-H260 VanDerWaalsContact SG-CE1 3.55Å; C257-H260 PolarHBondContact SG-ND1 2.92Å; Q258-H260 VanDerWaalsContact C-N 3.32Å; Q258-H260 PolarHBondContact O-N 3.12Å; H260-F268 AromaticContact CD2-CE2 3.6Å; H260-F268 AromaticContact CD2-CZ 3.52Å; H260-F268 AromaticContact NE2-CZ 3.7Å
261	L	93.9	Very high	93.9	Very high	99 Å²	99	38 Å²	38	52%	0.518	22%	0.215	S	C	.	.	H	α-helix	trans	-97.3	-21.7	172.5	-57.9	176.4	0	0	0	112.1	C255 Q258 A259 M323	C255-L261 HydrophobicContact CB-CD1 4.41Å; C255-L261 HydrophobicContact CB-CD2 3.93Å; C255-L261 HydrophobicContact CB-CG 3.89Å; Q258-L261 WeakPolarHBondContact O-CA 3.34Å; Q258-L261 WeakPolarHBondContact O-CB 3.07Å; Q258-L261 PolarHBondContact O-N 3.37Å; A259-L261 PolarHBondContact O-N 3.01Å; A259-L261 VanDerWaalsContact O-N 3.17Å; L261-M323 HydrophobicContact CB-CE 3.53Å; L261-M323 HydrophobicContact CD1-CE 3.56Å; L261-M323 HydrophobicContact CG-CE 4.18Å
262	V	93.9	Very high	94.6	Very high	26 Å²	26	33.7 Å²	33.7	16%	0.158	19%	0.186	C	C	.	.	H	α-helix	trans	-108.3	-33.4	-177.7	-59.5	0	0	0	0	113.1	Q258 A259 M323 V327	Q258-V262 PolarHBondContact O-N 3.31Å; A259-V262 WeakPolarHBondContact O-CG2 3.32Å; A259-V262 PolarHBondContact O-N 2.59Å; V262-M323 HydrophobicContact CG1-CB 3.57Å; V262-M323 HydrophobicContact CG1-CE 4.22Å; V262-V327 HydrophobicContact CG2-CB 4.44Å; V262-V327 HydrophobicContact CG2-CG2 3.87Å
263	W	96.1	Very high	95	Very high	6 Å²	6	32.1 Å²	32.1	2%	0.023	18%	0.184	C	C	.	.	S	Bend	trans	-101.8	121.7	176.3	-63.9	-30.5	0	0	0	110.2	L88 I104 A259 R267 F268 L271 G300 V327 I328	L88-W263 HydrophobicContact CD2-CH2 4.44Å; L88-W263 HydrophobicContact CD2-CZ3 4.26Å; I104-W263 HydrophobicContact CD1-CZ3 4.05Å; A259-W263 HydrophobicContact CB-CE3 3.84Å; A259-W263 HydrophobicContact CB-CZ3 3.98Å; A259-W263 PolarHBondContact O-N 3.5Å; W263-R267 HydrophobicContact CB-CB 4.27Å; W263-R267 HydrophobicContact CB-CG 3.96Å; W263-R267 HydrophobicContact CG-CG 3.94Å; W263-F268 HydrophobicContact CB-CD2 3.7Å; W263-F268 HydrophobicContact CB-CE2 3.6Å; W263-F268 HydrophobicContact CB-CG 4.48Å; W263-F268 HydrophobicContact CB-CZ 4.32Å; W263-F268 HydrophobicContact CE3-CD1 4.42Å; W263-F268 AromaticContact CE3-CE1 3.88Å; W263-F268 HydrophobicContact CE3-CE1 3.88Å; W263-F268 HydrophobicContact CE3-CE2 4.25Å; W263-F268 AromaticContact CE3-CZ 3.8Å; W263-F268 HydrophobicContact CE3-CZ 3.8Å; W263-F268 HydrophobicContact CZ3-CE1 4.42Å; W263-F268 WeakPolarHBondContact O-CE2 3.49Å; W263-L271 HydrophobicContact CD2-CD1 3.66Å; W263-L271 HydrophobicContact CE3-CD1 3.92Å; W263-L271 HydrophobicContact CG-CD1 4.17Å; W263-L271 HydrophobicContact CH2-CD1 4.1Å; W263-L271 HydrophobicContact CZ2-CD1 3.84Å; W263-L271 HydrophobicContact CZ3-CD1 4.14Å; W263-G300 PolarHBondContact NE1-O 3.43Å; W263-V327 HydrophobicContact CE3-CG1 4.36Å; W263-V327 HydrophobicContact CH2-CG1 3.29Å; W263-V327 HydrophobicContact CZ2-CG1 3.54Å; W263-V327 HydrophobicContact CZ3-CG1 3.74Å; W263-I328 HydrophobicContact CZ2-CD1 4.04Å
264	T	95.8	Very high	95.5	Very high	75 Å²	75	40.9 Å²	40.9	46%	0.46	22%	0.215	S	C	.	.			trans	-70	165.8	171.6	65.1	0	0	0	0	111	R267 F268	T264-R267 WeakPolarHBondContact O-CA 3.31Å; T264-R267 WeakPolarHBondContact O-CB 3.32Å; T264-R267 PolarHBondContact O-N 2.96Å; T264-R267 PolarHBondContact OG1-N 3.23Å; T264-F268 PolarHBondContact O-N 3.22Å
265	R	96.4	Very high	95.7	Very high	36 Å²	36	46.8 Å²	46.8	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-55.3	-48.4	177.6	-82.5	61.7	172.6	-100	-0.3	112.1	W85 S112 V113 C114 F208 R267 F268 G269	W85-R265 HydrophobicContact CB-CB 4Å; W85-R265 HydrophobicContact CB-CG 4.2Å; S112-R265 PolarHBondContact O-NH2 3.27Å; S112-R265 PolarHBondContact OG-NH1 3.04Å; V113-R265 PolarHBondContact O-NH1 3.25Å; C114-R265 HydrophobicContact CB-CG 4.5Å; F208-R265 HydrophobicContact CE2-CG 4.41Å; R265-R267 VanDerWaalsContact C-N 3.29Å; R265-R267 PolarHBondContact O-N 3.36Å; R265-F268 PolarHBondContact O-N 3.49Å; R265-G269 PolarHBondContact O-N 3.35Å; R265-G269 VanDerWaalsContact O-N 3.11Å
266	P	96.7	Very high	95.8	Very high	51 Å²	51	46.7 Å²	46.7	33%	0.331	22%	0.223	S	C	.	.	H	α-helix	trans	-59.9	-35.3	172.6	-26.4	35.6	0	0	0	113.8	G269 E270	P266-G269 CarbonylContact O-C 3.58Å; P266-G269 PolarHBondContact O-N 3.45Å; P266-E270 PolarHBondContact O-N 2.79Å
267	R	96.9	Very high	95.8	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-69.1	-40.1	178.1	179.6	55.7	176.9	167.8	5.4	112.5	W263 T264 R265 G269 E270 L271 G300 E367 Y369	W263-R267 HydrophobicContact CB-CB 4.27Å; W263-R267 HydrophobicContact CB-CG 3.96Å; W263-R267 HydrophobicContact CG-CG 3.94Å; T264-R267 WeakPolarHBondContact O-CA 3.31Å; T264-R267 WeakPolarHBondContact O-CB 3.32Å; T264-R267 PolarHBondContact O-N 2.96Å; T264-R267 PolarHBondContact OG1-N 3.23Å; R265-R267 VanDerWaalsContact C-N 3.29Å; R265-R267 PolarHBondContact O-N 3.36Å; R267-G269 VanDerWaalsContact C-N 3.3Å; R267-G269 PolarHBondContact O-N 2.85Å; R267-E270 WeakPolarHBondContact CD-OE2 3.36Å; R267-E270 IonicContact CZ-OE2 3.6Å; R267-E270 IonicContact NH1-OE2 2.64Å; R267-E270 PolarHBondContact NH1-OE2 2.82Å; R267-E270 WeakPolarHBondContact O-CB 3.5Å; R267-E270 PolarHBondContact O-N 3.38Å; R267-L271 HydrophobicContact CG-CD1 4.39Å; R267-L271 VanDerWaalsContact NH2-CD2 3.35Å; R267-L271 WeakPolarHBondContact O-CG 3.49Å; R267-L271 PolarHBondContact O-N 2.82Å; R267-G300 PolarHBondContact NH2-O 3.34Å; R267-E367 IonicContact CZ-OE2 3.3Å; R267-E367 IonicContact NH1-OE2 2.7Å; R267-E367 PolarHBondContact NH1-OE2 2.85Å; R267-E367 IonicContact NH2-OE1 3.42Å; R267-E367 PolarHBondContact NH2-OE1 3.16Å; R267-E367 IonicContact NH2-OE2 3.23Å; R267-E367 PolarHBondContact NH2-OE2 2.95Å; R267-E367 VanDerWaalsContact NH2-OE2 3.14Å; R267-Y369 HydrophobicContact CB-CE2 4.23Å; R267-Y369 HydrophobicContact CG-CE1 4.08Å; R267-Y369 HydrophobicContact CG-CE2 4.1Å
268	F	97.7	Very high	95.9	Very high	1 Å²	1	44 Å²	44	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-57.3	-46.3	169.6	-91.4	-82.8	0	0	0	111	S84 W85 L88 I104 A259 H260 W263 T264 R265 E270 L271 N272	S84-F268 CarbonylContact O-C 3.52Å; S84-F268 WeakPolarHBondContact O-CB 3.04Å; W85-F268 WeakPolarHBondContact O-CB 3.44Å; L88-F268 HydrophobicContact CB-CE1 4.32Å; I104-F268 HydrophobicContact CG2-CE1 4.28Å; A259-F268 HydrophobicContact CB-CZ 3.89Å; H260-F268 AromaticContact CD2-CE2 3.6Å; H260-F268 AromaticContact CD2-CZ 3.52Å; H260-F268 AromaticContact NE2-CZ 3.7Å; W263-F268 HydrophobicContact CB-CD2 3.7Å; W263-F268 HydrophobicContact CB-CE2 3.6Å; W263-F268 HydrophobicContact CB-CG 4.48Å; W263-F268 HydrophobicContact CB-CZ 4.32Å; W263-F268 HydrophobicContact CE3-CD1 4.42Å; W263-F268 AromaticContact CE3-CE1 3.88Å; W263-F268 HydrophobicContact CE3-CE1 3.88Å; W263-F268 HydrophobicContact CE3-CE2 4.25Å; W263-F268 AromaticContact CE3-CZ 3.8Å; W263-F268 HydrophobicContact CE3-CZ 3.8Å; W263-F268 HydrophobicContact CZ3-CE1 4.42Å; W263-F268 WeakPolarHBondContact O-CE2 3.49Å; T264-F268 PolarHBondContact O-N 3.22Å; R265-F268 PolarHBondContact O-N 3.49Å; F268-E270 VanDerWaalsContact C-N 3.33Å; F268-E270 PolarHBondContact O-N 3.46Å; F268-L271 PolarHBondContact O-N 3.1Å; F268-N272 WeakPolarHBondContact O-CB 3.48Å; F268-N272 VanDerWaalsContact O-CG 3.27Å; F268-N272 PolarHBondContact O-N 2.92Å; F268-N272 VanDerWaalsContact O-N 3.14Å; F268-N272 PolarHBondContact O-ND2 3.42Å; F268-N272 VanDerWaalsContact O-ND2 3.08Å
269	G	97.4	Very high	96	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-57.4	-44.2	173.2	0	0	0	0	0	112.8	S84 R265 P266 R267 L271 N272 D273	S84-G269 PolarHBondContact O-N 3.38Å; R265-G269 PolarHBondContact O-N 3.35Å; R265-G269 VanDerWaalsContact O-N 3.11Å; P266-G269 CarbonylContact O-C 3.58Å; P266-G269 PolarHBondContact O-N 3.45Å; R267-G269 VanDerWaalsContact C-N 3.3Å; R267-G269 PolarHBondContact O-N 2.85Å; G269-L271 PolarHBondContact O-N 2.84Å; G269-N272 CarbonylContact O-C 3.57Å; G269-N272 PolarHBondContact O-N 2.95Å; G269-N272 VanDerWaalsContact O-N 3.15Å; G269-D273 PolarHBondContact O-N 3.27Å; G269-D273 VanDerWaalsContact O-N 3.09Å
270	E	97.4	Very high	96.1	Very high	9 Å²	9	43.7 Å²	43.7	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-43.2	179.3	-157	-178.1	-162.4	0	0	112.9	P266 R267 F268 N272 D273 R276 H533 R534	P266-E270 PolarHBondContact O-N 2.79Å; R267-E270 WeakPolarHBondContact CD-OE2 3.36Å; R267-E270 IonicContact CZ-OE2 3.6Å; R267-E270 IonicContact NH1-OE2 2.64Å; R267-E270 PolarHBondContact NH1-OE2 2.82Å; R267-E270 WeakPolarHBondContact O-CB 3.5Å; R267-E270 PolarHBondContact O-N 3.38Å; F268-E270 VanDerWaalsContact C-N 3.33Å; F268-E270 PolarHBondContact O-N 3.46Å; E270-N272 PolarHBondContact O-N 2.84Å; E270-D273 PolarHBondContact O-N 3.4Å; E270-R276 IonicContact OE1-CZ 2.67Å; E270-R276 IonicContact OE1-NE 3.96Å; E270-R276 PolarHBondContact OE1-NE 2.92Å; E270-R276 VanDerWaalsContact OE1-NE 3.13Å; E270-R276 IonicContact OE1-NH2 3.4Å; E270-R276 PolarHBondContact OE1-NH2 3.11Å; E270-H533 HydrophobicContact CB-CB 3.71Å; E270-H533 HydrophobicContact CG-CB 3.89Å; E270-H533 PolarHBondContact N-ND1 3.22Å; E270-R534 IonicContact OE1-CZ 2.75Å; E270-R534 VanDerWaalsContact OE1-CZ 3.26Å; E270-R534 IonicContact OE1-NE 3.85Å; E270-R534 PolarHBondContact OE1-NE 2.83Å; E270-R534 IonicContact OE1-NH2 2.81Å; E270-R534 PolarHBondContact OE1-NH2 3.24Å; E270-R534 IonicContact OE2-CZ 3.21Å; E270-R534 IonicContact OE2-NE 3.8Å; E270-R534 PolarHBondContact OE2-NE 3.29Å; E270-R534 IonicContact OE2-NH2 2.9Å; E270-R534 PolarHBondContact OE2-NH2 2.94Å
271	L	97	Very high	96.1	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-66.9	-26.6	177.9	-71.8	174.7	0	0	0	112	L88 W263 R267 F268 G269 L302	L88-L271 HydrophobicContact CD1-CB 4.06Å; W263-L271 HydrophobicContact CD2-CD1 3.66Å; W263-L271 HydrophobicContact CE3-CD1 3.92Å; W263-L271 HydrophobicContact CG-CD1 4.17Å; W263-L271 HydrophobicContact CH2-CD1 4.1Å; W263-L271 HydrophobicContact CZ2-CD1 3.84Å; W263-L271 HydrophobicContact CZ3-CD1 4.14Å; R267-L271 HydrophobicContact CG-CD1 4.39Å; R267-L271 VanDerWaalsContact NH2-CD2 3.35Å; R267-L271 WeakPolarHBondContact O-CG 3.49Å; R267-L271 PolarHBondContact O-N 2.82Å; F268-L271 PolarHBondContact O-N 3.1Å; G269-L271 PolarHBondContact O-N 2.84Å; L271-L302 HydrophobicContact CD2-CB 4.5Å; L271-L302 HydrophobicContact CD2-CD1 4.02Å; L271-L302 HydrophobicContact CD2-CG 3.92Å
272	N	97.4	Very high	96.3	Very high	23 Å²	23	41.1 Å²	41.1	12%	0.123	21%	0.21	C	C	.	.	H	α-helix	trans	-89.4	-8.2	178.6	-71.5	-31.1	0	0	0	113.8	S84 Q87 Q89 F268 G269 E270 R274	S84-N272 PolarHBondContact O-ND2 3.16Å; Q87-N272 PolarHBondContact O-ND2 3.18Å; Q89-N272 VanDerWaalsContact CB-OD1 3.29Å; Q89-N272 WeakPolarHBondContact CB-OD1 3.28Å; Q89-N272 HydrophobicContact CG-CB 4.48Å; Q89-N272 PolarHBondContact N-OD1 2.86Å; F268-N272 WeakPolarHBondContact O-CB 3.48Å; F268-N272 VanDerWaalsContact O-CG 3.27Å; F268-N272 PolarHBondContact O-N 2.92Å; F268-N272 VanDerWaalsContact O-N 3.14Å; F268-N272 PolarHBondContact O-ND2 3.42Å; F268-N272 VanDerWaalsContact O-ND2 3.08Å; G269-N272 CarbonylContact O-C 3.57Å; G269-N272 PolarHBondContact O-N 2.95Å; G269-N272 VanDerWaalsContact O-N 3.15Å; E270-N272 PolarHBondContact O-N 2.84Å; N272-R274 PolarHBondContact O-N 2.86Å
273	D	96	Very high	96.5	Very high	53 Å²	53	39.9 Å²	39.9	28%	0.283	20%	0.203	S	C	.	.			trans	-71.6	101.5	178.1	-174.1	-24.9	0	0	0	110.5	G269 E270 R275 R276 T277 H533	G269-D273 PolarHBondContact O-N 3.27Å; G269-D273 VanDerWaalsContact O-N 3.09Å; E270-D273 PolarHBondContact O-N 3.4Å; D273-R275 VanDerWaalsContact C-N 3.28Å; D273-R275 PolarHBondContact O-N 3.22Å; D273-R275 WeakPolarHBondContact OD1-CA 3.29Å; D273-R275 WeakPolarHBondContact OD1-CB 3.47Å; D273-R275 PolarHBondContact OD1-N 2.97Å; D273-R276 HydrophobicContact CB-CB 3.85Å; D273-R276 PolarHBondContact O-N 2.63Å; D273-R276 PolarHBondContact OD1-N 2.9Å; D273-T277 PolarHBondContact O-N 3.48Å; D273-T277 PolarHBondContact O-OG1 2.91Å; D273-H533 IonicContact OD2-CD2 3.35Å
274	R	94.4	Very high	96.5	Very high	202 Å²	202	39.6 Å²	39.6	76%	0.762	20%	0.202	S	C	*	.	H	α-helix	trans	-62.6	-31.9	-179.8	-62.2	-176	-177.2	177.8	2.8	113.3	N272 G278	N272-R274 PolarHBondContact O-N 2.86Å; R274-G278 PolarHBondContact O-N 2.88Å
275	R	94	Very high	96.5	Very high	199 Å²	199	41.5 Å²	41.5	75%	0.751	20%	0.201	S	C	*	.	H	α-helix	trans	-69.2	-46.6	177.9	-66.9	-177	179.6	-173.9	0.8	109.2	D273 G278 S279	D273-R275 VanDerWaalsContact C-N 3.28Å; D273-R275 PolarHBondContact O-N 3.22Å; D273-R275 WeakPolarHBondContact OD1-CA 3.29Å; D273-R275 WeakPolarHBondContact OD1-CB 3.47Å; D273-R275 PolarHBondContact OD1-N 2.97Å; R275-G278 PolarHBondContact O-N 3Å; R275-S279 PolarHBondContact O-N 3Å; R275-S279 PolarHBondContact O-OG 2.84Å
276	R	95.2	Very high	96.5	Very high	22 Å²	22	43.6 Å²	43.6	8%	0.083	22%	0.221	C	C	.	.	H	α-helix	trans	-59	-51.6	175.2	-176	-178.3	178.1	-80.2	-3	111.7	E270 D273 G278 S279 Y280 E367 V514	E270-R276 IonicContact OE1-CZ 2.67Å; E270-R276 IonicContact OE1-NE 3.96Å; E270-R276 PolarHBondContact OE1-NE 2.92Å; E270-R276 VanDerWaalsContact OE1-NE 3.13Å; E270-R276 IonicContact OE1-NH2 3.4Å; E270-R276 PolarHBondContact OE1-NH2 3.11Å; D273-R276 HydrophobicContact CB-CB 3.85Å; D273-R276 PolarHBondContact O-N 2.63Å; D273-R276 PolarHBondContact OD1-N 2.9Å; R276-G278 VanDerWaalsContact C-N 3.26Å; R276-G278 PolarHBondContact O-N 3.34Å; R276-S279 WeakPolarHBondContact O-CB 3.37Å; R276-S279 PolarHBondContact O-N 2.83Å; R276-S279 VanDerWaalsContact O-N 3.12Å; R276-Y280 HydrophobicContact CG-CD2 4.03Å; R276-Y280 HydrophobicContact CG-CE2 3.97Å; R276-Y280 WeakPolarHBondContact O-CD2 3.11Å; R276-Y280 PolarHBondContact O-N 3.48Å; R276-Y280 VanDerWaalsContact O-N 3.1Å; R276-E367 IonicContact CZ-OE2 2.81Å; R276-E367 IonicContact NH1-OE2 2.64Å; R276-E367 PolarHBondContact NH1-OE2 2.95Å; R276-E367 IonicContact NH2-OE2 3.72Å; R276-E367 PolarHBondContact NH2-OE2 3.48Å; R276-V514 HydrophobicContact CG-CG1 4.27Å
277	T	95.4	Very high	96.5	Very high	11 Å²	11	42.5 Å²	42.5	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-57.9	-40.8	176.7	-65.4	0	0	0	0	111.1	D273 S279 Y280 V281 F306	D273-T277 PolarHBondContact O-N 3.48Å; D273-T277 PolarHBondContact O-OG1 2.91Å; T277-S279 PolarHBondContact O-N 3.18Å; T277-Y280 PolarHBondContact O-N 3.29Å; T277-V281 HydrophobicContact CG2-CG2 4.15Å; T277-V281 WeakPolarHBondContact O-CB 3.21Å; T277-V281 VanDerWaalsContact O-CG2 3.29Å; T277-V281 WeakPolarHBondContact O-CG2 3.37Å; T277-V281 PolarHBondContact O-N 3.32Å; T277-F306 HydrophobicContact CG2-CE2 3.78Å; T277-F306 HydrophobicContact CG2-CZ 3.79Å
278	G	95.9	Very high	96.5	Very high	37 Å²	37	43.8 Å²	43.8	38%	0.381	22%	0.22	S	C	.	.	H	α-helix	trans	-56.4	-45.8	173.9	0	0	0	0	0	113.3	R274 R275 R276 V281 A282	R274-G278 PolarHBondContact O-N 2.88Å; R275-G278 PolarHBondContact O-N 3Å; R276-G278 VanDerWaalsContact C-N 3.26Å; R276-G278 PolarHBondContact O-N 3.34Å; G278-V281 PolarHBondContact O-N 2.8Å; G278-A282 WeakPolarHBondContact O-CB 3.2Å; G278-A282 PolarHBondContact O-N 2.95Å
279	S	96.8	Very high	96.3	Very high	38 Å²	38	46.3 Å²	46.3	27%	0.266	24%	0.238	S	C	.	.	H	α-helix	trans	-61.8	-45.1	176.5	-61	0	0	0	0	112.5	R275 R276 T277 A282 A283	R275-S279 PolarHBondContact O-N 3Å; R275-S279 PolarHBondContact O-OG 2.84Å; R276-S279 WeakPolarHBondContact O-CB 3.37Å; R276-S279 PolarHBondContact O-N 2.83Å; R276-S279 VanDerWaalsContact O-N 3.12Å; T277-S279 PolarHBondContact O-N 3.18Å; S279-A282 PolarHBondContact O-N 3.42Å; S279-A283 WeakPolarHBondContact O-CB 3.18Å; S279-A283 PolarHBondContact O-N 3.13Å
280	Y	97.6	Very high	96.1	Very high	5 Å²	5	55 Å²	55	2%	0.02	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-40.8	177.2	-84.1	-82.3	0	0	0	112.6	R276 T277 A283 L284 L303 E367 L400 L508 V514	R276-Y280 HydrophobicContact CG-CD2 4.03Å; R276-Y280 HydrophobicContact CG-CE2 3.97Å; R276-Y280 WeakPolarHBondContact O-CD2 3.11Å; R276-Y280 PolarHBondContact O-N 3.48Å; R276-Y280 VanDerWaalsContact O-N 3.1Å; T277-Y280 PolarHBondContact O-N 3.29Å; Y280-A283 PolarHBondContact O-N 3.17Å; Y280-L284 WeakPolarHBondContact O-CB 3.49Å; Y280-L284 WeakPolarHBondContact O-CG 3.45Å; Y280-L284 PolarHBondContact O-N 3.3Å; Y280-L303 HydrophobicContact CD1-CD1 3.56Å; Y280-L303 HydrophobicContact CD1-CD2 4.3Å; Y280-L303 HydrophobicContact CE1-CD1 4.45Å; Y280-L303 HydrophobicContact CE1-CD2 4.47Å; Y280-L303 HydrophobicContact CG-CD1 4.07Å; Y280-E367 HydrophobicContact CE1-CG 4.18Å; Y280-E367 WeakPolarHBondContact OH-CA 3.44Å; Y280-E367 PolarHBondContact OH-O 2.76Å; Y280-E367 VanDerWaalsContact OH-O 3.12Å; Y280-L400 HydrophobicContact CD1-CD2 4.4Å; Y280-L508 HydrophobicContact CD1-CD1 3.71Å; Y280-L508 HydrophobicContact CD1-CD2 4.17Å; Y280-L508 HydrophobicContact CD2-CD1 4.19Å; Y280-L508 HydrophobicContact CE1-CD1 3.87Å; Y280-L508 HydrophobicContact CE1-CD2 3.52Å; Y280-L508 HydrophobicContact CE1-CG 4.38Å; Y280-L508 HydrophobicContact CE2-CD1 4.32Å; Y280-L508 HydrophobicContact CG-CD1 3.89Å; Y280-V514 HydrophobicContact CD2-CG2 4.43Å; Y280-V514 HydrophobicContact CE2-CG1 4.37Å; Y280-V514 HydrophobicContact CE2-CG2 4.03Å
281	V	96.9	Very high	96	Very high	9 Å²	9	58.9 Å²	58.9	6%	0.055	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-42.1	175.9	169.1	0	0	0	0	110.7	V93 T277 G278 L284 R285 F306 L310	V93-V281 HydrophobicContact CG1-CG1 4.16Å; V93-V281 HydrophobicContact CG1-CG2 4.08Å; V93-V281 HydrophobicContact CG2-CG2 4.11Å; T277-V281 HydrophobicContact CG2-CG2 4.15Å; T277-V281 WeakPolarHBondContact O-CB 3.21Å; T277-V281 VanDerWaalsContact O-CG2 3.29Å; T277-V281 WeakPolarHBondContact O-CG2 3.37Å; T277-V281 PolarHBondContact O-N 3.32Å; G278-V281 PolarHBondContact O-N 2.8Å; V281-L284 PolarHBondContact O-N 2.83Å; V281-R285 WeakPolarHBondContact O-CG 3.4Å; V281-R285 PolarHBondContact O-N 2.96Å; V281-F306 HydrophobicContact CG2-CD2 4.42Å; V281-F306 HydrophobicContact CG2-CG 4.48Å; V281-L310 HydrophobicContact CG1-CD1 4.4Å; V281-L310 HydrophobicContact CG1-CD2 4.42Å
282	A	96.6	Very high	96	Very high	50 Å²	50	58.6 Å²	58.6	41%	0.413	30%	0.297	S	S	.	.	H	α-helix	trans	-62.7	-46	176.4	0	0	0	0	0	111.8	G278 S279 R285 S286	G278-A282 WeakPolarHBondContact O-CB 3.2Å; G278-A282 PolarHBondContact O-N 2.95Å; S279-A282 PolarHBondContact O-N 3.42Å; A282-R285 PolarHBondContact O-N 2.61Å; A282-S286 PolarHBondContact O-N 3.39Å
283	A	97.8	Very high	96.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-41.1	177.1	0	0	0	0	0	112.4	S279 Y280 R285 S286 V287 L400 L508 T509 V512	S279-A283 WeakPolarHBondContact O-CB 3.18Å; S279-A283 PolarHBondContact O-N 3.13Å; Y280-A283 PolarHBondContact O-N 3.17Å; A283-R285 VanDerWaalsContact C-N 3.34Å; A283-R285 PolarHBondContact O-N 2.86Å; A283-S286 PolarHBondContact O-N 2.85Å; A283-S286 PolarHBondContact O-OG 3.25Å; A283-V287 PolarHBondContact O-N 3.4Å; A283-L400 HydrophobicContact CB-CD1 3.88Å; A283-L508 HydrophobicContact CB-CB 3.66Å; A283-L508 HydrophobicContact CB-CD1 3.83Å; A283-L508 HydrophobicContact CB-CG 4.42Å; A283-T509 HydrophobicContact CB-CG2 4.05Å; A283-V512 HydrophobicContact CB-CB 4.49Å; A283-V512 HydrophobicContact CB-CG1 4.38Å
284	L	97.6	Very high	96.2	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-43.3	174	-77.6	176.8	0	0	0	111.4	Y280 V281 S286 V287 L288 L303 F306 A307 L310 M365 L400	Y280-L284 WeakPolarHBondContact O-CB 3.49Å; Y280-L284 WeakPolarHBondContact O-CG 3.45Å; Y280-L284 PolarHBondContact O-N 3.3Å; V281-L284 PolarHBondContact O-N 2.83Å; L284-S286 VanDerWaalsContact C-N 3.29Å; L284-S286 PolarHBondContact O-N 3.14Å; L284-V287 WeakPolarHBondContact O-CG2 3.46Å; L284-V287 PolarHBondContact O-N 3.23Å; L284-L288 HydrophobicContact CB-CD1 4Å; L284-L288 HydrophobicContact CB-CG 4.49Å; L284-L288 HydrophobicContact CD2-CD1 4.32Å; L284-L288 VanDerWaalsContact O-CB 3.29Å; L284-L288 WeakPolarHBondContact O-CB 3.43Å; L284-L288 WeakPolarHBondContact O-CG 3.4Å; L284-L288 PolarHBondContact O-N 3.36Å; L284-L303 HydrophobicContact CD1-CD1 3.58Å; L284-L303 HydrophobicContact CD1-CG 4.29Å; L284-L303 HydrophobicContact CD2-CD1 4.37Å; L284-L303 HydrophobicContact CG-CD1 4.04Å; L284-F306 HydrophobicContact CD1-CB 3.87Å; L284-A307 HydrophobicContact CD1-CB 4.3Å; L284-A307 HydrophobicContact CD2-CB 4.38Å; L284-L310 HydrophobicContact CB-CD1 3.52Å; L284-L310 HydrophobicContact CD1-CD1 4.03Å; L284-L310 HydrophobicContact CG-CD1 4.46Å; L284-M365 HydrophobicContact CD2-SD 3.72Å; L284-L400 HydrophobicContact CD2-CD1 4.33Å
285	R	95.6	Very high	96.4	Very high	116 Å²	116	45.3 Å²	45.3	44%	0.438	24%	0.242	S	C	.	.	H	α-helix	trans	-61.4	-35.3	178.1	-74.4	-172.4	-146.6	-169.8	-2.3	113.6	E94 V281 A282 A283 V287 L310	E94-R285 VanDerWaalsContact CG-CZ 3.46Å; E94-R285 VanDerWaalsContact OE1-CD 3.3Å; E94-R285 WeakPolarHBondContact OE1-CD 3.31Å; E94-R285 IonicContact OE1-CZ 2.77Å; E94-R285 IonicContact OE1-NE 3.01Å; E94-R285 PolarHBondContact OE1-NE 3.41Å; E94-R285 IonicContact OE1-NH1 2.74Å; E94-R285 PolarHBondContact OE1-NH1 2.9Å; E94-R285 IonicContact OE1-NH2 3.28Å; E94-R285 PolarHBondContact OE1-NH2 2.92Å; E94-R285 IonicContact OE2-CZ 3.03Å; E94-R285 IonicContact OE2-NE 3.93Å; E94-R285 IonicContact OE2-NH1 2.88Å; E94-R285 PolarHBondContact OE2-NH1 2.92Å; E94-R285 IonicContact OE2-NH2 2.77Å; E94-R285 PolarHBondContact OE2-NH2 2.99Å; V281-R285 WeakPolarHBondContact O-CG 3.4Å; V281-R285 PolarHBondContact O-N 2.96Å; A282-R285 PolarHBondContact O-N 2.61Å; A283-R285 VanDerWaalsContact C-N 3.34Å; A283-R285 PolarHBondContact O-N 2.86Å; R285-V287 VanDerWaalsContact C-N 3.26Å; R285-V287 PolarHBondContact O-N 2.74Å; R285-L310 HydrophobicContact CG-CD1 4.18Å; R285-L310 HydrophobicContact CG-CD2 3.96Å
286	S	96.4	Very high	96.6	Very high	80 Å²	80	35.9 Å²	35.9	56%	0.559	21%	0.206	S	C	*	.	H	α-helix	trans	-73.7	-18.7	-179.9	55.6	0	0	0	0	113.4	A282 A283 L284	A282-S286 PolarHBondContact O-N 3.39Å; A283-S286 PolarHBondContact O-N 2.85Å; A283-S286 PolarHBondContact O-OG 3.25Å; L284-S286 VanDerWaalsContact C-N 3.29Å; L284-S286 PolarHBondContact O-N 3.14Å
287	V	96.3	Very high	96.7	Very high	27 Å²	27	35 Å²	35	16%	0.164	20%	0.203	C	C	.	.	H	α-helix	trans	-111.4	-20.9	-176	-53.4	0	0	0	0	114.2	A283 L284 R285 V363 T398 L400 T509	A283-V287 PolarHBondContact O-N 3.4Å; L284-V287 WeakPolarHBondContact O-CG2 3.46Å; L284-V287 PolarHBondContact O-N 3.23Å; R285-V287 VanDerWaalsContact C-N 3.26Å; R285-V287 PolarHBondContact O-N 2.74Å; V287-V363 HydrophobicContact CG2-CG1 4.21Å; V287-T398 HydrophobicContact CB-CG2 3.91Å; V287-T398 HydrophobicContact CG1-CG2 3.75Å; V287-L400 HydrophobicContact CG1-CD1 4.33Å; V287-L400 HydrophobicContact CG2-CD1 3.8Å; V287-T509 HydrophobicContact CG1-CG2 4.1Å
288	L	96.9	Very high	96.8	Very high	29 Å²	29	34.5 Å²	34.5	15%	0.152	20%	0.2	C	C	.	.			trans	-81.6	144.2	-178.6	-69.5	176.6	0	0	0	112.4	L284 C294 A307 L310 A312 V363	L284-L288 HydrophobicContact CB-CD1 4Å; L284-L288 HydrophobicContact CB-CG 4.49Å; L284-L288 HydrophobicContact CD2-CD1 4.32Å; L284-L288 VanDerWaalsContact O-CB 3.29Å; L284-L288 WeakPolarHBondContact O-CB 3.43Å; L284-L288 WeakPolarHBondContact O-CG 3.4Å; L284-L288 PolarHBondContact O-N 3.36Å; L288-C294 WeakPolarHBondContact CD2-SG 3.37Å; L288-A307 HydrophobicContact CD1-CB 4.16Å; L288-L310 HydrophobicContact CD1-CB 3.81Å; L288-L310 HydrophobicContact CD1-CD1 4.15Å; L288-A312 HydrophobicContact CD2-CB 4.2Å; L288-V363 HydrophobicContact CD2-CG2 4.32Å
289	S	94.7	Very high	96.7	Very high	54 Å²	54	33.3 Å²	33.3	38%	0.378	19%	0.185	S	C	.	.			trans	-132	163.7	173.8	63.4	0	0	0	0	110.2	D291 S292	S289-D291 VanDerWaalsContact CB-OD1 3.27Å; S289-D291 WeakPolarHBondContact CB-OD1 3.16Å; S289-D291 PolarHBondContact O-N 3.25Å; S289-D291 VanDerWaalsContact O-N 3.12Å; S289-D291 PolarHBondContact OG-OD1 3.27Å; S289-S292 PolarHBondContact N-OG 2.81Å; S289-S292 WeakPolarHBondContact O-CB 3.31Å; S289-S292 PolarHBondContact O-N 3.41Å; S289-S292 PolarHBondContact O-OG 3.17Å; S289-S292 PolarHBondContact OG-N 2.81Å; S289-S292 PolarHBondContact OG-OG 3.48Å
290	E	91.8	Very high	96.6	Very high	183 Å²	183	31.5 Å²	31.5	86%	0.855	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.8	178.9	-65.5	-173.8	169.8	0	0	113.7	K313	E290-K313 WeakPolarHBondContact O-CB 3.33Å
291	D	95.4	Very high	96.6	Very high	91 Å²	91	31.3 Å²	31.3	49%	0.487	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	5.1	177.6	73.4	-48.9	0	0	0	113.6	S289 V293 R394	S289-D291 VanDerWaalsContact CB-OD1 3.27Å; S289-D291 WeakPolarHBondContact CB-OD1 3.16Å; S289-D291 PolarHBondContact O-N 3.25Å; S289-D291 VanDerWaalsContact O-N 3.12Å; S289-D291 PolarHBondContact OG-OD1 3.27Å; D291-V293 PolarHBondContact O-N 3.01Å; D291-R394 IonicContact OD2-NH1 3.26Å
292	S	98.1	Very high	96.6	Very high	1 Å²	1	31 Å²	31	1%	0.007	17%	0.17	C	C	.	.			trans	-64.9	125.8	-175.5	-77.9	0	0	0	0	112.9	S289 K313 K314 S362	S289-S292 PolarHBondContact N-OG 2.81Å; S289-S292 WeakPolarHBondContact O-CB 3.31Å; S289-S292 PolarHBondContact O-N 3.41Å; S289-S292 PolarHBondContact O-OG 3.17Å; S289-S292 PolarHBondContact OG-N 2.81Å; S289-S292 PolarHBondContact OG-OG 3.48Å; S292-K313 VanDerWaalsContact O-CB 3.28Å; S292-K313 WeakPolarHBondContact O-CB 2.86Å; S292-K313 PolarHBondContact O-N 2.8Å; S292-K314 PolarHBondContact O-N 3.02Å; S292-S362 WeakPolarHBondContact CA-OG 3.43Å
293	V	98.4	Very high	96.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	107.6	168.8	177.9	0	0	0	0	107.7	D291 K313 K314 F316 E359 Q360 S362 V363 R394	D291-V293 PolarHBondContact O-N 3.01Å; V293-K313 HydrophobicContact CG2-CD 4.42Å; V293-K314 WeakPolarHBondContact CA-O 2.81Å; V293-K314 HydrophobicContact CG1-CB 4.5Å; V293-K314 HydrophobicContact CG2-CB 4.41Å; V293-F316 HydrophobicContact CG1-CD2 4.37Å; V293-F316 HydrophobicContact CG1-CE2 4.01Å; V293-E359 HydrophobicContact CG1-CB 3.98Å; V293-E359 HydrophobicContact CG2-CB 4.3Å; V293-Q360 WeakPolarHBondContact CB-O 3.44Å; V293-S362 PolarHBondContact N-OG 2.73Å; V293-S362 PolarHBondContact O-N 3.02Å; V293-S362 PolarHBondContact O-OG 3.45Å; V293-V363 PolarHBondContact O-N 3.22Å; V293-R394 VanDerWaalsContact CG2-NH2 3.31Å
294	C	98.7	Very high	96.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	138.7	-173	-53.6	0	0	0	0	111.4	L288 K314 V315 F316 V363 M365	L288-C294 WeakPolarHBondContact CD2-SG 3.37Å; C294-K314 PolarHBondContact N-O 2.87Å; C294-V315 HydrophobicContact CB-CG1 4.21Å; C294-V315 HydrophobicContact CB-CG2 4.26Å; C294-V315 WeakPolarHBondContact O-CA 3.38Å; C294-F316 PolarHBondContact O-N 2.56Å; C294-V363 CarbonylContact C-O 3.6Å; C294-V363 VanDerWaalsContact CA-O 3.26Å; C294-V363 WeakPolarHBondContact CA-O 3.22Å; C294-M365 HydrophobicContact CB-CE 3.74Å; C294-M365 HydrophobicContact CB-SD 4.18Å
295	L	98.6	Very high	96.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124	166.5	-179.6	65.4	0	0	0	108.9	F316 L318 L351 I361 V363 L364 M365 L389	L295-F316 CarbonylContact C-O 3.46Å; L295-F316 WeakPolarHBondContact CA-O 3.37Å; L295-F316 HydrophobicContact CD1-CB 3.53Å; L295-L318 HydrophobicContact CD1-CD2 3.95Å; L295-L318 HydrophobicContact CD1-CG 3.93Å; L295-L318 HydrophobicContact CD2-CD1 4.49Å; L295-L351 HydrophobicContact CD1-CD2 4.47Å; L295-L351 HydrophobicContact CD2-CD2 3.74Å; L295-I361 HydrophobicContact CB-CD1 4.11Å; L295-I361 HydrophobicContact CB-CG1 4.15Å; L295-I361 HydrophobicContact CB-CG2 3.95Å; L295-I361 HydrophobicContact CD2-CD1 3.49Å; L295-I361 VanDerWaalsContact CD2-CD1 3.49Å; L295-I361 HydrophobicContact CD2-CG1 4.37Å; L295-I361 HydrophobicContact CG-CD1 4.44Å; L295-V363 PolarHBondContact N-O 2.9Å; L295-L364 HydrophobicContact CB-CD1 4.17Å; L295-L364 HydrophobicContact CD2-CD1 4.1Å; L295-L364 HydrophobicContact CG-CD1 4.17Å; L295-M365 PolarHBondContact O-N 2.62Å; L295-L389 HydrophobicContact CD2-CD1 3.67Å; L295-L389 HydrophobicContact CD2-CD2 4.02Å; L295-L389 HydrophobicContact CD2-CG 4.45Å
296	S	98.3	Very high	96.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	137.7	175.2	-176.9	0	0	0	0	111.5	F316 L318 M365	S296-F316 PolarHBondContact N-O 3.41Å; S296-L318 PolarHBondContact O-N 2.85Å; S296-M365 CarbonylContact C-O 3.57Å; S296-M365 VanDerWaalsContact CA-O 3.27Å; S296-M365 WeakPolarHBondContact CA-O 3.26Å
297	V	97.8	Very high	96.8	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.018	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	93.9	173	-172.6	0	0	0	0	109.5	L318 L364 M365 F370 F382 C385 L389	V297-L318 HydrophobicContact CG2-CD1 4.03Å; V297-L318 HydrophobicContact CG2-CG 4.36Å; V297-L364 HydrophobicContact CG2-CD1 3.97Å; V297-M365 PolarHBondContact N-O 3.41Å; V297-F370 HydrophobicContact CG1-CE1 4.21Å; V297-F370 HydrophobicContact CG1-CZ 4.45Å; V297-F382 HydrophobicContact CB-CD2 4.17Å; V297-F382 HydrophobicContact CB-CE2 4.3Å; V297-C385 HydrophobicContact CG1-CB 3.8Å; V297-L389 HydrophobicContact CG2-CD1 4.08Å
298	S	96.1	Very high	96.8	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.007	11%	0.108	C	C	.	.	S	Bend	trans	-169.9	135.1	173.1	-76.3	0	0	0	0	108.6	G300 E367 P368 Y369	S298-G300 PolarHBondContact O-N 2.94Å; S298-E367 PolarHBondContact OG-N 3.03Å; S298-P368 WeakPolarHBondContact OG-CA 3.18Å; S298-Y369 CarbonylContact C-O 3.58Å; S298-Y369 WeakPolarHBondContact CA-O 3.2Å; S298-Y369 PolarHBondContact OG-N 3.1Å
299	D	94.8	Very high	96.7	Very high	12 Å²	12	21.1 Å²	21.1	6%	0.064	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	122.1	-175.6	-62.5	-29.9	0	0	0	110.4	S301 N320 Y369 F370 S371	D299-S301 VanDerWaalsContact C-N 3.3Å; D299-S301 PolarHBondContact O-N 3.44Å; D299-N320 WeakPolarHBondContact OD1-CB 3.48Å; D299-N320 PolarHBondContact OD1-ND2 3.1Å; D299-Y369 HydrophobicContact CB-CD1 4.48Å; D299-Y369 PolarHBondContact N-O 3.2Å; D299-Y369 WeakPolarHBondContact O-CD1 3.41Å; D299-F370 VanDerWaalsContact OD2-CA 3.27Å; D299-F370 WeakPolarHBondContact OD2-CA 3.34Å; D299-S371 PolarHBondContact OD2-N 3.21Å
300	G	94.9	Very high	96.8	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.01	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	42.2	171.8	0	0	0	0	0	112.2	W263 R267 S298 E319 S324	W263-G300 PolarHBondContact NE1-O 3.43Å; R267-G300 PolarHBondContact NH2-O 3.34Å; S298-G300 PolarHBondContact O-N 2.94Å; G300-E319 PolarHBondContact N-OE2 3.31Å; G300-S324 WeakPolarHBondContact CA-OG 3.18Å; G300-S324 PolarHBondContact N-OG 3.1Å
301	S	96.3	Very high	96.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.083	C	C	.	.			trans	-88.7	143.6	-177.9	175.3	0	0	0	0	112.4	D299 L303 P304 I328 E367	D299-S301 VanDerWaalsContact C-N 3.3Å; D299-S301 PolarHBondContact O-N 3.44Å; S301-L303 WeakPolarHBondContact OG-CB 3.38Å; S301-L303 PolarHBondContact OG-N 3.1Å; S301-L303 VanDerWaalsContact OG-N 3.07Å; S301-P304 WeakPolarHBondContact O-CD 3.29Å; S301-I328 WeakPolarHBondContact O-CD1 3.4Å; S301-E367 WeakPolarHBondContact CA-OE1 3.14Å; S301-E367 VanDerWaalsContact CB-OE1 3.28Å; S301-E367 WeakPolarHBondContact CB-OE1 3.42Å; S301-E367 PolarHBondContact OG-OE1 3.01Å
302	L	97.2	Very high	97	Very high	3 Å²	3	9.9 Å²	9.9	2%	0.016	6%	0.063	C	C	.	.	S	Bend	trans	-88.9	-10	170.6	-62.7	-176.5	0	0	0	112.7	L88 L98 L271 V305 F306 I328 V331 E367	L88-L302 HydrophobicContact CD1-CD1 4.33Å; L98-L302 HydrophobicContact CD2-CD1 4.24Å; L271-L302 HydrophobicContact CD2-CB 4.5Å; L271-L302 HydrophobicContact CD2-CD1 4.02Å; L271-L302 HydrophobicContact CD2-CG 3.92Å; L302-V305 WeakPolarHBondContact O-CA 3.39Å; L302-V305 WeakPolarHBondContact O-CB 3.48Å; L302-V305 PolarHBondContact O-N 2.88Å; L302-F306 HydrophobicContact CB-CE1 4.09Å; L302-F306 HydrophobicContact CB-CE2 3.86Å; L302-F306 HydrophobicContact CB-CZ 3.6Å; L302-F306 HydrophobicContact CD1-CZ 4.24Å; L302-F306 WeakPolarHBondContact O-CG 3.25Å; L302-F306 PolarHBondContact O-N 3.24Å; L302-I328 HydrophobicContact CD2-CD1 4.17Å; L302-V331 HydrophobicContact CD2-CG1 4.02Å; L302-V331 HydrophobicContact CD2-CG2 4.24Å; L302-E367 PolarHBondContact N-OE1 2.84Å
303	L	97.3	Very high	97	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-52.8	-44.5	178.5	-165.3	68.2	0	0	0	114.5	Y280 L284 S301 V305 F306 A307 M365 E367 L400	Y280-L303 HydrophobicContact CD1-CD1 3.56Å; Y280-L303 HydrophobicContact CD1-CD2 4.3Å; Y280-L303 HydrophobicContact CE1-CD1 4.45Å; Y280-L303 HydrophobicContact CE1-CD2 4.47Å; Y280-L303 HydrophobicContact CG-CD1 4.07Å; L284-L303 HydrophobicContact CD1-CD1 3.58Å; L284-L303 HydrophobicContact CD1-CG 4.29Å; L284-L303 HydrophobicContact CD2-CD1 4.37Å; L284-L303 HydrophobicContact CG-CD1 4.04Å; S301-L303 WeakPolarHBondContact OG-CB 3.38Å; S301-L303 PolarHBondContact OG-N 3.1Å; S301-L303 VanDerWaalsContact OG-N 3.07Å; L303-V305 VanDerWaalsContact C-N 3.28Å; L303-V305 PolarHBondContact O-N 3.3Å; L303-F306 WeakPolarHBondContact O-CB 3.35Å; L303-F306 PolarHBondContact O-N 2.9Å; L303-A307 PolarHBondContact O-N 3.23Å; L303-M365 HydrophobicContact CD2-CB 4.01Å; L303-M365 HydrophobicContact CD2-CG 4.06Å; L303-M365 HydrophobicContact CG-SD 4.36Å; L303-E367 HydrophobicContact CB-CG 4.09Å; L303-E367 HydrophobicContact CD2-CG 4.29Å; L303-L400 HydrophobicContact CD2-CD2 4.35Å
304	P	97.8	Very high	96.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-65.4	-31.8	176.2	24.9	-33.8	0	0	0	113	S301 A307 H308 V315 V341 M365	S301-P304 WeakPolarHBondContact O-CD 3.29Å; P304-A307 PolarHBondContact O-N 3.41Å; P304-H308 PolarHBondContact O-N 3.38Å; P304-H308 VanDerWaalsContact O-N 3.09Å; P304-V315 HydrophobicContact CB-CG1 3.74Å; P304-V341 HydrophobicContact CB-CG1 3.91Å; P304-V341 HydrophobicContact CB-CG2 4.34Å; P304-V341 WeakPolarHBondContact O-CG2 3.39Å; P304-M365 HydrophobicContact CB-CE 4.1Å
305	V	97.7	Very high	96.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.3	-42.2	174.5	-172.8	0	0	0	0	110	L98 L302 L303 H308 M309 I328 L332	L98-V305 HydrophobicContact CD1-CG1 3.75Å; L302-V305 WeakPolarHBondContact O-CA 3.39Å; L302-V305 WeakPolarHBondContact O-CB 3.48Å; L302-V305 PolarHBondContact O-N 2.88Å; L303-V305 VanDerWaalsContact C-N 3.28Å; L303-V305 PolarHBondContact O-N 3.3Å; V305-H308 PolarHBondContact O-N 2.93Å; V305-M309 HydrophobicContact CG1-SD 4.25Å; V305-M309 VanDerWaalsContact O-CG 3.3Å; V305-M309 WeakPolarHBondContact O-CG 3.48Å; V305-M309 PolarHBondContact O-N 3.37Å; V305-I328 HydrophobicContact CG2-CG2 4.29Å; V305-L332 HydrophobicContact CG1-CD2 4.13Å; V305-L332 HydrophobicContact CG2-CD2 3.99Å; V305-L332 HydrophobicContact CG2-CG 4.41Å
306	F	97.7	Very high	96.9	Very high	7 Å²	7	17.6 Å²	17.6	3%	0.031	10%	0.096	C	C	.	.	H	α-helix	trans	-63.3	-45	176	-56.4	-27.7	0	0	0	112	V93 L98 T277 V281 L284 L302 L303 H308 M309 L310	V93-F306 HydrophobicContact CG2-CD1 3.56Å; V93-F306 HydrophobicContact CG2-CE1 3.79Å; V93-F306 HydrophobicContact CG2-CG 4.26Å; L98-F306 HydrophobicContact CD2-CE1 3.92Å; T277-F306 HydrophobicContact CG2-CE2 3.78Å; T277-F306 HydrophobicContact CG2-CZ 3.79Å; V281-F306 HydrophobicContact CG2-CD2 4.42Å; V281-F306 HydrophobicContact CG2-CG 4.48Å; L284-F306 HydrophobicContact CD1-CB 3.87Å; L302-F306 HydrophobicContact CB-CE1 4.09Å; L302-F306 HydrophobicContact CB-CE2 3.86Å; L302-F306 HydrophobicContact CB-CZ 3.6Å; L302-F306 HydrophobicContact CD1-CZ 4.24Å; L302-F306 WeakPolarHBondContact O-CG 3.25Å; L302-F306 PolarHBondContact O-N 3.24Å; L303-F306 WeakPolarHBondContact O-CB 3.35Å; L303-F306 PolarHBondContact O-N 2.9Å; F306-H308 VanDerWaalsContact C-N 3.3Å; F306-H308 PolarHBondContact O-N 3.43Å; F306-M309 WeakPolarHBondContact O-CB 3.43Å; F306-M309 PolarHBondContact O-N 3.02Å; F306-M309 VanDerWaalsContact O-N 3.09Å; F306-L310 VanDerWaalsContact O-CG 3.28Å; F306-L310 WeakPolarHBondContact O-CG 3.45Å; F306-L310 PolarHBondContact O-N 2.97Å
307	A	97.5	Very high	96.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.4	-40.5	176.7	0	0	0	0	0	112.4	L284 L288 L303 P304 L310 G311 A312 V315 M365	L284-A307 HydrophobicContact CD1-CB 4.3Å; L284-A307 HydrophobicContact CD2-CB 4.38Å; L288-A307 HydrophobicContact CD1-CB 4.16Å; L303-A307 PolarHBondContact O-N 3.23Å; P304-A307 PolarHBondContact O-N 3.41Å; A307-L310 PolarHBondContact O-N 2.81Å; A307-G311 PolarHBondContact O-N 3.24Å; A307-A312 WeakPolarHBondContact O-CB 3.18Å; A307-A312 PolarHBondContact O-N 2.63Å; A307-V315 HydrophobicContact CB-CG2 4.28Å; A307-M365 HydrophobicContact CB-CE 3.56Å; A307-M365 HydrophobicContact CB-SD 3.8Å
308	H	96.9	Very high	96.9	Very high	53 Å²	53	17.5 Å²	17.5	25%	0.245	10%	0.096	C	C	.	.	H	α-helix	trans	-64	-42.5	173.8	173.2	65	0	0	0	111.9	P304 V305 F306 L310 G311 V315 G340 V341	P304-H308 PolarHBondContact O-N 3.38Å; P304-H308 VanDerWaalsContact O-N 3.09Å; V305-H308 PolarHBondContact O-N 2.93Å; F306-H308 VanDerWaalsContact C-N 3.3Å; F306-H308 PolarHBondContact O-N 3.43Å; H308-L310 PolarHBondContact O-N 3.36Å; H308-G311 PolarHBondContact O-N 2.76Å; H308-V315 HydrophobicContact CB-CG2 4.01Å; H308-G340 VanDerWaalsContact CE1-CA 3.49Å; H308-G340 WeakPolarHBondContact CE1-CA 3.39Å; H308-G340 PolarHBondContact ND1-O 3.09Å; H308-V341 HydrophobicContact CB-CG2 3.98Å
309	M	95.4	Very high	96.8	Very high	34 Å²	34	17.5 Å²	17.5	17%	0.167	10%	0.096	C	C	.	.	H	α-helix	trans	-63.4	-30.6	176.5	-72.6	176	69.5	0	0	113.2	V93 A96 L98 V305 F306 G311 K337	V93-M309 HydrophobicContact CB-CE 3.82Å; V93-M309 HydrophobicContact CB-SD 4.48Å; V93-M309 HydrophobicContact CG1-CB 4.32Å; V93-M309 HydrophobicContact CG1-CE 4.49Å; V93-M309 HydrophobicContact CG2-CE 4.29Å; A96-M309 HydrophobicContact CB-CE 3.57Å; L98-M309 HydrophobicContact CD1-SD 4.02Å; V305-M309 HydrophobicContact CG1-SD 4.25Å; V305-M309 VanDerWaalsContact O-CG 3.3Å; V305-M309 WeakPolarHBondContact O-CG 3.48Å; V305-M309 PolarHBondContact O-N 3.37Å; F306-M309 WeakPolarHBondContact O-CB 3.43Å; F306-M309 PolarHBondContact O-N 3.02Å; F306-M309 VanDerWaalsContact O-N 3.09Å; M309-G311 VanDerWaalsContact C-N 3.26Å; M309-G311 PolarHBondContact O-N 3.26Å; M309-K337 HydrophobicContact CG-CD 3.91Å; M309-K337 VanDerWaalsContact CG-CE 3.48Å; M309-K337 HydrophobicContact SD-CD 4.38Å
310	L	96	Very high	96.4	Very high	35 Å²	35	20.9 Å²	20.9	18%	0.183	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	3.5	177.9	-66.2	172.9	0	0	0	113.6	V93 E94 V281 L284 R285 L288 F306 A307 H308	V93-L310 HydrophobicContact CG1-CD2 3.93Å; V93-L310 HydrophobicContact CG1-CG 4.16Å; E94-L310 HydrophobicContact CB-CD2 4.44Å; E94-L310 HydrophobicContact CG-CD2 3.45Å; E94-L310 VanDerWaalsContact CG-CD2 3.45Å; V281-L310 HydrophobicContact CG1-CD1 4.4Å; V281-L310 HydrophobicContact CG1-CD2 4.42Å; L284-L310 HydrophobicContact CB-CD1 3.52Å; L284-L310 HydrophobicContact CD1-CD1 4.03Å; L284-L310 HydrophobicContact CG-CD1 4.46Å; R285-L310 HydrophobicContact CG-CD1 4.18Å; R285-L310 HydrophobicContact CG-CD2 3.96Å; L288-L310 HydrophobicContact CD1-CB 3.81Å; L288-L310 HydrophobicContact CD1-CD1 4.15Å; F306-L310 VanDerWaalsContact O-CG 3.28Å; F306-L310 WeakPolarHBondContact O-CG 3.45Å; F306-L310 PolarHBondContact O-N 2.97Å; A307-L310 PolarHBondContact O-N 2.81Å; H308-L310 PolarHBondContact O-N 3.36Å
311	G	95.1	Very high	96.2	Very high	48 Å²	48	23 Å²	23	50%	0.495	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	18.2	170.1	0	0	0	0	0	115.7	A307 H308 M309 K313	A307-G311 PolarHBondContact O-N 3.24Å; H308-G311 PolarHBondContact O-N 2.76Å; M309-G311 VanDerWaalsContact C-N 3.26Å; M309-G311 PolarHBondContact O-N 3.26Å; G311-K313 PolarHBondContact O-N 2.87Å
312	A	97.2	Very high	96.1	Very high	9 Å²	9	30.9 Å²	30.9	7%	0.074	16%	0.158	C	C	.	.			trans	-57	135.3	171	0	0	0	0	0	111.3	L288 A307 K314 V315	L288-A312 HydrophobicContact CD2-CB 4.2Å; A307-A312 WeakPolarHBondContact O-CB 3.18Å; A307-A312 PolarHBondContact O-N 2.63Å; A312-K314 VanDerWaalsContact C-N 3.27Å; A312-K314 PolarHBondContact O-N 2.86Å; A312-V315 HydrophobicContact CB-CG2 3.71Å
313	K	96.9	Very high	95.9	Very high	115 Å²	115	33.9 Å²	33.9	50%	0.5	17%	0.173	S	C	.	.	S	Bend	trans	-52.8	-45.9	179.8	-172.6	-166.1	174.3	-157.7	0	111.9	E290 S292 V293 G311 E359	E290-K313 WeakPolarHBondContact O-CB 3.33Å; S292-K313 VanDerWaalsContact O-CB 3.28Å; S292-K313 WeakPolarHBondContact O-CB 2.86Å; S292-K313 PolarHBondContact O-N 2.8Å; V293-K313 HydrophobicContact CG2-CD 4.42Å; G311-K313 PolarHBondContact O-N 2.87Å; K313-E359 IonicContact NZ-OE1 2.78Å; K313-E359 PolarHBondContact NZ-OE1 2.88Å; K313-E359 IonicContact NZ-OE2 3.45Å; K313-E359 PolarHBondContact NZ-OE2 3.42Å
314	K	97.8	Very high	95.7	Very high	46 Å²	46	34.1 Å²	34.1	20%	0.2	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	135.5	-176.4	-173.9	66.7	177.5	171.9	0	109.6	S292 V293 C294 A312 F316 E342	S292-K314 PolarHBondContact O-N 3.02Å; V293-K314 WeakPolarHBondContact CA-O 2.81Å; V293-K314 HydrophobicContact CG1-CB 4.5Å; V293-K314 HydrophobicContact CG2-CB 4.41Å; C294-K314 PolarHBondContact N-O 2.87Å; A312-K314 VanDerWaalsContact C-N 3.27Å; A312-K314 PolarHBondContact O-N 2.86Å; K314-F316 HydrophobicContact CB-CE2 4.48Å; K314-F316 HydrophobicContact CD-CE2 4.39Å; K314-F316 HydrophobicContact CD-CZ 4.32Å; K314-F316 VanDerWaalsContact CE-CZ 3.49Å; K314-F316 HydrophobicContact CG-CD2 4.13Å; K314-F316 HydrophobicContact CG-CE2 3.42Å; K314-F316 VanDerWaalsContact CG-CE2 3.42Å; K314-F316 HydrophobicContact CG-CZ 3.76Å; K314-E342 WeakPolarHBondContact CE-OE2 3.24Å; K314-E342 IonicContact NZ-OE2 3.97Å; K314-E342 PolarHBondContact NZ-OE2 2.88Å
315	V	98.5	Very high	95.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.7	178.4	-171.2	0	0	0	0	110	C294 P304 A307 H308 A312 V341 E342 M365	C294-V315 HydrophobicContact CB-CG1 4.21Å; C294-V315 HydrophobicContact CB-CG2 4.26Å; C294-V315 WeakPolarHBondContact O-CA 3.38Å; P304-V315 HydrophobicContact CB-CG1 3.74Å; A307-V315 HydrophobicContact CB-CG2 4.28Å; H308-V315 HydrophobicContact CB-CG2 4.01Å; A312-V315 HydrophobicContact CB-CG2 3.71Å; V315-V341 HydrophobicContact CB-CG1 4.49Å; V315-V341 HydrophobicContact CB-CG2 4.24Å; V315-V341 HydrophobicContact CG1-CG1 4.12Å; V315-V341 HydrophobicContact CG1-CG2 4.2Å; V315-E342 PolarHBondContact O-N 3.38Å; V315-M365 HydrophobicContact CG1-CE 3.84Å
316	F	98.5	Very high	95.6	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	148.7	170.8	-59.5	-91.4	0	0	0	109.2	V293 C294 L295 S296 K314 E342 L344 L356	V293-F316 HydrophobicContact CG1-CD2 4.37Å; V293-F316 HydrophobicContact CG1-CE2 4.01Å; C294-F316 PolarHBondContact O-N 2.56Å; L295-F316 CarbonylContact C-O 3.46Å; L295-F316 WeakPolarHBondContact CA-O 3.37Å; L295-F316 HydrophobicContact CD1-CB 3.53Å; S296-F316 PolarHBondContact N-O 3.41Å; K314-F316 HydrophobicContact CB-CE2 4.48Å; K314-F316 HydrophobicContact CD-CE2 4.39Å; K314-F316 HydrophobicContact CD-CZ 4.32Å; K314-F316 VanDerWaalsContact CE-CZ 3.49Å; K314-F316 HydrophobicContact CG-CD2 4.13Å; K314-F316 HydrophobicContact CG-CE2 3.42Å; K314-F316 VanDerWaalsContact CG-CE2 3.42Å; K314-F316 HydrophobicContact CG-CZ 3.76Å; F316-E342 CarbonylContact C-O 3.51Å; F316-E342 VanDerWaalsContact CA-O 3.27Å; F316-E342 WeakPolarHBondContact CA-O 3.31Å; F316-E342 HydrophobicContact CD1-CB 3.7Å; F316-E342 HydrophobicContact CD1-CG 3.88Å; F316-E342 HydrophobicContact CE1-CB 4.07Å; F316-E342 HydrophobicContact CE1-CG 4.04Å; F316-E342 VanDerWaalsContact CE1-OE2 3.32Å; F316-E342 WeakPolarHBondContact CE1-OE2 3.36Å; F316-E342 HydrophobicContact CG-CB 4.5Å; F316-L344 HydrophobicContact CD1-CD1 4.04Å; F316-L356 HydrophobicContact CB-CD2 4.43Å; F316-L356 HydrophobicContact CD1-CD2 3.94Å; F316-L356 HydrophobicContact CD2-CD2 3.84Å; F316-L356 HydrophobicContact CE1-CD2 4.07Å; F316-L356 HydrophobicContact CE2-CD2 3.96Å; F316-L356 HydrophobicContact CG-CD2 3.82Å; F316-L356 HydrophobicContact CZ-CB 4.4Å; F316-L356 HydrophobicContact CZ-CD2 4.07Å
317	S	97.9	Very high	95.5	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.3	168.5	-161.2	0	0	0	0	109.5	E319 E342 L344	S317-E319 PolarHBondContact OG-OE1 2.92Å; S317-E342 PolarHBondContact N-O 2.92Å; S317-L344 PolarHBondContact O-N 2.97Å
318	L	97.3	Very high	95.5	Very high	2 Å²	2	38 Å²	38	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123	169.4	-54.1	-173.7	0	0	0	108.9	L295 S296 V297 L344 P348 L351	L295-L318 HydrophobicContact CD1-CD2 3.95Å; L295-L318 HydrophobicContact CD1-CG 3.93Å; L295-L318 HydrophobicContact CD2-CD1 4.49Å; S296-L318 PolarHBondContact O-N 2.85Å; V297-L318 HydrophobicContact CG2-CD1 4.03Å; V297-L318 HydrophobicContact CG2-CG 4.36Å; L318-L344 WeakPolarHBondContact CA-O 3.42Å; L318-L344 HydrophobicContact CD2-CB 3.88Å; L318-L344 HydrophobicContact CD2-CD1 4.04Å; L318-P348 HydrophobicContact CD1-CB 4.27Å; L318-P348 HydrophobicContact CD1-CG 3.99Å; L318-L351 HydrophobicContact CD2-CD1 4.2Å; L318-L351 HydrophobicContact CD2-CD2 4.27Å
319	E	94.4	Very high	95.4	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.199	C	C	.	.			trans	-116.8	119.1	177.7	-64.7	-66	152.9	0	0	109.6	G300 S317 S321 S324 K325 L343 L344	G300-E319 PolarHBondContact N-OE2 3.31Å; S317-E319 PolarHBondContact OG-OE1 2.92Å; E319-S321 PolarHBondContact O-N 2.79Å; E319-S324 WeakPolarHBondContact OE2-CB 3.17Å; E319-S324 PolarHBondContact OE2-OG 2.88Å; E319-K325 HydrophobicContact CB-CB 3.9Å; E319-K325 HydrophobicContact CG-CB 4.02Å; E319-L343 HydrophobicContact CG-CD2 4.48Å; E319-L344 PolarHBondContact N-O 2.9Å
320	N	87.1	Confident	95.5	Very high	82 Å²	82	40.7 Å²	40.7	44%	0.439	21%	0.205	S	C	.	.	S	Bend	trans	-76.5	-9.2	-179.2	-69	-41.6	0	0	0	113.6	D299	D299-N320 WeakPolarHBondContact OD1-CB 3.48Å; D299-N320 PolarHBondContact OD1-ND2 3.1Å
321	S	90.2	Very high	95.5	Very high	46 Å²	46	39 Å²	39	32%	0.322	20%	0.196	S	C	.	.			trans	-133.9	132.7	-178.5	168.4	0	0	0	0	110.7	E319 M323 S324 K325	E319-S321 PolarHBondContact O-N 2.79Å; S321-M323 PolarHBondContact O-N 3.23Å; S321-M323 PolarHBondContact OG-N 3.05Å; S321-S324 WeakPolarHBondContact O-CB 3.44Å; S321-S324 PolarHBondContact O-N 2.68Å; S321-S324 VanDerWaalsContact O-N 3.12Å; S321-S324 PolarHBondContact OG-N 2.87Å; S321-K325 PolarHBondContact O-N 3.39Å
322	R	93.6	Very high	95.6	Very high	166 Å²	166	37 Å²	37	63%	0.626	17%	0.174	S	C	*	.	H	α-helix	trans	-56.1	-37.6	173	-173.3	173.2	177.2	-177.8	1.7	112.5	Q326 E345	R322-Q326 WeakPolarHBondContact O-CB 3.33Å; R322-Q326 VanDerWaalsContact O-CG 3.29Å; R322-Q326 WeakPolarHBondContact O-CG 3.33Å; R322-Q326 PolarHBondContact O-N 2.76Å; R322-E345 VanDerWaalsContact CA-OE1 3.23Å; R322-E345 WeakPolarHBondContact CA-OE1 3.29Å; R322-E345 WeakPolarHBondContact CB-OE1 3.24Å; R322-E345 WeakPolarHBondContact CG-OE1 3.43Å
323	M	93.8	Very high	95.6	Very high	66 Å²	66	42 Å²	42	33%	0.325	20%	0.195	S	C	.	.	H	α-helix	trans	-68.7	-40.8	179.1	-64.3	175	61.2	0	0	111.1	L261 V262 S321 Q326 V327	L261-M323 HydrophobicContact CB-CE 3.53Å; L261-M323 HydrophobicContact CD1-CE 3.56Å; L261-M323 HydrophobicContact CG-CE 4.18Å; V262-M323 HydrophobicContact CG1-CB 3.57Å; V262-M323 HydrophobicContact CG1-CE 4.22Å; S321-M323 PolarHBondContact O-N 3.23Å; S321-M323 PolarHBondContact OG-N 3.05Å; M323-Q326 PolarHBondContact O-N 2.87Å; M323-V327 WeakPolarHBondContact O-CG2 3.15Å; M323-V327 PolarHBondContact O-N 2.69Å
324	S	93.5	Very high	95.6	Very high	5 Å²	5	38.1 Å²	38.1	4%	0.035	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-47.5	175.8	-175.1	0	0	0	0	111.2	G300 E319 S321 Q326 V327 I328	G300-S324 WeakPolarHBondContact CA-OG 3.18Å; G300-S324 PolarHBondContact N-OG 3.1Å; E319-S324 WeakPolarHBondContact OE2-CB 3.17Å; E319-S324 PolarHBondContact OE2-OG 2.88Å; S321-S324 WeakPolarHBondContact O-CB 3.44Å; S321-S324 PolarHBondContact O-N 2.68Å; S321-S324 VanDerWaalsContact O-N 3.12Å; S321-S324 PolarHBondContact OG-N 2.87Å; S324-Q326 PolarHBondContact O-N 2.87Å; S324-V327 PolarHBondContact O-N 2.91Å; S324-I328 PolarHBondContact O-N 3.41Å; S324-I328 VanDerWaalsContact O-N 3.08Å
325	K	95.4	Very high	95.5	Very high	37 Å²	37	36.9 Å²	36.9	16%	0.161	18%	0.18	C	C	.	.	H	α-helix	trans	-53.9	-50.5	172.9	170.5	173.8	168.4	-178.5	0	112.1	E319 S321 V327 I328 E329 L343 E345	E319-K325 HydrophobicContact CB-CB 3.9Å; E319-K325 HydrophobicContact CG-CB 4.02Å; S321-K325 PolarHBondContact O-N 3.39Å; K325-V327 VanDerWaalsContact C-N 3.29Å; K325-V327 PolarHBondContact O-N 3.2Å; K325-I328 PolarHBondContact O-N 3.13Å; K325-I328 VanDerWaalsContact O-N 3.11Å; K325-E329 WeakPolarHBondContact CE-OE1 3.24Å; K325-E329 HydrophobicContact CG-CG 4.29Å; K325-E329 WeakPolarHBondContact O-CG 3.32Å; K325-E329 PolarHBondContact O-N 2.93Å; K325-L343 HydrophobicContact CD-CB 4.14Å; K325-L343 HydrophobicContact CG-CB 3.94Å; K325-L343 HydrophobicContact CG-CD1 4.05Å; K325-E345 HydrophobicContact CD-CG 3.54Å; K325-E345 WeakPolarHBondContact CD-OE2 3.08Å; K325-E345 IonicContact NZ-OE2 3.19Å; K325-E345 PolarHBondContact NZ-OE2 3.29Å
326	Q	95.9	Very high	95.3	Very high	52 Å²	52	42.5 Å²	42.5	24%	0.243	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-40.1	-179.6	-77.4	178.8	-25.8	0	0	112.1	Q258 R322 M323 S324 I328 E329 E330	Q258-Q326 VanDerWaalsContact OE1-CB 3.24Å; R322-Q326 WeakPolarHBondContact O-CB 3.33Å; R322-Q326 VanDerWaalsContact O-CG 3.29Å; R322-Q326 WeakPolarHBondContact O-CG 3.33Å; R322-Q326 PolarHBondContact O-N 2.76Å; M323-Q326 PolarHBondContact O-N 2.87Å; S324-Q326 PolarHBondContact O-N 2.87Å; Q326-I328 PolarHBondContact O-N 3.37Å; Q326-E329 WeakPolarHBondContact O-CB 3.2Å; Q326-E329 PolarHBondContact O-N 3.21Å; Q326-E330 WeakPolarHBondContact O-CG 3.38Å; Q326-E330 PolarHBondContact O-N 3.06Å
327	V	96.3	Very high	95.1	Very high	1 Å²	1	45 Å²	45	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-43.1	175.2	171.8	0	0	0	0	111.5	Q258 A259 V262 W263 M323 S324 K325 E330 V331	Q258-V327 HydrophobicContact CB-CG2 3.8Å; A259-V327 HydrophobicContact CB-CG1 4.18Å; A259-V327 HydrophobicContact CB-CG2 4.3Å; V262-V327 HydrophobicContact CG2-CB 4.44Å; V262-V327 HydrophobicContact CG2-CG2 3.87Å; W263-V327 HydrophobicContact CE3-CG1 4.36Å; W263-V327 HydrophobicContact CH2-CG1 3.29Å; W263-V327 HydrophobicContact CZ2-CG1 3.54Å; W263-V327 HydrophobicContact CZ3-CG1 3.74Å; M323-V327 WeakPolarHBondContact O-CG2 3.15Å; M323-V327 PolarHBondContact O-N 2.69Å; S324-V327 PolarHBondContact O-N 2.91Å; K325-V327 VanDerWaalsContact C-N 3.29Å; K325-V327 PolarHBondContact O-N 3.2Å; V327-E330 PolarHBondContact O-N 3.03Å; V327-V331 WeakPolarHBondContact O-CG2 3.36Å; V327-V331 PolarHBondContact O-N 3.12Å
328	I	96.9	Very high	94.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.2	-35.1	176.5	-57.5	-54.4	0	0	0	111.9	W263 S301 L302 V305 S324 K325 Q326 E330 V331 L332 L343	W263-I328 HydrophobicContact CZ2-CD1 4.04Å; S301-I328 WeakPolarHBondContact O-CD1 3.4Å; L302-I328 HydrophobicContact CD2-CD1 4.17Å; V305-I328 HydrophobicContact CG2-CG2 4.29Å; S324-I328 PolarHBondContact O-N 3.41Å; S324-I328 VanDerWaalsContact O-N 3.08Å; K325-I328 PolarHBondContact O-N 3.13Å; K325-I328 VanDerWaalsContact O-N 3.11Å; Q326-I328 PolarHBondContact O-N 3.37Å; I328-E330 VanDerWaalsContact C-N 3.34Å; I328-E330 PolarHBondContact O-N 3.35Å; I328-V331 PolarHBondContact O-N 3.25Å; I328-L332 HydrophobicContact CG2-CD1 4.3Å; I328-L332 WeakPolarHBondContact O-CG 3.15Å; I328-L332 PolarHBondContact O-N 2.93Å; I328-L343 HydrophobicContact CB-CD1 4.11Å; I328-L343 HydrophobicContact CB-CD2 4.44Å; I328-L343 HydrophobicContact CG2-CD1 4.02Å; I328-L343 HydrophobicContact CG2-CD2 3.86Å
329	E	96.6	Very high	94.4	Very high	83 Å²	83	55.2 Å²	55.2	39%	0.388	29%	0.292	S	S	.	.	H	α-helix	trans	-58.9	-44.9	171.3	-70.5	176.7	161.9	0	0	111.4	K325 Q326 V331 L332 E333 L343	K325-E329 WeakPolarHBondContact CE-OE1 3.24Å; K325-E329 HydrophobicContact CG-CG 4.29Å; K325-E329 WeakPolarHBondContact O-CG 3.32Å; K325-E329 PolarHBondContact O-N 2.93Å; Q326-E329 WeakPolarHBondContact O-CB 3.2Å; Q326-E329 PolarHBondContact O-N 3.21Å; E329-V331 VanDerWaalsContact C-N 3.34Å; E329-V331 PolarHBondContact O-N 2.87Å; E329-L332 PolarHBondContact O-N 2.94Å; E329-E333 WeakPolarHBondContact O-CB 3.34Å; E329-E333 PolarHBondContact O-N 3.02Å; E329-L343 HydrophobicContact CB-CD1 4.42Å; E329-L343 HydrophobicContact CG-CD1 3.41Å; E329-L343 VanDerWaalsContact CG-CD1 3.41Å
330	E	96.3	Very high	94.4	Very high	60 Å²	60	56 Å²	56	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-38.5	176.1	-73.2	-176.4	-165.9	0	0	112.2	P101 Q326 V327 I328 E333 A334	P101-E330 HydrophobicContact CB-CB 4.12Å; P101-E330 HydrophobicContact CG-CB 4.07Å; Q326-E330 WeakPolarHBondContact O-CG 3.38Å; Q326-E330 PolarHBondContact O-N 3.06Å; V327-E330 PolarHBondContact O-N 3.03Å; I328-E330 VanDerWaalsContact C-N 3.34Å; I328-E330 PolarHBondContact O-N 3.35Å; E330-E333 PolarHBondContact O-N 3.01Å; E330-A334 VanDerWaalsContact O-CB 3.3Å; E330-A334 WeakPolarHBondContact O-CB 3.44Å; E330-A334 PolarHBondContact O-N 3.11Å
331	V	96.9	Very high	94.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-46.9	173.5	173	0	0	0	0	110.9	L98 P101 L302 V327 I328 E329 E333 N335	L98-V331 HydrophobicContact CD1-CG1 4.22Å; L98-V331 HydrophobicContact CD2-CG1 4.18Å; L98-V331 HydrophobicContact CG-CG1 4.48Å; P101-V331 HydrophobicContact CG-CB 4.37Å; P101-V331 HydrophobicContact CG-CG2 3.69Å; L302-V331 HydrophobicContact CD2-CG1 4.02Å; L302-V331 HydrophobicContact CD2-CG2 4.24Å; V327-V331 WeakPolarHBondContact O-CG2 3.36Å; V327-V331 PolarHBondContact O-N 3.12Å; I328-V331 PolarHBondContact O-N 3.25Å; E329-V331 VanDerWaalsContact C-N 3.34Å; E329-V331 PolarHBondContact O-N 2.87Å; V331-E333 VanDerWaalsContact C-N 3.34Å; V331-E333 PolarHBondContact O-N 3.12Å; V331-N335 PolarHBondContact O-N 2.93Å; V331-N335 PolarHBondContact O-ND2 3.17Å
332	L	97.1	Very high	95.2	Very high	5 Å²	5	52 Å²	52	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-41.1	178.1	-69.8	165.1	0	0	0	111.5	V305 I328 E329 N335 S336 K337 K338 V341 L343	V305-L332 HydrophobicContact CG1-CD2 4.13Å; V305-L332 HydrophobicContact CG2-CD2 3.99Å; V305-L332 HydrophobicContact CG2-CG 4.41Å; I328-L332 HydrophobicContact CG2-CD1 4.3Å; I328-L332 WeakPolarHBondContact O-CG 3.15Å; I328-L332 PolarHBondContact O-N 2.93Å; E329-L332 PolarHBondContact O-N 2.94Å; L332-N335 PolarHBondContact O-N 3.17Å; L332-S336 PolarHBondContact O-N 3.43Å; L332-K337 HydrophobicContact CD2-CB 3.94Å; L332-K337 CarbonylContact O-C 3.49Å; L332-K337 WeakPolarHBondContact O-CA 3.39Å; L332-K337 PolarHBondContact O-N 3.4Å; L332-K338 PolarHBondContact O-N 2.76Å; L332-V341 HydrophobicContact CD1-CB 3.99Å; L332-V341 HydrophobicContact CD2-CB 4.36Å; L332-V341 HydrophobicContact CD2-CG2 4.01Å; L332-L343 HydrophobicContact CD1-CD1 4.24Å
333	E	96.6	Very high	95.4	Very high	114 Å²	114	44.9 Å²	44.9	53%	0.533	25%	0.249	S	C	.	.	H	α-helix	trans	-65	-47.7	178.7	-175.3	158.9	155.2	0	0	112	E329 E330 V331 N335 S336 K338	E329-E333 WeakPolarHBondContact O-CB 3.34Å; E329-E333 PolarHBondContact O-N 3.02Å; E330-E333 PolarHBondContact O-N 3.01Å; V331-E333 VanDerWaalsContact C-N 3.34Å; V331-E333 PolarHBondContact O-N 3.12Å; E333-N335 PolarHBondContact O-N 2.78Å; E333-S336 PolarHBondContact O-N 2.96Å; E333-S336 VanDerWaalsContact O-N 3.11Å; E333-K338 IonicContact OE2-NZ 3.89Å; E333-K338 PolarHBondContact OE2-NZ 3.35Å
334	A	96.1	Very high	95.5	Very high	33 Å²	33	42.7 Å²	42.7	27%	0.273	24%	0.238	S	C	.	.	H	α-helix	trans	-58.8	-23.4	177.9	0	0	0	0	0	113.4	P101 E330	P101-A334 HydrophobicContact CB-CB 4.43Å; E330-A334 VanDerWaalsContact O-CB 3.3Å; E330-A334 WeakPolarHBondContact O-CB 3.44Å; E330-A334 PolarHBondContact O-N 3.11Å
335	N	96	Very high	95.6	Very high	21 Å²	21	47 Å²	47	11%	0.112	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	13.2	-177.4	-70.8	-82.1	0	0	0	113.8	L98 V99 V331 L332 E333 K337	L98-N335 WeakPolarHBondContact CA-OD1 3.33Å; L98-N335 HydrophobicContact CD1-CB 3.95Å; L98-N335 WeakPolarHBondContact CD1-ND2 3.5Å; V99-N335 WeakPolarHBondContact CG2-OD1 3.19Å; V99-N335 PolarHBondContact N-OD1 2.96Å; V99-N335 PolarHBondContact O-ND2 3.19Å; V331-N335 PolarHBondContact O-N 2.93Å; V331-N335 PolarHBondContact O-ND2 3.17Å; L332-N335 PolarHBondContact O-N 3.17Å; E333-N335 PolarHBondContact O-N 2.78Å; N335-K337 HydrophobicContact CB-CD 4.27Å; N335-K337 WeakPolarHBondContact O-CG 3.34Å; N335-K337 PolarHBondContact O-N 2.91Å
336	S	95.1	Very high	95.5	Very high	118 Å²	118	47.1 Å²	47.1	83%	0.825	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	33.2	-178.1	-56.3	0	0	0	0	113.6	L332 E333	L332-S336 PolarHBondContact O-N 3.43Å; E333-S336 PolarHBondContact O-N 2.96Å; E333-S336 VanDerWaalsContact O-N 3.11Å
337	K	93.8	Very high	95.4	Very high	54 Å²	54	52.2 Å²	52.2	24%	0.235	28%	0.277	C	S	.	.			trans	-115.8	20.8	-178.7	-71.7	172.7	-170.7	-58.3	0	112.4	M309 L332 N335 G339 G340	M309-K337 HydrophobicContact CG-CD 3.91Å; M309-K337 VanDerWaalsContact CG-CE 3.48Å; M309-K337 HydrophobicContact SD-CD 4.38Å; L332-K337 HydrophobicContact CD2-CB 3.94Å; L332-K337 CarbonylContact O-C 3.49Å; L332-K337 WeakPolarHBondContact O-CA 3.39Å; L332-K337 PolarHBondContact O-N 3.4Å; N335-K337 HydrophobicContact CB-CD 4.27Å; N335-K337 WeakPolarHBondContact O-CG 3.34Å; N335-K337 PolarHBondContact O-N 2.91Å; K337-G339 PolarHBondContact O-N 3.03Å; K337-G340 PolarHBondContact O-N 2.87Å
338	K	91.7	Very high	95.3	Very high	154 Å²	154	52.4 Å²	52.4	67%	0.67	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	126.2	179.7	-169.4	167.9	-169.1	151.7	0	110.5	L332 E333 G340	L332-K338 PolarHBondContact O-N 2.76Å; E333-K338 IonicContact OE2-NZ 3.89Å; E333-K338 PolarHBondContact OE2-NZ 3.35Å; K338-G340 VanDerWaalsContact C-N 3.26Å; K338-G340 PolarHBondContact O-N 2.85Å
339	G	89.7	Confident	95.2	Very high	61 Å²	61	57.7 Å²	57.7	63%	0.629	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-0.9	-176	0	0	0	0	0	115.3	K337 V341	K337-G339 PolarHBondContact O-N 3.03Å; G339-V341 VanDerWaalsContact C-N 3.28Å; G339-V341 PolarHBondContact O-N 3.25Å
340	G	93.3	Very high	95.2	Very high	17 Å²	17	59.4 Å²	59.4	18%	0.175	31%	0.311	C	S	.	.	S	Bend	trans	-68.9	-26.5	174.4	0	0	0	0	0	113.5	H308 K337 K338	H308-G340 VanDerWaalsContact CE1-CA 3.49Å; H308-G340 WeakPolarHBondContact CE1-CA 3.39Å; H308-G340 PolarHBondContact ND1-O 3.09Å; K337-G340 PolarHBondContact O-N 2.87Å; K338-G340 VanDerWaalsContact C-N 3.26Å; K338-G340 PolarHBondContact O-N 2.85Å
341	V	97.6	Very high	95.2	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.036	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.7	170.9	-179.3	0	0	0	0	108.4	P304 H308 V315 L332 G339 L343	P304-V341 HydrophobicContact CB-CG1 3.91Å; P304-V341 HydrophobicContact CB-CG2 4.34Å; P304-V341 WeakPolarHBondContact O-CG2 3.39Å; H308-V341 HydrophobicContact CB-CG2 3.98Å; V315-V341 HydrophobicContact CB-CG1 4.49Å; V315-V341 HydrophobicContact CB-CG2 4.24Å; V315-V341 HydrophobicContact CG1-CG1 4.12Å; V315-V341 HydrophobicContact CG1-CG2 4.2Å; L332-V341 HydrophobicContact CD1-CB 3.99Å; L332-V341 HydrophobicContact CD2-CB 4.36Å; L332-V341 HydrophobicContact CD2-CG2 4.01Å; G339-V341 VanDerWaalsContact C-N 3.28Å; G339-V341 PolarHBondContact O-N 3.25Å; V341-L343 HydrophobicContact CG1-CD2 3.75Å; V341-L343 HydrophobicContact CG1-CG 4.46Å
342	E	97.4	Very high	95.2	Very high	38 Å²	38	60.1 Å²	60.1	18%	0.178	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	109.4	175.2	-173.9	158.9	-171.5	0	0	110	K314 V315 F316 S317 L344 R357	K314-E342 WeakPolarHBondContact CE-OE2 3.24Å; K314-E342 IonicContact NZ-OE2 3.97Å; K314-E342 PolarHBondContact NZ-OE2 2.88Å; V315-E342 PolarHBondContact O-N 3.38Å; F316-E342 CarbonylContact C-O 3.51Å; F316-E342 VanDerWaalsContact CA-O 3.27Å; F316-E342 WeakPolarHBondContact CA-O 3.31Å; F316-E342 HydrophobicContact CD1-CB 3.7Å; F316-E342 HydrophobicContact CD1-CG 3.88Å; F316-E342 HydrophobicContact CE1-CB 4.07Å; F316-E342 HydrophobicContact CE1-CG 4.04Å; F316-E342 VanDerWaalsContact CE1-OE2 3.32Å; F316-E342 WeakPolarHBondContact CE1-OE2 3.36Å; F316-E342 HydrophobicContact CG-CB 4.5Å; S317-E342 PolarHBondContact N-O 2.92Å; E342-L344 HydrophobicContact CG-CD2 4.02Å; E342-R357 IonicContact OE1-CZ 3.82Å; E342-R357 IonicContact OE1-NE 3.23Å; E342-R357 PolarHBondContact OE1-NE 2.85Å; E342-R357 IonicContact OE1-NH2 2.7Å; E342-R357 PolarHBondContact OE1-NH2 2.85Å; E342-R357 IonicContact OE2-CZ 3.02Å; E342-R357 VanDerWaalsContact OE2-CZ 3.23Å; E342-R357 IonicContact OE2-NE 2.73Å; E342-R357 PolarHBondContact OE2-NE 2.74Å; E342-R357 VanDerWaalsContact OE2-NE 3.13Å; E342-R357 IonicContact OE2-NH2 2.76Å; E342-R357 PolarHBondContact OE2-NH2 3.37Å
343	L	97.4	Very high	95	Very high	18 Å²	18	63 Å²	63	9%	0.094	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.6	-175.2	-56.4	171.7	0	0	0	110.4	E319 K325 I328 E329 L332 V341	E319-L343 HydrophobicContact CG-CD2 4.48Å; K325-L343 HydrophobicContact CD-CB 4.14Å; K325-L343 HydrophobicContact CG-CB 3.94Å; K325-L343 HydrophobicContact CG-CD1 4.05Å; I328-L343 HydrophobicContact CB-CD1 4.11Å; I328-L343 HydrophobicContact CB-CD2 4.44Å; I328-L343 HydrophobicContact CG2-CD1 4.02Å; I328-L343 HydrophobicContact CG2-CD2 3.86Å; E329-L343 HydrophobicContact CB-CD1 4.42Å; E329-L343 HydrophobicContact CG-CD1 3.41Å; E329-L343 VanDerWaalsContact CG-CD1 3.41Å; L332-L343 HydrophobicContact CD1-CD1 4.24Å; V341-L343 HydrophobicContact CG1-CD2 3.75Å; V341-L343 HydrophobicContact CG1-CG 4.46Å
344	L	96.4	Very high	95	Very high	20 Å²	20	65.5 Å²	65.5	11%	0.105	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.3	-174.3	-56.1	178.2	0	0	0	110.3	F316 S317 L318 E319 E342 I346 L351	F316-L344 HydrophobicContact CD1-CD1 4.04Å; S317-L344 PolarHBondContact O-N 2.97Å; L318-L344 WeakPolarHBondContact CA-O 3.42Å; L318-L344 HydrophobicContact CD2-CB 3.88Å; L318-L344 HydrophobicContact CD2-CD1 4.04Å; E319-L344 PolarHBondContact N-O 2.9Å; E342-L344 HydrophobicContact CG-CD2 4.02Å; L344-I346 VanDerWaalsContact C-N 3.26Å; L344-I346 HydrophobicContact CB-CD1 4.45Å; L344-I346 HydrophobicContact CB-CG1 4.4Å; L344-I346 PolarHBondContact O-N 2.82Å; L344-L351 HydrophobicContact CD1-CD1 3.74Å
345	E	94.6	Very high	94.9	Very high	96 Å²	96	66.4 Å²	66.4	45%	0.449	35%	0.351	S	S	.	.			trans	-94.3	56.1	173.3	-67.6	170.5	97.5	0	0	109.5	R322 K325	R322-E345 VanDerWaalsContact CA-OE1 3.23Å; R322-E345 WeakPolarHBondContact CA-OE1 3.29Å; R322-E345 WeakPolarHBondContact CB-OE1 3.24Å; R322-E345 WeakPolarHBondContact CG-OE1 3.43Å; K325-E345 HydrophobicContact CD-CG 3.54Å; K325-E345 WeakPolarHBondContact CD-OE2 3.08Å; K325-E345 IonicContact NZ-OE2 3.19Å; K325-E345 PolarHBondContact NZ-OE2 3.29Å
346	I	93.9	Very high	94.9	Very high	38 Å²	38	65.4 Å²	65.4	20%	0.195	35%	0.346	C	S	.	.			trans	-127.5	136	-174.8	-56.5	175.7	0	0	0	107.9	L344 Q350 L351 D355	L344-I346 VanDerWaalsContact C-N 3.26Å; L344-I346 HydrophobicContact CB-CD1 4.45Å; L344-I346 HydrophobicContact CB-CG1 4.4Å; L344-I346 PolarHBondContact O-N 2.82Å; I346-Q350 HydrophobicContact CG2-CB 3.84Å; I346-L351 HydrophobicContact CD1-CD1 4.37Å; I346-L351 HydrophobicContact CG2-CB 4.41Å; I346-L351 HydrophobicContact CG2-CD1 4.4Å; I346-D355 HydrophobicContact CD1-CB 4.12Å
347	R	93.6	Very high	94.8	Very high	159 Å²	159	68 Å²	68	60%	0.6	34%	0.337	S	S	*	.			trans	-70	146.8	175.2	-61.5	-175.9	178.1	-177.9	-1.2	110.6	E349 Q350 L351	R347-E349 WeakPolarHBondContact CB-OE2 3.39Å; R347-E349 PolarHBondContact O-N 2.93Å; R347-E349 VanDerWaalsContact O-N 3.1Å; R347-Q350 HydrophobicContact CB-CG 4.31Å; R347-Q350 PolarHBondContact O-N 2.95Å; R347-L351 PolarHBondContact O-N 3.48Å
348	P	94.8	Very high	94.7	Very high	5 Å²	5	68.2 Å²	68.2	3%	0.032	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-51.1	-38.3	-179.4	-25.3	31.8	0	0	0	114	L318 Q350 L351 C385 A388 L389	L318-P348 HydrophobicContact CD1-CB 4.27Å; L318-P348 HydrophobicContact CD1-CG 3.99Å; P348-Q350 PolarHBondContact O-N 3.05Å; P348-L351 PolarHBondContact O-N 2.81Å; P348-C385 HydrophobicContact CB-CB 4.01Å; P348-C385 HydrophobicContact CG-CB 3.78Å; P348-A388 HydrophobicContact CB-CB 4.2Å; P348-L389 HydrophobicContact CB-CD1 4.31Å; P348-L389 HydrophobicContact CB-CD2 4.4Å; P348-L389 HydrophobicContact CB-CG 4.13Å
349	E	94.5	Very high	94.9	Very high	111 Å²	111	63.6 Å²	63.6	52%	0.519	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-74	-15.9	-178	-43.9	71	-140.6	0	0	113.3	R347 A388	R347-E349 WeakPolarHBondContact CB-OE2 3.39Å; R347-E349 PolarHBondContact O-N 2.93Å; R347-E349 VanDerWaalsContact O-N 3.1Å; E349-A388 HydrophobicContact CB-CB 4.39Å; E349-A388 HydrophobicContact CG-CB 3.87Å
350	Q	95.7	Very high	95.1	Very high	120 Å²	120	65.8 Å²	65.8	56%	0.561	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-103	-10.3	-178.4	-63.7	178.5	-35.3	0	0	112.5	I346 R347 P348	I346-Q350 HydrophobicContact CG2-CB 3.84Å; R347-Q350 HydrophobicContact CB-CG 4.31Å; R347-Q350 PolarHBondContact O-N 2.95Å; P348-Q350 PolarHBondContact O-N 3.05Å
351	L	96.8	Very high	95.4	Very high	14 Å²	14	65 Å²	65	7%	0.073	32%	0.321	C	S	.	.			trans	-65.9	134.3	-178.9	-170.4	69.4	0	0	0	110.3	L295 L318 L344 I346 R347 P348 D355 L356 L389 L392	L295-L351 HydrophobicContact CD1-CD2 4.47Å; L295-L351 HydrophobicContact CD2-CD2 3.74Å; L318-L351 HydrophobicContact CD2-CD1 4.2Å; L318-L351 HydrophobicContact CD2-CD2 4.27Å; L344-L351 HydrophobicContact CD1-CD1 3.74Å; I346-L351 HydrophobicContact CD1-CD1 4.37Å; I346-L351 HydrophobicContact CG2-CB 4.41Å; I346-L351 HydrophobicContact CG2-CD1 4.4Å; R347-L351 PolarHBondContact O-N 3.48Å; P348-L351 PolarHBondContact O-N 2.81Å; L351-D355 HydrophobicContact CD1-CB 3.71Å; L351-L356 HydrophobicContact CD2-CD1 4.26Å; L351-L356 HydrophobicContact CD2-CD2 4.2Å; L351-L356 HydrophobicContact CD2-CG 4.33Å; L351-L389 HydrophobicContact CB-CD2 4.09Å; L351-L389 HydrophobicContact CD2-CD2 3.55Å; L351-L389 HydrophobicContact CG-CD2 4.43Å; L351-L392 HydrophobicContact CB-CD1 4.11Å; L351-L392 HydrophobicContact CD2-CD1 3.89Å; L351-L392 HydrophobicContact CG-CD1 3.91Å; L351-L392 WeakPolarHBondContact O-CD1 3.42Å
352	T	96.1	Very high	95.4	Very high	60 Å²	60	65.4 Å²	65.4	37%	0.368	33%	0.325	S	S	.	.			trans	-119.8	166.7	178.3	73.6	0	0	0	0	111.8	Q354 D355 L356	T352-Q354 PolarHBondContact O-N 3.08Å; T352-Q354 PolarHBondContact OG1-N 2.85Å; T352-D355 WeakPolarHBondContact CB-OD2 3.19Å; T352-D355 PolarHBondContact N-OD2 2.88Å; T352-D355 PolarHBondContact O-N 3.47Å; T352-D355 PolarHBondContact OG1-OD2 2.85Å; T352-L356 PolarHBondContact O-N 2.82Å
353	S	94.4	Very high	95.5	Very high	65 Å²	65	63.6 Å²	63.6	46%	0.455	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-24.4	173.6	62.5	0	0	0	0	113	L356 R357 G358	S353-L356 CarbonylContact O-C 3.57Å; S353-L356 PolarHBondContact O-N 2.88Å; S353-R357 PolarHBondContact O-N 3.16Å; S353-G358 WeakPolarHBondContact O-CA 3.42Å; S353-G358 PolarHBondContact O-N 3.08Å
354	Q	95.1	Very high	95.5	Very high	168 Å²	168	62.8 Å²	62.8	79%	0.785	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-39.2	177.4	-66.8	-175.1	-2.6	0	0	111.6	T352 L356 R357	T352-Q354 PolarHBondContact O-N 3.08Å; T352-Q354 PolarHBondContact OG1-N 2.85Å; Q354-L356 PolarHBondContact O-N 3.15Å; Q354-R357 WeakPolarHBondContact O-CA 3.11Å; Q354-R357 PolarHBondContact O-N 2.86Å
355	D	96	Very high	95.6	Very high	51 Å²	51	61.8 Å²	61.8	27%	0.273	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.4	174.9	-54.6	-58.3	0	0	0	111.1	I346 L351 T352 R357	I346-D355 HydrophobicContact CD1-CB 4.12Å; L351-D355 HydrophobicContact CD1-CB 3.71Å; T352-D355 WeakPolarHBondContact CB-OD2 3.19Å; T352-D355 PolarHBondContact N-OD2 2.88Å; T352-D355 PolarHBondContact O-N 3.47Å; T352-D355 PolarHBondContact OG1-OD2 2.85Å; D355-R357 VanDerWaalsContact C-N 3.26Å; D355-R357 PolarHBondContact O-N 2.86Å
356	L	95.7	Very high	95.7	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	8.7	173.1	-59.2	178.5	0	0	0	113.6	F316 L351 T352 S353 Q354 G358 E359 I361 L392	F316-L356 HydrophobicContact CB-CD2 4.43Å; F316-L356 HydrophobicContact CD1-CD2 3.94Å; F316-L356 HydrophobicContact CD2-CD2 3.84Å; F316-L356 HydrophobicContact CE1-CD2 4.07Å; F316-L356 HydrophobicContact CE2-CD2 3.96Å; F316-L356 HydrophobicContact CG-CD2 3.82Å; F316-L356 HydrophobicContact CZ-CB 4.4Å; F316-L356 HydrophobicContact CZ-CD2 4.07Å; L351-L356 HydrophobicContact CD2-CD1 4.26Å; L351-L356 HydrophobicContact CD2-CD2 4.2Å; L351-L356 HydrophobicContact CD2-CG 4.33Å; T352-L356 PolarHBondContact O-N 2.82Å; S353-L356 CarbonylContact O-C 3.57Å; S353-L356 PolarHBondContact O-N 2.88Å; Q354-L356 PolarHBondContact O-N 3.15Å; L356-G358 PolarHBondContact O-N 2.85Å; L356-E359 WeakPolarHBondContact O-CB 3.36Å; L356-E359 PolarHBondContact O-N 2.55Å; L356-I361 HydrophobicContact CD1-CD1 3.88Å; L356-I361 HydrophobicContact CD1-CG1 3.82Å; L356-L392 HydrophobicContact CD1-CB 4.35Å; L356-L392 HydrophobicContact CD1-CD1 4.12Å
357	R	93.3	Very high	95.6	Very high	171 Å²	171	55.7 Å²	55.7	65%	0.645	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	31.2	-179.7	-49.5	-179.8	-173.7	-162.1	-2.8	113.8	E342 S353 Q354 D355 E359	E342-R357 IonicContact OE1-CZ 3.82Å; E342-R357 IonicContact OE1-NE 3.23Å; E342-R357 PolarHBondContact OE1-NE 2.85Å; E342-R357 IonicContact OE1-NH2 2.7Å; E342-R357 PolarHBondContact OE1-NH2 2.85Å; E342-R357 IonicContact OE2-CZ 3.02Å; E342-R357 VanDerWaalsContact OE2-CZ 3.23Å; E342-R357 IonicContact OE2-NE 2.73Å; E342-R357 PolarHBondContact OE2-NE 2.74Å; E342-R357 VanDerWaalsContact OE2-NE 3.13Å; E342-R357 IonicContact OE2-NH2 2.76Å; E342-R357 PolarHBondContact OE2-NH2 3.37Å; S353-R357 PolarHBondContact O-N 3.16Å; Q354-R357 WeakPolarHBondContact O-CA 3.11Å; Q354-R357 PolarHBondContact O-N 2.86Å; D355-R357 VanDerWaalsContact C-N 3.26Å; D355-R357 PolarHBondContact O-N 2.86Å; R357-E359 VanDerWaalsContact C-N 3.28Å; R357-E359 PolarHBondContact O-N 3.04Å
358	G	91.4	Very high	95.3	Very high	59 Å²	59	48.2 Å²	48.2	61%	0.608	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.8	0.5	-178	0	0	0	0	0	114.9	S353 L356	S353-G358 WeakPolarHBondContact O-CA 3.42Å; S353-G358 PolarHBondContact O-N 3.08Å; L356-G358 PolarHBondContact O-N 2.85Å
359	E	94.4	Very high	95.3	Very high	58 Å²	58	48.9 Å²	48.9	27%	0.271	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-73.6	147.1	174.7	-64.3	-79.6	-169.5	0	0	110.7	V293 K313 L356 R357	V293-E359 HydrophobicContact CG1-CB 3.98Å; V293-E359 HydrophobicContact CG2-CB 4.3Å; K313-E359 IonicContact NZ-OE1 2.78Å; K313-E359 PolarHBondContact NZ-OE1 2.88Å; K313-E359 IonicContact NZ-OE2 3.45Å; K313-E359 PolarHBondContact NZ-OE2 3.42Å; L356-E359 WeakPolarHBondContact O-CB 3.36Å; L356-E359 PolarHBondContact O-N 2.55Å; R357-E359 VanDerWaalsContact C-N 3.28Å; R357-E359 PolarHBondContact O-N 3.04Å
360	Q	94.8	Very high	95.4	Very high	106 Å²	106	43.7 Å²	43.7	50%	0.495	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-100.2	141.7	169.5	-67.8	-171.5	0.3	0	0	110.5	V293 S362 R394	V293-Q360 WeakPolarHBondContact CB-O 3.44Å; Q360-S362 PolarHBondContact O-N 3.46Å; Q360-R394 HydrophobicContact CB-CG 3.43Å; Q360-R394 VanDerWaalsContact CB-CG 3.43Å; Q360-R394 PolarHBondContact O-NE 3.22Å; Q360-R394 PolarHBondContact O-NH2 3.11Å
361	I	98.4	Very high	95.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	119.3	-176.4	-56.3	159.1	0	0	0	109.5	L295 L356 V363 L364 L392 L393 R394 A397	L295-I361 HydrophobicContact CB-CD1 4.11Å; L295-I361 HydrophobicContact CB-CG1 4.15Å; L295-I361 HydrophobicContact CB-CG2 3.95Å; L295-I361 HydrophobicContact CD2-CD1 3.49Å; L295-I361 VanDerWaalsContact CD2-CD1 3.49Å; L295-I361 HydrophobicContact CD2-CG1 4.37Å; L295-I361 HydrophobicContact CG-CD1 4.44Å; L356-I361 HydrophobicContact CD1-CD1 3.88Å; L356-I361 HydrophobicContact CD1-CG1 3.82Å; I361-V363 WeakPolarHBondContact CG2-O 3.27Å; I361-L364 HydrophobicContact CG2-CB 4.43Å; I361-L392 HydrophobicContact CD1-CB 3.82Å; I361-L392 PolarHBondContact N-O 3.4Å; I361-L392 VanDerWaalsContact N-O 3.15Å; I361-L393 HydrophobicContact CB-CD2 3.91Å; I361-L393 HydrophobicContact CD1-CD2 4.07Å; I361-L393 HydrophobicContact CG2-CD2 3.82Å; I361-R394 WeakPolarHBondContact O-CG 3.46Å; I361-R394 PolarHBondContact O-N 3.09Å; I361-A397 WeakPolarHBondContact O-CB 3.37Å
362	S	98.4	Very high	95	Very high	15 Å²	15	46.3 Å²	46.3	11%	0.105	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-24.4	173.6	65.4	0	0	0	0	112.9	S292 V293 Q360 A397 T398	S292-S362 WeakPolarHBondContact CA-OG 3.43Å; V293-S362 PolarHBondContact N-OG 2.73Å; V293-S362 PolarHBondContact O-N 3.02Å; V293-S362 PolarHBondContact O-OG 3.45Å; Q360-S362 PolarHBondContact O-N 3.46Å; S362-A397 CarbonylContact O-C 3.54Å; S362-A397 WeakPolarHBondContact O-CA 3.25Å; S362-T398 PolarHBondContact O-N 3.19Å
363	V	98.7	Very high	95	Very high	1 Å²	1	45 Å²	45	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	114.7	176.8	-176.1	0	0	0	0	109.1	V287 L288 V293 C294 L295 I361 M365 T398	V287-V363 HydrophobicContact CG2-CG1 4.21Å; L288-V363 HydrophobicContact CD2-CG2 4.32Å; V293-V363 PolarHBondContact O-N 3.22Å; C294-V363 CarbonylContact C-O 3.6Å; C294-V363 VanDerWaalsContact CA-O 3.26Å; C294-V363 WeakPolarHBondContact CA-O 3.22Å; L295-V363 PolarHBondContact N-O 2.9Å; I361-V363 WeakPolarHBondContact CG2-O 3.27Å; V363-M365 HydrophobicContact CG1-CB 4.46Å; V363-T398 CarbonylContact C-O 3.54Å; V363-T398 WeakPolarHBondContact CA-O 3.34Å
364	L	98.8	Very high	94.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.5	168.3	178.2	67.7	0	0	0	108.1	L295 V297 I361 F382 R386 L389 L393 T398 I399 L400	L295-L364 HydrophobicContact CB-CD1 4.17Å; L295-L364 HydrophobicContact CD2-CD1 4.1Å; L295-L364 HydrophobicContact CG-CD1 4.17Å; V297-L364 HydrophobicContact CG2-CD1 3.97Å; I361-L364 HydrophobicContact CG2-CB 4.43Å; L364-F382 HydrophobicContact CD2-CZ 4.41Å; L364-F382 HydrophobicContact CG-CE2 4.4Å; L364-F382 HydrophobicContact CG-CZ 4.19Å; L364-R386 HydrophobicContact CD2-CB 3.52Å; L364-R386 HydrophobicContact CD2-CG 3.55Å; L364-L389 HydrophobicContact CD1-CD1 3.87Å; L364-L393 HydrophobicContact CB-CD2 4.07Å; L364-L393 HydrophobicContact CD2-CD2 4.41Å; L364-T398 PolarHBondContact N-O 3.2Å; L364-I399 HydrophobicContact CB-CD1 3.88Å; L364-I399 HydrophobicContact CD2-CD1 4.23Å; L364-I399 CarbonylContact O-C 3.54Å; L364-I399 WeakPolarHBondContact O-CA 3.38Å; L364-L400 PolarHBondContact O-N 3.28Å
365	M	98.3	Very high	95	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	153.5	-173.2	66	-168.8	178.4	0	0	113.9	L284 C294 L295 S296 V297 L303 P304 A307 V315 V363 L400	L284-M365 HydrophobicContact CD2-SD 3.72Å; C294-M365 HydrophobicContact CB-CE 3.74Å; C294-M365 HydrophobicContact CB-SD 4.18Å; L295-M365 PolarHBondContact O-N 2.62Å; S296-M365 CarbonylContact C-O 3.57Å; S296-M365 VanDerWaalsContact CA-O 3.27Å; S296-M365 WeakPolarHBondContact CA-O 3.26Å; V297-M365 PolarHBondContact N-O 3.41Å; L303-M365 HydrophobicContact CD2-CB 4.01Å; L303-M365 HydrophobicContact CD2-CG 4.06Å; L303-M365 HydrophobicContact CG-SD 4.36Å; P304-M365 HydrophobicContact CB-CE 4.1Å; A307-M365 HydrophobicContact CB-CE 3.56Å; A307-M365 HydrophobicContact CB-SD 3.8Å; V315-M365 HydrophobicContact CG1-CE 3.84Å; V363-M365 HydrophobicContact CG1-CB 4.46Å; M365-L400 CarbonylContact C-O 3.54Å; M365-L400 WeakPolarHBondContact CA-O 3.44Å; M365-L400 HydrophobicContact CB-CB 4.28Å; M365-L400 HydrophobicContact CB-CD2 4.24Å
366	G	97	Very high	95	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.219	C	C	.	.			trans	-160.8	155.7	175.4	0	0	0	0	0	112.6	L400 P401	G366-L400 PolarHBondContact N-O 2.9Å; G366-P401 VanDerWaalsContact O-CD 3.31Å; G366-P401 WeakPolarHBondContact O-CD 3.24Å
367	E	91.1	Very high	95	Very high	5 Å²	5	39.7 Å²	39.7	2%	0.023	22%	0.22	C	C	.	.			trans	-82.3	8	168.4	-77	-174.5	-122.7	0	0	113.4	R267 R276 Y280 S298 S301 L302 L303	R267-E367 IonicContact CZ-OE2 3.3Å; R267-E367 IonicContact NH1-OE2 2.7Å; R267-E367 PolarHBondContact NH1-OE2 2.85Å; R267-E367 IonicContact NH2-OE1 3.42Å; R267-E367 PolarHBondContact NH2-OE1 3.16Å; R267-E367 IonicContact NH2-OE2 3.23Å; R267-E367 PolarHBondContact NH2-OE2 2.95Å; R267-E367 VanDerWaalsContact NH2-OE2 3.14Å; R276-E367 IonicContact CZ-OE2 2.81Å; R276-E367 IonicContact NH1-OE2 2.64Å; R276-E367 PolarHBondContact NH1-OE2 2.95Å; R276-E367 IonicContact NH2-OE2 3.72Å; R276-E367 PolarHBondContact NH2-OE2 3.48Å; Y280-E367 HydrophobicContact CE1-CG 4.18Å; Y280-E367 WeakPolarHBondContact OH-CA 3.44Å; Y280-E367 PolarHBondContact OH-O 2.76Å; Y280-E367 VanDerWaalsContact OH-O 3.12Å; S298-E367 PolarHBondContact OG-N 3.03Å; S301-E367 WeakPolarHBondContact CA-OE1 3.14Å; S301-E367 VanDerWaalsContact CB-OE1 3.28Å; S301-E367 WeakPolarHBondContact CB-OE1 3.42Å; S301-E367 PolarHBondContact OG-OE1 3.01Å; L302-E367 PolarHBondContact N-OE1 2.84Å; L303-E367 HydrophobicContact CB-CG 4.09Å; L303-E367 HydrophobicContact CD2-CG 4.29Å
368	P	87.8	Confident	95.2	Very high	2 Å²	2	34 Å²	34	1%	0.013	20%	0.201	C	C	.	.				-22.5	92.7	-109.6	27.8	-40.1	0	0	0	115.4	S298 F370 F382 P401	S298-P368 WeakPolarHBondContact OG-CA 3.18Å; P368-F370 HydrophobicContact CB-CE2 4.08Å; P368-F382 HydrophobicContact CB-CB 3.66Å; P368-F382 HydrophobicContact CB-CG 4.16Å; P368-P401 HydrophobicContact CG-CG 4.3Å
369	Y	95.5	Very high	95.4	Very high	20 Å²	20	31.5 Å²	31.5	8%	0.078	17%	0.174	C	C	.	.			trans	-113.9	131.4	170.2	176.1	-90	0	0	0	110.2	R267 S298 D299	R267-Y369 HydrophobicContact CB-CE2 4.23Å; R267-Y369 HydrophobicContact CG-CE1 4.08Å; R267-Y369 HydrophobicContact CG-CE2 4.1Å; S298-Y369 CarbonylContact C-O 3.58Å; S298-Y369 WeakPolarHBondContact CA-O 3.2Å; S298-Y369 PolarHBondContact OG-N 3.1Å; D299-Y369 HydrophobicContact CB-CD1 4.48Å; D299-Y369 PolarHBondContact N-O 3.2Å; D299-Y369 WeakPolarHBondContact O-CD1 3.41Å
370	F	95.3	Very high	95.5	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.009	16%	0.161	C	C	.	.			trans	-134.7	133.9	174.7	-54.5	-75.7	0	0	0	109.7	V297 D299 P368 T372 S373 F381 F382	V297-F370 HydrophobicContact CG1-CE1 4.21Å; V297-F370 HydrophobicContact CG1-CZ 4.45Å; D299-F370 VanDerWaalsContact OD2-CA 3.27Å; D299-F370 WeakPolarHBondContact OD2-CA 3.34Å; P368-F370 HydrophobicContact CB-CE2 4.08Å; F370-T372 PolarHBondContact O-N 3.17Å; F370-T372 VanDerWaalsContact O-N 3.12Å; F370-S373 VanDerWaalsContact O-CB 3.29Å; F370-S373 WeakPolarHBondContact O-CB 3.41Å; F370-S373 PolarHBondContact O-N 3.39Å; F370-S373 PolarHBondContact O-OG 3.44Å; F370-F381 AromaticContact CD1-CD1 3.67Å; F370-F381 HydrophobicContact CD1-CD1 3.67Å; F370-F381 HydrophobicContact CD1-CE1 4.17Å; F370-F381 HydrophobicContact CD2-CB 4.02Å; F370-F381 HydrophobicContact CD2-CD1 4.05Å; F370-F381 AromaticContact CE1-CD1 3.54Å; F370-F381 HydrophobicContact CE1-CD1 3.54Å; F370-F381 HydrophobicContact CE1-CE1 4.02Å; F370-F381 HydrophobicContact CE2-CB 3.88Å; F370-F381 AromaticContact CE2-CD1 3.94Å; F370-F381 HydrophobicContact CE2-CD1 3.94Å; F370-F381 HydrophobicContact CE2-CG 4.41Å; F370-F381 AromaticContact CG-CD1 3.93Å; F370-F381 HydrophobicContact CG-CD1 3.93Å; F370-F381 HydrophobicContact CZ-CB 4.37Å; F370-F381 AromaticContact CZ-CD1 3.67Å; F370-F381 HydrophobicContact CZ-CD1 3.67Å; F370-F381 HydrophobicContact CZ-CE1 4.49Å; F370-F381 HydrophobicContact CZ-CG 4.47Å; F370-F382 HydrophobicContact CE2-CB 4.04Å; F370-F382 HydrophobicContact CZ-CB 3.97Å
371	S	92.3	Very high	95.6	Very high	76 Å²	76	27.5 Å²	27.5	53%	0.531	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.3	-172.4	63.9	0	0	0	0	113.4	D299	D299-S371 PolarHBondContact OD2-N 3.21Å
372	T	93.1	Very high	95.6	Very high	113 Å²	113	27.5 Å²	27.5	69%	0.693	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-3.6	177.1	55.6	0	0	0	0	113.6	F370 L374	F370-T372 PolarHBondContact O-N 3.17Å; F370-T372 VanDerWaalsContact O-N 3.12Å; T372-L374 PolarHBondContact O-N 3.18Å
373	S	94.3	Very high	95.6	Very high	31 Å²	31	27.1 Å²	27.1	22%	0.217	15%	0.15	C	C	.	.			trans	-71.4	126.3	178.8	-67.6	0	0	0	0	111.1	F370 H378	F370-S373 VanDerWaalsContact O-CB 3.29Å; F370-S373 WeakPolarHBondContact O-CB 3.41Å; F370-S373 PolarHBondContact O-N 3.39Å; F370-S373 PolarHBondContact O-OG 3.44Å; S373-H378 WeakPolarHBondContact OG-CB 3.3Å
374	L	93.9	Very high	95.6	Very high	125 Å²	125	29.9 Å²	29.9	65%	0.654	16%	0.161	S	C	*	.			trans	-110	-45.9	176	-62.9	172.5	0	0	0	110.7	T372 H378 P452	T372-L374 PolarHBondContact O-N 3.18Å; L374-H378 PolarHBondContact N-ND1 3.1Å; L374-P452 VanDerWaalsContact O-CB 3.24Å; L374-P452 WeakPolarHBondContact O-CB 3.45Å
375	L	96.1	Very high	95.6	Very high	23 Å²	23	29.9 Å²	29.9	12%	0.12	16%	0.161	C	C	.	.	S	Bend	trans	-99	153.9	178.1	-65.9	165.1	0	0	0	111	W377 H378 A450 P452	L375-W377 VanDerWaalsContact C-N 3.31Å; L375-W377 HydrophobicContact CB-CD2 4.24Å; L375-W377 HydrophobicContact CB-CH2 4.33Å; L375-W377 HydrophobicContact CB-CZ2 3.94Å; L375-W377 HydrophobicContact CD1-CH2 4.28Å; L375-W377 HydrophobicContact CD1-CZ2 3.56Å; L375-W377 HydrophobicContact CD2-CH2 4.3Å; L375-W377 HydrophobicContact CD2-CZ2 4.37Å; L375-W377 HydrophobicContact CG-CZ2 4.16Å; L375-W377 PolarHBondContact O-N 3.08Å; L375-H378 WeakPolarHBondContact O-CB 3.28Å; L375-H378 PolarHBondContact O-N 2.93Å; L375-A450 WeakPolarHBondContact CD2-O 3.16Å; L375-P452 HydrophobicContact CD2-CB 4.18Å; L375-P452 HydrophobicContact CD2-CG 4.37Å
376	P	96.5	Very high	95.5	Very high	19 Å²	19	31 Å²	31	12%	0.123	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-53.3	-42.9	-175.1	-29.2	35.8	0	0	0	114.4	H378 S379 M504	P376-H378 VanDerWaalsContact C-N 3.27Å; P376-H378 PolarHBondContact O-N 2.94Å; P376-S379 PolarHBondContact O-N 3.08Å; P376-S379 PolarHBondContact O-OG 3.29Å; P376-M504 VanDerWaalsContact C-CG 3.42Å; P376-M504 HydrophobicContact CB-CB 4.36Å; P376-M504 HydrophobicContact CB-CG 3.76Å; P376-M504 WeakPolarHBondContact O-CG 3.28Å
377	W	96.4	Very high	95.6	Very high	7 Å²	7	33 Å²	33	3%	0.027	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-76.4	-5.9	-178	53.9	84.9	0	0	0	114.4	L375 S379 L380 L406 A450 L502 M504 V568 M570	L375-W377 VanDerWaalsContact C-N 3.31Å; L375-W377 HydrophobicContact CB-CD2 4.24Å; L375-W377 HydrophobicContact CB-CH2 4.33Å; L375-W377 HydrophobicContact CB-CZ2 3.94Å; L375-W377 HydrophobicContact CD1-CH2 4.28Å; L375-W377 HydrophobicContact CD1-CZ2 3.56Å; L375-W377 HydrophobicContact CD2-CH2 4.3Å; L375-W377 HydrophobicContact CD2-CZ2 4.37Å; L375-W377 HydrophobicContact CG-CZ2 4.16Å; L375-W377 PolarHBondContact O-N 3.08Å; W377-S379 PolarHBondContact O-N 2.73Å; W377-S379 VanDerWaalsContact O-N 3.13Å; W377-L380 HydrophobicContact CB-CD1 4.1Å; W377-L380 HydrophobicContact CB-CG 4.42Å; W377-L380 WeakPolarHBondContact O-CB 3.29Å; W377-L380 WeakPolarHBondContact O-CG 3Å; W377-L380 PolarHBondContact O-N 3.31Å; W377-L406 HydrophobicContact CE3-CD1 4.02Å; W377-L406 HydrophobicContact CZ3-CD1 4.47Å; W377-A450 HydrophobicContact CH2-CB 3.93Å; W377-L502 HydrophobicContact CZ3-CB 4.38Å; W377-L502 HydrophobicContact CZ3-CD2 4.33Å; W377-M504 HydrophobicContact CB-CG 4.39Å; W377-M504 HydrophobicContact CB-SD 4.05Å; W377-V568 HydrophobicContact CB-CG2 4.03Å; W377-V568 HydrophobicContact CD2-CB 4.12Å; W377-V568 HydrophobicContact CD2-CG2 4.09Å; W377-V568 HydrophobicContact CG-CB 4.19Å; W377-V568 HydrophobicContact CG-CG2 3.66Å; W377-V568 HydrophobicContact CZ2-CB 4.48Å; W377-M570 HydrophobicContact CH2-CE 3.19Å; W377-M570 HydrophobicContact CH2-SD 4.33Å; W377-M570 HydrophobicContact CZ2-CE 3.56Å; W377-M570 HydrophobicContact CZ3-CE 3.9Å
378	H	96.8	Very high	95.9	Very high	53 Å²	53	34.9 Å²	34.9	25%	0.245	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-62.8	-18	170.3	-65.8	-173.3	0	0	0	111.6	S373 L374 L375 P376 L380 F381	S373-H378 WeakPolarHBondContact OG-CB 3.3Å; L374-H378 PolarHBondContact N-ND1 3.1Å; L375-H378 WeakPolarHBondContact O-CB 3.28Å; L375-H378 PolarHBondContact O-N 2.93Å; P376-H378 VanDerWaalsContact C-N 3.27Å; P376-H378 PolarHBondContact O-N 2.94Å; H378-L380 PolarHBondContact O-N 2.86Å; H378-F381 WeakPolarHBondContact O-CB 3.35Å; H378-F381 PolarHBondContact O-N 3.17Å; H378-F381 VanDerWaalsContact O-N 3.11Å
379	S	94.5	Very high	96.4	Very high	6 Å²	6	34.8 Å²	34.8	4%	0.042	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-61	-20.4	169.8	68.4	0	0	0	0	113.4	P376 W377 F381 F382	P376-S379 PolarHBondContact O-N 3.08Å; P376-S379 PolarHBondContact O-OG 3.29Å; W377-S379 PolarHBondContact O-N 2.73Å; W377-S379 VanDerWaalsContact O-N 3.13Å; S379-F381 PolarHBondContact O-N 2.66Å; S379-F382 PolarHBondContact O-N 2.94Å; S379-F382 VanDerWaalsContact O-N 3.12Å
380	L	97.7	Very high	96.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-61.6	-12.1	173.1	-63.8	177.9	0	0	0	112.8	W377 H378 F382 W383 Y384 F472 F474 M504 F561	W377-L380 HydrophobicContact CB-CD1 4.1Å; W377-L380 HydrophobicContact CB-CG 4.42Å; W377-L380 WeakPolarHBondContact O-CB 3.29Å; W377-L380 WeakPolarHBondContact O-CG 3Å; W377-L380 PolarHBondContact O-N 3.31Å; H378-L380 PolarHBondContact O-N 2.86Å; L380-F382 PolarHBondContact O-N 3.47Å; L380-F382 VanDerWaalsContact O-N 3.1Å; L380-W383 WeakPolarHBondContact O-CA 3.41Å; L380-W383 WeakPolarHBondContact O-CB 3.17Å; L380-W383 PolarHBondContact O-N 3.09Å; L380-Y384 WeakPolarHBondContact O-CD2 3.27Å; L380-F472 HydrophobicContact CD1-CD1 4.05Å; L380-F472 HydrophobicContact CD1-CD2 4.24Å; L380-F472 HydrophobicContact CD1-CE1 3.83Å; L380-F472 HydrophobicContact CD1-CE2 4.04Å; L380-F472 HydrophobicContact CD1-CG 4.24Å; L380-F472 HydrophobicContact CD1-CZ 3.82Å; L380-F472 HydrophobicContact CD2-CB 3.92Å; L380-F472 HydrophobicContact CD2-CD1 4.23Å; L380-F472 HydrophobicContact CD2-CD2 3.7Å; L380-F472 HydrophobicContact CD2-CE2 4.25Å; L380-F472 HydrophobicContact CD2-CG 3.68Å; L380-F474 HydrophobicContact CD2-CE1 3.79Å; L380-F474 HydrophobicContact CD2-CZ 3.82Å; L380-M504 HydrophobicContact CD2-CE 3.96Å; L380-M504 HydrophobicContact CG-CE 4.39Å; L380-F561 HydrophobicContact CD1-CD2 4.1Å; L380-F561 HydrophobicContact CD1-CE2 3.78Å; L380-F561 HydrophobicContact CD1-CZ 4.39Å
381	F	97.4	Very high	96.5	Very high	78 Å²	78	39.2 Å²	39.2	34%	0.342	24%	0.242	S	C	.	.	H	α-helix	trans	-51	-32.5	168.4	-177.3	-117.5	0	0	0	112.4	F370 H378 S379 W383 Y384 C385	F370-F381 AromaticContact CD1-CD1 3.67Å; F370-F381 HydrophobicContact CD1-CD1 3.67Å; F370-F381 HydrophobicContact CD1-CE1 4.17Å; F370-F381 HydrophobicContact CD2-CB 4.02Å; F370-F381 HydrophobicContact CD2-CD1 4.05Å; F370-F381 AromaticContact CE1-CD1 3.54Å; F370-F381 HydrophobicContact CE1-CD1 3.54Å; F370-F381 HydrophobicContact CE1-CE1 4.02Å; F370-F381 HydrophobicContact CE2-CB 3.88Å; F370-F381 AromaticContact CE2-CD1 3.94Å; F370-F381 HydrophobicContact CE2-CD1 3.94Å; F370-F381 HydrophobicContact CE2-CG 4.41Å; F370-F381 AromaticContact CG-CD1 3.93Å; F370-F381 HydrophobicContact CG-CD1 3.93Å; F370-F381 HydrophobicContact CZ-CB 4.37Å; F370-F381 AromaticContact CZ-CD1 3.67Å; F370-F381 HydrophobicContact CZ-CD1 3.67Å; F370-F381 HydrophobicContact CZ-CE1 4.49Å; F370-F381 HydrophobicContact CZ-CG 4.47Å; H378-F381 WeakPolarHBondContact O-CB 3.35Å; H378-F381 PolarHBondContact O-N 3.17Å; H378-F381 VanDerWaalsContact O-N 3.11Å; S379-F381 PolarHBondContact O-N 2.66Å; F381-W383 VanDerWaalsContact C-N 3.25Å; F381-W383 PolarHBondContact O-N 2.97Å; F381-Y384 WeakPolarHBondContact O-CB 3.3Å; F381-Y384 PolarHBondContact O-N 2.97Å; F381-Y384 VanDerWaalsContact O-N 3.1Å; F381-C385 VanDerWaalsContact CE1-SG 3.54Å; F381-C385 PolarHBondContact O-N 2.89Å; F381-C385 PolarHBondContact O-SG 2.94Å
382	F	98.2	Very high	96.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.2	-37.9	171.6	176.1	-99.1	0	0	0	113.2	V297 L364 P368 F370 S379 L380 Y384 C385 R386 I399 P401 F474	V297-F382 HydrophobicContact CB-CD2 4.17Å; V297-F382 HydrophobicContact CB-CE2 4.3Å; L364-F382 HydrophobicContact CD2-CZ 4.41Å; L364-F382 HydrophobicContact CG-CE2 4.4Å; L364-F382 HydrophobicContact CG-CZ 4.19Å; P368-F382 HydrophobicContact CB-CB 3.66Å; P368-F382 HydrophobicContact CB-CG 4.16Å; F370-F382 HydrophobicContact CE2-CB 4.04Å; F370-F382 HydrophobicContact CZ-CB 3.97Å; S379-F382 PolarHBondContact O-N 2.94Å; S379-F382 VanDerWaalsContact O-N 3.12Å; L380-F382 PolarHBondContact O-N 3.47Å; L380-F382 VanDerWaalsContact O-N 3.1Å; F382-Y384 VanDerWaalsContact C-N 3.33Å; F382-Y384 PolarHBondContact O-N 2.94Å; F382-C385 WeakPolarHBondContact O-CB 3.35Å; F382-C385 PolarHBondContact O-N 2.94Å; F382-R386 WeakPolarHBondContact O-CB 3.48Å; F382-R386 PolarHBondContact O-N 3.49Å; F382-I399 HydrophobicContact CE1-CG2 4.01Å; F382-I399 HydrophobicContact CZ-CG2 4.19Å; F382-P401 HydrophobicContact CE1-CG 4.42Å; F382-F474 AromaticContact CD1-CD2 3.59Å; F382-F474 HydrophobicContact CD1-CD2 3.59Å; F382-F474 AromaticContact CD1-CE2 3.71Å; F382-F474 HydrophobicContact CD1-CE2 3.71Å; F382-F474 HydrophobicContact CD1-CG 4.25Å; F382-F474 HydrophobicContact CD1-CZ 4.46Å; F382-F474 HydrophobicContact CE1-CB 4.48Å; F382-F474 AromaticContact CE1-CD2 3.71Å; F382-F474 HydrophobicContact CE1-CD2 3.71Å; F382-F474 HydrophobicContact CE1-CE2 4.25Å; F382-F474 HydrophobicContact CE1-CG 4.34Å
383	W	98.4	Very high	97	Very high	7 Å²	7	33 Å²	33	3%	0.027	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-36.5	177.8	-163.8	17.8	0	0	0	112.3	L380 F381 R386 T387 F472 D473 F474 Q476 V478 P479 I483 F561	L380-W383 WeakPolarHBondContact O-CA 3.41Å; L380-W383 WeakPolarHBondContact O-CB 3.17Å; L380-W383 PolarHBondContact O-N 3.09Å; F381-W383 VanDerWaalsContact C-N 3.25Å; F381-W383 PolarHBondContact O-N 2.97Å; W383-R386 PolarHBondContact O-N 2.78Å; W383-T387 WeakPolarHBondContact O-CB 3.49Å; W383-T387 PolarHBondContact O-N 2.96Å; W383-T387 PolarHBondContact O-OG1 2.95Å; W383-F472 HydrophobicContact CE3-CB 4.24Å; W383-F472 HydrophobicContact CE3-CD1 4.34Å; W383-F472 HydrophobicContact CH2-CB 4.5Å; W383-F472 HydrophobicContact CH2-CD1 4.44Å; W383-F472 HydrophobicContact CZ3-CB 4.12Å; W383-F472 AromaticContact CZ3-CD1 3.74Å; W383-F472 HydrophobicContact CZ3-CD1 3.74Å; W383-F472 HydrophobicContact CZ3-CG 4.39Å; W383-D473 PolarHBondContact NE1-O 2.99Å; W383-D473 VanDerWaalsContact NE1-O 3.14Å; W383-F474 HydrophobicContact CB-CD1 3.66Å; W383-F474 HydrophobicContact CB-CE1 3.55Å; W383-F474 HydrophobicContact CB-CZ 4.38Å; W383-F474 AromaticContact CD1-CD1 3.55Å; W383-F474 AromaticContact CD2-CD1 3.92Å; W383-F474 HydrophobicContact CD2-CD1 3.92Å; W383-F474 HydrophobicContact CD2-CE1 4.08Å; W383-F474 HydrophobicContact CE3-CE1 4.46Å; W383-F474 AromaticContact CG-CD1 3.43Å; W383-F474 HydrophobicContact CG-CD1 3.43Å; W383-F474 VanDerWaalsContact CG-CD1 3.43Å; W383-F474 AromaticContact CG-CE1 3.71Å; W383-F474 HydrophobicContact CG-CE1 3.71Å; W383-F474 HydrophobicContact CG-CG 4.46Å; W383-Q476 PolarHBondContact NE1-O 2.76Å; W383-V478 HydrophobicContact CB-CG2 4Å; W383-V478 HydrophobicContact CD2-CB 4.36Å; W383-V478 HydrophobicContact CD2-CG2 3.46Å; W383-V478 VanDerWaalsContact CD2-CG2 3.46Å; W383-V478 HydrophobicContact CE3-CG2 3.84Å; W383-V478 HydrophobicContact CG-CG2 3.51Å; W383-P479 HydrophobicContact CH2-CG 4.1Å; W383-I483 HydrophobicContact CH2-CD1 3.94Å; W383-I483 HydrophobicContact CZ3-CD1 4.22Å; W383-F561 HydrophobicContact CE3-CE1 4.33Å; W383-F561 HydrophobicContact CE3-CZ 4.41Å; W383-F561 HydrophobicContact CZ3-CD1 4.45Å; W383-F561 AromaticContact CZ3-CE1 3.76Å; W383-F561 HydrophobicContact CZ3-CE1 3.76Å; W383-F561 HydrophobicContact CZ3-CZ 4.27Å
384	Y	98.1	Very high	97.1	Very high	59 Å²	59	34 Å²	34	23%	0.231	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-44.8	172.2	-69.2	-91.5	0	0	0	111.3	L380 F381 F382 R386 T387 A388 V478 F561 P563 G566	L380-Y384 WeakPolarHBondContact O-CD2 3.27Å; F381-Y384 WeakPolarHBondContact O-CB 3.3Å; F381-Y384 PolarHBondContact O-N 2.97Å; F381-Y384 VanDerWaalsContact O-N 3.1Å; F382-Y384 VanDerWaalsContact C-N 3.33Å; F382-Y384 PolarHBondContact O-N 2.94Å; Y384-R386 VanDerWaalsContact C-N 3.34Å; Y384-R386 PolarHBondContact O-N 2.93Å; Y384-T387 WeakPolarHBondContact O-CB 3.1Å; Y384-T387 PolarHBondContact O-N 2.68Å; Y384-T387 VanDerWaalsContact O-N 3.1Å; Y384-A388 PolarHBondContact O-N 2.78Å; Y384-V478 HydrophobicContact CD1-CG2 4.22Å; Y384-V478 HydrophobicContact CD2-CG2 4.43Å; Y384-V478 HydrophobicContact CE1-CG1 4.04Å; Y384-V478 HydrophobicContact CE1-CG2 4.38Å; Y384-V478 HydrophobicContact CG-CG2 4.25Å; Y384-F561 HydrophobicContact CE2-CZ 4.19Å; Y384-F561 WeakPolarHBondContact OH-CZ 3.43Å; Y384-P563 WeakPolarHBondContact CE1-O 3.37Å; Y384-P563 VanDerWaalsContact OH-C 3.29Å; Y384-P563 WeakPolarHBondContact OH-CA 3.17Å; Y384-P563 PolarHBondContact OH-O 2.63Å; Y384-G566 WeakPolarHBondContact OH-CA 3.45Å; Y384-G566 PolarHBondContact OH-N 3.02Å
385	C	97.9	Very high	97	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-46.3	174.4	-54.6	0	0	0	0	111.2	V297 P348 F381 F382 T387 A388 L389	V297-C385 HydrophobicContact CG1-CB 3.8Å; P348-C385 HydrophobicContact CB-CB 4.01Å; P348-C385 HydrophobicContact CG-CB 3.78Å; F381-C385 VanDerWaalsContact CE1-SG 3.54Å; F381-C385 PolarHBondContact O-N 2.89Å; F381-C385 PolarHBondContact O-SG 2.94Å; F382-C385 WeakPolarHBondContact O-CB 3.35Å; F382-C385 PolarHBondContact O-N 2.94Å; C385-T387 PolarHBondContact O-N 2.85Å; C385-A388 PolarHBondContact O-N 3.38Å; C385-L389 WeakPolarHBondContact O-CB 3.47Å; C385-L389 WeakPolarHBondContact O-CD1 3.5Å; C385-L389 WeakPolarHBondContact O-CG 3.42Å; C385-L389 PolarHBondContact O-N 2.96Å
386	R	98	Very high	97	Very high	25 Å²	25	39.1 Å²	39.1	9%	0.094	24%	0.237	C	C	.	.	H	α-helix	trans	-56.7	-39.8	174.4	177.9	-91.9	175.7	-128.1	6.3	112.1	L364 F382 W383 Y384 L389 A390 I399 F474 T475 Q476 C477	L364-R386 HydrophobicContact CD2-CB 3.52Å; L364-R386 HydrophobicContact CD2-CG 3.55Å; F382-R386 WeakPolarHBondContact O-CB 3.48Å; F382-R386 PolarHBondContact O-N 3.49Å; W383-R386 PolarHBondContact O-N 2.78Å; Y384-R386 VanDerWaalsContact C-N 3.34Å; Y384-R386 PolarHBondContact O-N 2.93Å; R386-L389 PolarHBondContact O-N 2.98Å; R386-A390 PolarHBondContact O-N 3.14Å; R386-I399 HydrophobicContact CG-CD1 4.33Å; R386-I399 HydrophobicContact CG-CG2 4.29Å; R386-F474 WeakPolarHBondContact CD-O 3.24Å; R386-F474 PolarHBondContact NE-O 3.21Å; R386-T475 PolarHBondContact NH2-O 3.44Å; R386-Q476 WeakPolarHBondContact CD-O 3.34Å; R386-Q476 VanDerWaalsContact CZ-C 3.41Å; R386-Q476 PolarHBondContact NE-O 2.71Å; R386-C477 PolarHBondContact NH1-SG 3.11Å
387	T	98.3	Very high	97	Very high	42 Å²	42	39.3 Å²	39.3	26%	0.258	24%	0.241	S	C	.	.	H	α-helix	trans	-67.8	-44.8	178.5	-60.6	0	0	0	0	111.7	W383 Y384 C385 L389 A390 C477 V478	W383-T387 WeakPolarHBondContact O-CB 3.49Å; W383-T387 PolarHBondContact O-N 2.96Å; W383-T387 PolarHBondContact O-OG1 2.95Å; Y384-T387 WeakPolarHBondContact O-CB 3.1Å; Y384-T387 PolarHBondContact O-N 2.68Å; Y384-T387 VanDerWaalsContact O-N 3.1Å; C385-T387 PolarHBondContact O-N 2.85Å; T387-L389 PolarHBondContact O-N 2.88Å; T387-A390 VanDerWaalsContact O-CB 3.27Å; T387-A390 WeakPolarHBondContact O-CB 3.36Å; T387-A390 PolarHBondContact O-N 2.89Å; T387-C477 HydrophobicContact CG2-CB 3.84Å; T387-C477 WeakPolarHBondContact OG1-CA 3.42Å; T387-V478 WeakPolarHBondContact OG1-CG2 3.2Å; T387-V478 PolarHBondContact OG1-N 3.41Å
388	A	97.9	Very high	97.1	Very high	43 Å²	43	41.6 Å²	41.6	36%	0.355	26%	0.255	S	S	.	.	H	α-helix	trans	-61.1	-35.5	175.3	0	0	0	0	0	112.4	P348 E349 Y384 C385 A390	P348-A388 HydrophobicContact CB-CB 4.2Å; E349-A388 HydrophobicContact CB-CB 4.39Å; E349-A388 HydrophobicContact CG-CB 3.87Å; Y384-A388 PolarHBondContact O-N 2.78Å; C385-A388 PolarHBondContact O-N 3.38Å; A388-A390 VanDerWaalsContact C-N 3.33Å; A388-A390 PolarHBondContact O-N 2.92Å
389	L	97.9	Very high	97.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-2.4	-178.3	-66.2	167	0	0	0	113.9	L295 V297 P348 L351 L364 C385 R386 T387 G391 L392 L393	L295-L389 HydrophobicContact CD2-CD1 3.67Å; L295-L389 HydrophobicContact CD2-CD2 4.02Å; L295-L389 HydrophobicContact CD2-CG 4.45Å; V297-L389 HydrophobicContact CG2-CD1 4.08Å; P348-L389 HydrophobicContact CB-CD1 4.31Å; P348-L389 HydrophobicContact CB-CD2 4.4Å; P348-L389 HydrophobicContact CB-CG 4.13Å; L351-L389 HydrophobicContact CB-CD2 4.09Å; L351-L389 HydrophobicContact CD2-CD2 3.55Å; L351-L389 HydrophobicContact CG-CD2 4.43Å; L364-L389 HydrophobicContact CD1-CD1 3.87Å; C385-L389 WeakPolarHBondContact O-CB 3.47Å; C385-L389 WeakPolarHBondContact O-CD1 3.5Å; C385-L389 WeakPolarHBondContact O-CG 3.42Å; C385-L389 PolarHBondContact O-N 2.96Å; R386-L389 PolarHBondContact O-N 2.98Å; T387-L389 PolarHBondContact O-N 2.88Å; L389-G391 PolarHBondContact O-N 2.85Å; L389-L392 HydrophobicContact CD2-CD1 4.06Å; L389-L392 PolarHBondContact O-N 3.27Å; L389-L393 PolarHBondContact O-N 3.17Å
390	A	97.1	Very high	97.3	Very high	38 Å²	38	39.3 Å²	39.3	31%	0.314	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-53.3	-33.9	-172.8	0	0	0	0	0	113.7	R386 T387 A388 L392	R386-A390 PolarHBondContact O-N 3.14Å; T387-A390 VanDerWaalsContact O-CB 3.27Å; T387-A390 WeakPolarHBondContact O-CB 3.36Å; T387-A390 PolarHBondContact O-N 2.89Å; A388-A390 VanDerWaalsContact C-N 3.33Å; A388-A390 PolarHBondContact O-N 2.92Å; A390-L392 VanDerWaalsContact C-N 3.28Å; A390-L392 PolarHBondContact O-N 3.16Å
391	G	96	Very high	97.4	Very high	78 Å²	78	39.2 Å²	39.2	80%	0.804	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-73.4	-11.1	177.7	0	0	0	0	0	115.6	L389	L389-G391 PolarHBondContact O-N 2.85Å
392	L	97.4	Very high	97.4	Very high	32 Å²	32	36.6 Å²	36.6	17%	0.168	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-106.7	-8	180	-60.2	176.9	0	0	0	113	L351 L356 I361 L389 A390	L351-L392 HydrophobicContact CB-CD1 4.11Å; L351-L392 HydrophobicContact CD2-CD1 3.89Å; L351-L392 HydrophobicContact CG-CD1 3.91Å; L351-L392 WeakPolarHBondContact O-CD1 3.42Å; L356-L392 HydrophobicContact CD1-CB 4.35Å; L356-L392 HydrophobicContact CD1-CD1 4.12Å; I361-L392 HydrophobicContact CD1-CB 3.82Å; I361-L392 PolarHBondContact N-O 3.4Å; I361-L392 VanDerWaalsContact N-O 3.15Å; L389-L392 HydrophobicContact CD2-CD1 4.06Å; L389-L392 PolarHBondContact O-N 3.27Å; A390-L392 VanDerWaalsContact C-N 3.28Å; A390-L392 PolarHBondContact O-N 3.16Å
393	L	97.8	Very high	97.4	Very high	25 Å²	25	37.7 Å²	37.7	13%	0.131	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	141.7	177.3	-58.3	-179.3	0	0	0	110.8	I361 L364 L389 A397 I399	I361-L393 HydrophobicContact CB-CD2 3.91Å; I361-L393 HydrophobicContact CD1-CD2 4.07Å; I361-L393 HydrophobicContact CG2-CD2 3.82Å; L364-L393 HydrophobicContact CB-CD2 4.07Å; L364-L393 HydrophobicContact CD2-CD2 4.41Å; L389-L393 PolarHBondContact O-N 3.17Å; L393-A397 HydrophobicContact CB-CB 4.02Å; L393-I399 HydrophobicContact CD1-CD1 3.95Å
394	R	96.4	Very high	97.4	Very high	52 Å²	52	37.3 Å²	37.3	20%	0.196	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	151.6	165.1	-64.8	-178.9	-166.6	-176.6	3.9	109.5	D291 V293 Q360 I361 T396 A397	D291-R394 IonicContact OD2-NH1 3.26Å; V293-R394 VanDerWaalsContact CG2-NH2 3.31Å; Q360-R394 HydrophobicContact CB-CG 3.43Å; Q360-R394 VanDerWaalsContact CB-CG 3.43Å; Q360-R394 PolarHBondContact O-NE 3.22Å; Q360-R394 PolarHBondContact O-NH2 3.11Å; I361-R394 WeakPolarHBondContact O-CG 3.46Å; I361-R394 PolarHBondContact O-N 3.09Å; R394-T396 PolarHBondContact O-N 2.85Å; R394-T396 VanDerWaalsContact O-N 3.09Å; R394-A397 HydrophobicContact CB-CB 4.34Å; R394-A397 WeakPolarHBondContact O-CB 3.25Å; R394-A397 PolarHBondContact O-N 2.99Å
395	P	93.1	Very high	97.4	Very high	133 Å²	133	34.5 Å²	34.5	86%	0.864	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-56.9	-27.5	176.6	-27.5	35.5	0	0	0	114.8
396	T	94.6	Very high	97.5	Very high	123 Å²	123	34.5 Å²	34.5	76%	0.755	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	22.2	178.4	62.5	0	0	0	0	112.2	R394 T398	R394-T396 PolarHBondContact O-N 2.85Å; R394-T396 VanDerWaalsContact O-N 3.09Å; T396-T398 PolarHBondContact O-N 2.82Å
397	A	97.5	Very high	97.5	Very high	24 Å²	24	34.5 Å²	34.5	20%	0.198	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136.4	-178.1	0	0	0	0	0	111.1	I361 S362 L393 R394	I361-A397 WeakPolarHBondContact O-CB 3.37Å; S362-A397 CarbonylContact O-C 3.54Å; S362-A397 WeakPolarHBondContact O-CA 3.25Å; L393-A397 HydrophobicContact CB-CB 4.02Å; R394-A397 HydrophobicContact CB-CB 4.34Å; R394-A397 WeakPolarHBondContact O-CB 3.25Å; R394-A397 PolarHBondContact O-N 2.99Å
398	T	98.1	Very high	97.5	Very high	54 Å²	54	32.5 Å²	32.5	33%	0.331	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	137.1	172.7	-53.7	0	0	0	0	109.8	V287 S362 V363 L364 T396	V287-T398 HydrophobicContact CB-CG2 3.91Å; V287-T398 HydrophobicContact CG1-CG2 3.75Å; S362-T398 PolarHBondContact O-N 3.19Å; V363-T398 CarbonylContact C-O 3.54Å; V363-T398 WeakPolarHBondContact CA-O 3.34Å; L364-T398 PolarHBondContact N-O 3.2Å; T396-T398 PolarHBondContact O-N 2.82Å
399	I	98.4	Very high	97.5	Very high	11 Å²	11	30.5 Å²	30.5	6%	0.056	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.9	174.5	-43.5	-58.8	0	0	0	108	L364 F382 R386 L393 P401 C402 F474	L364-I399 HydrophobicContact CB-CD1 3.88Å; L364-I399 HydrophobicContact CD2-CD1 4.23Å; L364-I399 CarbonylContact O-C 3.54Å; L364-I399 WeakPolarHBondContact O-CA 3.38Å; F382-I399 HydrophobicContact CE1-CG2 4.01Å; F382-I399 HydrophobicContact CZ-CG2 4.19Å; R386-I399 HydrophobicContact CG-CD1 4.33Å; R386-I399 HydrophobicContact CG-CG2 4.29Å; L393-I399 HydrophobicContact CD1-CD1 3.95Å; I399-P401 CarbonylContact C-O 3.59Å; I399-P401 WeakPolarHBondContact CG2-O 3.26Å; I399-P401 CarbonylContact O-C 3.51Å; I399-C402 WeakPolarHBondContact O-CA 3.46Å; I399-C402 PolarHBondContact O-N 3.01Å; I399-F474 HydrophobicContact CG2-CB 3.98Å
400	L	98.1	Very high	97.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	110.5	-179	-175.5	151.2	0	0	0	109.6	Y280 A283 L284 V287 L303 L364 M365 G366	Y280-L400 HydrophobicContact CD1-CD2 4.4Å; A283-L400 HydrophobicContact CB-CD1 3.88Å; L284-L400 HydrophobicContact CD2-CD1 4.33Å; V287-L400 HydrophobicContact CG1-CD1 4.33Å; V287-L400 HydrophobicContact CG2-CD1 3.8Å; L303-L400 HydrophobicContact CD2-CD2 4.35Å; L364-L400 PolarHBondContact O-N 3.28Å; M365-L400 CarbonylContact C-O 3.54Å; M365-L400 WeakPolarHBondContact CA-O 3.44Å; M365-L400 HydrophobicContact CB-CB 4.28Å; M365-L400 HydrophobicContact CB-CD2 4.24Å; G366-L400 PolarHBondContact N-O 2.9Å
401	P	98.3	Very high	97.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	19%	0.187	C	C	.	.	S	Bend	cis	-64.5	151.6	-0.5	23.2	-31.7	0	0	0	114.3	G366 P368 F382 I399 F474 C506 H507 L508	G366-P401 VanDerWaalsContact O-CD 3.31Å; G366-P401 WeakPolarHBondContact O-CD 3.24Å; P368-P401 HydrophobicContact CG-CG 4.3Å; F382-P401 HydrophobicContact CE1-CG 4.42Å; I399-P401 CarbonylContact C-O 3.59Å; I399-P401 WeakPolarHBondContact CG2-O 3.26Å; I399-P401 CarbonylContact O-C 3.51Å; P401-F474 HydrophobicContact CB-CD2 4.34Å; P401-F474 HydrophobicContact CG-CD2 3.85Å; P401-F474 HydrophobicContact CG-CE2 3.78Å; P401-F474 WeakPolarHBondContact O-CD2 3.48Å; P401-C506 HydrophobicContact CB-CB 4.36Å; P401-C506 HydrophobicContact CG-CB 4.42Å; P401-H507 CarbonylContact C-O 3.59Å; P401-H507 VanDerWaalsContact CA-O 3.3Å; P401-H507 WeakPolarHBondContact CA-O 3.29Å; P401-H507 WeakPolarHBondContact CB-O 3.46Å; P401-L508 HydrophobicContact CB-CD2 4.12Å
402	C	97.9	Very high	97.8	Very high	23 Å²	23	27.2 Å²	27.2	16%	0.155	16%	0.159	C	C	.	.			trans	-76.7	-30.2	175.1	60.3	0	0	0	0	111.8	I399 F474 T475 H507	I399-C402 WeakPolarHBondContact O-CA 3.46Å; I399-C402 PolarHBondContact O-N 3.01Å; C402-F474 WeakPolarHBondContact O-CA 3.31Å; C402-F474 WeakPolarHBondContact O-CB 3.4Å; C402-F474 PolarHBondContact O-N 3.1Å; C402-T475 HydrophobicContact CB-CG2 4.28Å; C402-T475 PolarHBondContact O-N 3.25Å; C402-H507 PolarHBondContact N-O 3.18Å; C402-H507 PolarHBondContact SG-O 3.41Å
403	S	98.3	Very high	97.8	Very high	22 Å²	22	25.8 Å²	25.8	15%	0.154	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	169.9	175	62	0	0	0	0	111.7	F472 H507	S403-F472 CarbonylContact C-O 3.58Å; S403-F472 WeakPolarHBondContact CA-O 3.34Å; S403-F472 WeakPolarHBondContact CB-O 3.26Å; S403-H507 PolarHBondContact N-O 3.36Å; S403-H507 PolarHBondContact O-N 3.3Å; S403-H507 WeakPolarHBondContact OG-CB 3.48Å; S403-H507 PolarHBondContact OG-CD2 2.94Å; S403-H507 VanDerWaalsContact OG-CD2 3.22Å
404	A	98.4	Very high	97.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	158.9	168.8	0	0	0	0	0	110.1	F472 F474 M504 D505	A404-F472 PolarHBondContact N-O 2.55Å; A404-F472 WeakPolarHBondContact O-CD2 3.27Å; A404-F472 PolarHBondContact O-N 3.39Å; A404-F474 HydrophobicContact CB-CE1 4.31Å; A404-F474 HydrophobicContact CB-CE2 3.94Å; A404-F474 HydrophobicContact CB-CZ 3.59Å; A404-M504 HydrophobicContact CB-CE 3.73Å; A404-D505 CarbonylContact C-O 3.49Å; A404-D505 WeakPolarHBondContact CA-O 3.39Å; A404-D505 WeakPolarHBondContact CB-O 3.5Å
405	S	98.4	Very high	97.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139	-179.9	60	0	0	0	0	111.5	H407 E468 M470 M504 D505 H507	S405-H407 PolarHBondContact OG-CD2 3.15Å; S405-H407 VanDerWaalsContact OG-CD2 3.23Å; S405-H407 PolarHBondContact OG-NE2 3.36Å; S405-E468 WeakPolarHBondContact CB-OE2 3.23Å; S405-M470 CarbonylContact C-O 3.59Å; S405-M470 WeakPolarHBondContact CA-O 3.27Å; S405-M504 WeakPolarHBondContact O-CA 3.33Å; S405-D505 PolarHBondContact N-O 2.99Å; S405-D505 PolarHBondContact O-N 3.48Å; S405-H507 WeakPolarHBondContact CB-NE2 3.29Å; S405-H507 PolarHBondContact OG-NE2 2.72Å
406	L	98.7	Very high	98.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	126.3	171.2	-179.2	65.8	0	0	0	109	W377 V469 M470 F472 L502 M504 F559 V568	W377-L406 HydrophobicContact CE3-CD1 4.02Å; W377-L406 HydrophobicContact CZ3-CD1 4.47Å; L406-V469 HydrophobicContact CB-CG2 4.11Å; L406-V469 HydrophobicContact CD2-CG2 3.91Å; L406-V469 HydrophobicContact CG-CG2 3.81Å; L406-V469 VanDerWaalsContact O-CG2 3.29Å; L406-V469 WeakPolarHBondContact O-CG2 3.24Å; L406-V469 PolarHBondContact O-N 2.92Å; L406-M470 HydrophobicContact CB-CB 4.13Å; L406-M470 HydrophobicContact CD2-CG 4.43Å; L406-M470 HydrophobicContact CD2-SD 4.2Å; L406-M470 PolarHBondContact N-O 2.73Å; L406-M470 PolarHBondContact O-N 3.41Å; L406-F472 HydrophobicContact CB-CE2 4.13Å; L406-L502 HydrophobicContact CD1-CB 4.36Å; L406-M504 HydrophobicContact CB-SD 3.89Å; L406-M504 HydrophobicContact CD1-SD 3.81Å; L406-M504 HydrophobicContact CG-SD 4.47Å; L406-F559 HydrophobicContact CD2-CD1 3.99Å; L406-F559 HydrophobicContact CD2-CE1 3.94Å; L406-F559 HydrophobicContact CD2-CZ 4.48Å; L406-V568 HydrophobicContact CD2-CG1 4.13Å
407	H	98.7	Very high	98.2	Very high	25 Å²	25	19.6 Å²	19.6	12%	0.116	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	152.2	178	-71.8	-102.9	0	0	0	111.2	S405 T467 E468 L502 W503 D505	S405-H407 PolarHBondContact OG-CD2 3.15Å; S405-H407 VanDerWaalsContact OG-CD2 3.23Å; S405-H407 PolarHBondContact OG-NE2 3.36Å; H407-T467 WeakPolarHBondContact CA-O 3.42Å; H407-E468 IonicContact CE1-OE2 3.94Å; H407-E468 IonicContact NE2-OE2 3.06Å; H407-L502 VanDerWaalsContact O-CA 3.29Å; H407-L502 WeakPolarHBondContact O-CA 3.45Å; H407-W503 HydrophobicContact CB-CD2 3.75Å; H407-W503 HydrophobicContact CB-CE3 4.15Å; H407-W503 HydrophobicContact CB-CG 4.35Å; H407-W503 HydrophobicContact CB-CH2 3.75Å; H407-W503 HydrophobicContact CB-CZ2 3.32Å; H407-W503 HydrophobicContact CB-CZ3 4.14Å; H407-W503 AromaticContact CG-CE2 4Å; H407-W503 AromaticContact CG-CZ2 3.97Å; H407-W503 AromaticContact CG-NE1 3.96Å; H407-W503 PolarHBondContact N-O 2.93Å; H407-W503 PolarHBondContact O-N 2.96Å; H407-W503 VanDerWaalsContact O-N 3.08Å; H407-D505 IonicContact CD2-OD2 3.52Å; H407-D505 IonicContact NE2-OD2 3.55Å
408	V	98.7	Very high	98.1	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	152.7	178.1	-55.2	0	0	0	0	112.3	P466 T467 V469 L489 V500 A501 L502 F559	V408-P466 WeakPolarHBondContact O-CA 3.35Å; V408-T467 PolarHBondContact N-O 2.98Å; V408-T467 PolarHBondContact O-N 3.23Å; V408-V469 HydrophobicContact CB-CG1 4.46Å; V408-V469 HydrophobicContact CG1-CG1 4.15Å; V408-V469 HydrophobicContact CG1-CG2 3.8Å; V408-V469 HydrophobicContact CG2-CG1 3.49Å; V408-V469 VanDerWaalsContact CG2-CG1 3.49Å; V408-L489 HydrophobicContact CG2-CD1 3.64Å; V408-L489 HydrophobicContact CG2-CD2 3.98Å; V408-L489 HydrophobicContact CG2-CG 4.41Å; V408-V500 HydrophobicContact CB-CG1 3.83Å; V408-V500 HydrophobicContact CG1-CG1 4.42Å; V408-A501 CarbonylContact C-O 3.59Å; V408-A501 VanDerWaalsContact CA-O 3.27Å; V408-A501 WeakPolarHBondContact CA-O 3.16Å; V408-L502 HydrophobicContact CG1-CD2 3.91Å; V408-L502 HydrophobicContact CG1-CG 3.95Å; V408-F559 HydrophobicContact CG1-CE2 4.02Å; V408-F559 HydrophobicContact CG1-CZ 3.69Å
409	V	98.7	Very high	98	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	133.9	169.1	67.4	0	0	0	0	110.4	V411 A462 V500 A501 W503 I522 W530	V409-V411 HydrophobicContact CG1-CG1 3.82Å; V409-A462 HydrophobicContact CG2-CB 3.57Å; V409-V500 WeakPolarHBondContact O-CA 3.39Å; V409-A501 HydrophobicContact CG1-CB 4.12Å; V409-A501 PolarHBondContact N-O 2.86Å; V409-A501 PolarHBondContact O-N 3.06Å; V409-W503 HydrophobicContact CB-CH2 4.27Å; V409-W503 HydrophobicContact CB-CZ3 4.14Å; V409-W503 HydrophobicContact CG1-CH2 4.14Å; V409-W503 HydrophobicContact CG1-CZ3 3.7Å; V409-I522 HydrophobicContact CG2-CD1 4.14Å; V409-W530 HydrophobicContact CG1-CH2 3.89Å; V409-W530 HydrophobicContact CG1-CZ2 4.39Å
410	A	98.4	Very high	97.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	133.3	174.5	0	0	0	0	0	109.8	L463 T464 F491 V500 V555	A410-L463 PolarHBondContact O-N 3.3Å; A410-T464 HydrophobicContact CB-CG2 3.57Å; A410-T464 PolarHBondContact N-OG1 3.2Å; A410-F491 HydrophobicContact CB-CE1 4.03Å; A410-V500 HydrophobicContact CB-CG2 4.47Å; A410-V555 HydrophobicContact CB-CG2 3.82Å
411	V	98.6	Very high	97.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.4	-169	-63.5	0	0	0	0	113.5	V409 F413 C460 R461 H498 G499 A501	V409-V411 HydrophobicContact CG1-CG1 3.82Å; V411-F413 HydrophobicContact CG2-CD2 3.99Å; V411-F413 HydrophobicContact CG2-CE1 4.2Å; V411-F413 HydrophobicContact CG2-CE2 3.43Å; V411-F413 VanDerWaalsContact CG2-CE2 3.43Å; V411-F413 HydrophobicContact CG2-CZ 3.54Å; V411-C460 HydrophobicContact CB-CB 4.29Å; V411-R461 CarbonylContact C-O 3.44Å; V411-R461 WeakPolarHBondContact CA-O 3.49Å; V411-H498 PolarHBondContact O-N 2.89Å; V411-G499 PolarHBondContact N-O 3.13Å; V411-G499 PolarHBondContact O-N 3.14Å; V411-A501 HydrophobicContact CG1-CB 4.28Å; V411-A501 HydrophobicContact CG2-CB 4.43Å
412	E	98.6	Very high	97.2	Very high	47 Å²	47	33.9 Å²	33.9	22%	0.22	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	103	161.8	176.3	178.5	62.1	0	0	108	C460 R461 L463 G495 R496	E412-C460 CarbonylContact O-C 3.58Å; E412-C460 VanDerWaalsContact O-CA 3.27Å; E412-C460 WeakPolarHBondContact O-CA 3.06Å; E412-R461 HydrophobicContact CB-CB 4.49Å; E412-R461 PolarHBondContact N-O 2.94Å; E412-R461 PolarHBondContact O-N 3.02Å; E412-R461 IonicContact OE1-CZ 3.2Å; E412-R461 VanDerWaalsContact OE1-CZ 3.26Å; E412-R461 IonicContact OE1-NE 2.79Å; E412-R461 PolarHBondContact OE1-NE 2.93Å; E412-R461 IonicContact OE1-NH2 2.73Å; E412-R461 PolarHBondContact OE1-NH2 2.82Å; E412-R461 IonicContact OE2-NH2 3.33Å; E412-L463 HydrophobicContact CB-CD1 4.14Å; E412-L463 HydrophobicContact CB-CD2 4.2Å; E412-L463 HydrophobicContact CB-CG 4.21Å; E412-G495 WeakPolarHBondContact OE2-CA 3.48Å; E412-R496 WeakPolarHBondContact CA-O 3.47Å; E412-R496 VanDerWaalsContact CB-O 3.24Å; E412-R496 WeakPolarHBondContact CB-O 3.49Å; E412-R496 WeakPolarHBondContact CG-O 3.38Å; E412-R496 PolarHBondContact OE2-N 2.87Å
413	F	98.4	Very high	97	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	140.9	168	-70.4	-70.2	0	0	0	111.3	V411 L416 W417 L455 C460 H498 V538 F540	V411-F413 HydrophobicContact CG2-CD2 3.99Å; V411-F413 HydrophobicContact CG2-CE1 4.2Å; V411-F413 HydrophobicContact CG2-CE2 3.43Å; V411-F413 VanDerWaalsContact CG2-CE2 3.43Å; V411-F413 HydrophobicContact CG2-CZ 3.54Å; F413-L416 HydrophobicContact CB-CB 4.11Å; F413-L416 HydrophobicContact CD1-CB 3.78Å; F413-L416 HydrophobicContact CD1-CD2 3.98Å; F413-L416 HydrophobicContact CD1-CG 4.46Å; F413-L416 HydrophobicContact CD2-CB 4.48Å; F413-L416 HydrophobicContact CE1-CB 4.38Å; F413-L416 HydrophobicContact CE1-CD2 3.69Å; F413-L416 HydrophobicContact CE2-CD2 4.37Å; F413-L416 HydrophobicContact CG-CB 3.87Å; F413-L416 HydrophobicContact CG-CD2 4.47Å; F413-L416 HydrophobicContact CZ-CD2 3.9Å; F413-W417 HydrophobicContact CB-CB 4.35Å; F413-L455 HydrophobicContact CE1-CD2 3.66Å; F413-L455 HydrophobicContact CZ-CD2 3.92Å; F413-C460 HydrophobicContact CD1-CB 3.42Å; F413-C460 VanDerWaalsContact CD1-CB 3.42Å; F413-C460 HydrophobicContact CE1-CB 3.67Å; F413-C460 HydrophobicContact CG-CB 4.19Å; F413-H498 HydrophobicContact CD2-CB 4.03Å; F413-H498 PolarHBondContact N-ND1 2.84Å; F413-H498 VanDerWaalsContact N-ND1 3.12Å; F413-H498 PolarHBondContact O-CE1 3.25Å; F413-H498 PolarHBondContact O-ND1 3.06Å; F413-V538 HydrophobicContact CE2-CG1 3.66Å; F413-V538 HydrophobicContact CZ-CG1 3.81Å; F413-V538 HydrophobicContact CZ-CG2 4.14Å; F413-F540 HydrophobicContact CD2-CE1 4.27Å; F413-F540 HydrophobicContact CE2-CE1 4.17Å
414	Q	97.1	Very high	96.9	Very high	118 Å²	118	36.1 Å²	36.1	55%	0.551	19%	0.186	S	C	*	.	S	Bend	trans	-62.6	-51	168.2	-168.3	-174.4	-53.7	0	0	109.8	W417 P459	Q414-W417 PolarHBondContact O-NE1 3.48Å; Q414-W417 VanDerWaalsContact O-NE1 3.09Å; Q414-P459 HydrophobicContact CB-CB 4.25Å; Q414-P459 PolarHBondContact N-O 2.77Å
415	D	97.6	Very high	96.8	Very high	19 Å²	19	42 Å²	42	10%	0.102	22%	0.216	C	C	.	.	S	Bend	trans	-136.3	-29.4	-170.7	-54.6	-68	0	0	0	116.8	W198 W417 R418	W198-D415 HydrophobicContact CB-CB 4.24Å; W198-D415 HydrophobicContact CD2-CB 3.21Å; W198-D415 VanDerWaalsContact CE2-CB 3.47Å; W198-D415 HydrophobicContact CE3-CB 3.5Å; W198-D415 VanDerWaalsContact CE3-CB 3.5Å; W198-D415 HydrophobicContact CG-CB 3.56Å; W198-D415 HydrophobicContact CH2-CB 4.15Å; W198-D415 WeakPolarHBondContact CH2-O 3.12Å; W198-D415 HydrophobicContact CZ2-CB 3.94Å; W198-D415 HydrophobicContact CZ3-CB 3.96Å; W198-D415 WeakPolarHBondContact CZ3-O 3.36Å; D415-W417 PolarHBondContact O-N 3.48Å; D415-R418 WeakPolarHBondContact O-CB 3.42Å; D415-R418 WeakPolarHBondContact O-CG 3.1Å; D415-R418 PolarHBondContact O-N 2.92Å; D415-R418 IonicContact OD1-CZ 3.69Å; D415-R418 IonicContact OD1-NH1 3.13Å; D415-R418 PolarHBondContact OD1-NH1 3.12Å; D415-R418 IonicContact OD1-NH2 3.26Å
416	L	98.1	Very high	96.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-56.2	-27	-175.7	-175.1	65.8	0	0	0	113.7	F413 R418 I419 H453 L455 Y458 F540	F413-L416 HydrophobicContact CB-CB 4.11Å; F413-L416 HydrophobicContact CD1-CB 3.78Å; F413-L416 HydrophobicContact CD1-CD2 3.98Å; F413-L416 HydrophobicContact CD1-CG 4.46Å; F413-L416 HydrophobicContact CD2-CB 4.48Å; F413-L416 HydrophobicContact CE1-CB 4.38Å; F413-L416 HydrophobicContact CE1-CD2 3.69Å; F413-L416 HydrophobicContact CE2-CD2 4.37Å; F413-L416 HydrophobicContact CG-CB 3.87Å; F413-L416 HydrophobicContact CG-CD2 4.47Å; F413-L416 HydrophobicContact CZ-CD2 3.9Å; L416-R418 PolarHBondContact O-N 3.39Å; L416-R418 VanDerWaalsContact O-N 3.07Å; L416-I419 HydrophobicContact CD1-CD1 3.72Å; L416-I419 HydrophobicContact CD1-CG1 4.5Å; L416-I419 HydrophobicContact CD1-CG2 4.3Å; L416-I419 HydrophobicContact CG-CD1 4.38Å; L416-I419 WeakPolarHBondContact O-CG1 3.46Å; L416-I419 PolarHBondContact O-N 3.41Å; L416-H453 HydrophobicContact CD2-CB 4.38Å; L416-L455 HydrophobicContact CD2-CD2 3.91Å; L416-Y458 HydrophobicContact CB-CD1 4.11Å; L416-Y458 HydrophobicContact CB-CG 4.18Å; L416-Y458 HydrophobicContact CD1-CD1 3.68Å; L416-Y458 HydrophobicContact CD1-CD2 4.15Å; L416-Y458 HydrophobicContact CD1-CE1 3.71Å; L416-Y458 HydrophobicContact CD1-CE2 4.18Å; L416-Y458 HydrophobicContact CD1-CG 3.88Å; L416-Y458 HydrophobicContact CD2-CD2 4.07Å; L416-Y458 HydrophobicContact CD2-CG 3.93Å; L416-Y458 HydrophobicContact CG-CD1 4.3Å; L416-Y458 HydrophobicContact CG-CG 4.21Å; L416-F540 HydrophobicContact CD2-CZ 4.2Å; L416-F540 HydrophobicContact CG-CE1 4.36Å; L416-F540 HydrophobicContact CG-CZ 3.99Å
417	W	96.8	Very high	96.6	Very high	65 Å²	65	53.2 Å²	53.2	25%	0.246	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-55.6	-26.3	175.8	68	-91.1	0	0	0	113.5	F413 Q414 D415 I419 R420 A421 H498	F413-W417 HydrophobicContact CB-CB 4.35Å; Q414-W417 PolarHBondContact O-NE1 3.48Å; Q414-W417 VanDerWaalsContact O-NE1 3.09Å; D415-W417 PolarHBondContact O-N 3.48Å; W417-I419 VanDerWaalsContact C-N 3.26Å; W417-I419 PolarHBondContact O-N 2.94Å; W417-R420 PolarHBondContact O-N 3.02Å; W417-A421 HydrophobicContact CE3-CB 3.57Å; W417-A421 HydrophobicContact CZ3-CB 3.56Å; W417-A421 PolarHBondContact O-N 2.81Å; W417-H498 HydrophobicContact CB-CB 3.76Å; W417-H498 AromaticContact CD1-CE1 3.52Å; W417-H498 AromaticContact CD1-ND1 3.64Å; W417-H498 AromaticContact CD1-NE2 4Å; W417-H498 AromaticContact CG-CD2 3.93Å; W417-H498 AromaticContact CG-CE1 3.8Å; W417-H498 AromaticContact CG-CG 3.91Å; W417-H498 AromaticContact CG-ND1 3.8Å; W417-H498 AromaticContact CG-NE2 3.88Å; W417-H498 AromaticContact NE1-CE1 3.95Å
418	R	96.2	Very high	96.5	Very high	117 Å²	117	55.3 Å²	55.3	44%	0.442	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-66.1	-23.4	-178.5	-67.8	-170.9	-175.3	83.6	-3.9	113.7	W198 D415 L416 R420	W198-R418 HydrophobicContact CZ3-CB 4.18Å; D415-R418 WeakPolarHBondContact O-CB 3.42Å; D415-R418 WeakPolarHBondContact O-CG 3.1Å; D415-R418 PolarHBondContact O-N 2.92Å; D415-R418 IonicContact OD1-CZ 3.69Å; D415-R418 IonicContact OD1-NH1 3.13Å; D415-R418 PolarHBondContact OD1-NH1 3.12Å; D415-R418 IonicContact OD1-NH2 3.26Å; L416-R418 PolarHBondContact O-N 3.39Å; L416-R418 VanDerWaalsContact O-N 3.07Å; R418-R420 PolarHBondContact O-N 2.95Å
419	I	95.1	Very high	96.3	Very high	41 Å²	41	62.6 Å²	62.6	21%	0.21	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-71.1	-15	-177.6	80.3	-179.9	0	0	0	112.9	W198 D200 L416 W417 H453 F540	W198-I419 HydrophobicContact CH2-CG2 4.01Å; D200-I419 HydrophobicContact CB-CG2 3.89Å; L416-I419 HydrophobicContact CD1-CD1 3.72Å; L416-I419 HydrophobicContact CD1-CG1 4.5Å; L416-I419 HydrophobicContact CD1-CG2 4.3Å; L416-I419 HydrophobicContact CG-CD1 4.38Å; L416-I419 WeakPolarHBondContact O-CG1 3.46Å; L416-I419 PolarHBondContact O-N 3.41Å; W417-I419 VanDerWaalsContact C-N 3.26Å; W417-I419 PolarHBondContact O-N 2.94Å; I419-H453 VanDerWaalsContact CD1-CE1 3.48Å; I419-H453 WeakPolarHBondContact CD1-CE1 3.5Å; I419-F540 HydrophobicContact CD1-CE2 4.23Å; I419-F540 HydrophobicContact CD1-CZ 4.05Å; I419-F540 HydrophobicContact CG1-CE2 4.43Å; I419-F540 HydrophobicContact CG1-CZ 4.18Å
420	R	93	Very high	96.2	Very high	98 Å²	98	68 Å²	68	37%	0.37	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-5.9	177.8	-65	-55.1	171.7	-106.3	-2.8	114.3	W417 R418 E451 F540	W417-R420 PolarHBondContact O-N 3.02Å; R418-R420 PolarHBondContact O-N 2.95Å; R420-E451 IonicContact CZ-OE1 3.3Å; R420-E451 IonicContact CZ-OE2 3.94Å; R420-E451 VanDerWaalsContact CZ-OE2 3.3Å; R420-E451 IonicContact NE-OE1 3.78Å; R420-E451 PolarHBondContact NE-OE1 2.87Å; R420-E451 IonicContact NE-OE2 3.51Å; R420-E451 PolarHBondContact NE-OE2 3.05Å; R420-E451 VanDerWaalsContact NH2-CD 3.34Å; R420-E451 IonicContact NH2-OE1 3.18Å; R420-E451 PolarHBondContact NH2-OE1 2.82Å; R420-E451 IonicContact NH2-OE2 2.73Å; R420-E451 PolarHBondContact NH2-OE2 2.73Å; R420-F540 HydrophobicContact CB-CB 4.4Å; R420-F540 HydrophobicContact CB-CD2 4.27Å; R420-F540 HydrophobicContact CB-CG 4.19Å; R420-F540 HydrophobicContact CG-CB 4.48Å; R420-F540 HydrophobicContact CG-CD2 3.57Å; R420-F540 HydrophobicContact CG-CE2 3.87Å; R420-F540 HydrophobicContact CG-CG 4Å
421	A	92.4	Very high	96.1	Very high	36 Å²	36	70 Å²	70	30%	0.298	38%	0.375	S	S	.	.	S	Bend	trans	-72.3	140.5	178.2	0	0	0	0	0	111.2	W417	W417-A421 HydrophobicContact CE3-CB 3.57Å; W417-A421 HydrophobicContact CZ3-CB 3.56Å; W417-A421 PolarHBondContact O-N 2.81Å
422	P	93.1	Very high	96	Very high	96 Å²	96	72.4 Å²	72.4	62%	0.623	39%	0.39	S	S	*	.			trans	-63.9	142.1	171.7	28.3	-34.2	0	0	0	110.2	D435	P422-D435 WeakPolarHBondContact CA-OD1 3.39Å; P422-D435 HydrophobicContact CB-CB 3.98Å
423	C	94.4	Very high	96	Very high	72 Å²	72	74.1 Å²	74.1	49%	0.486	41%	0.405	S	S	.	.			trans	-85	-40.1	-179.2	-175.3	0	0	0	0	112	I425 V431 D435	C423-I425 PolarHBondContact O-N 2.92Å; C423-V431 HydrophobicContact CB-CG2 3.79Å; C423-D435 VanDerWaalsContact N-CG 3.34Å; C423-D435 PolarHBondContact N-OD1 3.19Å; C423-D435 PolarHBondContact N-OD2 3.23Å; C423-D435 VanDerWaalsContact N-OD2 3.16Å
424	G	95.5	Very high	95.8	Very high	21 Å²	21	79 Å²	79	22%	0.216	43%	0.429	C	S	.	.			trans	68.4	-88.8	-176.1	0	0	0	0	0	112.5	V431 T432 D435	G424-V431 VanDerWaalsContact O-CG2 3.25Å; G424-V431 WeakPolarHBondContact O-CG2 3.21Å; G424-V431 PolarHBondContact O-N 2.74Å; G424-T432 PolarHBondContact O-N 2.94Å; G424-D435 WeakPolarHBondContact CA-OD2 3.08Å; G424-D435 PolarHBondContact N-OD2 2.7Å
425	I	96.9	Very high	95.6	Very high	124 Å²	124	74.9 Å²	74.9	64%	0.636	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	121.3	-179.8	-59	176.3	0	0	0	109.3	C423 F429	C423-I425 PolarHBondContact O-N 2.92Å; I425-F429 WeakPolarHBondContact CA-O 3.16Å
426	C	96.1	Very high	95.4	Very high	59 Å²	59	79.2 Å²	79.2	40%	0.399	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	116.6	176.6	-172.2	0	0	0	0	109.7	G428 F429 V431	C426-G428 PolarHBondContact O-N 3.3Å; C426-F429 PolarHBondContact N-O 2.87Å; C426-F429 WeakPolarHBondContact O-CB 3.22Å; C426-F429 WeakPolarHBondContact O-CD2 3.49Å; C426-F429 PolarHBondContact O-N 2.55Å; C426-V431 HydrophobicContact CB-CG1 4.3Å; C426-V431 HydrophobicContact CB-CG2 4.11Å
427	E	95.9	Very high	95.1	Very high	176 Å²	176	83.6 Å²	83.6	82%	0.822	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	32.2	179.6	-61	-56.8	126.1	0	0	114.5	F429	E427-F429 HydrophobicContact CB-CD2 4.44Å
428	G	96.1	Very high	94.8	Very high	68 Å²	68	83 Å²	83	70%	0.701	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-1.7	-178.5	0	0	0	0	0	115.4	C426	C426-G428 PolarHBondContact O-N 3.3Å
429	F	95.4	Very high	94.3	Very high	154 Å²	154	80.3 Å²	80.3	68%	0.675	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.7	173	-58.1	-82	0	0	0	110.8	I425 C426 E427 V431	I425-F429 WeakPolarHBondContact CA-O 3.16Å; C426-F429 PolarHBondContact N-O 2.87Å; C426-F429 WeakPolarHBondContact O-CB 3.22Å; C426-F429 WeakPolarHBondContact O-CD2 3.49Å; C426-F429 PolarHBondContact O-N 2.55Å; E427-F429 HydrophobicContact CB-CD2 4.44Å; F429-V431 PolarHBondContact O-N 3.22Å
430	D	96.6	Very high	94	Very high	112 Å²	112	86.3 Å²	86.3	60%	0.599	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	112.4	173	-177	2.7	0	0	0	109.9	T432	D430-T432 WeakPolarHBondContact OD1-CB 3.31Å; D430-T432 PolarHBondContact OD1-N 2.86Å; D430-T432 PolarHBondContact OD1-OG1 2.85Å
431	V	97.1	Very high	93.7	Very high	43 Å²	43	85.6 Å²	85.6	26%	0.261	48%	0.478	S	S	.	.			trans	-111.1	13.1	178.8	-62.8	0	0	0	0	112.2	C423 G424 C426 F429 P433 M434 D435	C423-V431 HydrophobicContact CB-CG2 3.79Å; G424-V431 VanDerWaalsContact O-CG2 3.25Å; G424-V431 WeakPolarHBondContact O-CG2 3.21Å; G424-V431 PolarHBondContact O-N 2.74Å; C426-V431 HydrophobicContact CB-CG1 4.3Å; C426-V431 HydrophobicContact CB-CG2 4.11Å; F429-V431 PolarHBondContact O-N 3.22Å; V431-P433 VanDerWaalsContact O-N 3.15Å; V431-M434 VanDerWaalsContact O-CB 3.31Å; V431-M434 WeakPolarHBondContact O-CB 3.48Å; V431-M434 PolarHBondContact O-N 2.96Å; V431-D435 PolarHBondContact O-N 2.91Å
432	T	96.6	Very high	93.3	Very high	51 Å²	51	86.5 Å²	86.5	31%	0.313	48%	0.478	S	S	.	.	H	α-helix	trans	-50.8	-35.3	175.2	-50.3	0	0	0	0	113.7	G424 D430 M434 D435 E436	G424-T432 PolarHBondContact O-N 2.94Å; D430-T432 WeakPolarHBondContact OD1-CB 3.31Å; D430-T432 PolarHBondContact OD1-N 2.86Å; D430-T432 PolarHBondContact OD1-OG1 2.85Å; T432-M434 PolarHBondContact O-N 3.16Å; T432-D435 WeakPolarHBondContact O-CB 3.32Å; T432-D435 PolarHBondContact O-N 3.39Å; T432-D435 VanDerWaalsContact O-N 3.08Å; T432-E436 HydrophobicContact CG2-CG 4.36Å; T432-E436 WeakPolarHBondContact O-CG 3.49Å; T432-E436 PolarHBondContact O-N 2.85Å
433	P	97	Very high	92.7	Very high	83 Å²	83	84.5 Å²	84.5	54%	0.539	46%	0.462	S	S	.	.	H	α-helix	trans	-58	-30.9	174	-27.4	36.6	0	0	0	114.5	V431 M437	V431-P433 VanDerWaalsContact O-N 3.15Å; P433-M437 PolarHBondContact O-N 2.95Å; P433-M437 VanDerWaalsContact O-N 3.1Å
434	M	94.3	Very high	91.9	Very high	104 Å²	104	89.6 Å²	89.6	51%	0.512	48%	0.476	S	S	.	.	H	α-helix	trans	-71.8	-43.8	174	-176.6	61.1	-173.5	0	0	110.8	V431 T432 E436 M437 V438	V431-M434 VanDerWaalsContact O-CB 3.31Å; V431-M434 WeakPolarHBondContact O-CB 3.48Å; V431-M434 PolarHBondContact O-N 2.96Å; T432-M434 PolarHBondContact O-N 3.16Å; M434-E436 VanDerWaalsContact C-N 3.3Å; M434-E436 PolarHBondContact O-N 2.98Å; M434-M437 HydrophobicContact CE-CE 3.72Å; M434-M437 WeakPolarHBondContact O-CB 3.05Å; M434-M437 PolarHBondContact O-N 2.71Å; M434-M437 VanDerWaalsContact O-N 3.09Å; M434-M437 HydrophobicContact SD-CE 3.56Å; M434-M437 VanDerWaalsContact SD-CE 3.56Å; M434-M437 HydrophobicContact SD-SD 4.45Å; M434-V438 HydrophobicContact CE-CG2 3.73Å; M434-V438 WeakPolarHBondContact O-CG2 3.48Å; M434-V438 PolarHBondContact O-N 2.9Å; M434-V438 HydrophobicContact SD-CG2 4.46Å
435	D	93	Very high	90.5	Very high	31 Å²	31	95.9 Å²	95.9	17%	0.166	49%	0.493	C	S	.	.	H	α-helix	trans	-57.6	-45.2	175.6	-62.6	-29.4	0	0	0	111	P422 C423 G424 V431 T432 M437 V438 Q439	P422-D435 WeakPolarHBondContact CA-OD1 3.39Å; P422-D435 HydrophobicContact CB-CB 3.98Å; C423-D435 VanDerWaalsContact N-CG 3.34Å; C423-D435 PolarHBondContact N-OD1 3.19Å; C423-D435 PolarHBondContact N-OD2 3.23Å; C423-D435 VanDerWaalsContact N-OD2 3.16Å; G424-D435 WeakPolarHBondContact CA-OD2 3.08Å; G424-D435 PolarHBondContact N-OD2 2.7Å; V431-D435 PolarHBondContact O-N 2.91Å; T432-D435 WeakPolarHBondContact O-CB 3.32Å; T432-D435 PolarHBondContact O-N 3.39Å; T432-D435 VanDerWaalsContact O-N 3.08Å; D435-M437 VanDerWaalsContact C-N 3.32Å; D435-M437 PolarHBondContact O-N 2.95Å; D435-V438 PolarHBondContact O-N 2.69Å; D435-Q439 VanDerWaalsContact O-CB 3.27Å; D435-Q439 WeakPolarHBondContact O-CB 3.33Å; D435-Q439 PolarHBondContact O-N 2.9Å
436	E	93.3	Very high	88.4	Confident	110 Å²	110	100.2 Å²	100.2	51%	0.514	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-34.7	176	-70.7	179.5	179.4	0	0	112.8	T432 M434 R440	T432-E436 HydrophobicContact CG2-CG 4.36Å; T432-E436 WeakPolarHBondContact O-CG 3.49Å; T432-E436 PolarHBondContact O-N 2.85Å; M434-E436 VanDerWaalsContact C-N 3.3Å; M434-E436 PolarHBondContact O-N 2.98Å; E436-R440 WeakPolarHBondContact O-CB 3.26Å; E436-R440 VanDerWaalsContact O-CG 3.23Å; E436-R440 WeakPolarHBondContact O-CG 3.45Å; E436-R440 PolarHBondContact O-N 2.78Å; E436-R440 VanDerWaalsContact O-N 3.13Å; E436-R440 PolarHBondContact O-NE 3.21Å
437	M	93.4	Very high	86.6	Confident	94 Å²	94	99.4 Å²	99.4	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-65.7	-51.6	175	-172.2	-174.7	86.3	0	0	110.5	P433 M434 D435 Q439 R440 S441	P433-M437 PolarHBondContact O-N 2.95Å; P433-M437 VanDerWaalsContact O-N 3.1Å; M434-M437 HydrophobicContact CE-CE 3.72Å; M434-M437 WeakPolarHBondContact O-CB 3.05Å; M434-M437 PolarHBondContact O-N 2.71Å; M434-M437 VanDerWaalsContact O-N 3.09Å; M434-M437 HydrophobicContact SD-CE 3.56Å; M434-M437 VanDerWaalsContact SD-CE 3.56Å; M434-M437 HydrophobicContact SD-SD 4.45Å; D435-M437 VanDerWaalsContact C-N 3.32Å; D435-M437 PolarHBondContact O-N 2.95Å; M437-Q439 PolarHBondContact O-N 2.64Å; M437-R440 PolarHBondContact O-N 3.38Å; M437-S441 PolarHBondContact O-N 2.89Å; M437-S441 PolarHBondContact O-OG 2.82Å
438	V	90	Very high	85.6	Confident	53 Å²	53	92.8 Å²	92.8	32%	0.321	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-47.1	179.8	173.6	0	0	0	0	110.7	M434 D435 R440 S441 L442	M434-V438 HydrophobicContact CE-CG2 3.73Å; M434-V438 WeakPolarHBondContact O-CG2 3.48Å; M434-V438 PolarHBondContact O-N 2.9Å; M434-V438 HydrophobicContact SD-CG2 4.46Å; D435-V438 PolarHBondContact O-N 2.69Å; V438-R440 VanDerWaalsContact C-N 3.34Å; V438-R440 PolarHBondContact O-N 3.42Å; V438-S441 WeakPolarHBondContact O-CB 3.19Å; V438-S441 PolarHBondContact O-N 2.92Å; V438-S441 VanDerWaalsContact O-N 3.12Å; V438-L442 HydrophobicContact CG1-CD1 3.9Å; V438-L442 HydrophobicContact CG1-CG 4.34Å; V438-L442 WeakPolarHBondContact O-CG 3.44Å; V438-L442 PolarHBondContact O-N 3Å
439	Q	85.8	Confident	85	Confident	61 Å²	61	94.6 Å²	94.6	29%	0.285	46%	0.463	S	S	.	.	H	α-helix	trans	-61.2	-42.6	-179.5	-173	62.2	41.8	0	0	111.7	D435 M437 S441 L442 D443 R448	D435-Q439 VanDerWaalsContact O-CB 3.27Å; D435-Q439 WeakPolarHBondContact O-CB 3.33Å; D435-Q439 PolarHBondContact O-N 2.9Å; M437-Q439 PolarHBondContact O-N 2.64Å; Q439-S441 VanDerWaalsContact C-N 3.33Å; Q439-S441 PolarHBondContact O-N 2.81Å; Q439-L442 PolarHBondContact O-N 3.46Å; Q439-D443 VanDerWaalsContact NE2-CG 3.26Å; Q439-D443 PolarHBondContact NE2-OD1 3.33Å; Q439-D443 PolarHBondContact NE2-OD2 3.37Å; Q439-D443 WeakPolarHBondContact O-CB 3.37Å; Q439-D443 PolarHBondContact O-N 3.13Å; Q439-R448 VanDerWaalsContact NE2-NH2 3.16Å
440	R	87.9	Confident	84.9	Confident	166 Å²	166	87.6 Å²	87.6	63%	0.626	43%	0.434	S	S	*	.	H	α-helix	trans	-63.2	-37	175.1	-78	-177.9	-68.6	173.4	-3.8	112.7	E436 M437 V438 F444	E436-R440 WeakPolarHBondContact O-CB 3.26Å; E436-R440 VanDerWaalsContact O-CG 3.23Å; E436-R440 WeakPolarHBondContact O-CG 3.45Å; E436-R440 PolarHBondContact O-N 2.78Å; E436-R440 VanDerWaalsContact O-N 3.13Å; E436-R440 PolarHBondContact O-NE 3.21Å; M437-R440 PolarHBondContact O-N 3.38Å; V438-R440 VanDerWaalsContact C-N 3.34Å; V438-R440 PolarHBondContact O-N 3.42Å; R440-F444 PolarHBondContact O-N 2.91Å; R440-F444 VanDerWaalsContact O-N 3.17Å
441	S	87.1	Confident	84.8	Confident	84 Å²	84	83.9 Å²	83.9	59%	0.587	41%	0.413	S	S	*	.	H	α-helix	trans	-67.3	-39.6	175.4	-67.7	0	0	0	0	112.3	M437 V438 Q439 F444	M437-S441 PolarHBondContact O-N 2.89Å; M437-S441 PolarHBondContact O-OG 2.82Å; V438-S441 WeakPolarHBondContact O-CB 3.19Å; V438-S441 PolarHBondContact O-N 2.92Å; V438-S441 VanDerWaalsContact O-N 3.12Å; Q439-S441 VanDerWaalsContact C-N 3.33Å; Q439-S441 PolarHBondContact O-N 2.81Å; S441-F444 WeakPolarHBondContact O-CB 3.31Å; S441-F444 PolarHBondContact O-N 3.23Å
442	L	82.9	Confident	84.8	Confident	54 Å²	54	84 Å²	84	28%	0.283	41%	0.414	S	S	.	.	H	α-helix	trans	-70.2	-36.5	177.7	-67	172.4	0	0	0	112.6	V438 Q439 F444	V438-L442 HydrophobicContact CG1-CD1 3.9Å; V438-L442 HydrophobicContact CG1-CG 4.34Å; V438-L442 WeakPolarHBondContact O-CG 3.44Å; V438-L442 PolarHBondContact O-N 3Å; Q439-L442 PolarHBondContact O-N 3.46Å; L442-F444 VanDerWaalsContact C-N 3.3Å
443	D	80.6	Confident	84.9	Confident	55 Å²	55	82.5 Å²	82.5	29%	0.294	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	2.9	178.4	-68.7	-32	0	0	0	113.2	Q439 R445 R448 R542	Q439-D443 VanDerWaalsContact NE2-CG 3.26Å; Q439-D443 PolarHBondContact NE2-OD1 3.33Å; Q439-D443 PolarHBondContact NE2-OD2 3.37Å; Q439-D443 WeakPolarHBondContact O-CB 3.37Å; Q439-D443 PolarHBondContact O-N 3.13Å; D443-R445 VanDerWaalsContact C-N 3.25Å; D443-R445 PolarHBondContact O-N 2.86Å; D443-R448 IonicContact OD1-NE 2.83Å; D443-R448 PolarHBondContact OD1-NE 3.11Å; D443-R542 IonicContact OD1-CZ 2.76Å; D443-R542 IonicContact OD1-NE 2.8Å; D443-R542 IonicContact OD1-NH2 3.84Å; D443-R542 PolarHBondContact OD1-NH2 3.43Å; D443-R542 IonicContact OD2-NH2 3.62Å
444	F	78.4	Confident	85	Confident	178 Å²	178	79.4 Å²	79.4	78%	0.781	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-29.6	-179	178.6	-102.1	0	0	0	112.8	R440 S441 L442	R440-F444 PolarHBondContact O-N 2.91Å; R440-F444 VanDerWaalsContact O-N 3.17Å; S441-F444 WeakPolarHBondContact O-CB 3.31Å; S441-F444 PolarHBondContact O-N 3.23Å; L442-F444 VanDerWaalsContact C-N 3.3Å
445	R	67.1	Low	85.2	Confident	154 Å²	154	74.5 Å²	74.5	58%	0.581	36%	0.359	S	S	*	.	S	Bend	trans	-83.9	147.6	173.6	-65	-169.5	-177.9	-172.7	6.2	110.2	D443 S447 E449	D443-R445 VanDerWaalsContact C-N 3.25Å; D443-R445 PolarHBondContact O-N 2.86Å; R445-S447 WeakPolarHBondContact CB-O 3.36Å; R445-S447 PolarHBondContact O-N 3.24Å; R445-E449 VanDerWaalsContact CD-OE1 3.28Å; R445-E449 WeakPolarHBondContact CD-OE1 3.47Å; R445-E449 IonicContact CZ-OE1 3.66Å; R445-E449 IonicContact CZ-OE2 3.75Å; R445-E449 IonicContact NE-OE1 2.92Å; R445-E449 IonicContact NH1-OE1 3.4Å; R445-E449 PolarHBondContact NH1-OE1 3.06Å; R445-E449 IonicContact NH1-OE2 3.71Å; R445-E449 PolarHBondContact NH1-OE2 3.2Å
446	E	52.3	Low	85.4	Confident	215 Å²	215	74.5 Å²	74.5	100%	1.005	36%	0.357	S	S	*	.	S	Bend	trans	-59.2	-18.8	177	-67.7	-177	163.4	0	0	113.2
447	S	58.8	Low	85.7	Confident	41 Å²	41	70.1 Å²	70.1	29%	0.287	34%	0.337	S	S	.	.	S	Bend	trans	-135.8	136.5	173.7	176.2	0	0	0	0	109.9	R445 M570	R445-S447 WeakPolarHBondContact CB-O 3.36Å; R445-S447 PolarHBondContact O-N 3.24Å; S447-M570 PolarHBondContact OG-O 2.62Å
448	R	73.7	Confident	85.9	Confident	37 Å²	37	66.2 Å²	66.2	14%	0.14	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-69.5	133.5	169.4	-88.1	-179.4	151	-146	-8.6	109.2	Q439 D443 Y539 F540	Q439-R448 VanDerWaalsContact NE2-NH2 3.16Å; D443-R448 IonicContact OD1-NE 2.83Å; D443-R448 PolarHBondContact OD1-NE 3.11Å; R448-Y539 HydrophobicContact CB-CE2 3.73Å; R448-Y539 WeakPolarHBondContact O-CE2 3.4Å; R448-F540 PolarHBondContact NH1-O 2.88Å
449	E	84	Confident	86.3	Confident	107 Å²	107	65.6 Å²	65.6	50%	0.5	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-97	149.6	179.8	-73.7	169.9	-161	0	0	111.2	R445	R445-E449 VanDerWaalsContact CD-OE1 3.28Å; R445-E449 WeakPolarHBondContact CD-OE1 3.47Å; R445-E449 IonicContact CZ-OE1 3.66Å; R445-E449 IonicContact CZ-OE2 3.75Å; R445-E449 IonicContact NE-OE1 2.92Å; R445-E449 IonicContact NH1-OE1 3.4Å; R445-E449 PolarHBondContact NH1-OE1 3.06Å; R445-E449 IonicContact NH1-OE2 3.71Å; R445-E449 PolarHBondContact NH1-OE2 3.2Å
450	A	92.9	Very high	86.9	Confident	6 Å²	6	63.3 Å²	63.3	5%	0.05	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-71.5	150	167.7	0	0	0	0	0	110.1	L375 W377 L502 V538 M570	L375-A450 WeakPolarHBondContact CD2-O 3.16Å; W377-A450 HydrophobicContact CH2-CB 3.93Å; A450-L502 HydrophobicContact CB-CD1 4.18Å; A450-V538 CarbonylContact C-O 3.6Å; A450-V538 WeakPolarHBondContact CA-O 3.48Å; A450-M570 HydrophobicContact CB-CE 4.46Å; A450-M570 HydrophobicContact CB-SD 3.96Å
451	E	95.3	Very high	87.4	Confident	34 Å²	34	58.5 Å²	58.5	16%	0.159	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	137	179.7	-60	178.4	-161.8	0	0	110.7	R420 H453 G537 V538	R420-E451 IonicContact CZ-OE1 3.3Å; R420-E451 IonicContact CZ-OE2 3.94Å; R420-E451 VanDerWaalsContact CZ-OE2 3.3Å; R420-E451 IonicContact NE-OE1 3.78Å; R420-E451 PolarHBondContact NE-OE1 2.87Å; R420-E451 IonicContact NE-OE2 3.51Å; R420-E451 PolarHBondContact NE-OE2 3.05Å; R420-E451 VanDerWaalsContact NH2-CD 3.34Å; R420-E451 IonicContact NH2-OE1 3.18Å; R420-E451 PolarHBondContact NH2-OE1 2.82Å; R420-E451 IonicContact NH2-OE2 2.73Å; R420-E451 PolarHBondContact NH2-OE2 2.73Å; E451-H453 WeakPolarHBondContact CB-NE2 3.49Å; E451-H453 PolarHBondContact O-CD2 3.03Å; E451-H453 PolarHBondContact O-N 2.75Å; E451-H453 IonicContact OE2-CE1 2.78Å; E451-H453 IonicContact OE2-NE2 3.14Å; E451-H453 PolarHBondContact OE2-NE2 2.95Å; E451-G537 CarbonylContact O-C 3.52Å; E451-G537 WeakPolarHBondContact O-CA 3.45Å; E451-V538 PolarHBondContact N-O 2.78Å; E451-V538 PolarHBondContact O-N 2.99Å
452	P	97.3	Very high	87.9	Confident	46 Å²	46	54.5 Å²	54.5	30%	0.299	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	115.4	-179.7	30.9	-32.5	0	0	0	111.8	L374 L375 K535 Q536	L374-P452 VanDerWaalsContact O-CB 3.24Å; L374-P452 WeakPolarHBondContact O-CB 3.45Å; L375-P452 HydrophobicContact CD2-CB 4.18Å; L375-P452 HydrophobicContact CD2-CG 4.37Å; P452-K535 HydrophobicContact CB-CB 4.12Å; P452-K535 HydrophobicContact CB-CD 4.12Å; P452-Q536 CarbonylContact C-O 3.37Å; P452-Q536 WeakPolarHBondContact CA-O 3.37Å
453	H	98.2	Very high	88.6	Confident	20 Å²	20	52 Å²	52	9%	0.093	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.7	179.3	-70.3	-78.3	0	0	0	111.8	L416 I419 E451 L455 K535 Q536 V538	L416-H453 HydrophobicContact CD2-CB 4.38Å; I419-H453 VanDerWaalsContact CD1-CE1 3.48Å; I419-H453 WeakPolarHBondContact CD1-CE1 3.5Å; E451-H453 WeakPolarHBondContact CB-NE2 3.49Å; E451-H453 PolarHBondContact O-CD2 3.03Å; E451-H453 PolarHBondContact O-N 2.75Å; E451-H453 IonicContact OE2-CE1 2.78Å; E451-H453 IonicContact OE2-NE2 3.14Å; E451-H453 PolarHBondContact OE2-NE2 2.95Å; H453-L455 HydrophobicContact CB-CD2 4.01Å; H453-L455 PolarHBondContact O-N 3.03Å; H453-K535 CarbonylContact O-C 3.59Å; H453-K535 WeakPolarHBondContact O-CA 3.45Å; H453-Q536 PolarHBondContact N-O 3.21Å; H453-Q536 PolarHBondContact O-N 2.79Å; H453-Q536 PolarHBondContact O-OE1 3.09Å; H453-V538 HydrophobicContact CB-CG2 3.99Å
454	P	98.1	Very high	89.5	Confident	17 Å²	17	49.4 Å²	49.4	11%	0.11	23%	0.231	C	C	.	.			trans	-75.3	85.7	171	31.3	-34	0	0	0	109.8	W456 E457 Y458 K535	P454-W456 PolarHBondContact O-N 3.15Å; P454-E457 HydrophobicContact CB-CG 4.41Å; P454-E457 HydrophobicContact CG-CG 4.26Å; P454-E457 WeakPolarHBondContact CG-OE1 3.28Å; P454-E457 WeakPolarHBondContact O-CB 3.27Å; P454-E457 PolarHBondContact O-N 3.01Å; P454-Y458 HydrophobicContact CG-CE2 4.09Å; P454-Y458 WeakPolarHBondContact O-CD2 3.46Å; P454-K535 HydrophobicContact CB-CG 4.33Å
455	L	98.7	Very high	90.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-64.8	-12.3	-167.9	-68	-176.4	0	0	0	115	F413 L416 H453 E457 Y458 A501 W530 Q536 V538	F413-L455 HydrophobicContact CE1-CD2 3.66Å; F413-L455 HydrophobicContact CZ-CD2 3.92Å; L416-L455 HydrophobicContact CD2-CD2 3.91Å; H453-L455 HydrophobicContact CB-CD2 4.01Å; H453-L455 PolarHBondContact O-N 3.03Å; L455-E457 PolarHBondContact O-N 2.64Å; L455-Y458 CarbonylContact O-C 3.43Å; L455-Y458 PolarHBondContact O-N 3.09Å; L455-Y458 VanDerWaalsContact O-N 3.09Å; L455-A501 HydrophobicContact CD1-CB 3.7Å; L455-W530 HydrophobicContact CB-CB 4Å; L455-W530 VanDerWaalsContact CB-CD1 3.4Å; L455-W530 HydrophobicContact CB-CD2 3.68Å; L455-W530 HydrophobicContact CB-CE3 4.46Å; L455-W530 HydrophobicContact CB-CG 3.42Å; L455-W530 VanDerWaalsContact CB-CG 3.42Å; L455-W530 HydrophobicContact CD1-CD2 3.9Å; L455-W530 HydrophobicContact CD1-CE3 4.16Å; L455-W530 HydrophobicContact CD1-CH2 3.95Å; L455-W530 HydrophobicContact CD1-CZ2 3.66Å; L455-W530 HydrophobicContact CD1-CZ3 4.19Å; L455-W530 HydrophobicContact CG-CD2 4.44Å; L455-W530 VanDerWaalsContact O-CD1 3.31Å; L455-Q536 VanDerWaalsContact CB-OE1 3.32Å; L455-Q536 HydrophobicContact CD1-CB 3.65Å; L455-Q536 HydrophobicContact CD1-CG 4.16Å; L455-Q536 HydrophobicContact CG-CB 3.94Å; L455-Q536 HydrophobicContact CG-CG 4.46Å; L455-V538 HydrophobicContact CD1-CG2 4.19Å; L455-V538 HydrophobicContact CD2-CG2 3.65Å; L455-V538 HydrophobicContact CG-CG2 4.24Å
456	W	98.4	Very high	91.9	Very high	31 Å²	31	42 Å²	42	12%	0.117	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-62.8	-22.1	170.3	81	-86.9	0	0	0	112.7	W85 V116 Q120 V121 P454 W530 R532	W85-W456 AromaticContact CH2-CH2 3.69Å; W85-W456 HydrophobicContact CH2-CH2 3.69Å; W85-W456 AromaticContact CH2-CZ2 3.58Å; W85-W456 HydrophobicContact CH2-CZ2 3.58Å; W85-W456 HydrophobicContact CZ2-CH2 4.28Å; W85-W456 HydrophobicContact CZ2-CZ2 4.04Å; V116-W456 HydrophobicContact CG2-CH2 3.54Å; V116-W456 HydrophobicContact CG2-CZ2 3.65Å; Q120-W456 HydrophobicContact CB-CE3 4.46Å; Q120-W456 HydrophobicContact CB-CZ3 4.21Å; V121-W456 HydrophobicContact CG2-CH2 3.8Å; V121-W456 HydrophobicContact CG2-CZ3 3.98Å; P454-W456 PolarHBondContact O-N 3.15Å; W456-W530 HydrophobicContact CB-CB 4.26Å; W456-R532 HydrophobicContact CB-CG 3.98Å; W456-R532 VanDerWaalsContact CD1-CA 3.5Å; W456-R532 HydrophobicContact CD2-CB 4.31Å; W456-R532 HydrophobicContact CD2-CG 3.85Å; W456-R532 HydrophobicContact CE3-CG 4.29Å; W456-R532 HydrophobicContact CG-CB 4.08Å; W456-R532 HydrophobicContact CG-CG 3.72Å
457	E	98.5	Very high	94.1	Very high	18 Å²	18	33.9 Å²	33.9	8%	0.084	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-85.5	-8.4	176.4	-64.6	-173.3	-128	0	0	113.2	V116 Q117 Q120 P454 L455	V116-E457 WeakPolarHBondContact CA-OE2 3.36Å; V116-E457 HydrophobicContact CG2-CG 4.26Å; V116-E457 WeakPolarHBondContact CG2-OE2 3.49Å; Q117-E457 HydrophobicContact CB-CB 3.92Å; Q117-E457 HydrophobicContact CB-CG 4.45Å; Q117-E457 HydrophobicContact CG-CB 4.04Å; Q117-E457 PolarHBondContact N-OE2 3.35Å; Q120-E457 WeakPolarHBondContact CG-O 3.37Å; P454-E457 HydrophobicContact CB-CG 4.41Å; P454-E457 HydrophobicContact CG-CG 4.26Å; P454-E457 WeakPolarHBondContact CG-OE1 3.28Å; P454-E457 WeakPolarHBondContact O-CB 3.27Å; P454-E457 PolarHBondContact O-N 3.01Å; L455-E457 PolarHBondContact O-N 2.64Å
458	Y	98.4	Very high	95.9	Very high	13 Å²	13	36 Å²	36	5%	0.051	18%	0.181	C	C	.	.	S	Bend	trans	-133.7	91.7	-169	-57.3	-68.1	0	0	0	111.2	Q117 W198 D200 L416 P454 L455 C460	Q117-Y458 HydrophobicContact CG-CD1 4.31Å; Q117-Y458 HydrophobicContact CG-CE1 3.74Å; W198-Y458 HydrophobicContact CZ2-CD1 4.03Å; W198-Y458 AromaticContact CZ2-CE1 3.98Å; W198-Y458 HydrophobicContact CZ2-CE1 3.98Å; D200-Y458 WeakPolarHBondContact OD1-CE1 3.33Å; D200-Y458 PolarHBondContact OD1-OH 2.98Å; L416-Y458 HydrophobicContact CB-CD1 4.11Å; L416-Y458 HydrophobicContact CB-CG 4.18Å; L416-Y458 HydrophobicContact CD1-CD1 3.68Å; L416-Y458 HydrophobicContact CD1-CD2 4.15Å; L416-Y458 HydrophobicContact CD1-CE1 3.71Å; L416-Y458 HydrophobicContact CD1-CE2 4.18Å; L416-Y458 HydrophobicContact CD1-CG 3.88Å; L416-Y458 HydrophobicContact CD2-CD2 4.07Å; L416-Y458 HydrophobicContact CD2-CG 3.93Å; L416-Y458 HydrophobicContact CG-CD1 4.3Å; L416-Y458 HydrophobicContact CG-CG 4.21Å; P454-Y458 HydrophobicContact CG-CE2 4.09Å; P454-Y458 WeakPolarHBondContact O-CD2 3.46Å; L455-Y458 CarbonylContact O-C 3.43Å; L455-Y458 PolarHBondContact O-N 3.09Å; L455-Y458 VanDerWaalsContact O-N 3.09Å; Y458-C460 PolarHBondContact O-N 3.01Å
459	P	97.6	Very high	97.1	Very high	39 Å²	39	34.7 Å²	34.7	25%	0.253	18%	0.177	S	C	.	.			trans	-51.3	130.7	179.4	-29.4	36.4	0	0	0	112.6	Q120 Q414	Q120-P459 VanDerWaalsContact OE1-CG 3.25Å; Q414-P459 HydrophobicContact CB-CB 4.25Å; Q414-P459 PolarHBondContact N-O 2.77Å
460	C	98.3	Very high	97.8	Very high	13 Å²	13	29.9 Å²	29.9	9%	0.088	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	159.2	178	74.8	0	0	0	0	111.8	V411 E412 F413 Y458 C528 W530	V411-C460 HydrophobicContact CB-CB 4.29Å; E412-C460 CarbonylContact O-C 3.58Å; E412-C460 VanDerWaalsContact O-CA 3.27Å; E412-C460 WeakPolarHBondContact O-CA 3.06Å; F413-C460 HydrophobicContact CD1-CB 3.42Å; F413-C460 VanDerWaalsContact CD1-CB 3.42Å; F413-C460 HydrophobicContact CE1-CB 3.67Å; F413-C460 HydrophobicContact CG-CB 4.19Å; Y458-C460 PolarHBondContact O-N 3.01Å; C460-C528 PolarHBondContact O-N 3.43Å; C460-W530 PolarHBondContact SG-NE1 3.07Å
461	R	98.2	Very high	98	Very high	66 Å²	66	33.1 Å²	33.1	25%	0.249	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.8	-178.4	-163.9	171.7	68.6	117.2	-3.9	110.2	V411 E412 L463 T494 Q525 G526	V411-R461 CarbonylContact C-O 3.44Å; V411-R461 WeakPolarHBondContact CA-O 3.49Å; E412-R461 HydrophobicContact CB-CB 4.49Å; E412-R461 PolarHBondContact N-O 2.94Å; E412-R461 PolarHBondContact O-N 3.02Å; E412-R461 IonicContact OE1-CZ 3.2Å; E412-R461 VanDerWaalsContact OE1-CZ 3.26Å; E412-R461 IonicContact OE1-NE 2.79Å; E412-R461 PolarHBondContact OE1-NE 2.93Å; E412-R461 IonicContact OE1-NH2 2.73Å; E412-R461 PolarHBondContact OE1-NH2 2.82Å; E412-R461 IonicContact OE2-NH2 3.33Å; R461-L463 PolarHBondContact O-N 3.45Å; R461-T494 PolarHBondContact NH2-O 3.46Å; R461-Q525 WeakPolarHBondContact CD-O 3.44Å; R461-Q525 WeakPolarHBondContact CG-O 3.5Å; R461-G526 CarbonylContact C-O 3.35Å; R461-G526 VanDerWaalsContact CA-O 3.25Å; R461-G526 WeakPolarHBondContact CA-O 3.25Å
462	A	98.4	Very high	98.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	124.4	175.8	0	0	0	0	0	111.7	V409 R493 I522 G526	V409-A462 HydrophobicContact CG2-CB 3.57Å; A462-R493 WeakPolarHBondContact O-CD 3.42Å; A462-R493 PolarHBondContact O-NH1 3.35Å; A462-I522 HydrophobicContact CB-CD1 3.6Å; A462-I522 HydrophobicContact CB-CG1 4.17Å; A462-I522 HydrophobicContact CB-CG2 3.86Å; A462-G526 PolarHBondContact N-O 3.38Å
463	L	98.4	Very high	98.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	-95.7	-13.1	176.2	-57.8	-178.7	0	0	0	113	A410 E412 R461 F491 I492 R493 C497	A410-L463 PolarHBondContact O-N 3.3Å; E412-L463 HydrophobicContact CB-CD1 4.14Å; E412-L463 HydrophobicContact CB-CD2 4.2Å; E412-L463 HydrophobicContact CB-CG 4.21Å; R461-L463 PolarHBondContact O-N 3.45Å; L463-F491 HydrophobicContact CB-CD1 3.79Å; L463-F491 HydrophobicContact CB-CE1 4.18Å; L463-F491 HydrophobicContact CD1-CE1 4.39Å; L463-F491 WeakPolarHBondContact O-CA 3.37Å; L463-I492 WeakPolarHBondContact O-CG1 3.48Å; L463-I492 PolarHBondContact O-N 2.73Å; L463-R493 HydrophobicContact CD2-CB 4.17Å; L463-R493 PolarHBondContact O-N 3.05Å; L463-C497 VanDerWaalsContact CD1-CA 3.49Å; L463-C497 HydrophobicContact CD1-CB 3.66Å
464	T	98.3	Very high	98.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	17%	0.165	C	C	.	.	S	Bend	trans	-122.1	171.2	176.5	65.5	0	0	0	0	110	A410 L489 P490 F491	A410-T464 HydrophobicContact CB-CG2 3.57Å; A410-T464 PolarHBondContact N-OG1 3.2Å; T464-L489 HydrophobicContact CG2-CB 3.7Å; T464-P490 WeakPolarHBondContact CG2-O 3.45Å; T464-F491 HydrophobicContact CG2-CD1 3.86Å; T464-F491 HydrophobicContact CG2-CE1 4.26Å
465	H	97.6	Very high	98.1	Very high	122 Å²	122	33.6 Å²	33.6	57%	0.565	18%	0.177	S	C	*	.			trans	-67.3	151.6	159.5	-70.9	-65.2	0	0	0	110.1
466	P	97.9	Very high	98	Very high	56 Å²	56	39 Å²	39	36%	0.364	20%	0.202	S	C	.	.			trans	-71.1	132.5	166.8	31.5	-27.6	0	0	0	107.9	V408 W503 L518 I522	V408-P466 WeakPolarHBondContact O-CA 3.35Å; P466-W503 HydrophobicContact CB-CH2 3.8Å; P466-W503 HydrophobicContact CB-CZ2 4.2Å; P466-L518 HydrophobicContact CB-CD1 4.09Å; P466-I522 HydrophobicContact CB-CD1 4.17Å; P466-I522 HydrophobicContact CG-CD1 3.85Å
467	T	98.1	Very high	98	Very high	44 Å²	44	40.2 Å²	40.2	27%	0.27	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	129.4	-173	-59.2	0	0	0	0	110	H407 V408 V469 L489	H407-T467 WeakPolarHBondContact CA-O 3.42Å; V408-T467 PolarHBondContact N-O 2.98Å; V408-T467 PolarHBondContact O-N 3.23Å; T467-V469 HydrophobicContact CG2-CG1 4.29Å; T467-V469 PolarHBondContact O-N 3.07Å; T467-L489 HydrophobicContact CG2-CD2 4.1Å; T467-L489 WeakPolarHBondContact OG1-CD2 3.43Å
468	E	98.1	Very high	98	Very high	86 Å²	86	40.4 Å²	40.4	40%	0.402	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	122.6	165.6	-178.3	174	126.6	0	0	109.2	S405 H407 T471	S405-E468 WeakPolarHBondContact CB-OE2 3.23Å; H407-E468 IonicContact CE1-OE2 3.94Å; H407-E468 IonicContact NE2-OE2 3.06Å; E468-T471 PolarHBondContact OE1-OG1 3.18Å
469	V	98.1	Very high	97.9	Very high	8 Å²	8	42 Å²	42	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-24.8	-176.9	-65.1	0	0	0	0	113.1	L406 V408 T467 S485 Y557 F559	L406-V469 HydrophobicContact CB-CG2 4.11Å; L406-V469 HydrophobicContact CD2-CG2 3.91Å; L406-V469 HydrophobicContact CG-CG2 3.81Å; L406-V469 VanDerWaalsContact O-CG2 3.29Å; L406-V469 WeakPolarHBondContact O-CG2 3.24Å; L406-V469 PolarHBondContact O-N 2.92Å; V408-V469 HydrophobicContact CB-CG1 4.46Å; V408-V469 HydrophobicContact CG1-CG1 4.15Å; V408-V469 HydrophobicContact CG1-CG2 3.8Å; V408-V469 HydrophobicContact CG2-CG1 3.49Å; V408-V469 VanDerWaalsContact CG2-CG1 3.49Å; T467-V469 HydrophobicContact CG2-CG1 4.29Å; T467-V469 PolarHBondContact O-N 3.07Å; V469-S485 WeakPolarHBondContact O-CB 3.38Å; V469-S485 PolarHBondContact O-OG 3.01Å; V469-Y557 HydrophobicContact CB-CE2 3.99Å; V469-Y557 HydrophobicContact CG1-CD2 4.24Å; V469-Y557 HydrophobicContact CG1-CE1 3.99Å; V469-Y557 HydrophobicContact CG1-CE2 3.69Å; V469-F559 HydrophobicContact CB-CD2 4.02Å; V469-F559 HydrophobicContact CB-CE2 4.04Å; V469-F559 HydrophobicContact CG1-CE2 4.17Å; V469-F559 HydrophobicContact CG2-CD2 3.88Å; V469-F559 HydrophobicContact CG2-CE2 3.71Å; V469-F559 HydrophobicContact CG2-CZ 4.21Å
470	M	98.1	Very high	97.8	Very high	6 Å²	6	49 Å²	49	3%	0.03	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	146.1	176	-55.7	-175	77.7	0	0	110.4	S405 L406 F472 I483 F559 F561 V568	S405-M470 CarbonylContact C-O 3.59Å; S405-M470 WeakPolarHBondContact CA-O 3.27Å; L406-M470 HydrophobicContact CB-CB 4.13Å; L406-M470 HydrophobicContact CD2-CG 4.43Å; L406-M470 HydrophobicContact CD2-SD 4.2Å; L406-M470 PolarHBondContact N-O 2.73Å; L406-M470 PolarHBondContact O-N 3.41Å; M470-F472 HydrophobicContact CB-CE1 4.42Å; M470-F472 HydrophobicContact CB-CE2 4.02Å; M470-F472 HydrophobicContact CB-CZ 3.76Å; M470-F472 HydrophobicContact CE-CE1 4.21Å; M470-F472 HydrophobicContact CE-CZ 4.27Å; M470-F472 HydrophobicContact SD-CZ 4.1Å; M470-I483 HydrophobicContact CE-CB 3.87Å; M470-I483 HydrophobicContact CE-CG2 3.75Å; M470-I483 WeakPolarHBondContact CE-O 3.36Å; M470-F559 HydrophobicContact CG-CB 4.25Å; M470-F559 HydrophobicContact SD-CB 3.66Å; M470-F559 HydrophobicContact SD-CG 4.32Å; M470-F561 HydrophobicContact CE-CB 3.58Å; M470-F561 HydrophobicContact SD-CB 4.47Å; M470-V568 HydrophobicContact SD-CG1 4.33Å
471	T	97.7	Very high	97.7	Very high	75 Å²	75	55.2 Å²	55.2	46%	0.46	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.1	176	-33	0	0	0	0	109.1	E468	E468-T471 PolarHBondContact OE1-OG1 3.18Å
472	F	98.3	Very high	97.7	Very high	1 Å²	1	55.1 Å²	55.1	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	108.1	-177.2	-50.9	-80.1	0	0	0	108.9	L380 W383 S403 A404 L406 M470 F474 I483 M504 F561	L380-F472 HydrophobicContact CD1-CD1 4.05Å; L380-F472 HydrophobicContact CD1-CD2 4.24Å; L380-F472 HydrophobicContact CD1-CE1 3.83Å; L380-F472 HydrophobicContact CD1-CE2 4.04Å; L380-F472 HydrophobicContact CD1-CG 4.24Å; L380-F472 HydrophobicContact CD1-CZ 3.82Å; L380-F472 HydrophobicContact CD2-CB 3.92Å; L380-F472 HydrophobicContact CD2-CD1 4.23Å; L380-F472 HydrophobicContact CD2-CD2 3.7Å; L380-F472 HydrophobicContact CD2-CE2 4.25Å; L380-F472 HydrophobicContact CD2-CG 3.68Å; W383-F472 HydrophobicContact CE3-CB 4.24Å; W383-F472 HydrophobicContact CE3-CD1 4.34Å; W383-F472 HydrophobicContact CH2-CB 4.5Å; W383-F472 HydrophobicContact CH2-CD1 4.44Å; W383-F472 HydrophobicContact CZ3-CB 4.12Å; W383-F472 AromaticContact CZ3-CD1 3.74Å; W383-F472 HydrophobicContact CZ3-CD1 3.74Å; W383-F472 HydrophobicContact CZ3-CG 4.39Å; S403-F472 CarbonylContact C-O 3.58Å; S403-F472 WeakPolarHBondContact CA-O 3.34Å; S403-F472 WeakPolarHBondContact CB-O 3.26Å; A404-F472 PolarHBondContact N-O 2.55Å; A404-F472 WeakPolarHBondContact O-CD2 3.27Å; A404-F472 PolarHBondContact O-N 3.39Å; L406-F472 HydrophobicContact CB-CE2 4.13Å; M470-F472 HydrophobicContact CB-CE1 4.42Å; M470-F472 HydrophobicContact CB-CE2 4.02Å; M470-F472 HydrophobicContact CB-CZ 3.76Å; M470-F472 HydrophobicContact CE-CE1 4.21Å; M470-F472 HydrophobicContact CE-CZ 4.27Å; M470-F472 HydrophobicContact SD-CZ 4.1Å; F472-F474 HydrophobicContact CB-CD1 4.44Å; F472-F474 HydrophobicContact CB-CE1 3.9Å; F472-F474 PolarHBondContact O-N 3.07Å; F472-I483 HydrophobicContact CD1-CD1 4.38Å; F472-M504 HydrophobicContact CD2-CE 3.77Å; F472-M504 HydrophobicContact CE2-CE 3.74Å; F472-M504 HydrophobicContact CE2-SD 4.3Å; F472-F561 HydrophobicContact CE1-CB 4.09Å; F472-F561 HydrophobicContact CE1-CD1 4.21Å; F472-F561 HydrophobicContact CE1-CD2 4.32Å; F472-F561 AromaticContact CE1-CG 3.94Å; F472-F561 HydrophobicContact CE1-CG 3.94Å
473	D	97.9	Very high	97.6	Very high	67 Å²	67	57.4 Å²	57.4	36%	0.358	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	103.9	-177.3	-177.8	-1	0	0	0	110.9	W383 T475 Q476	W383-D473 PolarHBondContact NE1-O 2.99Å; W383-D473 VanDerWaalsContact NE1-O 3.14Å; D473-T475 VanDerWaalsContact CG-OG1 3.24Å; D473-T475 PolarHBondContact O-N 2.81Å; D473-T475 WeakPolarHBondContact OD1-CA 3.41Å; D473-T475 VanDerWaalsContact OD1-CB 3.22Å; D473-T475 WeakPolarHBondContact OD1-CB 2.98Å; D473-T475 WeakPolarHBondContact OD1-CG2 3.36Å; D473-T475 PolarHBondContact OD1-N 3.01Å; D473-T475 PolarHBondContact OD1-OG1 2.81Å; D473-T475 PolarHBondContact OD2-OG1 3.25Å; D473-Q476 PolarHBondContact O-N 2.98Å
474	F	98.3	Very high	97.5	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-8	179.7	-60.2	-16.4	0	0	0	112.7	L380 F382 W383 R386 I399 P401 C402 A404 F472 Q476	L380-F474 HydrophobicContact CD2-CE1 3.79Å; L380-F474 HydrophobicContact CD2-CZ 3.82Å; F382-F474 AromaticContact CD1-CD2 3.59Å; F382-F474 HydrophobicContact CD1-CD2 3.59Å; F382-F474 AromaticContact CD1-CE2 3.71Å; F382-F474 HydrophobicContact CD1-CE2 3.71Å; F382-F474 HydrophobicContact CD1-CG 4.25Å; F382-F474 HydrophobicContact CD1-CZ 4.46Å; F382-F474 HydrophobicContact CE1-CB 4.48Å; F382-F474 AromaticContact CE1-CD2 3.71Å; F382-F474 HydrophobicContact CE1-CD2 3.71Å; F382-F474 HydrophobicContact CE1-CE2 4.25Å; F382-F474 HydrophobicContact CE1-CG 4.34Å; W383-F474 HydrophobicContact CB-CD1 3.66Å; W383-F474 HydrophobicContact CB-CE1 3.55Å; W383-F474 HydrophobicContact CB-CZ 4.38Å; W383-F474 AromaticContact CD1-CD1 3.55Å; W383-F474 AromaticContact CD2-CD1 3.92Å; W383-F474 HydrophobicContact CD2-CD1 3.92Å; W383-F474 HydrophobicContact CD2-CE1 4.08Å; W383-F474 HydrophobicContact CE3-CE1 4.46Å; W383-F474 AromaticContact CG-CD1 3.43Å; W383-F474 HydrophobicContact CG-CD1 3.43Å; W383-F474 VanDerWaalsContact CG-CD1 3.43Å; W383-F474 AromaticContact CG-CE1 3.71Å; W383-F474 HydrophobicContact CG-CE1 3.71Å; W383-F474 HydrophobicContact CG-CG 4.46Å; R386-F474 WeakPolarHBondContact CD-O 3.24Å; R386-F474 PolarHBondContact NE-O 3.21Å; I399-F474 HydrophobicContact CG2-CB 3.98Å; P401-F474 HydrophobicContact CB-CD2 4.34Å; P401-F474 HydrophobicContact CG-CD2 3.85Å; P401-F474 HydrophobicContact CG-CE2 3.78Å; P401-F474 WeakPolarHBondContact O-CD2 3.48Å; C402-F474 WeakPolarHBondContact O-CA 3.31Å; C402-F474 WeakPolarHBondContact O-CB 3.4Å; C402-F474 PolarHBondContact O-N 3.1Å; A404-F474 HydrophobicContact CB-CE1 4.31Å; A404-F474 HydrophobicContact CB-CE2 3.94Å; A404-F474 HydrophobicContact CB-CZ 3.59Å; F472-F474 HydrophobicContact CB-CD1 4.44Å; F472-F474 HydrophobicContact CB-CE1 3.9Å; F472-F474 PolarHBondContact O-N 3.07Å; F474-Q476 PolarHBondContact O-N 3.33Å
475	T	96.9	Very high	97.5	Very high	59 Å²	59	62.3 Å²	62.3	36%	0.362	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-14.2	169.7	79.3	0	0	0	0	112.2	R386 C402 D473	R386-T475 PolarHBondContact NH2-O 3.44Å; C402-T475 HydrophobicContact CB-CG2 4.28Å; C402-T475 PolarHBondContact O-N 3.25Å; D473-T475 VanDerWaalsContact CG-OG1 3.24Å; D473-T475 PolarHBondContact O-N 2.81Å; D473-T475 WeakPolarHBondContact OD1-CA 3.41Å; D473-T475 VanDerWaalsContact OD1-CB 3.22Å; D473-T475 WeakPolarHBondContact OD1-CB 2.98Å; D473-T475 WeakPolarHBondContact OD1-CG2 3.36Å; D473-T475 PolarHBondContact OD1-N 3.01Å; D473-T475 PolarHBondContact OD1-OG1 2.81Å; D473-T475 PolarHBondContact OD2-OG1 3.25Å
476	Q	96.8	Very high	97.5	Very high	113 Å²	113	63.5 Å²	63.5	53%	0.528	35%	0.346	S	S	.	.	S	Bend	trans	-109.8	162.8	174.7	-57	-55.4	-42.4	0	0	111.8	W383 R386 D473 F474	W383-Q476 PolarHBondContact NE1-O 2.76Å; R386-Q476 WeakPolarHBondContact CD-O 3.34Å; R386-Q476 VanDerWaalsContact CZ-C 3.41Å; R386-Q476 PolarHBondContact NE-O 2.71Å; D473-Q476 PolarHBondContact O-N 2.98Å; F474-Q476 PolarHBondContact O-N 3.33Å
477	C	97.8	Very high	97.5	Very high	58 Å²	58	62 Å²	62	39%	0.392	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-68.3	153.8	168.4	-69	0	0	0	0	110.4	R386 T387	R386-C477 PolarHBondContact NH1-SG 3.11Å; T387-C477 HydrophobicContact CG2-CB 3.84Å; T387-C477 WeakPolarHBondContact OG1-CA 3.42Å
478	V	97.9	Very high	97.4	Very high	22 Å²	22	62.8 Å²	62.8	13%	0.133	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-53.1	127.1	168.2	174.7	0	0	0	0	108.7	W383 Y384 T387 P563	W383-V478 HydrophobicContact CB-CG2 4Å; W383-V478 HydrophobicContact CD2-CB 4.36Å; W383-V478 HydrophobicContact CD2-CG2 3.46Å; W383-V478 VanDerWaalsContact CD2-CG2 3.46Å; W383-V478 HydrophobicContact CE3-CG2 3.84Å; W383-V478 HydrophobicContact CG-CG2 3.51Å; Y384-V478 HydrophobicContact CD1-CG2 4.22Å; Y384-V478 HydrophobicContact CD2-CG2 4.43Å; Y384-V478 HydrophobicContact CE1-CG1 4.04Å; Y384-V478 HydrophobicContact CE1-CG2 4.38Å; Y384-V478 HydrophobicContact CG-CG2 4.25Å; T387-V478 WeakPolarHBondContact OG1-CG2 3.2Å; T387-V478 PolarHBondContact OG1-N 3.41Å; V478-P563 HydrophobicContact CG1-CB 3.78Å
479	P	97.1	Very high	97.4	Very high	47 Å²	47	58.8 Å²	58.8	31%	0.305	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-69.4	158.5	179.4	28.6	-34.3	0	0	0	111.2	W383 I483 P563	W383-P479 HydrophobicContact CH2-CG 4.1Å; P479-I483 HydrophobicContact CG-CD1 3.87Å; P479-I483 HydrophobicContact CG-CG1 4.02Å; P479-P563 HydrophobicContact CG-CG 4.39Å; P479-P563 WeakPolarHBondContact O-CB 3.12Å; P479-P563 VanDerWaalsContact O-CG 3.31Å; P479-P563 WeakPolarHBondContact O-CG 3.35Å
480	Q	95.4	Very high	97.3	Very high	185 Å²	185	61.2 Å²	61.2	86%	0.864	34%	0.341	S	S	*	.	S	Bend	trans	-81.1	-30.1	173.4	-67	-173	-20.5	0	0	112.3
481	E	96.8	Very high	97.3	Very high	143 Å²	143	61 Å²	61	67%	0.668	34%	0.34	S	S	*	.	S	Bend	trans	-89.2	147.1	-178.3	-62.3	-59.5	145.8	0	0	111.6	P563	E481-P563 WeakPolarHBondContact O-CG 3.46Å
482	P	97.2	Very high	97.3	Very high	65 Å²	65	60 Å²	60	42%	0.422	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-54.9	144.4	172.7	-28	37	0	0	0	113.9	T560 F561 E562	P482-T560 HydrophobicContact CB-CG2 3.86Å; P482-F561 WeakPolarHBondContact CA-O 3.13Å; P482-E562 VanDerWaalsContact CB-OE2 3.25Å; P482-E562 WeakPolarHBondContact CB-OE2 3.42Å; P482-E562 VanDerWaalsContact CG-OE2 3.24Å; P482-E562 WeakPolarHBondContact CG-OE2 3.41Å
483	I	97	Very high	97.2	Very high	48 Å²	48	62.3 Å²	62.3	25%	0.246	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.2	171.8	-50.1	175.9	0	0	0	107.2	W383 M470 F472 P479 T560 F561	W383-I483 HydrophobicContact CH2-CD1 3.94Å; W383-I483 HydrophobicContact CZ3-CD1 4.22Å; M470-I483 HydrophobicContact CE-CB 3.87Å; M470-I483 HydrophobicContact CE-CG2 3.75Å; M470-I483 WeakPolarHBondContact CE-O 3.36Å; F472-I483 HydrophobicContact CD1-CD1 4.38Å; P479-I483 HydrophobicContact CG-CD1 3.87Å; P479-I483 HydrophobicContact CG-CG1 4.02Å; I483-T560 CarbonylContact O-C 3.59Å; I483-T560 WeakPolarHBondContact O-CA 3.28Å; I483-F561 HydrophobicContact CB-CB 4.32Å; I483-F561 HydrophobicContact CD1-CD1 3.95Å; I483-F561 HydrophobicContact CG1-CD1 4.18Å; I483-F561 PolarHBondContact N-O 3.09Å; I483-F561 VanDerWaalsContact N-O 3.11Å; I483-F561 PolarHBondContact O-N 3.01Å
484	S	97.1	Very high	97.2	Very high	76 Å²	76	63.4 Å²	63.4	53%	0.531	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.2	179	-66.6	0	0	0	0	112.4	F559 T560	S484-F559 CarbonylContact C-O 3.57Å; S484-F559 WeakPolarHBondContact CA-O 3.38Å; S484-T560 PolarHBondContact OG-OG1 2.85Å
485	S	97.6	Very high	97.1	Very high	28 Å²	28	64 Å²	64	20%	0.196	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	137.4	176	-179.7	0	0	0	0	110.2	V469 S558 F559	V469-S485 WeakPolarHBondContact O-CB 3.38Å; V469-S485 PolarHBondContact O-OG 3.01Å; S485-S558 CarbonylContact O-C 3.36Å; S485-S558 WeakPolarHBondContact O-CA 3.37Å; S485-F559 PolarHBondContact N-O 3.37Å; S485-F559 PolarHBondContact O-N 3.42Å
486	Q	97.6	Very high	97.1	Very high	146 Å²	146	66.3 Å²	66.3	68%	0.682	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	148	178.5	-66.8	-177.8	-10.1	0	0	109.4	Y557 S558	Q486-Y557 WeakPolarHBondContact CA-O 3.27Å; Q486-S558 PolarHBondContact NE2-OG 3.35Å
487	G	96.9	Very high	97.2	Very high	26 Å²	26	61 Å²	61	27%	0.268	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	-170.2	178.7	0	0	0	0	0	112.9	S556 Y557	G487-S556 WeakPolarHBondContact O-CA 3.5Å; G487-Y557 VanDerWaalsContact CA-CZ 3.45Å; G487-Y557 PolarHBondContact N-O 3.03Å; G487-Y557 VanDerWaalsContact N-O 3.16Å; G487-Y557 WeakPolarHBondContact O-CD1 3.2Å; G487-Y557 PolarHBondContact O-N 3.19Å
488	L	97.1	Very high	97.1	Very high	60 Å²	60	59 Å²	59	31%	0.314	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.3	-177.9	-177.8	67.8	0	0	0	108.8	P490 T575	L488-P490 WeakPolarHBondContact O-CD 3.33Å; L488-T575 VanDerWaalsContact CD1-OG1 3.23Å; L488-T575 WeakPolarHBondContact CD1-OG1 3.23Å
489	L	97.3	Very high	97.1	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	97.1	170.9	-52.4	173.5	0	0	0	108.3	V408 T464 T467 F491 G554 V555 Y557	V408-L489 HydrophobicContact CG2-CD1 3.64Å; V408-L489 HydrophobicContact CG2-CD2 3.98Å; V408-L489 HydrophobicContact CG2-CG 4.41Å; T464-L489 HydrophobicContact CG2-CB 3.7Å; T467-L489 HydrophobicContact CG2-CD2 4.1Å; T467-L489 WeakPolarHBondContact OG1-CD2 3.43Å; L489-F491 PolarHBondContact O-N 2.79Å; L489-G554 CarbonylContact O-C 3.53Å; L489-G554 WeakPolarHBondContact O-CA 3.29Å; L489-V555 HydrophobicContact CB-CB 4.29Å; L489-V555 HydrophobicContact CD1-CB 4.39Å; L489-V555 PolarHBondContact N-O 2.89Å; L489-V555 PolarHBondContact O-N 3.2Å; L489-Y557 HydrophobicContact CD1-CD1 4.36Å; L489-Y557 HydrophobicContact CD2-CD1 4.11Å; L489-Y557 HydrophobicContact CD2-CE1 3.83Å; L489-Y557 HydrophobicContact CG-CD1 3.87Å; L489-Y557 HydrophobicContact CG-CE1 4.09Å
490	P	97.4	Very high	97.2	Very high	60 Å²	60	55.7 Å²	55.7	39%	0.39	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	135.2	179.9	-18.5	32.1	0	0	0	110.4	T464 L488 I492	T464-P490 WeakPolarHBondContact CG2-O 3.45Å; L488-P490 WeakPolarHBondContact O-CD 3.33Å; P490-I492 PolarHBondContact O-N 3.29Å
491	F	97.7	Very high	97.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.			trans	-72.9	124.1	174.1	-66.7	-62.3	0	0	0	110.9	A410 L463 T464 L489 C497 W545 S547 G549 G551 T553 V555 I574	A410-F491 HydrophobicContact CB-CE1 4.03Å; L463-F491 HydrophobicContact CB-CD1 3.79Å; L463-F491 HydrophobicContact CB-CE1 4.18Å; L463-F491 HydrophobicContact CD1-CE1 4.39Å; L463-F491 WeakPolarHBondContact O-CA 3.37Å; T464-F491 HydrophobicContact CG2-CD1 3.86Å; T464-F491 HydrophobicContact CG2-CE1 4.26Å; L489-F491 PolarHBondContact O-N 2.79Å; F491-C497 HydrophobicContact CE1-CB 3.8Å; F491-C497 HydrophobicContact CZ-CB 3.8Å; F491-W545 AromaticContact CE2-CD1 3.56Å; F491-W545 AromaticContact CE2-NE1 3.95Å; F491-S547 WeakPolarHBondContact CB-OG 3.38Å; F491-S547 VanDerWaalsContact CG-OG 3.24Å; F491-S547 WeakPolarHBondContact CG-OG 3.25Å; F491-G549 CarbonylContact O-C 3.52Å; F491-G551 WeakPolarHBondContact O-CA 3.4Å; F491-G551 PolarHBondContact O-N 2.87Å; F491-T553 WeakPolarHBondContact CD2-O 3.23Å; F491-T553 PolarHBondContact N-O 3.39Å; F491-V555 HydrophobicContact CE1-CG2 3.72Å; F491-V555 HydrophobicContact CE2-CG2 4.27Å; F491-V555 HydrophobicContact CZ-CG2 3.42Å; F491-V555 VanDerWaalsContact CZ-CG2 3.42Å; F491-I574 HydrophobicContact CE2-CD1 4.21Å; F491-I574 HydrophobicContact CZ-CD1 3.98Å
492	I	97.1	Very high	97.4	Very high	56 Å²	56	40 Å²	40	29%	0.287	22%	0.223	S	C	.	.			trans	-107.5	-4.8	-179.2	60.7	168	0	0	0	112.7	L463 P490	L463-I492 WeakPolarHBondContact O-CG1 3.48Å; L463-I492 PolarHBondContact O-N 2.73Å; P490-I492 PolarHBondContact O-N 3.29Å
493	R	96.8	Very high	97.5	Very high	48 Å²	48	37.2 Å²	37.2	18%	0.181	20%	0.204	C	C	.	.	S	Bend	trans	-134.7	145.7	177.4	-65.3	-175.3	-173.3	83.4	2.3	111.1	A462 L463 S523 E524 S547 G549	A462-R493 WeakPolarHBondContact O-CD 3.42Å; A462-R493 PolarHBondContact O-NH1 3.35Å; L463-R493 HydrophobicContact CD2-CB 4.17Å; L463-R493 PolarHBondContact O-N 3.05Å; R493-S523 PolarHBondContact NH2-O 3.13Å; R493-E524 PolarHBondContact NE-O 3.34Å; R493-E524 VanDerWaalsContact NE-O 3.1Å; R493-E524 PolarHBondContact NH2-O 3.49Å; R493-S547 PolarHBondContact O-OG 3.09Å; R493-G549 WeakPolarHBondContact O-CA 3.47Å
494	T	97.2	Very high	97.5	Very high	90 Å²	90	35.3 Å²	35.3	55%	0.552	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	134.5	168.6	-46.7	0	0	0	0	109.4	R461 S547 L548	R461-T494 PolarHBondContact NH2-O 3.46Å; T494-S547 VanDerWaalsContact CA-O 3.27Å; T494-S547 WeakPolarHBondContact CA-O 3.39Å; T494-S547 WeakPolarHBondContact CG2-O 3.39Å; T494-L548 PolarHBondContact OG1-O 3.4Å
495	G	96.4	Very high	97.6	Very high	12 Å²	12	32.8 Å²	32.8	12%	0.124	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161	173.9	179.2	0	0	0	0	0	112.1	E412 S547	E412-G495 WeakPolarHBondContact OE2-CA 3.48Å; G495-S547 PolarHBondContact N-O 3.01Å; G495-S547 VanDerWaalsContact N-O 3.11Å; G495-S547 WeakPolarHBondContact O-CB 3.35Å; G495-S547 PolarHBondContact O-N 3.28Å
496	R	97.3	Very high	97.6	Very high	109 Å²	109	32 Å²	32	41%	0.411	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	105.2	-179.2	-168.9	170.2	-173.4	-169.3	-1.7	110.6	E412 H498 A544 W545 D546	E412-R496 WeakPolarHBondContact CA-O 3.47Å; E412-R496 VanDerWaalsContact CB-O 3.24Å; E412-R496 WeakPolarHBondContact CB-O 3.49Å; E412-R496 WeakPolarHBondContact CG-O 3.38Å; E412-R496 PolarHBondContact OE2-N 2.87Å; R496-H498 PolarHBondContact O-N 3.49Å; R496-A544 HydrophobicContact CG-CB 3.83Å; R496-W545 CarbonylContact C-O 3.54Å; R496-W545 WeakPolarHBondContact CA-O 3.49Å; R496-D546 WeakPolarHBondContact CG-OD1 3.47Å
497	C	97.7	Very high	97.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	112.9	178.1	-173.7	0	0	0	0	109.9	L463 F491 L541 A544 W545	L463-C497 VanDerWaalsContact CD1-CA 3.49Å; L463-C497 HydrophobicContact CD1-CB 3.66Å; F491-C497 HydrophobicContact CE1-CB 3.8Å; F491-C497 HydrophobicContact CZ-CB 3.8Å; C497-L541 HydrophobicContact CB-CD1 4.39Å; C497-A544 CarbonylContact O-C 3.45Å; C497-A544 WeakPolarHBondContact O-CA 3.44Å; C497-W545 HydrophobicContact CB-CB 4.29Å; C497-W545 PolarHBondContact N-O 2.81Å; C497-W545 PolarHBondContact O-N 3.47Å
498	H	97.6	Very high	97.6	Very high	16 Å²	16	25.6 Å²	25.6	7%	0.074	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-30.4	179.9	-64.6	136.6	0	0	0	112.2	V411 F413 W417 R496 L541	V411-H498 PolarHBondContact O-N 2.89Å; F413-H498 HydrophobicContact CD2-CB 4.03Å; F413-H498 PolarHBondContact N-ND1 2.84Å; F413-H498 VanDerWaalsContact N-ND1 3.12Å; F413-H498 PolarHBondContact O-CE1 3.25Å; F413-H498 PolarHBondContact O-ND1 3.06Å; W417-H498 HydrophobicContact CB-CB 3.76Å; W417-H498 AromaticContact CD1-CE1 3.52Å; W417-H498 AromaticContact CD1-ND1 3.64Å; W417-H498 AromaticContact CD1-NE2 4Å; W417-H498 AromaticContact CG-CD2 3.93Å; W417-H498 AromaticContact CG-CE1 3.8Å; W417-H498 AromaticContact CG-CG 3.91Å; W417-H498 AromaticContact CG-ND1 3.8Å; W417-H498 AromaticContact CG-NE2 3.88Å; W417-H498 AromaticContact NE1-CE1 3.95Å; R496-H498 PolarHBondContact O-N 3.49Å; H498-L541 PolarHBondContact O-N 2.93Å
499	G	97.1	Very high	97.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	-176.8	-174.5	0	0	0	0	0	112.9	V411 Y539	V411-G499 PolarHBondContact N-O 3.13Å; V411-G499 PolarHBondContact O-N 3.14Å; G499-Y539 CarbonylContact C-O 3.6Å; G499-Y539 WeakPolarHBondContact CA-O 3.33Å
500	V	98.4	Very high	97.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.2	173	-175.7	0	0	0	0	108.2	V408 V409 A410 L502 Y539 V555 F572	V408-V500 HydrophobicContact CB-CG1 3.83Å; V408-V500 HydrophobicContact CG1-CG1 4.42Å; V409-V500 WeakPolarHBondContact O-CA 3.39Å; A410-V500 HydrophobicContact CB-CG2 4.47Å; V500-L502 WeakPolarHBondContact O-CD1 3.21Å; V500-Y539 PolarHBondContact N-O 3.16Å; V500-Y539 PolarHBondContact O-N 3.24Å; V500-V555 HydrophobicContact CG2-CG1 4.05Å; V500-F572 HydrophobicContact CB-CD1 4.38Å; V500-F572 HydrophobicContact CB-CE1 3.95Å; V500-F572 HydrophobicContact CB-CE2 4.29Å; V500-F572 HydrophobicContact CB-CZ 3.84Å; V500-F572 HydrophobicContact CG1-CE1 3.68Å; V500-F572 HydrophobicContact CG1-CZ 3.64Å; V500-F572 HydrophobicContact CG2-CD1 3.78Å; V500-F572 HydrophobicContact CG2-CE1 3.78Å; V500-F572 HydrophobicContact CG2-CG 4.15Å; V500-F572 HydrophobicContact CG2-CZ 4.15Å
501	A	98.6	Very high	97.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	140.1	171.6	0	0	0	0	0	109.7	V408 V409 V411 L455 W530 G537	V408-A501 CarbonylContact C-O 3.59Å; V408-A501 VanDerWaalsContact CA-O 3.27Å; V408-A501 WeakPolarHBondContact CA-O 3.16Å; V409-A501 HydrophobicContact CG1-CB 4.12Å; V409-A501 PolarHBondContact N-O 2.86Å; V409-A501 PolarHBondContact O-N 3.06Å; V411-A501 HydrophobicContact CG1-CB 4.28Å; V411-A501 HydrophobicContact CG2-CB 4.43Å; L455-A501 HydrophobicContact CD1-CB 3.7Å; A501-W530 HydrophobicContact CB-CH2 3.56Å; A501-W530 HydrophobicContact CB-CZ2 3.91Å; A501-W530 HydrophobicContact CB-CZ3 4.45Å; A501-G537 CarbonylContact C-O 3.55Å; A501-G537 WeakPolarHBondContact CA-O 3.42Å
502	L	98.6	Very high	97.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.9	-175.9	-54.2	92.9	0	0	0	110.8	W377 L406 H407 V408 A450 V500 Q536 G537 F559 M570 F572	W377-L502 HydrophobicContact CZ3-CB 4.38Å; W377-L502 HydrophobicContact CZ3-CD2 4.33Å; L406-L502 HydrophobicContact CD1-CB 4.36Å; H407-L502 VanDerWaalsContact O-CA 3.29Å; H407-L502 WeakPolarHBondContact O-CA 3.45Å; V408-L502 HydrophobicContact CG1-CD2 3.91Å; V408-L502 HydrophobicContact CG1-CG 3.95Å; A450-L502 HydrophobicContact CB-CD1 4.18Å; V500-L502 WeakPolarHBondContact O-CD1 3.21Å; L502-Q536 WeakPolarHBondContact O-CB 3.47Å; L502-G537 PolarHBondContact N-O 2.9Å; L502-G537 PolarHBondContact O-N 3.48Å; L502-F559 HydrophobicContact CD2-CE1 3.6Å; L502-F559 HydrophobicContact CD2-CZ 3.68Å; L502-M570 HydrophobicContact CD1-SD 4.44Å; L502-M570 HydrophobicContact CD2-CE 4.23Å; L502-M570 HydrophobicContact CD2-SD 3.78Å; L502-F572 HydrophobicContact CD2-CZ 4.22Å
503	W	98.6	Very high	97.1	Very high	5 Å²	5	37.6 Å²	37.6	2%	0.019	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	165.5	175.8	69.5	96.1	0	0	0	112.1	H407 V409 P466 D505 S515 G517 L518 W530 Q536	H407-W503 HydrophobicContact CB-CD2 3.75Å; H407-W503 HydrophobicContact CB-CE3 4.15Å; H407-W503 HydrophobicContact CB-CG 4.35Å; H407-W503 HydrophobicContact CB-CH2 3.75Å; H407-W503 HydrophobicContact CB-CZ2 3.32Å; H407-W503 HydrophobicContact CB-CZ3 4.14Å; H407-W503 AromaticContact CG-CE2 4Å; H407-W503 AromaticContact CG-CZ2 3.97Å; H407-W503 AromaticContact CG-NE1 3.96Å; H407-W503 PolarHBondContact N-O 2.93Å; H407-W503 PolarHBondContact O-N 2.96Å; H407-W503 VanDerWaalsContact O-N 3.08Å; V409-W503 HydrophobicContact CB-CH2 4.27Å; V409-W503 HydrophobicContact CB-CZ3 4.14Å; V409-W503 HydrophobicContact CG1-CH2 4.14Å; V409-W503 HydrophobicContact CG1-CZ3 3.7Å; P466-W503 HydrophobicContact CB-CH2 3.8Å; P466-W503 HydrophobicContact CB-CZ2 4.2Å; W503-D505 PolarHBondContact NE1-OD1 3.14Å; W503-S515 PolarHBondContact NE1-OG 3.4Å; W503-G517 VanDerWaalsContact CG-CA 3.43Å; W503-L518 HydrophobicContact CH2-CD1 3.57Å; W503-L518 HydrophobicContact CH2-CG 4.08Å; W503-L518 HydrophobicContact CZ2-CB 4.32Å; W503-L518 HydrophobicContact CZ2-CD1 3.69Å; W503-L518 HydrophobicContact CZ2-CG 4Å; W503-L518 HydrophobicContact CZ3-CD1 4.36Å; W503-W530 HydrophobicContact CD2-CZ3 4.24Å; W503-W530 HydrophobicContact CE3-CH2 4.12Å; W503-W530 AromaticContact CE3-CZ3 3.76Å; W503-W530 HydrophobicContact CE3-CZ3 3.76Å; W503-W530 HydrophobicContact CZ3-CH2 4.09Å; W503-W530 HydrophobicContact CZ3-CZ3 4.11Å; W503-Q536 HydrophobicContact CB-CG 4.13Å
504	M	98.3	Very high	97.1	Very high	9 Å²	9	36.4 Å²	36.4	4%	0.044	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.9	174.4	-65.8	-62.3	-62.6	0	0	110.4	P376 W377 L380 A404 S405 L406 F472 G516	P376-M504 VanDerWaalsContact C-CG 3.42Å; P376-M504 HydrophobicContact CB-CB 4.36Å; P376-M504 HydrophobicContact CB-CG 3.76Å; P376-M504 WeakPolarHBondContact O-CG 3.28Å; W377-M504 HydrophobicContact CB-CG 4.39Å; W377-M504 HydrophobicContact CB-SD 4.05Å; L380-M504 HydrophobicContact CD2-CE 3.96Å; L380-M504 HydrophobicContact CG-CE 4.39Å; A404-M504 HydrophobicContact CB-CE 3.73Å; S405-M504 WeakPolarHBondContact O-CA 3.33Å; L406-M504 HydrophobicContact CB-SD 3.89Å; L406-M504 HydrophobicContact CD1-SD 3.81Å; L406-M504 HydrophobicContact CG-SD 4.47Å; F472-M504 HydrophobicContact CD2-CE 3.77Å; F472-M504 HydrophobicContact CE2-CE 3.74Å; F472-M504 HydrophobicContact CE2-SD 4.3Å; M504-G516 WeakPolarHBondContact O-CA 3.32Å; M504-G516 PolarHBondContact O-N 3.12Å
505	D	97.9	Very high	97.1	Very high	22 Å²	22	33.6 Å²	33.6	12%	0.118	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137.5	163.4	-74.2	2	0	0	0	108.9	A404 S405 H407 W503 T513 S515	A404-D505 CarbonylContact C-O 3.49Å; A404-D505 WeakPolarHBondContact CA-O 3.39Å; A404-D505 WeakPolarHBondContact CB-O 3.5Å; S405-D505 PolarHBondContact N-O 2.99Å; S405-D505 PolarHBondContact O-N 3.48Å; H407-D505 IonicContact CD2-OD2 3.52Å; H407-D505 IonicContact NE2-OD2 3.55Å; W503-D505 PolarHBondContact NE1-OD1 3.14Å; D505-T513 HydrophobicContact CB-CG2 4Å; D505-S515 WeakPolarHBondContact OD1-CA 3.41Å; D505-S515 WeakPolarHBondContact OD1-CB 3.28Å; D505-S515 PolarHBondContact OD1-OG 2.95Å
506	C	97.6	Very high	97.1	Very high	13 Å²	13	33.8 Å²	33.8	9%	0.088	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.8	176.2	-66.3	0	0	0	0	109.1	P401 L508 T513 V514	P401-C506 HydrophobicContact CB-CB 4.36Å; P401-C506 HydrophobicContact CG-CB 4.42Å; C506-L508 HydrophobicContact CB-CD2 4.42Å; C506-L508 PolarHBondContact O-N 2.52Å; C506-T513 WeakPolarHBondContact O-CA 3.36Å; C506-V514 PolarHBondContact N-O 3.01Å; C506-V514 PolarHBondContact O-N 2.82Å
507	H	98.1	Very high	97.1	Very high	34 Å²	34	28.6 Å²	28.6	16%	0.157	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	101.3	175.6	-51.5	-68.7	0	0	0	108	P401 C402 S403 S405 T513	P401-H507 CarbonylContact C-O 3.59Å; P401-H507 VanDerWaalsContact CA-O 3.3Å; P401-H507 WeakPolarHBondContact CA-O 3.29Å; P401-H507 WeakPolarHBondContact CB-O 3.46Å; C402-H507 PolarHBondContact N-O 3.18Å; C402-H507 PolarHBondContact SG-O 3.41Å; S403-H507 PolarHBondContact N-O 3.36Å; S403-H507 PolarHBondContact O-N 3.3Å; S403-H507 WeakPolarHBondContact OG-CB 3.48Å; S403-H507 PolarHBondContact OG-CD2 2.94Å; S403-H507 VanDerWaalsContact OG-CD2 3.22Å; S405-H507 WeakPolarHBondContact CB-NE2 3.29Å; S405-H507 PolarHBondContact OG-NE2 2.72Å; H507-T513 PolarHBondContact ND1-OG1 2.85Å
508	L	97.9	Very high	97.1	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	-44	-177.4	-55.3	-169.8	0	0	0	110.8	Y280 A283 P401 C506 V512 V514	Y280-L508 HydrophobicContact CD1-CD1 3.71Å; Y280-L508 HydrophobicContact CD1-CD2 4.17Å; Y280-L508 HydrophobicContact CD2-CD1 4.19Å; Y280-L508 HydrophobicContact CE1-CD1 3.87Å; Y280-L508 HydrophobicContact CE1-CD2 3.52Å; Y280-L508 HydrophobicContact CE1-CG 4.38Å; Y280-L508 HydrophobicContact CE2-CD1 4.32Å; Y280-L508 HydrophobicContact CG-CD1 3.89Å; A283-L508 HydrophobicContact CB-CB 3.66Å; A283-L508 HydrophobicContact CB-CD1 3.83Å; A283-L508 HydrophobicContact CB-CG 4.42Å; P401-L508 HydrophobicContact CB-CD2 4.12Å; C506-L508 HydrophobicContact CB-CD2 4.42Å; C506-L508 PolarHBondContact O-N 2.52Å; L508-V512 HydrophobicContact CB-CB 4.29Å; L508-V512 HydrophobicContact CB-CG1 4.22Å; L508-V512 WeakPolarHBondContact CB-O 3.3Å; L508-V512 HydrophobicContact CD1-CG1 3.95Å; L508-V512 HydrophobicContact CG-CG1 4.31Å; L508-V512 PolarHBondContact N-O 3.41Å; L508-V514 HydrophobicContact CD1-CG2 3.8Å; L508-V514 HydrophobicContact CG-CG2 4.16Å
509	T	95.3	Very high	97	Very high	22 Å²	22	31.9 Å²	31.9	14%	0.135	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	176.1	174.2	62.3	0	0	0	0	108.2	A283 V287 D511 V512	A283-T509 HydrophobicContact CB-CG2 4.05Å; V287-T509 HydrophobicContact CG1-CG2 4.1Å; T509-D511 PolarHBondContact O-N 3.09Å; T509-D511 VanDerWaalsContact O-N 3.13Å; T509-V512 PolarHBondContact N-O 3.4Å; T509-V512 PolarHBondContact O-N 3.04Å; T509-V512 WeakPolarHBondContact OG1-CB 3.45Å; T509-V512 WeakPolarHBondContact OG1-CG2 3.27Å; T509-V512 PolarHBondContact OG1-N 2.9Å
510	D	91.5	Very high	96.9	Very high	157 Å²	157	36.1 Å²	36.1	84%	0.84	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-34.7	178.7	-62.1	-14.8	0	0	0	113.1
511	D	94.1	Very high	96.8	Very high	157 Å²	157	41.6 Å²	41.6	84%	0.84	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-9.6	-177.8	-60	-48.1	0	0	0	115	T509	T509-D511 PolarHBondContact O-N 3.09Å; T509-D511 VanDerWaalsContact O-N 3.13Å
512	V	96.9	Very high	96.6	Very high	29 Å²	29	43.1 Å²	43.1	18%	0.176	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	113.4	-170.7	-175.3	0	0	0	0	110.3	A283 L508 T509	A283-V512 HydrophobicContact CB-CB 4.49Å; A283-V512 HydrophobicContact CB-CG1 4.38Å; L508-V512 HydrophobicContact CB-CB 4.29Å; L508-V512 HydrophobicContact CB-CG1 4.22Å; L508-V512 WeakPolarHBondContact CB-O 3.3Å; L508-V512 HydrophobicContact CD1-CG1 3.95Å; L508-V512 HydrophobicContact CG-CG1 4.31Å; L508-V512 PolarHBondContact N-O 3.41Å; T509-V512 PolarHBondContact N-O 3.4Å; T509-V512 PolarHBondContact O-N 3.04Å; T509-V512 WeakPolarHBondContact OG1-CB 3.45Å; T509-V512 WeakPolarHBondContact OG1-CG2 3.27Å; T509-V512 PolarHBondContact OG1-N 2.9Å
513	T	96.9	Very high	96.5	Very high	65 Å²	65	45 Å²	45	40%	0.399	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.9	176	-63.1	0	0	0	0	110.5	D505 C506 H507	D505-T513 HydrophobicContact CB-CG2 4Å; C506-T513 WeakPolarHBondContact O-CA 3.36Å; H507-T513 PolarHBondContact ND1-OG1 2.85Å
514	V	97.1	Very high	96.2	Very high	22 Å²	22	52.9 Å²	52.9	13%	0.133	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118.6	172.1	176.2	0	0	0	0	108.4	R276 Y280 C506 L508	R276-V514 HydrophobicContact CG-CG1 4.27Å; Y280-V514 HydrophobicContact CD2-CG2 4.43Å; Y280-V514 HydrophobicContact CE2-CG1 4.37Å; Y280-V514 HydrophobicContact CE2-CG2 4.03Å; C506-V514 PolarHBondContact N-O 3.01Å; C506-V514 PolarHBondContact O-N 2.82Å; L508-V514 HydrophobicContact CD1-CG2 3.8Å; L508-V514 HydrophobicContact CG-CG2 4.16Å
515	S	97	Very high	96	Very high	31 Å²	31	58.2 Å²	58.2	22%	0.217	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.4	178	-173.8	0	0	0	0	112.5	W503 D505 G517 L518	W503-S515 PolarHBondContact NE1-OG 3.4Å; D505-S515 WeakPolarHBondContact OD1-CA 3.41Å; D505-S515 WeakPolarHBondContact OD1-CB 3.28Å; D505-S515 PolarHBondContact OD1-OG 2.95Å; S515-G517 VanDerWaalsContact C-N 3.34Å; S515-G517 PolarHBondContact OG-N 2.76Å; S515-L518 WeakPolarHBondContact CB-O 3.37Å; S515-L518 PolarHBondContact OG-O 3.28Å
516	G	96.7	Very high	95.9	Very high	17 Å²	17	57.1 Å²	57.1	18%	0.175	32%	0.316	C	S	.	.	S	Bend	trans	-86.9	-0.7	166.7	0	0	0	0	0	114	M504 Q536	M504-G516 WeakPolarHBondContact O-CA 3.32Å; M504-G516 PolarHBondContact O-N 3.12Å; G516-Q536 PolarHBondContact O-NE2 2.93Å
517	G	97.7	Very high	95.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	-127.7	-105.2	-177.5	0	0	0	0	0	112.2	W503 S515 T519 W530 S531	W503-G517 VanDerWaalsContact CG-CA 3.43Å; S515-G517 VanDerWaalsContact C-N 3.34Å; S515-G517 PolarHBondContact OG-N 2.76Å; G517-T519 PolarHBondContact O-N 3.45Å; G517-W530 CarbonylContact O-C 3.45Å; G517-W530 WeakPolarHBondContact O-CA 3.4Å; G517-S531 WeakPolarHBondContact O-CB 3.44Å; G517-S531 PolarHBondContact O-N 3.25Å
518	L	97.5	Very high	95.8	Very high	20 Å²	20	60.1 Å²	60.1	11%	0.105	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-67.9	123.2	-176.3	-68.7	173.1	0	0	0	111.2	P466 W503 S515 I522 C528 E529 W530	P466-L518 HydrophobicContact CB-CD1 4.09Å; W503-L518 HydrophobicContact CH2-CD1 3.57Å; W503-L518 HydrophobicContact CH2-CG 4.08Å; W503-L518 HydrophobicContact CZ2-CB 4.32Å; W503-L518 HydrophobicContact CZ2-CD1 3.69Å; W503-L518 HydrophobicContact CZ2-CG 4Å; W503-L518 HydrophobicContact CZ3-CD1 4.36Å; S515-L518 WeakPolarHBondContact CB-O 3.37Å; S515-L518 PolarHBondContact OG-O 3.28Å; L518-I522 HydrophobicContact CD1-CD1 3.82Å; L518-I522 HydrophobicContact CD1-CG1 3.91Å; L518-C528 HydrophobicContact CD2-CB 3.82Å; L518-E529 WeakPolarHBondContact CA-O 3.32Å; L518-W530 HydrophobicContact CD2-CD2 4.01Å; L518-W530 HydrophobicContact CD2-CE3 3.85Å; L518-W530 HydrophobicContact CD2-CH2 3.84Å; L518-W530 HydrophobicContact CD2-CZ2 4Å; L518-W530 HydrophobicContact CD2-CZ3 3.77Å; L518-W530 HydrophobicContact CG-CE3 4.13Å; L518-W530 HydrophobicContact CG-CH2 4.07Å; L518-W530 HydrophobicContact CG-CZ3 3.75Å
519	T	95.3	Very high	95.8	Very high	65 Å²	65	65.8 Å²	65.8	40%	0.399	36%	0.36	S	S	.	.	S	Bend	trans	-95.3	-14.5	-178.2	58.2	0	0	0	0	113.5	G517 E529	G517-T519 PolarHBondContact O-N 3.45Å; T519-E529 PolarHBondContact N-O 3.09Å; T519-E529 PolarHBondContact OG1-O 3.34Å
520	Q	94.6	Very high	95.9	Very high	88 Å²	88	65.3 Å²	65.3	41%	0.411	36%	0.355	S	S	.	.	S	Bend	trans	-138.6	157	175.3	-65.7	-60.8	-52	0	0	109.2	E529	Q520-E529 HydrophobicContact CB-CB 4.32Å; Q520-E529 WeakPolarHBondContact CG-OE2 3.31Å
521	P	95.6	Very high	96.1	Very high	116 Å²	116	58.5 Å²	58.5	75%	0.753	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-54.5	141.4	167.1	-23.1	34	0	0	0	111	S523	P521-S523 PolarHBondContact O-N 2.92Å
522	I	96.3	Very high	96.2	Very high	32 Å²	32	56.8 Å²	56.8	16%	0.164	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-57.6	134.5	176.3	-71.6	160.9	0	0	0	109.6	V409 A462 P466 L518	V409-I522 HydrophobicContact CG2-CD1 4.14Å; A462-I522 HydrophobicContact CB-CD1 3.6Å; A462-I522 HydrophobicContact CB-CG1 4.17Å; A462-I522 HydrophobicContact CB-CG2 3.86Å; P466-I522 HydrophobicContact CB-CD1 4.17Å; P466-I522 HydrophobicContact CG-CD1 3.85Å; L518-I522 HydrophobicContact CD1-CD1 3.82Å; L518-I522 HydrophobicContact CD1-CG1 3.91Å
523	S	95.9	Very high	96.1	Very high	39 Å²	39	56.5 Å²	56.5	27%	0.273	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-62	163.7	-179.7	90	0	0	0	0	111.6	R493 P521 Q525 G526 D527	R493-S523 PolarHBondContact NH2-O 3.13Å; P521-S523 PolarHBondContact O-N 2.92Å; S523-Q525 PolarHBondContact O-N 3Å; S523-Q525 PolarHBondContact OG-N 2.75Å; S523-G526 WeakPolarHBondContact O-CA 3.31Å; S523-G526 PolarHBondContact O-N 3.3Å; S523-G526 PolarHBondContact OG-N 3.46Å; S523-G526 VanDerWaalsContact OG-N 3.17Å; S523-D527 PolarHBondContact N-O 3.33Å; S523-D527 VanDerWaalsContact N-O 3.17Å; S523-D527 WeakPolarHBondContact OG-CB 3.31Å; S523-D527 PolarHBondContact OG-N 3.06Å; S523-D527 PolarHBondContact OG-OD2 3.17Å
524	E	91.8	Very high	96	Very high	170 Å²	170	56 Å²	56	79%	0.794	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-38.9	173.2	-68.6	-174.4	167.5	0	0	111.3	R493 G526	R493-E524 PolarHBondContact NE-O 3.34Å; R493-E524 VanDerWaalsContact NE-O 3.1Å; R493-E524 PolarHBondContact NH2-O 3.49Å; E524-G526 VanDerWaalsContact C-N 3.25Å; E524-G526 PolarHBondContact O-N 3.45Å
525	Q	93.3	Very high	96	Very high	121 Å²	121	60.3 Å²	60.3	57%	0.565	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-11.2	180	-46.8	-42.3	-23.4	0	0	113.5	R461 S523	R461-Q525 WeakPolarHBondContact CD-O 3.44Å; R461-Q525 WeakPolarHBondContact CG-O 3.5Å; S523-Q525 PolarHBondContact O-N 3Å; S523-Q525 PolarHBondContact OG-N 2.75Å
526	G	95.7	Very high	96.1	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.296	C	S	.	.			trans	101.2	4.9	177.6	0	0	0	0	0	113.7	R461 A462 S523 E524 C528	R461-G526 CarbonylContact C-O 3.35Å; R461-G526 VanDerWaalsContact CA-O 3.25Å; R461-G526 WeakPolarHBondContact CA-O 3.25Å; A462-G526 PolarHBondContact N-O 3.38Å; S523-G526 WeakPolarHBondContact O-CA 3.31Å; S523-G526 PolarHBondContact O-N 3.3Å; S523-G526 PolarHBondContact OG-N 3.46Å; S523-G526 VanDerWaalsContact OG-N 3.17Å; E524-G526 VanDerWaalsContact C-N 3.25Å; E524-G526 PolarHBondContact O-N 3.45Å; G526-C528 PolarHBondContact O-N 3.07Å
527	D	96.3	Very high	96.2	Very high	91 Å²	91	58 Å²	58	49%	0.487	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-62.5	135	-178.4	-49.5	-55.8	0	0	0	110.6	S523	S523-D527 PolarHBondContact N-O 3.33Å; S523-D527 VanDerWaalsContact N-O 3.17Å; S523-D527 WeakPolarHBondContact OG-CB 3.31Å; S523-D527 PolarHBondContact OG-N 3.06Å; S523-D527 PolarHBondContact OG-OD2 3.17Å
528	C	97.8	Very high	96.2	Very high	18 Å²	18	58 Å²	58	12%	0.122	29%	0.288	C	S	.	.			trans	-104.7	128.7	-178.4	-63	0	0	0	0	110.8	C460 L518 G526 W530	C460-C528 PolarHBondContact O-N 3.43Å; L518-C528 HydrophobicContact CD2-CB 3.82Å; G526-C528 PolarHBondContact O-N 3.07Å; C528-W530 HydrophobicContact CB-CZ2 3.84Å; C528-W530 VanDerWaalsContact CB-NE1 3.31Å
529	E	97.4	Very high	96.1	Very high	121 Å²	121	57.7 Å²	57.7	57%	0.565	29%	0.285	S	S	*	.			trans	-106.3	106.3	171.3	-70.5	-169.6	-165	0	0	110.9	L518 T519 Q520	L518-E529 WeakPolarHBondContact CA-O 3.32Å; T519-E529 PolarHBondContact N-O 3.09Å; T519-E529 PolarHBondContact OG1-O 3.34Å; Q520-E529 HydrophobicContact CB-CB 4.32Å; Q520-E529 WeakPolarHBondContact CG-OE2 3.31Å
530	W	98.3	Very high	96.1	Very high	12 Å²	12	55.4 Å²	55.4	5%	0.045	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-93.2	150.7	-174.3	-58.2	101.8	0	0	0	113.4	V409 L455 W456 C460 A501 W503 G517 L518 C528 R532 Q536	V409-W530 HydrophobicContact CG1-CH2 3.89Å; V409-W530 HydrophobicContact CG1-CZ2 4.39Å; L455-W530 HydrophobicContact CB-CB 4Å; L455-W530 VanDerWaalsContact CB-CD1 3.4Å; L455-W530 HydrophobicContact CB-CD2 3.68Å; L455-W530 HydrophobicContact CB-CE3 4.46Å; L455-W530 HydrophobicContact CB-CG 3.42Å; L455-W530 VanDerWaalsContact CB-CG 3.42Å; L455-W530 HydrophobicContact CD1-CD2 3.9Å; L455-W530 HydrophobicContact CD1-CE3 4.16Å; L455-W530 HydrophobicContact CD1-CH2 3.95Å; L455-W530 HydrophobicContact CD1-CZ2 3.66Å; L455-W530 HydrophobicContact CD1-CZ3 4.19Å; L455-W530 HydrophobicContact CG-CD2 4.44Å; L455-W530 VanDerWaalsContact O-CD1 3.31Å; W456-W530 HydrophobicContact CB-CB 4.26Å; C460-W530 PolarHBondContact SG-NE1 3.07Å; A501-W530 HydrophobicContact CB-CH2 3.56Å; A501-W530 HydrophobicContact CB-CZ2 3.91Å; A501-W530 HydrophobicContact CB-CZ3 4.45Å; W503-W530 HydrophobicContact CD2-CZ3 4.24Å; W503-W530 HydrophobicContact CE3-CH2 4.12Å; W503-W530 AromaticContact CE3-CZ3 3.76Å; W503-W530 HydrophobicContact CE3-CZ3 3.76Å; W503-W530 HydrophobicContact CZ3-CH2 4.09Å; W503-W530 HydrophobicContact CZ3-CZ3 4.11Å; G517-W530 CarbonylContact O-C 3.45Å; G517-W530 WeakPolarHBondContact O-CA 3.4Å; L518-W530 HydrophobicContact CD2-CD2 4.01Å; L518-W530 HydrophobicContact CD2-CE3 3.85Å; L518-W530 HydrophobicContact CD2-CH2 3.84Å; L518-W530 HydrophobicContact CD2-CZ2 4Å; L518-W530 HydrophobicContact CD2-CZ3 3.77Å; L518-W530 HydrophobicContact CG-CE3 4.13Å; L518-W530 HydrophobicContact CG-CH2 4.07Å; L518-W530 HydrophobicContact CG-CZ3 3.75Å; C528-W530 HydrophobicContact CB-CZ2 3.84Å; C528-W530 VanDerWaalsContact CB-NE1 3.31Å; W530-R532 PolarHBondContact O-N 2.93Å; W530-Q536 HydrophobicContact CE3-CG 3.69Å; W530-Q536 HydrophobicContact CZ3-CG 3.96Å
531	S	96.3	Very high	96	Very high	14 Å²	14	52.3 Å²	52.3	10%	0.098	26%	0.256	C	S	.	.			trans	-61.1	127.3	170.8	-179.8	0	0	0	0	110	G517 H533	G517-S531 WeakPolarHBondContact O-CB 3.44Å; G517-S531 PolarHBondContact O-N 3.25Å; S531-H533 PolarHBondContact O-N 3.28Å
532	R	95.8	Very high	95.4	Very high	121 Å²	121	54.5 Å²	54.5	46%	0.457	25%	0.249	S	C	.	.	S	Bend	trans	-74.5	-18	-180	-61.1	-173.1	177.1	89.3	5.3	113.4	W456 W530	W456-R532 HydrophobicContact CB-CG 3.98Å; W456-R532 VanDerWaalsContact CD1-CA 3.5Å; W456-R532 HydrophobicContact CD2-CB 4.31Å; W456-R532 HydrophobicContact CD2-CG 3.85Å; W456-R532 HydrophobicContact CE3-CG 4.29Å; W456-R532 HydrophobicContact CG-CB 4.08Å; W456-R532 HydrophobicContact CG-CG 3.72Å; W530-R532 PolarHBondContact O-N 2.93Å
533	H	94.8	Very high	95	Very high	24 Å²	24	57.6 Å²	57.6	11%	0.111	27%	0.274	C	S	.	.	S	Bend	trans	-103.3	-6.8	-164.8	-56.1	-44.9	0	0	0	113.3	E270 D273 S531	E270-H533 HydrophobicContact CB-CB 3.71Å; E270-H533 HydrophobicContact CG-CB 3.89Å; E270-H533 PolarHBondContact N-ND1 3.22Å; D273-H533 IonicContact OD2-CD2 3.35Å; S531-H533 PolarHBondContact O-N 3.28Å
534	R	94.6	Very high	94.7	Very high	54 Å²	54	57.3 Å²	57.3	20%	0.204	27%	0.273	C	S	.	.	S	Bend	trans	-129.9	142.8	175.9	-65.4	-64.9	-178.2	138.5	6.2	108.9	E270 Q536	E270-R534 IonicContact OE1-CZ 2.75Å; E270-R534 VanDerWaalsContact OE1-CZ 3.26Å; E270-R534 IonicContact OE1-NE 3.85Å; E270-R534 PolarHBondContact OE1-NE 2.83Å; E270-R534 IonicContact OE1-NH2 2.81Å; E270-R534 PolarHBondContact OE1-NH2 3.24Å; E270-R534 IonicContact OE2-CZ 3.21Å; E270-R534 IonicContact OE2-NE 3.8Å; E270-R534 PolarHBondContact OE2-NE 3.29Å; E270-R534 IonicContact OE2-NH2 2.9Å; E270-R534 PolarHBondContact OE2-NH2 2.94Å; R534-Q536 PolarHBondContact O-NE2 3.1Å
535	K	97.7	Very high	94.8	Very high	112 Å²	112	54 Å²	54	49%	0.487	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-79.7	141.2	166.5	-65.1	-171.1	175.1	-167.9	0	108.7	P452 H453 P454	P452-K535 HydrophobicContact CB-CB 4.12Å; P452-K535 HydrophobicContact CB-CD 4.12Å; H453-K535 CarbonylContact O-C 3.59Å; H453-K535 WeakPolarHBondContact O-CA 3.45Å; P454-K535 HydrophobicContact CB-CG 4.33Å
536	Q	98.6	Very high	95	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	154.9	171.8	-65.5	72.5	43.9	0	0	109	P452 H453 L455 L502 W503 G516 W530 R534	P452-Q536 CarbonylContact C-O 3.37Å; P452-Q536 WeakPolarHBondContact CA-O 3.37Å; H453-Q536 PolarHBondContact N-O 3.21Å; H453-Q536 PolarHBondContact O-N 2.79Å; H453-Q536 PolarHBondContact O-OE1 3.09Å; L455-Q536 VanDerWaalsContact CB-OE1 3.32Å; L455-Q536 HydrophobicContact CD1-CB 3.65Å; L455-Q536 HydrophobicContact CD1-CG 4.16Å; L455-Q536 HydrophobicContact CG-CB 3.94Å; L455-Q536 HydrophobicContact CG-CG 4.46Å; L502-Q536 WeakPolarHBondContact O-CB 3.47Å; W503-Q536 HydrophobicContact CB-CG 4.13Å; G516-Q536 PolarHBondContact O-NE2 2.93Å; W530-Q536 HydrophobicContact CE3-CG 3.69Å; W530-Q536 HydrophobicContact CZ3-CG 3.96Å; R534-Q536 PolarHBondContact O-NE2 3.1Å
537	G	98.2	Very high	94.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	139.1	170.5	0	0	0	0	0	109.9	E451 A501 L502	E451-G537 CarbonylContact O-C 3.52Å; E451-G537 WeakPolarHBondContact O-CA 3.45Å; A501-G537 CarbonylContact C-O 3.55Å; A501-G537 WeakPolarHBondContact CA-O 3.42Å; L502-G537 PolarHBondContact N-O 2.9Å; L502-G537 PolarHBondContact O-N 3.48Å
538	V	98.1	Very high	94.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.1	172.9	-175.6	0	0	0	0	108.8	F413 A450 E451 H453 L455 F540	F413-V538 HydrophobicContact CE2-CG1 3.66Å; F413-V538 HydrophobicContact CZ-CG1 3.81Å; F413-V538 HydrophobicContact CZ-CG2 4.14Å; A450-V538 CarbonylContact C-O 3.6Å; A450-V538 WeakPolarHBondContact CA-O 3.48Å; E451-V538 PolarHBondContact N-O 2.78Å; E451-V538 PolarHBondContact O-N 2.99Å; H453-V538 HydrophobicContact CB-CG2 3.99Å; L455-V538 HydrophobicContact CD1-CG2 4.19Å; L455-V538 HydrophobicContact CD2-CG2 3.65Å; L455-V538 HydrophobicContact CG-CG2 4.24Å; V538-F540 HydrophobicContact CB-CE2 4.31Å; V538-F540 HydrophobicContact CB-CZ 4.41Å; V538-F540 HydrophobicContact CG1-CD1 4.17Å; V538-F540 HydrophobicContact CG1-CD2 4.17Å; V538-F540 HydrophobicContact CG1-CE1 3.84Å; V538-F540 HydrophobicContact CG1-CE2 3.86Å; V538-F540 HydrophobicContact CG1-CG 4.33Å; V538-F540 HydrophobicContact CG1-CZ 3.68Å
539	Y	96.8	Very high	94.3	Very high	13 Å²	13	55.7 Å²	55.7	5%	0.051	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	108.2	169	-171.8	-78.9	0	0	0	108.9	R448 G499 V500 L541 M570 F572	R448-Y539 HydrophobicContact CB-CE2 3.73Å; R448-Y539 WeakPolarHBondContact O-CE2 3.4Å; G499-Y539 CarbonylContact C-O 3.6Å; G499-Y539 WeakPolarHBondContact CA-O 3.33Å; V500-Y539 PolarHBondContact N-O 3.16Å; V500-Y539 PolarHBondContact O-N 3.24Å; Y539-L541 HydrophobicContact CE1-CD2 4.49Å; Y539-M570 HydrophobicContact CD2-CG 3.93Å; Y539-M570 HydrophobicContact CD2-SD 4.07Å; Y539-M570 HydrophobicContact CE2-CG 4.15Å; Y539-F572 HydrophobicContact CD1-CB 4.21Å; Y539-F572 AromaticContact CD1-CD2 3.48Å; Y539-F572 HydrophobicContact CD1-CD2 3.48Å; Y539-F572 VanDerWaalsContact CD1-CD2 3.48Å; Y539-F572 HydrophobicContact CD1-CE2 4.17Å; Y539-F572 HydrophobicContact CD1-CG 4.2Å; Y539-F572 AromaticContact CD2-CD2 3.8Å; Y539-F572 HydrophobicContact CD2-CD2 3.8Å; Y539-F572 HydrophobicContact CD2-CE2 4.02Å; Y539-F572 HydrophobicContact CE1-CB 4.01Å; Y539-F572 AromaticContact CE1-CD2 3.83Å; Y539-F572 HydrophobicContact CE1-CD2 3.83Å; Y539-F572 HydrophobicContact CE1-CG 4.39Å; Y539-F572 HydrophobicContact CE2-CD2 4.09Å; Y539-F572 AromaticContact CG-CD2 3.47Å; Y539-F572 HydrophobicContact CG-CD2 3.47Å; Y539-F572 VanDerWaalsContact CG-CD2 3.47Å; Y539-F572 AromaticContact CG-CE2 3.73Å; Y539-F572 HydrophobicContact CG-CE2 3.73Å
540	F	94.8	Very high	94.1	Very high	17 Å²	17	53.6 Å²	53.6	8%	0.075	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	130	175.3	-66.1	-77.7	0	0	0	110.9	F413 L416 I419 R420 R448 V538	F413-F540 HydrophobicContact CD2-CE1 4.27Å; F413-F540 HydrophobicContact CE2-CE1 4.17Å; L416-F540 HydrophobicContact CD2-CZ 4.2Å; L416-F540 HydrophobicContact CG-CE1 4.36Å; L416-F540 HydrophobicContact CG-CZ 3.99Å; I419-F540 HydrophobicContact CD1-CE2 4.23Å; I419-F540 HydrophobicContact CD1-CZ 4.05Å; I419-F540 HydrophobicContact CG1-CE2 4.43Å; I419-F540 HydrophobicContact CG1-CZ 4.18Å; R420-F540 HydrophobicContact CB-CB 4.4Å; R420-F540 HydrophobicContact CB-CD2 4.27Å; R420-F540 HydrophobicContact CB-CG 4.19Å; R420-F540 HydrophobicContact CG-CB 4.48Å; R420-F540 HydrophobicContact CG-CD2 3.57Å; R420-F540 HydrophobicContact CG-CE2 3.87Å; R420-F540 HydrophobicContact CG-CG 4Å; R448-F540 PolarHBondContact NH1-O 2.88Å; V538-F540 HydrophobicContact CB-CE2 4.31Å; V538-F540 HydrophobicContact CB-CZ 4.41Å; V538-F540 HydrophobicContact CG1-CD1 4.17Å; V538-F540 HydrophobicContact CG1-CD2 4.17Å; V538-F540 HydrophobicContact CG1-CE1 3.84Å; V538-F540 HydrophobicContact CG1-CE2 3.86Å; V538-F540 HydrophobicContact CG1-CG 4.33Å; V538-F540 HydrophobicContact CG1-CZ 3.68Å
541	L	91.9	Very high	93.7	Very high	23 Å²	23	54.4 Å²	54.4	12%	0.12	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	148.7	172.6	-63.2	179.2	0	0	0	109.9	C497 H498 Y539 S543 F572 I574	C497-L541 HydrophobicContact CB-CD1 4.39Å; H498-L541 PolarHBondContact O-N 2.93Å; Y539-L541 HydrophobicContact CE1-CD2 4.49Å; L541-S543 VanDerWaalsContact C-N 3.26Å; L541-S543 WeakPolarHBondContact CB-O 3.45Å; L541-S543 PolarHBondContact O-N 3.08Å; L541-F572 HydrophobicContact CD2-CB 4.24Å; L541-I574 HydrophobicContact CD1-CD1 4.02Å
542	R	83.9	Confident	93.4	Very high	163 Å²	163	62 Å²	62	62%	0.615	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.8	-42.1	175	-76.2	-177.4	170.2	171.6	-2.5	111.9	D443	D443-R542 IonicContact OD1-CZ 2.76Å; D443-R542 IonicContact OD1-NE 2.8Å; D443-R542 IonicContact OD1-NH2 3.84Å; D443-R542 PolarHBondContact OD1-NH2 3.43Å; D443-R542 IonicContact OD2-NH2 3.62Å
543	S	86.3	Confident	93.3	Very high	97 Å²	97	57.7 Å²	57.7	68%	0.678	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.1	174.3	-58.7	0	0	0	0	108	L541	L541-S543 VanDerWaalsContact C-N 3.26Å; L541-S543 WeakPolarHBondContact CB-O 3.45Å; L541-S543 PolarHBondContact O-N 3.08Å
544	A	91.3	Very high	93.4	Very high	32 Å²	32	56.6 Å²	56.6	26%	0.264	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	146.6	173.3	0	0	0	0	0	110.7	R496 C497	R496-A544 HydrophobicContact CG-CB 3.83Å; C497-A544 CarbonylContact O-C 3.45Å; C497-A544 WeakPolarHBondContact O-CA 3.44Å
545	W	94.3	Very high	93.5	Very high	102 Å²	102	54 Å²	54	39%	0.386	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.3	-176.2	-179.9	-94.6	0	0	0	112.1	F491 R496 C497 S547 T553 I574	F491-W545 AromaticContact CE2-CD1 3.56Å; F491-W545 AromaticContact CE2-NE1 3.95Å; R496-W545 CarbonylContact C-O 3.54Å; R496-W545 WeakPolarHBondContact CA-O 3.49Å; C497-W545 HydrophobicContact CB-CB 4.29Å; C497-W545 PolarHBondContact N-O 2.81Å; C497-W545 PolarHBondContact O-N 3.47Å; W545-S547 PolarHBondContact O-N 2.94Å; W545-T553 HydrophobicContact CZ2-CG2 4.33Å; W545-I574 HydrophobicContact CB-CD1 4.06Å; W545-I574 HydrophobicContact CB-CG1 3.98Å; W545-I574 HydrophobicContact CD2-CB 4.34Å; W545-I574 HydrophobicContact CD2-CG1 4.18Å; W545-I574 HydrophobicContact CD2-CG2 3.63Å; W545-I574 HydrophobicContact CE3-CB 4.36Å; W545-I574 HydrophobicContact CE3-CG1 4.33Å; W545-I574 HydrophobicContact CE3-CG2 3.96Å; W545-I574 HydrophobicContact CG-CD1 4.17Å; W545-I574 HydrophobicContact CG-CG1 4.02Å; W545-I574 HydrophobicContact CG-CG2 4.01Å; W545-I574 HydrophobicContact CH2-CG2 4.27Å; W545-I574 HydrophobicContact CZ2-CG2 3.97Å; W545-I574 HydrophobicContact CZ3-CG2 4.27Å
546	D	95.9	Very high	93.4	Very high	113 Å²	113	50.4 Å²	50.4	60%	0.604	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	109.2	174.9	-64.8	-51.9	0	0	0	110.3	R496	R496-D546 WeakPolarHBondContact CG-OD1 3.47Å
547	S	92.8	Very high	93.3	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.028	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	141	177.6	176	0	0	0	0	111.7	F491 R493 T494 G495 W545 G549	F491-S547 WeakPolarHBondContact CB-OG 3.38Å; F491-S547 VanDerWaalsContact CG-OG 3.24Å; F491-S547 WeakPolarHBondContact CG-OG 3.25Å; R493-S547 PolarHBondContact O-OG 3.09Å; T494-S547 VanDerWaalsContact CA-O 3.27Å; T494-S547 WeakPolarHBondContact CA-O 3.39Å; T494-S547 WeakPolarHBondContact CG2-O 3.39Å; G495-S547 PolarHBondContact N-O 3.01Å; G495-S547 VanDerWaalsContact N-O 3.11Å; G495-S547 WeakPolarHBondContact O-CB 3.35Å; G495-S547 PolarHBondContact O-N 3.28Å; W545-S547 PolarHBondContact O-N 2.94Å; S547-G549 PolarHBondContact OG-N 2.89Å
548	L	92.3	Very high	93.3	Very high	128 Å²	128	53.1 Å²	53.1	67%	0.67	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	-16.1	170.1	-62.5	178.4	0	0	0	113.1	T494 D550	T494-L548 PolarHBondContact OG1-O 3.4Å; L548-D550 VanDerWaalsContact C-N 3.33Å
549	G	91.7	Very high	93.2	Very high	19 Å²	19	53.1 Å²	53.1	20%	0.196	28%	0.278	C	S	.	.	S	Bend	trans	72.8	19.9	-178.5	0	0	0	0	0	115.2	F491 R493 S547	F491-G549 CarbonylContact O-C 3.52Å; R493-G549 WeakPolarHBondContact O-CA 3.47Å; S547-G549 PolarHBondContact OG-N 2.89Å
550	D	91.6	Very high	93.2	Very high	77 Å²	77	54 Å²	54	41%	0.412	29%	0.285	S	S	.	.	S	Bend	trans	-93.5	5.4	-177.7	68.5	-3.7	0	0	0	113.8	L548 R552	L548-D550 VanDerWaalsContact C-N 3.33Å; D550-R552 PolarHBondContact O-N 3.21Å; D550-R552 WeakPolarHBondContact OD1-CB 3.39Å; D550-R552 PolarHBondContact OD1-N 3.49Å; D550-R552 WeakPolarHBondContact OD2-CD 3.42Å; D550-R552 IonicContact OD2-NE 2.75Å
551	G	89.9	Confident	93.3	Very high	30 Å²	30	53.2 Å²	53.2	31%	0.309	28%	0.281	S	S	.	.	S	Bend	trans	71.6	0.8	-178.9	0	0	0	0	0	115.7	F491	F491-G551 WeakPolarHBondContact O-CA 3.4Å; F491-G551 PolarHBondContact O-N 2.87Å
552	R	90.2	Very high	93.6	Very high	174 Å²	174	53.7 Å²	53.7	66%	0.657	28%	0.283	S	S	*	.	S	Bend	trans	-79.7	-24.6	-179.3	-63.7	-176.4	-179.8	175.7	-0.7	113.6	D550 H577	D550-R552 PolarHBondContact O-N 3.21Å; D550-R552 WeakPolarHBondContact OD1-CB 3.39Å; D550-R552 PolarHBondContact OD1-N 3.49Å; D550-R552 WeakPolarHBondContact OD2-CD 3.42Å; D550-R552 IonicContact OD2-NE 2.75Å; R552-H577 PolarHBondContact O-N 3.39Å
553	T	94.3	Very high	94.2	Very high	30 Å²	30	46.5 Å²	46.5	18%	0.184	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	152.8	175.4	55.4	0	0	0	0	109.2	F491 W545 T575	F491-T553 WeakPolarHBondContact CD2-O 3.23Å; F491-T553 PolarHBondContact N-O 3.39Å; W545-T553 HydrophobicContact CZ2-CG2 4.33Å; T553-T575 WeakPolarHBondContact CA-O 3.31Å
554	G	95.6	Very high	94.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	175	179.5	0	0	0	0	0	112.6	L489 T575	L489-G554 CarbonylContact O-C 3.53Å; L489-G554 WeakPolarHBondContact O-CA 3.29Å; G554-T575 PolarHBondContact N-O 3.44Å; G554-T575 PolarHBondContact O-N 3.1Å
555	V	96.8	Very high	94.6	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	109.8	173.1	-170.3	0	0	0	0	108.3	A410 L489 F491 V500 F572 S573 I574	A410-V555 HydrophobicContact CB-CG2 3.82Å; L489-V555 HydrophobicContact CB-CB 4.29Å; L489-V555 HydrophobicContact CD1-CB 4.39Å; L489-V555 PolarHBondContact N-O 2.89Å; L489-V555 PolarHBondContact O-N 3.2Å; F491-V555 HydrophobicContact CE1-CG2 3.72Å; F491-V555 HydrophobicContact CE2-CG2 4.27Å; F491-V555 HydrophobicContact CZ-CG2 3.42Å; F491-V555 VanDerWaalsContact CZ-CG2 3.42Å; V500-V555 HydrophobicContact CG2-CG1 4.05Å; V555-F572 HydrophobicContact CG1-CB 4.11Å; V555-F572 HydrophobicContact CG1-CD1 3.76Å; V555-F572 HydrophobicContact CG1-CG 4.38Å; V555-S573 CarbonylContact C-O 3.53Å; V555-I574 HydrophobicContact CG2-CD1 3.88Å
556	S	96.9	Very high	94.5	Very high	36 Å²	36	46.8 Å²	46.8	25%	0.252	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137.1	167.8	-171	0	0	0	0	109	G487 F572 S573	G487-S556 WeakPolarHBondContact O-CA 3.5Å; S556-F572 WeakPolarHBondContact O-CA 3.35Å; S556-S573 PolarHBondContact N-O 3.41Å; S556-S573 PolarHBondContact O-N 2.98Å
557	Y	96.8	Very high	94.3	Very high	23 Å²	23	45 Å²	45	9%	0.09	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	150.4	176.6	66.1	-97.8	0	0	0	111.5	V469 Q486 G487 L489 F559 D571	V469-Y557 HydrophobicContact CB-CE2 3.99Å; V469-Y557 HydrophobicContact CG1-CD2 4.24Å; V469-Y557 HydrophobicContact CG1-CE1 3.99Å; V469-Y557 HydrophobicContact CG1-CE2 3.69Å; Q486-Y557 WeakPolarHBondContact CA-O 3.27Å; G487-Y557 VanDerWaalsContact CA-CZ 3.45Å; G487-Y557 PolarHBondContact N-O 3.03Å; G487-Y557 VanDerWaalsContact N-O 3.16Å; G487-Y557 WeakPolarHBondContact O-CD1 3.2Å; G487-Y557 PolarHBondContact O-N 3.19Å; L489-Y557 HydrophobicContact CD1-CD1 4.36Å; L489-Y557 HydrophobicContact CD2-CD1 4.11Å; L489-Y557 HydrophobicContact CD2-CE1 3.83Å; L489-Y557 HydrophobicContact CG-CD1 3.87Å; L489-Y557 HydrophobicContact CG-CE1 4.09Å; Y557-F559 AromaticContact CD2-CD2 3.45Å; Y557-F559 HydrophobicContact CD2-CD2 3.45Å; Y557-F559 VanDerWaalsContact CD2-CD2 3.45Å; Y557-F559 AromaticContact CD2-CE2 3.6Å; Y557-F559 HydrophobicContact CD2-CE2 3.6Å; Y557-F559 HydrophobicContact CE2-CD2 4.09Å; Y557-F559 HydrophobicContact CE2-CE2 4.37Å; Y557-F559 HydrophobicContact CG-CD2 4.22Å; Y557-F559 AromaticContact CG-CE2 3.92Å; Y557-F559 HydrophobicContact CG-CE2 3.92Å; Y557-D571 WeakPolarHBondContact CA-O 3.34Å
558	S	96.6	Very high	94.4	Very high	35 Å²	35	45.3 Å²	45.3	25%	0.245	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	123.8	166.2	-176.8	0	0	0	0	109.1	S485 Q486 M570 D571	S485-S558 CarbonylContact O-C 3.36Å; S485-S558 WeakPolarHBondContact O-CA 3.37Å; Q486-S558 PolarHBondContact NE2-OG 3.35Å; S558-M570 CarbonylContact O-C 3.26Å; S558-M570 VanDerWaalsContact O-CA 3.31Å; S558-M570 WeakPolarHBondContact O-CA 3.47Å; S558-D571 PolarHBondContact N-O 3.13Å; S558-D571 PolarHBondContact O-N 2.92Å
559	F	96.8	Very high	94.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	143.1	175.3	-71.2	-81	0	0	0	110.9	L406 V408 V469 M470 S484 S485 L502 Y557 V568 K569 M570 F572	L406-F559 HydrophobicContact CD2-CD1 3.99Å; L406-F559 HydrophobicContact CD2-CE1 3.94Å; L406-F559 HydrophobicContact CD2-CZ 4.48Å; V408-F559 HydrophobicContact CG1-CE2 4.02Å; V408-F559 HydrophobicContact CG1-CZ 3.69Å; V469-F559 HydrophobicContact CB-CD2 4.02Å; V469-F559 HydrophobicContact CB-CE2 4.04Å; V469-F559 HydrophobicContact CG1-CE2 4.17Å; V469-F559 HydrophobicContact CG2-CD2 3.88Å; V469-F559 HydrophobicContact CG2-CE2 3.71Å; V469-F559 HydrophobicContact CG2-CZ 4.21Å; M470-F559 HydrophobicContact CG-CB 4.25Å; M470-F559 HydrophobicContact SD-CB 3.66Å; M470-F559 HydrophobicContact SD-CG 4.32Å; S484-F559 CarbonylContact C-O 3.57Å; S484-F559 WeakPolarHBondContact CA-O 3.38Å; S485-F559 PolarHBondContact N-O 3.37Å; S485-F559 PolarHBondContact O-N 3.42Å; L502-F559 HydrophobicContact CD2-CE1 3.6Å; L502-F559 HydrophobicContact CD2-CZ 3.68Å; Y557-F559 AromaticContact CD2-CD2 3.45Å; Y557-F559 HydrophobicContact CD2-CD2 3.45Å; Y557-F559 VanDerWaalsContact CD2-CD2 3.45Å; Y557-F559 AromaticContact CD2-CE2 3.6Å; Y557-F559 HydrophobicContact CD2-CE2 3.6Å; Y557-F559 HydrophobicContact CE2-CD2 4.09Å; Y557-F559 HydrophobicContact CE2-CE2 4.37Å; Y557-F559 HydrophobicContact CG-CD2 4.22Å; Y557-F559 AromaticContact CG-CE2 3.92Å; Y557-F559 HydrophobicContact CG-CE2 3.92Å; F559-V568 HydrophobicContact CD1-CG1 3.76Å; F559-V568 HydrophobicContact CE1-CG1 4.48Å; F559-K569 WeakPolarHBondContact CA-O 3.43Å; F559-M570 HydrophobicContact CD1-CB 3.63Å; F559-M570 HydrophobicContact CE1-CB 3.48Å; F559-M570 VanDerWaalsContact CE1-CB 3.48Å; F559-M570 HydrophobicContact CE1-CE 4.22Å; F559-M570 HydrophobicContact CE1-CG 4.42Å; F559-M570 HydrophobicContact CE1-SD 4.13Å; F559-M570 HydrophobicContact CZ-CB 4.34Å; F559-F572 HydrophobicContact CE1-CZ 4.25Å; F559-F572 HydrophobicContact CE2-CE1 4.27Å; F559-F572 HydrophobicContact CE2-CZ 4.15Å; F559-F572 HydrophobicContact CZ-CE1 4.03Å; F559-F572 HydrophobicContact CZ-CE2 4.18Å; F559-F572 AromaticContact CZ-CZ 3.46Å; F559-F572 HydrophobicContact CZ-CZ 3.46Å; F559-F572 VanDerWaalsContact CZ-CZ 3.46Å
560	T	97.1	Very high	94.6	Very high	31 Å²	31	43.4 Å²	43.4	19%	0.19	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	115.4	167.9	-60.5	0	0	0	0	109.4	P482 I483 S484 E562 V568 K569	P482-T560 HydrophobicContact CB-CG2 3.86Å; I483-T560 CarbonylContact O-C 3.59Å; I483-T560 WeakPolarHBondContact O-CA 3.28Å; S484-T560 PolarHBondContact OG-OG1 2.85Å; T560-E562 HydrophobicContact CG2-CG 4.32Å; T560-E562 WeakPolarHBondContact CG2-OE2 3.45Å; T560-E562 VanDerWaalsContact CG2-OE2 3.27Å; T560-V568 WeakPolarHBondContact O-CA 3.17Å; T560-K569 PolarHBondContact N-O 3.34Å; T560-K569 PolarHBondContact O-N 2.83Å
561	F	97.4	Very high	94.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125.5	167.1	170.1	-108.4	0	0	0	109	L380 W383 Y384 M470 F472 P482 I483 P563 D567 V568	L380-F561 HydrophobicContact CD1-CD2 4.1Å; L380-F561 HydrophobicContact CD1-CE2 3.78Å; L380-F561 HydrophobicContact CD1-CZ 4.39Å; W383-F561 HydrophobicContact CE3-CE1 4.33Å; W383-F561 HydrophobicContact CE3-CZ 4.41Å; W383-F561 HydrophobicContact CZ3-CD1 4.45Å; W383-F561 AromaticContact CZ3-CE1 3.76Å; W383-F561 HydrophobicContact CZ3-CE1 3.76Å; W383-F561 HydrophobicContact CZ3-CZ 4.27Å; Y384-F561 HydrophobicContact CE2-CZ 4.19Å; Y384-F561 WeakPolarHBondContact OH-CZ 3.43Å; M470-F561 HydrophobicContact CE-CB 3.58Å; M470-F561 HydrophobicContact SD-CB 4.47Å; F472-F561 HydrophobicContact CE1-CB 4.09Å; F472-F561 HydrophobicContact CE1-CD1 4.21Å; F472-F561 HydrophobicContact CE1-CD2 4.32Å; F472-F561 AromaticContact CE1-CG 3.94Å; F472-F561 HydrophobicContact CE1-CG 3.94Å; P482-F561 WeakPolarHBondContact CA-O 3.13Å; I483-F561 HydrophobicContact CB-CB 4.32Å; I483-F561 HydrophobicContact CD1-CD1 3.95Å; I483-F561 HydrophobicContact CG1-CD1 4.18Å; I483-F561 PolarHBondContact N-O 3.09Å; I483-F561 VanDerWaalsContact N-O 3.11Å; I483-F561 PolarHBondContact O-N 3.01Å; F561-P563 HydrophobicContact CD1-CG 4.11Å; F561-P563 HydrophobicContact CE1-CB 4.14Å; F561-P563 HydrophobicContact CE1-CG 3.92Å; F561-P563 WeakPolarHBondContact O-CD 3.23Å; F561-D567 WeakPolarHBondContact CA-O 3.28Å; F561-V568 HydrophobicContact CB-CG2 4.38Å; F561-V568 HydrophobicContact CD2-CG2 3.95Å
562	E	96.4	Very high	94.9	Very high	34 Å²	34	43.1 Å²	43.1	16%	0.159	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	100.8	-177.6	-58.3	-69.4	-129.4	0	0	110.4	P482 T560 S564 L565 G566 D567 K569	P482-E562 VanDerWaalsContact CB-OE2 3.25Å; P482-E562 WeakPolarHBondContact CB-OE2 3.42Å; P482-E562 VanDerWaalsContact CG-OE2 3.24Å; P482-E562 WeakPolarHBondContact CG-OE2 3.41Å; T560-E562 HydrophobicContact CG2-CG 4.32Å; T560-E562 WeakPolarHBondContact CG2-OE2 3.45Å; T560-E562 VanDerWaalsContact CG2-OE2 3.27Å; E562-S564 PolarHBondContact O-N 3.35Å; E562-S564 VanDerWaalsContact O-N 3.1Å; E562-L565 HydrophobicContact CB-CB 4.47Å; E562-L565 PolarHBondContact O-N 2.75Å; E562-G566 PolarHBondContact O-N 2.91Å; E562-D567 PolarHBondContact N-O 2.86Å; E562-K569 HydrophobicContact CG-CD 4.14Å; E562-K569 HydrophobicContact CG-CG 4.48Å; E562-K569 IonicContact OE1-NZ 3.97Å; E562-K569 PolarHBondContact OE1-NZ 2.88Å
563	P	96.5	Very high	95	Very high	11 Å²	11	37.2 Å²	37.2	7%	0.071	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-26.1	-170.8	-24.9	33.9	0	0	0	114.6	Y384 V478 P479 E481 F561 L565	Y384-P563 WeakPolarHBondContact CE1-O 3.37Å; Y384-P563 VanDerWaalsContact OH-C 3.29Å; Y384-P563 WeakPolarHBondContact OH-CA 3.17Å; Y384-P563 PolarHBondContact OH-O 2.63Å; V478-P563 HydrophobicContact CG1-CB 3.78Å; P479-P563 HydrophobicContact CG-CG 4.39Å; P479-P563 WeakPolarHBondContact O-CB 3.12Å; P479-P563 VanDerWaalsContact O-CG 3.31Å; P479-P563 WeakPolarHBondContact O-CG 3.35Å; E481-P563 WeakPolarHBondContact O-CG 3.46Å; F561-P563 HydrophobicContact CD1-CG 4.11Å; F561-P563 HydrophobicContact CE1-CB 4.14Å; F561-P563 HydrophobicContact CE1-CG 3.92Å; F561-P563 WeakPolarHBondContact O-CD 3.23Å; P563-L565 VanDerWaalsContact C-N 3.27Å; P563-L565 PolarHBondContact O-N 2.7Å
564	S	94.3	Very high	95	Very high	112 Å²	112	38.1 Å²	38.1	78%	0.783	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-20.8	178	56	0	0	0	0	113.7	E562	E562-S564 PolarHBondContact O-N 3.35Å; E562-S564 VanDerWaalsContact O-N 3.1Å
565	L	92	Very high	94.6	Very high	112 Å²	112	40.5 Å²	40.5	59%	0.586	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112	-29.3	-177.3	-59.8	177.8	0	0	0	112.5	E562 P563 D567	E562-L565 HydrophobicContact CB-CB 4.47Å; E562-L565 PolarHBondContact O-N 2.75Å; P563-L565 VanDerWaalsContact C-N 3.27Å; P563-L565 PolarHBondContact O-N 2.7Å; L565-D567 HydrophobicContact CB-CB 4.18Å
566	G	92.3	Very high	93.6	Very high	14 Å²	14	43.1 Å²	43.1	14%	0.144	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	8.6	-169.4	0	0	0	0	0	113.5	Y384 E562	Y384-G566 WeakPolarHBondContact OH-CA 3.45Å; Y384-G566 PolarHBondContact OH-N 3.02Å; E562-G566 PolarHBondContact O-N 2.91Å
567	D	92.2	Very high	91.6	Very high	76 Å²	76	51.4 Å²	51.4	41%	0.406	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	149.3	-178.4	-72.3	-25.9	0	0	0	111.9	F561 E562 L565	F561-D567 WeakPolarHBondContact CA-O 3.28Å; E562-D567 PolarHBondContact N-O 2.86Å; L565-D567 HydrophobicContact CB-CB 4.18Å
568	V	94.7	Very high	91.4	Very high	10 Å²	10	52.9 Å²	52.9	6%	0.061	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	106.4	171.4	-179.5	0	0	0	0	108.3	W377 L406 M470 F559 T560 F561 M570	W377-V568 HydrophobicContact CB-CG2 4.03Å; W377-V568 HydrophobicContact CD2-CB 4.12Å; W377-V568 HydrophobicContact CD2-CG2 4.09Å; W377-V568 HydrophobicContact CG-CB 4.19Å; W377-V568 HydrophobicContact CG-CG2 3.66Å; W377-V568 HydrophobicContact CZ2-CB 4.48Å; L406-V568 HydrophobicContact CD2-CG1 4.13Å; M470-V568 HydrophobicContact SD-CG1 4.33Å; F559-V568 HydrophobicContact CD1-CG1 3.76Å; F559-V568 HydrophobicContact CE1-CG1 4.48Å; T560-V568 WeakPolarHBondContact O-CA 3.17Å; F561-V568 HydrophobicContact CB-CG2 4.38Å; F561-V568 HydrophobicContact CD2-CG2 3.95Å; V568-M570 HydrophobicContact CG1-CE 4.22Å; V568-M570 WeakPolarHBondContact O-CE 2.98Å
569	K	94.3	Very high	91.1	Very high	98 Å²	98	53.8 Å²	53.8	43%	0.426	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	140.2	170.4	-65.8	174.5	-176.7	162.2	0	109.1	F559 T560 E562	F559-K569 WeakPolarHBondContact CA-O 3.43Å; T560-K569 PolarHBondContact N-O 3.34Å; T560-K569 PolarHBondContact O-N 2.83Å; E562-K569 HydrophobicContact CG-CD 4.14Å; E562-K569 HydrophobicContact CG-CG 4.48Å; E562-K569 IonicContact OE1-NZ 3.97Å; E562-K569 PolarHBondContact OE1-NZ 2.88Å
570	M	94.4	Very high	90.8	Very high	8 Å²	8	56.8 Å²	56.8	4%	0.039	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.3	179.2	63.3	-161.5	73.8	0	0	112.4	W377 S447 A450 L502 Y539 S558 F559 V568 F572	W377-M570 HydrophobicContact CH2-CE 3.19Å; W377-M570 HydrophobicContact CH2-SD 4.33Å; W377-M570 HydrophobicContact CZ2-CE 3.56Å; W377-M570 HydrophobicContact CZ3-CE 3.9Å; S447-M570 PolarHBondContact OG-O 2.62Å; A450-M570 HydrophobicContact CB-CE 4.46Å; A450-M570 HydrophobicContact CB-SD 3.96Å; L502-M570 HydrophobicContact CD1-SD 4.44Å; L502-M570 HydrophobicContact CD2-CE 4.23Å; L502-M570 HydrophobicContact CD2-SD 3.78Å; Y539-M570 HydrophobicContact CD2-CG 3.93Å; Y539-M570 HydrophobicContact CD2-SD 4.07Å; Y539-M570 HydrophobicContact CE2-CG 4.15Å; S558-M570 CarbonylContact O-C 3.26Å; S558-M570 VanDerWaalsContact O-CA 3.31Å; S558-M570 WeakPolarHBondContact O-CA 3.47Å; F559-M570 HydrophobicContact CD1-CB 3.63Å; F559-M570 HydrophobicContact CE1-CB 3.48Å; F559-M570 VanDerWaalsContact CE1-CB 3.48Å; F559-M570 HydrophobicContact CE1-CE 4.22Å; F559-M570 HydrophobicContact CE1-CG 4.42Å; F559-M570 HydrophobicContact CE1-SD 4.13Å; F559-M570 HydrophobicContact CZ-CB 4.34Å; V568-M570 HydrophobicContact CG1-CE 4.22Å; V568-M570 WeakPolarHBondContact O-CE 2.98Å; M570-F572 HydrophobicContact CB-CE2 4.21Å; M570-F572 HydrophobicContact CG-CE2 4.15Å; M570-F572 HydrophobicContact SD-CE2 4.08Å
571	D	93.6	Very high	90.4	Very high	88 Å²	88	58.3 Å²	58.3	47%	0.471	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.2	169.1	-171.3	-96.7	0	0	0	109.4	Y557 S558	Y557-D571 WeakPolarHBondContact CA-O 3.34Å; S558-D571 PolarHBondContact N-O 3.13Å; S558-D571 PolarHBondContact O-N 2.92Å
572	F	93.9	Very high	90	Very high	13 Å²	13	61.9 Å²	61.9	6%	0.057	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.3	176.4	-65.6	-84.6	0	0	0	110	V500 L502 Y539 L541 V555 S556 F559 M570	V500-F572 HydrophobicContact CB-CD1 4.38Å; V500-F572 HydrophobicContact CB-CE1 3.95Å; V500-F572 HydrophobicContact CB-CE2 4.29Å; V500-F572 HydrophobicContact CB-CZ 3.84Å; V500-F572 HydrophobicContact CG1-CE1 3.68Å; V500-F572 HydrophobicContact CG1-CZ 3.64Å; V500-F572 HydrophobicContact CG2-CD1 3.78Å; V500-F572 HydrophobicContact CG2-CE1 3.78Å; V500-F572 HydrophobicContact CG2-CG 4.15Å; V500-F572 HydrophobicContact CG2-CZ 4.15Å; L502-F572 HydrophobicContact CD2-CZ 4.22Å; Y539-F572 HydrophobicContact CD1-CB 4.21Å; Y539-F572 AromaticContact CD1-CD2 3.48Å; Y539-F572 HydrophobicContact CD1-CD2 3.48Å; Y539-F572 VanDerWaalsContact CD1-CD2 3.48Å; Y539-F572 HydrophobicContact CD1-CE2 4.17Å; Y539-F572 HydrophobicContact CD1-CG 4.2Å; Y539-F572 AromaticContact CD2-CD2 3.8Å; Y539-F572 HydrophobicContact CD2-CD2 3.8Å; Y539-F572 HydrophobicContact CD2-CE2 4.02Å; Y539-F572 HydrophobicContact CE1-CB 4.01Å; Y539-F572 AromaticContact CE1-CD2 3.83Å; Y539-F572 HydrophobicContact CE1-CD2 3.83Å; Y539-F572 HydrophobicContact CE1-CG 4.39Å; Y539-F572 HydrophobicContact CE2-CD2 4.09Å; Y539-F572 AromaticContact CG-CD2 3.47Å; Y539-F572 HydrophobicContact CG-CD2 3.47Å; Y539-F572 VanDerWaalsContact CG-CD2 3.47Å; Y539-F572 AromaticContact CG-CE2 3.73Å; Y539-F572 HydrophobicContact CG-CE2 3.73Å; L541-F572 HydrophobicContact CD2-CB 4.24Å; V555-F572 HydrophobicContact CG1-CB 4.11Å; V555-F572 HydrophobicContact CG1-CD1 3.76Å; V555-F572 HydrophobicContact CG1-CG 4.38Å; S556-F572 WeakPolarHBondContact O-CA 3.35Å; F559-F572 HydrophobicContact CE1-CZ 4.25Å; F559-F572 HydrophobicContact CE2-CE1 4.27Å; F559-F572 HydrophobicContact CE2-CZ 4.15Å; F559-F572 HydrophobicContact CZ-CE1 4.03Å; F559-F572 HydrophobicContact CZ-CE2 4.18Å; F559-F572 AromaticContact CZ-CZ 3.46Å; F559-F572 HydrophobicContact CZ-CZ 3.46Å; F559-F572 VanDerWaalsContact CZ-CZ 3.46Å; M570-F572 HydrophobicContact CB-CE2 4.21Å; M570-F572 HydrophobicContact CG-CE2 4.15Å; M570-F572 HydrophobicContact SD-CE2 4.08Å
573	S	92.7	Very high	89.5	Confident	50 Å²	50	63.8 Å²	63.8	35%	0.35	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151	174.8	56.5	0	0	0	0	110.7	V555 S556	V555-S573 CarbonylContact C-O 3.53Å; S556-S573 PolarHBondContact N-O 3.41Å; S556-S573 PolarHBondContact O-N 2.98Å
574	I	92.9	Very high	89	Confident	49 Å²	49	67.6 Å²	67.6	25%	0.251	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.8	173.4	-56.6	-59.9	0	0	0	108.8	F491 L541 W545 V555	F491-I574 HydrophobicContact CE2-CD1 4.21Å; F491-I574 HydrophobicContact CZ-CD1 3.98Å; L541-I574 HydrophobicContact CD1-CD1 4.02Å; W545-I574 HydrophobicContact CB-CD1 4.06Å; W545-I574 HydrophobicContact CB-CG1 3.98Å; W545-I574 HydrophobicContact CD2-CB 4.34Å; W545-I574 HydrophobicContact CD2-CG1 4.18Å; W545-I574 HydrophobicContact CD2-CG2 3.63Å; W545-I574 HydrophobicContact CE3-CB 4.36Å; W545-I574 HydrophobicContact CE3-CG1 4.33Å; W545-I574 HydrophobicContact CE3-CG2 3.96Å; W545-I574 HydrophobicContact CG-CD1 4.17Å; W545-I574 HydrophobicContact CG-CG1 4.02Å; W545-I574 HydrophobicContact CG-CG2 4.01Å; W545-I574 HydrophobicContact CH2-CG2 4.27Å; W545-I574 HydrophobicContact CZ2-CG2 3.97Å; W545-I574 HydrophobicContact CZ3-CG2 4.27Å; V555-I574 HydrophobicContact CG2-CD1 3.88Å
575	T	88.4	Confident	88.6	Confident	51 Å²	51	64.2 Å²	64.2	31%	0.313	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.4	174.1	57.3	0	0	0	0	110.3	L488 T553 G554	L488-T575 VanDerWaalsContact CD1-OG1 3.23Å; L488-T575 WeakPolarHBondContact CD1-OG1 3.23Å; T553-T575 WeakPolarHBondContact CA-O 3.31Å; G554-T575 PolarHBondContact N-O 3.44Å; G554-T575 PolarHBondContact O-N 3.1Å
576	G	76.1	Confident	88.3	Confident	54 Å²	54	60.2 Å²	60.2	56%	0.557	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	149.2	169	0	0	0	0	0	109.9
577	H	54.6	Low	88	Confident	211 Å²	211	64.4 Å²	64.4	98%	0.977	36%	0.355	S	S	*	.			trans	-70.4	0	166.7	-81	-57.3	0	0	0	112.8	R552	R552-H577 PolarHBondContact O-N 3.39Å

Retrieved 577 of 577 residues in 428.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).