A0A087Y3B4_POEFO Loading...

tRNA-splicing endonuclease subunit Sen2

Constitutes one of the two catalytic subunit of the tRNA-splicing endonuclease complex, a complex responsible for identification and cleavage of the splice sites in pre-tRNA. It cleaves pre-tRNA at the 5'- and 3'-splice sites to release the intron. The products are an intron and two tRNA half-molecules bearing 2',3'-cyclic phosphate and 5'-OH termini. There are no conserved sequences at the splice sites, but the intron is invariably located at the same site in the gene, placing the splice sites an invariant distance from the constant structural features of the tRNA body.

AlphaFold DB , UniProt , Accession A0A087Y3B4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 390 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	M	36.6	Very low	51.8	Low	233 Å²	233	133.7 Å²	133.7	100%	1.148	59%	0.591	S	S	*	*				0	123.1	0	-88.8	-173.9	-97.9	0	0	108
2	Q	40.6	Very low	52	Low	146 Å²	146	125.3 Å²	125.3	68%	0.682	56%	0.558	S	S	*	*			trans	-73.4	138.1	173	-166	168.4	-3.4	0	0	108.2	E4 R275	Q2-E4 PolarHBondContact O-N 3.15Å; Q2-R275 VanDerWaalsContact NE2-NH2 3.1Å
3	A	47.1	Very low	52.1	Low	14 Å²	14	131.8 Å²	131.8	12%	0.116	58%	0.577	C	S	.	*			trans	-65.7	123.7	-176.7	0	0	0	0	0	110.9	F5 M344 E372 I374	A3-F5 HydrophobicContact CB-CE2 4.26Å; A3-F5 VanDerWaalsContact O-CD2 3.25Å; A3-F5 WeakPolarHBondContact O-CD2 3.44Å; A3-F5 WeakPolarHBondContact O-CE2 3.48Å; A3-F5 PolarHBondContact O-N 2.82Å; A3-M344 HydrophobicContact CB-CE 4.21Å; A3-E372 HydrophobicContact CB-CB 3.87Å; A3-I374 HydrophobicContact CB-CD1 3.79Å; A3-I374 HydrophobicContact CB-CG1 3.85Å
4	E	53.6	Low	52.4	Low	134 Å²	134	126.2 Å²	126.2	63%	0.626	56%	0.558	S	S	*	*			trans	-75.7	114.6	168.3	-76.5	-171.1	169.6	0	0	110	Q2 R6	Q2-E4 PolarHBondContact O-N 3.15Å; E4-R6 PolarHBondContact O-N 3.4Å; E4-R6 IonicContact OE2-NH2 3.33Å; E4-R6 PolarHBondContact OE2-NH2 2.96Å
5	F	65.2	Low	52.6	Low	54 Å²	54	130.9 Å²	130.9	24%	0.237	57%	0.573	C	S	.	*			trans	-78	115.3	-179.1	-77.6	-84	0	0	0	111	A3 F272 W277 L293 Y305 M344 E372	A3-F5 HydrophobicContact CB-CE2 4.26Å; A3-F5 VanDerWaalsContact O-CD2 3.25Å; A3-F5 WeakPolarHBondContact O-CD2 3.44Å; A3-F5 WeakPolarHBondContact O-CE2 3.48Å; A3-F5 PolarHBondContact O-N 2.82Å; F5-F272 HydrophobicContact CE1-CD1 4.49Å; F5-F272 HydrophobicContact CE1-CE1 4.29Å; F5-F272 HydrophobicContact CZ-CD1 4.5Å; F5-F272 HydrophobicContact CZ-CE1 4.12Å; F5-W277 HydrophobicContact CB-CZ2 3.89Å; F5-W277 HydrophobicContact CD1-CD2 4.46Å; F5-W277 AromaticContact CD1-CE2 3.42Å; F5-W277 VanDerWaalsContact CD1-CE2 3.42Å; F5-W277 AromaticContact CD1-CZ2 3.52Å; F5-W277 HydrophobicContact CD1-CZ2 3.52Å; F5-W277 AromaticContact CD1-NE1 3.16Å; F5-W277 AromaticContact CE1-NE1 3.69Å; F5-W277 HydrophobicContact CG-CZ2 4.12Å; F5-W277 AromaticContact CG-NE1 3.65Å; F5-L293 HydrophobicContact CE1-CD1 4.47Å; F5-Y305 HydrophobicContact CD1-CD2 4.44Å; F5-Y305 AromaticContact CD1-CE2 3.82Å; F5-Y305 HydrophobicContact CD1-CE2 3.82Å; F5-Y305 HydrophobicContact CE1-CE2 4.34Å; F5-M344 HydrophobicContact CD1-CE 4.43Å; F5-M344 HydrophobicContact CE1-CE 3.62Å; F5-M344 HydrophobicContact CE1-SD 4.36Å; F5-M344 HydrophobicContact CZ-CE 3.84Å; F5-M344 HydrophobicContact CZ-SD 4.39Å; F5-E372 WeakPolarHBondContact CE2-OE1 3.3Å; F5-E372 HydrophobicContact CZ-CG 4.5Å; F5-E372 WeakPolarHBondContact CZ-OE1 3.23Å
6	R	61.4	Low	53.5	Low	155 Å²	155	125.1 Å²	125.1	59%	0.585	55%	0.548	S	S	*	.			trans	-107.2	141.1	-179.9	-64.6	-176.4	-177.2	179.8	1.8	111.6	E4 Y305	E4-R6 PolarHBondContact O-N 3.4Å; E4-R6 IonicContact OE2-NH2 3.33Å; E4-R6 PolarHBondContact OE2-NH2 2.96Å; R6-Y305 PolarHBondContact N-OH 3.11Å
7	P	50.7	Low	54.1	Low	97 Å²	97	126.6 Å²	126.6	63%	0.63	56%	0.563	S	S	*	*			trans	-65.4	150.3	173.3	27.6	-32.5	0	0	0	110.5
8	P	56.5	Low	54.8	Low	27 Å²	27	125.7 Å²	125.7	18%	0.175	56%	0.556	C	S	.	*			trans	-63.7	145.8	-176	22.3	-29.6	0	0	0	112.2	R10 Y301 S304	P8-R10 VanDerWaalsContact C-N 3.26Å; P8-R10 PolarHBondContact O-N 2.84Å; P8-Y301 HydrophobicContact CG-CD1 3.46Å; P8-Y301 VanDerWaalsContact CG-CD1 3.46Å; P8-Y301 HydrophobicContact CG-CE1 4.2Å; P8-Y301 HydrophobicContact CG-CG 3.84Å; P8-S304 WeakPolarHBondContact CB-OG 3.23Å; P8-S304 WeakPolarHBondContact CD-OG 3.49Å
9	R	53.8	Low	55.6	Low	213 Å²	213	125 Å²	125	80%	0.804	55%	0.552	S	S	*	*	S	Bend	trans	-68.6	-15.3	-175.6	-64.6	-175.4	179.3	-160.6	-3.2	115
10	R	54.3	Low	55.8	Low	205 Å²	205	122.2 Å²	122.2	77%	0.774	55%	0.553	S	S	*	*			trans	-136.7	130.5	-177.8	-68.6	-174.7	179	-177.7	-0.3	110.7	P8	P8-R10 VanDerWaalsContact C-N 3.26Å; P8-R10 PolarHBondContact O-N 2.84Å
11	R	50	Low	56.6	Low	193 Å²	193	120.1 Å²	120.1	73%	0.728	55%	0.551	S	S	*	*	B	Isolated β-bridge	trans	-89.7	131.2	174.4	-168.5	176.2	177.6	-178.5	-2.3	108.7	Y301	R11-Y301 HydrophobicContact CB-CE1 4.44Å; R11-Y301 HydrophobicContact CG-CE1 4.13Å
12	T	54.3	Low	57.8	Low	32 Å²	32	109.7 Å²	109.7	20%	0.196	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-73	155.3	169.7	33.5	0	0	0	0	110	V14 P299 F300 Y301 H302	T12-V14 PolarHBondContact O-N 3.43Å; T12-P299 PolarHBondContact OG1-O 3.25Å; T12-F300 PolarHBondContact OG1-O 3.1Å; T12-Y301 PolarHBondContact OG1-N 2.99Å; T12-H302 VanDerWaalsContact CG2-CE1 3.48Å; T12-H302 WeakPolarHBondContact CG2-CE1 3.29Å; T12-H302 VanDerWaalsContact CG2-NE2 3.26Å; T12-H302 WeakPolarHBondContact CG2-NE2 3.28Å
13	R	53.3	Low	58.6	Low	211 Å²	211	106.9 Å²	106.9	80%	0.796	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-63.4	119.4	163.1	-74.5	-176	179.1	178.3	-0.4	106.9	Y15	R13-Y15 HydrophobicContact CB-CE2 4.09Å; R13-Y15 WeakPolarHBondContact O-CD2 3.43Å
14	V	55.8	Low	59	Low	53 Å²	53	112.4 Å²	112.4	32%	0.321	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-90.7	127.4	-175.2	179.6	0	0	0	0	107.9	T12 E16 F300	T12-V14 PolarHBondContact O-N 3.43Å; V14-E16 WeakPolarHBondContact CG1-O 3.41Å; V14-F300 HydrophobicContact CB-CD1 4.43Å; V14-F300 HydrophobicContact CG1-CD1 3.47Å; V14-F300 VanDerWaalsContact CG1-CD1 3.47Å; V14-F300 HydrophobicContact CG1-CE1 3.51Å; V14-F300 HydrophobicContact CG2-CD1 4.07Å
15	Y	55.9	Low	59.1	Low	197 Å²	197	108.7 Å²	108.7	77%	0.773	51%	0.505	S	S	*	.			trans	-111.8	4.1	175.9	-60.4	-81.6	0	0	0	112.5	R13	R13-Y15 HydrophobicContact CB-CE2 4.09Å; R13-Y15 WeakPolarHBondContact O-CD2 3.43Å
16	E	66	Low	58.5	Low	38 Å²	38	117.5 Å²	117.5	18%	0.178	54%	0.537	C	S	.	.	S	Bend	trans	-125.2	145.5	-176	-67.7	-177.8	-167.6	0	0	111.5	V14 Y59 P299 F300	V14-E16 WeakPolarHBondContact CG1-O 3.41Å; E16-Y59 PolarHBondContact OE2-OH 3Å; E16-P299 HydrophobicContact CG-CB 4.29Å; E16-P299 VanDerWaalsContact OE2-CG 3.31Å; E16-P299 WeakPolarHBondContact OE2-CG 3.34Å; E16-F300 HydrophobicContact CB-CE1 4.49Å; E16-F300 HydrophobicContact CB-CZ 4.37Å; E16-F300 VanDerWaalsContact O-CE1 3.24Å; E16-F300 WeakPolarHBondContact O-CE1 3.47Å
17	D	63.6	Low	58.1	Low	151 Å²	151	116 Å²	116	81%	0.807	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-80.9	131.5	171.5	-68.6	-36.3	0	0	0	110.8	K19	D17-K19 PolarHBondContact O-N 3.07Å
18	Y	68.4	Low	58.4	Low	110 Å²	110	120.9 Å²	120.9	43%	0.431	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-70.9	116.4	178.2	179	-98.9	0	0	0	110.7	P21 K296 F300	Y18-P21 WeakPolarHBondContact OH-CD 3.38Å; Y18-K296 HydrophobicContact CD2-CB 4.36Å; Y18-K296 HydrophobicContact CD2-CD 3.93Å; Y18-K296 HydrophobicContact CE2-CB 4.11Å; Y18-K296 HydrophobicContact CE2-CD 3.94Å; Y18-K296 HydrophobicContact CE2-CG 4.19Å; Y18-F300 HydrophobicContact CD2-CD2 4.26Å; Y18-F300 AromaticContact CD2-CE2 3.66Å; Y18-F300 HydrophobicContact CD2-CE2 3.66Å; Y18-F300 AromaticContact CD2-CZ 3.99Å; Y18-F300 HydrophobicContact CD2-CZ 3.99Å; Y18-F300 HydrophobicContact CG-CE2 4.48Å; Y18-F300 HydrophobicContact CG-CZ 4.38Å
19	K	68.4	Low	58.3	Low	112 Å²	112	128.7 Å²	128.7	49%	0.487	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-91.2	142	167	-59.7	-163.9	-174	177.7	0	110.1	D17 N56	D17-K19 PolarHBondContact O-N 3.07Å; K19-N56 HydrophobicContact CD-CB 3.94Å
20	A	61.3	Low	58.5	Low	68 Å²	68	125.6 Å²	125.6	56%	0.562	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-58.1	147.6	175.7	0	0	0	0	0	110.4
21	P	71.6	Confident	59.1	Low	79 Å²	79	120.5 Å²	120.5	51%	0.513	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-58.1	154.9	175.8	-19.6	32	0	0	0	111.3	Y18 Q57	Y18-P21 WeakPolarHBondContact OH-CD 3.38Å; P21-Q57 CarbonylContact C-O 3.59Å; P21-Q57 VanDerWaalsContact CA-O 3.32Å; P21-Q57 WeakPolarHBondContact CA-O 3.29Å
22	L	62.4	Low	60.3	Low	14 Å²	14	118 Å²	118	7%	0.073	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-46.9	127.1	173.1	-80.9	163.4	0	0	0	109.2	L24 Y34 Q57 F60 L230 L234 V236	L22-L24 PolarHBondContact O-N 3.27Å; L22-Y34 HydrophobicContact CD2-CE2 4Å; L22-Q57 HydrophobicContact CB-CB 4.48Å; L22-Q57 HydrophobicContact CD2-CB 4.01Å; L22-Q57 HydrophobicContact CG-CB 3.65Å; L22-Q57 PolarHBondContact N-O 3.02Å; L22-F60 HydrophobicContact CD1-CD2 4.24Å; L22-F60 HydrophobicContact CD1-CE2 3.92Å; L22-L230 HydrophobicContact CD1-CD2 3.55Å; L22-L234 HydrophobicContact CB-CD1 3.97Å; L22-L234 HydrophobicContact CD1-CD1 3.94Å; L22-V236 HydrophobicContact CD1-CG2 4.23Å
23	P	56.8	Low	61.8	Low	88 Å²	88	120.7 Å²	120.7	57%	0.571	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-61	135.6	-175.7	24.1	-32.5	0	0	0	109.7	I25	P23-I25 PolarHBondContact O-N 2.79Å; P23-I25 VanDerWaalsContact O-N 3.13Å
24	L	55.1	Low	63.5	Low	130 Å²	130	111.1 Å²	111.1	68%	0.681	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-60.7	117.4	160.3	-67.3	173.3	0	0	0	106.3	L22 R26 L234	L22-L24 PolarHBondContact O-N 3.27Å; L24-R26 PolarHBondContact O-N 2.96Å; L24-L234 HydrophobicContact CD2-CD2 3.89Å
25	I	56.3	Low	65.2	Low	56 Å²	56	113.2 Å²	113.2	29%	0.287	53%	0.531	S	S	.	.			trans	-57.9	113.3	-172.8	-60.4	-177.7	0	0	0	109.4	P23 R31 L234 G235 V236	P23-I25 PolarHBondContact O-N 2.79Å; P23-I25 VanDerWaalsContact O-N 3.13Å; I25-R31 HydrophobicContact CD1-CG 4.37Å; I25-R31 HydrophobicContact CG2-CG 4.42Å; I25-L234 WeakPolarHBondContact CD1-O 3.27Å; I25-L234 VanDerWaalsContact CG1-O 3.28Å; I25-L234 WeakPolarHBondContact CG1-O 3.5Å; I25-G235 WeakPolarHBondContact CD1-O 3.35Å; I25-V236 HydrophobicContact CD1-CG1 4.09Å; I25-V236 HydrophobicContact CG1-CG1 4.45Å
26	R	51.3	Low	67	Low	239 Å²	239	103.9 Å²	103.9	90%	0.902	50%	0.495	S	S	*	.			trans	-99.3	-34.7	170.1	-70.8	-174.4	177.1	-173.1	-0.9	112.4	L24	L24-R26 PolarHBondContact O-N 2.96Å
27	N	53.9	Low	68.2	Low	123 Å²	123	105.1 Å²	105.1	66%	0.658	50%	0.501	S	S	*	.			trans	-123.8	139.6	177.6	-80.3	-14.3	0	0	0	111.9
28	R	57.1	Low	69.5	Low	200 Å²	200	98.8 Å²	98.8	76%	0.755	47%	0.467	S	S	*	.	S	Bend	trans	-77.9	-17.1	-178	-78.5	-170.6	172.9	-171.6	-1.1	114.4	R31	R28-R31 VanDerWaalsContact O-CD 3.29Å; R28-R31 WeakPolarHBondContact O-CD 3.43Å; R28-R31 VanDerWaalsContact O-CG 3.29Å; R28-R31 WeakPolarHBondContact O-CG 3.3Å
29	Q	54.7	Low	70.5	Confident	191 Å²	191	96 Å²	96	89%	0.893	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-25.6	-169.7	-72.1	171.7	-21.6	0	0	114.2	R31	Q29-R31 VanDerWaalsContact C-N 3.34Å; Q29-R31 PolarHBondContact O-N 3.48Å
30	D	58.4	Low	71.3	Confident	148 Å²	148	98.2 Å²	98.2	79%	0.791	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	23.5	175.5	-73.6	-35.8	0	0	0	113.9	K32	D30-K32 PolarHBondContact O-N 3.02Å; D30-K32 VanDerWaalsContact O-N 3.08Å
31	R	65.8	Low	72.6	Confident	97 Å²	97	100.5 Å²	100.5	37%	0.366	47%	0.472	S	S	.	.			trans	-73.5	104.4	-172	-81.2	179.6	159.3	-163	-14.3	111.6	I25 R28 Q29 H33	I25-R31 HydrophobicContact CD1-CG 4.37Å; I25-R31 HydrophobicContact CG2-CG 4.42Å; R28-R31 VanDerWaalsContact O-CD 3.29Å; R28-R31 WeakPolarHBondContact O-CD 3.43Å; R28-R31 VanDerWaalsContact O-CG 3.29Å; R28-R31 WeakPolarHBondContact O-CG 3.3Å; Q29-R31 VanDerWaalsContact C-N 3.34Å; Q29-R31 PolarHBondContact O-N 3.48Å; R31-H33 PolarHBondContact O-N 3.4Å; R31-H33 VanDerWaalsContact O-N 3.16Å
32	K	74.7	Confident	73.5	Confident	140 Å²	140	99.5 Å²	99.5	61%	0.609	46%	0.46	S	S	*	.			trans	-66.6	110.7	156.9	-66	-173.2	-179.8	-175.3	0	108.2	D30 Y34	D30-K32 PolarHBondContact O-N 3.02Å; D30-K32 VanDerWaalsContact O-N 3.08Å; K32-Y34 HydrophobicContact CB-CE1 4.22Å
33	H	85.9	Confident	75	Confident	89 Å²	89	98.8 Å²	98.8	41%	0.412	46%	0.457	S	S	.	.			trans	-101.7	127.6	175.9	-117.9	61.9	0	0	0	109.4	R31 G235	R31-H33 PolarHBondContact O-N 3.4Å; R31-H33 VanDerWaalsContact O-N 3.16Å; H33-G235 PolarHBondContact CE1-O 2.77Å; H33-G235 VanDerWaalsContact CE1-O 3.29Å
34	Y	90.8	Very high	76.7	Confident	10 Å²	10	96 Å²	96	4%	0.039	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	149.5	-180	-50.8	-63.7	0	0	0	110.4	L22 K32 H50 S53 I54 V236 L237 S238	L22-Y34 HydrophobicContact CD2-CE2 4Å; K32-Y34 HydrophobicContact CB-CE1 4.22Å; Y34-H50 HydrophobicContact CD1-CB 3.77Å; Y34-H50 AromaticContact CD1-CD2 3.58Å; Y34-H50 AromaticContact CD1-CG 3.61Å; Y34-H50 HydrophobicContact CG-CB 4.44Å; Y34-S53 WeakPolarHBondContact OH-CB 3.32Å; Y34-S53 PolarHBondContact OH-OG 3.45Å; Y34-I54 HydrophobicContact CD1-CD1 4.23Å; Y34-I54 HydrophobicContact CD1-CG1 4.2Å; Y34-I54 HydrophobicContact CD2-CD1 3.88Å; Y34-I54 HydrophobicContact CD2-CG1 3.65Å; Y34-I54 HydrophobicContact CE1-CG1 4.41Å; Y34-I54 HydrophobicContact CE2-CG1 3.91Å; Y34-I54 HydrophobicContact CG-CD1 3.67Å; Y34-I54 HydrophobicContact CG-CG1 3.82Å; Y34-V236 HydrophobicContact CD2-CB 3.9Å; Y34-V236 HydrophobicContact CD2-CG2 3.96Å; Y34-V236 VanDerWaalsContact CD2-O 3.31Å; Y34-V236 WeakPolarHBondContact CD2-O 3.3Å; Y34-V236 HydrophobicContact CE2-CB 3.97Å; Y34-V236 HydrophobicContact CE2-CG2 4.1Å; Y34-V236 PolarHBondContact N-O 3.05Å; Y34-L237 CarbonylContact O-C 3.58Å; Y34-L237 WeakPolarHBondContact O-CA 3.49Å; Y34-S238 PolarHBondContact O-N 2.89Å
35	R	91.4	Very high	78.3	Confident	98 Å²	98	89.9 Å²	89.9	37%	0.37	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.1	175.6	178.4	173.4	171.3	171.7	-1.5	110.1	E37 H50 Y240	R35-E37 IonicContact CZ-OE1 3.82Å; R35-E37 IonicContact NE-OE1 3.13Å; R35-E37 IonicContact NH2-OE1 2.87Å; R35-E37 PolarHBondContact NH2-OE1 3Å; R35-H50 PolarHBondContact N-ND1 3.38Å; R35-Y240 HydrophobicContact CG-CD2 3.78Å; R35-Y240 HydrophobicContact CG-CE2 3.79Å
36	G	92	Very high	79.7	Confident	1 Å²	1	89.6 Å²	89.6	1%	0.01	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	155.2	169	0	0	0	0	0	111.6	L44 S238 V239 Y240	G36-L44 CarbonylContact C-O 3.58Å; G36-L44 WeakPolarHBondContact CA-O 3.5Å; G36-S238 PolarHBondContact N-O 2.86Å; G36-V239 CarbonylContact O-C 3.55Å; G36-V239 WeakPolarHBondContact O-CA 3.21Å; G36-Y240 PolarHBondContact O-N 3.39Å
37	E	91.9	Very high	81.2	Confident	63 Å²	63	82.6 Å²	82.6	29%	0.294	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.6	179.9	-61.5	-167.5	162.4	0	0	109.9	R35 V39 V43 L44 Y240	R35-E37 IonicContact CZ-OE1 3.82Å; R35-E37 IonicContact NE-OE1 3.13Å; R35-E37 IonicContact NH2-OE1 2.87Å; R35-E37 PolarHBondContact NH2-OE1 3Å; E37-V39 PolarHBondContact O-N 3.35Å; E37-V43 CarbonylContact O-C 2.89Å; E37-V43 WeakPolarHBondContact O-CA 3.38Å; E37-L44 PolarHBondContact N-O 3.23Å; E37-L44 PolarHBondContact O-N 3.14Å; E37-Y240 WeakPolarHBondContact CA-O 3.26Å
38	L	91.7	Very high	82.5	Confident	18 Å²	18	80.4 Å²	80.4	9%	0.094	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	115	176.9	179	59.1	0	0	0	109.5	V43 V239 Y240 L246 T254 F255 L258	L38-V43 HydrophobicContact CD1-CG2 3.99Å; L38-V239 HydrophobicContact CB-CG1 3.83Å; L38-Y240 PolarHBondContact N-O 2.95Å; L38-L246 HydrophobicContact CD2-CD1 4.05Å; L38-T254 HydrophobicContact CD2-CG2 3.58Å; L38-F255 HydrophobicContact CD1-CE1 3.78Å; L38-F255 HydrophobicContact CD2-CE1 4.15Å; L38-L258 HydrophobicContact CD1-CD1 4.39Å
39	V	87.9	Confident	83.6	Confident	51 Å²	51	75.8 Å²	75.8	31%	0.309	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	112.2	179.4	179.2	0	0	0	0	108.4	E37 Q41 Q42 L44	E37-V39 PolarHBondContact O-N 3.35Å; V39-Q41 PolarHBondContact O-N 2.92Å; V39-Q42 CarbonylContact C-O 3.46Å; V39-Q42 PolarHBondContact N-O 3.49Å; V39-Q42 WeakPolarHBondContact O-CG 3.48Å; V39-Q42 PolarHBondContact O-N 3Å; V39-L44 HydrophobicContact CB-CD1 4Å; V39-L44 HydrophobicContact CB-CG 4.26Å; V39-L44 HydrophobicContact CG1-CD1 4.39Å; V39-L44 HydrophobicContact CG2-CD1 3.9Å; V39-L44 HydrophobicContact CG2-CG 4.3Å
40	H	85.4	Confident	85.2	Confident	160 Å²	160	68.5 Å²	68.5	74%	0.741	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	-115.6	-174.3	-57.3	89.9	0	0	0	112.9	L258	H40-L258 VanDerWaalsContact O-CD1 3.3Å; H40-L258 WeakPolarHBondContact O-CD1 3.42Å
41	Q	88.6	Confident	86.5	Confident	115 Å²	115	61.7 Å²	61.7	54%	0.537	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	23.9	-179.1	-62.4	-169.4	3.4	0	0	113	V39 L224 L258	V39-Q41 PolarHBondContact O-N 2.92Å; Q41-L224 WeakPolarHBondContact O-CD2 3.19Å; Q41-L258 HydrophobicContact CG-CB 4.39Å; Q41-L258 HydrophobicContact CG-CD2 4.28Å; Q41-L258 PolarHBondContact NE2-O 3.04Å
42	Q	91.6	Very high	87.4	Confident	58 Å²	58	61.4 Å²	61.4	27%	0.271	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.8	-178.6	55.8	-176.9	-10.3	0	0	111.4	V39 L44 Q221	V39-Q42 CarbonylContact C-O 3.46Å; V39-Q42 PolarHBondContact N-O 3.49Å; V39-Q42 WeakPolarHBondContact O-CG 3.48Å; V39-Q42 PolarHBondContact O-N 3Å; Q42-L44 HydrophobicContact CG-CD2 4.12Å; Q42-Q221 VanDerWaalsContact OE1-CG 3.31Å
43	V	93.4	Very high	87.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.3	173.1	177.1	0	0	0	0	108.8	E37 L38 L222 A227 L237 V239 F255	E37-V43 CarbonylContact O-C 2.89Å; E37-V43 WeakPolarHBondContact O-CA 3.38Å; L38-V43 HydrophobicContact CD1-CG2 3.99Å; V43-L222 HydrophobicContact CB-CB 4.26Å; V43-L222 HydrophobicContact CG1-CD1 4.38Å; V43-L222 PolarHBondContact N-O 2.64Å; V43-L222 VanDerWaalsContact N-O 3.12Å; V43-L222 WeakPolarHBondContact O-CB 3.38Å; V43-L222 PolarHBondContact O-N 3.14Å; V43-A227 HydrophobicContact CB-CB 3.83Å; V43-A227 HydrophobicContact CG1-CB 4.38Å; V43-A227 HydrophobicContact CG2-CB 3.61Å; V43-L237 HydrophobicContact CG1-CD2 4.48Å; V43-V239 HydrophobicContact CG1-CG1 4.23Å; V43-V239 HydrophobicContact CG1-CG2 4.07Å; V43-V239 HydrophobicContact CG2-CG1 4Å; V43-V239 HydrophobicContact CG2-CG2 4.35Å; V43-F255 HydrophobicContact CG2-CE1 4.44Å; V43-F255 HydrophobicContact CG2-CZ 3.88Å
44	L	91.9	Very high	88.1	Confident	30 Å²	30	51.3 Å²	51.3	16%	0.157	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.9	-178.8	-55.6	-175.3	0	0	0	110.2	G36 E37 V39 Q42 Q221	G36-L44 CarbonylContact C-O 3.58Å; G36-L44 WeakPolarHBondContact CA-O 3.5Å; E37-L44 PolarHBondContact N-O 3.23Å; E37-L44 PolarHBondContact O-N 3.14Å; V39-L44 HydrophobicContact CB-CD1 4Å; V39-L44 HydrophobicContact CB-CG 4.26Å; V39-L44 HydrophobicContact CG1-CD1 4.39Å; V39-L44 HydrophobicContact CG2-CD1 3.9Å; V39-L44 HydrophobicContact CG2-CG 4.3Å; Q42-L44 HydrophobicContact CG-CD2 4.12Å; L44-Q221 HydrophobicContact CD2-CB 4.42Å; L44-Q221 HydrophobicContact CD2-CG 3.6Å
45	V	89.6	Confident	87.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.6	168.6	179.4	0	0	0	0	107.9	H50 I51 I54 L220 L222 L237	V45-H50 HydrophobicContact CG1-CB 3.44Å; V45-H50 VanDerWaalsContact CG1-CB 3.44Å; V45-I51 HydrophobicContact CB-CG1 4.44Å; V45-I51 HydrophobicContact CG1-CG1 4.06Å; V45-I51 WeakPolarHBondContact O-CD1 3.41Å; V45-I51 WeakPolarHBondContact O-CG1 3.34Å; V45-I54 HydrophobicContact CG1-CD1 4.23Å; V45-I54 HydrophobicContact CG2-CD1 4.08Å; V45-L220 HydrophobicContact CB-CB 4.2Å; V45-L220 PolarHBondContact N-O 2.97Å; V45-L220 PolarHBondContact O-N 3.37Å; V45-L222 HydrophobicContact CG2-CD1 3.75Å; V45-L222 HydrophobicContact CG2-CG 4.38Å; V45-L237 HydrophobicContact CG2-CD1 4.38Å
46	C	85.4	Confident	87.6	Confident	51 Å²	51	47.1 Å²	47.1	35%	0.345	24%	0.242	S	C	.	.			trans	-100.1	-25.4	-172.6	-44.8	0	0	0	0	113.1	Y219	C46-Y219 HydrophobicContact CB-CD1 3.64Å; C46-Y219 HydrophobicContact CB-CE1 3.67Å; C46-Y219 WeakPolarHBondContact SG-CD1 3.44Å; C46-Y219 VanDerWaalsContact SG-CE1 3.54Å
47	H	82.8	Confident	87.2	Confident	92 Å²	92	49 Å²	49	43%	0.426	25%	0.25	S	S	.	.			trans	-75.9	125.1	-175.2	-163	-73.1	0	0	0	110.7	D49 H50 I51	H47-D49 VanDerWaalsContact C-N 3.34Å; H47-D49 IonicContact CE1-OD2 3.35Å; H47-D49 PolarHBondContact CE1-OD2 3.02Å; H47-D49 PolarHBondContact ND1-N 3.2Å; H47-D49 IonicContact ND1-OD2 2.74Å; H47-D49 PolarHBondContact O-N 3.09Å; H47-H50 HydrophobicContact CB-CB 4.09Å; H47-H50 WeakPolarHBondContact O-CB 3.47Å; H47-H50 PolarHBondContact O-N 3.29Å; H47-I51 WeakPolarHBondContact O-CG1 3.24Å; H47-I51 PolarHBondContact O-N 3.48Å
48	P	80.7	Confident	86.8	Confident	77 Å²	77	46.5 Å²	46.5	50%	0.5	24%	0.242	S	C	.	.	H	α-helix	trans	-58.4	-42	-172.2	20.9	-32.7	0	0	0	113.1	H50 I51 Q52	P48-H50 VanDerWaalsContact C-N 3.32Å; P48-H50 PolarHBondContact O-N 3.29Å; P48-I51 WeakPolarHBondContact O-CB 3.41Å; P48-I51 PolarHBondContact O-N 3.09Å; P48-Q52 PolarHBondContact O-N 3.21Å
49	D	81.3	Confident	86.6	Confident	102 Å²	102	46.1 Å²	46.1	55%	0.545	24%	0.239	S	C	.	.	H	α-helix	trans	-65.3	-36.1	177.8	-59.5	-28.3	0	0	0	112.8	H47 S53	H47-D49 VanDerWaalsContact C-N 3.34Å; H47-D49 IonicContact CE1-OD2 3.35Å; H47-D49 PolarHBondContact CE1-OD2 3.02Å; H47-D49 PolarHBondContact ND1-N 3.2Å; H47-D49 IonicContact ND1-OD2 2.74Å; H47-D49 PolarHBondContact O-N 3.09Å; D49-S53 WeakPolarHBondContact O-CB 3.48Å; D49-S53 PolarHBondContact O-N 2.95Å
50	H	87.5	Confident	86.7	Confident	38 Å²	38	43.9 Å²	43.9	18%	0.176	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-43.8	176.1	-61.2	179	0	0	0	109.9	Y34 R35 V45 H47 P48 S53 I54	Y34-H50 HydrophobicContact CD1-CB 3.77Å; Y34-H50 AromaticContact CD1-CD2 3.58Å; Y34-H50 AromaticContact CD1-CG 3.61Å; Y34-H50 HydrophobicContact CG-CB 4.44Å; R35-H50 PolarHBondContact N-ND1 3.38Å; V45-H50 HydrophobicContact CG1-CB 3.44Å; V45-H50 VanDerWaalsContact CG1-CB 3.44Å; H47-H50 HydrophobicContact CB-CB 4.09Å; H47-H50 WeakPolarHBondContact O-CB 3.47Å; H47-H50 PolarHBondContact O-N 3.29Å; P48-H50 VanDerWaalsContact C-N 3.32Å; P48-H50 PolarHBondContact O-N 3.29Å; H50-S53 PolarHBondContact O-N 2.79Å; H50-I54 HydrophobicContact CB-CD1 4.37Å; H50-I54 WeakPolarHBondContact O-CB 3.29Å; H50-I54 VanDerWaalsContact O-CG1 3.23Å; H50-I54 WeakPolarHBondContact O-CG1 3.49Å; H50-I54 PolarHBondContact O-N 2.67Å
51	I	86.6	Confident	86.9	Confident	6 Å²	6	36.5 Å²	36.5	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-55.9	-54.4	176.8	-66.7	172.3	0	0	0	110.2	V45 H47 P48 S53 H55 P70 E218 L220	V45-I51 HydrophobicContact CB-CG1 4.44Å; V45-I51 HydrophobicContact CG1-CG1 4.06Å; V45-I51 WeakPolarHBondContact O-CD1 3.41Å; V45-I51 WeakPolarHBondContact O-CG1 3.34Å; H47-I51 WeakPolarHBondContact O-CG1 3.24Å; H47-I51 PolarHBondContact O-N 3.48Å; P48-I51 WeakPolarHBondContact O-CB 3.41Å; P48-I51 PolarHBondContact O-N 3.09Å; I51-S53 VanDerWaalsContact C-N 3.34Å; I51-S53 PolarHBondContact O-N 3.02Å; I51-H55 WeakPolarHBondContact O-CB 3.47Å; I51-H55 PolarHBondContact O-N 2.95Å; I51-P70 HydrophobicContact CG2-CB 3.58Å; I51-P70 HydrophobicContact CG2-CG 3.54Å; I51-E218 WeakPolarHBondContact CD1-O 3.27Å; I51-L220 HydrophobicContact CB-CB 4.3Å; I51-L220 HydrophobicContact CG1-CB 3.79Å; I51-L220 HydrophobicContact CG2-CB 4.04Å
52	Q	84.3	Confident	86.9	Confident	90 Å²	90	37.4 Å²	37.4	42%	0.421	20%	0.195	S	C	.	.	H	α-helix	trans	-62.9	-41.7	-179	-69.8	-173.4	12.8	0	0	111.8	P48 N56	P48-Q52 PolarHBondContact O-N 3.21Å; Q52-N56 WeakPolarHBondContact O-CB 3.32Å; Q52-N56 PolarHBondContact O-N 3.19Å; Q52-N56 PolarHBondContact O-ND2 3.25Å
53	S	86.1	Confident	86.5	Confident	17 Å²	17	34.9 Å²	34.9	12%	0.119	18%	0.184	C	C	.	.	H	α-helix	trans	-68.9	-49.5	-177.9	-164.7	0	0	0	0	111.9	Y34 D49 H50 I51 Q57	Y34-S53 WeakPolarHBondContact OH-CB 3.32Å; Y34-S53 PolarHBondContact OH-OG 3.45Å; D49-S53 WeakPolarHBondContact O-CB 3.48Å; D49-S53 PolarHBondContact O-N 2.95Å; H50-S53 PolarHBondContact O-N 2.79Å; I51-S53 VanDerWaalsContact C-N 3.34Å; I51-S53 PolarHBondContact O-N 3.02Å; S53-Q57 VanDerWaalsContact O-CB 3.26Å; S53-Q57 WeakPolarHBondContact O-CB 3.48Å; S53-Q57 WeakPolarHBondContact O-CG 3.29Å; S53-Q57 PolarHBondContact O-N 3.35Å; S53-Q57 VanDerWaalsContact O-N 3.08Å; S53-Q57 PolarHBondContact OG-NE2 3.01Å
54	I	89	Confident	85.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-44.3	179.7	-70.9	170.2	0	0	0	110.6	Y34 V45 H50 F60 L220 L222 L230 L237	Y34-I54 HydrophobicContact CD1-CD1 4.23Å; Y34-I54 HydrophobicContact CD1-CG1 4.2Å; Y34-I54 HydrophobicContact CD2-CD1 3.88Å; Y34-I54 HydrophobicContact CD2-CG1 3.65Å; Y34-I54 HydrophobicContact CE1-CG1 4.41Å; Y34-I54 HydrophobicContact CE2-CG1 3.91Å; Y34-I54 HydrophobicContact CG-CD1 3.67Å; Y34-I54 HydrophobicContact CG-CG1 3.82Å; V45-I54 HydrophobicContact CG1-CD1 4.23Å; V45-I54 HydrophobicContact CG2-CD1 4.08Å; H50-I54 HydrophobicContact CB-CD1 4.37Å; H50-I54 WeakPolarHBondContact O-CB 3.29Å; H50-I54 VanDerWaalsContact O-CG1 3.23Å; H50-I54 WeakPolarHBondContact O-CG1 3.49Å; H50-I54 PolarHBondContact O-N 2.67Å; I54-F60 HydrophobicContact CG2-CB 3.51Å; I54-F60 HydrophobicContact CG2-CD2 4.38Å; I54-F60 HydrophobicContact CG2-CG 4.28Å; I54-F60 WeakPolarHBondContact O-CD2 3.34Å; I54-L220 HydrophobicContact CB-CD2 4.07Å; I54-L220 HydrophobicContact CG2-CD2 3.68Å; I54-L222 HydrophobicContact CG2-CD2 4.17Å; I54-L230 HydrophobicContact CG2-CD1 4Å; I54-L237 HydrophobicContact CD1-CD1 4.5Å
55	H	87.7	Confident	84.8	Confident	9 Å²	9	40 Å²	40	4%	0.042	21%	0.214	C	C	.	.	H	α-helix	trans	-67.5	-48.9	179.5	-177.3	-91.1	0	0	0	111.6	I51 Q57 Y59 P70	I51-H55 WeakPolarHBondContact O-CB 3.47Å; I51-H55 PolarHBondContact O-N 2.95Å; H55-Q57 VanDerWaalsContact C-N 3.33Å; H55-Q57 PolarHBondContact O-N 2.83Å; H55-Y59 AromaticContact CE1-CD1 3.66Å; H55-Y59 AromaticContact CE1-CE1 3.84Å; H55-Y59 AromaticContact NE2-CD1 3.84Å; H55-Y59 WeakPolarHBondContact O-CA 3.48Å; H55-Y59 PolarHBondContact O-N 3.35Å; H55-P70 HydrophobicContact CB-CG 3.85Å
56	N	84.5	Confident	83.7	Confident	12 Å²	12	40.8 Å²	40.8	6%	0.064	22%	0.219	C	C	.	.	H	α-helix	trans	-72.8	-25.9	-173.2	-64.3	-27.6	0	0	0	113.2	K19 Q52 G58	K19-N56 HydrophobicContact CD-CB 3.94Å; Q52-N56 WeakPolarHBondContact O-CB 3.32Å; Q52-N56 PolarHBondContact O-N 3.19Å; Q52-N56 PolarHBondContact O-ND2 3.25Å; N56-G58 VanDerWaalsContact C-N 3.35Å; N56-G58 PolarHBondContact O-N 3.46Å
57	Q	83.1	Confident	82.7	Confident	39 Å²	39	50.5 Å²	50.5	18%	0.182	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	29.5	-176.5	-61.5	179.7	31.7	0	0	113.2	P21 L22 S53 H55	P21-Q57 CarbonylContact C-O 3.59Å; P21-Q57 VanDerWaalsContact CA-O 3.32Å; P21-Q57 WeakPolarHBondContact CA-O 3.29Å; L22-Q57 HydrophobicContact CB-CB 4.48Å; L22-Q57 HydrophobicContact CD2-CB 4.01Å; L22-Q57 HydrophobicContact CG-CB 3.65Å; L22-Q57 PolarHBondContact N-O 3.02Å; S53-Q57 VanDerWaalsContact O-CB 3.26Å; S53-Q57 WeakPolarHBondContact O-CB 3.48Å; S53-Q57 WeakPolarHBondContact O-CG 3.29Å; S53-Q57 PolarHBondContact O-N 3.35Å; S53-Q57 VanDerWaalsContact O-N 3.08Å; S53-Q57 PolarHBondContact OG-NE2 3.01Å; H55-Q57 VanDerWaalsContact C-N 3.33Å; H55-Q57 PolarHBondContact O-N 2.83Å
58	G	82.8	Confident	81.8	Confident	12 Å²	12	50.2 Å²	50.2	12%	0.124	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	158.7	4.8	175.6	0	0	0	0	0	115.5	N56 F60 R273	N56-G58 VanDerWaalsContact C-N 3.35Å; N56-G58 PolarHBondContact O-N 3.46Å; G58-F60 VanDerWaalsContact C-N 3.29Å; G58-F60 PolarHBondContact O-N 2.99Å; G58-R273 VanDerWaalsContact O-CZ 3.31Å; G58-R273 PolarHBondContact O-NH1 2.99Å; G58-R273 PolarHBondContact O-NH2 3.09Å
59	Y	88.4	Confident	81.4	Confident	9 Å²	9	50.2 Å²	50.2	4%	0.035	25%	0.252	C	S	.	.			trans	50.1	53	-176.1	-65	-82.6	0	0	0	110	E16 H55 K280 K296 P299 F300	E16-Y59 PolarHBondContact OE2-OH 3Å; H55-Y59 AromaticContact CE1-CD1 3.66Å; H55-Y59 AromaticContact CE1-CE1 3.84Å; H55-Y59 AromaticContact NE2-CD1 3.84Å; H55-Y59 WeakPolarHBondContact O-CA 3.48Å; H55-Y59 PolarHBondContact O-N 3.35Å; Y59-K280 WeakPolarHBondContact O-CE 3.16Å; Y59-K280 PolarHBondContact O-NZ 3.02Å; Y59-K296 WeakPolarHBondContact CD2-O 3.45Å; Y59-K296 WeakPolarHBondContact CE2-O 3.41Å; Y59-P299 HydrophobicContact CD1-CG 4.5Å; Y59-P299 HydrophobicContact CE1-CG 3.68Å; Y59-F300 AromaticContact CE2-CD2 4Å; Y59-F300 HydrophobicContact CE2-CD2 4Å; Y59-F300 AromaticContact CE2-CE2 3.57Å; Y59-F300 HydrophobicContact CE2-CE2 3.57Å; Y59-F300 AromaticContact CZ-CE2 3.53Å; Y59-F300 WeakPolarHBondContact OH-CE2 3.44Å; Y59-F300 WeakPolarHBondContact OH-CZ 3.45Å
60	F	90.8	Very high	81	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.022	23%	0.229	C	C	.	.			trans	-85.9	141.1	172.2	-66.4	-83.8	0	0	0	109.4	L22 I54 G58 L222 E226 F229 L230 L234 Y269	L22-F60 HydrophobicContact CD1-CD2 4.24Å; L22-F60 HydrophobicContact CD1-CE2 3.92Å; I54-F60 HydrophobicContact CG2-CB 3.51Å; I54-F60 HydrophobicContact CG2-CD2 4.38Å; I54-F60 HydrophobicContact CG2-CG 4.28Å; I54-F60 WeakPolarHBondContact O-CD2 3.34Å; G58-F60 VanDerWaalsContact C-N 3.29Å; G58-F60 PolarHBondContact O-N 2.99Å; F60-L222 HydrophobicContact CB-CD2 3.86Å; F60-E226 HydrophobicContact CD1-CB 4.23Å; F60-E226 HydrophobicContact CD1-CG 4.25Å; F60-F229 AromaticContact CE1-CD1 3.71Å; F60-F229 HydrophobicContact CE1-CD1 3.71Å; F60-F229 HydrophobicContact CE1-CE1 4.28Å; F60-F229 AromaticContact CZ-CD1 3.82Å; F60-F229 HydrophobicContact CZ-CD1 3.82Å; F60-F229 AromaticContact CZ-CE1 3.98Å; F60-F229 HydrophobicContact CZ-CE1 3.98Å; F60-L230 HydrophobicContact CB-CD1 4.19Å; F60-L230 HydrophobicContact CD1-CD1 4.13Å; F60-L230 HydrophobicContact CD1-CD2 4.31Å; F60-L230 HydrophobicContact CD1-CG 4.12Å; F60-L230 HydrophobicContact CD2-CD2 4.03Å; F60-L230 HydrophobicContact CE1-CD2 4.28Å; F60-L230 HydrophobicContact CE1-CG 4.24Å; F60-L230 HydrophobicContact CE2-CD2 4Å; F60-L230 HydrophobicContact CG-CD1 4.11Å; F60-L230 HydrophobicContact CG-CD2 4.19Å; F60-L230 HydrophobicContact CG-CG 4.34Å; F60-L230 HydrophobicContact CZ-CD2 4.13Å; F60-L234 HydrophobicContact CE2-CD1 4.36Å; F60-L234 HydrophobicContact CZ-CD1 4.04Å; F60-Y269 WeakPolarHBondContact CE1-OH 3.43Å
61	G	89.3	Confident	79.9	Confident	5 Å²	5	48.7 Å²	48.7	5%	0.052	24%	0.243	C	C	.	.	S	Bend	trans	73.5	-173.2	175.4	0	0	0	0	0	115.4	Q221 E226 K280	G61-Q221 CarbonylContact C-O 3.55Å; G61-Q221 WeakPolarHBondContact CA-O 3.37Å; G61-E226 VanDerWaalsContact CA-OE2 3.27Å; G61-E226 WeakPolarHBondContact CA-OE2 3.17Å; G61-E226 PolarHBondContact N-OE1 2.88Å; G61-E226 PolarHBondContact N-OE2 2.86Å; G61-E226 VanDerWaalsContact N-OE2 3.11Å; G61-K280 PolarHBondContact O-NZ 3.47Å
62	K	87.3	Confident	78.7	Confident	134 Å²	134	51.6 Å²	51.6	58%	0.583	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.2	137.5	176.3	-167.8	-166.5	169.2	-162	0	109.4	Q221	K62-Q221 PolarHBondContact N-O 2.96Å; K62-Q221 PolarHBondContact O-N 2.94Å
63	G	84.3	Confident	77.7	Confident	4 Å²	4	49.1 Å²	49.1	4%	0.041	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	145.1	168.5	0	0	0	0	0	111.2
64	V	78	Confident	76.6	Confident	71 Å²	71	50.5 Å²	50.5	43%	0.43	25%	0.254	S	S	.	.	S	Bend	trans	-77.5	-44.5	178	-178.4	0	0	0	0	110.7	E218 Y219 Q221	V64-E218 PolarHBondContact N-OE1 3.37Å; V64-Y219 PolarHBondContact N-O 3.48Å; V64-Q221 VanDerWaalsContact CG2-CD 3.47Å; V64-Q221 HydrophobicContact CG2-CG 3.63Å
65	L	71.4	Confident	75.3	Confident	67 Å²	67	51.4 Å²	51.4	35%	0.351	26%	0.26	S	S	.	.	S	Bend	trans	-92.1	-16.7	-175.3	-54.6	176.6	0	0	0	111.4	H72 L216 E218	L65-H72 HydrophobicContact CB-CB 3.61Å; L65-H72 WeakPolarHBondContact CB-CD2 3.4Å; L65-H72 VanDerWaalsContact CB-CG 3.42Å; L65-H72 HydrophobicContact CD1-CB 4.19Å; L65-L216 HydrophobicContact CD1-CB 4.24Å; L65-E218 WeakPolarHBondContact CB-OE2 3.32Å; L65-E218 PolarHBondContact N-OE1 2.82Å; L65-E218 PolarHBondContact N-OE2 3.06Å
66	S	66.9	Low	74.1	Confident	16 Å²	16	58.7 Å²	58.7	11%	0.112	30%	0.3	C	S	.	.			trans	-101.7	142.7	-177.5	-58.8	0	0	0	0	114.9	R69 E71 H72 E218	S66-R69 WeakPolarHBondContact CB-O 3.25Å; S66-R69 PolarHBondContact OG-O 2.92Å; S66-R69 VanDerWaalsContact OG-O 3.06Å; S66-E71 VanDerWaalsContact OG-C 3.23Å; S66-E71 PolarHBondContact OG-N 2.83Å; S66-E71 VanDerWaalsContact OG-N 3.11Å; S66-E71 PolarHBondContact OG-O 3.07Å; S66-H72 PolarHBondContact OG-N 3.27Å; S66-E218 VanDerWaalsContact CB-OE2 3.24Å; S66-E218 WeakPolarHBondContact CB-OE2 3.49Å; S66-E218 PolarHBondContact N-OE2 3.04Å; S66-E218 PolarHBondContact OG-OE2 2.76Å
67	R	63.8	Low	73.5	Confident	255 Å²	255	64.2 Å²	64.2	96%	0.962	33%	0.325	S	S	*	.	S	Bend	trans	-81.8	-31.6	179.9	-68.9	-177.5	175.3	175.1	0.2	114.2
68	A	63.8	Low	73.1	Confident	87 Å²	87	68.5 Å²	68.5	72%	0.719	34%	0.34	S	S	*	.	S	Bend	trans	-128.6	-53.6	-171	0	0	0	0	0	113.1
69	R	73.3	Confident	72.9	Confident	76 Å²	76	71.2 Å²	71.2	29%	0.287	35%	0.349	S	S	.	.	S	Bend	trans	-124	138.8	179.9	-176.5	176.3	175.4	-176.8	-10.9	108.3	S66 E71	S66-R69 WeakPolarHBondContact CB-O 3.25Å; S66-R69 PolarHBondContact OG-O 2.92Å; S66-R69 VanDerWaalsContact OG-O 3.06Å; R69-E71 WeakPolarHBondContact CD-OE2 3.47Å; R69-E71 HydrophobicContact CG-CG 4.09Å; R69-E71 VanDerWaalsContact CZ-CD 3.46Å; R69-E71 IonicContact CZ-OE1 3.32Å; R69-E71 IonicContact CZ-OE2 3.57Å; R69-E71 IonicContact NE-OE1 2.79Å; R69-E71 PolarHBondContact NE-OE1 2.75Å; R69-E71 IonicContact NE-OE2 3.99Å; R69-E71 PolarHBondContact NE-OE2 2.89Å; R69-E71 IonicContact NH1-OE1 3.86Å; R69-E71 IonicContact NH1-OE2 2.97Å; R69-E71 IonicContact NH2-OE1 2.63Å; R69-E71 PolarHBondContact NH2-OE1 2.96Å; R69-E71 PolarHBondContact O-N 3.11Å
70	P	71.3	Confident	72.2	Confident	9 Å²	9	78 Å²	78	6%	0.058	38%	0.379	C	S	.	.	S	Bend	trans	-72.2	67.8	-177.2	33.9	-39.1	0	0	0	111.1	I51 H55 E218 L220	I51-P70 HydrophobicContact CG2-CB 3.58Å; I51-P70 HydrophobicContact CG2-CG 3.54Å; H55-P70 HydrophobicContact CB-CG 3.85Å; P70-E218 HydrophobicContact CB-CG 4.07Å; P70-L220 HydrophobicContact CB-CD1 4.19Å; P70-L220 HydrophobicContact CG-CD1 4.1Å
71	E	66.3	Low	71.3	Confident	99 Å²	99	80.6 Å²	80.6	46%	0.463	39%	0.391	S	S	.	.			trans	-132.1	83.7	177.3	-73.9	-179.5	170.7	0	0	105.5	S66 R69	S66-E71 VanDerWaalsContact OG-C 3.23Å; S66-E71 PolarHBondContact OG-N 2.83Å; S66-E71 VanDerWaalsContact OG-N 3.11Å; S66-E71 PolarHBondContact OG-O 3.07Å; R69-E71 WeakPolarHBondContact CD-OE2 3.47Å; R69-E71 HydrophobicContact CG-CG 4.09Å; R69-E71 VanDerWaalsContact CZ-CD 3.46Å; R69-E71 IonicContact CZ-OE1 3.32Å; R69-E71 IonicContact CZ-OE2 3.57Å; R69-E71 IonicContact NE-OE1 2.79Å; R69-E71 PolarHBondContact NE-OE1 2.75Å; R69-E71 IonicContact NE-OE2 3.99Å; R69-E71 PolarHBondContact NE-OE2 2.89Å; R69-E71 IonicContact NH1-OE1 3.86Å; R69-E71 IonicContact NH1-OE2 2.97Å; R69-E71 IonicContact NH2-OE1 2.63Å; R69-E71 PolarHBondContact NH2-OE1 2.96Å; R69-E71 PolarHBondContact O-N 3.11Å
72	H	60.1	Low	70.3	Confident	68 Å²	68	88.8 Å²	88.8	32%	0.315	43%	0.425	S	S	.	.			trans	-96	115.2	170.4	178.7	-94.8	0	0	0	108.4	L65 S66 E218	L65-H72 HydrophobicContact CB-CB 3.61Å; L65-H72 WeakPolarHBondContact CB-CD2 3.4Å; L65-H72 VanDerWaalsContact CB-CG 3.42Å; L65-H72 HydrophobicContact CD1-CB 4.19Å; S66-H72 PolarHBondContact OG-N 3.27Å; H72-E218 HydrophobicContact CB-CB 4.14Å; H72-E218 HydrophobicContact CB-CG 4.41Å; H72-E218 WeakPolarHBondContact CB-OE2 3.38Å
73	S	62.9	Low	69.2	Low	37 Å²	37	84.5 Å²	84.5	26%	0.259	42%	0.419	S	S	.	.			trans	-106.5	146.1	166.7	-179.8	0	0	0	0	109.1	S75 W78	S73-S75 VanDerWaalsContact CB-O 3.23Å; S73-S75 WeakPolarHBondContact CB-O 3.35Å; S73-S75 PolarHBondContact O-N 3.01Å; S73-S75 PolarHBondContact OG-N 3.24Å; S73-S75 VanDerWaalsContact OG-N 3.17Å; S73-S75 PolarHBondContact OG-O 3.16Å; S73-W78 WeakPolarHBondContact OG-CZ2 3.49Å
74	I	63	Low	68.4	Low	47 Å²	47	85.9 Å²	85.9	24%	0.241	43%	0.426	C	S	.	.	S	Bend	trans	-66.3	-21.5	172.7	-59.7	173.2	0	0	0	110.7	I89 L97 S212	I74-I89 HydrophobicContact CG2-CG2 3.98Å; I74-L97 HydrophobicContact CG2-CD1 4.23Å; I74-S212 WeakPolarHBondContact CD1-OG 3.34Å
75	S	61.8	Low	68.2	Low	18 Å²	18	87.6 Å²	87.6	13%	0.126	43%	0.433	C	S	.	.			trans	-143.9	147.1	173.9	-172.6	0	0	0	0	113.4	S73 Q77 W78 V88	S73-S75 VanDerWaalsContact CB-O 3.23Å; S73-S75 WeakPolarHBondContact CB-O 3.35Å; S73-S75 PolarHBondContact O-N 3.01Å; S73-S75 PolarHBondContact OG-N 3.24Å; S73-S75 VanDerWaalsContact OG-N 3.17Å; S73-S75 PolarHBondContact OG-O 3.16Å; S75-Q77 VanDerWaalsContact C-N 3.31Å; S75-Q77 PolarHBondContact OG-N 2.94Å; S75-Q77 PolarHBondContact OG-O 2.7Å; S75-W78 PolarHBondContact O-NE1 2.76Å; S75-W78 VanDerWaalsContact O-NE1 3.09Å; S75-V88 WeakPolarHBondContact CB-O 3.3Å; S75-V88 PolarHBondContact OG-O 3.46Å
76	D	63.9	Low	68.5	Low	163 Å²	163	85.1 Å²	85.1	87%	0.872	42%	0.42	S	S	*	.	S	Bend	trans	-80.2	-15.5	168.6	-65.1	-33.3	0	0	0	112.2
77	Q	70.6	Confident	69	Low	128 Å²	128	85 Å²	85	60%	0.598	42%	0.418	S	S	*	.			trans	-95.6	128.6	176.1	-65.1	-175.5	3.5	0	0	110	S75 P87 V88	S75-Q77 VanDerWaalsContact C-N 3.31Å; S75-Q77 PolarHBondContact OG-N 2.94Å; S75-Q77 PolarHBondContact OG-O 2.7Å; Q77-P87 WeakPolarHBondContact O-CA 3.07Å; Q77-V88 HydrophobicContact CB-CB 4.06Å; Q77-V88 PolarHBondContact O-N 3.07Å
78	W	76.2	Confident	69.8	Low	129 Å²	129	73 Å²	73	49%	0.489	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.2	179.8	-69.4	79.8	0	0	0	109.5	S73 S75 L85 L86 P87	S73-W78 WeakPolarHBondContact OG-CZ2 3.49Å; S75-W78 PolarHBondContact O-NE1 2.76Å; S75-W78 VanDerWaalsContact O-NE1 3.09Å; W78-L85 HydrophobicContact CB-CD2 3.91Å; W78-L85 HydrophobicContact CB-CG 4.14Å; W78-L85 HydrophobicContact CD2-CD2 4Å; W78-L85 HydrophobicContact CE3-CD2 3.61Å; W78-L85 HydrophobicContact CE3-CG 4.02Å; W78-L85 HydrophobicContact CG-CD2 4.17Å; W78-L85 HydrophobicContact CZ3-CD2 4.38Å; W78-L86 WeakPolarHBondContact CA-O 3.19Å; W78-L86 VanDerWaalsContact CE3-C 3.5Å; W78-P87 HydrophobicContact CD2-CB 4.32Å; W78-P87 HydrophobicContact CE3-CB 4.27Å; W78-P87 HydrophobicContact CH2-CB 4.27Å; W78-P87 HydrophobicContact CH2-CG 4.36Å; W78-P87 HydrophobicContact CZ2-CB 4.31Å; W78-P87 HydrophobicContact CZ3-CB 4.25Å; W78-P87 HydrophobicContact CZ3-CG 4.27Å
79	E	78.1	Confident	70.8	Confident	69 Å²	69	69.3 Å²	69.3	32%	0.322	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.6	179.4	-167.7	164.8	152.6	0	0	111.1	H81 L85 L86 V88 L195 R207	E79-H81 PolarHBondContact O-N 3.32Å; E79-L85 WeakPolarHBondContact O-CA 3.33Å; E79-L86 PolarHBondContact N-O 3.25Å; E79-L86 PolarHBondContact O-N 2.94Å; E79-V88 HydrophobicContact CB-CG2 3.68Å; E79-L195 HydrophobicContact CB-CD2 4.49Å; E79-R207 IonicContact OE1-CZ 3.3Å; E79-R207 IonicContact OE1-NH1 2.7Å; E79-R207 PolarHBondContact OE1-NH1 2.55Å; E79-R207 IonicContact OE2-CZ 2.97Å; E79-R207 IonicContact OE2-NH1 3.55Å; E79-R207 PolarHBondContact OE2-NH1 3.45Å; E79-R207 IonicContact OE2-NH2 2.67Å
80	K	73.9	Confident	71.4	Confident	151 Å²	151	67.9 Å²	67.9	66%	0.657	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	106.1	174.4	-167.9	174.9	-179.3	177.7	0	108.6	G83 V84 L85	K80-G83 WeakPolarHBondContact CE-O 3.17Å; K80-V84 CarbonylContact C-O 3.51Å; K80-V84 VanDerWaalsContact CA-O 3.32Å; K80-V84 WeakPolarHBondContact CA-O 3.42Å; K80-L85 HydrophobicContact CB-CD1 4.37Å
81	H	71.5	Confident	72.1	Confident	60 Å²	60	70.1 Å²	70.1	28%	0.278	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.5	174.4	-171.9	-96.3	0	0	0	109.3	E79 G83 V84 L86 L195 V209	E79-H81 PolarHBondContact O-N 3.32Å; H81-G83 PolarHBondContact O-N 2.87Å; H81-G83 VanDerWaalsContact O-N 3.09Å; H81-V84 PolarHBondContact N-O 3.31Å; H81-V84 PolarHBondContact O-N 3.13Å; H81-L86 HydrophobicContact CB-CD1 4.47Å; H81-L195 HydrophobicContact CB-CD1 3.95Å; H81-V209 WeakPolarHBondContact ND1-CG2 3.4Å
82	K	67.9	Low	73	Confident	177 Å²	177	68.4 Å²	68.4	77%	0.77	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	40.4	179.4	-62.5	-175.5	177.1	-173	0	114.5
83	G	64.7	Low	74.1	Confident	44 Å²	44	69.7 Å²	69.7	45%	0.454	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.8	-14.5	177.8	0	0	0	0	0	115.5	K80 H81	K80-G83 WeakPolarHBondContact CE-O 3.17Å; H81-G83 PolarHBondContact O-N 2.87Å; H81-G83 VanDerWaalsContact O-N 3.09Å
84	V	67.5	Low	75.1	Confident	32 Å²	32	67.9 Å²	67.9	19%	0.194	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	137.8	-177.9	-178.5	0	0	0	0	110.5	K80 H81 L86 P189	K80-V84 CarbonylContact C-O 3.51Å; K80-V84 VanDerWaalsContact CA-O 3.32Å; K80-V84 WeakPolarHBondContact CA-O 3.42Å; H81-V84 PolarHBondContact N-O 3.31Å; H81-V84 PolarHBondContact O-N 3.13Å; V84-L86 HydrophobicContact CG1-CD2 3.85Å; V84-L86 HydrophobicContact CG1-CG 4.02Å; V84-P189 HydrophobicContact CB-CG 4.33Å; V84-P189 VanDerWaalsContact CG1-CD 3.41Å; V84-P189 HydrophobicContact CG1-CG 3.78Å; V84-P189 VanDerWaalsContact CG2-CD 3.47Å; V84-P189 HydrophobicContact CG2-CG 3.73Å
85	L	74.2	Confident	76.2	Confident	107 Å²	107	70.1 Å²	70.1	56%	0.56	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.7	173.3	-155.6	95	0	0	0	109.4	W78 E79 K80	W78-L85 HydrophobicContact CB-CD2 3.91Å; W78-L85 HydrophobicContact CB-CG 4.14Å; W78-L85 HydrophobicContact CD2-CD2 4Å; W78-L85 HydrophobicContact CE3-CD2 3.61Å; W78-L85 HydrophobicContact CE3-CG 4.02Å; W78-L85 HydrophobicContact CG-CD2 4.17Å; W78-L85 HydrophobicContact CZ3-CD2 4.38Å; E79-L85 WeakPolarHBondContact O-CA 3.33Å; K80-L85 HydrophobicContact CB-CD1 4.37Å
86	L	76.1	Confident	77.3	Confident	15 Å²	15	72 Å²	72	8%	0.079	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.3	-178.6	-66.1	175.2	0	0	0	111.4	W78 E79 H81 V84 L195 V209	W78-L86 WeakPolarHBondContact CA-O 3.19Å; W78-L86 VanDerWaalsContact CE3-C 3.5Å; E79-L86 PolarHBondContact N-O 3.25Å; E79-L86 PolarHBondContact O-N 2.94Å; H81-L86 HydrophobicContact CB-CD1 4.47Å; V84-L86 HydrophobicContact CG1-CD2 3.85Å; V84-L86 HydrophobicContact CG1-CG 4.02Å; L86-L195 HydrophobicContact CB-CB 4.4Å; L86-L195 HydrophobicContact CD1-CD1 4.49Å; L86-V209 HydrophobicContact CD1-CG1 3.99Å; L86-V209 HydrophobicContact CD1-CG2 3.92Å
87	P	78.1	Confident	78.2	Confident	13 Å²	13	64.4 Å²	64.4	8%	0.084	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	133.5	173.6	29.8	-32.2	0	0	0	110.2	Q77 W78 V194 L195	Q77-P87 WeakPolarHBondContact O-CA 3.07Å; W78-P87 HydrophobicContact CD2-CB 4.32Å; W78-P87 HydrophobicContact CE3-CB 4.27Å; W78-P87 HydrophobicContact CH2-CB 4.27Å; W78-P87 HydrophobicContact CH2-CG 4.36Å; W78-P87 HydrophobicContact CZ2-CB 4.31Å; W78-P87 HydrophobicContact CZ3-CB 4.25Å; W78-P87 HydrophobicContact CZ3-CG 4.27Å; P87-V194 HydrophobicContact CG-CG1 4.13Å; P87-L195 PolarHBondContact O-N 3.38Å
88	V	81.1	Confident	78.8	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.03	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.2	-178.1	-175	0	0	0	0	110.1	S75 Q77 E79 L195 D197	S75-V88 WeakPolarHBondContact CB-O 3.3Å; S75-V88 PolarHBondContact OG-O 3.46Å; Q77-V88 HydrophobicContact CB-CB 4.06Å; Q77-V88 PolarHBondContact O-N 3.07Å; E79-V88 HydrophobicContact CB-CG2 3.68Å; V88-L195 CarbonylContact C-O 3.57Å; V88-L195 WeakPolarHBondContact CA-O 3.29Å; V88-L195 HydrophobicContact CG2-CB 4.25Å; V88-L195 HydrophobicContact CG2-CD2 3.96Å; V88-D197 HydrophobicContact CG1-CB 4.42Å
89	I	84.8	Confident	79.2	Confident	8 Å²	8	61 Å²	61	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.4	178.6	57.7	176.4	0	0	0	110.4	I74 Y94 L97 V194 L195 V196 D197	I74-I89 HydrophobicContact CG2-CG2 3.98Å; I89-Y94 HydrophobicContact CD1-CD2 3.58Å; I89-Y94 HydrophobicContact CD1-CG 4.25Å; I89-L97 HydrophobicContact CD1-CD1 4.46Å; I89-V194 HydrophobicContact CD1-CB 3.75Å; I89-V194 HydrophobicContact CD1-CG1 4.11Å; I89-V194 HydrophobicContact CD1-CG2 3.65Å; I89-V194 HydrophobicContact CG1-CB 4.18Å; I89-V194 HydrophobicContact CG1-CG2 4.41Å; I89-L195 PolarHBondContact N-O 2.85Å; I89-V196 HydrophobicContact CD1-CG2 4.18Å; I89-V196 HydrophobicContact CG1-CG2 4.12Å; I89-V196 WeakPolarHBondContact O-CA 3.43Å; I89-D197 PolarHBondContact O-N 2.82Å
90	S	86.4	Confident	79.4	Confident	46 Å²	46	63.3 Å²	63.3	32%	0.322	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	152.8	172.9	65.1	0	0	0	0	111.2	S92 R93 Y94	S90-S92 VanDerWaalsContact C-N 3.28Å; S90-S92 PolarHBondContact O-N 3.32Å; S90-S92 PolarHBondContact OG-OG 3.06Å; S90-R93 WeakPolarHBondContact O-CB 3.36Å; S90-R93 PolarHBondContact O-N 3.07Å; S90-R93 VanDerWaalsContact O-N 3.09Å; S90-R93 WeakPolarHBondContact OG-CB 3.41Å; S90-R93 PolarHBondContact OG-N 2.99Å; S90-Y94 PolarHBondContact O-N 3.46Å
91	Q	86.1	Confident	79.8	Confident	56 Å²	56	56.3 Å²	56.3	26%	0.262	28%	0.277	S	S	.	.	H	α-helix	trans	-53.5	-45	172.1	-178.6	174.2	-7.2	0	0	112.5	R93 Y94 E95 V196 D197 L198	Q91-R93 VanDerWaalsContact C-N 3.28Å; Q91-R93 PolarHBondContact O-N 3.36Å; Q91-Y94 WeakPolarHBondContact O-CB 3.49Å; Q91-Y94 PolarHBondContact O-N 2.71Å; Q91-Y94 VanDerWaalsContact O-N 3.1Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.38Å; Q91-E95 PolarHBondContact NE2-OE1 3.16Å; Q91-E95 WeakPolarHBondContact O-CG 3.48Å; Q91-E95 PolarHBondContact O-N 3.08Å; Q91-V196 HydrophobicContact CB-CG1 4.15Å; Q91-D197 WeakPolarHBondContact CB-O 3.33Å; Q91-D197 PolarHBondContact N-O 2.75Å; Q91-L198 HydrophobicContact CB-CD2 4.33Å; Q91-L198 HydrophobicContact CG-CD2 4.13Å
92	S	84.4	Confident	80.2	Confident	64 Å²	64	58 Å²	58	45%	0.448	29%	0.285	S	S	.	.	H	α-helix	trans	-57.5	-38.2	176.6	50.2	0	0	0	0	113.4	S90 E96	S90-S92 VanDerWaalsContact C-N 3.28Å; S90-S92 PolarHBondContact O-N 3.32Å; S90-S92 PolarHBondContact OG-OG 3.06Å; S92-E96 PolarHBondContact O-N 2.92Å
93	R	83	Confident	80.9	Confident	94 Å²	94	52.3 Å²	52.3	36%	0.355	27%	0.271	S	S	.	.	H	α-helix	trans	-71.8	-38.7	176.2	-177.9	58.8	171.7	173.5	2	111.5	S90 Q91 E96 L97	S90-R93 WeakPolarHBondContact O-CB 3.36Å; S90-R93 PolarHBondContact O-N 3.07Å; S90-R93 VanDerWaalsContact O-N 3.09Å; S90-R93 WeakPolarHBondContact OG-CB 3.41Å; S90-R93 PolarHBondContact OG-N 2.99Å; Q91-R93 VanDerWaalsContact C-N 3.28Å; Q91-R93 PolarHBondContact O-N 3.36Å; R93-E96 IonicContact CZ-OE2 3.87Å; R93-E96 IonicContact NH1-OE1 3.87Å; R93-E96 IonicContact NH1-OE2 2.78Å; R93-E96 PolarHBondContact NH1-OE2 3.29Å; R93-E96 PolarHBondContact O-N 3.49Å; R93-L97 WeakPolarHBondContact O-CG 3.4Å; R93-L97 PolarHBondContact O-N 2.76Å; R93-L97 VanDerWaalsContact O-N 3.09Å
94	Y	84.3	Confident	81.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-44.9	176	-172.7	-104.9	0	0	0	112.1	I89 S90 Q91 E96 L97 L98 L122 V194 V196 R210 R211 P213	I89-Y94 HydrophobicContact CD1-CD2 3.58Å; I89-Y94 HydrophobicContact CD1-CG 4.25Å; S90-Y94 PolarHBondContact O-N 3.46Å; Q91-Y94 WeakPolarHBondContact O-CB 3.49Å; Q91-Y94 PolarHBondContact O-N 2.71Å; Q91-Y94 VanDerWaalsContact O-N 3.1Å; Y94-E96 VanDerWaalsContact C-N 3.32Å; Y94-E96 PolarHBondContact O-N 3.47Å; Y94-L97 PolarHBondContact O-N 3.02Å; Y94-L98 HydrophobicContact CD1-CD1 3.82Å; Y94-L98 HydrophobicContact CD1-CG 4.41Å; Y94-L98 HydrophobicContact CE1-CD1 3.52Å; Y94-L98 HydrophobicContact CE1-CG 4.08Å; Y94-L98 PolarHBondContact O-N 3.27Å; Y94-L122 PolarHBondContact OH-O 3.41Å; Y94-V194 HydrophobicContact CD2-CG2 3.98Å; Y94-V194 HydrophobicContact CE2-CG2 3.73Å; Y94-V196 HydrophobicContact CD1-CG2 4.26Å; Y94-V196 HydrophobicContact CD2-CG2 3.59Å; Y94-V196 HydrophobicContact CE2-CG2 3.95Å; Y94-V196 HydrophobicContact CG-CG1 4.28Å; Y94-V196 HydrophobicContact CG-CG2 3.71Å; Y94-R210 HydrophobicContact CE1-CB 4.45Å; Y94-R210 HydrophobicContact CE2-CB 3.93Å; Y94-R210 WeakPolarHBondContact OH-CB 3.08Å; Y94-R211 WeakPolarHBondContact CE2-O 3.32Å; Y94-R211 PolarHBondContact OH-O 3.25Å; Y94-P213 HydrophobicContact CD2-CG 4.08Å; Y94-P213 HydrophobicContact CE2-CG 3.63Å
95	E	85.4	Confident	82.1	Confident	94 Å²	94	54.6 Å²	54.6	44%	0.439	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-35.6	176	-70.8	171.6	-173.1	0	0	112.4	Q91 L98 R99	Q91-E95 WeakPolarHBondContact CG-OE1 3.38Å; Q91-E95 PolarHBondContact NE2-OE1 3.16Å; Q91-E95 WeakPolarHBondContact O-CG 3.48Å; Q91-E95 PolarHBondContact O-N 3.08Å; E95-L98 PolarHBondContact O-N 2.88Å; E95-R99 WeakPolarHBondContact O-CG 3.45Å; E95-R99 PolarHBondContact O-N 2.96Å
96	E	84.4	Confident	82.2	Confident	58 Å²	58	53.3 Å²	53.3	27%	0.271	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-44.5	171.9	-171.5	-177.1	-158.8	0	0	112.2	S92 R93 Y94 L98 R99 W100	S92-E96 PolarHBondContact O-N 2.92Å; R93-E96 IonicContact CZ-OE2 3.87Å; R93-E96 IonicContact NH1-OE1 3.87Å; R93-E96 IonicContact NH1-OE2 2.78Å; R93-E96 PolarHBondContact NH1-OE2 3.29Å; R93-E96 PolarHBondContact O-N 3.49Å; Y94-E96 VanDerWaalsContact C-N 3.32Å; Y94-E96 PolarHBondContact O-N 3.47Å; E96-L98 VanDerWaalsContact C-N 3.34Å; E96-L98 PolarHBondContact O-N 2.92Å; E96-R99 PolarHBondContact O-N 2.95Å; E96-W100 HydrophobicContact CG-CZ2 3.91Å; E96-W100 PolarHBondContact O-N 2.79Å; E96-W100 VanDerWaalsContact O-N 3.09Å; E96-W100 WeakPolarHBondContact OE1-CZ2 3.42Å
97	L	83.2	Confident	82.2	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-38.1	177.3	-66.4	171.7	0	0	0	112.1	I74 I89 R93 Y94 W100 A101 P213 L214	I74-L97 HydrophobicContact CG2-CD1 4.23Å; I89-L97 HydrophobicContact CD1-CD1 4.46Å; R93-L97 WeakPolarHBondContact O-CG 3.4Å; R93-L97 PolarHBondContact O-N 2.76Å; R93-L97 VanDerWaalsContact O-N 3.09Å; Y94-L97 PolarHBondContact O-N 3.02Å; L97-W100 HydrophobicContact CD2-CE3 4Å; L97-W100 HydrophobicContact CD2-CZ3 4.1Å; L97-W100 PolarHBondContact O-N 3.41Å; L97-A101 PolarHBondContact O-N 3.42Å; L97-P213 HydrophobicContact CB-CB 4.17Å; L97-P213 HydrophobicContact CB-CG 4.05Å; L97-L214 HydrophobicContact CD2-CD1 3.99Å
98	L	83.2	Confident	81.9	Confident	26 Å²	26	60.9 Å²	60.9	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-45.7	173.4	-79.1	170.8	0	0	0	111.9	Y94 E95 E96 W100 A101 E102 L119 L122 P213	Y94-L98 HydrophobicContact CD1-CD1 3.82Å; Y94-L98 HydrophobicContact CD1-CG 4.41Å; Y94-L98 HydrophobicContact CE1-CD1 3.52Å; Y94-L98 HydrophobicContact CE1-CG 4.08Å; Y94-L98 PolarHBondContact O-N 3.27Å; E95-L98 PolarHBondContact O-N 2.88Å; E96-L98 VanDerWaalsContact C-N 3.34Å; E96-L98 PolarHBondContact O-N 2.92Å; L98-W100 VanDerWaalsContact C-N 3.25Å; L98-W100 PolarHBondContact O-N 2.84Å; L98-A101 WeakPolarHBondContact O-CB 3.42Å; L98-A101 PolarHBondContact O-N 3.32Å; L98-A101 VanDerWaalsContact O-N 3.13Å; L98-E102 WeakPolarHBondContact O-CB 3.42Å; L98-E102 PolarHBondContact O-N 2.9Å; L98-L119 HydrophobicContact CD2-CD2 4.31Å; L98-L122 HydrophobicContact CD2-CB 4.15Å; L98-P213 HydrophobicContact CD2-CB 3.88Å; L98-P213 HydrophobicContact CD2-CG 3.72Å; L98-P213 HydrophobicContact CG-CB 4.2Å; L98-P213 HydrophobicContact CG-CG 3.75Å
99	R	84.9	Confident	81	Confident	158 Å²	158	71.9 Å²	71.9	60%	0.596	35%	0.352	S	S	*	.	H	α-helix	trans	-60	-36.3	176.5	-74	-173.5	-64.7	155	-0.2	112.4	E95 E96 A103	E95-R99 WeakPolarHBondContact O-CG 3.45Å; E95-R99 PolarHBondContact O-N 2.96Å; E96-R99 PolarHBondContact O-N 2.95Å; R99-A103 WeakPolarHBondContact O-CB 3.44Å; R99-A103 PolarHBondContact O-N 2.63Å
100	W	83.1	Confident	79.8	Confident	118 Å²	118	75.6 Å²	75.6	45%	0.447	37%	0.372	S	S	.	.	H	α-helix	trans	-69.8	-41.4	175.1	-66.6	-3.2	0	0	0	112.1	E96 L97 L98 E102 A103 E104 L214	E96-W100 HydrophobicContact CG-CZ2 3.91Å; E96-W100 PolarHBondContact O-N 2.79Å; E96-W100 VanDerWaalsContact O-N 3.09Å; E96-W100 WeakPolarHBondContact OE1-CZ2 3.42Å; L97-W100 HydrophobicContact CD2-CE3 4Å; L97-W100 HydrophobicContact CD2-CZ3 4.1Å; L97-W100 PolarHBondContact O-N 3.41Å; L98-W100 VanDerWaalsContact C-N 3.25Å; L98-W100 PolarHBondContact O-N 2.84Å; W100-E102 VanDerWaalsContact C-N 3.35Å; W100-A103 PolarHBondContact O-N 3.3Å; W100-E104 WeakPolarHBondContact O-CB 3.44Å; W100-E104 PolarHBondContact O-N 2.63Å; W100-L214 HydrophobicContact CB-CD1 3.96Å; W100-L214 HydrophobicContact CE3-CD1 3.98Å
101	A	81.3	Confident	79.2	Confident	4 Å²	4	78.8 Å²	78.8	3%	0.033	39%	0.385	C	S	.	.	H	α-helix	trans	-61.8	-43	175.2	0	0	0	0	0	111.7	L97 L98 E104 L105 L119 P213 L214	L97-A101 PolarHBondContact O-N 3.42Å; L98-A101 WeakPolarHBondContact O-CB 3.42Å; L98-A101 PolarHBondContact O-N 3.32Å; L98-A101 VanDerWaalsContact O-N 3.13Å; A101-E104 PolarHBondContact O-N 2.85Å; A101-L105 WeakPolarHBondContact O-CB 3.28Å; A101-L105 VanDerWaalsContact O-CG 3.27Å; A101-L105 WeakPolarHBondContact O-CG 3.45Å; A101-L105 PolarHBondContact O-N 2.92Å; A101-L119 HydrophobicContact CB-CD2 4.36Å; A101-P213 HydrophobicContact CB-CB 4.18Å; A101-L214 HydrophobicContact CB-CD2 3.84Å; A101-L214 HydrophobicContact CB-CG 4.34Å
102	E	80.9	Confident	78.5	Confident	95 Å²	95	83.6 Å²	83.6	44%	0.444	41%	0.407	S	S	.	.	H	α-helix	trans	-60.6	-45.6	174.7	-178.2	179.8	-167.8	0	0	112	L98 W100 E104 L105 S106 L119	L98-E102 WeakPolarHBondContact O-CB 3.42Å; L98-E102 PolarHBondContact O-N 2.9Å; W100-E102 VanDerWaalsContact C-N 3.35Å; E102-E104 VanDerWaalsContact C-N 3.34Å; E102-E104 PolarHBondContact O-N 2.85Å; E102-L105 PolarHBondContact O-N 3.45Å; E102-S106 WeakPolarHBondContact O-CB 3.48Å; E102-S106 PolarHBondContact O-N 2.86Å; E102-S106 PolarHBondContact O-OG 2.84Å; E102-L119 HydrophobicContact CB-CD1 3.84Å; E102-L119 HydrophobicContact CB-CD2 4.27Å; E102-L119 HydrophobicContact CG-CD1 3.84Å
103	A	82.1	Confident	77.9	Confident	59 Å²	59	87 Å²	87	49%	0.488	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-39.4	176.9	0	0	0	0	0	112.3	R99 W100 S106 S107	R99-A103 WeakPolarHBondContact O-CB 3.44Å; R99-A103 PolarHBondContact O-N 2.63Å; W100-A103 PolarHBondContact O-N 3.3Å; A103-S106 PolarHBondContact O-N 3.13Å; A103-S107 WeakPolarHBondContact O-CB 3.22Å; A103-S107 PolarHBondContact O-N 2.86Å
104	E	79.1	Confident	77.2	Confident	98 Å²	98	84.6 Å²	84.6	46%	0.458	42%	0.416	S	S	.	.	H	α-helix	trans	-64.8	-50.1	176.6	-176.9	61.3	-149.9	0	0	111	W100 A101 E102 S106 S107 Q108	W100-E104 WeakPolarHBondContact O-CB 3.44Å; W100-E104 PolarHBondContact O-N 2.63Å; A101-E104 PolarHBondContact O-N 2.85Å; E102-E104 VanDerWaalsContact C-N 3.34Å; E102-E104 PolarHBondContact O-N 2.85Å; E104-S106 VanDerWaalsContact C-N 3.29Å; E104-S106 PolarHBondContact O-N 2.75Å; E104-S107 WeakPolarHBondContact O-CB 2.9Å; E104-S107 PolarHBondContact O-N 2.95Å; E104-S107 PolarHBondContact O-OG 2.82Å; E104-Q108 WeakPolarHBondContact O-CG 3.31Å; E104-Q108 PolarHBondContact O-N 3.17Å; E104-Q108 PolarHBondContact OE1-NE2 3.01Å
105	L	77.8	Confident	76.3	Confident	25 Å²	25	85.1 Å²	85.1	13%	0.131	42%	0.42	C	S	.	.	H	α-helix	trans	-58	-41.6	176.4	-70.9	169	0	0	0	111.9	A101 E102 S107 Q108 L110 A115 T118 L119	A101-L105 WeakPolarHBondContact O-CB 3.28Å; A101-L105 VanDerWaalsContact O-CG 3.27Å; A101-L105 WeakPolarHBondContact O-CG 3.45Å; A101-L105 PolarHBondContact O-N 2.92Å; E102-L105 PolarHBondContact O-N 3.45Å; L105-S107 VanDerWaalsContact C-N 3.32Å; L105-S107 PolarHBondContact O-N 2.93Å; L105-Q108 PolarHBondContact O-N 2.84Å; L105-L110 HydrophobicContact CD2-CD1 3.65Å; L105-A115 HydrophobicContact CB-CB 4.09Å; L105-A115 HydrophobicContact CD1-CB 4.34Å; L105-T118 HydrophobicContact CD1-CG2 4.31Å; L105-L119 HydrophobicContact CD1-CD2 4.31Å; L105-L119 HydrophobicContact CD1-CG 4.19Å
106	S	76.9	Confident	75.6	Confident	80 Å²	80	84.9 Å²	84.9	56%	0.559	42%	0.422	S	S	*	.	H	α-helix	trans	-63.8	-37.1	176	-59.3	0	0	0	0	112.1	E102 A103 E104 R109	E102-S106 WeakPolarHBondContact O-CB 3.48Å; E102-S106 PolarHBondContact O-N 2.86Å; E102-S106 PolarHBondContact O-OG 2.84Å; A103-S106 PolarHBondContact O-N 3.13Å; E104-S106 VanDerWaalsContact C-N 3.29Å; E104-S106 PolarHBondContact O-N 2.75Å; S106-R109 PolarHBondContact O-N 3.09Å
107	S	76.6	Confident	75.1	Confident	77 Å²	77	88.4 Å²	88.4	54%	0.538	44%	0.439	S	S	.	.	H	α-helix	trans	-71.5	-29.8	178.7	81.6	0	0	0	0	113.2	A103 E104 L105 R109	A103-S107 WeakPolarHBondContact O-CB 3.22Å; A103-S107 PolarHBondContact O-N 2.86Å; E104-S107 WeakPolarHBondContact O-CB 2.9Å; E104-S107 PolarHBondContact O-N 2.95Å; E104-S107 PolarHBondContact O-OG 2.82Å; L105-S107 VanDerWaalsContact C-N 3.32Å; L105-S107 PolarHBondContact O-N 2.93Å; S107-R109 PolarHBondContact O-N 3.35Å
108	Q	71.9	Confident	74.4	Confident	111 Å²	111	91.4 Å²	91.4	52%	0.519	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	0.6	179.4	-68.9	-179.3	19.5	0	0	113.4	E104 L105 L110	E104-Q108 WeakPolarHBondContact O-CG 3.31Å; E104-Q108 PolarHBondContact O-N 3.17Å; E104-Q108 PolarHBondContact OE1-NE2 3.01Å; L105-Q108 PolarHBondContact O-N 2.84Å; Q108-L110 HydrophobicContact CB-CD1 4.34Å; Q108-L110 HydrophobicContact CB-CG 4.24Å; Q108-L110 PolarHBondContact O-N 2.99Å
109	R	60.6	Low	73.8	Confident	236 Å²	236	91.2 Å²	91.2	89%	0.891	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	32	-177.1	-54.4	-174.4	80.7	-167.2	5.6	113.2	S106 S107	S106-R109 PolarHBondContact O-N 3.09Å; S107-R109 PolarHBondContact O-N 3.35Å
110	L	61	Low	73.2	Confident	86 Å²	86	89.6 Å²	89.6	45%	0.45	46%	0.459	S	S	.	.			trans	-66.1	153.2	167.9	-68.3	168.7	0	0	0	109	L105 Q108 E112	L105-L110 HydrophobicContact CD2-CD1 3.65Å; Q108-L110 HydrophobicContact CB-CD1 4.34Å; Q108-L110 HydrophobicContact CB-CG 4.24Å; Q108-L110 PolarHBondContact O-N 2.99Å; L110-E112 PolarHBondContact O-N 3.19Å
111	D	73.5	Confident	72.7	Confident	112 Å²	112	85.7 Å²	85.7	60%	0.599	45%	0.451	S	S	*	.			trans	-58.3	136.9	176.8	-156.9	-8.4	0	0	0	110	E113 A114 A115	D111-E113 PolarHBondContact O-N 2.89Å; D111-E113 VanDerWaalsContact O-N 3.14Å; D111-A114 HydrophobicContact CB-CB 4.35Å; D111-A114 PolarHBondContact O-N 2.98Å; D111-A115 PolarHBondContact O-N 3.19Å
112	E	70.8	Confident	72.1	Confident	158 Å²	158	86.7 Å²	86.7	74%	0.738	46%	0.456	S	S	*	.	H	α-helix	trans	-58.3	-33	-174.5	-71.9	-175.5	173.4	0	0	111	L110 N116	L110-E112 PolarHBondContact O-N 3.19Å; E112-N116 WeakPolarHBondContact O-CB 3.2Å; E112-N116 VanDerWaalsContact O-CG 3.24Å; E112-N116 PolarHBondContact O-N 2.97Å; E112-N116 PolarHBondContact O-ND2 3.43Å; E112-N116 VanDerWaalsContact O-ND2 3.14Å
113	E	71.9	Confident	71.5	Confident	136 Å²	136	85 Å²	85	64%	0.636	45%	0.453	S	S	*	.	H	α-helix	trans	-67.9	-39.7	176.9	-64.8	178.8	176.1	0	0	112.6	D111 N116 Q117	D111-E113 PolarHBondContact O-N 2.89Å; D111-E113 VanDerWaalsContact O-N 3.14Å; E113-N116 PolarHBondContact O-N 3.34Å; E113-Q117 VanDerWaalsContact O-CG 3.29Å; E113-Q117 WeakPolarHBondContact O-CG 3.36Å; E113-Q117 PolarHBondContact O-N 3.1Å
114	A	69.1	Low	71.1	Confident	42 Å²	42	88.8 Å²	88.8	35%	0.347	46%	0.46	S	S	.	.	H	α-helix	trans	-71.8	-36.2	177.5	0	0	0	0	0	111.8	D111 T118	D111-A114 HydrophobicContact CB-CB 4.35Å; D111-A114 PolarHBondContact O-N 2.98Å; A114-T118 WeakPolarHBondContact O-CB 3.23Å; A114-T118 PolarHBondContact O-N 3.48Å; A114-T118 PolarHBondContact O-OG1 3.47Å
115	A	64.5	Low	70.3	Confident	11 Å²	11	86.8 Å²	86.8	9%	0.091	46%	0.455	C	S	.	.	H	α-helix	trans	-63.2	-45.9	173.2	0	0	0	0	0	111.1	L105 D111 T118 L119	L105-A115 HydrophobicContact CB-CB 4.09Å; L105-A115 HydrophobicContact CD1-CB 4.34Å; D111-A115 PolarHBondContact O-N 3.19Å; A115-T118 PolarHBondContact O-N 2.95Å; A115-L119 WeakPolarHBondContact O-CG 3.35Å; A115-L119 PolarHBondContact O-N 3.09Å
116	N	70.1	Confident	69.7	Low	89 Å²	89	88.2 Å²	88.2	48%	0.476	47%	0.465	S	S	.	.	H	α-helix	trans	-63.8	-41.5	177.5	-74.7	-28.4	0	0	0	112.7	E112 E113 T118 L119 L120	E112-N116 WeakPolarHBondContact O-CB 3.2Å; E112-N116 VanDerWaalsContact O-CG 3.24Å; E112-N116 PolarHBondContact O-N 2.97Å; E112-N116 PolarHBondContact O-ND2 3.43Å; E112-N116 VanDerWaalsContact O-ND2 3.14Å; E113-N116 PolarHBondContact O-N 3.34Å; N116-T118 VanDerWaalsContact C-N 3.31Å; N116-T118 PolarHBondContact O-N 3.35Å; N116-L119 PolarHBondContact O-N 3.09Å; N116-L120 WeakPolarHBondContact O-CB 3.21Å; N116-L120 VanDerWaalsContact O-CG 3.28Å; N116-L120 WeakPolarHBondContact O-CG 3.43Å; N116-L120 PolarHBondContact O-N 2.94Å
117	Q	73.8	Confident	68.5	Low	132 Å²	132	92.8 Å²	92.8	62%	0.617	48%	0.477	S	S	*	.	H	α-helix	trans	-61.8	-39.7	174.2	-74.3	172.6	24.6	0	0	112.1	E113 L120 A121	E113-Q117 VanDerWaalsContact O-CG 3.29Å; E113-Q117 WeakPolarHBondContact O-CG 3.36Å; E113-Q117 PolarHBondContact O-N 3.1Å; Q117-L120 PolarHBondContact O-N 3.05Å; Q117-A121 WeakPolarHBondContact O-CB 3.21Å; Q117-A121 PolarHBondContact O-N 3.29Å
118	T	69.9	Low	67.1	Low	66 Å²	66	96.8 Å²	96.8	41%	0.405	49%	0.487	S	S	.	.	H	α-helix	trans	-66.4	-43.1	177.4	-53.6	0	0	0	0	111.3	L105 A114 A115 N116 A121 L122	L105-T118 HydrophobicContact CD1-CG2 4.31Å; A114-T118 WeakPolarHBondContact O-CB 3.23Å; A114-T118 PolarHBondContact O-N 3.48Å; A114-T118 PolarHBondContact O-OG1 3.47Å; A115-T118 PolarHBondContact O-N 2.95Å; N116-T118 VanDerWaalsContact C-N 3.31Å; N116-T118 PolarHBondContact O-N 3.35Å; T118-A121 PolarHBondContact O-N 3.05Å; T118-L122 HydrophobicContact CG2-CD1 4.49Å; T118-L122 VanDerWaalsContact O-CG 3.3Å; T118-L122 WeakPolarHBondContact O-CG 3.35Å; T118-L122 PolarHBondContact O-N 3.29Å; T118-L122 VanDerWaalsContact O-N 3.09Å
119	L	70.8	Confident	65.3	Low	23 Å²	23	100.7 Å²	100.7	12%	0.12	51%	0.505	C	S	.	.	H	α-helix	trans	-66.7	-37.3	176.8	-70.9	172.6	0	0	0	112.8	L98 A101 E102 L105 A115 N116 L122 T123	L98-L119 HydrophobicContact CD2-CD2 4.31Å; A101-L119 HydrophobicContact CB-CD2 4.36Å; E102-L119 HydrophobicContact CB-CD1 3.84Å; E102-L119 HydrophobicContact CB-CD2 4.27Å; E102-L119 HydrophobicContact CG-CD1 3.84Å; L105-L119 HydrophobicContact CD1-CD2 4.31Å; L105-L119 HydrophobicContact CD1-CG 4.19Å; A115-L119 WeakPolarHBondContact O-CG 3.35Å; A115-L119 PolarHBondContact O-N 3.09Å; N116-L119 PolarHBondContact O-N 3.09Å; L119-L122 HydrophobicContact CD2-CD1 4.43Å; L119-L122 PolarHBondContact O-N 3.06Å; L119-T123 PolarHBondContact O-N 2.69Å; L119-T123 PolarHBondContact O-OG1 3.21Å
120	L	72.2	Confident	63.9	Low	123 Å²	123	97.5 Å²	97.5	64%	0.644	50%	0.501	S	S	*	.	H	α-helix	trans	-63.3	-46.6	174.1	-75.6	167.7	0	0	0	111	N116 Q117 L122 T123 E124	N116-L120 WeakPolarHBondContact O-CB 3.21Å; N116-L120 VanDerWaalsContact O-CG 3.28Å; N116-L120 WeakPolarHBondContact O-CG 3.43Å; N116-L120 PolarHBondContact O-N 2.94Å; Q117-L120 PolarHBondContact O-N 3.05Å; L120-L122 PolarHBondContact O-N 3Å; L120-T123 PolarHBondContact O-N 2.98Å; L120-E124 PolarHBondContact O-N 3.01Å
121	A	72.1	Confident	62.4	Low	36 Å²	36	101.7 Å²	101.7	30%	0.298	52%	0.518	S	S	.	.	H	α-helix	trans	-63.7	-22.2	175.9	0	0	0	0	0	113.6	Q117 T118	Q117-A121 WeakPolarHBondContact O-CB 3.21Å; Q117-A121 PolarHBondContact O-N 3.29Å; T118-A121 PolarHBondContact O-N 3.05Å
122	L	68.4	Low	60.3	Low	25 Å²	25	105 Å²	105	13%	0.131	53%	0.529	C	S	.	.	H	α-helix	trans	-81.2	-33	172.2	-71.4	170.4	0	0	0	112.1	Y94 L98 T118 L119 L120 R211 P213	Y94-L122 PolarHBondContact OH-O 3.41Å; L98-L122 HydrophobicContact CD2-CB 4.15Å; T118-L122 HydrophobicContact CG2-CD1 4.49Å; T118-L122 VanDerWaalsContact O-CG 3.3Å; T118-L122 WeakPolarHBondContact O-CG 3.35Å; T118-L122 PolarHBondContact O-N 3.29Å; T118-L122 VanDerWaalsContact O-N 3.09Å; L119-L122 HydrophobicContact CD2-CD1 4.43Å; L119-L122 PolarHBondContact O-N 3.06Å; L120-L122 PolarHBondContact O-N 3Å; L122-R211 HydrophobicContact CD2-CB 3.87Å; L122-P213 HydrophobicContact CD1-CB 4.27Å
123	T	67.9	Low	58.3	Low	60 Å²	60	104.2 Å²	104.2	37%	0.368	53%	0.531	S	S	.	.	H	α-helix	trans	-85.7	-18.2	-176.9	-47.3	0	0	0	0	112.5	L119 L120 T125	L119-T123 PolarHBondContact O-N 2.69Å; L119-T123 PolarHBondContact O-OG1 3.21Å; L120-T123 PolarHBondContact O-N 2.98Å; T123-T125 PolarHBondContact O-N 3.41Å
124	E	73.3	Confident	56.2	Low	138 Å²	138	101.5 Å²	101.5	65%	0.645	54%	0.539	S	S	*	.	S	Bend	trans	-60.8	125.1	176.6	-163.3	168.1	-153.3	0	0	111.5	L120	L120-E124 PolarHBondContact O-N 3.01Å
125	T	63.5	Low	54.3	Low	57 Å²	57	104 Å²	104	35%	0.35	56%	0.56	S	S	.	*			trans	-69.9	130.2	174.1	47.3	0	0	0	0	109.1	T123 E127 E208	T123-T125 PolarHBondContact O-N 3.41Å; T125-E127 VanDerWaalsContact C-N 3.31Å; T125-E127 PolarHBondContact O-N 2.98Å; T125-E208 HydrophobicContact CG2-CB 4.43Å; T125-E208 HydrophobicContact CG2-CG 4.41Å; T125-E208 WeakPolarHBondContact CG2-OE2 3.42Å
126	V	65.1	Low	52.6	Low	55 Å²	55	112.9 Å²	112.9	33%	0.333	60%	0.599	S	S	.	*			trans	-79	87.3	175.6	-173.3	0	0	0	0	108.2	E128 Y193 V209	V126-E128 HydrophobicContact CG1-CG 4.1Å; V126-Y193 HydrophobicContact CG2-CD1 4.04Å; V126-Y193 HydrophobicContact CG2-CE1 3.59Å; V126-V209 PolarHBondContact N-O 3.27Å
127	E	52.2	Low	50.3	Low	175 Å²	175	117.2 Å²	117.2	82%	0.818	62%	0.617	S	S	*	*			trans	-87.6	113.9	160.9	-64.1	-168.5	160.9	0	0	107.2	T125	T125-E127 VanDerWaalsContact C-N 3.31Å; T125-E127 PolarHBondContact O-N 2.98Å
128	E	46.7	Very low	48	Very low	162 Å²	162	118.7 Å²	118.7	76%	0.757	62%	0.624	S	S	*	*			trans	-99.1	128.7	167.7	-76.4	-172.7	169.2	0	0	108.7	V126 E130	V126-E128 HydrophobicContact CG1-CG 4.1Å; E128-E130 PolarHBondContact O-N 3.33Å
129	E	35	Very low	46.2	Very low	192 Å²	192	120.7 Å²	120.7	90%	0.897	64%	0.638	S	S	*	*			trans	-52.8	126.8	179.1	-62.8	-179.8	159.4	0	0	110.2	E131	E129-E131 PolarHBondContact O-N 3.43Å; E129-E131 VanDerWaalsContact O-N 3.11Å
130	E	30.9	Very low	43.9	Very low	170 Å²	170	123.6 Å²	123.6	79%	0.794	67%	0.674	S	S	*	*			trans	-65.7	108.6	167	-65.2	-173.2	159.7	0	0	107.2	E128 E132	E128-E130 PolarHBondContact O-N 3.33Å; E130-E132 PolarHBondContact O-N 2.97Å
131	E	29.8	Very low	41.5	Very low	173 Å²	173	121.7 Å²	121.7	81%	0.808	68%	0.683	S	S	*	*			trans	-62.3	95.9	160.7	-81	-172.3	163.3	0	0	107.2	E129 N133	E129-E131 PolarHBondContact O-N 3.43Å; E129-E131 VanDerWaalsContact O-N 3.11Å; E131-N133 PolarHBondContact O-N 2.96Å
132	E	29.1	Very low	39.1	Very low	181 Å²	181	123.8 Å²	123.8	85%	0.846	71%	0.709	S	S	*	*			trans	-58.1	88.9	164.8	-86.4	-170.2	148.6	0	0	108.4	E130 G134	E130-E132 PolarHBondContact O-N 2.97Å; E132-G134 PolarHBondContact O-N 2.84Å
133	N	29.1	Very low	37	Very low	143 Å²	143	127.8 Å²	127.8	77%	0.765	75%	0.745	S	S	*	*			trans	-72.4	88.8	161.1	-81	-47.2	0	0	0	108	E131 A135	E131-N133 PolarHBondContact O-N 2.96Å; N133-A135 PolarHBondContact O-N 3.23Å; N133-A135 VanDerWaalsContact O-N 3.15Å
134	G	27.6	Very low	34.8	Very low	79 Å²	79	130.6 Å²	130.6	81%	0.814	77%	0.766	S	S	*	*			trans	-58.4	110.8	165.2	0	0	0	0	0	109.9	E132	E132-G134 PolarHBondContact O-N 2.84Å
135	A	29.3	Very low	32.4	Very low	95 Å²	95	130.7 Å²	130.7	79%	0.785	78%	0.776	S	S	*	*			trans	-100.5	113.9	170.1	0	0	0	0	0	108.8	N133	N133-A135 PolarHBondContact O-N 3.23Å; N133-A135 VanDerWaalsContact O-N 3.15Å
136	E	27.2	Very low	30.5	Very low	196 Å²	196	135.3 Å²	135.3	92%	0.916	80%	0.797	S	S	*	*			trans	-64	136	167.1	-67.5	-179.6	147.1	0	0	110.7
137	E	23.4	Very low	28.5	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	82%	0.822	S	S	*	*			trans	-64.2	128.2	168.6	-79.6	-176.3	164.7	0	0	110.8
138	E	23.6	Very low	27.1	Very low	164 Å²	164	142.7 Å²	142.7	77%	0.766	83%	0.827	S	S	*	*				140.5	175.6	78	-95	-96.3	129.8	0	0	105.7
139	P	32.4	Very low	26	Very low	108 Å²	108	145.5 Å²	145.5	70%	0.701	83%	0.831	S	S	*	*			cis	-129.8	163.5	-18.7	22.2	0.2	0	0	0	114.5
140	G	22.3	Very low	25.4	Very low	84 Å²	84	144.5 Å²	144.5	87%	0.866	83%	0.83	S	S	*	*			trans	112.6	120.7	133.4	0	0	0	0	0	118.6
141	G	22.5	Very low	24.9	Very low	82 Å²	82	139.9 Å²	139.9	85%	0.845	83%	0.829	S	S	*	*			trans	133.4	75.1	156.7	0	0	0	0	0	114.1
142	G	21.9	Very low	24.6	Very low	81 Å²	81	136.3 Å²	136.3	84%	0.835	83%	0.829	S	S	*	*			trans	-77.7	159	-176.8	0	0	0	0	0	115.6
143	A	24	Very low	24.2	Very low	108 Å²	108	136.6 Å²	136.6	89%	0.893	83%	0.83	S	S	*	*			trans	-162.5	110.8	140	0	0	0	0	0	108.8
144	C	21.3	Very low	23.9	Very low	119 Å²	119	135.7 Å²	135.7	80%	0.804	84%	0.835	S	S	*	*			trans	-86.2	132	175.9	178	0	0	0	0	109.6
145	V	23.6	Very low	23.6	Very low	141 Å²	141	141.4 Å²	141.4	86%	0.855	84%	0.838	S	S	*	*			trans	-148	100.2	144.2	-172.4	0	0	0	0	111.3
146	L	23.1	Very low	23.9	Very low	153 Å²	153	142.1 Å²	142.1	80%	0.801	83%	0.834	S	S	*	*				51.5	120	123.8	-145.9	76.6	0	0	0	121.7
147	M	22.9	Very low	23.6	Very low	173 Å²	173	142 Å²	142	85%	0.852	83%	0.834	S	S	*	*			trans	-34.2	147.4	155.1	-71.8	-171.6	170.6	0	0	116.2
148	K	23.5	Very low	23.6	Very low	213 Å²	213	140.7 Å²	140.7	93%	0.926	83%	0.832	S	S	*	*				-161.4	137.6	109.8	-121.2	171.4	-179.2	174	0	113.9
149	R	23.2	Very low	23.7	Very low	220 Å²	220	144.9 Å²	144.9	83%	0.83	84%	0.841	S	S	*	*			trans	-99.4	168.9	179.5	-158.3	-177.2	-157.7	-179.5	5.7	108.9
150	L	22.3	Very low	23.2	Very low	171 Å²	171	146.3 Å²	146.3	90%	0.895	84%	0.843	S	S	*	*			trans	87.3	134.6	162.4	-49.9	158.4	0	0	0	114.3
151	G	20.6	Very low	23.3	Very low	74 Å²	74	148.5 Å²	148.5	76%	0.763	84%	0.844	S	S	*	*			cis	157.7	157.5	4.4	0	0	0	0	0	109.8
152	A	22.8	Very low	23.3	Very low	97 Å²	97	155.4 Å²	155.4	80%	0.802	84%	0.844	S	S	*	*			trans	76.9	110.6	156.7	0	0	0	0	0	121.8
153	E	20.6	Very low	23.5	Very low	188 Å²	188	157.7 Å²	157.7	88%	0.879	85%	0.847	S	S	*	*				44.1	120.4	125	-59.9	-174.7	138.3	0	0	122.3
154	S	23.2	Very low	23.5	Very low	124 Å²	124	160.2 Å²	160.2	87%	0.867	85%	0.846	S	S	*	*				172.7	146	105.4	44.6	0	0	0	0	112.6
155	K	21.4	Very low	24.1	Very low	199 Å²	199	159.7 Å²	159.7	87%	0.865	84%	0.841	S	S	*	*			trans	-79	-172.1	175.4	-72.7	-179.8	174.7	177.7	0	111.5
156	P	35.2	Very low	24.2	Very low	110 Å²	110	162.3 Å²	162.3	71%	0.714	84%	0.844	S	S	*	*			cis	-127.6	176.5	-39.5	27.4	-7	0	0	0	111.7
157	E	22.5	Very low	24.2	Very low	194 Å²	194	162.3 Å²	162.3	91%	0.907	85%	0.845	S	S	*	*			trans	171.9	159.4	130.3	-95.5	-175.3	-172.7	0	0	113.8
158	D	23.2	Very low	24.5	Very low	152 Å²	152	161.8 Å²	161.8	81%	0.813	85%	0.845	S	S	*	*			trans	-63.6	148.6	-161.5	-76.1	-50.6	0	0	0	117.3
159	R	25.3	Very low	24.5	Very low	251 Å²	251	158.5 Å²	158.5	95%	0.947	84%	0.837	S	S	*	*				-163.4	119.3	129	-110.2	168.6	-178.5	-173	0.4	113.6
160	N	21.7	Very low	24.6	Very low	138 Å²	138	156.5 Å²	156.5	74%	0.738	84%	0.837	S	S	*	*			trans	-51.5	140.6	167.4	-171.2	27.7	0	0	0	113.4
161	C	23.6	Very low	24.7	Very low	131 Å²	131	156 Å²	156	89%	0.885	84%	0.836	S	S	*	*			trans	-163.1	130.4	141.1	-93.4	0	0	0	0	111.5
162	R	23.2	Very low	25	Very low	226 Å²	226	158.7 Å²	158.7	85%	0.853	84%	0.837	S	S	*	*			trans	-84.3	144.6	173.1	-64.1	171.4	168.7	-179	-5.2	110.2
163	S	26.1	Very low	25.2	Very low	130 Å²	130	162.7 Å²	162.7	91%	0.909	84%	0.839	S	S	*	*				-174.5	144.3	129	14.7	0	0	0	0	111.6
164	D	23.8	Very low	25.5	Very low	160 Å²	160	158.5 Å²	158.5	86%	0.856	83%	0.828	S	S	*	*			trans	-93.7	-175.1	-177.1	-121.9	-15	0	0	0	110.3
165	P	34.8	Very low	25.5	Very low	109 Å²	109	159.5 Å²	159.5	71%	0.708	82%	0.823	S	S	*	*				-102.6	160.4	-126.7	41.4	-36.8	0	0	0	114.6
166	Q	24.4	Very low	26	Very low	196 Å²	196	155.6 Å²	155.6	92%	0.916	82%	0.821	S	S	*	*			trans	-139.6	128.6	158	-70.9	-169.6	-18.9	0	0	111.6
167	N	24.8	Very low	25.4	Very low	153 Å²	153	157.8 Å²	157.8	82%	0.818	83%	0.827	S	S	*	*			trans	-44.4	151.1	166	-70	-44.5	0	0	0	112.3
168	L	27.9	Very low	26	Very low	162 Å²	162	154.1 Å²	154.1	85%	0.848	82%	0.823	S	S	*	*			trans	-162.9	112.3	131.1	-98.2	165.5	0	0	0	108.4
169	D	23.2	Very low	26	Very low	144 Å²	144	153.7 Å²	153.7	77%	0.77	82%	0.82	S	S	*	*			trans	-56.7	141.8	159.8	-67.4	-51.4	0	0	0	109.9
170	Q	27.1	Very low	26.4	Very low	178 Å²	178	147.2 Å²	147.2	83%	0.832	81%	0.814	S	S	*	*			trans	-161.2	112.1	144.9	-111.9	161.2	55.8	0	0	111
171	D	23.1	Very low	26.6	Very low	161 Å²	161	149 Å²	149	86%	0.861	82%	0.817	S	S	*	*			trans	-59.6	128.1	166.1	-63.4	-58.8	0	0	0	111.3
172	V	27.4	Very low	27.2	Very low	130 Å²	130	149.1 Å²	149.1	79%	0.788	82%	0.815	S	S	*	*			trans	-144.6	103.3	156	-177.2	0	0	0	0	108
173	E	25.8	Very low	27.3	Very low	180 Å²	180	143.3 Å²	143.3	84%	0.841	81%	0.808	S	S	*	*			trans	-71.4	144.2	153.5	-75.4	-115.4	150.7	0	0	108.6
174	P	28.8	Very low	28	Very low	100 Å²	100	142.9 Å²	142.9	65%	0.649	81%	0.805	S	S	*	*				-149.6	149.2	102.2	33.9	-14.9	0	0	0	116.5
175	N	22.7	Very low	28.1	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	79%	0.792	S	S	*	*			trans	73.3	125	137.1	-63.7	-16.7	0	0	0	121.2
176	S	31.3	Very low	27.9	Very low	117 Å²	117	138.5 Å²	138.5	82%	0.818	79%	0.793	S	S	*	*			trans	-49.8	127.9	159.9	-56.3	0	0	0	0	112.5
177	D	22.8	Very low	27.9	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	79%	0.791	S	S	*	*			trans	-138.3	138.8	143.2	-90.8	-38.2	0	0	0	109.2
178	S	34.2	Very low	28.2	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	79%	0.787	S	S	*	*			trans	-94.2	93.1	-169.9	179.3	0	0	0	0	108.3
179	D	23.8	Very low	28.5	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	76%	0.763	S	S	*	*			trans	-104.8	111.7	174.3	-75.5	-31.4	0	0	0	111.4	E181	D179-E181 PolarHBondContact O-N 3.25Å; D179-E181 VanDerWaalsContact O-N 3.07Å
180	S	34.8	Very low	29.2	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	75%	0.749	S	S	*	*			trans	-68	90.7	166.5	50.7	0	0	0	0	109.8	T182	S180-T182 PolarHBondContact O-N 3.09Å
181	E	25.9	Very low	30.4	Very low	175 Å²	175	126.7 Å²	126.7	82%	0.818	75%	0.751	S	S	*	*			trans	-83.6	109.7	169.9	-71.8	-156.7	153.4	0	0	110.9	D179 S183	D179-E181 PolarHBondContact O-N 3.25Å; D179-E181 VanDerWaalsContact O-N 3.07Å; E181-S183 VanDerWaalsContact C-N 3.32Å; E181-S183 PolarHBondContact O-N 3.29Å
182	T	34.9	Very low	32.4	Very low	135 Å²	135	120.4 Å²	120.4	83%	0.828	72%	0.724	S	S	*	*			trans	-70.3	89.5	165.2	-52	0	0	0	0	107.3	S180 S184	S180-T182 PolarHBondContact O-N 3.09Å; T182-S184 PolarHBondContact O-N 2.83Å
183	S	25.3	Very low	34.7	Very low	103 Å²	103	117.5 Å²	117.5	72%	0.72	70%	0.7	S	S	*	*			trans	-78.4	106.8	173.7	72.2	0	0	0	0	109.2	E181 G185	E181-S183 VanDerWaalsContact C-N 3.32Å; E181-S183 PolarHBondContact O-N 3.29Å; S183-G185 PolarHBondContact O-N 3.23Å
184	S	41.3	Very low	37.3	Very low	121 Å²	121	109 Å²	109	85%	0.846	66%	0.66	S	S	*	*			trans	-62	83.6	161.6	-61.9	0	0	0	0	108.9	T182	T182-S184 PolarHBondContact O-N 2.83Å
185	G	25.9	Very low	39.9	Very low	55 Å²	55	104.3 Å²	104.3	57%	0.567	63%	0.629	S	S	*	*			trans	-81.3	117.8	-178.2	0	0	0	0	0	110.9	S183 R187	S183-G185 PolarHBondContact O-N 3.23Å; G185-R187 PolarHBondContact O-N 3.39Å; G185-R187 VanDerWaalsContact O-N 3.09Å
186	V	30.9	Very low	42.8	Very low	122 Å²	122	97.4 Å²	97.4	74%	0.739	59%	0.592	S	S	*	*			trans	-48.6	112.5	162.8	173.2	0	0	0	0	108.8	V188	V186-V188 PolarHBondContact O-N 3.01Å
187	R	24.5	Very low	45.3	Very low	233 Å²	233	94.3 Å²	94.3	88%	0.879	57%	0.567	S	S	*	*			trans	-74.1	106.3	170.1	-73	-174.2	178.6	-174.4	1.3	108	G185 P189	G185-R187 PolarHBondContact O-N 3.39Å; G185-R187 VanDerWaalsContact O-N 3.09Å; R187-P189 WeakPolarHBondContact O-CD 3.05Å
188	V	29.9	Very low	48.1	Very low	120 Å²	120	88.2 Å²	88.2	73%	0.727	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-66.9	119.1	166.3	-179	0	0	0	0	106.9	V186 G190	V186-V188 PolarHBondContact O-N 3.01Å; V188-G190 PolarHBondContact O-N 3.01Å
189	P	35.3	Very low	49.5	Very low	52 Å²	52	89.5 Å²	89.5	34%	0.338	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-62.3	127.3	167.3	-16.2	31.5	0	0	0	107.1	V84 R187 Y193	V84-P189 HydrophobicContact CB-CG 4.33Å; V84-P189 VanDerWaalsContact CG1-CD 3.41Å; V84-P189 HydrophobicContact CG1-CG 3.78Å; V84-P189 VanDerWaalsContact CG2-CD 3.47Å; V84-P189 HydrophobicContact CG2-CG 3.73Å; R187-P189 WeakPolarHBondContact O-CD 3.05Å; P189-Y193 HydrophobicContact CB-CD2 4Å; P189-Y193 HydrophobicContact CB-CE2 4.3Å
190	G	37.6	Very low	51	Low	47 Å²	47	85 Å²	85	49%	0.485	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-57.2	170	178.8	0	0	0	0	0	112.9	V188 G192	V188-G190 PolarHBondContact O-N 3.01Å; G190-G192 PolarHBondContact O-N 3.41Å
191	P	52.5	Low	51.9	Low	134 Å²	134	89.4 Å²	89.4	87%	0.87	52%	0.518	S	S	*	.	S	Bend	trans	-56.2	112.2	177.6	24.5	-33	0	0	0	109.7
192	G	64.9	Low	52.9	Low	29 Å²	29	88.6 Å²	88.6	30%	0.299	52%	0.519	S	S	.	.			trans	162.3	0.1	-176.8	0	0	0	0	0	117.4	G190 R211 S212	G190-G192 PolarHBondContact O-N 3.41Å; G192-R211 CarbonylContact O-C 3.52Å; G192-R211 WeakPolarHBondContact O-CA 3.37Å; G192-S212 PolarHBondContact O-N 2.89Å
193	Y	75.1	Confident	53.4	Low	69 Å²	69	86.5 Å²	86.5	27%	0.271	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.3	178	-63.5	-86.3	0	0	0	111.6	V126 P189 V209 R210 R211	V126-Y193 HydrophobicContact CG2-CD1 4.04Å; V126-Y193 HydrophobicContact CG2-CE1 3.59Å; P189-Y193 HydrophobicContact CB-CD2 4Å; P189-Y193 HydrophobicContact CB-CE2 4.3Å; Y193-V209 HydrophobicContact CD1-CG1 4.25Å; Y193-R210 WeakPolarHBondContact CA-O 3.44Å; Y193-R211 HydrophobicContact CD1-CG 3.85Å; Y193-R211 HydrophobicContact CE1-CG 3.42Å; Y193-R211 VanDerWaalsContact CE1-CG 3.42Å
194	V	80.4	Confident	54.6	Low	1 Å²	1	84.1 Å²	84.1	1%	0.006	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	144.5	-177	-68.1	0	0	0	0	109.3	P87 I89 Y94 V196 R210	P87-V194 HydrophobicContact CG-CG1 4.13Å; I89-V194 HydrophobicContact CD1-CB 3.75Å; I89-V194 HydrophobicContact CD1-CG1 4.11Å; I89-V194 HydrophobicContact CD1-CG2 3.65Å; I89-V194 HydrophobicContact CG1-CB 4.18Å; I89-V194 HydrophobicContact CG1-CG2 4.41Å; Y94-V194 HydrophobicContact CD2-CG2 3.98Å; Y94-V194 HydrophobicContact CE2-CG2 3.73Å; V194-V196 HydrophobicContact CG2-CG2 4.15Å; V194-R210 PolarHBondContact N-O 3.38Å; V194-R210 PolarHBondContact O-N 2.94Å
195	L	83.6	Confident	55.4	Low	1 Å²	1	80.5 Å²	80.5	1%	0.005	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	114.4	171.4	-158.6	88.6	0	0	0	108	E79 H81 L86 P87 V88 I89 R207 V209	E79-L195 HydrophobicContact CB-CD2 4.49Å; H81-L195 HydrophobicContact CB-CD1 3.95Å; L86-L195 HydrophobicContact CB-CB 4.4Å; L86-L195 HydrophobicContact CD1-CD1 4.49Å; P87-L195 PolarHBondContact O-N 3.38Å; V88-L195 CarbonylContact C-O 3.57Å; V88-L195 WeakPolarHBondContact CA-O 3.29Å; V88-L195 HydrophobicContact CG2-CB 4.25Å; V88-L195 HydrophobicContact CG2-CD2 3.96Å; I89-L195 PolarHBondContact N-O 2.85Å; L195-R207 HydrophobicContact CD2-CB 4.05Å; L195-R207 HydrophobicContact CD2-CG 4.23Å; L195-R207 HydrophobicContact CG-CB 4.21Å; L195-V209 HydrophobicContact CD1-CG2 3.74Å
196	V	83.6	Confident	57.6	Low	0 Å²	0	80.4 Å²	80.4	0%	0	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.1	-179.6	-173.5	0	0	0	0	108.9	I89 Q91 Y94 V194 L198 R207 E208 R210	I89-V196 HydrophobicContact CD1-CG2 4.18Å; I89-V196 HydrophobicContact CG1-CG2 4.12Å; I89-V196 WeakPolarHBondContact O-CA 3.43Å; Q91-V196 HydrophobicContact CB-CG1 4.15Å; Y94-V196 HydrophobicContact CD1-CG2 4.26Å; Y94-V196 HydrophobicContact CD2-CG2 3.59Å; Y94-V196 HydrophobicContact CE2-CG2 3.95Å; Y94-V196 HydrophobicContact CG-CG1 4.28Å; Y94-V196 HydrophobicContact CG-CG2 3.71Å; V194-V196 HydrophobicContact CG2-CG2 4.15Å; V196-L198 HydrophobicContact CG1-CD2 4.37Å; V196-L198 PolarHBondContact O-N 2.91Å; V196-R207 WeakPolarHBondContact O-CA 3.23Å; V196-E208 PolarHBondContact N-O 2.86Å; V196-E208 PolarHBondContact O-N 2.97Å; V196-E208 VanDerWaalsContact O-N 3.11Å; V196-R210 HydrophobicContact CG2-CB 4.16Å; V196-R210 HydrophobicContact CG2-CG 4.12Å
197	D	85	Confident	60	Low	52 Å²	52	79.6 Å²	79.6	28%	0.278	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	108.4	173.4	-158.7	11.2	0	0	0	108.6	V88 I89 Q91 R207	V88-D197 HydrophobicContact CG1-CB 4.42Å; I89-D197 PolarHBondContact O-N 2.82Å; Q91-D197 WeakPolarHBondContact CB-O 3.33Å; Q91-D197 PolarHBondContact N-O 2.75Å; D197-R207 IonicContact OD1-NE 3.07Å
198	L	80.1	Confident	62.9	Low	28 Å²	28	71.3 Å²	71.3	15%	0.147	45%	0.447	C	S	.	.			trans	-79.3	123.2	176.3	-58.8	173.5	0	0	0	108.3	Q91 V196 A200 A206 E208	Q91-L198 HydrophobicContact CB-CD2 4.33Å; Q91-L198 HydrophobicContact CG-CD2 4.13Å; V196-L198 HydrophobicContact CG1-CD2 4.37Å; V196-L198 PolarHBondContact O-N 2.91Å; L198-A200 PolarHBondContact O-N 2.84Å; L198-A206 VanDerWaalsContact CB-O 3.24Å; L198-A206 WeakPolarHBondContact CB-O 3.38Å; L198-A206 HydrophobicContact CD1-CB 4.14Å; L198-A206 WeakPolarHBondContact CG-O 3.47Å; L198-A206 PolarHBondContact N-O 3.32Å; L198-E208 HydrophobicContact CD1-CG 3.93Å; L198-E208 WeakPolarHBondContact CD1-OE1 3.06Å
199	E	64.8	Low	65.4	Low	144 Å²	144	66.9 Å²	66.9	67%	0.673	42%	0.42	S	S	*	.			trans	-68	97	177.3	-68.2	-178.4	-169.3	0	0	109
200	A	55.9	Low	67.6	Low	50 Å²	50	66 Å²	66	41%	0.413	41%	0.41	S	S	.	.			trans	-77.9	129.2	176.1	0	0	0	0	0	110.5	L198 D202 G204	L198-A200 PolarHBondContact O-N 2.84Å; A200-D202 PolarHBondContact O-N 2.92Å; A200-G204 WeakPolarHBondContact CB-O 3.32Å
201	Q	52.3	Low	69.5	Low	207 Å²	207	69.1 Å²	69.1	97%	0.967	41%	0.407	S	S	*	.	S	Bend	trans	-66.9	-9.2	171.8	-85	175.7	7.3	0	0	113.5
202	D	46.3	Very low	70.6	Confident	157 Å²	157	63.3 Å²	63.3	84%	0.84	37%	0.37	S	S	*	.	S	Bend	trans	-142.2	68.4	-173.6	-142	13.7	0	0	0	112	A200 G204	A200-D202 PolarHBondContact O-N 2.92Å; D202-G204 PolarHBondContact O-N 2.62Å
203	G	46.6	Very low	71	Confident	92 Å²	92	62.5 Å²	62.5	95%	0.948	36%	0.359	S	S	*	.	S	Bend	trans	64.9	-10.8	156.4	0	0	0	0	0	120.1
204	G	49.6	Very low	70.6	Confident	52 Å²	52	61 Å²	61	54%	0.536	36%	0.355	S	S	.	.			trans	-120.4	91.7	176.4	0	0	0	0	0	110.8	A200 D202 A206	A200-G204 WeakPolarHBondContact CB-O 3.32Å; D202-G204 PolarHBondContact O-N 2.62Å; G204-A206 PolarHBondContact O-N 3.17Å; G204-A206 VanDerWaalsContact O-N 3.13Å
205	G	58.4	Low	69.7	Low	45 Å²	45	65 Å²	65	46%	0.464	39%	0.389	S	S	.	.			trans	-63.2	111.3	175.9	0	0	0	0	0	110.7
206	A	73.1	Confident	68.9	Low	54 Å²	54	68.6 Å²	68.6	45%	0.446	41%	0.408	S	S	.	.			trans	-76	133.3	170.4	0	0	0	0	0	108.6	L198 G204	L198-A206 VanDerWaalsContact CB-O 3.24Å; L198-A206 WeakPolarHBondContact CB-O 3.38Å; L198-A206 HydrophobicContact CD1-CB 4.14Å; L198-A206 WeakPolarHBondContact CG-O 3.47Å; L198-A206 PolarHBondContact N-O 3.32Å; G204-A206 PolarHBondContact O-N 3.17Å; G204-A206 VanDerWaalsContact O-N 3.13Å
207	R	81	Confident	68.1	Low	105 Å²	105	71.3 Å²	71.3	40%	0.396	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	126.8	-177.5	-72.7	167.3	173	-170.8	-13.9	109.2	E79 L195 V196 D197	E79-R207 IonicContact OE1-CZ 3.3Å; E79-R207 IonicContact OE1-NH1 2.7Å; E79-R207 PolarHBondContact OE1-NH1 2.55Å; E79-R207 IonicContact OE2-CZ 2.97Å; E79-R207 IonicContact OE2-NH1 3.55Å; E79-R207 PolarHBondContact OE2-NH1 3.45Å; E79-R207 IonicContact OE2-NH2 2.67Å; L195-R207 HydrophobicContact CD2-CB 4.05Å; L195-R207 HydrophobicContact CD2-CG 4.23Å; L195-R207 HydrophobicContact CG-CB 4.21Å; V196-R207 WeakPolarHBondContact O-CA 3.23Å; D197-R207 IonicContact OD1-NE 3.07Å
208	E	84.9	Confident	67.8	Low	59 Å²	59	69.7 Å²	69.7	28%	0.276	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.7	-176.5	-68.7	178.8	-178.4	0	0	110.5	T125 V196 L198 R210	T125-E208 HydrophobicContact CG2-CB 4.43Å; T125-E208 HydrophobicContact CG2-CG 4.41Å; T125-E208 WeakPolarHBondContact CG2-OE2 3.42Å; V196-E208 PolarHBondContact N-O 2.86Å; V196-E208 PolarHBondContact O-N 2.97Å; V196-E208 VanDerWaalsContact O-N 3.11Å; L198-E208 HydrophobicContact CD1-CG 3.93Å; L198-E208 WeakPolarHBondContact CD1-OE1 3.06Å; E208-R210 HydrophobicContact CB-CG 4.37Å; E208-R210 IonicContact OE2-CZ 3.7Å; E208-R210 VanDerWaalsContact OE2-CZ 3.3Å; E208-R210 IonicContact OE2-NE 3.74Å; E208-R210 PolarHBondContact OE2-NE 3.22Å; E208-R210 IonicContact OE2-NH2 2.92Å; E208-R210 PolarHBondContact OE2-NH2 2.93Å
209	V	82.6	Confident	68	Low	27 Å²	27	72.7 Å²	72.7	16%	0.164	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	118	169.8	-179.1	0	0	0	0	107.8	H81 L86 V126 Y193 L195	H81-V209 WeakPolarHBondContact ND1-CG2 3.4Å; L86-V209 HydrophobicContact CD1-CG1 3.99Å; L86-V209 HydrophobicContact CD1-CG2 3.92Å; V126-V209 PolarHBondContact N-O 3.27Å; Y193-V209 HydrophobicContact CD1-CG1 4.25Å; L195-V209 HydrophobicContact CD1-CG2 3.74Å
210	R	82.2	Confident	69.2	Low	34 Å²	34	65.8 Å²	65.8	13%	0.128	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	161.7	176.1	-58.3	-169.9	-177.8	178.5	-5.3	111	Y94 Y193 V194 V196 E208	Y94-R210 HydrophobicContact CE1-CB 4.45Å; Y94-R210 HydrophobicContact CE2-CB 3.93Å; Y94-R210 WeakPolarHBondContact OH-CB 3.08Å; Y193-R210 WeakPolarHBondContact CA-O 3.44Å; V194-R210 PolarHBondContact N-O 3.38Å; V194-R210 PolarHBondContact O-N 2.94Å; V196-R210 HydrophobicContact CG2-CB 4.16Å; V196-R210 HydrophobicContact CG2-CG 4.12Å; E208-R210 HydrophobicContact CB-CG 4.37Å; E208-R210 IonicContact OE2-CZ 3.7Å; E208-R210 VanDerWaalsContact OE2-CZ 3.3Å; E208-R210 IonicContact OE2-NE 3.74Å; E208-R210 PolarHBondContact OE2-NE 3.22Å; E208-R210 IonicContact OE2-NH2 2.92Å; E208-R210 PolarHBondContact OE2-NH2 2.93Å
211	R	77	Confident	71	Confident	111 Å²	111	66.3 Å²	66.3	42%	0.419	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	139.7	172.5	-76.1	-176.9	174.5	173.1	4	109.9	Y94 L122 G192 Y193 P213	Y94-R211 WeakPolarHBondContact CE2-O 3.32Å; Y94-R211 PolarHBondContact OH-O 3.25Å; L122-R211 HydrophobicContact CD2-CB 3.87Å; G192-R211 CarbonylContact O-C 3.52Å; G192-R211 WeakPolarHBondContact O-CA 3.37Å; Y193-R211 HydrophobicContact CD1-CG 3.85Å; Y193-R211 HydrophobicContact CE1-CG 3.42Å; Y193-R211 VanDerWaalsContact CE1-CG 3.42Å; R211-P213 VanDerWaalsContact O-CD 3.29Å; R211-P213 WeakPolarHBondContact O-CD 3.26Å
212	S	75.9	Confident	73	Confident	13 Å²	13	56.5 Å²	56.5	9%	0.091	34%	0.341	C	S	.	.			trans	-65.8	121.5	174.4	-167.6	0	0	0	0	109	I74 G192 L214	I74-S212 WeakPolarHBondContact CD1-OG 3.34Å; G192-S212 PolarHBondContact O-N 2.89Å; S212-L214 PolarHBondContact O-N 2.72Å; S212-L214 VanDerWaalsContact O-N 3.16Å; S212-L214 PolarHBondContact OG-O 3.35Å
213	P	72.4	Confident	75.2	Confident	11 Å²	11	50.9 Å²	50.9	7%	0.071	31%	0.314	C	S	.	.	S	Bend	trans	-63.6	-22.3	-178.1	-25.3	36.8	0	0	0	113.4	Y94 L97 L98 A101 L122 R211	Y94-P213 HydrophobicContact CD2-CG 4.08Å; Y94-P213 HydrophobicContact CE2-CG 3.63Å; L97-P213 HydrophobicContact CB-CB 4.17Å; L97-P213 HydrophobicContact CB-CG 4.05Å; L98-P213 HydrophobicContact CD2-CB 3.88Å; L98-P213 HydrophobicContact CD2-CG 3.72Å; L98-P213 HydrophobicContact CG-CB 4.2Å; L98-P213 HydrophobicContact CG-CG 3.75Å; A101-P213 HydrophobicContact CB-CB 4.18Å; L122-P213 HydrophobicContact CD1-CB 4.27Å; R211-P213 VanDerWaalsContact O-CD 3.29Å; R211-P213 WeakPolarHBondContact O-CD 3.26Å
214	L	68	Low	77.6	Confident	37 Å²	37	46.5 Å²	46.5	19%	0.194	27%	0.269	C	S	.	.	S	Bend	trans	-132.8	119.3	-179.2	-64.9	175.1	0	0	0	109.6	L97 W100 A101 S212 L216	L97-L214 HydrophobicContact CD2-CD1 3.99Å; W100-L214 HydrophobicContact CB-CD1 3.96Å; W100-L214 HydrophobicContact CE3-CD1 3.98Å; A101-L214 HydrophobicContact CB-CD2 3.84Å; A101-L214 HydrophobicContact CB-CG 4.34Å; S212-L214 PolarHBondContact O-N 2.72Å; S212-L214 VanDerWaalsContact O-N 3.16Å; S212-L214 PolarHBondContact OG-O 3.35Å; L214-L216 HydrophobicContact CB-CG 4.15Å; L214-L216 PolarHBondContact O-N 3.17Å
215	A	61.3	Low	79.8	Confident	85 Å²	85	44.9 Å²	44.9	70%	0.702	25%	0.247	S	C	*	.			trans	-77.1	72.6	167.8	0	0	0	0	0	110	T217	A215-T217 VanDerWaalsContact C-N 3.28Å; A215-T217 PolarHBondContact O-N 3.13Å
216	L	65.8	Low	81.5	Confident	78 Å²	78	43.3 Å²	43.3	41%	0.408	23%	0.228	S	C	.	.			trans	-74.7	83.5	172	-69.3	173.4	0	0	0	109.5	L65 L214	L65-L216 HydrophobicContact CD1-CB 4.24Å; L214-L216 HydrophobicContact CB-CG 4.15Å; L214-L216 PolarHBondContact O-N 3.17Å
217	T	66.3	Low	82.6	Confident	57 Å²	57	40.7 Å²	40.7	35%	0.35	21%	0.206	S	C	.	.			trans	-77.9	129.6	173.4	50.2	0	0	0	0	110	A215 Y219	A215-T217 VanDerWaalsContact C-N 3.28Å; A215-T217 PolarHBondContact O-N 3.13Å; T217-Y219 WeakPolarHBondContact O-CD2 3.46Å; T217-Y219 WeakPolarHBondContact O-CE2 3.16Å; T217-Y219 VanDerWaalsContact OG1-CE2 3.3Å; T217-Y219 WeakPolarHBondContact OG1-CE2 3.37Å; T217-Y219 PolarHBondContact OG1-OH 3.08Å
218	E	79.4	Confident	83.4	Confident	18 Å²	18	35.7 Å²	35.7	8%	0.084	19%	0.188	C	C	.	.			trans	-65.8	138.8	168.6	-176.3	64.5	-86.9	0	0	109.5	I51 V64 L65 S66 P70 H72	I51-E218 WeakPolarHBondContact CD1-O 3.27Å; V64-E218 PolarHBondContact N-OE1 3.37Å; L65-E218 WeakPolarHBondContact CB-OE2 3.32Å; L65-E218 PolarHBondContact N-OE1 2.82Å; L65-E218 PolarHBondContact N-OE2 3.06Å; S66-E218 VanDerWaalsContact CB-OE2 3.24Å; S66-E218 WeakPolarHBondContact CB-OE2 3.49Å; S66-E218 PolarHBondContact N-OE2 3.04Å; S66-E218 PolarHBondContact OG-OE2 2.76Å; P70-E218 HydrophobicContact CB-CG 4.07Å; H72-E218 HydrophobicContact CB-CB 4.14Å; H72-E218 HydrophobicContact CB-CG 4.41Å; H72-E218 WeakPolarHBondContact CB-OE2 3.38Å
219	Y	85.3	Confident	83.9	Confident	90 Å²	90	33.9 Å²	33.9	35%	0.353	18%	0.179	S	C	.	.			trans	-121.3	140.1	174.1	-57.7	-86	0	0	0	108.7	C46 V64 T217	C46-Y219 HydrophobicContact CB-CD1 3.64Å; C46-Y219 HydrophobicContact CB-CE1 3.67Å; C46-Y219 WeakPolarHBondContact SG-CD1 3.44Å; C46-Y219 VanDerWaalsContact SG-CE1 3.54Å; V64-Y219 PolarHBondContact N-O 3.48Å; T217-Y219 WeakPolarHBondContact O-CD2 3.46Å; T217-Y219 WeakPolarHBondContact O-CE2 3.16Å; T217-Y219 VanDerWaalsContact OG1-CE2 3.3Å; T217-Y219 WeakPolarHBondContact OG1-CE2 3.37Å; T217-Y219 PolarHBondContact OG1-OH 3.08Å
220	L	90	Very high	84.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.9	171.6	-175	72.6	0	0	0	109.4	V45 I51 I54 P70 L222	V45-L220 HydrophobicContact CB-CB 4.2Å; V45-L220 PolarHBondContact N-O 2.97Å; V45-L220 PolarHBondContact O-N 3.37Å; I51-L220 HydrophobicContact CB-CB 4.3Å; I51-L220 HydrophobicContact CG1-CB 3.79Å; I51-L220 HydrophobicContact CG2-CB 4.04Å; I54-L220 HydrophobicContact CB-CD2 4.07Å; I54-L220 HydrophobicContact CG2-CD2 3.68Å; P70-L220 HydrophobicContact CB-CD1 4.19Å; P70-L220 HydrophobicContact CG-CD1 4.1Å; L220-L222 HydrophobicContact CD2-CD2 4.13Å; L220-L222 HydrophobicContact CG-CD2 4.4Å
221	Q	92.1	Very high	85.1	Confident	60 Å²	60	31.9 Å²	31.9	28%	0.28	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.4	173.3	-70.1	-179.9	-15.3	0	0	109.9	Q42 L44 G61 K62 V64	Q42-Q221 VanDerWaalsContact OE1-CG 3.31Å; L44-Q221 HydrophobicContact CD2-CB 4.42Å; L44-Q221 HydrophobicContact CD2-CG 3.6Å; G61-Q221 CarbonylContact C-O 3.55Å; G61-Q221 WeakPolarHBondContact CA-O 3.37Å; K62-Q221 PolarHBondContact N-O 2.96Å; K62-Q221 PolarHBondContact O-N 2.94Å; V64-Q221 VanDerWaalsContact CG2-CD 3.47Å; V64-Q221 HydrophobicContact CG2-CG 3.63Å
222	L	94.3	Very high	85.9	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.8	171.4	-59.4	171.6	0	0	0	109.6	V43 V45 I54 F60 L220 E226 A227 L230 L237	V43-L222 HydrophobicContact CB-CB 4.26Å; V43-L222 HydrophobicContact CG1-CD1 4.38Å; V43-L222 PolarHBondContact N-O 2.64Å; V43-L222 VanDerWaalsContact N-O 3.12Å; V43-L222 WeakPolarHBondContact O-CB 3.38Å; V43-L222 PolarHBondContact O-N 3.14Å; V45-L222 HydrophobicContact CG2-CD1 3.75Å; V45-L222 HydrophobicContact CG2-CG 4.38Å; I54-L222 HydrophobicContact CG2-CD2 4.17Å; F60-L222 HydrophobicContact CB-CD2 3.86Å; L220-L222 HydrophobicContact CD2-CD2 4.13Å; L220-L222 HydrophobicContact CG-CD2 4.4Å; L222-E226 HydrophobicContact CB-CB 4.28Å; L222-E226 HydrophobicContact CD2-CB 4.32Å; L222-A227 HydrophobicContact CB-CB 4.16Å; L222-A227 HydrophobicContact CD1-CB 4.44Å; L222-L230 HydrophobicContact CD1-CD1 3.79Å; L222-L230 HydrophobicContact CD2-CD1 4.03Å; L222-L237 HydrophobicContact CD1-CD2 3.78Å
223	S	94.3	Very high	86.7	Confident	38 Å²	38	32.5 Å²	32.5	27%	0.266	18%	0.177	S	C	.	.			trans	-65	160.6	165.6	88.8	0	0	0	0	110.7	E225 E226 A227	S223-E225 WeakPolarHBondContact CB-OE2 3.33Å; S223-E225 PolarHBondContact O-N 2.89Å; S223-E225 PolarHBondContact OG-N 3.02Å; S223-E225 PolarHBondContact OG-OE2 2.89Å; S223-E226 PolarHBondContact N-OE2 3.42Å; S223-E226 PolarHBondContact O-N 3.4Å; S223-E226 PolarHBondContact OG-N 3.5Å; S223-E226 VanDerWaalsContact OG-N 3.17Å; S223-A227 WeakPolarHBondContact O-CB 2.84Å; S223-A227 PolarHBondContact O-N 3.11Å
224	L	95.6	Very high	87.5	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-56.2	-38.4	176.6	-56.3	-177.6	0	0	0	111.5	Q41 F228 F255 L258 R259 F262	Q41-L224 WeakPolarHBondContact O-CD2 3.19Å; L224-F228 VanDerWaalsContact O-CB 3.26Å; L224-F228 WeakPolarHBondContact O-CB 3.37Å; L224-F228 PolarHBondContact O-N 2.86Å; L224-F255 HydrophobicContact CB-CD2 3.88Å; L224-F255 HydrophobicContact CB-CE2 4.1Å; L224-F255 HydrophobicContact CB-CG 4.15Å; L224-F255 HydrophobicContact CD1-CB 4.39Å; L224-F255 HydrophobicContact CD1-CG 4.41Å; L224-F255 HydrophobicContact CD2-CD1 3.79Å; L224-F255 HydrophobicContact CD2-CD2 4.4Å; L224-F255 HydrophobicContact CD2-CE1 3.68Å; L224-F255 HydrophobicContact CD2-CE2 4.3Å; L224-F255 HydrophobicContact CD2-CG 4.15Å; L224-F255 HydrophobicContact CD2-CZ 3.93Å; L224-F255 HydrophobicContact CG-CG 4.47Å; L224-F255 VanDerWaalsContact O-CE2 3.24Å; L224-F255 WeakPolarHBondContact O-CE2 3.22Å; L224-L258 HydrophobicContact CD1-CB 4.27Å; L224-R259 HydrophobicContact CD1-CB 4.33Å; L224-F262 HydrophobicContact CB-CD2 3.93Å; L224-F262 HydrophobicContact CB-CE2 3.69Å; L224-F262 HydrophobicContact CD1-CD2 4.42Å
225	E	95.8	Very high	88.6	Confident	17 Å²	17	31.9 Å²	31.9	8%	0.079	18%	0.178	C	C	.	.	H	α-helix	trans	-70.2	-43.2	177.7	-53.5	85.1	167.8	0	0	112.5	S223 F228 F229 R259 F262 S265 Y266 Y269	S223-E225 WeakPolarHBondContact CB-OE2 3.33Å; S223-E225 PolarHBondContact O-N 2.89Å; S223-E225 PolarHBondContact OG-N 3.02Å; S223-E225 PolarHBondContact OG-OE2 2.89Å; E225-F228 PolarHBondContact O-N 2.73Å; E225-F229 VanDerWaalsContact O-CB 3.26Å; E225-F229 WeakPolarHBondContact O-CB 3.14Å; E225-F229 PolarHBondContact O-N 3.11Å; E225-R259 IonicContact OE1-CZ 3.57Å; E225-R259 IonicContact OE1-NH1 3.52Å; E225-R259 PolarHBondContact OE1-NH1 3.38Å; E225-R259 IonicContact OE1-NH2 3.31Å; E225-R259 PolarHBondContact OE1-NH2 2.98Å; E225-R259 IonicContact OE2-NH2 2.92Å; E225-R259 PolarHBondContact OE2-NH2 3.4Å; E225-F262 HydrophobicContact CG-CE2 4.35Å; E225-S265 WeakPolarHBondContact OE1-CB 3.26Å; E225-S265 PolarHBondContact OE1-OG 3.31Å; E225-Y266 HydrophobicContact CB-CD2 4.05Å; E225-Y266 HydrophobicContact CG-CD2 4.46Å; E225-Y269 HydrophobicContact CB-CD1 3.97Å; E225-Y269 HydrophobicContact CB-CD2 3.75Å; E225-Y269 HydrophobicContact CB-CE2 4.33Å; E225-Y269 HydrophobicContact CB-CG 3.57Å; E225-Y269 HydrophobicContact CG-CG 4.37Å
226	E	95.5	Very high	90	Very high	12 Å²	12	28.2 Å²	28.2	6%	0.056	15%	0.147	C	C	.	.	H	α-helix	trans	-60	-48.6	175.7	-75.5	177.8	141.2	0	0	110.5	F60 G61 L222 S223 F229 L230 Y269 K280	F60-E226 HydrophobicContact CD1-CB 4.23Å; F60-E226 HydrophobicContact CD1-CG 4.25Å; G61-E226 VanDerWaalsContact CA-OE2 3.27Å; G61-E226 WeakPolarHBondContact CA-OE2 3.17Å; G61-E226 PolarHBondContact N-OE1 2.88Å; G61-E226 PolarHBondContact N-OE2 2.86Å; G61-E226 VanDerWaalsContact N-OE2 3.11Å; L222-E226 HydrophobicContact CB-CB 4.28Å; L222-E226 HydrophobicContact CD2-CB 4.32Å; S223-E226 PolarHBondContact N-OE2 3.42Å; S223-E226 PolarHBondContact O-N 3.4Å; S223-E226 PolarHBondContact OG-N 3.5Å; S223-E226 VanDerWaalsContact OG-N 3.17Å; E226-F229 PolarHBondContact O-N 3.06Å; E226-L230 WeakPolarHBondContact O-CG 3.24Å; E226-L230 PolarHBondContact O-N 3.11Å; E226-Y269 HydrophobicContact CG-CE2 3.77Å; E226-Y269 WeakPolarHBondContact CG-OH 3.26Å; E226-K280 IonicContact OE1-NZ 2.72Å; E226-K280 PolarHBondContact OE1-NZ 3.34Å
227	A	96.1	Very high	91.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-50.8	178.2	0	0	0	0	0	111	V43 L222 S223 F229 L230 V231 L237 F255	V43-A227 HydrophobicContact CB-CB 3.83Å; V43-A227 HydrophobicContact CG1-CB 4.38Å; V43-A227 HydrophobicContact CG2-CB 3.61Å; L222-A227 HydrophobicContact CB-CB 4.16Å; L222-A227 HydrophobicContact CD1-CB 4.44Å; S223-A227 WeakPolarHBondContact O-CB 2.84Å; S223-A227 PolarHBondContact O-N 3.11Å; A227-F229 VanDerWaalsContact C-N 3.28Å; A227-F229 PolarHBondContact O-N 3.01Å; A227-L230 PolarHBondContact O-N 3.07Å; A227-L230 VanDerWaalsContact O-N 3.11Å; A227-V231 WeakPolarHBondContact O-CG2 3.38Å; A227-V231 PolarHBondContact O-N 3.32Å; A227-L237 HydrophobicContact CB-CD2 4.27Å; A227-F255 HydrophobicContact CB-CE2 4.28Å; A227-F255 HydrophobicContact CB-CZ 4.28Å
228	F	96.8	Very high	92.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-33.2	-179.4	-163.4	-107.1	0	0	0	112	L224 E225 V231 Y232 V248 L251 W252 F255 F262 Y266 P362	L224-F228 VanDerWaalsContact O-CB 3.26Å; L224-F228 WeakPolarHBondContact O-CB 3.37Å; L224-F228 PolarHBondContact O-N 2.86Å; E225-F228 PolarHBondContact O-N 2.73Å; F228-V231 PolarHBondContact O-N 3.34Å; F228-Y232 HydrophobicContact CE1-CD1 4.14Å; F228-Y232 HydrophobicContact CE1-CD2 4.35Å; F228-Y232 AromaticContact CE1-CG 3.78Å; F228-Y232 HydrophobicContact CE1-CG 3.78Å; F228-Y232 HydrophobicContact CZ-CD2 4.16Å; F228-Y232 AromaticContact CZ-CG 3.99Å; F228-Y232 HydrophobicContact CZ-CG 3.99Å; F228-Y232 WeakPolarHBondContact O-CB 2.95Å; F228-Y232 PolarHBondContact O-N 2.75Å; F228-V248 HydrophobicContact CE2-CG1 4.07Å; F228-V248 HydrophobicContact CZ-CG1 4Å; F228-L251 HydrophobicContact CD2-CD2 3.97Å; F228-L251 HydrophobicContact CD2-CG 4.25Å; F228-W252 AromaticContact CD1-CE3 3.83Å; F228-W252 HydrophobicContact CD1-CE3 3.83Å; F228-W252 AromaticContact CD1-CZ3 3.95Å; F228-W252 HydrophobicContact CD1-CZ3 3.95Å; F228-W252 HydrophobicContact CD2-CE3 4.46Å; F228-W252 HydrophobicContact CE1-CD2 4.45Å; F228-W252 AromaticContact CE1-CE3 3.3Å; F228-W252 HydrophobicContact CE1-CE3 3.3Å; F228-W252 AromaticContact CE1-CZ3 3.59Å; F228-W252 HydrophobicContact CE1-CZ3 3.59Å; F228-W252 HydrophobicContact CE2-CB 3.94Å; F228-W252 AromaticContact CE2-CE3 3.97Å; F228-W252 HydrophobicContact CE2-CE3 3.97Å; F228-W252 HydrophobicContact CG-CE3 4.43Å; F228-W252 HydrophobicContact CZ-CB 4.12Å; F228-W252 HydrophobicContact CZ-CD2 4.21Å; F228-W252 AromaticContact CZ-CE3 3.4Å; F228-W252 HydrophobicContact CZ-CE3 3.4Å; F228-W252 HydrophobicContact CZ-CZ3 4.17Å; F228-F255 HydrophobicContact CB-CD2 4.01Å; F228-F255 HydrophobicContact CB-CE2 3.89Å; F228-F255 HydrophobicContact CD2-CD2 4.3Å; F228-F255 HydrophobicContact CD2-CE2 4.42Å; F228-F255 HydrophobicContact CG-CD2 4.45Å; F228-F262 HydrophobicContact CB-CZ 3.93Å; F228-F262 HydrophobicContact CD1-CZ 4.29Å; F228-F262 HydrophobicContact CG-CZ 4.06Å; F228-Y266 HydrophobicContact CB-CD2 4.19Å; F228-Y266 HydrophobicContact CB-CE2 3.96Å; F228-Y266 AromaticContact CD1-CD1 3.93Å; F228-Y266 HydrophobicContact CD1-CD1 3.93Å; F228-Y266 AromaticContact CD1-CD2 3.94Å; F228-Y266 HydrophobicContact CD1-CD2 3.94Å; F228-Y266 AromaticContact CD1-CE1 3.52Å; F228-Y266 HydrophobicContact CD1-CE1 3.52Å; F228-Y266 AromaticContact CD1-CE2 3.55Å; F228-Y266 HydrophobicContact CD1-CE2 3.55Å; F228-Y266 HydrophobicContact CD1-CG 4.11Å; F228-Y266 AromaticContact CD1-CZ 3.32Å; F228-Y266 HydrophobicContact CE1-CD1 4.29Å; F228-Y266 AromaticContact CE1-CE1 3.76Å; F228-Y266 HydrophobicContact CE1-CE1 3.76Å; F228-Y266 AromaticContact CE1-CZ 3.9Å; F228-Y266 HydrophobicContact CG-CE2 4.25Å; F228-P362 HydrophobicContact CE1-CB 4.15Å; F228-P362 HydrophobicContact CZ-CB 3.86Å; F228-P362 HydrophobicContact CZ-CG 4.29Å
229	F	95.7	Very high	93.4	Very high	20 Å²	20	23 Å²	23	9%	0.088	12%	0.121	C	C	.	.	I	π-helix	trans	-64.3	-42.3	172.8	-172.7	-94.3	0	0	0	112.4	F60 E225 E226 A227 V231 S233 L234 Y266 Y269 H270 R273	F60-F229 AromaticContact CE1-CD1 3.71Å; F60-F229 HydrophobicContact CE1-CD1 3.71Å; F60-F229 HydrophobicContact CE1-CE1 4.28Å; F60-F229 AromaticContact CZ-CD1 3.82Å; F60-F229 HydrophobicContact CZ-CD1 3.82Å; F60-F229 AromaticContact CZ-CE1 3.98Å; F60-F229 HydrophobicContact CZ-CE1 3.98Å; E225-F229 VanDerWaalsContact O-CB 3.26Å; E225-F229 WeakPolarHBondContact O-CB 3.14Å; E225-F229 PolarHBondContact O-N 3.11Å; E226-F229 PolarHBondContact O-N 3.06Å; A227-F229 VanDerWaalsContact C-N 3.28Å; A227-F229 PolarHBondContact O-N 3.01Å; F229-V231 VanDerWaalsContact C-N 3.31Å; F229-V231 PolarHBondContact O-N 3.2Å; F229-S233 WeakPolarHBondContact CD2-OG 3.39Å; F229-S233 WeakPolarHBondContact O-CB 3.5Å; F229-S233 PolarHBondContact O-N 3.35Å; F229-L234 HydrophobicContact CD1-CD1 3.92Å; F229-L234 HydrophobicContact CD1-CG 4.05Å; F229-L234 HydrophobicContact CE1-CD1 3.67Å; F229-L234 HydrophobicContact CE1-CD2 4.15Å; F229-L234 HydrophobicContact CE1-CG 3.69Å; F229-L234 HydrophobicContact CZ-CG 4.48Å; F229-L234 PolarHBondContact O-N 3.18Å; F229-Y266 HydrophobicContact CB-CE2 4.05Å; F229-Y269 HydrophobicContact CB-CD1 4.17Å; F229-Y269 HydrophobicContact CB-CE1 3.66Å; F229-Y269 HydrophobicContact CD1-CE1 4.47Å; F229-Y269 HydrophobicContact CD2-CD1 4.36Å; F229-Y269 HydrophobicContact CD2-CE1 4.17Å; F229-Y269 HydrophobicContact CG-CD1 4.42Å; F229-Y269 AromaticContact CG-CE1 3.85Å; F229-Y269 HydrophobicContact CG-CE1 3.85Å; F229-H270 AromaticContact CD2-CD2 3.87Å; F229-H270 AromaticContact CE2-CD2 3.84Å; F229-R273 HydrophobicContact CD2-CB 4.21Å; F229-R273 HydrophobicContact CD2-CG 4.4Å; F229-R273 HydrophobicContact CE1-CB 4.29Å; F229-R273 HydrophobicContact CE1-CG 4.38Å; F229-R273 HydrophobicContact CE2-CB 3.58Å; F229-R273 HydrophobicContact CE2-CG 4.19Å; F229-R273 HydrophobicContact CZ-CB 3.63Å; F229-R273 HydrophobicContact CZ-CG 4.18Å
230	L	94.6	Very high	93.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	I	π-helix	trans	-65.8	-33.9	176.8	-70.9	163.3	0	0	0	112.4	L22 I54 F60 L222 E226 A227 L234 G235 V236 L237	L22-L230 HydrophobicContact CD1-CD2 3.55Å; I54-L230 HydrophobicContact CG2-CD1 4Å; F60-L230 HydrophobicContact CB-CD1 4.19Å; F60-L230 HydrophobicContact CD1-CD1 4.13Å; F60-L230 HydrophobicContact CD1-CD2 4.31Å; F60-L230 HydrophobicContact CD1-CG 4.12Å; F60-L230 HydrophobicContact CD2-CD2 4.03Å; F60-L230 HydrophobicContact CE1-CD2 4.28Å; F60-L230 HydrophobicContact CE1-CG 4.24Å; F60-L230 HydrophobicContact CE2-CD2 4Å; F60-L230 HydrophobicContact CG-CD1 4.11Å; F60-L230 HydrophobicContact CG-CD2 4.19Å; F60-L230 HydrophobicContact CG-CG 4.34Å; F60-L230 HydrophobicContact CZ-CD2 4.13Å; L222-L230 HydrophobicContact CD1-CD1 3.79Å; L222-L230 HydrophobicContact CD2-CD1 4.03Å; E226-L230 WeakPolarHBondContact O-CG 3.24Å; E226-L230 PolarHBondContact O-N 3.11Å; A227-L230 PolarHBondContact O-N 3.07Å; A227-L230 VanDerWaalsContact O-N 3.11Å; L230-L234 HydrophobicContact CD2-CD1 3.85Å; L230-G235 PolarHBondContact O-N 3.01Å; L230-V236 HydrophobicContact CB-CG2 4.27Å; L230-V236 HydrophobicContact CD2-CG2 3.76Å; L230-V236 PolarHBondContact O-N 3.39Å; L230-L237 HydrophobicContact CB-CB 3.69Å; L230-L237 HydrophobicContact CB-CD2 3.96Å; L230-L237 HydrophobicContact CB-CG 4.48Å; L230-L237 HydrophobicContact CD1-CD2 4.19Å; L230-L237 PolarHBondContact O-N 3.26Å
231	V	94.9	Very high	93.7	Very high	19 Å²	19	25.1 Å²	25.1	12%	0.115	13%	0.132	C	C	.	.	I	π-helix	trans	-77	-57.9	175.6	179.6	0	0	0	0	111.6	A227 F228 F229 G235 L237 V239 V248 L251	A227-V231 WeakPolarHBondContact O-CG2 3.38Å; A227-V231 PolarHBondContact O-N 3.32Å; F228-V231 PolarHBondContact O-N 3.34Å; F229-V231 VanDerWaalsContact C-N 3.31Å; F229-V231 PolarHBondContact O-N 3.2Å; V231-G235 VanDerWaalsContact O-CA 3.22Å; V231-G235 WeakPolarHBondContact O-CA 3.36Å; V231-G235 PolarHBondContact O-N 3.12Å; V231-L237 HydrophobicContact CG2-CB 4.07Å; V231-L237 HydrophobicContact CG2-CD2 4.2Å; V231-L237 HydrophobicContact CG2-CG 4.24Å; V231-L237 WeakPolarHBondContact CG2-O 3.35Å; V231-V239 HydrophobicContact CG2-CG2 3.75Å; V231-V248 HydrophobicContact CG1-CG2 4.12Å; V231-L251 HydrophobicContact CB-CD2 4.15Å; V231-L251 HydrophobicContact CG1-CD2 4.12Å; V231-L251 HydrophobicContact CG2-CD2 3.74Å
232	Y	94.6	Very high	93.3	Very high	100 Å²	100	31 Å²	31	39%	0.392	16%	0.16	S	C	.	.	I	π-helix	trans	-79.4	-51.5	-168.7	178.6	-108.5	0	0	0	113.2	F228 V248 Y266 P362 L365	F228-Y232 HydrophobicContact CE1-CD1 4.14Å; F228-Y232 HydrophobicContact CE1-CD2 4.35Å; F228-Y232 AromaticContact CE1-CG 3.78Å; F228-Y232 HydrophobicContact CE1-CG 3.78Å; F228-Y232 HydrophobicContact CZ-CD2 4.16Å; F228-Y232 AromaticContact CZ-CG 3.99Å; F228-Y232 HydrophobicContact CZ-CG 3.99Å; F228-Y232 WeakPolarHBondContact O-CB 2.95Å; F228-Y232 PolarHBondContact O-N 2.75Å; Y232-V248 HydrophobicContact CD2-CG1 3.8Å; Y232-Y266 WeakPolarHBondContact CD1-OH 3.24Å; Y232-P362 HydrophobicContact CD2-CB 4.35Å; Y232-P362 HydrophobicContact CD2-CG 4.4Å; Y232-P362 HydrophobicContact CE2-CB 3.98Å; Y232-P362 HydrophobicContact CE2-CG 4.03Å; Y232-L365 HydrophobicContact CE1-CD1 4.25Å
233	S	92	Very high	92.7	Very high	38 Å²	38	36.8 Å²	36.8	27%	0.266	19%	0.186	S	C	.	.	I	π-helix	trans	-85.1	-40.3	-172.8	-53.1	0	0	0	0	112.2	F229 Y266 H270	F229-S233 WeakPolarHBondContact CD2-OG 3.39Å; F229-S233 WeakPolarHBondContact O-CB 3.5Å; F229-S233 PolarHBondContact O-N 3.35Å; S233-Y266 PolarHBondContact OG-OH 2.86Å; S233-H270 PolarHBondContact OG-CD2 3.31Å; S233-H270 PolarHBondContact OG-NE2 3.49Å
234	L	90	Very high	92.5	Very high	13 Å²	13	41.4 Å²	41.4	7%	0.068	20%	0.204	C	C	.	.	S	Bend	trans	-95.8	-29.2	-178.1	-62.8	-179.2	0	0	0	112.9	L22 L24 I25 F60 F229 L230 V236	L22-L234 HydrophobicContact CB-CD1 3.97Å; L22-L234 HydrophobicContact CD1-CD1 3.94Å; L24-L234 HydrophobicContact CD2-CD2 3.89Å; I25-L234 WeakPolarHBondContact CD1-O 3.27Å; I25-L234 VanDerWaalsContact CG1-O 3.28Å; I25-L234 WeakPolarHBondContact CG1-O 3.5Å; F60-L234 HydrophobicContact CE2-CD1 4.36Å; F60-L234 HydrophobicContact CZ-CD1 4.04Å; F229-L234 HydrophobicContact CD1-CD1 3.92Å; F229-L234 HydrophobicContact CD1-CG 4.05Å; F229-L234 HydrophobicContact CE1-CD1 3.67Å; F229-L234 HydrophobicContact CE1-CD2 4.15Å; F229-L234 HydrophobicContact CE1-CG 3.69Å; F229-L234 HydrophobicContact CZ-CG 4.48Å; F229-L234 PolarHBondContact O-N 3.18Å; L230-L234 HydrophobicContact CD2-CD1 3.85Å; L234-V236 VanDerWaalsContact C-N 3.29Å; L234-V236 HydrophobicContact CB-CG1 4.29Å; L234-V236 HydrophobicContact CB-CG2 3.93Å; L234-V236 PolarHBondContact O-N 3.25Å
235	G	91.1	Very high	92.3	Very high	21 Å²	21	44.6 Å²	44.6	22%	0.216	22%	0.224	C	C	.	.			trans	65.3	29.9	179.8	0	0	0	0	0	114.1	I25 H33 L230 V231	I25-G235 WeakPolarHBondContact CD1-O 3.35Å; H33-G235 PolarHBondContact CE1-O 2.77Å; H33-G235 VanDerWaalsContact CE1-O 3.29Å; L230-G235 PolarHBondContact O-N 3.01Å; V231-G235 VanDerWaalsContact O-CA 3.22Å; V231-G235 WeakPolarHBondContact O-CA 3.36Å; V231-G235 PolarHBondContact O-N 3.12Å
236	V	90.9	Very high	92.3	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.055	23%	0.229	C	C	.	.			trans	-110.4	-14.8	-175.8	-62.4	0	0	0	0	113.6	L22 I25 Y34 L230 L234	L22-V236 HydrophobicContact CD1-CG2 4.23Å; I25-V236 HydrophobicContact CD1-CG1 4.09Å; I25-V236 HydrophobicContact CG1-CG1 4.45Å; Y34-V236 HydrophobicContact CD2-CB 3.9Å; Y34-V236 HydrophobicContact CD2-CG2 3.96Å; Y34-V236 VanDerWaalsContact CD2-O 3.31Å; Y34-V236 WeakPolarHBondContact CD2-O 3.3Å; Y34-V236 HydrophobicContact CE2-CB 3.97Å; Y34-V236 HydrophobicContact CE2-CG2 4.1Å; Y34-V236 PolarHBondContact N-O 3.05Å; L230-V236 HydrophobicContact CB-CG2 4.27Å; L230-V236 HydrophobicContact CD2-CG2 3.76Å; L230-V236 PolarHBondContact O-N 3.39Å; L234-V236 VanDerWaalsContact C-N 3.29Å; L234-V236 HydrophobicContact CB-CG1 4.29Å; L234-V236 HydrophobicContact CB-CG2 3.93Å; L234-V236 PolarHBondContact O-N 3.25Å
237	L	93.5	Very high	92.3	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.7	-178.7	-177.3	70.1	0	0	0	110.3	Y34 V43 V45 I54 L222 A227 L230 V231 V239	Y34-L237 CarbonylContact O-C 3.58Å; Y34-L237 WeakPolarHBondContact O-CA 3.49Å; V43-L237 HydrophobicContact CG1-CD2 4.48Å; V45-L237 HydrophobicContact CG2-CD1 4.38Å; I54-L237 HydrophobicContact CD1-CD1 4.5Å; L222-L237 HydrophobicContact CD1-CD2 3.78Å; A227-L237 HydrophobicContact CB-CD2 4.27Å; L230-L237 HydrophobicContact CB-CB 3.69Å; L230-L237 HydrophobicContact CB-CD2 3.96Å; L230-L237 HydrophobicContact CB-CG 4.48Å; L230-L237 HydrophobicContact CD1-CD2 4.19Å; L230-L237 PolarHBondContact O-N 3.26Å; V231-L237 HydrophobicContact CG2-CB 4.07Å; V231-L237 HydrophobicContact CG2-CD2 4.2Å; V231-L237 HydrophobicContact CG2-CG 4.24Å; V231-L237 WeakPolarHBondContact CG2-O 3.35Å; L237-V239 HydrophobicContact CD2-CG2 3.92Å; L237-V239 HydrophobicContact CG-CG2 4.12Å
238	S	94	Very high	92.3	Very high	34 Å²	34	49.9 Å²	49.9	24%	0.238	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.4	165.4	-65.8	0	0	0	0	109.1	Y34 G36	Y34-S238 PolarHBondContact O-N 2.89Å; G36-S238 PolarHBondContact N-O 2.86Å
239	V	94.9	Very high	92.3	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.5	-177.6	-179.3	0	0	0	0	109.6	G36 L38 V43 V231 L237 L246 L251	G36-V239 CarbonylContact O-C 3.55Å; G36-V239 WeakPolarHBondContact O-CA 3.21Å; L38-V239 HydrophobicContact CB-CG1 3.83Å; V43-V239 HydrophobicContact CG1-CG1 4.23Å; V43-V239 HydrophobicContact CG1-CG2 4.07Å; V43-V239 HydrophobicContact CG2-CG1 4Å; V43-V239 HydrophobicContact CG2-CG2 4.35Å; V231-V239 HydrophobicContact CG2-CG2 3.75Å; L237-V239 HydrophobicContact CD2-CG2 3.92Å; L237-V239 HydrophobicContact CG-CG2 4.12Å; V239-L246 PolarHBondContact O-N 3.27Å; V239-L251 HydrophobicContact CB-CD1 3.97Å; V239-L251 HydrophobicContact CB-CD2 4.21Å; V239-L251 HydrophobicContact CG1-CD1 3.8Å; V239-L251 HydrophobicContact CG2-CD1 4.4Å; V239-L251 HydrophobicContact CG2-CD2 4.02Å
240	Y	91.6	Very high	92.3	Very high	59 Å²	59	56 Å²	56	23%	0.231	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	142.2	-178.2	-70.5	-103.9	0	0	0	111	R35 G36 E37 L38 Q243 E244 P245	R35-Y240 HydrophobicContact CG-CD2 3.78Å; R35-Y240 HydrophobicContact CG-CE2 3.79Å; G36-Y240 PolarHBondContact O-N 3.39Å; E37-Y240 WeakPolarHBondContact CA-O 3.26Å; L38-Y240 PolarHBondContact N-O 2.95Å; Y240-Q243 WeakPolarHBondContact CD1-O 3.39Å; Y240-E244 CarbonylContact C-O 3.54Å; Y240-E244 VanDerWaalsContact CA-O 3.26Å; Y240-E244 WeakPolarHBondContact CA-O 3.47Å; Y240-P245 HydrophobicContact CD1-CB 4.12Å; Y240-P245 HydrophobicContact CE1-CB 3.79Å; Y240-P245 HydrophobicContact CE1-CG 4.11Å; Y240-P245 HydrophobicContact CE2-CB 4.49Å
241	Q	89.3	Confident	92.4	Very high	76 Å²	76	56.1 Å²	56.1	36%	0.355	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	125	169.7	-177	174.9	36.2	0	0	107.9	Q243 E244 L246	Q241-Q243 PolarHBondContact O-N 3.35Å; Q241-E244 PolarHBondContact N-O 2.75Å; Q241-E244 PolarHBondContact O-N 2.55Å; Q241-L246 HydrophobicContact CB-CD1 3.93Å; Q241-L246 HydrophobicContact CB-CD2 4.21Å; Q241-L246 HydrophobicContact CB-CG 4.07Å
242	Q	84.5	Confident	92.4	Very high	185 Å²	185	55.2 Å²	55.2	86%	0.864	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	42.2	-177.4	-60.2	177.2	-13.9	0	0	113.3	E244	Q242-E244 PolarHBondContact O-N 2.94Å
243	Q	82.1	Confident	92.5	Very high	122 Å²	122	56 Å²	56	57%	0.57	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	0.4	-176.3	-56.2	-62.6	-25.5	0	0	116.7	Y240 Q241	Y240-Q243 WeakPolarHBondContact CD1-O 3.39Å; Q241-Q243 PolarHBondContact O-N 3.35Å
244	E	89.1	Confident	92.7	Very high	135 Å²	135	55.6 Å²	55.6	63%	0.631	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	136	175.5	-68.9	-60.2	147.5	0	0	111.7	Y240 Q241 Q242	Y240-E244 CarbonylContact C-O 3.54Å; Y240-E244 VanDerWaalsContact CA-O 3.26Å; Y240-E244 WeakPolarHBondContact CA-O 3.47Å; Q241-E244 PolarHBondContact N-O 2.75Å; Q241-E244 PolarHBondContact O-N 2.55Å; Q242-E244 PolarHBondContact O-N 2.94Å
245	P	92.2	Very high	92.9	Very high	68 Å²	68	55 Å²	55	44%	0.442	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.6	176.5	29.9	-31.9	0	0	0	110.5	Y240	Y240-P245 HydrophobicContact CD1-CB 4.12Å; Y240-P245 HydrophobicContact CE1-CB 3.79Å; Y240-P245 HydrophobicContact CE1-CG 4.11Å; Y240-P245 HydrophobicContact CE2-CB 4.49Å
246	L	94.3	Very high	93.1	Very high	33 Å²	33	56.1 Å²	56.1	17%	0.173	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-81.4	133.5	175.1	-64.5	175.5	0	0	0	110.5	L38 V239 Q241 E250 L251	L38-L246 HydrophobicContact CD2-CD1 4.05Å; V239-L246 PolarHBondContact O-N 3.27Å; Q241-L246 HydrophobicContact CB-CD1 3.93Å; Q241-L246 HydrophobicContact CB-CD2 4.21Å; Q241-L246 HydrophobicContact CB-CG 4.07Å; L246-E250 HydrophobicContact CB-CB 4.49Å; L246-E250 HydrophobicContact CD2-CB 4.33Å; L246-L251 HydrophobicContact CB-CB 4.24Å; L246-L251 HydrophobicContact CB-CD1 4.4Å; L246-L251 HydrophobicContact CD1-CD1 3.76Å
247	S	96	Very high	93.2	Very high	54 Å²	54	63 Å²	63	38%	0.378	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-65.4	161.7	167.4	71.1	0	0	0	0	111	V249 E250 L251	S247-V249 PolarHBondContact O-N 3.23Å; S247-E250 WeakPolarHBondContact CB-OE2 3.32Å; S247-E250 PolarHBondContact N-OE2 3.39Å; S247-E250 PolarHBondContact O-N 2.9Å; S247-E250 WeakPolarHBondContact OG-CB 3.43Å; S247-E250 VanDerWaalsContact OG-CG 3.25Å; S247-E250 WeakPolarHBondContact OG-CG 3.35Å; S247-E250 PolarHBondContact OG-N 3.35Å; S247-E250 PolarHBondContact OG-OE2 2.59Å; S247-L251 WeakPolarHBondContact O-CB 3.07Å; S247-L251 PolarHBondContact O-N 3.32Å
248	V	96.2	Very high	93.3	Very high	54 Å²	54	65.2 Å²	65.2	33%	0.327	33%	0.327	S	S	.	.	H	α-helix	trans	-55.7	-40.2	179.7	178.7	0	0	0	0	112	F228 V231 Y232 W252 P362	F228-V248 HydrophobicContact CE2-CG1 4.07Å; F228-V248 HydrophobicContact CZ-CG1 4Å; V231-V248 HydrophobicContact CG1-CG2 4.12Å; Y232-V248 HydrophobicContact CD2-CG1 3.8Å; V248-W252 VanDerWaalsContact O-CB 3.32Å; V248-W252 WeakPolarHBondContact O-CB 3.41Å; V248-W252 PolarHBondContact O-N 2.94Å; V248-P362 HydrophobicContact CG1-CG 4.19Å
249	V	96.1	Very high	93.1	Very high	54 Å²	54	65.8 Å²	65.8	33%	0.327	32%	0.324	S	S	.	.	H	α-helix	trans	-73.6	-41.7	-178.5	179.5	0	0	0	0	111	S247 W252 R253	S247-V249 PolarHBondContact O-N 3.23Å; V249-W252 PolarHBondContact O-N 2.99Å; V249-R253 WeakPolarHBondContact O-CG 3.47Å; V249-R253 PolarHBondContact O-N 3.35Å
250	E	96	Very high	92.8	Very high	95 Å²	95	71.5 Å²	71.5	44%	0.444	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-45.7	175	-70.9	161.4	149.6	0	0	110.9	L246 S247 W252 R253 T254	L246-E250 HydrophobicContact CB-CB 4.49Å; L246-E250 HydrophobicContact CD2-CB 4.33Å; S247-E250 WeakPolarHBondContact CB-OE2 3.32Å; S247-E250 PolarHBondContact N-OE2 3.39Å; S247-E250 PolarHBondContact O-N 2.9Å; S247-E250 WeakPolarHBondContact OG-CB 3.43Å; S247-E250 VanDerWaalsContact OG-CG 3.25Å; S247-E250 WeakPolarHBondContact OG-CG 3.35Å; S247-E250 PolarHBondContact OG-N 3.35Å; S247-E250 PolarHBondContact OG-OE2 2.59Å; E250-W252 VanDerWaalsContact C-N 3.33Å; E250-W252 PolarHBondContact O-N 3.24Å; E250-R253 PolarHBondContact O-N 3.42Å; E250-T254 WeakPolarHBondContact O-CB 3.39Å; E250-T254 PolarHBondContact O-N 3.26Å; E250-T254 PolarHBondContact O-OG1 3.1Å
251	L	96.5	Very high	92.7	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-59.4	-44.3	177.1	-171.2	66.8	0	0	0	111.6	F228 V231 V239 L246 S247 T254 F255	F228-L251 HydrophobicContact CD2-CD2 3.97Å; F228-L251 HydrophobicContact CD2-CG 4.25Å; V231-L251 HydrophobicContact CB-CD2 4.15Å; V231-L251 HydrophobicContact CG1-CD2 4.12Å; V231-L251 HydrophobicContact CG2-CD2 3.74Å; V239-L251 HydrophobicContact CB-CD1 3.97Å; V239-L251 HydrophobicContact CB-CD2 4.21Å; V239-L251 HydrophobicContact CG1-CD1 3.8Å; V239-L251 HydrophobicContact CG2-CD1 4.4Å; V239-L251 HydrophobicContact CG2-CD2 4.02Å; L246-L251 HydrophobicContact CB-CB 4.24Å; L246-L251 HydrophobicContact CB-CD1 4.4Å; L246-L251 HydrophobicContact CD1-CD1 3.76Å; S247-L251 WeakPolarHBondContact O-CB 3.07Å; S247-L251 PolarHBondContact O-N 3.32Å; L251-T254 PolarHBondContact O-N 2.99Å; L251-F255 HydrophobicContact CD1-CD1 4.08Å; L251-F255 HydrophobicContact CD1-CE1 3.37Å; L251-F255 HydrophobicContact CD1-CE2 4.05Å; L251-F255 HydrophobicContact CD1-CZ 3.38Å; L251-F255 HydrophobicContact CD2-CE2 4.18Å; L251-F255 HydrophobicContact CD2-CZ 4.18Å; L251-F255 HydrophobicContact CG-CD1 4.44Å; L251-F255 HydrophobicContact CG-CD2 4.3Å; L251-F255 HydrophobicContact CG-CE1 4.02Å; L251-F255 HydrophobicContact CG-CE2 3.88Å; L251-F255 HydrophobicContact CG-CZ 3.75Å; L251-F255 WeakPolarHBondContact O-CB 3.31Å; L251-F255 WeakPolarHBondContact O-CD1 3.26Å; L251-F255 VanDerWaalsContact O-CG 3.29Å; L251-F255 WeakPolarHBondContact O-CG 3.5Å; L251-F255 PolarHBondContact O-N 3.28Å
252	W	96.7	Very high	92.9	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.7	-48.5	176.3	176.6	-98.6	0	0	0	112.2	F228 V248 V249 E250 F255 R256 F262 V263 Y266 L359 P362 L365	F228-W252 AromaticContact CD1-CE3 3.83Å; F228-W252 HydrophobicContact CD1-CE3 3.83Å; F228-W252 AromaticContact CD1-CZ3 3.95Å; F228-W252 HydrophobicContact CD1-CZ3 3.95Å; F228-W252 HydrophobicContact CD2-CE3 4.46Å; F228-W252 HydrophobicContact CE1-CD2 4.45Å; F228-W252 AromaticContact CE1-CE3 3.3Å; F228-W252 HydrophobicContact CE1-CE3 3.3Å; F228-W252 AromaticContact CE1-CZ3 3.59Å; F228-W252 HydrophobicContact CE1-CZ3 3.59Å; F228-W252 HydrophobicContact CE2-CB 3.94Å; F228-W252 AromaticContact CE2-CE3 3.97Å; F228-W252 HydrophobicContact CE2-CE3 3.97Å; F228-W252 HydrophobicContact CG-CE3 4.43Å; F228-W252 HydrophobicContact CZ-CB 4.12Å; F228-W252 HydrophobicContact CZ-CD2 4.21Å; F228-W252 AromaticContact CZ-CE3 3.4Å; F228-W252 HydrophobicContact CZ-CE3 3.4Å; F228-W252 HydrophobicContact CZ-CZ3 4.17Å; V248-W252 VanDerWaalsContact O-CB 3.32Å; V248-W252 WeakPolarHBondContact O-CB 3.41Å; V248-W252 PolarHBondContact O-N 2.94Å; V249-W252 PolarHBondContact O-N 2.99Å; E250-W252 VanDerWaalsContact C-N 3.33Å; E250-W252 PolarHBondContact O-N 3.24Å; W252-F255 PolarHBondContact O-N 3.24Å; W252-R256 WeakPolarHBondContact O-CG 2.95Å; W252-R256 PolarHBondContact O-N 2.92Å; W252-F262 HydrophobicContact CD2-CE1 4.23Å; W252-F262 HydrophobicContact CE3-CD1 4.39Å; W252-F262 AromaticContact CE3-CE1 3.52Å; W252-F262 HydrophobicContact CE3-CE1 3.52Å; W252-F262 HydrophobicContact CE3-CZ 4.32Å; W252-F262 HydrophobicContact CH2-CE1 4.27Å; W252-F262 HydrophobicContact CZ3-CD1 4.29Å; W252-F262 AromaticContact CZ3-CE1 3.54Å; W252-F262 HydrophobicContact CZ3-CE1 3.54Å; W252-F262 HydrophobicContact CZ3-CZ 4.23Å; W252-V263 HydrophobicContact CH2-CB 4.44Å; W252-V263 HydrophobicContact CH2-CG1 4.19Å; W252-V263 HydrophobicContact CH2-CG2 4.23Å; W252-V263 HydrophobicContact CZ2-CB 4.37Å; W252-V263 HydrophobicContact CZ2-CG1 4.11Å; W252-V263 HydrophobicContact CZ2-CG2 3.76Å; W252-Y266 HydrophobicContact CH2-CD1 4.28Å; W252-Y266 AromaticContact CZ3-CD1 3.74Å; W252-Y266 HydrophobicContact CZ3-CD1 3.74Å; W252-Y266 HydrophobicContact CZ3-CE1 4.33Å; W252-Y266 HydrophobicContact CZ3-CG 4.3Å; W252-L359 PolarHBondContact NE1-O 3.49Å; W252-P362 HydrophobicContact CD2-CB 4.05Å; W252-P362 HydrophobicContact CE3-CB 4.04Å; W252-P362 HydrophobicContact CG-CB 4.43Å; W252-P362 HydrophobicContact CZ3-CB 4.45Å; W252-L365 HydrophobicContact CH2-CD1 4.15Å; W252-L365 HydrophobicContact CH2-CD2 3.93Å; W252-L365 HydrophobicContact CH2-CG 4.04Å; W252-L365 HydrophobicContact CZ3-CD1 4.16Å
253	R	95.5	Very high	93.4	Very high	118 Å²	118	59.5 Å²	59.5	45%	0.445	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-45.6	177.1	-71.8	172.6	179.4	177.2	-6.7	111.5	V249 E250 F255 R256 L257 D360	V249-R253 WeakPolarHBondContact O-CG 3.47Å; V249-R253 PolarHBondContact O-N 3.35Å; E250-R253 PolarHBondContact O-N 3.42Å; R253-F255 VanDerWaalsContact C-N 3.31Å; R253-F255 PolarHBondContact O-N 2.9Å; R253-R256 PolarHBondContact O-N 3.39Å; R253-L257 WeakPolarHBondContact O-CG 3.3Å; R253-L257 PolarHBondContact O-N 3.46Å; R253-D360 PolarHBondContact NE-O 3.45Å
254	T	95.4	Very high	94	Very high	28 Å²	28	53.8 Å²	53.8	17%	0.172	28%	0.283	C	S	.	.	H	α-helix	trans	-58.4	-43.7	176.4	-62.2	0	0	0	0	111.3	L38 E250 L251 L257 L258	L38-T254 HydrophobicContact CD2-CG2 3.58Å; E250-T254 WeakPolarHBondContact O-CB 3.39Å; E250-T254 PolarHBondContact O-N 3.26Å; E250-T254 PolarHBondContact O-OG1 3.1Å; L251-T254 PolarHBondContact O-N 2.99Å; T254-L257 PolarHBondContact O-N 2.75Å; T254-L258 HydrophobicContact CG2-CD1 4.06Å; T254-L258 VanDerWaalsContact O-CG 3.27Å; T254-L258 WeakPolarHBondContact O-CG 3.26Å; T254-L258 PolarHBondContact O-N 3.23Å
255	F	96.1	Very high	94.3	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-36.4	179.1	-71.6	2.6	0	0	0	112.7	L38 V43 L224 A227 F228 L251 W252 R253 L258 R259 F262	L38-F255 HydrophobicContact CD1-CE1 3.78Å; L38-F255 HydrophobicContact CD2-CE1 4.15Å; V43-F255 HydrophobicContact CG2-CE1 4.44Å; V43-F255 HydrophobicContact CG2-CZ 3.88Å; L224-F255 HydrophobicContact CB-CD2 3.88Å; L224-F255 HydrophobicContact CB-CE2 4.1Å; L224-F255 HydrophobicContact CB-CG 4.15Å; L224-F255 HydrophobicContact CD1-CB 4.39Å; L224-F255 HydrophobicContact CD1-CG 4.41Å; L224-F255 HydrophobicContact CD2-CD1 3.79Å; L224-F255 HydrophobicContact CD2-CD2 4.4Å; L224-F255 HydrophobicContact CD2-CE1 3.68Å; L224-F255 HydrophobicContact CD2-CE2 4.3Å; L224-F255 HydrophobicContact CD2-CG 4.15Å; L224-F255 HydrophobicContact CD2-CZ 3.93Å; L224-F255 HydrophobicContact CG-CG 4.47Å; L224-F255 VanDerWaalsContact O-CE2 3.24Å; L224-F255 WeakPolarHBondContact O-CE2 3.22Å; A227-F255 HydrophobicContact CB-CE2 4.28Å; A227-F255 HydrophobicContact CB-CZ 4.28Å; F228-F255 HydrophobicContact CB-CD2 4.01Å; F228-F255 HydrophobicContact CB-CE2 3.89Å; F228-F255 HydrophobicContact CD2-CD2 4.3Å; F228-F255 HydrophobicContact CD2-CE2 4.42Å; F228-F255 HydrophobicContact CG-CD2 4.45Å; L251-F255 HydrophobicContact CD1-CD1 4.08Å; L251-F255 HydrophobicContact CD1-CE1 3.37Å; L251-F255 HydrophobicContact CD1-CE2 4.05Å; L251-F255 HydrophobicContact CD1-CZ 3.38Å; L251-F255 HydrophobicContact CD2-CE2 4.18Å; L251-F255 HydrophobicContact CD2-CZ 4.18Å; L251-F255 HydrophobicContact CG-CD1 4.44Å; L251-F255 HydrophobicContact CG-CD2 4.3Å; L251-F255 HydrophobicContact CG-CE1 4.02Å; L251-F255 HydrophobicContact CG-CE2 3.88Å; L251-F255 HydrophobicContact CG-CZ 3.75Å; L251-F255 WeakPolarHBondContact O-CB 3.31Å; L251-F255 WeakPolarHBondContact O-CD1 3.26Å; L251-F255 VanDerWaalsContact O-CG 3.29Å; L251-F255 WeakPolarHBondContact O-CG 3.5Å; L251-F255 PolarHBondContact O-N 3.28Å; W252-F255 PolarHBondContact O-N 3.24Å; R253-F255 VanDerWaalsContact C-N 3.31Å; R253-F255 PolarHBondContact O-N 2.9Å; F255-L258 HydrophobicContact CD1-CD1 4.36Å; F255-L258 PolarHBondContact O-N 2.81Å; F255-R259 PolarHBondContact O-N 2.75Å; F255-F262 HydrophobicContact CB-CD1 3.66Å; F255-F262 HydrophobicContact CB-CD2 4.07Å; F255-F262 HydrophobicContact CB-CE1 3.52Å; F255-F262 HydrophobicContact CB-CE2 3.97Å; F255-F262 HydrophobicContact CB-CG 3.93Å; F255-F262 HydrophobicContact CB-CZ 3.72Å; F255-F262 HydrophobicContact CD2-CE1 4.12Å; F255-F262 AromaticContact CD2-CE2 3.82Å; F255-F262 HydrophobicContact CD2-CE2 3.82Å; F255-F262 AromaticContact CD2-CZ 3.52Å; F255-F262 HydrophobicContact CD2-CZ 3.52Å; F255-F262 HydrophobicContact CG-CE1 4.35Å; F255-F262 HydrophobicContact CG-CE2 4.33Å; F255-F262 HydrophobicContact CG-CZ 4.12Å
256	R	94.7	Very high	94.5	Very high	46 Å²	46	44.8 Å²	44.8	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-39	171.7	-76.3	-174.7	61.1	-133.7	0.2	113	W252 R253 L258 R259 F262 V263 E356 L359 D360	W252-R256 WeakPolarHBondContact O-CG 2.95Å; W252-R256 PolarHBondContact O-N 2.92Å; R253-R256 PolarHBondContact O-N 3.39Å; R256-L258 VanDerWaalsContact C-N 3.34Å; R256-R259 CarbonylContact O-C 3.57Å; R256-R259 VanDerWaalsContact O-C 3.23Å; R256-R259 VanDerWaalsContact O-O 3.06Å; R256-F262 HydrophobicContact CG-CD1 3.96Å; R256-V263 HydrophobicContact CG-CG2 3.83Å; R256-E356 IonicContact NH2-OE2 3.84Å; R256-L359 WeakPolarHBondContact CD-O 3.3Å; R256-L359 VanDerWaalsContact CZ-CB 3.49Å; R256-L359 VanDerWaalsContact CZ-O 3.26Å; R256-L359 PolarHBondContact NE-O 3.5Å; R256-L359 PolarHBondContact NH1-O 3.42Å; R256-D360 IonicContact CZ-OD1 3.91Å; R256-D360 VanDerWaalsContact NH1-N 3.19Å; R256-D360 IonicContact NH1-OD1 3.71Å; R256-D360 PolarHBondContact NH1-OD1 3.32Å; R256-D360 IonicContact NH2-OD1 2.66Å
257	L	93.6	Very high	94.6	Very high	152 Å²	152	43.6 Å²	43.6	80%	0.796	23%	0.232	S	C	*	.	H	α-helix	trans	-65.8	-38.5	175.4	-71.3	170.9	0	0	0	111.7	R253 T254	R253-L257 WeakPolarHBondContact O-CG 3.3Å; R253-L257 PolarHBondContact O-N 3.46Å; T254-L257 PolarHBondContact O-N 2.75Å
258	L	93.8	Very high	94.6	Very high	52 Å²	52	41 Å²	41	27%	0.272	21%	0.214	S	C	.	.	H	α-helix	trans	-73	-35.4	178.2	-69.3	170.2	0	0	0	112.9	L38 H40 Q41 L224 T254 F255 R256	L38-L258 HydrophobicContact CD1-CD1 4.39Å; H40-L258 VanDerWaalsContact O-CD1 3.3Å; H40-L258 WeakPolarHBondContact O-CD1 3.42Å; Q41-L258 HydrophobicContact CG-CB 4.39Å; Q41-L258 HydrophobicContact CG-CD2 4.28Å; Q41-L258 PolarHBondContact NE2-O 3.04Å; L224-L258 HydrophobicContact CD1-CB 4.27Å; T254-L258 HydrophobicContact CG2-CD1 4.06Å; T254-L258 VanDerWaalsContact O-CG 3.27Å; T254-L258 WeakPolarHBondContact O-CG 3.26Å; T254-L258 PolarHBondContact O-N 3.23Å; F255-L258 HydrophobicContact CD1-CD1 4.36Å; F255-L258 PolarHBondContact O-N 2.81Å; R256-L258 VanDerWaalsContact C-N 3.34Å
259	R	90.6	Very high	94.6	Very high	47 Å²	47	38.7 Å²	38.7	18%	0.177	20%	0.199	C	C	.	.			trans	-136.4	113.7	176.4	-107.1	-160.4	-64.3	135.2	-10	112.5	L224 E225 F255 R256 D261 F262 S265	L224-R259 HydrophobicContact CD1-CB 4.33Å; E225-R259 IonicContact OE1-CZ 3.57Å; E225-R259 IonicContact OE1-NH1 3.52Å; E225-R259 PolarHBondContact OE1-NH1 3.38Å; E225-R259 IonicContact OE1-NH2 3.31Å; E225-R259 PolarHBondContact OE1-NH2 2.98Å; E225-R259 IonicContact OE2-NH2 2.92Å; E225-R259 PolarHBondContact OE2-NH2 3.4Å; F255-R259 PolarHBondContact O-N 2.75Å; R256-R259 CarbonylContact O-C 3.57Å; R256-R259 VanDerWaalsContact O-C 3.23Å; R256-R259 VanDerWaalsContact O-O 3.06Å; R259-D261 VanDerWaalsContact CD-OD1 3.26Å; R259-D261 WeakPolarHBondContact CD-OD1 3.47Å; R259-D261 WeakPolarHBondContact CG-OD1 3.31Å; R259-D261 PolarHBondContact O-N 2.94Å; R259-F262 HydrophobicContact CB-CB 4.01Å; R259-F262 WeakPolarHBondContact O-CB 3.19Å; R259-F262 PolarHBondContact O-N 2.96Å; R259-S265 PolarHBondContact NH1-OG 3.22Å
260	P	88.1	Confident	94.6	Very high	123 Å²	123	39.1 Å²	39.1	80%	0.799	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-29	178.9	-26.1	35	0	0	0	114.8	F262	P260-F262 VanDerWaalsContact C-N 3.32Å
261	D	89.8	Confident	94.6	Very high	63 Å²	63	35.9 Å²	35.9	34%	0.337	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	6	177.7	68.6	-38.1	0	0	0	113	R259 V263 S264 S265	R259-D261 VanDerWaalsContact CD-OD1 3.26Å; R259-D261 WeakPolarHBondContact CD-OD1 3.47Å; R259-D261 WeakPolarHBondContact CG-OD1 3.31Å; R259-D261 PolarHBondContact O-N 2.94Å; D261-V263 VanDerWaalsContact C-N 3.28Å; D261-V263 PolarHBondContact O-N 3.08Å; D261-S264 PolarHBondContact O-N 3.14Å; D261-S265 PolarHBondContact O-N 3.18Å; D261-S265 PolarHBondContact O-OG 3.34Å
262	F	94.3	Very high	94.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-56	-40.1	-175.9	175.9	-109.5	0	0	0	112.7	L224 E225 F228 W252 F255 R256 R259 P260 S264 S265 Y266	L224-F262 HydrophobicContact CB-CD2 3.93Å; L224-F262 HydrophobicContact CB-CE2 3.69Å; L224-F262 HydrophobicContact CD1-CD2 4.42Å; E225-F262 HydrophobicContact CG-CE2 4.35Å; F228-F262 HydrophobicContact CB-CZ 3.93Å; F228-F262 HydrophobicContact CD1-CZ 4.29Å; F228-F262 HydrophobicContact CG-CZ 4.06Å; W252-F262 HydrophobicContact CD2-CE1 4.23Å; W252-F262 HydrophobicContact CE3-CD1 4.39Å; W252-F262 AromaticContact CE3-CE1 3.52Å; W252-F262 HydrophobicContact CE3-CE1 3.52Å; W252-F262 HydrophobicContact CE3-CZ 4.32Å; W252-F262 HydrophobicContact CH2-CE1 4.27Å; W252-F262 HydrophobicContact CZ3-CD1 4.29Å; W252-F262 AromaticContact CZ3-CE1 3.54Å; W252-F262 HydrophobicContact CZ3-CE1 3.54Å; W252-F262 HydrophobicContact CZ3-CZ 4.23Å; F255-F262 HydrophobicContact CB-CD1 3.66Å; F255-F262 HydrophobicContact CB-CD2 4.07Å; F255-F262 HydrophobicContact CB-CE1 3.52Å; F255-F262 HydrophobicContact CB-CE2 3.97Å; F255-F262 HydrophobicContact CB-CG 3.93Å; F255-F262 HydrophobicContact CB-CZ 3.72Å; F255-F262 HydrophobicContact CD2-CE1 4.12Å; F255-F262 AromaticContact CD2-CE2 3.82Å; F255-F262 HydrophobicContact CD2-CE2 3.82Å; F255-F262 AromaticContact CD2-CZ 3.52Å; F255-F262 HydrophobicContact CD2-CZ 3.52Å; F255-F262 HydrophobicContact CG-CE1 4.35Å; F255-F262 HydrophobicContact CG-CE2 4.33Å; F255-F262 HydrophobicContact CG-CZ 4.12Å; R256-F262 HydrophobicContact CG-CD1 3.96Å; R259-F262 HydrophobicContact CB-CB 4.01Å; R259-F262 WeakPolarHBondContact O-CB 3.19Å; R259-F262 PolarHBondContact O-N 2.96Å; P260-F262 VanDerWaalsContact C-N 3.32Å; F262-S264 PolarHBondContact O-N 3.17Å; F262-S265 VanDerWaalsContact CA-OG 3.23Å; F262-S265 WeakPolarHBondContact CA-OG 3.46Å; F262-S265 PolarHBondContact O-N 3.21Å; F262-S265 PolarHBondContact O-OG 3.2Å; F262-Y266 HydrophobicContact CZ-CD2 4.43Å; F262-Y266 HydrophobicContact CZ-CG 4.23Å; F262-Y266 WeakPolarHBondContact O-CB 3.27Å; F262-Y266 PolarHBondContact O-N 3.15Å
263	V	95.2	Very high	94.3	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.024	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-48.8	-179.4	-177.1	0	0	0	0	111.3	W252 R256 D261 A267 Y350 L359 L368	W252-V263 HydrophobicContact CH2-CB 4.44Å; W252-V263 HydrophobicContact CH2-CG1 4.19Å; W252-V263 HydrophobicContact CH2-CG2 4.23Å; W252-V263 HydrophobicContact CZ2-CB 4.37Å; W252-V263 HydrophobicContact CZ2-CG1 4.11Å; W252-V263 HydrophobicContact CZ2-CG2 3.76Å; R256-V263 HydrophobicContact CG-CG2 3.83Å; D261-V263 VanDerWaalsContact C-N 3.28Å; D261-V263 PolarHBondContact O-N 3.08Å; V263-A267 VanDerWaalsContact O-CB 3.28Å; V263-A267 WeakPolarHBondContact O-CB 3.35Å; V263-A267 PolarHBondContact O-N 2.87Å; V263-Y350 WeakPolarHBondContact CB-OH 3.41Å; V263-Y350 VanDerWaalsContact CG1-OH 3.31Å; V263-Y350 WeakPolarHBondContact CG1-OH 3.33Å; V263-L359 HydrophobicContact CG1-CD2 4.33Å; V263-L368 HydrophobicContact CG1-CD1 3.8Å
264	S	94.4	Very high	94.1	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-46.5	179.4	-60.8	0	0	0	0	111.8	D261 F262 A267 A268 Y350	D261-S264 PolarHBondContact O-N 3.14Å; F262-S264 PolarHBondContact O-N 3.17Å; S264-A267 PolarHBondContact O-N 2.62Å; S264-A268 PolarHBondContact O-N 2.88Å; S264-Y350 PolarHBondContact OG-OH 2.82Å; S264-Y350 VanDerWaalsContact OG-OH 3.1Å
265	S	94.5	Very high	93.8	Very high	13 Å²	13	37.8 Å²	37.8	9%	0.091	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-41.2	179.8	52.3	0	0	0	0	111.8	E225 R259 D261 F262 Y269	E225-S265 WeakPolarHBondContact OE1-CB 3.26Å; E225-S265 PolarHBondContact OE1-OG 3.31Å; R259-S265 PolarHBondContact NH1-OG 3.22Å; D261-S265 PolarHBondContact O-N 3.18Å; D261-S265 PolarHBondContact O-OG 3.34Å; F262-S265 VanDerWaalsContact CA-OG 3.23Å; F262-S265 WeakPolarHBondContact CA-OG 3.46Å; F262-S265 PolarHBondContact O-N 3.21Å; F262-S265 PolarHBondContact O-OG 3.2Å; S265-Y269 VanDerWaalsContact O-CB 3.3Å; S265-Y269 WeakPolarHBondContact O-CB 3.23Å; S265-Y269 PolarHBondContact O-N 3.11Å
266	Y	96.7	Very high	93.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-42.8	174	-178.3	-104.7	0	0	0	112.4	E225 F228 F229 Y232 S233 W252 F262 A268 Y269 H270 L365	E225-Y266 HydrophobicContact CB-CD2 4.05Å; E225-Y266 HydrophobicContact CG-CD2 4.46Å; F228-Y266 HydrophobicContact CB-CD2 4.19Å; F228-Y266 HydrophobicContact CB-CE2 3.96Å; F228-Y266 AromaticContact CD1-CD1 3.93Å; F228-Y266 HydrophobicContact CD1-CD1 3.93Å; F228-Y266 AromaticContact CD1-CD2 3.94Å; F228-Y266 HydrophobicContact CD1-CD2 3.94Å; F228-Y266 AromaticContact CD1-CE1 3.52Å; F228-Y266 HydrophobicContact CD1-CE1 3.52Å; F228-Y266 AromaticContact CD1-CE2 3.55Å; F228-Y266 HydrophobicContact CD1-CE2 3.55Å; F228-Y266 HydrophobicContact CD1-CG 4.11Å; F228-Y266 AromaticContact CD1-CZ 3.32Å; F228-Y266 HydrophobicContact CE1-CD1 4.29Å; F228-Y266 AromaticContact CE1-CE1 3.76Å; F228-Y266 HydrophobicContact CE1-CE1 3.76Å; F228-Y266 AromaticContact CE1-CZ 3.9Å; F228-Y266 HydrophobicContact CG-CE2 4.25Å; F229-Y266 HydrophobicContact CB-CE2 4.05Å; Y232-Y266 WeakPolarHBondContact CD1-OH 3.24Å; S233-Y266 PolarHBondContact OG-OH 2.86Å; W252-Y266 HydrophobicContact CH2-CD1 4.28Å; W252-Y266 AromaticContact CZ3-CD1 3.74Å; W252-Y266 HydrophobicContact CZ3-CD1 3.74Å; W252-Y266 HydrophobicContact CZ3-CE1 4.33Å; W252-Y266 HydrophobicContact CZ3-CG 4.3Å; F262-Y266 HydrophobicContact CZ-CD2 4.43Å; F262-Y266 HydrophobicContact CZ-CG 4.23Å; F262-Y266 WeakPolarHBondContact O-CB 3.27Å; F262-Y266 PolarHBondContact O-N 3.15Å; Y266-A268 VanDerWaalsContact C-N 3.32Å; Y266-A268 PolarHBondContact O-N 2.98Å; Y266-Y269 PolarHBondContact O-N 2.77Å; Y266-Y269 VanDerWaalsContact O-N 3.17Å; Y266-H270 HydrophobicContact CE1-CB 4.14Å; Y266-H270 VanDerWaalsContact O-CB 3.27Å; Y266-H270 WeakPolarHBondContact O-CB 3.35Å; Y266-H270 PolarHBondContact O-N 3.16Å; Y266-L365 HydrophobicContact CD1-CD1 3.73Å; Y266-L365 HydrophobicContact CD1-CD2 3.94Å; Y266-L365 HydrophobicContact CD1-CG 4.49Å; Y266-L365 HydrophobicContact CE1-CD1 3.44Å; Y266-L365 VanDerWaalsContact CE1-CD1 3.44Å; Y266-L365 HydrophobicContact CE1-CD2 4.43Å
267	A	96.8	Very high	93.3	Very high	9 Å²	9	38 Å²	38	7%	0.074	21%	0.213	C	C	.	.	H	α-helix	trans	-58.1	-45.2	176.6	0	0	0	0	0	111.4	V263 S264 H271 I348 L365 L368	V263-A267 VanDerWaalsContact O-CB 3.28Å; V263-A267 WeakPolarHBondContact O-CB 3.35Å; V263-A267 PolarHBondContact O-N 2.87Å; S264-A267 PolarHBondContact O-N 2.62Å; A267-H271 VanDerWaalsContact O-CB 3.23Å; A267-H271 WeakPolarHBondContact O-CB 3.5Å; A267-H271 PolarHBondContact O-N 3.49Å; A267-I348 HydrophobicContact CB-CD1 4.08Å; A267-I348 HydrophobicContact CB-CG2 4.15Å; A267-L365 HydrophobicContact CB-CD2 4Å; A267-L368 HydrophobicContact CB-CD1 4.11Å
268	A	96.2	Very high	93.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.3	-48.2	173.2	0	0	0	0	0	111.8	S264 Y266 H270 H271 F272 L291 V309 I348	S264-A268 PolarHBondContact O-N 2.88Å; Y266-A268 VanDerWaalsContact C-N 3.32Å; Y266-A268 PolarHBondContact O-N 2.98Å; A268-H270 PolarHBondContact O-N 3.15Å; A268-H271 WeakPolarHBondContact O-CB 2.84Å; A268-H271 PolarHBondContact O-N 2.82Å; A268-F272 HydrophobicContact CB-CE2 4.33Å; A268-F272 WeakPolarHBondContact O-CD2 3.03Å; A268-F272 PolarHBondContact O-N 2.67Å; A268-L291 HydrophobicContact CB-CD1 4.36Å; A268-V309 HydrophobicContact CB-CB 4.46Å; A268-V309 HydrophobicContact CB-CG1 3.91Å; A268-V309 HydrophobicContact CB-CG2 3.63Å; A268-I348 HydrophobicContact CB-CD1 4.1Å
269	Y	96.3	Very high	93.3	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-50.5	179.4	-177.1	-83.2	0	0	0	112	F60 E225 E226 F229 S265 Y266 H271 F272 R273 P279	F60-Y269 WeakPolarHBondContact CE1-OH 3.43Å; E225-Y269 HydrophobicContact CB-CD1 3.97Å; E225-Y269 HydrophobicContact CB-CD2 3.75Å; E225-Y269 HydrophobicContact CB-CE2 4.33Å; E225-Y269 HydrophobicContact CB-CG 3.57Å; E225-Y269 HydrophobicContact CG-CG 4.37Å; E226-Y269 HydrophobicContact CG-CE2 3.77Å; E226-Y269 WeakPolarHBondContact CG-OH 3.26Å; F229-Y269 HydrophobicContact CB-CD1 4.17Å; F229-Y269 HydrophobicContact CB-CE1 3.66Å; F229-Y269 HydrophobicContact CD1-CE1 4.47Å; F229-Y269 HydrophobicContact CD2-CD1 4.36Å; F229-Y269 HydrophobicContact CD2-CE1 4.17Å; F229-Y269 HydrophobicContact CG-CD1 4.42Å; F229-Y269 AromaticContact CG-CE1 3.85Å; F229-Y269 HydrophobicContact CG-CE1 3.85Å; S265-Y269 VanDerWaalsContact O-CB 3.3Å; S265-Y269 WeakPolarHBondContact O-CB 3.23Å; S265-Y269 PolarHBondContact O-N 3.11Å; Y266-Y269 PolarHBondContact O-N 2.77Å; Y266-Y269 VanDerWaalsContact O-N 3.17Å; Y269-H271 VanDerWaalsContact C-N 3.34Å; Y269-H271 PolarHBondContact O-N 3.02Å; Y269-F272 PolarHBondContact O-N 3.4Å; Y269-R273 HydrophobicContact CD1-CG 3.94Å; Y269-R273 HydrophobicContact CE1-CG 3.43Å; Y269-R273 VanDerWaalsContact CE1-CG 3.43Å; Y269-R273 WeakPolarHBondContact O-CB 3.24Å; Y269-R273 WeakPolarHBondContact O-CG 3.11Å; Y269-R273 PolarHBondContact O-N 2.7Å; Y269-R273 PolarHBondContact OH-NE 3.25Å; Y269-R273 PolarHBondContact OH-NH2 2.96Å; Y269-P279 HydrophobicContact CD2-CB 3.99Å; Y269-P279 HydrophobicContact CD2-CG 3.54Å; Y269-P279 HydrophobicContact CE2-CB 4.14Å; Y269-P279 HydrophobicContact CE2-CG 3.48Å; Y269-P279 VanDerWaalsContact CE2-CG 3.48Å; Y269-P279 HydrophobicContact CG-CG 4.12Å
270	H	95.6	Very high	93.3	Very high	64 Å²	64	27.9 Å²	27.9	30%	0.296	16%	0.163	S	C	.	.	H	α-helix	trans	-58.8	-46.2	178.3	-178.8	-86.5	0	0	0	111.1	F229 S233 Y266 A268 R273 S274	F229-H270 AromaticContact CD2-CD2 3.87Å; F229-H270 AromaticContact CE2-CD2 3.84Å; S233-H270 PolarHBondContact OG-CD2 3.31Å; S233-H270 PolarHBondContact OG-NE2 3.49Å; Y266-H270 HydrophobicContact CE1-CB 4.14Å; Y266-H270 VanDerWaalsContact O-CB 3.27Å; Y266-H270 WeakPolarHBondContact O-CB 3.35Å; Y266-H270 PolarHBondContact O-N 3.16Å; A268-H270 PolarHBondContact O-N 3.15Å; H270-R273 PolarHBondContact O-N 2.97Å; H270-S274 WeakPolarHBondContact O-CB 3.44Å; H270-S274 PolarHBondContact O-N 3.21Å; H270-S274 PolarHBondContact O-OG 3.22Å
271	H	95.1	Very high	93.1	Very high	26 Å²	26	23.7 Å²	23.7	12%	0.12	14%	0.142	C	C	.	.	H	α-helix	trans	-57.1	-51.2	177	177.5	85.9	0	0	0	112.2	A267 A268 Y269 R273 S274 R275 V370 E372	A267-H271 VanDerWaalsContact O-CB 3.23Å; A267-H271 WeakPolarHBondContact O-CB 3.5Å; A267-H271 PolarHBondContact O-N 3.49Å; A268-H271 WeakPolarHBondContact O-CB 2.84Å; A268-H271 PolarHBondContact O-N 2.82Å; Y269-H271 VanDerWaalsContact C-N 3.34Å; Y269-H271 PolarHBondContact O-N 3.02Å; H271-R273 PolarHBondContact O-N 3.46Å; H271-S274 PolarHBondContact O-N 3Å; H271-S274 PolarHBondContact O-OG 3.25Å; H271-R275 PolarHBondContact CE1-NE 2.7Å; H271-R275 PolarHBondContact CE1-NH2 3.3Å; H271-R275 PolarHBondContact NE2-NE 3.41Å; H271-R275 PolarHBondContact O-N 3.49Å; H271-V370 HydrophobicContact CB-CG1 4.26Å; H271-V370 HydrophobicContact CB-CG2 4.25Å; H271-E372 IonicContact CD2-OE1 3.69Å; H271-E372 IonicContact CE1-OE1 2.89Å; H271-E372 IonicContact NE2-OE1 3.42Å; H271-E372 PolarHBondContact NE2-OE1 2.74Å
272	F	94.9	Very high	92.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-39.3	179.6	-67.7	-56.1	0	0	0	112.8	F5 A268 Y269 R275 G276 W277 P279 L291 L293 V307 M344 C346	F5-F272 HydrophobicContact CE1-CD1 4.49Å; F5-F272 HydrophobicContact CE1-CE1 4.29Å; F5-F272 HydrophobicContact CZ-CD1 4.5Å; F5-F272 HydrophobicContact CZ-CE1 4.12Å; A268-F272 HydrophobicContact CB-CE2 4.33Å; A268-F272 WeakPolarHBondContact O-CD2 3.03Å; A268-F272 PolarHBondContact O-N 2.67Å; Y269-F272 PolarHBondContact O-N 3.4Å; F272-R275 PolarHBondContact O-N 2.93Å; F272-G276 PolarHBondContact O-N 3.32Å; F272-W277 HydrophobicContact CB-CB 4.23Å; F272-W277 WeakPolarHBondContact O-CB 3.33Å; F272-W277 PolarHBondContact O-N 3.17Å; F272-P279 HydrophobicContact CB-CG 4.4Å; F272-L291 HydrophobicContact CD2-CD1 4.26Å; F272-L291 HydrophobicContact CE2-CD1 4.46Å; F272-L293 HydrophobicContact CB-CD2 3.96Å; F272-L293 HydrophobicContact CD1-CD1 3.52Å; F272-L293 HydrophobicContact CD1-CD2 4.27Å; F272-L293 HydrophobicContact CD2-CD1 4.31Å; F272-L293 HydrophobicContact CD2-CD2 3.86Å; F272-L293 HydrophobicContact CE1-CD1 3.62Å; F272-L293 HydrophobicContact CE2-CD1 4.4Å; F272-L293 HydrophobicContact CE2-CD2 4.46Å; F272-L293 HydrophobicContact CG-CD1 3.9Å; F272-L293 HydrophobicContact CG-CD2 3.76Å; F272-L293 HydrophobicContact CZ-CD1 4.07Å; F272-V307 HydrophobicContact CE2-CG1 3.85Å; F272-V307 HydrophobicContact CE2-CG2 4.41Å; F272-V307 HydrophobicContact CZ-CG1 3.99Å; F272-V307 HydrophobicContact CZ-CG2 4.32Å; F272-M344 HydrophobicContact CE1-SD 3.83Å; F272-M344 HydrophobicContact CZ-SD 3.85Å; F272-C346 HydrophobicContact CE2-CB 4.26Å; F272-C346 HydrophobicContact CZ-CB 4.1Å
273	R	92.8	Very high	90.8	Very high	27 Å²	27	25.3 Å²	25.3	10%	0.102	17%	0.173	C	C	.	.	H	α-helix	trans	-60	-44.6	173.7	-80.5	-67.5	-173.6	-178.8	4	112	G58 F229 Y269 H270 H271 R275 G276 W277 P279	G58-R273 VanDerWaalsContact O-CZ 3.31Å; G58-R273 PolarHBondContact O-NH1 2.99Å; G58-R273 PolarHBondContact O-NH2 3.09Å; F229-R273 HydrophobicContact CD2-CB 4.21Å; F229-R273 HydrophobicContact CD2-CG 4.4Å; F229-R273 HydrophobicContact CE1-CB 4.29Å; F229-R273 HydrophobicContact CE1-CG 4.38Å; F229-R273 HydrophobicContact CE2-CB 3.58Å; F229-R273 HydrophobicContact CE2-CG 4.19Å; F229-R273 HydrophobicContact CZ-CB 3.63Å; F229-R273 HydrophobicContact CZ-CG 4.18Å; Y269-R273 HydrophobicContact CD1-CG 3.94Å; Y269-R273 HydrophobicContact CE1-CG 3.43Å; Y269-R273 VanDerWaalsContact CE1-CG 3.43Å; Y269-R273 WeakPolarHBondContact O-CB 3.24Å; Y269-R273 WeakPolarHBondContact O-CG 3.11Å; Y269-R273 PolarHBondContact O-N 2.7Å; Y269-R273 PolarHBondContact OH-NE 3.25Å; Y269-R273 PolarHBondContact OH-NH2 2.96Å; H270-R273 PolarHBondContact O-N 2.97Å; H271-R273 PolarHBondContact O-N 3.46Å; R273-R275 PolarHBondContact O-N 3.41Å; R273-G276 WeakPolarHBondContact O-CA 3.12Å; R273-G276 PolarHBondContact O-N 2.86Å; R273-W277 WeakPolarHBondContact CD-O 3.45Å; R273-P279 HydrophobicContact CG-CG 3.88Å
274	S	91.3	Very high	89.8	Confident	81 Å²	81	25.1 Å²	25.1	57%	0.566	17%	0.172	S	C	*	.	H	α-helix	trans	-62.5	-26.9	178.5	75.5	0	0	0	0	113.1	H270 H271 G276	H270-S274 WeakPolarHBondContact O-CB 3.44Å; H270-S274 PolarHBondContact O-N 3.21Å; H270-S274 PolarHBondContact O-OG 3.22Å; H271-S274 PolarHBondContact O-N 3Å; H271-S274 PolarHBondContact O-OG 3.25Å; S274-G276 VanDerWaalsContact C-N 3.28Å; S274-G276 PolarHBondContact O-N 3.22Å
275	R	89.9	Confident	89.1	Confident	79 Å²	79	29 Å²	29	30%	0.298	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	8.2	173.6	-67	-173.7	175.8	-167.5	7.9	113.9	Q2 H271 F272 R273 E372	Q2-R275 VanDerWaalsContact NE2-NH2 3.1Å; H271-R275 PolarHBondContact CE1-NE 2.7Å; H271-R275 PolarHBondContact CE1-NH2 3.3Å; H271-R275 PolarHBondContact NE2-NE 3.41Å; H271-R275 PolarHBondContact O-N 3.49Å; F272-R275 PolarHBondContact O-N 2.93Å; R273-R275 PolarHBondContact O-N 3.41Å; R275-E372 IonicContact CZ-OE1 3.66Å; R275-E372 VanDerWaalsContact CZ-OE1 3.31Å; R275-E372 IonicContact CZ-OE2 3.79Å; R275-E372 IonicContact NE-OE1 2.64Å; R275-E372 IonicContact NH1-OE1 2.77Å; R275-E372 PolarHBondContact NH1-OE1 3.13Å; R275-E372 IonicContact NH1-OE2 2.78Å; R275-E372 PolarHBondContact NH1-OE2 2.89Å; R275-E372 IonicContact NH2-OE1 3.22Å; R275-E372 IonicContact NH2-OE2 2.59Å
276	G	88.8	Confident	88.7	Confident	45 Å²	45	36.3 Å²	36.3	46%	0.464	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	18.6	177.4	0	0	0	0	0	114.6	F272 R273 S274	F272-G276 PolarHBondContact O-N 3.32Å; R273-G276 WeakPolarHBondContact O-CA 3.12Å; R273-G276 PolarHBondContact O-N 2.86Å; S274-G276 VanDerWaalsContact C-N 3.28Å; S274-G276 PolarHBondContact O-N 3.22Å
277	W	91	Very high	88.2	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.019	25%	0.248	C	C	.	.			trans	-88.1	155.4	170.1	-69.1	88.8	0	0	0	110.9	F5 F272 R273 P279 L293 Y294 R295 Y305	F5-W277 HydrophobicContact CB-CZ2 3.89Å; F5-W277 HydrophobicContact CD1-CD2 4.46Å; F5-W277 AromaticContact CD1-CE2 3.42Å; F5-W277 VanDerWaalsContact CD1-CE2 3.42Å; F5-W277 AromaticContact CD1-CZ2 3.52Å; F5-W277 HydrophobicContact CD1-CZ2 3.52Å; F5-W277 AromaticContact CD1-NE1 3.16Å; F5-W277 AromaticContact CE1-NE1 3.69Å; F5-W277 HydrophobicContact CG-CZ2 4.12Å; F5-W277 AromaticContact CG-NE1 3.65Å; F272-W277 HydrophobicContact CB-CB 4.23Å; F272-W277 WeakPolarHBondContact O-CB 3.33Å; F272-W277 PolarHBondContact O-N 3.17Å; R273-W277 WeakPolarHBondContact CD-O 3.45Å; W277-P279 VanDerWaalsContact C-CD 3.48Å; W277-P279 WeakPolarHBondContact O-CD 3.42Å; W277-L293 HydrophobicContact CD2-CB 4.32Å; W277-L293 HydrophobicContact CE3-CB 3.75Å; W277-L293 HydrophobicContact CZ3-CB 4.36Å; W277-Y294 VanDerWaalsContact CE3-C 3.45Å; W277-Y294 VanDerWaalsContact CE3-O 3.3Å; W277-R295 HydrophobicContact CH2-CB 4.44Å; W277-R295 HydrophobicContact CZ3-CB 4.07Å; W277-Y305 AromaticContact CH2-CD2 3.99Å; W277-Y305 HydrophobicContact CH2-CD2 3.99Å; W277-Y305 AromaticContact CH2-CE2 3.59Å; W277-Y305 HydrophobicContact CH2-CE2 3.59Å; W277-Y305 HydrophobicContact CZ2-CD2 4.39Å; W277-Y305 AromaticContact CZ2-CE2 3.82Å; W277-Y305 HydrophobicContact CZ2-CE2 3.82Å; W277-Y305 HydrophobicContact CZ3-CD2 4.13Å; W277-Y305 HydrophobicContact CZ3-CE2 4.19Å
278	V	92.5	Very high	87.9	Confident	9 Å²	9	40.8 Å²	40.8	6%	0.055	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	91.4	172.6	179.2	0	0	0	0	108.1	Y294 K296	V278-Y294 PolarHBondContact N-O 3.49Å; V278-Y294 WeakPolarHBondContact O-CD2 3.4Å; V278-Y294 PolarHBondContact O-N 3.38Å; V278-K296 WeakPolarHBondContact CG2-O 3.49Å
279	P	93.9	Very high	87.7	Confident	0 Å²	0	41 Å²	41	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	138.6	173.3	26	-33.6	0	0	0	112	Y269 F272 R273 W277 L291 M292 L293	Y269-P279 HydrophobicContact CD2-CB 3.99Å; Y269-P279 HydrophobicContact CD2-CG 3.54Å; Y269-P279 HydrophobicContact CE2-CB 4.14Å; Y269-P279 HydrophobicContact CE2-CG 3.48Å; Y269-P279 VanDerWaalsContact CE2-CG 3.48Å; Y269-P279 HydrophobicContact CG-CG 4.12Å; F272-P279 HydrophobicContact CB-CG 4.4Å; R273-P279 HydrophobicContact CG-CG 3.88Å; W277-P279 VanDerWaalsContact C-CD 3.48Å; W277-P279 WeakPolarHBondContact O-CD 3.42Å; P279-L291 HydrophobicContact CB-CD1 4.34Å; P279-L291 HydrophobicContact CB-CD2 4.36Å; P279-M292 CarbonylContact C-O 3.49Å; P279-M292 WeakPolarHBondContact CA-O 3.5Å; P279-L293 HydrophobicContact CB-CD2 3.74Å
280	K	91.4	Very high	87.5	Confident	30 Å²	30	43.7 Å²	43.7	13%	0.13	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	121.3	175.1	-73.1	-64.7	-176.3	-177.4	0	112.1	Y59 G61 E226 M292 Y294	Y59-K280 WeakPolarHBondContact O-CE 3.16Å; Y59-K280 PolarHBondContact O-NZ 3.02Å; G61-K280 PolarHBondContact O-NZ 3.47Å; E226-K280 IonicContact OE1-NZ 2.72Å; E226-K280 PolarHBondContact OE1-NZ 3.34Å; K280-M292 PolarHBondContact N-O 2.94Å; K280-M292 PolarHBondContact O-N 3.36Å; K280-Y294 HydrophobicContact CB-CD2 4.4Å; K280-Y294 HydrophobicContact CB-CE2 4.02Å; K280-Y294 HydrophobicContact CG-CD2 4.15Å; K280-Y294 HydrophobicContact CG-CE2 4.06Å
281	G	83.3	Confident	87.5	Confident	36 Å²	36	41.2 Å²	41.2	37%	0.371	26%	0.264	S	S	.	.	S	Bend	trans	-78.8	-48.4	179	0	0	0	0	0	114.2	G283 G284 D290	G281-G283 PolarHBondContact O-N 2.99Å; G281-G284 PolarHBondContact O-N 2.99Å; G281-D290 WeakPolarHBondContact CA-O 3.33Å
282	G	70.4	Confident	87.4	Confident	75 Å²	75	40 Å²	40	77%	0.773	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.6	-174.8	0	0	0	0	0	115.8
283	G	65.7	Low	87.3	Confident	21 Å²	21	40 Å²	40	22%	0.216	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-24.6	171.7	0	0	0	0	0	114.1	G281 K286 Y287	G281-G283 PolarHBondContact O-N 2.99Å; G283-K286 PolarHBondContact O-N 3.13Å; G283-Y287 WeakPolarHBondContact O-CD2 3.28Å
284	G	74.5	Confident	87.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-68.5	-37.5	-174.5	0	0	0	0	0	113.2	G281 K286 Y287 G288 V289	G281-G284 PolarHBondContact O-N 2.99Å; G284-K286 PolarHBondContact O-N 3.4Å; G284-K286 VanDerWaalsContact O-N 3.1Å; G284-Y287 CarbonylContact O-C 3.59Å; G284-Y287 WeakPolarHBondContact O-CA 3.27Å; G284-Y287 PolarHBondContact O-N 2.79Å; G284-G288 PolarHBondContact O-N 2.78Å; G284-G288 VanDerWaalsContact O-N 3.11Å; G284-V289 CarbonylContact C-O 3.48Å; G284-V289 VanDerWaalsContact CA-O 3.25Å; G284-V289 WeakPolarHBondContact CA-O 3.02Å; G284-V289 PolarHBondContact O-N 2.97Å; G284-V289 VanDerWaalsContact O-O 3.06Å
285	A	80.6	Confident	86.9	Confident	84 Å²	84	42 Å²	42	69%	0.694	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-54.6	-34.6	178.8	0	0	0	0	0	112.8	Y287 G288 V289	A285-Y287 PolarHBondContact O-N 3.37Å; A285-G288 PolarHBondContact O-N 3Å; A285-V289 PolarHBondContact N-O 2.92Å
286	K	84.6	Confident	86.4	Confident	168 Å²	168	42.2 Å²	42.2	73%	0.73	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-63.9	-23.9	177.2	-60.8	-176.8	-179.9	-176.4	0	113.4	G283 G284	G283-K286 PolarHBondContact O-N 3.13Å; G284-K286 PolarHBondContact O-N 3.4Å; G284-K286 VanDerWaalsContact O-N 3.1Å
287	Y	87.3	Confident	86.2	Confident	72 Å²	72	40.1 Å²	40.1	28%	0.282	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-113.4	7.8	-177.3	-53.1	-64.2	0	0	0	112.3	G283 G284 A285 V289 M292 L332 V339	G283-Y287 WeakPolarHBondContact O-CD2 3.28Å; G284-Y287 CarbonylContact O-C 3.59Å; G284-Y287 WeakPolarHBondContact O-CA 3.27Å; G284-Y287 PolarHBondContact O-N 2.79Å; A285-Y287 PolarHBondContact O-N 3.37Å; Y287-V289 VanDerWaalsContact C-N 3.3Å; Y287-V289 PolarHBondContact O-N 3.35Å; Y287-M292 HydrophobicContact CD2-CE 3.9Å; Y287-M292 HydrophobicContact CD2-CG 4.33Å; Y287-M292 HydrophobicContact CD2-SD 3.65Å; Y287-M292 HydrophobicContact CE2-CE 4.07Å; Y287-M292 HydrophobicContact CE2-SD 4.3Å; Y287-M292 HydrophobicContact CG-SD 4.47Å; Y287-L332 VanDerWaalsContact O-CD1 3.23Å; Y287-L332 WeakPolarHBondContact O-CD1 3.3Å; Y287-V339 HydrophobicContact CD1-CG1 4.28Å; Y287-V339 HydrophobicContact CD1-CG2 4.01Å; Y287-V339 HydrophobicContact CE1-CB 4.3Å; Y287-V339 HydrophobicContact CE1-CG1 3.74Å; Y287-V339 HydrophobicContact CE1-CG2 4.04Å
288	G	89.2	Confident	85.8	Confident	31 Å²	31	42.4 Å²	42.4	32%	0.32	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	25.8	-178.3	0	0	0	0	0	113.9	G284 A285 R322	G284-G288 PolarHBondContact O-N 2.78Å; G284-G288 VanDerWaalsContact O-N 3.11Å; A285-G288 PolarHBondContact O-N 3Å; G288-R322 PolarHBondContact O-NH1 3.4Å
289	V	92.6	Very high	85.3	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.024	26%	0.258	C	S	.	.			trans	-123.1	165.3	179.1	-61	0	0	0	0	111.5	G284 A285 Y287 M292 V307 V308 L332 L343	G284-V289 CarbonylContact C-O 3.48Å; G284-V289 VanDerWaalsContact CA-O 3.25Å; G284-V289 WeakPolarHBondContact CA-O 3.02Å; G284-V289 PolarHBondContact O-N 2.97Å; G284-V289 VanDerWaalsContact O-O 3.06Å; A285-V289 PolarHBondContact N-O 2.92Å; Y287-V289 VanDerWaalsContact C-N 3.3Å; Y287-V289 PolarHBondContact O-N 3.35Å; V289-M292 HydrophobicContact CG2-SD 3.65Å; V289-V307 WeakPolarHBondContact CB-O 3.23Å; V289-V308 HydrophobicContact CB-CG2 4.38Å; V289-V308 HydrophobicContact CG1-CG2 3.97Å; V289-L332 HydrophobicContact CG1-CD1 3.8Å; V289-L332 HydrophobicContact CG1-CD2 4.33Å; V289-L332 HydrophobicContact CG1-CG 4.4Å; V289-L343 HydrophobicContact CG1-CD1 4.36Å
290	D	92.9	Very high	84.6	Confident	61 Å²	61	44.1 Å²	44.1	33%	0.326	26%	0.261	S	S	.	.	S	Bend	trans	-86.7	-38.3	-175.3	-50.8	-51.3	0	0	0	111.3	G281 V307 V308 V309 R322	G281-D290 WeakPolarHBondContact CA-O 3.33Å; D290-V307 PolarHBondContact N-O 2.87Å; D290-V308 VanDerWaalsContact OD2-CA 3.3Å; D290-V308 WeakPolarHBondContact OD2-CA 3.45Å; D290-V309 HydrophobicContact CB-CG2 4.22Å; D290-V309 PolarHBondContact OD2-N 2.85Å; D290-R322 IonicContact OD1-NH2 3.86Å
291	L	94.2	Very high	84	Confident	11 Å²	11	45 Å²	45	6%	0.058	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.3	179.8	-56	168.9	0	0	0	112.1	A268 F272 P279 V307 V309	A268-L291 HydrophobicContact CB-CD1 4.36Å; F272-L291 HydrophobicContact CD2-CD1 4.26Å; F272-L291 HydrophobicContact CE2-CD1 4.46Å; P279-L291 HydrophobicContact CB-CD1 4.34Å; P279-L291 HydrophobicContact CB-CD2 4.36Å; L291-V307 HydrophobicContact CB-CB 4.18Å; L291-V307 PolarHBondContact N-O 3.49Å; L291-V307 VanDerWaalsContact N-O 3.07Å; L291-V307 PolarHBondContact O-N 2.78Å; L291-V309 HydrophobicContact CD1-CG2 4.2Å
292	M	93.3	Very high	84.1	Confident	2 Å²	2	48 Å²	48	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.9	165.2	-62.8	-62.3	-64	0	0	109.3	P279 K280 Y287 V289 Y294 A303 Y305 S306 K341	P279-M292 CarbonylContact C-O 3.49Å; P279-M292 WeakPolarHBondContact CA-O 3.5Å; K280-M292 PolarHBondContact N-O 2.94Å; K280-M292 PolarHBondContact O-N 3.36Å; Y287-M292 HydrophobicContact CD2-CE 3.9Å; Y287-M292 HydrophobicContact CD2-CG 4.33Å; Y287-M292 HydrophobicContact CD2-SD 3.65Å; Y287-M292 HydrophobicContact CE2-CE 4.07Å; Y287-M292 HydrophobicContact CE2-SD 4.3Å; Y287-M292 HydrophobicContact CG-SD 4.47Å; V289-M292 HydrophobicContact CG2-SD 3.65Å; M292-Y294 HydrophobicContact CB-CE2 3.81Å; M292-A303 HydrophobicContact CB-CB 4.05Å; M292-A303 HydrophobicContact CE-CB 3.52Å; M292-Y305 WeakPolarHBondContact CA-O 3.42Å; M292-S306 PolarHBondContact SD-OG 2.91Å; M292-K341 HydrophobicContact CE-CD 4.27Å; M292-K341 HydrophobicContact CE-CG 4.2Å
293	L	92.7	Very high	85	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.3	-178.2	-57.1	-174.6	0	0	0	112.1	F5 F272 W277 P279 A303 S304 Y305 V307 M344	F5-L293 HydrophobicContact CE1-CD1 4.47Å; F272-L293 HydrophobicContact CB-CD2 3.96Å; F272-L293 HydrophobicContact CD1-CD1 3.52Å; F272-L293 HydrophobicContact CD1-CD2 4.27Å; F272-L293 HydrophobicContact CD2-CD1 4.31Å; F272-L293 HydrophobicContact CD2-CD2 3.86Å; F272-L293 HydrophobicContact CE1-CD1 3.62Å; F272-L293 HydrophobicContact CE2-CD1 4.4Å; F272-L293 HydrophobicContact CE2-CD2 4.46Å; F272-L293 HydrophobicContact CG-CD1 3.9Å; F272-L293 HydrophobicContact CG-CD2 3.76Å; F272-L293 HydrophobicContact CZ-CD1 4.07Å; W277-L293 HydrophobicContact CD2-CB 4.32Å; W277-L293 HydrophobicContact CE3-CB 3.75Å; W277-L293 HydrophobicContact CZ3-CB 4.36Å; P279-L293 HydrophobicContact CB-CD2 3.74Å; L293-A303 CarbonylContact O-C 3.39Å; L293-A303 VanDerWaalsContact O-CA 3.23Å; L293-A303 WeakPolarHBondContact O-CA 3.45Å; L293-S304 PolarHBondContact O-N 2.91Å; L293-Y305 HydrophobicContact CB-CD2 4.31Å; L293-Y305 HydrophobicContact CD1-CD2 4.21Å; L293-Y305 HydrophobicContact CD1-CG 4.47Å; L293-Y305 PolarHBondContact N-O 3.17Å; L293-V307 HydrophobicContact CD1-CG2 3.61Å; L293-V307 HydrophobicContact CD2-CG2 4.22Å; L293-V307 HydrophobicContact CG-CG2 3.55Å; L293-M344 HydrophobicContact CD1-SD 4.4Å
294	Y	90.6	Very high	86.2	Confident	38 Å²	38	44.1 Å²	44.1	15%	0.149	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142.9	175.7	-63.9	-100.3	0	0	0	110.6	W277 V278 K280 M292 P298 Y301 A303	W277-Y294 VanDerWaalsContact CE3-C 3.45Å; W277-Y294 VanDerWaalsContact CE3-O 3.3Å; V278-Y294 PolarHBondContact N-O 3.49Å; V278-Y294 WeakPolarHBondContact O-CD2 3.4Å; V278-Y294 PolarHBondContact O-N 3.38Å; K280-Y294 HydrophobicContact CB-CD2 4.4Å; K280-Y294 HydrophobicContact CB-CE2 4.02Å; K280-Y294 HydrophobicContact CG-CD2 4.15Å; K280-Y294 HydrophobicContact CG-CE2 4.06Å; M292-Y294 HydrophobicContact CB-CE2 3.81Å; Y294-P298 HydrophobicContact CD1-CB 4.27Å; Y294-P298 HydrophobicContact CD1-CG 4.19Å; Y294-P298 HydrophobicContact CD2-CG 4.43Å; Y294-P298 HydrophobicContact CE1-CB 3.88Å; Y294-P298 HydrophobicContact CE1-CG 4.02Å; Y294-P298 HydrophobicContact CE2-CG 4.28Å; Y294-P298 HydrophobicContact CG-CG 4.39Å; Y294-Y301 WeakPolarHBondContact CD1-O 3.47Å; Y294-A303 HydrophobicContact CD1-CB 4.16Å; Y294-A303 HydrophobicContact CD2-CB 4.22Å; Y294-A303 HydrophobicContact CE1-CB 3.88Å; Y294-A303 HydrophobicContact CE2-CB 3.93Å; Y294-A303 HydrophobicContact CG-CB 4.32Å
295	R	84.6	Confident	87	Confident	111 Å²	111	44.2 Å²	44.2	42%	0.419	23%	0.226	S	C	.	.	S	Bend	trans	-71.2	-42	-179.6	-178.4	58.1	174.8	166.4	-0.2	113.3	W277 Y301	W277-R295 HydrophobicContact CH2-CB 4.44Å; W277-R295 HydrophobicContact CZ3-CB 4.07Å; R295-Y301 HydrophobicContact CB-CD2 4.19Å
296	K	81.1	Confident	87.7	Confident	84 Å²	84	40.2 Å²	40.2	37%	0.365	19%	0.193	S	C	.	.	S	Bend	trans	-125.7	-30.8	178.3	-67.8	-165.6	-179.8	-170.7	0	113.4	Y18 Y59 V278 F300 Y301	Y18-K296 HydrophobicContact CD2-CB 4.36Å; Y18-K296 HydrophobicContact CD2-CD 3.93Å; Y18-K296 HydrophobicContact CE2-CB 4.11Å; Y18-K296 HydrophobicContact CE2-CD 3.94Å; Y18-K296 HydrophobicContact CE2-CG 4.19Å; Y59-K296 WeakPolarHBondContact CD2-O 3.45Å; Y59-K296 WeakPolarHBondContact CE2-O 3.41Å; V278-K296 WeakPolarHBondContact CG2-O 3.49Å; K296-F300 HydrophobicContact CB-CB 3.97Å; K296-F300 HydrophobicContact CB-CD2 3.75Å; K296-F300 HydrophobicContact CB-CG 4.1Å; K296-Y301 HydrophobicContact CB-CD2 4.03Å; K296-Y301 HydrophobicContact CB-CE2 4.15Å; K296-Y301 HydrophobicContact CD-CE2 3.94Å; K296-Y301 HydrophobicContact CG-CD2 4.2Å; K296-Y301 HydrophobicContact CG-CE2 3.86Å
297	G	83.1	Confident	88.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.			trans	155.6	164.3	179.7	0	0	0	0	0	110.8	P299 F300 Y301	G297-P299 VanDerWaalsContact C-CD 3.48Å; G297-F300 PolarHBondContact O-N 2.9Å; G297-Y301 PolarHBondContact O-N 2.96Å
298	P	83.8	Confident	88.5	Confident	54 Å²	54	28.8 Å²	28.8	35%	0.351	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-36.5	179.5	-23.2	32.5	0	0	0	115.8	Y294 F300	Y294-P298 HydrophobicContact CD1-CB 4.27Å; Y294-P298 HydrophobicContact CD1-CG 4.19Å; Y294-P298 HydrophobicContact CD2-CG 4.43Å; Y294-P298 HydrophobicContact CE1-CB 3.88Å; Y294-P298 HydrophobicContact CE1-CG 4.02Å; Y294-P298 HydrophobicContact CE2-CG 4.28Å; Y294-P298 HydrophobicContact CG-CG 4.39Å; P298-F300 VanDerWaalsContact C-N 3.33Å; P298-F300 PolarHBondContact O-N 3.28Å
299	P	80.8	Confident	88.7	Confident	32 Å²	32	27.8 Å²	27.8	21%	0.208	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-32	177.3	-26.1	38.7	0	0	0	113.4	T12 E16 Y59 G297	T12-P299 PolarHBondContact OG1-O 3.25Å; E16-P299 HydrophobicContact CG-CB 4.29Å; E16-P299 VanDerWaalsContact OE2-CG 3.31Å; E16-P299 WeakPolarHBondContact OE2-CG 3.34Å; Y59-P299 HydrophobicContact CD1-CG 4.5Å; Y59-P299 HydrophobicContact CE1-CG 3.68Å; G297-P299 VanDerWaalsContact C-CD 3.48Å
300	F	79.5	Confident	88.6	Confident	12 Å²	12	28 Å²	28	5%	0.053	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-35.5	-172.5	-63.3	-63.7	0	0	0	114.8	T12 V14 E16 Y18 Y59 K296 G297 P298	T12-F300 PolarHBondContact OG1-O 3.1Å; V14-F300 HydrophobicContact CB-CD1 4.43Å; V14-F300 HydrophobicContact CG1-CD1 3.47Å; V14-F300 VanDerWaalsContact CG1-CD1 3.47Å; V14-F300 HydrophobicContact CG1-CE1 3.51Å; V14-F300 HydrophobicContact CG2-CD1 4.07Å; E16-F300 HydrophobicContact CB-CE1 4.49Å; E16-F300 HydrophobicContact CB-CZ 4.37Å; E16-F300 VanDerWaalsContact O-CE1 3.24Å; E16-F300 WeakPolarHBondContact O-CE1 3.47Å; Y18-F300 HydrophobicContact CD2-CD2 4.26Å; Y18-F300 AromaticContact CD2-CE2 3.66Å; Y18-F300 HydrophobicContact CD2-CE2 3.66Å; Y18-F300 AromaticContact CD2-CZ 3.99Å; Y18-F300 HydrophobicContact CD2-CZ 3.99Å; Y18-F300 HydrophobicContact CG-CE2 4.48Å; Y18-F300 HydrophobicContact CG-CZ 4.38Å; Y59-F300 AromaticContact CE2-CD2 4Å; Y59-F300 HydrophobicContact CE2-CD2 4Å; Y59-F300 AromaticContact CE2-CE2 3.57Å; Y59-F300 HydrophobicContact CE2-CE2 3.57Å; Y59-F300 AromaticContact CZ-CE2 3.53Å; Y59-F300 WeakPolarHBondContact OH-CE2 3.44Å; Y59-F300 WeakPolarHBondContact OH-CZ 3.45Å; K296-F300 HydrophobicContact CB-CB 3.97Å; K296-F300 HydrophobicContact CB-CD2 3.75Å; K296-F300 HydrophobicContact CB-CG 4.1Å; G297-F300 PolarHBondContact O-N 2.9Å; P298-F300 VanDerWaalsContact C-N 3.33Å; P298-F300 PolarHBondContact O-N 3.28Å
301	Y	79.4	Confident	88.4	Confident	48 Å²	48	29.3 Å²	29.3	19%	0.188	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-146.4	148.5	-175.8	-67.2	-77.4	0	0	0	109.5	P8 R11 T12 Y294 R295 K296 G297	P8-Y301 HydrophobicContact CG-CD1 3.46Å; P8-Y301 VanDerWaalsContact CG-CD1 3.46Å; P8-Y301 HydrophobicContact CG-CE1 4.2Å; P8-Y301 HydrophobicContact CG-CG 3.84Å; R11-Y301 HydrophobicContact CB-CE1 4.44Å; R11-Y301 HydrophobicContact CG-CE1 4.13Å; T12-Y301 PolarHBondContact OG1-N 2.99Å; Y294-Y301 WeakPolarHBondContact CD1-O 3.47Å; R295-Y301 HydrophobicContact CB-CD2 4.19Å; K296-Y301 HydrophobicContact CB-CD2 4.03Å; K296-Y301 HydrophobicContact CB-CE2 4.15Å; K296-Y301 HydrophobicContact CD-CE2 3.94Å; K296-Y301 HydrophobicContact CG-CD2 4.2Å; K296-Y301 HydrophobicContact CG-CE2 3.86Å; G297-Y301 PolarHBondContact O-N 2.96Å
302	H	85.7	Confident	88	Confident	99 Å²	99	29.5 Å²	29.5	46%	0.458	14%	0.135	S	C	.	.			trans	-64.6	154.1	158.1	-60.7	-64.6	0	0	0	109.6	T12	T12-H302 VanDerWaalsContact CG2-CE1 3.48Å; T12-H302 WeakPolarHBondContact CG2-CE1 3.29Å; T12-H302 VanDerWaalsContact CG2-NE2 3.26Å; T12-H302 WeakPolarHBondContact CG2-NE2 3.28Å
303	A	88.9	Confident	87.5	Confident	3 Å²	3	30.3 Å²	30.3	3%	0.025	15%	0.145	C	C	.	.			trans	-52.6	146.5	171.1	0	0	0	0	0	110.6	M292 L293 Y294 K341	M292-A303 HydrophobicContact CB-CB 4.05Å; M292-A303 HydrophobicContact CE-CB 3.52Å; L293-A303 CarbonylContact O-C 3.39Å; L293-A303 VanDerWaalsContact O-CA 3.23Å; L293-A303 WeakPolarHBondContact O-CA 3.45Å; Y294-A303 HydrophobicContact CD1-CB 4.16Å; Y294-A303 HydrophobicContact CD2-CB 4.22Å; Y294-A303 HydrophobicContact CE1-CB 3.88Å; Y294-A303 HydrophobicContact CE2-CB 3.93Å; Y294-A303 HydrophobicContact CG-CB 4.32Å; A303-K341 HydrophobicContact CB-CD 4.18Å; A303-K341 WeakPolarHBondContact O-CD 2.85Å; A303-K341 WeakPolarHBondContact O-CE 3.31Å; A303-K341 PolarHBondContact O-NZ 3.27Å
304	S	90.1	Very high	86.6	Confident	12 Å²	12	34.6 Å²	34.6	8%	0.084	17%	0.165	C	C	.	.	S	Bend	trans	-91.9	-43.1	173.1	-65.8	0	0	0	0	111	P8 L293 E342	P8-S304 WeakPolarHBondContact CB-OG 3.23Å; P8-S304 WeakPolarHBondContact CD-OG 3.49Å; L293-S304 PolarHBondContact O-N 2.91Å; S304-E342 PolarHBondContact O-N 3.24Å
305	Y	92.6	Very high	85.4	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.1	-171.5	-57.2	-79.7	0	0	0	111.5	F5 R6 W277 M292 L293 E342 M344 I374	F5-Y305 HydrophobicContact CD1-CD2 4.44Å; F5-Y305 AromaticContact CD1-CE2 3.82Å; F5-Y305 HydrophobicContact CD1-CE2 3.82Å; F5-Y305 HydrophobicContact CE1-CE2 4.34Å; R6-Y305 PolarHBondContact N-OH 3.11Å; W277-Y305 AromaticContact CH2-CD2 3.99Å; W277-Y305 HydrophobicContact CH2-CD2 3.99Å; W277-Y305 AromaticContact CH2-CE2 3.59Å; W277-Y305 HydrophobicContact CH2-CE2 3.59Å; W277-Y305 HydrophobicContact CZ2-CD2 4.39Å; W277-Y305 AromaticContact CZ2-CE2 3.82Å; W277-Y305 HydrophobicContact CZ2-CE2 3.82Å; W277-Y305 HydrophobicContact CZ3-CD2 4.13Å; W277-Y305 HydrophobicContact CZ3-CE2 4.19Å; M292-Y305 WeakPolarHBondContact CA-O 3.42Å; L293-Y305 HydrophobicContact CB-CD2 4.31Å; L293-Y305 HydrophobicContact CD1-CD2 4.21Å; L293-Y305 HydrophobicContact CD1-CG 4.47Å; L293-Y305 PolarHBondContact N-O 3.17Å; Y305-E342 VanDerWaalsContact CA-O 3.31Å; Y305-E342 WeakPolarHBondContact CA-O 3.18Å; Y305-E342 HydrophobicContact CD1-CB 3.72Å; Y305-E342 HydrophobicContact CE1-CB 3.86Å; Y305-E342 WeakPolarHBondContact CE1-OE2 3.45Å; Y305-M344 HydrophobicContact CD1-CE 3.72Å; Y305-M344 HydrophobicContact CD2-CE 4.35Å; Y305-M344 HydrophobicContact CE1-CE 3.93Å; Y305-M344 HydrophobicContact CG-CE 3.96Å; Y305-I374 HydrophobicContact CE1-CD1 4.11Å
306	S	94.6	Very high	84.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.1	163.2	-60.7	0	0	0	0	107.1	M292 E342 M344	M292-S306 PolarHBondContact SD-OG 2.91Å; S306-E342 PolarHBondContact N-O 3.23Å; S306-M344 PolarHBondContact O-N 2.98Å
307	V	94.6	Very high	83.1	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.4	-169.1	-176.4	0	0	0	0	111	F272 V289 D290 L291 L293 V309 M344 C346	F272-V307 HydrophobicContact CE2-CG1 3.85Å; F272-V307 HydrophobicContact CE2-CG2 4.41Å; F272-V307 HydrophobicContact CZ-CG1 3.99Å; F272-V307 HydrophobicContact CZ-CG2 4.32Å; V289-V307 WeakPolarHBondContact CB-O 3.23Å; D290-V307 PolarHBondContact N-O 2.87Å; L291-V307 HydrophobicContact CB-CB 4.18Å; L291-V307 PolarHBondContact N-O 3.49Å; L291-V307 VanDerWaalsContact N-O 3.07Å; L291-V307 PolarHBondContact O-N 2.78Å; L293-V307 HydrophobicContact CD1-CG2 3.61Å; L293-V307 HydrophobicContact CD2-CG2 4.22Å; L293-V307 HydrophobicContact CG-CG2 3.55Å; V307-V309 HydrophobicContact CG1-CG2 4.43Å; V307-M344 VanDerWaalsContact CA-O 3.31Å; V307-M344 WeakPolarHBondContact CA-O 3.47Å; V307-M344 HydrophobicContact CG2-CB 4.17Å; V307-M344 HydrophobicContact CG2-CG 4.49Å; V307-M344 HydrophobicContact CG2-SD 4.12Å; V307-C346 HydrophobicContact CG1-CB 3.63Å
308	V	94.1	Very high	81.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.1	166.5	-177	0	0	0	0	108.9	V289 D290 E310 F324 L332 L343 M344 L345 C346	V289-V308 HydrophobicContact CB-CG2 4.38Å; V289-V308 HydrophobicContact CG1-CG2 3.97Å; D290-V308 VanDerWaalsContact OD2-CA 3.3Å; D290-V308 WeakPolarHBondContact OD2-CA 3.45Å; V308-E310 HydrophobicContact CG1-CG 4.31Å; V308-F324 HydrophobicContact CG1-CE2 3.9Å; V308-F324 HydrophobicContact CG1-CZ 3.9Å; V308-F324 HydrophobicContact CG2-CZ 4.22Å; V308-L332 HydrophobicContact CG2-CD2 3.55Å; V308-L343 HydrophobicContact CG2-CD1 4.26Å; V308-M344 PolarHBondContact N-O 3.01Å; V308-L345 HydrophobicContact CB-CD2 3.95Å; V308-L345 HydrophobicContact CG2-CD2 4.33Å; V308-C346 PolarHBondContact O-N 3Å
309	V	93.4	Very high	80.5	Confident	11 Å²	11	41.3 Å²	41.3	7%	0.067	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.4	178.7	-177.5	0	0	0	0	109.2	A268 D290 L291 V307 C346 I348	A268-V309 HydrophobicContact CB-CB 4.46Å; A268-V309 HydrophobicContact CB-CG1 3.91Å; A268-V309 HydrophobicContact CB-CG2 3.63Å; D290-V309 HydrophobicContact CB-CG2 4.22Å; D290-V309 PolarHBondContact OD2-N 2.85Å; L291-V309 HydrophobicContact CD1-CG2 4.2Å; V307-V309 HydrophobicContact CG1-CG2 4.43Å; V309-C346 WeakPolarHBondContact CA-O 3.27Å; V309-C346 HydrophobicContact CG2-CB 4.49Å; V309-I348 HydrophobicContact CG1-CG1 3.93Å
310	E	90.4	Very high	79.7	Confident	7 Å²	7	41.9 Å²	41.9	3%	0.033	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.2	-179.6	-71.7	-63	163	0	0	111	V308 A320 L321 R322 F324 C346 Y347 I348	V308-E310 HydrophobicContact CG1-CG 4.31Å; E310-A320 WeakPolarHBondContact OE2-CB 3.48Å; E310-L321 PolarHBondContact OE2-N 3.37Å; E310-R322 WeakPolarHBondContact OE1-CB 3.41Å; E310-R322 PolarHBondContact OE2-N 3.21Å; E310-F324 WeakPolarHBondContact OE1-CE2 3.25Å; E310-C346 PolarHBondContact N-O 3.43Å; E310-Y347 HydrophobicContact CB-CD1 3.83Å; E310-Y347 HydrophobicContact CB-CE1 4.08Å; E310-Y347 HydrophobicContact CG-CE1 4.42Å; E310-Y347 CarbonylContact O-C 3.23Å; E310-Y347 WeakPolarHBondContact O-CA 3.43Å; E310-I348 PolarHBondContact O-N 3.38Å
311	R	89.5	Confident	79.1	Confident	89 Å²	89	45.2 Å²	45.2	34%	0.336	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.4	167.2	179.5	171.6	178.5	-176.6	-0	108.8	L321 Y350 E356	R311-L321 HydrophobicContact CB-CD1 3.83Å; R311-L321 HydrophobicContact CB-CD2 3.99Å; R311-L321 HydrophobicContact CB-CG 3.65Å; R311-Y350 HydrophobicContact CB-CE2 4.41Å; R311-Y350 HydrophobicContact CG-CD2 3.68Å; R311-Y350 HydrophobicContact CG-CE2 3.57Å; R311-E356 IonicContact NH2-OE1 3.63Å
312	T	86.3	Confident	78.8	Confident	15 Å²	15	47.4 Å²	47.4	9%	0.092	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	144.1	178	-57.9	0	0	0	0	110.5	L316 I348 I349 Y350	T312-L316 HydrophobicContact CG2-CD2 3.88Å; T312-I348 PolarHBondContact N-O 3.36Å; T312-I349 CarbonylContact O-C 3.59Å; T312-I349 VanDerWaalsContact O-CA 3.27Å; T312-I349 WeakPolarHBondContact O-CA 3.37Å; T312-Y350 PolarHBondContact O-N 3.23Å
313	G	82.1	Confident	78.3	Confident	20 Å²	20	48 Å²	48	21%	0.206	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	161.5	171.2	0	0	0	0	0	111.6	S315 L316	G313-S315 PolarHBondContact O-N 3.18Å; G313-S315 VanDerWaalsContact O-N 3.14Å; G313-L316 PolarHBondContact O-N 2.66Å
314	E	73.8	Confident	77.9	Confident	89 Å²	89	50.8 Å²	50.8	42%	0.416	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.4	-178.2	-164.6	160.6	-139.2	0	0	114.2	L316 I349 Y350 T352 K369	E314-L316 PolarHBondContact O-N 3.24Å; E314-I349 HydrophobicContact CB-CG2 4.37Å; E314-Y350 PolarHBondContact N-O 3.31Å; E314-Y350 VanDerWaalsContact N-O 3.09Å; E314-T352 HydrophobicContact CB-CG2 4.33Å; E314-K369 IonicContact OE1-NZ 3.95Å; E314-K369 PolarHBondContact OE1-NZ 2.99Å
315	S	65.8	Low	77.8	Confident	94 Å²	94	53.3 Å²	53.3	66%	0.657	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	7.3	175.4	58.5	0	0	0	0	114.6	G313 G317	G313-S315 PolarHBondContact O-N 3.18Å; G313-S315 VanDerWaalsContact O-N 3.14Å; S315-G317 PolarHBondContact O-N 3.19Å
316	L	62.2	Low	77.5	Confident	134 Å²	134	63.1 Å²	63.1	70%	0.702	37%	0.37	S	S	*	.	S	Bend	trans	55.2	5.8	-169.2	-64.3	165	0	0	0	114.2	T312 G313 E314	T312-L316 HydrophobicContact CG2-CD2 3.88Å; G313-L316 PolarHBondContact O-N 2.66Å; E314-L316 PolarHBondContact O-N 3.24Å
317	G	54.4	Low	77.4	Confident	57 Å²	57	73.4 Å²	73.4	59%	0.588	41%	0.408	S	S	*	.			trans	-102.2	93.2	174.5	0	0	0	0	0	109.6	S315	S315-G317 PolarHBondContact O-N 3.19Å
318	G	56	Low	77.2	Confident	49 Å²	49	75.5 Å²	75.5	51%	0.505	42%	0.423	S	S	.	.	S	Bend	trans	-152.6	156.3	172.5	0	0	0	0	0	109.6	A320	G318-A320 PolarHBondContact O-N 3.42Å
319	A	56.9	Low	77	Confident	95 Å²	95	77.1 Å²	77.1	79%	0.785	43%	0.432	S	S	*	.			trans	-64.9	108.6	170.7	0	0	0	0	0	108.1
320	A	63.8	Low	76.9	Confident	43 Å²	43	78.8 Å²	78.8	36%	0.355	45%	0.447	S	S	.	.			trans	-51.6	141.3	169.7	0	0	0	0	0	108.9	E310 G318 R322	E310-A320 WeakPolarHBondContact OE2-CB 3.48Å; G318-A320 PolarHBondContact O-N 3.42Å; A320-R322 PolarHBondContact O-N 2.94Å
321	L	66.7	Low	76.9	Confident	83 Å²	83	80.8 Å²	80.8	44%	0.435	46%	0.464	S	S	.	.	S	Bend	trans	-59.4	-35.1	176	-69	174.3	0	0	0	109.5	E310 R311	E310-L321 PolarHBondContact OE2-N 3.37Å; R311-L321 HydrophobicContact CB-CD1 3.83Å; R311-L321 HydrophobicContact CB-CD2 3.99Å; R311-L321 HydrophobicContact CB-CG 3.65Å
322	R	73	Confident	77	Confident	94 Å²	94	77 Å²	77	36%	0.355	45%	0.45	S	S	.	.	S	Bend	trans	-125.7	103.4	171.9	-172.1	-175.4	-75.1	-179	3.7	110.2	G288 D290 E310 A320 F324	G288-R322 PolarHBondContact O-NH1 3.4Å; D290-R322 IonicContact OD1-NH2 3.86Å; E310-R322 WeakPolarHBondContact OE1-CB 3.41Å; E310-R322 PolarHBondContact OE2-N 3.21Å; A320-R322 PolarHBondContact O-N 2.94Å; R322-F324 HydrophobicContact CB-CE2 4.32Å; R322-F324 HydrophobicContact CG-CE1 4.32Å; R322-F324 HydrophobicContact CG-CE2 4.31Å; R322-F324 HydrophobicContact CG-CZ 4.14Å; R322-F324 WeakPolarHBondContact O-CD2 3.32Å; R322-F324 PolarHBondContact O-N 3.46Å
323	P	74.3	Confident	77.3	Confident	111 Å²	111	77.7 Å²	77.7	72%	0.721	46%	0.456	S	S	*	.			trans	-65.3	110.9	173.2	25.3	-31.7	0	0	0	109.9
324	F	81.2	Confident	77.7	Confident	62 Å²	62	86.4 Å²	86.4	27%	0.272	48%	0.483	S	S	.	.			trans	-86.8	121.6	174.9	-74	-74.3	0	0	0	111.1	V308 E310 R322 L329 L332	V308-F324 HydrophobicContact CG1-CE2 3.9Å; V308-F324 HydrophobicContact CG1-CZ 3.9Å; V308-F324 HydrophobicContact CG2-CZ 4.22Å; E310-F324 WeakPolarHBondContact OE1-CE2 3.25Å; R322-F324 HydrophobicContact CB-CE2 4.32Å; R322-F324 HydrophobicContact CG-CE1 4.32Å; R322-F324 HydrophobicContact CG-CE2 4.31Å; R322-F324 HydrophobicContact CG-CZ 4.14Å; R322-F324 WeakPolarHBondContact O-CD2 3.32Å; R322-F324 PolarHBondContact O-N 3.46Å; F324-L329 HydrophobicContact CB-CB 4.37Å; F324-L329 HydrophobicContact CD1-CB 4.47Å; F324-L332 HydrophobicContact CE1-CD2 3.92Å; F324-L332 HydrophobicContact CZ-CD2 3.94Å
325	S	88.3	Confident	78.6	Confident	65 Å²	65	85.8 Å²	85.8	46%	0.455	48%	0.481	S	S	.	.			trans	-69.7	156.8	152.5	74.1	0	0	0	0	110.1	R327 S328 L329	S325-R327 PolarHBondContact O-N 2.92Å; S325-R327 PolarHBondContact OG-N 2.79Å; S325-S328 WeakPolarHBondContact CA-OG 3.37Å; S325-S328 PolarHBondContact N-OG 2.98Å; S325-S328 PolarHBondContact O-N 3.17Å; S325-S328 VanDerWaalsContact O-N 3.13Å; S325-S328 PolarHBondContact O-OG 3.09Å; S325-S328 PolarHBondContact OG-N 3.13Å; S325-S328 PolarHBondContact OG-OG 2.84Å; S325-L329 PolarHBondContact O-N 2.88Å
326	W	87	Confident	79.8	Confident	207 Å²	207	81.3 Å²	81.3	78%	0.784	45%	0.45	S	S	*	.	H	α-helix	trans	-54.5	-36.2	171.8	-175.9	-110.4	0	0	0	112.3	L329 A330	W326-L329 HydrophobicContact CE3-CD2 4.46Å; W326-L329 HydrophobicContact CZ3-CD2 4.38Å; W326-L329 PolarHBondContact O-N 2.79Å; W326-A330 VanDerWaalsContact O-CB 3.23Å; W326-A330 WeakPolarHBondContact O-CB 3.16Å; W326-A330 PolarHBondContact O-N 2.85Å
327	R	90.9	Very high	81.1	Confident	216 Å²	216	77.9 Å²	77.9	82%	0.815	44%	0.441	S	S	*	.	H	α-helix	trans	-65.5	-44.9	178.1	-64.9	-178.5	-173.9	145.7	1.1	112	S325 A330 A331	S325-R327 PolarHBondContact O-N 2.92Å; S325-R327 PolarHBondContact OG-N 2.79Å; R327-A330 PolarHBondContact O-N 2.78Å; R327-A331 WeakPolarHBondContact O-CB 3.25Å; R327-A331 PolarHBondContact O-N 3.07Å
328	S	90.6	Very high	82.8	Confident	44 Å²	44	79.5 Å²	79.5	31%	0.308	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-39.4	177.7	43.6	0	0	0	0	111.9	S325 A331 L332	S325-S328 WeakPolarHBondContact CA-OG 3.37Å; S325-S328 PolarHBondContact N-OG 2.98Å; S325-S328 PolarHBondContact O-N 3.17Å; S325-S328 VanDerWaalsContact O-N 3.13Å; S325-S328 PolarHBondContact O-OG 3.09Å; S325-S328 PolarHBondContact OG-N 3.13Å; S325-S328 PolarHBondContact OG-OG 2.84Å; S328-A331 PolarHBondContact O-N 2.82Å; S328-L332 WeakPolarHBondContact O-CB 3.44Å; S328-L332 PolarHBondContact O-N 3.41Å
329	L	90.4	Very high	84.4	Confident	34 Å²	34	79.4 Å²	79.4	18%	0.178	43%	0.433	C	S	.	.	H	α-helix	trans	-65.9	-43.8	175.9	-174	60.3	0	0	0	111.5	F324 S325 W326 L332 S333 L343	F324-L329 HydrophobicContact CB-CB 4.37Å; F324-L329 HydrophobicContact CD1-CB 4.47Å; S325-L329 PolarHBondContact O-N 2.88Å; W326-L329 HydrophobicContact CE3-CD2 4.46Å; W326-L329 HydrophobicContact CZ3-CD2 4.38Å; W326-L329 PolarHBondContact O-N 2.79Å; L329-L332 PolarHBondContact O-N 3.1Å; L329-S333 WeakPolarHBondContact O-CB 3.26Å; L329-S333 PolarHBondContact O-N 3.11Å; L329-L343 HydrophobicContact CD1-CD2 4.22Å
330	A	90.3	Very high	85.9	Confident	47 Å²	47	79.6 Å²	79.6	39%	0.388	43%	0.428	S	S	.	.	H	α-helix	trans	-64.1	-40	176.4	0	0	0	0	0	112.2	W326 R327 S333 R334	W326-A330 VanDerWaalsContact O-CB 3.23Å; W326-A330 WeakPolarHBondContact O-CB 3.16Å; W326-A330 PolarHBondContact O-N 2.85Å; R327-A330 PolarHBondContact O-N 2.78Å; A330-S333 PolarHBondContact O-N 2.86Å; A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 2.81Å
331	A	91.8	Very high	87.1	Confident	48 Å²	48	79.4 Å²	79.4	40%	0.397	42%	0.42	S	S	.	.	H	α-helix	trans	-62.3	-46	174.3	0	0	0	0	0	111.1	R327 S328 R334 I335	R327-A331 WeakPolarHBondContact O-CB 3.25Å; R327-A331 PolarHBondContact O-N 3.07Å; S328-A331 PolarHBondContact O-N 2.82Å; A331-R334 PolarHBondContact O-N 3.03Å; A331-I335 VanDerWaalsContact O-CG1 3.3Å; A331-I335 WeakPolarHBondContact O-CG1 3.37Å; A331-I335 PolarHBondContact O-N 2.78Å
332	L	92.1	Very high	88.3	Confident	9 Å²	9	78.9 Å²	78.9	5%	0.047	42%	0.415	C	S	.	.	H	α-helix	trans	-63.4	-43.3	178.1	-173.5	62.6	0	0	0	112.3	Y287 V289 V308 F324 S328 L329 R334 I335 T336 L343	Y287-L332 VanDerWaalsContact O-CD1 3.23Å; Y287-L332 WeakPolarHBondContact O-CD1 3.3Å; V289-L332 HydrophobicContact CG1-CD1 3.8Å; V289-L332 HydrophobicContact CG1-CD2 4.33Å; V289-L332 HydrophobicContact CG1-CG 4.4Å; V308-L332 HydrophobicContact CG2-CD2 3.55Å; F324-L332 HydrophobicContact CE1-CD2 3.92Å; F324-L332 HydrophobicContact CZ-CD2 3.94Å; S328-L332 WeakPolarHBondContact O-CB 3.44Å; S328-L332 PolarHBondContact O-N 3.41Å; L329-L332 PolarHBondContact O-N 3.1Å; L332-R334 VanDerWaalsContact C-N 3.31Å; L332-R334 PolarHBondContact O-N 3.46Å; L332-I335 PolarHBondContact O-N 2.77Å; L332-T336 VanDerWaalsContact O-CB 3.3Å; L332-T336 WeakPolarHBondContact O-CB 3.49Å; L332-T336 PolarHBondContact O-N 2.79Å; L332-T336 PolarHBondContact O-OG1 3.14Å; L332-L343 HydrophobicContact CD2-CD1 3.89Å; L332-L343 HydrophobicContact CD2-CD2 4.27Å; L332-L343 HydrophobicContact CG-CD1 4.02Å; L332-L343 HydrophobicContact CG-CD2 4.18Å
333	S	91.9	Very high	89.3	Confident	30 Å²	30	74.6 Å²	74.6	21%	0.21	40%	0.399	C	S	.	.	H	α-helix	trans	-58.7	-43.1	173.6	-179.2	0	0	0	0	111.1	L329 A330 T336 A337	L329-S333 WeakPolarHBondContact O-CB 3.26Å; L329-S333 PolarHBondContact O-N 3.11Å; A330-S333 PolarHBondContact O-N 2.86Å; S333-T336 PolarHBondContact O-N 2.88Å; S333-A337 VanDerWaalsContact O-CB 3.3Å; S333-A337 WeakPolarHBondContact O-CB 3.31Å; S333-A337 PolarHBondContact O-N 3.31Å
334	R	91	Very high	90.2	Very high	204 Å²	204	69.3 Å²	69.3	77%	0.77	37%	0.365	S	S	*	.	H	α-helix	trans	-66.1	-43.2	177.7	-173.1	178.1	-178.6	177.7	0.4	112.9	A330 A331 L332 T336 A337 S338	A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 2.81Å; A331-R334 PolarHBondContact O-N 3.03Å; L332-R334 VanDerWaalsContact C-N 3.31Å; L332-R334 PolarHBondContact O-N 3.46Å; R334-T336 VanDerWaalsContact C-N 3.34Å; R334-A337 PolarHBondContact O-N 2.94Å; R334-S338 WeakPolarHBondContact O-CB 3.48Å; R334-S338 PolarHBondContact O-N 2.93Å
335	I	92.1	Very high	90.8	Very high	75 Å²	75	67 Å²	67	39%	0.385	36%	0.355	S	S	.	.	H	α-helix	trans	-62.8	-44.5	176.3	-68.7	163.8	0	0	0	110	A331 L332 A337 S338 V339	A331-I335 VanDerWaalsContact O-CG1 3.3Å; A331-I335 WeakPolarHBondContact O-CG1 3.37Å; A331-I335 PolarHBondContact O-N 2.78Å; L332-I335 PolarHBondContact O-N 2.77Å; I335-A337 PolarHBondContact O-N 2.79Å; I335-S338 PolarHBondContact O-N 2.95Å; I335-S338 PolarHBondContact O-OG 2.88Å; I335-V339 WeakPolarHBondContact O-CG2 3.03Å; I335-V339 PolarHBondContact O-N 3.49Å
336	T	91.4	Very high	91.1	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.006	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-43.6	179.4	-60.1	0	0	0	0	111.5	L332 S333 R334 S338 V339 S340 K341 L343	L332-T336 VanDerWaalsContact O-CB 3.3Å; L332-T336 WeakPolarHBondContact O-CB 3.49Å; L332-T336 PolarHBondContact O-N 2.79Å; L332-T336 PolarHBondContact O-OG1 3.14Å; S333-T336 PolarHBondContact O-N 2.88Å; R334-T336 VanDerWaalsContact C-N 3.34Å; T336-S338 PolarHBondContact O-N 2.85Å; T336-V339 WeakPolarHBondContact O-CG2 3.5Å; T336-V339 PolarHBondContact O-N 3.03Å; T336-S340 PolarHBondContact O-N 2.74Å; T336-K341 HydrophobicContact CG2-CB 3.72Å; T336-K341 WeakPolarHBondContact CG2-O 3.28Å; T336-K341 PolarHBondContact O-N 3.48Å; T336-K341 VanDerWaalsContact O-N 3.09Å; T336-L343 HydrophobicContact CG2-CB 3.88Å
337	A	89	Confident	91.4	Very high	61 Å²	61	57.2 Å²	57.2	50%	0.504	31%	0.309	S	S	.	.	H	α-helix	trans	-66.2	-35.7	176.7	0	0	0	0	0	112.8	S333 R334 I335 V339 S340	S333-A337 VanDerWaalsContact O-CB 3.3Å; S333-A337 WeakPolarHBondContact O-CB 3.31Å; S333-A337 PolarHBondContact O-N 3.31Å; R334-A337 PolarHBondContact O-N 2.94Å; I335-A337 PolarHBondContact O-N 2.79Å; A337-V339 PolarHBondContact O-N 3.24Å; A337-S340 PolarHBondContact O-N 2.87Å
338	S	89.9	Confident	91.5	Very high	91 Å²	91	46.9 Å²	46.9	64%	0.636	27%	0.27	S	S	*	.	H	α-helix	trans	-64.3	-29.4	-179.6	74.3	0	0	0	0	112.6	R334 I335 T336 S340	R334-S338 WeakPolarHBondContact O-CB 3.48Å; R334-S338 PolarHBondContact O-N 2.93Å; I335-S338 PolarHBondContact O-N 2.95Å; I335-S338 PolarHBondContact O-OG 2.88Å; T336-S338 PolarHBondContact O-N 2.85Å; S338-S340 VanDerWaalsContact C-N 3.33Å
339	V	88.9	Confident	91.6	Very high	47 Å²	47	45.9 Å²	45.9	29%	0.285	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	15.4	173.4	-65.5	0	0	0	0	113.9	Y287 I335 T336 A337 K341	Y287-V339 HydrophobicContact CD1-CG1 4.28Å; Y287-V339 HydrophobicContact CD1-CG2 4.01Å; Y287-V339 HydrophobicContact CE1-CB 4.3Å; Y287-V339 HydrophobicContact CE1-CG1 3.74Å; Y287-V339 HydrophobicContact CE1-CG2 4.04Å; I335-V339 WeakPolarHBondContact O-CG2 3.03Å; I335-V339 PolarHBondContact O-N 3.49Å; T336-V339 WeakPolarHBondContact O-CG2 3.5Å; T336-V339 PolarHBondContact O-N 3.03Å; A337-V339 PolarHBondContact O-N 3.24Å; V339-K341 HydrophobicContact CB-CG 4.36Å; V339-K341 HydrophobicContact CG2-CB 4.37Å; V339-K341 HydrophobicContact CG2-CG 3.65Å; V339-K341 VanDerWaalsContact O-CE 3.28Å; V339-K341 WeakPolarHBondContact O-CE 3.3Å; V339-K341 PolarHBondContact O-N 2.76Å
340	S	88.5	Confident	91.7	Very high	99 Å²	99	45.1 Å²	45.1	69%	0.692	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	50.8	178	-57.3	0	0	0	0	112.3	T336 A337 S338	T336-S340 PolarHBondContact O-N 2.74Å; A337-S340 PolarHBondContact O-N 2.87Å; S338-S340 VanDerWaalsContact C-N 3.33Å
341	K	90.6	Very high	91.7	Very high	40 Å²	40	43.7 Å²	43.7	17%	0.174	24%	0.242	C	C	.	.			trans	-122.8	161	174.9	-52.4	-65.7	156.1	-130.1	0	109.3	M292 A303 T336 V339	M292-K341 HydrophobicContact CE-CD 4.27Å; M292-K341 HydrophobicContact CE-CG 4.2Å; A303-K341 HydrophobicContact CB-CD 4.18Å; A303-K341 WeakPolarHBondContact O-CD 2.85Å; A303-K341 WeakPolarHBondContact O-CE 3.31Å; A303-K341 PolarHBondContact O-NZ 3.27Å; T336-K341 HydrophobicContact CG2-CB 3.72Å; T336-K341 WeakPolarHBondContact CG2-O 3.28Å; T336-K341 PolarHBondContact O-N 3.48Å; T336-K341 VanDerWaalsContact O-N 3.09Å; V339-K341 HydrophobicContact CB-CG 4.36Å; V339-K341 HydrophobicContact CG2-CB 4.37Å; V339-K341 HydrophobicContact CG2-CG 3.65Å; V339-K341 VanDerWaalsContact O-CE 3.28Å; V339-K341 WeakPolarHBondContact O-CE 3.3Å; V339-K341 PolarHBondContact O-N 2.76Å
342	E	91.4	Very high	91.5	Very high	72 Å²	72	46.9 Å²	46.9	34%	0.336	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.9	172.1	-70.3	179.1	-163.3	0	0	109.9	S304 Y305 S306	S304-E342 PolarHBondContact O-N 3.24Å; Y305-E342 VanDerWaalsContact CA-O 3.31Å; Y305-E342 WeakPolarHBondContact CA-O 3.18Å; Y305-E342 HydrophobicContact CD1-CB 3.72Å; Y305-E342 HydrophobicContact CE1-CB 3.86Å; Y305-E342 WeakPolarHBondContact CE1-OE2 3.45Å; S306-E342 PolarHBondContact N-O 3.23Å
343	L	93.1	Very high	91.3	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	129.3	177.4	178.7	61.3	0	0	0	108.8	V289 V308 L329 L332 T336 V375	V289-L343 HydrophobicContact CG1-CD1 4.36Å; V308-L343 HydrophobicContact CG2-CD1 4.26Å; L329-L343 HydrophobicContact CD1-CD2 4.22Å; L332-L343 HydrophobicContact CD2-CD1 3.89Å; L332-L343 HydrophobicContact CD2-CD2 4.27Å; L332-L343 HydrophobicContact CG-CD1 4.02Å; L332-L343 HydrophobicContact CG-CD2 4.18Å; T336-L343 HydrophobicContact CG2-CB 3.88Å; L343-V375 HydrophobicContact CB-CB 4.23Å; L343-V375 HydrophobicContact CD2-CB 4.07Å; L343-V375 HydrophobicContact CD2-CG1 4.25Å; L343-V375 HydrophobicContact CD2-CG2 4.41Å; L343-V375 HydrophobicContact CG-CB 4.14Å; L343-V375 HydrophobicContact CG-CG2 4.41Å; L343-V375 PolarHBondContact O-N 3.03Å
344	M	94.2	Very high	91.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.2	178	180	-178.5	-74.9	0	0	109.6	A3 F5 F272 L293 Y305 S306 V307 V308 E372 A373 I374	A3-M344 HydrophobicContact CB-CE 4.21Å; F5-M344 HydrophobicContact CD1-CE 4.43Å; F5-M344 HydrophobicContact CE1-CE 3.62Å; F5-M344 HydrophobicContact CE1-SD 4.36Å; F5-M344 HydrophobicContact CZ-CE 3.84Å; F5-M344 HydrophobicContact CZ-SD 4.39Å; F272-M344 HydrophobicContact CE1-SD 3.83Å; F272-M344 HydrophobicContact CZ-SD 3.85Å; L293-M344 HydrophobicContact CD1-SD 4.4Å; Y305-M344 HydrophobicContact CD1-CE 3.72Å; Y305-M344 HydrophobicContact CD2-CE 4.35Å; Y305-M344 HydrophobicContact CE1-CE 3.93Å; Y305-M344 HydrophobicContact CG-CE 3.96Å; S306-M344 PolarHBondContact O-N 2.98Å; V307-M344 VanDerWaalsContact CA-O 3.31Å; V307-M344 WeakPolarHBondContact CA-O 3.47Å; V307-M344 HydrophobicContact CG2-CB 4.17Å; V307-M344 HydrophobicContact CG2-CG 4.49Å; V307-M344 HydrophobicContact CG2-SD 4.12Å; V308-M344 PolarHBondContact N-O 3.01Å; M344-E372 HydrophobicContact SD-CB 4.49Å; M344-A373 CarbonylContact C-O 3.48Å; M344-A373 WeakPolarHBondContact CA-O 3.32Å; M344-I374 HydrophobicContact CE-CG1 4.11Å
345	L	93.2	Very high	90.9	Very high	13 Å²	13	44.1 Å²	44.1	7%	0.068	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.3	167.7	-54.4	179.2	0	0	0	107.8	V308 Y347 E372 A373 V375	V308-L345 HydrophobicContact CB-CD2 3.95Å; V308-L345 HydrophobicContact CG2-CD2 4.33Å; L345-Y347 HydrophobicContact CB-CD2 4.41Å; L345-Y347 HydrophobicContact CB-CE2 3.7Å; L345-Y347 HydrophobicContact CD1-CE2 4.43Å; L345-Y347 VanDerWaalsContact CD1-OH 3.24Å; L345-Y347 WeakPolarHBondContact CD1-OH 3.4Å; L345-E372 WeakPolarHBondContact O-CA 3.48Å; L345-A373 HydrophobicContact CB-CB 4.45Å; L345-A373 PolarHBondContact N-O 3.06Å; L345-A373 PolarHBondContact O-N 3.25Å; L345-V375 HydrophobicContact CD1-CG2 3.72Å; L345-V375 HydrophobicContact CD2-CG2 4.5Å; L345-V375 HydrophobicContact CG-CG2 3.7Å
346	C	94.5	Very high	90.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	104.1	177.8	-175.5	0	0	0	0	108.3	F272 V307 V308 V309 E310	F272-C346 HydrophobicContact CE2-CB 4.26Å; F272-C346 HydrophobicContact CZ-CB 4.1Å; V307-C346 HydrophobicContact CG1-CB 3.63Å; V308-C346 PolarHBondContact O-N 3Å; V309-C346 WeakPolarHBondContact CA-O 3.27Å; V309-C346 HydrophobicContact CG2-CB 4.49Å; E310-C346 PolarHBondContact N-O 3.43Å
347	Y	93.1	Very high	90.5	Very high	66 Å²	66	52.1 Å²	52.1	26%	0.259	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	123.3	179.7	-62	-80.1	0	0	0	110.2	E310 L345 V370 Q371 A373	E310-Y347 HydrophobicContact CB-CD1 3.83Å; E310-Y347 HydrophobicContact CB-CE1 4.08Å; E310-Y347 HydrophobicContact CG-CE1 4.42Å; E310-Y347 CarbonylContact O-C 3.23Å; E310-Y347 WeakPolarHBondContact O-CA 3.43Å; L345-Y347 HydrophobicContact CB-CD2 4.41Å; L345-Y347 HydrophobicContact CB-CE2 3.7Å; L345-Y347 HydrophobicContact CD1-CE2 4.43Å; L345-Y347 VanDerWaalsContact CD1-OH 3.24Å; L345-Y347 WeakPolarHBondContact CD1-OH 3.4Å; Y347-V370 WeakPolarHBondContact O-CA 3.36Å; Y347-Q371 PolarHBondContact N-O 3.45Å; Y347-Q371 PolarHBondContact O-N 3.18Å; Y347-A373 HydrophobicContact CE2-CB 4.08Å
348	I	94.1	Very high	90.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	106.8	170.2	-49.8	-57.6	0	0	0	107.2	A267 A268 V309 E310 T312 Y350 L368 V370	A267-I348 HydrophobicContact CB-CD1 4.08Å; A267-I348 HydrophobicContact CB-CG2 4.15Å; A268-I348 HydrophobicContact CB-CD1 4.1Å; V309-I348 HydrophobicContact CG1-CG1 3.93Å; E310-I348 PolarHBondContact O-N 3.38Å; T312-I348 PolarHBondContact N-O 3.36Å; I348-Y350 HydrophobicContact CB-CE2 4.23Å; I348-Y350 HydrophobicContact CG2-CD2 4.2Å; I348-Y350 HydrophobicContact CG2-CE2 3.63Å; I348-Y350 WeakPolarHBondContact O-CD2 3.23Å; I348-L368 HydrophobicContact CG2-CB 4.37Å; I348-L368 HydrophobicContact CG2-CD1 4.05Å; I348-V370 HydrophobicContact CD1-CB 4.39Å; I348-V370 HydrophobicContact CD1-CG1 4.02Å; I348-V370 HydrophobicContact CD1-CG2 3.79Å
349	I	92.4	Very high	90.6	Very high	22 Å²	22	48.1 Å²	48.1	11%	0.113	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	115.5	-174.3	-55.3	168.3	0	0	0	108.8	T312 E314 K369 Q371	T312-I349 CarbonylContact O-C 3.59Å; T312-I349 VanDerWaalsContact O-CA 3.27Å; T312-I349 WeakPolarHBondContact O-CA 3.37Å; E314-I349 HydrophobicContact CB-CG2 4.37Å; I349-K369 HydrophobicContact CB-CB 4.15Å; I349-K369 HydrophobicContact CD1-CB 4.49Å; I349-K369 PolarHBondContact N-O 3.47Å; I349-K369 PolarHBondContact O-N 3.2Å; I349-K369 VanDerWaalsContact O-N 3.13Å; I349-Q371 HydrophobicContact CD1-CB 4.02Å
350	Y	91.8	Very high	90.7	Very high	18 Å²	18	48.7 Å²	48.7	7%	0.071	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125	176.2	-75.8	-114.4	0	0	0	109	V263 S264 R311 T312 E314 I348 L354 L359 L368	V263-Y350 WeakPolarHBondContact CB-OH 3.41Å; V263-Y350 VanDerWaalsContact CG1-OH 3.31Å; V263-Y350 WeakPolarHBondContact CG1-OH 3.33Å; S264-Y350 PolarHBondContact OG-OH 2.82Å; S264-Y350 VanDerWaalsContact OG-OH 3.1Å; R311-Y350 HydrophobicContact CB-CE2 4.41Å; R311-Y350 HydrophobicContact CG-CD2 3.68Å; R311-Y350 HydrophobicContact CG-CE2 3.57Å; T312-Y350 PolarHBondContact O-N 3.23Å; E314-Y350 PolarHBondContact N-O 3.31Å; E314-Y350 VanDerWaalsContact N-O 3.09Å; I348-Y350 HydrophobicContact CB-CE2 4.23Å; I348-Y350 HydrophobicContact CG2-CD2 4.2Å; I348-Y350 HydrophobicContact CG2-CE2 3.63Å; I348-Y350 WeakPolarHBondContact O-CD2 3.23Å; Y350-L354 HydrophobicContact CD1-CD2 3.8Å; Y350-L354 HydrophobicContact CE1-CD2 4.28Å; Y350-L359 HydrophobicContact CE1-CD1 4.36Å; Y350-L359 HydrophobicContact CE1-CD2 3.96Å; Y350-L368 HydrophobicContact CD1-CD2 3.83Å; Y350-L368 HydrophobicContact CD2-CD2 4.1Å; Y350-L368 HydrophobicContact CE1-CD2 3.91Å; Y350-L368 HydrophobicContact CE2-CD2 4.17Å; Y350-L368 HydrophobicContact CG-CD2 3.9Å
351	P	90.9	Very high	91	Very high	18 Å²	18	45.7 Å²	45.7	12%	0.117	24%	0.243	C	C	.	.			trans	-71	150.8	174.6	32.4	-32.5	0	0	0	109.8	D353 L354 R367	P351-D353 WeakPolarHBondContact CB-OD1 3.43Å; P351-D353 PolarHBondContact O-N 2.85Å; P351-L354 HydrophobicContact CG-CB 4.08Å; P351-L354 WeakPolarHBondContact O-CB 3.42Å; P351-L354 PolarHBondContact O-N 2.91Å; P351-R367 HydrophobicContact CG-CB 4.36Å
352	T	86.6	Confident	91.2	Very high	115 Å²	115	44.1 Å²	44.1	71%	0.706	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.2	-170.7	49	0	0	0	0	113.9	E314	E314-T352 HydrophobicContact CB-CG2 4.33Å
353	D	88.1	Confident	91.3	Very high	108 Å²	108	45.2 Å²	45.2	58%	0.578	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	7.1	179.5	68.4	-31	0	0	0	113.1	P351 R367	P351-D353 WeakPolarHBondContact CB-OD1 3.43Å; P351-D353 PolarHBondContact O-N 2.85Å; D353-R367 PolarHBondContact O-NH2 2.86Å; D353-R367 VanDerWaalsContact O-NH2 3.13Å; D353-R367 IonicContact OD1-NH2 2.83Å; D353-R367 PolarHBondContact OD1-NH2 2.93Å; D353-R367 IonicContact OD2-CZ 3.97Å; D353-R367 IonicContact OD2-NH2 3.55Å; D353-R367 PolarHBondContact OD2-NH2 3.45Å
354	L	87.9	Confident	91.3	Very high	28 Å²	28	45.2 Å²	45.2	15%	0.147	25%	0.248	C	C	.	.			trans	-85.1	115.5	176.9	-164	67.9	0	0	0	110.1	Y350 P351 D358 L359 C364 R367 L368	Y350-L354 HydrophobicContact CD1-CD2 3.8Å; Y350-L354 HydrophobicContact CE1-CD2 4.28Å; P351-L354 HydrophobicContact CG-CB 4.08Å; P351-L354 WeakPolarHBondContact O-CB 3.42Å; P351-L354 PolarHBondContact O-N 2.91Å; L354-D358 HydrophobicContact CD1-CB 3.53Å; L354-D358 HydrophobicContact CG-CB 4.21Å; L354-L359 HydrophobicContact CD2-CD2 3.62Å; L354-L359 HydrophobicContact CG-CD2 4.2Å; L354-C364 HydrophobicContact CD1-CB 4.44Å; L354-R367 VanDerWaalsContact CD1-NH1 3.26Å; L354-L368 HydrophobicContact CD2-CD2 3.81Å
355	S	87.8	Confident	91.2	Very high	49 Å²	49	46.6 Å²	46.6	34%	0.343	26%	0.255	S	S	.	.			trans	-82.5	164.2	175.9	67.1	0	0	0	0	112	D357 D358	S355-D357 VanDerWaalsContact C-N 3.25Å; S355-D357 PolarHBondContact O-N 3.09Å; S355-D358 PolarHBondContact N-OD2 2.9Å; S355-D358 WeakPolarHBondContact O-CB 3.24Å; S355-D358 PolarHBondContact O-N 3.47Å; S355-D358 PolarHBondContact OG-N 3.44Å; S355-D358 VanDerWaalsContact OG-N 3.16Å; S355-D358 PolarHBondContact OG-OD2 3.5Å
356	E	86.4	Confident	91.2	Very high	111 Å²	111	50.8 Å²	50.8	52%	0.519	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-29.4	172.1	-74.1	-65.4	142.1	0	0	112.1	R256 R311 D358 L359	R256-E356 IonicContact NH2-OE2 3.84Å; R311-E356 IonicContact NH2-OE1 3.63Å; E356-D358 VanDerWaalsContact C-N 3.34Å; E356-L359 WeakPolarHBondContact O-CB 3.36Å; E356-L359 PolarHBondContact O-N 2.82Å; E356-L359 VanDerWaalsContact O-N 3.15Å
357	D	88.2	Confident	91.2	Very high	133 Å²	133	54.5 Å²	54.5	71%	0.711	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-35.4	175.1	-63.7	-31.4	0	0	0	111.5	S355 L359 D360	S355-D357 VanDerWaalsContact C-N 3.25Å; S355-D357 PolarHBondContact O-N 3.09Å; D357-L359 PolarHBondContact O-N 2.9Å; D357-D360 WeakPolarHBondContact O-CB 3.48Å; D357-D360 PolarHBondContact O-N 2.97Å; D357-D360 VanDerWaalsContact O-N 3.11Å
358	D	89.7	Confident	91.2	Very high	63 Å²	63	52.2 Å²	52.2	34%	0.337	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.3	-29.5	174.2	-67.7	-51.5	0	0	0	111.7	L354 S355 E356 D360 C364 R367	L354-D358 HydrophobicContact CD1-CB 3.53Å; L354-D358 HydrophobicContact CG-CB 4.21Å; S355-D358 PolarHBondContact N-OD2 2.9Å; S355-D358 WeakPolarHBondContact O-CB 3.24Å; S355-D358 PolarHBondContact O-N 3.47Å; S355-D358 PolarHBondContact OG-N 3.44Å; S355-D358 VanDerWaalsContact OG-N 3.16Å; S355-D358 PolarHBondContact OG-OD2 3.5Å; E356-D358 VanDerWaalsContact C-N 3.34Å; D358-D360 PolarHBondContact O-N 3.3Å; D358-C364 WeakPolarHBondContact O-CB 3.38Å; D358-R367 IonicContact OD1-NH1 3.77Å; D358-R367 IonicContact OD2-NH1 3.75Å; D358-R367 PolarHBondContact OD2-NH1 3.49Å
359	L	91	Very high	91.2	Very high	5 Å²	5	57.8 Å²	57.8	3%	0.026	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-74.5	-11.8	178.9	-59.7	178.3	0	0	0	112.7	W252 R256 V263 Y350 L354 E356 D357 S361 C364	W252-L359 PolarHBondContact NE1-O 3.49Å; R256-L359 WeakPolarHBondContact CD-O 3.3Å; R256-L359 VanDerWaalsContact CZ-CB 3.49Å; R256-L359 VanDerWaalsContact CZ-O 3.26Å; R256-L359 PolarHBondContact NE-O 3.5Å; R256-L359 PolarHBondContact NH1-O 3.42Å; V263-L359 HydrophobicContact CG1-CD2 4.33Å; Y350-L359 HydrophobicContact CE1-CD1 4.36Å; Y350-L359 HydrophobicContact CE1-CD2 3.96Å; L354-L359 HydrophobicContact CD2-CD2 3.62Å; L354-L359 HydrophobicContact CG-CD2 4.2Å; E356-L359 WeakPolarHBondContact O-CB 3.36Å; E356-L359 PolarHBondContact O-N 2.82Å; E356-L359 VanDerWaalsContact O-N 3.15Å; D357-L359 PolarHBondContact O-N 2.9Å; L359-S361 PolarHBondContact O-N 2.94Å; L359-C364 HydrophobicContact CD2-CB 4.05Å
360	D	91.6	Very high	91.3	Very high	58 Å²	58	58.7 Å²	58.7	31%	0.31	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-71	-4.4	176.5	-83.4	0.9	0	0	0	113.7	R253 R256 D357 D358	R253-D360 PolarHBondContact NE-O 3.45Å; R256-D360 IonicContact CZ-OD1 3.91Å; R256-D360 VanDerWaalsContact NH1-N 3.19Å; R256-D360 IonicContact NH1-OD1 3.71Å; R256-D360 PolarHBondContact NH1-OD1 3.32Å; R256-D360 IonicContact NH2-OD1 2.66Å; D357-D360 WeakPolarHBondContact O-CB 3.48Å; D357-D360 PolarHBondContact O-N 2.97Å; D357-D360 VanDerWaalsContact O-N 3.11Å; D358-D360 PolarHBondContact O-N 3.3Å
361	S	93.9	Very high	91.4	Very high	37 Å²	37	62.6 Å²	62.6	26%	0.259	34%	0.341	S	S	.	.	S	Bend	trans	-130.4	143.1	179.3	178	0	0	0	0	111.5	L359 V363 C364	L359-S361 PolarHBondContact O-N 2.94Å; S361-V363 PolarHBondContact O-N 3.36Å; S361-V363 WeakPolarHBondContact OG-CG2 3.39Å; S361-V363 PolarHBondContact OG-N 3.43Å; S361-C364 PolarHBondContact O-N 2.82Å; S361-C364 PolarHBondContact O-SG 2.9Å
362	P	94.8	Very high	91.5	Very high	6 Å²	6	62 Å²	62	4%	0.039	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-63.3	-10.6	175.2	28.1	-36.5	0	0	0	113.4	F228 Y232 V248 W252 C364 L365	F228-P362 HydrophobicContact CE1-CB 4.15Å; F228-P362 HydrophobicContact CZ-CB 3.86Å; F228-P362 HydrophobicContact CZ-CG 4.29Å; Y232-P362 HydrophobicContact CD2-CB 4.35Å; Y232-P362 HydrophobicContact CD2-CG 4.4Å; Y232-P362 HydrophobicContact CE2-CB 3.98Å; Y232-P362 HydrophobicContact CE2-CG 4.03Å; V248-P362 HydrophobicContact CG1-CG 4.19Å; W252-P362 HydrophobicContact CD2-CB 4.05Å; W252-P362 HydrophobicContact CE3-CB 4.04Å; W252-P362 HydrophobicContact CG-CB 4.43Å; W252-P362 HydrophobicContact CZ3-CB 4.45Å; P362-C364 PolarHBondContact O-N 2.88Å; P362-L365 HydrophobicContact CB-CD1 4.29Å; P362-L365 VanDerWaalsContact O-CB 3.3Å; P362-L365 WeakPolarHBondContact O-CB 3.3Å; P362-L365 WeakPolarHBondContact O-CD1 3.47Å; P362-L365 VanDerWaalsContact O-CG 3.26Å; P362-L365 WeakPolarHBondContact O-CG 3.37Å; P362-L365 PolarHBondContact O-N 3.33Å; P362-L365 VanDerWaalsContact O-N 3.14Å
363	V	93.6	Very high	91.7	Very high	95 Å²	95	58.2 Å²	58.2	58%	0.576	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-57.8	-28.9	174.1	176.5	0	0	0	0	111.8	S361 L365 S366	S361-V363 PolarHBondContact O-N 3.36Å; S361-V363 WeakPolarHBondContact OG-CG2 3.39Å; S361-V363 PolarHBondContact OG-N 3.43Å; V363-L365 PolarHBondContact O-N 2.89Å; V363-L365 VanDerWaalsContact O-N 3.08Å; V363-S366 PolarHBondContact O-N 3.44Å; V363-S366 VanDerWaalsContact O-N 3.15Å; V363-S366 PolarHBondContact O-OG 3.31Å
364	C	92.8	Very high	91.8	Very high	4 Å²	4	55.8 Å²	55.8	3%	0.027	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-56	-28.4	177.7	72.5	0	0	0	0	113.1	L354 D358 L359 S361 P362 S366 R367 L368	L354-C364 HydrophobicContact CD1-CB 4.44Å; D358-C364 WeakPolarHBondContact O-CB 3.38Å; L359-C364 HydrophobicContact CD2-CB 4.05Å; S361-C364 PolarHBondContact O-N 2.82Å; S361-C364 PolarHBondContact O-SG 2.9Å; P362-C364 PolarHBondContact O-N 2.88Å; C364-S366 PolarHBondContact O-N 2.77Å; C364-R367 WeakPolarHBondContact O-CB 3.46Å; C364-R367 PolarHBondContact O-N 2.87Å; C364-L368 PolarHBondContact O-N 3.43Å
365	L	93.8	Very high	91.8	Very high	30 Å²	30	56.4 Å²	56.4	16%	0.157	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-58	-31.6	-179.4	-66.1	169.4	0	0	0	113	Y232 W252 Y266 A267 P362 V363 R367 L368	Y232-L365 HydrophobicContact CE1-CD1 4.25Å; W252-L365 HydrophobicContact CH2-CD1 4.15Å; W252-L365 HydrophobicContact CH2-CD2 3.93Å; W252-L365 HydrophobicContact CH2-CG 4.04Å; W252-L365 HydrophobicContact CZ3-CD1 4.16Å; Y266-L365 HydrophobicContact CD1-CD1 3.73Å; Y266-L365 HydrophobicContact CD1-CD2 3.94Å; Y266-L365 HydrophobicContact CD1-CG 4.49Å; Y266-L365 HydrophobicContact CE1-CD1 3.44Å; Y266-L365 VanDerWaalsContact CE1-CD1 3.44Å; Y266-L365 HydrophobicContact CE1-CD2 4.43Å; A267-L365 HydrophobicContact CB-CD2 4Å; P362-L365 HydrophobicContact CB-CD1 4.29Å; P362-L365 VanDerWaalsContact O-CB 3.3Å; P362-L365 WeakPolarHBondContact O-CB 3.3Å; P362-L365 WeakPolarHBondContact O-CD1 3.47Å; P362-L365 VanDerWaalsContact O-CG 3.26Å; P362-L365 WeakPolarHBondContact O-CG 3.37Å; P362-L365 PolarHBondContact O-N 3.33Å; P362-L365 VanDerWaalsContact O-N 3.14Å; V363-L365 PolarHBondContact O-N 2.89Å; V363-L365 VanDerWaalsContact O-N 3.08Å; L365-R367 PolarHBondContact O-N 2.95Å; L365-L368 HydrophobicContact CD2-CD1 4.2Å; L365-L368 PolarHBondContact O-N 2.89Å
366	S	93.1	Very high	91.5	Very high	100 Å²	100	58.5 Å²	58.5	70%	0.699	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-68.2	-22.7	177.5	65.5	0	0	0	0	113.5	V363 C364	V363-S366 PolarHBondContact O-N 3.44Å; V363-S366 VanDerWaalsContact O-N 3.15Å; V363-S366 PolarHBondContact O-OG 3.31Å; C364-S366 PolarHBondContact O-N 2.77Å
367	R	93.7	Very high	90.9	Very high	79 Å²	79	63.3 Å²	63.3	30%	0.298	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-18.3	179.6	-65	177.8	64.5	-165.2	-4	112.7	P351 D353 L354 D358 C364 L365	P351-R367 HydrophobicContact CG-CB 4.36Å; D353-R367 PolarHBondContact O-NH2 2.86Å; D353-R367 VanDerWaalsContact O-NH2 3.13Å; D353-R367 IonicContact OD1-NH2 2.83Å; D353-R367 PolarHBondContact OD1-NH2 2.93Å; D353-R367 IonicContact OD2-CZ 3.97Å; D353-R367 IonicContact OD2-NH2 3.55Å; D353-R367 PolarHBondContact OD2-NH2 3.45Å; L354-R367 VanDerWaalsContact CD1-NH1 3.26Å; D358-R367 IonicContact OD1-NH1 3.77Å; D358-R367 IonicContact OD2-NH1 3.75Å; D358-R367 PolarHBondContact OD2-NH1 3.49Å; C364-R367 WeakPolarHBondContact O-CB 3.46Å; C364-R367 PolarHBondContact O-N 2.87Å; L365-R367 PolarHBondContact O-N 2.95Å
368	L	93.5	Very high	90.1	Very high	18 Å²	18	65.6 Å²	65.6	9%	0.094	34%	0.335	C	S	.	.			trans	-75.5	139.8	177.3	-58.8	-179.7	0	0	0	110.3	V263 A267 I348 Y350 L354 C364 L365	V263-L368 HydrophobicContact CG1-CD1 3.8Å; A267-L368 HydrophobicContact CB-CD1 4.11Å; I348-L368 HydrophobicContact CG2-CB 4.37Å; I348-L368 HydrophobicContact CG2-CD1 4.05Å; Y350-L368 HydrophobicContact CD1-CD2 3.83Å; Y350-L368 HydrophobicContact CD2-CD2 4.1Å; Y350-L368 HydrophobicContact CE1-CD2 3.91Å; Y350-L368 HydrophobicContact CE2-CD2 4.17Å; Y350-L368 HydrophobicContact CG-CD2 3.9Å; L354-L368 HydrophobicContact CD2-CD2 3.81Å; C364-L368 PolarHBondContact O-N 3.43Å; L365-L368 HydrophobicContact CD2-CD1 4.2Å; L365-L368 PolarHBondContact O-N 2.89Å
369	K	93.9	Very high	89.3	Confident	116 Å²	116	64.8 Å²	64.8	50%	0.504	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.7	171.6	-59.4	168.5	-174.2	162	0	109.2	E314 I349	E314-K369 IonicContact OE1-NZ 3.95Å; E314-K369 PolarHBondContact OE1-NZ 2.99Å; I349-K369 HydrophobicContact CB-CB 4.15Å; I349-K369 HydrophobicContact CD1-CB 4.49Å; I349-K369 PolarHBondContact N-O 3.47Å; I349-K369 PolarHBondContact O-N 3.2Å; I349-K369 VanDerWaalsContact O-N 3.13Å
370	V	94.2	Very high	88.4	Confident	42 Å²	42	66.9 Å²	66.9	26%	0.255	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.1	176.9	-175.7	0	0	0	0	109.2	H271 Y347 I348	H271-V370 HydrophobicContact CB-CG1 4.26Å; H271-V370 HydrophobicContact CB-CG2 4.25Å; Y347-V370 WeakPolarHBondContact O-CA 3.36Å; I348-V370 HydrophobicContact CD1-CB 4.39Å; I348-V370 HydrophobicContact CD1-CG1 4.02Å; I348-V370 HydrophobicContact CD1-CG2 3.79Å
371	Q	93.4	Very high	87.4	Confident	100 Å²	100	67.8 Å²	67.8	47%	0.467	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.8	177.3	178.9	175.8	-31.3	0	0	111	Y347 I349	Y347-Q371 PolarHBondContact N-O 3.45Å; Y347-Q371 PolarHBondContact O-N 3.18Å; I349-Q371 HydrophobicContact CD1-CB 4.02Å
372	E	93.4	Very high	86.1	Confident	6 Å²	6	72.8 Å²	72.8	3%	0.028	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.5	-177.2	-56.1	144.7	147.8	0	0	109.9	A3 F5 H271 R275 M344 L345	A3-E372 HydrophobicContact CB-CB 3.87Å; F5-E372 WeakPolarHBondContact CE2-OE1 3.3Å; F5-E372 HydrophobicContact CZ-CG 4.5Å; F5-E372 WeakPolarHBondContact CZ-OE1 3.23Å; H271-E372 IonicContact CD2-OE1 3.69Å; H271-E372 IonicContact CE1-OE1 2.89Å; H271-E372 IonicContact NE2-OE1 3.42Å; H271-E372 PolarHBondContact NE2-OE1 2.74Å; R275-E372 IonicContact CZ-OE1 3.66Å; R275-E372 VanDerWaalsContact CZ-OE1 3.31Å; R275-E372 IonicContact CZ-OE2 3.79Å; R275-E372 IonicContact NE-OE1 2.64Å; R275-E372 IonicContact NH1-OE1 2.77Å; R275-E372 PolarHBondContact NH1-OE1 3.13Å; R275-E372 IonicContact NH1-OE2 2.78Å; R275-E372 PolarHBondContact NH1-OE2 2.89Å; R275-E372 IonicContact NH2-OE1 3.22Å; R275-E372 IonicContact NH2-OE2 2.59Å; M344-E372 HydrophobicContact SD-CB 4.49Å; L345-E372 WeakPolarHBondContact O-CA 3.48Å
373	A	90.9	Very high	84.8	Confident	34 Å²	34	76 Å²	76	28%	0.281	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	118.4	172.8	0	0	0	0	0	110	M344 L345 Y347	M344-A373 CarbonylContact C-O 3.48Å; M344-A373 WeakPolarHBondContact CA-O 3.32Å; L345-A373 HydrophobicContact CB-CB 4.45Å; L345-A373 PolarHBondContact N-O 3.06Å; L345-A373 PolarHBondContact O-N 3.25Å; Y347-A373 HydrophobicContact CE2-CB 4.08Å
374	I	90.5	Very high	83.2	Confident	58 Å²	58	79.4 Å²	79.4	30%	0.297	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.1	172.5	-64.3	174.3	0	0	0	108.3	A3 Y305 M344	A3-I374 HydrophobicContact CB-CD1 3.79Å; A3-I374 HydrophobicContact CB-CG1 3.85Å; Y305-I374 HydrophobicContact CE1-CD1 4.11Å; M344-I374 HydrophobicContact CE-CG1 4.11Å
375	V	87.6	Confident	81.5	Confident	41 Å²	41	81.7 Å²	81.7	25%	0.248	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	102	176.7	-177.6	0	0	0	0	108.3	L343 L345	L343-V375 HydrophobicContact CB-CB 4.23Å; L343-V375 HydrophobicContact CD2-CB 4.07Å; L343-V375 HydrophobicContact CD2-CG1 4.25Å; L343-V375 HydrophobicContact CD2-CG2 4.41Å; L343-V375 HydrophobicContact CG-CB 4.14Å; L343-V375 HydrophobicContact CG-CG2 4.41Å; L343-V375 PolarHBondContact O-N 3.03Å; L345-V375 HydrophobicContact CD1-CG2 3.72Å; L345-V375 HydrophobicContact CD2-CG2 4.5Å; L345-V375 HydrophobicContact CG-CG2 3.7Å
376	S	80.9	Confident	79.7	Confident	92 Å²	92	86 Å²	86	64%	0.643	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-103	149.5	172.3	60.5	0	0	0	0	110.7
377	R	73.8	Confident	77.7	Confident	212 Å²	212	88.1 Å²	88.1	80%	0.8	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-75.2	127.2	168.1	179.9	177.6	177.6	174	0.8	107.9	V379	R377-V379 HydrophobicContact CG-CG2 4.34Å; R377-V379 PolarHBondContact O-N 3.31Å
378	W	72.3	Confident	75.6	Confident	182 Å²	182	91.1 Å²	91.1	69%	0.689	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-64.6	123.6	169.3	-170.7	83	0	0	0	110.1	S380	W378-S380 VanDerWaalsContact CZ3-CB 3.49Å
379	V	73.9	Confident	73.3	Confident	46 Å²	46	97.3 Å²	97.3	28%	0.279	48%	0.481	S	S	.	.			trans	-125.3	106.3	179	-179	0	0	0	0	108.3	R377 S381 R382 E383	R377-V379 HydrophobicContact CG-CG2 4.34Å; R377-V379 PolarHBondContact O-N 3.31Å; V379-S381 WeakPolarHBondContact CG1-OG 3.49Å; V379-S381 PolarHBondContact O-N 3.23Å; V379-R382 HydrophobicContact CB-CB 4.36Å; V379-R382 HydrophobicContact CB-CG 4.11Å; V379-R382 HydrophobicContact CG1-CG 3.89Å; V379-R382 PolarHBondContact O-N 3.13Å; V379-E383 WeakPolarHBondContact O-CG 3.44Å; V379-E383 PolarHBondContact O-N 3.39Å
380	S	71.3	Confident	70.7	Confident	48 Å²	48	101.3 Å²	101.3	34%	0.336	51%	0.506	S	S	.	.	H	α-helix	trans	-53.5	-26.3	-173.4	67.1	0	0	0	0	115.4	W378 R384	W378-S380 VanDerWaalsContact CZ3-CB 3.49Å; S380-R384 WeakPolarHBondContact O-CG 3.45Å; S380-R384 PolarHBondContact O-NE 2.93Å
381	S	70.8	Confident	69.6	Low	78 Å²	78	104.3 Å²	104.3	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-82.6	-25.1	178.5	54.1	0	0	0	0	114.1	V379	V379-S381 WeakPolarHBondContact CG1-OG 3.49Å; V379-S381 PolarHBondContact O-N 3.23Å
382	R	65.2	Low	68.3	Low	142 Å²	142	104.5 Å²	104.5	54%	0.536	52%	0.521	S	S	.	.	H	α-helix	trans	-85.1	-42.3	-179.4	-60.3	-179.5	88.8	-163.6	-2.2	110.8	V379 R384 A385 E386	V379-R382 HydrophobicContact CB-CB 4.36Å; V379-R382 HydrophobicContact CB-CG 4.11Å; V379-R382 HydrophobicContact CG1-CG 3.89Å; V379-R382 PolarHBondContact O-N 3.13Å; R382-R384 VanDerWaalsContact C-N 3.3Å; R382-R384 PolarHBondContact O-N 3.28Å; R382-A385 PolarHBondContact O-N 3.19Å; R382-E386 PolarHBondContact O-N 2.96Å; R382-E386 VanDerWaalsContact O-N 3.13Å
383	E	68.4	Low	66.9	Low	72 Å²	72	110 Å²	110	34%	0.336	55%	0.549	S	S	.	.	H	α-helix	trans	-65.7	-32.9	179.1	-55.4	-65.9	151.5	0	0	112.3	V379	V379-E383 WeakPolarHBondContact O-CG 3.44Å; V379-E383 PolarHBondContact O-N 3.39Å
384	R	61.1	Low	65.5	Low	167 Å²	167	114.5 Å²	114.5	63%	0.63	56%	0.564	S	S	*	*	H	α-helix	trans	-68.2	-36.2	174.4	-82.4	-174.8	-81.3	-165.5	-1.2	112.9	S380 R382	S380-R384 WeakPolarHBondContact O-CG 3.45Å; S380-R384 PolarHBondContact O-NE 2.93Å; R382-R384 VanDerWaalsContact C-N 3.3Å; R382-R384 PolarHBondContact O-N 3.28Å
385	A	56.3	Low	63.9	Low	53 Å²	53	118 Å²	118	44%	0.438	58%	0.581	S	S	.	*	H	α-helix	trans	-75.3	-37.5	-179.2	0	0	0	0	0	112.3	R382 Q387 D388	R382-A385 PolarHBondContact O-N 3.19Å; A385-Q387 PolarHBondContact O-N 3.25Å; A385-D388 PolarHBondContact O-N 2.9Å
386	E	55.8	Low	62.4	Low	121 Å²	121	123.1 Å²	123.1	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-67.3	-17.1	177.1	-70.6	-179.3	-175.5	0	0	113	R382	R382-E386 PolarHBondContact O-N 2.96Å; R382-E386 VanDerWaalsContact O-N 3.13Å
387	Q	51.1	Low	61	Low	143 Å²	143	125.4 Å²	125.4	67%	0.668	60%	0.6	S	S	*	*	H	α-helix	trans	-86.1	-22.3	177.4	-133.4	128.2	39.3	0	0	113.4	A385	A385-Q387 PolarHBondContact O-N 3.25Å
388	D	48.6	Very low	60.1	Low	142 Å²	142	118.7 Å²	118.7	76%	0.759	59%	0.585	S	S	*	*	H	α-helix	trans	-85.2	-11.5	178.1	-71.9	-25.1	0	0	0	112.4	A385	A385-D388 PolarHBondContact O-N 2.9Å
389	D	46.9	Very low	59	Low	148 Å²	148	113.4 Å²	113.4	79%	0.791	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	12.1	179.7	-77.5	-26.9	0	0	0	113.7
390	I	39.4	Very low	57.7	Low	201 Å²	201	119.5 Å²	119.5	100%	1.031	60%	0.603	S	S	*	*			trans	-106.5	0	-179.8	-61.4	175.2	0	0	0	112

Retrieved 390 of 390 residues in 388.1 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).