A0A077Z1D8_TRITR Loading...

leucine--tRNA ligase

AlphaFold DB , UniProt , Accession A0A077Z1D8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 305 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	31.9	Very low	231 Å²	231	151.2 Å²	151.2	100%	1.138	83%	0.829	S	S	*	*				0	135.3	0	-104.9	175.9	170.2	0	0	107.1
2	Y	30.2	Very low	31.4	Very low	236 Å²	236	148.8 Å²	148.8	93%	0.925	82%	0.822	S	S	*	*			trans	83.8	106.2	-169.2	-55.7	-75.2	0	0	0	115.1
3	A	28.4	Very low	30.9	Very low	101 Å²	101	146.1 Å²	146.1	84%	0.835	81%	0.812	S	S	*	*			trans	-97.3	142.6	176.6	0	0	0	0	0	109
4	D	34.8	Very low	30.3	Very low	131 Å²	131	146.3 Å²	146.3	70%	0.701	81%	0.809	S	S	*	*			trans	-117.3	132.3	166.2	167.3	-46.2	0	0	0	106.6	S6	D4-S6 VanDerWaalsContact C-N 3.33Å; D4-S6 PolarHBondContact O-N 3.24Å; D4-S6 WeakPolarHBondContact OD1-CB 3.45Å; D4-S6 PolarHBondContact OD1-N 3.42Å; D4-S6 PolarHBondContact OD1-OG 2.74Å
5	E	30.7	Very low	29.9	Very low	200 Å²	200	149.1 Å²	149.1	94%	0.935	81%	0.811	S	S	*	*			trans	-86.7	25	-165.9	-62.7	-179.5	148	0	0	114.6	G7	E5-G7 PolarHBondContact O-N 3.33Å
6	S	38.4	Very low	29.5	Very low	81 Å²	81	148.2 Å²	148.2	57%	0.566	81%	0.811	S	S	*	*			trans	-89.8	100.3	176.6	51.3	0	0	0	0	111.7	D4 Y8	D4-S6 VanDerWaalsContact C-N 3.33Å; D4-S6 PolarHBondContact O-N 3.24Å; D4-S6 WeakPolarHBondContact OD1-CB 3.45Å; D4-S6 PolarHBondContact OD1-N 3.42Å; D4-S6 PolarHBondContact OD1-OG 2.74Å; S6-Y8 PolarHBondContact O-N 3.11Å
7	G	32	Very low	29.1	Very low	79 Å²	79	143.6 Å²	143.6	81%	0.814	81%	0.805	S	S	*	*			trans	-65.2	54.9	-176.3	0	0	0	0	0	117.2	E5	E5-G7 PolarHBondContact O-N 3.33Å
8	Y	31.7	Very low	28.8	Very low	206 Å²	206	149.9 Å²	149.9	81%	0.808	82%	0.815	S	S	*	*			trans	-115.3	131.4	167.7	-73.5	-81.1	0	0	0	110.7	S6 N10	S6-Y8 PolarHBondContact O-N 3.11Å; Y8-N10 PolarHBondContact O-N 2.83Å
9	P	33.9	Very low	28.6	Very low	116 Å²	116	146.9 Å²	146.9	75%	0.753	81%	0.813	S	S	*	*			trans	-70.5	125	-177.8	28.7	-31.6	0	0	0	110.1	P11	P9-P11 VanDerWaalsContact O-CD 3.23Å; P9-P11 WeakPolarHBondContact O-CD 3.16Å
10	N	30.2	Very low	28.4	Very low	163 Å²	163	147.1 Å²	147.1	87%	0.872	81%	0.811	S	S	*	*			trans	-60.9	122.3	167.3	-87.2	-41	0	0	0	110.1	Y8	Y8-N10 PolarHBondContact O-N 2.83Å
11	P	31.3	Very low	28.2	Very low	119 Å²	119	149.2 Å²	149.2	77%	0.773	81%	0.812	S	S	*	*			trans	-96.6	111.7	167.5	7.4	13.8	0	0	0	110.5	P9	P9-P11 VanDerWaalsContact O-CD 3.23Å; P9-P11 WeakPolarHBondContact O-CD 3.16Å
12	V	25.8	Very low	27.9	Very low	122 Å²	122	146.2 Å²	146.2	74%	0.739	79%	0.793	S	S	*	*			trans	-14.7	127.9	153.9	-178.3	0	0	0	0	115.5	L14	V12-L14 HydrophobicContact CG1-CD1 4.18Å
13	V	24.4	Very low	27.7	Very low	114 Å²	114	140.6 Å²	140.6	69%	0.691	79%	0.787	S	S	*	*			trans	-82.3	121.3	169.1	178.1	0	0	0	0	109.2	F15	V13-F15 HydrophobicContact CG1-CD2 3.57Å; V13-F15 HydrophobicContact CG1-CE2 3.36Å; V13-F15 HydrophobicContact CG1-CZ 4.32Å
14	L	22.3	Very low	27.6	Very low	149 Å²	149	142.1 Å²	142.1	78%	0.78	79%	0.786	S	S	*	*			trans	-130.3	111	170.4	-121.7	137.8	0	0	0	109	V12 V16	V12-L14 HydrophobicContact CG1-CD1 4.18Å; L14-V16 HydrophobicContact CD2-CG2 4.49Å
15	F	24.1	Very low	27.3	Very low	189 Å²	189	143.4 Å²	143.4	83%	0.829	79%	0.791	S	S	*	*			trans	-87	113.9	177.4	-80.8	-88.8	0	0	0	110.1	V13	V13-F15 HydrophobicContact CG1-CD2 3.57Å; V13-F15 HydrophobicContact CG1-CE2 3.36Å; V13-F15 HydrophobicContact CG1-CZ 4.32Å
16	V	23.5	Very low	27.2	Very low	134 Å²	134	143.2 Å²	143.2	81%	0.812	79%	0.787	S	S	*	*			trans	-147	119.6	158.6	-169.5	0	0	0	0	109.6	L14	L14-V16 HydrophobicContact CD2-CG2 4.49Å
17	G	23.6	Very low	27	Very low	70 Å²	70	144.4 Å²	144.4	72%	0.722	79%	0.793	S	S	*	*	S	Bend	trans	42.5	118.2	151.5	0	0	0	0	0	121.5
18	R	23.7	Very low	26.8	Very low	257 Å²	257	147.5 Å²	147.5	97%	0.97	79%	0.791	S	S	*	*	S	Bend	trans	52.3	83.3	153.6	-67.7	-176	175.1	177.8	-1.2	117
19	A	24.9	Very low	26.7	Very low	94 Å²	94	147.6 Å²	147.6	78%	0.777	80%	0.796	S	S	*	*			trans	165.6	130	141.3	0	0	0	0	0	108.7
20	L	25.4	Very low	26.4	Very low	150 Å²	150	147.7 Å²	147.7	79%	0.785	79%	0.794	S	S	*	*			trans	-130.2	103.7	162.7	-72.4	172.4	0	0	0	109.6	F22	L20-F22 HydrophobicContact CB-CD2 4.14Å; L20-F22 HydrophobicContact CB-CE2 4.06Å; L20-F22 HydrophobicContact CD1-CE2 4.18Å; L20-F22 HydrophobicContact CD2-CD2 4.18Å; L20-F22 HydrophobicContact CD2-CE2 3.28Å; L20-F22 HydrophobicContact CD2-CZ 3.86Å; L20-F22 HydrophobicContact CG-CE2 4Å
21	K	23.1	Very low	26.3	Very low	191 Å²	191	148.8 Å²	148.8	83%	0.83	79%	0.792	S	S	*	*			trans	-84	130.2	151.7	-92.6	179.1	172.4	179.2	0	107.1
22	F	24.7	Very low	26.3	Very low	169 Å²	169	151.1 Å²	151.1	74%	0.741	79%	0.792	S	S	*	*			trans	-137	132.5	159.3	-77	-74.9	0	0	0	111.4	L20	L20-F22 HydrophobicContact CB-CD2 4.14Å; L20-F22 HydrophobicContact CB-CE2 4.06Å; L20-F22 HydrophobicContact CD1-CE2 4.18Å; L20-F22 HydrophobicContact CD2-CD2 4.18Å; L20-F22 HydrophobicContact CD2-CE2 3.28Å; L20-F22 HydrophobicContact CD2-CZ 3.86Å; L20-F22 HydrophobicContact CG-CE2 4Å
23	C	24.6	Very low	26.6	Very low	118 Å²	118	147.1 Å²	147.1	80%	0.797	77%	0.768	S	S	*	*			trans	-104.5	135.3	164.5	-176	0	0	0	0	106.9
24	V	27.5	Very low	27.1	Very low	133 Å²	133	148 Å²	148	81%	0.806	76%	0.762	S	S	*	*			trans	-139.9	133.3	174.3	-177.9	0	0	0	0	111.2
25	I	27.5	Very low	27.6	Very low	157 Å²	157	143.9 Å²	143.9	81%	0.805	74%	0.737	S	S	*	*			trans	-96.5	142.2	178.8	-60.8	172.3	0	0	0	109.5
26	K	29	Very low	28.1	Very low	196 Å²	196	135 Å²	135	85%	0.852	70%	0.698	S	S	*	*			trans	-55.9	171.2	-178.8	-82.3	-174.9	-179.9	177.2	0	115
27	P	33.4	Very low	28.5	Very low	107 Å²	107	130.3 Å²	130.3	70%	0.695	67%	0.67	S	S	*	*			cis	-148.8	-178.2	29.2	39.5	-16.1	0	0	0	119.2
28	N	27.9	Very low	29	Very low	144 Å²	144	133 Å²	133	77%	0.77	66%	0.658	S	S	*	*			trans	71.3	107	160.7	-61.5	-19.2	0	0	0	118.7
29	F	31.2	Very low	29.6	Very low	208 Å²	208	124.1 Å²	124.1	91%	0.912	63%	0.63	S	S	*	*			trans	-178.3	139.4	133.6	-106.1	-78.3	0	0	0	110.7
30	T	26.5	Very low	30	Very low	118 Å²	118	122.1 Å²	122.1	72%	0.724	61%	0.606	S	S	*	*			trans	-72.9	121.5	176.4	28.7	0	0	0	0	111
31	F	28.9	Very low	30.8	Very low	185 Å²	185	122.5 Å²	122.5	81%	0.811	60%	0.602	S	S	*	*			trans	-171.8	139.8	149.9	-95.8	-69.7	0	0	0	110.2	T33	F31-T33 PolarHBondContact O-N 3.38Å; F31-T33 PolarHBondContact O-OG1 3.19Å
32	H	31.1	Very low	31.7	Very low	169 Å²	169	122.3 Å²	122.3	78%	0.782	60%	0.604	S	S	*	*			trans	-50	124.5	-177.8	-70.2	-79.6	0	0	0	112.7
33	T	32	Very low	32.9	Very low	37 Å²	37	117.2 Å²	117.2	23%	0.227	58%	0.584	C	S	.	*			trans	-153.4	154.7	169	-14.4	0	0	0	0	115.1	F31 Y35 K67	F31-T33 PolarHBondContact O-N 3.38Å; F31-T33 PolarHBondContact O-OG1 3.19Å; T33-Y35 WeakPolarHBondContact O-CD2 3.31Å; T33-Y35 WeakPolarHBondContact O-CE2 3.38Å; T33-K67 VanDerWaalsContact CB-CD 3.48Å; T33-K67 HydrophobicContact CG2-CD 3.51Å; T33-K67 HydrophobicContact CG2-CG 3.54Å; T33-K67 VanDerWaalsContact CG2-NZ 3.29Å; T33-K67 WeakPolarHBondContact OG1-CD 3.22Å; T33-K67 VanDerWaalsContact OG1-CE 3.26Å; T33-K67 WeakPolarHBondContact OG1-CE 3.3Å; T33-K67 PolarHBondContact OG1-NZ 3.25Å
34	F	33.9	Very low	34.6	Very low	132 Å²	132	115.6 Å²	115.6	58%	0.579	57%	0.567	S	S	*	*			trans	-75.9	145.4	170.3	-62	-91.8	0	0	0	110.4	K67 M68	F34-K67 CarbonylContact O-C 3.47Å; F34-K67 WeakPolarHBondContact O-CA 3.45Å; F34-M68 HydrophobicContact CB-CE 3.39Å; F34-M68 HydrophobicContact CD1-CE 4.48Å; F34-M68 HydrophobicContact CG-CE 4.2Å; F34-M68 PolarHBondContact O-N 3.03Å
35	Y	32.4	Very low	36.4	Very low	64 Å²	64	112.8 Å²	112.8	25%	0.251	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.7	-177.7	-67.3	-110.9	0	0	0	110	T33 E66 K67 H120 R121 W123	T33-Y35 WeakPolarHBondContact O-CD2 3.31Å; T33-Y35 WeakPolarHBondContact O-CE2 3.38Å; Y35-E66 CarbonylContact C-O 3.55Å; Y35-E66 WeakPolarHBondContact CA-O 2.68Å; Y35-E66 VanDerWaalsContact CB-O 3.3Å; Y35-E66 WeakPolarHBondContact CB-O 3.46Å; Y35-K67 VanDerWaalsContact CD1-CA 3.42Å; Y35-K67 HydrophobicContact CD1-CB 4.01Å; Y35-K67 HydrophobicContact CE1-CB 3.7Å; Y35-K67 VanDerWaalsContact CE1-N 3.35Å; Y35-K67 HydrophobicContact CG-CB 4.48Å; Y35-H120 AromaticContact CD2-ND1 3.78Å; Y35-H120 AromaticContact CE2-CE1 3.83Å; Y35-H120 AromaticContact CE2-ND1 3.36Å; Y35-H120 WeakPolarHBondContact CE2-ND1 3.45Å; Y35-R121 VanDerWaalsContact O-O 3.08Å; Y35-W123 PolarHBondContact O-N 2.86Å
36	A	36	Very low	38.3	Very low	1 Å²	1	108.1 Å²	108.1	1%	0.008	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	158.3	175.6	0	0	0	0	0	111.2	E66 M68 N74	A36-E66 PolarHBondContact N-O 2.87Å; A36-E66 PolarHBondContact O-N 3.35Å; A36-M68 HydrophobicContact CB-CG 3.29Å; A36-M68 HydrophobicContact CB-SD 3.76Å; A36-N74 HydrophobicContact CB-CB 4.41Å; A36-N74 WeakPolarHBondContact CB-O 3.44Å
37	V	31.3	Very low	40.1	Very low	37 Å²	37	100.7 Å²	100.7	22%	0.224	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	137.5	170.2	174.7	0	0	0	0	108.4	L39 E63 C122	V37-L39 PolarHBondContact O-N 3.34Å; V37-E63 HydrophobicContact CG1-CG 4.13Å; V37-E63 WeakPolarHBondContact CG1-OE1 3.49Å; V37-C122 VanDerWaalsContact CG2-SG 3.53Å
38	W	34.2	Very low	41.8	Very low	125 Å²	125	101.1 Å²	101.1	47%	0.473	49%	0.492	S	S	.	.			trans	-58.7	107.9	169.6	-89.7	82.5	0	0	0	110.1	L40 E66	W38-L40 HydrophobicContact CE3-CD2 4.21Å; W38-L40 PolarHBondContact O-N 3.26Å; W38-E66 VanDerWaalsContact NE1-CD 3.3Å; W38-E66 PolarHBondContact NE1-OE1 3.37Å
39	L	35.9	Very low	43.6	Very low	71 Å²	71	97.9 Å²	97.9	37%	0.372	49%	0.492	S	S	.	.			trans	-84	104.1	151.3	-89.9	159.8	0	0	0	106.5	V37 F41 L95	V37-L39 PolarHBondContact O-N 3.34Å; L39-F41 HydrophobicContact CB-CD2 3.86Å; L39-F41 HydrophobicContact CB-CE2 3.57Å; L39-F41 HydrophobicContact CB-CZ 4.33Å; L39-F41 HydrophobicContact CD1-CE2 4.23Å; L39-F41 HydrophobicContact CD1-CZ 4.39Å; L39-F41 HydrophobicContact CG-CE2 4.46Å; L39-F41 WeakPolarHBondContact O-CD2 3.22Å; L39-F41 PolarHBondContact O-N 3.38Å; L39-L95 HydrophobicContact CD1-CD1 4.01Å
40	L	34.7	Very low	45.4	Very low	53 Å²	53	89 Å²	89	28%	0.277	46%	0.459	S	S	.	.			trans	-60.1	83	166.5	-75.6	162.5	0	0	0	109	W38 E42 L43 L61	W38-L40 HydrophobicContact CE3-CD2 4.21Å; W38-L40 PolarHBondContact O-N 3.26Å; L40-E42 PolarHBondContact O-N 3.49Å; L40-E42 VanDerWaalsContact O-N 3.16Å; L40-L43 HydrophobicContact CB-CB 3.9Å; L40-L43 HydrophobicContact CD1-CB 3.96Å; L40-L43 HydrophobicContact CD1-CD1 3.9Å; L40-L43 HydrophobicContact CD1-CG 4.44Å; L40-L43 HydrophobicContact CD2-CB 3.89Å; L40-L43 HydrophobicContact CD2-CD1 3.37Å; L40-L43 HydrophobicContact CD2-CG 3.68Å; L40-L43 HydrophobicContact CG-CB 4.1Å; L40-L43 HydrophobicContact CG-CD1 4.17Å; L40-L43 HydrophobicContact CG-CG 4.43Å; L40-L61 HydrophobicContact CD1-CD1 3.95Å; L40-L61 HydrophobicContact CD1-CD2 4.44Å
41	F	40.3	Very low	47.4	Very low	158 Å²	158	88 Å²	88	69%	0.693	45%	0.446	S	S	*	.	S	Bend	trans	-68.9	-4.4	173.9	-84.2	-77.8	0	0	0	112.7	L39	L39-F41 HydrophobicContact CB-CD2 3.86Å; L39-F41 HydrophobicContact CB-CE2 3.57Å; L39-F41 HydrophobicContact CB-CZ 4.33Å; L39-F41 HydrophobicContact CD1-CE2 4.23Å; L39-F41 HydrophobicContact CD1-CZ 4.39Å; L39-F41 HydrophobicContact CG-CE2 4.46Å; L39-F41 WeakPolarHBondContact O-CD2 3.22Å; L39-F41 PolarHBondContact O-N 3.38Å
42	E	43	Very low	49.3	Very low	187 Å²	187	81.5 Å²	81.5	87%	0.874	42%	0.419	S	S	*	.	S	Bend	trans	-128.4	-5.8	177.7	-67.6	-170.9	164.6	0	0	115.6	L40	L40-E42 PolarHBondContact O-N 3.49Å; L40-E42 VanDerWaalsContact O-N 3.16Å
43	L	49.1	Very low	51.4	Low	61 Å²	61	76.1 Å²	76.1	32%	0.319	39%	0.393	S	S	.	.			trans	-101.5	123.4	171.6	-65.9	177.6	0	0	0	110.3	L40 L61	L40-L43 HydrophobicContact CB-CB 3.9Å; L40-L43 HydrophobicContact CD1-CB 3.96Å; L40-L43 HydrophobicContact CD1-CD1 3.9Å; L40-L43 HydrophobicContact CD1-CG 4.44Å; L40-L43 HydrophobicContact CD2-CB 3.89Å; L40-L43 HydrophobicContact CD2-CD1 3.37Å; L40-L43 HydrophobicContact CD2-CG 3.68Å; L40-L43 HydrophobicContact CG-CB 4.1Å; L40-L43 HydrophobicContact CG-CD1 4.17Å; L40-L43 HydrophobicContact CG-CG 4.43Å; L43-L61 HydrophobicContact CD1-CD2 4.45Å
44	D	60.5	Low	53.5	Low	85 Å²	85	75.2 Å²	75.2	46%	0.455	39%	0.387	S	S	.	.			trans	-74.5	119	173	-127	-26.9	0	0	0	107.3	K55	D44-K55 HydrophobicContact CB-CB 4.1Å; D44-K55 HydrophobicContact CB-CD 3.88Å; D44-K55 HydrophobicContact CB-CG 4.35Å; D44-K55 WeakPolarHBondContact O-CB 3.47Å; D44-K55 PolarHBondContact O-N 3.2Å; D44-K55 IonicContact OD1-NZ 3.63Å; D44-K55 PolarHBondContact OD1-NZ 3.36Å
45	F	64.8	Low	55.4	Low	74 Å²	74	74.2 Å²	74.2	33%	0.325	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	154.6	-174.1	68.3	-92.1	0	0	0	114.3	L52 Y53 K55 L61	F45-L52 HydrophobicContact CD2-CD2 3.82Å; F45-L52 HydrophobicContact CE2-CD2 3.99Å; F45-Y53 CarbonylContact C-O 3.39Å; F45-Y53 WeakPolarHBondContact CA-O 3.36Å; F45-Y53 WeakPolarHBondContact CB-O 3.27Å; F45-K55 WeakPolarHBondContact O-CE 3.46Å; F45-L61 HydrophobicContact CB-CD1 3.73Å
46	T	68.6	Low	57.6	Low	58 Å²	58	79.5 Å²	79.5	36%	0.356	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.9	173.4	41.5	0	0	0	0	111	L52 Y53 K55	T46-L52 CarbonylContact O-C 3.46Å; T46-Y53 PolarHBondContact N-O 2.9Å; T46-Y53 PolarHBondContact O-N 3.45Å; T46-K55 HydrophobicContact CG2-CD 4.25Å; T46-K55 HydrophobicContact CG2-CG 3.62Å
47	S	66.5	Low	59.7	Low	40 Å²	40	82.1 Å²	82.1	28%	0.28	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.4	176.8	169.6	0	0	0	0	109.9	Q51	S47-Q51 WeakPolarHBondContact CA-O 3.28Å
48	L	69.6	Low	62	Low	117 Å²	117	82.8 Å²	82.8	61%	0.613	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	121.4	175.3	-87.7	133.3	0	0	0	108.7	G50 Q51 Y53	L48-G50 PolarHBondContact O-N 3.4Å; L48-Q51 PolarHBondContact N-O 3.24Å; L48-Q51 VanDerWaalsContact N-O 3.11Å; L48-Q51 PolarHBondContact O-N 3.29Å; L48-Q51 VanDerWaalsContact O-N 3.07Å; L48-Y53 HydrophobicContact CB-CD2 4.25Å; L48-Y53 HydrophobicContact CB-CE2 3.86Å
49	G	66.2	Low	64.2	Low	75 Å²	75	83.2 Å²	83.2	77%	0.773	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	18.8	177.3	0	0	0	0	0	115.4	Y130	G49-Y130 PolarHBondContact O-OH 2.67Å
50	G	67.8	Low	66.2	Low	21 Å²	21	84.5 Å²	84.5	22%	0.216	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	2.7	-178.1	0	0	0	0	0	118.2	L48	L48-G50 PolarHBondContact O-N 3.4Å
51	Q	68.6	Low	68	Low	97 Å²	97	83.8 Å²	83.8	45%	0.453	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	142.6	172.9	-72.7	-177.8	5.6	0	0	108.9	S47 L48 Y53 L60	S47-Q51 WeakPolarHBondContact CA-O 3.28Å; L48-Q51 PolarHBondContact N-O 3.24Å; L48-Q51 VanDerWaalsContact N-O 3.11Å; L48-Q51 PolarHBondContact O-N 3.29Å; L48-Q51 VanDerWaalsContact O-N 3.07Å; Q51-Y53 HydrophobicContact CB-CD2 4.5Å; Q51-Y53 HydrophobicContact CB-CE2 3.66Å; Q51-Y53 PolarHBondContact OE1-OH 3.29Å; Q51-L60 HydrophobicContact CB-CD1 3.53Å; Q51-L60 HydrophobicContact CG-CD1 3.95Å
52	L	69.5	Low	69.4	Low	49 Å²	49	83.4 Å²	83.4	26%	0.257	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	137.7	176.5	-65.6	176.8	0	0	0	108.7	F45 T46 L61	F45-L52 HydrophobicContact CD2-CD2 3.82Å; F45-L52 HydrophobicContact CE2-CD2 3.99Å; T46-L52 CarbonylContact O-C 3.46Å; L52-L61 HydrophobicContact CB-CB 3.87Å; L52-L61 HydrophobicContact CB-CD1 4.17Å; L52-L61 WeakPolarHBondContact O-CB 3.15Å; L52-L61 PolarHBondContact O-N 3.07Å
53	Y	73.7	Confident	70.4	Confident	57 Å²	57	79 Å²	79	22%	0.224	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	141	177.9	-63.3	-93.2	0	0	0	109.5	F45 T46 L48 Q51 K55 G58 Q59 L60	F45-Y53 CarbonylContact C-O 3.39Å; F45-Y53 WeakPolarHBondContact CA-O 3.36Å; F45-Y53 WeakPolarHBondContact CB-O 3.27Å; T46-Y53 PolarHBondContact N-O 2.9Å; T46-Y53 PolarHBondContact O-N 3.45Å; L48-Y53 HydrophobicContact CB-CD2 4.25Å; L48-Y53 HydrophobicContact CB-CE2 3.86Å; Q51-Y53 HydrophobicContact CB-CD2 4.5Å; Q51-Y53 HydrophobicContact CB-CE2 3.66Å; Q51-Y53 PolarHBondContact OE1-OH 3.29Å; Y53-K55 PolarHBondContact O-N 3.47Å; Y53-G58 WeakPolarHBondContact CD1-O 3.43Å; Y53-Q59 CarbonylContact C-O 3.57Å; Y53-Q59 VanDerWaalsContact CA-O 3.23Å; Y53-Q59 WeakPolarHBondContact CA-O 3.45Å; Y53-L60 HydrophobicContact CD1-CB 4.33Å; Y53-L60 HydrophobicContact CD1-CD1 4.43Å; Y53-L60 HydrophobicContact CE1-CB 4.12Å; Y53-L60 HydrophobicContact CE1-CD1 3.95Å; Y53-L60 HydrophobicContact CE2-CD1 4.46Å
54	D	76.6	Confident	71.1	Confident	18 Å²	18	79.7 Å²	79.7	10%	0.096	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	124.9	167.5	169.3	25.7	0	0	0	108.9	K56 S57 G58 Q59 L61	D54-K56 PolarHBondContact O-N 3.38Å; D54-K56 PolarHBondContact OD1-N 3.1Å; D54-K56 VanDerWaalsContact OD1-N 3.11Å; D54-S57 WeakPolarHBondContact CB-OG 3.26Å; D54-S57 VanDerWaalsContact CG-OG 3.29Å; D54-S57 WeakPolarHBondContact OD2-CB 3.49Å; D54-S57 PolarHBondContact OD2-N 3.43Å; D54-S57 VanDerWaalsContact OD2-N 3.17Å; D54-S57 PolarHBondContact OD2-OG 2.87Å; D54-G58 WeakPolarHBondContact O-CA 3.48Å; D54-G58 PolarHBondContact O-N 2.84Å; D54-Q59 PolarHBondContact N-O 2.99Å; D54-L61 HydrophobicContact CB-CD1 4.45Å; D54-L61 HydrophobicContact CB-CD2 4.07Å; D54-L61 HydrophobicContact CB-CG 4.32Å
55	K	74.9	Confident	71.4	Confident	110 Å²	110	84.2 Å²	84.2	48%	0.478	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.4	-179.6	-76.1	-179.8	-166.9	164.9	0	112.2	D44 F45 T46 Y53	D44-K55 HydrophobicContact CB-CB 4.1Å; D44-K55 HydrophobicContact CB-CD 3.88Å; D44-K55 HydrophobicContact CB-CG 4.35Å; D44-K55 WeakPolarHBondContact O-CB 3.47Å; D44-K55 PolarHBondContact O-N 3.2Å; D44-K55 IonicContact OD1-NZ 3.63Å; D44-K55 PolarHBondContact OD1-NZ 3.36Å; F45-K55 WeakPolarHBondContact O-CE 3.46Å; T46-K55 HydrophobicContact CG2-CD 4.25Å; T46-K55 HydrophobicContact CG2-CG 3.62Å; Y53-K55 PolarHBondContact O-N 3.47Å
56	K	77.5	Confident	71.7	Confident	175 Å²	175	82.6 Å²	82.6	76%	0.761	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-45.7	-174.9	-70.6	-176.7	179.1	175.6	0	111.5	D54	D54-K56 PolarHBondContact O-N 3.38Å; D54-K56 PolarHBondContact OD1-N 3.1Å; D54-K56 VanDerWaalsContact OD1-N 3.11Å
57	S	80.4	Confident	72.3	Confident	57 Å²	57	83.8 Å²	83.8	40%	0.399	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-16.6	-177.9	66.1	0	0	0	0	114.3	D54 Q59	D54-S57 WeakPolarHBondContact CB-OG 3.26Å; D54-S57 VanDerWaalsContact CG-OG 3.29Å; D54-S57 WeakPolarHBondContact OD2-CB 3.49Å; D54-S57 PolarHBondContact OD2-N 3.43Å; D54-S57 VanDerWaalsContact OD2-N 3.17Å; D54-S57 PolarHBondContact OD2-OG 2.87Å; S57-Q59 PolarHBondContact O-N 3.12Å; S57-Q59 WeakPolarHBondContact OG-CB 3.45Å; S57-Q59 WeakPolarHBondContact OG-CG 3.48Å; S57-Q59 PolarHBondContact OG-N 2.94Å
58	G	80.3	Confident	72.6	Confident	51 Å²	51	83.8 Å²	83.8	53%	0.526	44%	0.44	S	S	.	.			trans	67.6	6.9	-170.1	0	0	0	0	0	113.8	Y53 D54	Y53-G58 WeakPolarHBondContact CD1-O 3.43Å; D54-G58 WeakPolarHBondContact O-CA 3.48Å; D54-G58 PolarHBondContact O-N 2.84Å
59	Q	80	Confident	73.2	Confident	134 Å²	134	79.6 Å²	79.6	63%	0.626	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-79.7	143.2	-175.2	-67.7	-178.8	-4.6	0	0	111.7	Y53 D54 S57 L61	Y53-Q59 CarbonylContact C-O 3.57Å; Y53-Q59 VanDerWaalsContact CA-O 3.23Å; Y53-Q59 WeakPolarHBondContact CA-O 3.45Å; D54-Q59 PolarHBondContact N-O 2.99Å; S57-Q59 PolarHBondContact O-N 3.12Å; S57-Q59 WeakPolarHBondContact OG-CB 3.45Å; S57-Q59 WeakPolarHBondContact OG-CG 3.48Å; S57-Q59 PolarHBondContact OG-N 2.94Å; Q59-L61 PolarHBondContact O-N 3.33Å
60	L	78.7	Confident	73.8	Confident	98 Å²	98	85.4 Å²	85.4	51%	0.513	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	123.8	173.2	-178.3	69.1	0	0	0	110.1	Q51 Y53	Q51-L60 HydrophobicContact CB-CD1 3.53Å; Q51-L60 HydrophobicContact CG-CD1 3.95Å; Y53-L60 HydrophobicContact CD1-CB 4.33Å; Y53-L60 HydrophobicContact CD1-CD1 4.43Å; Y53-L60 HydrophobicContact CE1-CB 4.12Å; Y53-L60 HydrophobicContact CE1-CD1 3.95Å; Y53-L60 HydrophobicContact CE2-CD1 4.46Å
61	L	72.3	Confident	74.3	Confident	38 Å²	38	89.2 Å²	89.2	20%	0.199	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.3	173.7	-64.4	172.9	0	0	0	109.3	L40 L43 F45 L52 D54 Q59	L40-L61 HydrophobicContact CD1-CD1 3.95Å; L40-L61 HydrophobicContact CD1-CD2 4.44Å; L43-L61 HydrophobicContact CD1-CD2 4.45Å; F45-L61 HydrophobicContact CB-CD1 3.73Å; L52-L61 HydrophobicContact CB-CB 3.87Å; L52-L61 HydrophobicContact CB-CD1 4.17Å; L52-L61 WeakPolarHBondContact O-CB 3.15Å; L52-L61 PolarHBondContact O-N 3.07Å; D54-L61 HydrophobicContact CB-CD1 4.45Å; D54-L61 HydrophobicContact CB-CD2 4.07Å; D54-L61 HydrophobicContact CB-CG 4.32Å; Q59-L61 PolarHBondContact O-N 3.33Å
62	L	69	Low	74.4	Confident	150 Å²	150	87.7 Å²	87.7	79%	0.785	44%	0.44	S	S	*	.			trans	-86.2	115.5	171.6	-171.6	77.4	0	0	0	109.2	T64	L62-T64 HydrophobicContact CD2-CG2 3.76Å; L62-T64 HydrophobicContact CG-CG2 4.06Å; L62-T64 PolarHBondContact O-N 2.63Å
63	E	63.4	Low	74.3	Confident	94 Å²	94	93.4 Å²	93.4	44%	0.439	47%	0.465	S	S	.	.			trans	-75.9	120.9	170.5	-168.6	-179.3	174.5	0	0	109.3	V37	V37-E63 HydrophobicContact CG1-CG 4.13Å; V37-E63 WeakPolarHBondContact CG1-OE1 3.49Å
64	T	65.4	Low	74.1	Confident	75 Å²	75	91.2 Å²	91.2	46%	0.46	46%	0.457	S	S	.	.			trans	-125.7	134.9	169.7	60.6	0	0	0	0	109.5	L62	L62-T64 HydrophobicContact CD2-CG2 3.76Å; L62-T64 HydrophobicContact CG-CG2 4.06Å; L62-T64 PolarHBondContact O-N 2.63Å
65	W	66.4	Low	73.6	Confident	181 Å²	181	92.8 Å²	92.8	69%	0.686	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	131.1	174.2	37.2	73.5	0	0	0	110
66	E	70.9	Confident	73.3	Confident	40 Å²	40	89.7 Å²	89.7	19%	0.187	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	163.3	-177	58.7	157	-158.4	0	0	113.1	Y35 A36 W38 M68 K72 N74	Y35-E66 CarbonylContact C-O 3.55Å; Y35-E66 WeakPolarHBondContact CA-O 2.68Å; Y35-E66 VanDerWaalsContact CB-O 3.3Å; Y35-E66 WeakPolarHBondContact CB-O 3.46Å; A36-E66 PolarHBondContact N-O 2.87Å; A36-E66 PolarHBondContact O-N 3.35Å; W38-E66 VanDerWaalsContact NE1-CD 3.3Å; W38-E66 PolarHBondContact NE1-OE1 3.37Å; E66-M68 PolarHBondContact O-N 3.42Å; E66-K72 WeakPolarHBondContact OE1-CD 3.43Å; E66-K72 WeakPolarHBondContact OE2-CE 3.37Å; E66-K72 IonicContact OE2-NZ 2.69Å; E66-K72 PolarHBondContact OE2-NZ 3.23Å; E66-N74 PolarHBondContact OE1-ND2 3.44Å
67	K	79.7	Confident	72.8	Confident	83 Å²	83	85.6 Å²	85.6	36%	0.361	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	131.2	-175.3	171.9	172.5	167.4	145.5	0	110.4	T33 F34 Y35 S69 K72 N74	T33-K67 VanDerWaalsContact CB-CD 3.48Å; T33-K67 HydrophobicContact CG2-CD 3.51Å; T33-K67 HydrophobicContact CG2-CG 3.54Å; T33-K67 VanDerWaalsContact CG2-NZ 3.29Å; T33-K67 WeakPolarHBondContact OG1-CD 3.22Å; T33-K67 VanDerWaalsContact OG1-CE 3.26Å; T33-K67 WeakPolarHBondContact OG1-CE 3.3Å; T33-K67 PolarHBondContact OG1-NZ 3.25Å; F34-K67 CarbonylContact O-C 3.47Å; F34-K67 WeakPolarHBondContact O-CA 3.45Å; Y35-K67 VanDerWaalsContact CD1-CA 3.42Å; Y35-K67 HydrophobicContact CD1-CB 4.01Å; Y35-K67 HydrophobicContact CE1-CB 3.7Å; Y35-K67 VanDerWaalsContact CE1-N 3.35Å; Y35-K67 HydrophobicContact CG-CB 4.48Å; K67-S69 PolarHBondContact O-N 3.02Å; K67-K72 VanDerWaalsContact O-CD 3.25Å; K67-K72 WeakPolarHBondContact O-CD 3.27Å; K67-N74 PolarHBondContact O-ND2 3.34Å
68	M	74.6	Confident	71.8	Confident	40 Å²	40	86.5 Å²	86.5	20%	0.197	46%	0.458	C	S	.	.			trans	-62.5	123.4	170.4	-76.7	-160.2	-78.1	0	0	109.9	F34 A36 E66 N74 V76 W123	F34-M68 HydrophobicContact CB-CE 3.39Å; F34-M68 HydrophobicContact CD1-CE 4.48Å; F34-M68 HydrophobicContact CG-CE 4.2Å; F34-M68 PolarHBondContact O-N 3.03Å; A36-M68 HydrophobicContact CB-CG 3.29Å; A36-M68 HydrophobicContact CB-SD 3.76Å; E66-M68 PolarHBondContact O-N 3.42Å; M68-N74 VanDerWaalsContact CA-OD1 3.24Å; M68-N74 WeakPolarHBondContact CA-OD1 3.42Å; M68-V76 HydrophobicContact SD-CB 4.29Å; M68-V76 HydrophobicContact SD-CG2 4.22Å; M68-W123 HydrophobicContact CE-CB 4.48Å
69	S	80.5	Confident	70.6	Confident	28 Å²	28	92.1 Å²	92.1	20%	0.196	47%	0.471	C	S	.	.			trans	-152.7	155.5	172.1	75.4	0	0	0	0	111.5	K67 S71 K72 H73 N74	K67-S69 PolarHBondContact O-N 3.02Å; S69-S71 VanDerWaalsContact C-N 3.29Å; S69-S71 PolarHBondContact O-N 2.92Å; S69-S71 PolarHBondContact OG-OG 3.12Å; S69-K72 PolarHBondContact O-N 2.75Å; S69-K72 WeakPolarHBondContact OG-CB 3.43Å; S69-K72 WeakPolarHBondContact OG-CD 3.49Å; S69-K72 VanDerWaalsContact OG-CG 3.25Å; S69-K72 WeakPolarHBondContact OG-CG 3.4Å; S69-K72 PolarHBondContact OG-N 3.14Å; S69-H73 PolarHBondContact O-N 2.88Å; S69-N74 PolarHBondContact N-OD1 3.37Å; S69-N74 PolarHBondContact O-OD1 3.13Å
70	K	78.9	Confident	68.8	Low	198 Å²	198	89.9 Å²	89.9	86%	0.861	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-59.2	-41.6	172.9	-64.9	-176.6	179.2	-177.3	0	111.6	K72 H73	K70-K72 PolarHBondContact O-N 3.16Å; K70-H73 PolarHBondContact O-N 2.94Å; K70-H73 VanDerWaalsContact O-N 3.13Å
71	S	78.6	Confident	66.9	Low	100 Å²	100	87.4 Å²	87.4	70%	0.699	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-61.1	-27.6	179.3	53.5	0	0	0	0	113.9	S69 H73	S69-S71 VanDerWaalsContact C-N 3.29Å; S69-S71 PolarHBondContact O-N 2.92Å; S69-S71 PolarHBondContact OG-OG 3.12Å; S71-H73 PolarHBondContact O-ND1 3.4Å
72	K	71.9	Confident	64.9	Low	66 Å²	66	89.8 Å²	89.8	29%	0.287	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-94.9	-6.2	-179.5	-69.4	170.3	172.8	-147.9	0	113.4	E66 K67 S69 K70 N74	E66-K72 WeakPolarHBondContact OE1-CD 3.43Å; E66-K72 WeakPolarHBondContact OE2-CE 3.37Å; E66-K72 IonicContact OE2-NZ 2.69Å; E66-K72 PolarHBondContact OE2-NZ 3.23Å; K67-K72 VanDerWaalsContact O-CD 3.25Å; K67-K72 WeakPolarHBondContact O-CD 3.27Å; S69-K72 PolarHBondContact O-N 2.75Å; S69-K72 WeakPolarHBondContact OG-CB 3.43Å; S69-K72 WeakPolarHBondContact OG-CD 3.49Å; S69-K72 VanDerWaalsContact OG-CG 3.25Å; S69-K72 WeakPolarHBondContact OG-CG 3.4Å; S69-K72 PolarHBondContact OG-N 3.14Å; K70-K72 PolarHBondContact O-N 3.16Å; K72-N74 HydrophobicContact CB-CB 4.42Å; K72-N74 WeakPolarHBondContact CB-OD1 3.43Å; K72-N74 PolarHBondContact O-N 2.83Å
73	H	67.4	Low	63	Low	169 Å²	169	91.3 Å²	91.3	78%	0.782	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	24	-178.3	-54.9	74.4	0	0	0	113.5	S69 K70 S71	S69-H73 PolarHBondContact O-N 2.88Å; K70-H73 PolarHBondContact O-N 2.94Å; K70-H73 VanDerWaalsContact O-N 3.13Å; S71-H73 PolarHBondContact O-ND1 3.4Å
74	N	69.2	Low	61.5	Low	11 Å²	11	92.5 Å²	92.5	6%	0.059	50%	0.498	C	S	.	.			trans	-108.8	8.7	-179.9	67.8	-7.8	0	0	0	112.2	A36 E66 K67 M68 S69 K72	A36-N74 HydrophobicContact CB-CB 4.41Å; A36-N74 WeakPolarHBondContact CB-O 3.44Å; E66-N74 PolarHBondContact OE1-ND2 3.44Å; K67-N74 PolarHBondContact O-ND2 3.34Å; M68-N74 VanDerWaalsContact CA-OD1 3.24Å; M68-N74 WeakPolarHBondContact CA-OD1 3.42Å; S69-N74 PolarHBondContact N-OD1 3.37Å; S69-N74 PolarHBondContact O-OD1 3.13Å; K72-N74 HydrophobicContact CB-CB 4.42Å; K72-N74 WeakPolarHBondContact CB-OD1 3.43Å; K72-N74 PolarHBondContact O-N 2.83Å
75	G	66.5	Low	60.1	Low	50 Å²	50	91.8 Å²	91.8	52%	0.515	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-68.4	130	173.6	0	0	0	0	0	110.3
76	V	68.2	Low	58.8	Low	46 Å²	46	89.2 Å²	89.2	28%	0.279	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-90.7	119.2	174.7	177.8	0	0	0	0	109.4	M68 P78 L95 L125	M68-V76 HydrophobicContact SD-CB 4.29Å; M68-V76 HydrophobicContact SD-CG2 4.22Å; V76-P78 WeakPolarHBondContact O-CD 3.46Å; V76-L95 HydrophobicContact CG1-CD2 3.68Å; V76-L95 HydrophobicContact CG2-CD2 4.02Å; V76-L125 HydrophobicContact CG1-CD1 4.17Å
77	D	65.5	Low	57.1	Low	88 Å²	88	94.2 Å²	94.2	47%	0.471	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-74.6	121.4	173.8	-164.2	-42.2	0	0	0	109.9	Q79 V80	D77-Q79 PolarHBondContact OD1-N 3.04Å; D77-V80 HydrophobicContact CB-CB 4.14Å; D77-V80 VanDerWaalsContact CG-CB 3.48Å; D77-V80 VanDerWaalsContact CG-CG2 3.41Å; D77-V80 PolarHBondContact OD1-N 2.86Å; D77-V80 VanDerWaalsContact OD1-N 3.07Å; D77-V80 WeakPolarHBondContact OD2-CB 3.46Å; D77-V80 WeakPolarHBondContact OD2-CG2 3.46Å
78	P	61.4	Low	55	Low	76 Å²	76	98.4 Å²	98.4	49%	0.494	54%	0.543	S	S	.	.	S	Bend	trans	-71.5	-32.3	175.1	27	-31.7	0	0	0	113.4	V76 F99	V76-P78 WeakPolarHBondContact O-CD 3.46Å; P78-F99 HydrophobicContact CB-CD2 4.13Å; P78-F99 HydrophobicContact CB-CE2 3.31Å; P78-F99 HydrophobicContact CB-CZ 3.94Å; P78-F99 WeakPolarHBondContact O-CD2 3.19Å; P78-F99 VanDerWaalsContact O-CE2 3.28Å; P78-F99 WeakPolarHBondContact O-CE2 3.4Å
79	Q	53.3	Low	53.3	Low	169 Å²	169	103.5 Å²	103.5	79%	0.79	57%	0.565	S	S	*	*	S	Bend	trans	-99.1	-29.8	-168.1	-73.1	-179.6	-21.7	0	0	114.3	D77 C81	D77-Q79 PolarHBondContact OD1-N 3.04Å; Q79-C81 PolarHBondContact O-N 3.34Å
80	V	43.5	Very low	51.6	Low	88 Å²	88	108.1 Å²	108.1	53%	0.533	59%	0.594	S	S	.	*			trans	-87.3	112.3	-164.8	174.1	0	0	0	0	111.8	D77	D77-V80 HydrophobicContact CB-CB 4.14Å; D77-V80 VanDerWaalsContact CG-CB 3.48Å; D77-V80 VanDerWaalsContact CG-CG2 3.41Å; D77-V80 PolarHBondContact OD1-N 2.86Å; D77-V80 VanDerWaalsContact OD1-N 3.07Å; D77-V80 WeakPolarHBondContact OD2-CB 3.46Å; D77-V80 WeakPolarHBondContact OD2-CG2 3.46Å
81	C	37.8	Very low	49.9	Very low	45 Å²	45	108.2 Å²	108.2	30%	0.304	60%	0.595	S	S	.	*			trans	173	73.2	132	-87.1	0	0	0	0	112.4	Q79 K96	Q79-C81 PolarHBondContact O-N 3.34Å; C81-K96 HydrophobicContact CB-CB 4.08Å
82	A	31.2	Very low	48	Very low	88 Å²	88	109.5 Å²	109.5	73%	0.727	59%	0.588	S	S	*	*	S	Bend	trans	-93.3	-10.1	175.2	0	0	0	0	0	115.4
83	E	29.3	Very low	46.5	Very low	182 Å²	182	110.3 Å²	110.3	85%	0.85	60%	0.598	S	S	*	*	S	Bend	trans	-131.1	2	-157.7	-75.5	-174.8	169.7	0	0	121.2
84	V	31	Very low	45.2	Very low	120 Å²	120	103.7 Å²	103.7	73%	0.727	57%	0.57	S	S	*	*	S	Bend	trans	-138.4	-5.6	-177.5	-161.4	0	0	0	0	116
85	V	36.7	Very low	43.9	Very low	60 Å²	60	105.3 Å²	105.3	36%	0.364	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-86.9	-16.9	-168.3	-178.1	0	0	0	0	114.1	M87 K96	V85-M87 VanDerWaalsContact C-N 3.28Å; V85-M87 PolarHBondContact O-N 3.26Å; V85-K96 HydrophobicContact CG2-CD 4.01Å
86	S	37.9	Very low	42.9	Very low	127 Å²	127	107.5 Å²	107.5	89%	0.888	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-74.5	-11.7	-179.7	-159.9	0	0	0	0	114.6
87	M	36.7	Very low	42.1	Very low	145 Å²	145	107.2 Å²	107.2	71%	0.714	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-94	-20.9	-169.7	-163.9	173.9	-169.5	0	0	114.5	V85	V85-M87 VanDerWaalsContact C-N 3.28Å; V85-M87 PolarHBondContact O-N 3.26Å
88	Y	35.6	Very low	41.5	Very low	171 Å²	171	103.8 Å²	103.8	67%	0.671	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.6	-16.6	-170.9	-70.7	-79.7	0	0	0	116.3
89	F	38.5	Very low	41.2	Very low	147 Å²	147	103.3 Å²	103.3	65%	0.645	54%	0.543	S	S	*	.			trans	-148.4	83.8	-175.8	-82.3	-87.4	0	0	0	113.5	F91	F89-F91 PolarHBondContact O-N 3.46Å; F89-F91 VanDerWaalsContact O-N 3.11Å
90	P	43.8	Very low	41.2	Very low	124 Å²	124	100.9 Å²	100.9	81%	0.805	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-0.1	-177.8	27.2	-33.5	0	0	0	115.4
91	F	44.3	Very low	42	Very low	201 Å²	201	101.7 Å²	101.7	88%	0.882	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.7	5.9	-170	-107.5	-93.1	0	0	0	115.6	F89	F89-F91 PolarHBondContact O-N 3.46Å; F89-F91 VanDerWaalsContact O-N 3.11Å
92	F	39.3	Very low	43.2	Very low	127 Å²	127	102.6 Å²	102.6	56%	0.557	53%	0.528	S	S	*	.			trans	-128.8	82.9	-172.9	-135.9	-94	0	0	0	111.1	F128	F92-F128 HydrophobicContact CD1-CE1 4.22Å; F92-F128 HydrophobicContact CD1-CE2 4.3Å; F92-F128 AromaticContact CD1-CZ 3.82Å; F92-F128 HydrophobicContact CD1-CZ 3.82Å; F92-F128 HydrophobicContact CD2-CE1 4.1Å; F92-F128 AromaticContact CD2-CZ 3.85Å; F92-F128 HydrophobicContact CD2-CZ 3.85Å; F92-F128 AromaticContact CE1-CD1 3.92Å; F92-F128 HydrophobicContact CE1-CD1 3.92Å; F92-F128 AromaticContact CE1-CE1 3.43Å; F92-F128 HydrophobicContact CE1-CE1 3.43Å; F92-F128 VanDerWaalsContact CE1-CE1 3.43Å; F92-F128 HydrophobicContact CE1-CE2 4.07Å; F92-F128 HydrophobicContact CE1-CG 4.48Å; F92-F128 AromaticContact CE1-CZ 3.48Å; F92-F128 HydrophobicContact CE1-CZ 3.48Å; F92-F128 VanDerWaalsContact CE1-CZ 3.48Å; F92-F128 HydrophobicContact CE2-CD1 4.34Å; F92-F128 AromaticContact CE2-CE1 3.29Å; F92-F128 HydrophobicContact CE2-CE1 3.29Å; F92-F128 AromaticContact CE2-CZ 3.53Å; F92-F128 HydrophobicContact CE2-CZ 3.53Å; F92-F128 HydrophobicContact CG-CZ 4.02Å; F92-F128 AromaticContact CZ-CD1 3.59Å; F92-F128 HydrophobicContact CZ-CD1 3.59Å; F92-F128 AromaticContact CZ-CE1 2.91Å; F92-F128 HydrophobicContact CZ-CE1 2.91Å; F92-F128 HydrophobicContact CZ-CE2 4.35Å; F92-F128 AromaticContact CZ-CZ 3.36Å; F92-F128 HydrophobicContact CZ-CZ 3.36Å
93	T	39.8	Very low	45.1	Very low	83 Å²	83	99.4 Å²	99.4	51%	0.509	50%	0.504	S	S	.	.			trans	-112.7	92.2	178.3	36.8	0	0	0	0	110.6	D97	T93-D97 WeakPolarHBondContact CG2-OD2 3.28Å
94	C	39.7	Very low	47.5	Very low	29 Å²	29	93.4 Å²	93.4	20%	0.196	48%	0.481	C	S	.	.	S	Bend	trans	-142.9	140.5	169.2	-129	0	0	0	0	108	K96 D126 F128	C94-K96 VanDerWaalsContact C-N 3.28Å; C94-K96 PolarHBondContact O-N 3.46Å; C94-D126 VanDerWaalsContact CA-OD1 3.3Å; C94-D126 WeakPolarHBondContact CA-OD1 3.33Å; C94-D126 HydrophobicContact CB-CB 4.29Å; C94-D126 WeakPolarHBondContact CB-OD1 3.28Å; C94-D126 WeakPolarHBondContact CB-OD2 3.44Å; C94-D126 PolarHBondContact SG-OD1 3.1Å; C94-F128 HydrophobicContact CB-CD2 3.38Å; C94-F128 HydrophobicContact CB-CE2 3.47Å; C94-F128 VanDerWaalsContact CB-CE2 3.47Å; C94-F128 VanDerWaalsContact SG-CD2 3.55Å
95	L	41.6	Very low	49.9	Very low	45 Å²	45	87.7 Å²	87.7	24%	0.236	45%	0.447	C	S	.	.	S	Bend	trans	67.6	-41.1	-174.4	-115.5	114.5	0	0	0	119.1	L39 V76 D97 L125 D126	L39-L95 HydrophobicContact CD1-CD1 4.01Å; V76-L95 HydrophobicContact CG1-CD2 3.68Å; V76-L95 HydrophobicContact CG2-CD2 4.02Å; L95-D97 PolarHBondContact O-N 2.71Å; L95-D97 VanDerWaalsContact O-N 3.1Å; L95-L125 HydrophobicContact CB-CB 4.5Å; L95-L125 HydrophobicContact CD1-CB 3.37Å; L95-L125 HydrophobicContact CD2-CB 4.24Å; L95-L125 HydrophobicContact CD2-CD1 3.92Å; L95-L125 HydrophobicContact CG-CB 3.4Å; L95-L125 HydrophobicContact CG-CD1 3.79Å; L95-L125 HydrophobicContact CG-CG 4.23Å; L95-D126 WeakPolarHBondContact CA-OD1 3.32Å; L95-D126 WeakPolarHBondContact CB-OD1 3.4Å; L95-D126 WeakPolarHBondContact CB-OD2 3.44Å; L95-D126 HydrophobicContact CD1-CB 3.49Å; L95-D126 VanDerWaalsContact CD1-CB 3.49Å; L95-D126 WeakPolarHBondContact CD1-OD1 3.35Å; L95-D126 VanDerWaalsContact CD1-OD2 3.27Å; L95-D126 WeakPolarHBondContact CD1-OD2 3.4Å; L95-D126 PolarHBondContact N-OD1 3.5Å
96	K	45.3	Very low	51.8	Low	96 Å²	96	84.8 Å²	84.8	42%	0.417	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-7.1	-167.5	-68.4	-175.2	177.8	-178.3	0	115.9	C81 V85 C94	C81-K96 HydrophobicContact CB-CB 4.08Å; V85-K96 HydrophobicContact CG2-CD 4.01Å; C94-K96 VanDerWaalsContact C-N 3.28Å; C94-K96 PolarHBondContact O-N 3.46Å
97	D	51.4	Low	53.6	Low	40 Å²	40	79.2 Å²	79.2	21%	0.214	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	7.5	-170.8	-46.7	-39.5	0	0	0	114.9	T93 L95 F99 I100 K101	T93-D97 WeakPolarHBondContact CG2-OD2 3.28Å; L95-D97 PolarHBondContact O-N 2.71Å; L95-D97 VanDerWaalsContact O-N 3.1Å; D97-F99 PolarHBondContact O-N 2.82Å; D97-F99 VanDerWaalsContact O-N 3.16Å; D97-I100 PolarHBondContact O-N 2.85Å; D97-K101 HydrophobicContact CB-CB 3.57Å; D97-K101 HydrophobicContact CB-CD 3.92Å; D97-K101 HydrophobicContact CB-CG 4.43Å; D97-K101 WeakPolarHBondContact O-CA 3.46Å; D97-K101 WeakPolarHBondContact O-CB 3.32Å; D97-K101 PolarHBondContact O-N 2.91Å
98	L	53.1	Low	55.7	Low	17 Å²	17	77.9 Å²	77.9	9%	0.089	38%	0.377	C	S	.	.	I	π-helix	trans	-54.1	-49	-162.5	-169.4	69.9	0	0	0	114.1	Y102 G103 T107 L110 W123 L125 L139	L98-Y102 HydrophobicContact CD1-CD2 3.75Å; L98-Y102 HydrophobicContact CD1-CE2 4.26Å; L98-Y102 WeakPolarHBondContact O-CA 3.27Å; L98-Y102 WeakPolarHBondContact O-CB 3.35Å; L98-Y102 PolarHBondContact O-N 2.77Å; L98-G103 PolarHBondContact O-N 3.02Å; L98-T107 HydrophobicContact CD2-CG2 3.52Å; L98-T107 VanDerWaalsContact CD2-OG1 3.32Å; L98-T107 WeakPolarHBondContact CD2-OG1 3.44Å; L98-T107 HydrophobicContact CG-CG2 4.43Å; L98-T107 VanDerWaalsContact CG-OG1 3.32Å; L98-T107 WeakPolarHBondContact CG-OG1 3.04Å; L98-L110 HydrophobicContact CD2-CD2 4.38Å; L98-W123 HydrophobicContact CD2-CZ2 4.03Å; L98-L125 HydrophobicContact CB-CD1 4.48Å; L98-L125 HydrophobicContact CD1-CD2 3.75Å; L98-L125 HydrophobicContact CD2-CD1 3.98Å; L98-L125 HydrophobicContact CD2-CD2 3.66Å; L98-L125 HydrophobicContact CD2-CG 4.47Å; L98-L125 HydrophobicContact CG-CD2 4.25Å; L98-L139 HydrophobicContact CD1-CD1 3.95Å; L98-L139 HydrophobicContact CD1-CD2 3.92Å
99	F	56	Low	57.8	Low	65 Å²	65	70.7 Å²	70.7	29%	0.285	35%	0.35	S	S	.	.	I	π-helix	trans	-74.1	-35.4	177.4	-78.1	-95.1	0	0	0	113.4	P78 D97 G103 C104 T107	P78-F99 HydrophobicContact CB-CD2 4.13Å; P78-F99 HydrophobicContact CB-CE2 3.31Å; P78-F99 HydrophobicContact CB-CZ 3.94Å; P78-F99 WeakPolarHBondContact O-CD2 3.19Å; P78-F99 VanDerWaalsContact O-CE2 3.28Å; P78-F99 WeakPolarHBondContact O-CE2 3.4Å; D97-F99 PolarHBondContact O-N 2.82Å; D97-F99 VanDerWaalsContact O-N 3.16Å; F99-G103 WeakPolarHBondContact O-CA 3.48Å; F99-G103 PolarHBondContact O-N 3.06Å; F99-C104 HydrophobicContact CD1-CB 4.07Å; F99-C104 WeakPolarHBondContact CD1-SG 3.13Å; F99-C104 HydrophobicContact CE1-CB 3.95Å; F99-T107 HydrophobicContact CD2-CG2 4.5Å; F99-T107 HydrophobicContact CE1-CG2 4.38Å; F99-T107 HydrophobicContact CE2-CG2 3.72Å; F99-T107 HydrophobicContact CZ-CG2 3.67Å
100	I	53.3	Low	59.6	Low	118 Å²	118	64.2 Å²	64.2	61%	0.605	32%	0.322	S	S	*	.	I	π-helix	trans	-72.1	-40	179.8	-64.8	175.6	0	0	0	111.1	D97	D97-I100 PolarHBondContact O-N 2.85Å
101	K	59.1	Low	61.2	Low	105 Å²	105	61.3 Å²	61.3	46%	0.457	30%	0.302	S	S	.	.	I	π-helix	trans	-86.4	-34	-174.3	-176.1	170.8	-176.5	166	0	113.4	D97	D97-K101 HydrophobicContact CB-CB 3.57Å; D97-K101 HydrophobicContact CB-CD 3.92Å; D97-K101 HydrophobicContact CB-CG 4.43Å; D97-K101 WeakPolarHBondContact O-CA 3.46Å; D97-K101 WeakPolarHBondContact O-CB 3.32Å; D97-K101 PolarHBondContact O-N 2.91Å
102	Y	64.6	Low	62.9	Low	64 Å²	64	55.1 Å²	55.1	25%	0.251	28%	0.28	S	S	.	.	I	π-helix	trans	-121.5	-16.3	-176	-56.3	-84.3	0	0	0	113.5	L98 V106 L139 Q143	L98-Y102 HydrophobicContact CD1-CD2 3.75Å; L98-Y102 HydrophobicContact CD1-CE2 4.26Å; L98-Y102 WeakPolarHBondContact O-CA 3.27Å; L98-Y102 WeakPolarHBondContact O-CB 3.35Å; L98-Y102 PolarHBondContact O-N 2.77Å; Y102-V106 HydrophobicContact CD1-CG1 4.39Å; Y102-V106 HydrophobicContact CG-CG1 4.27Å; Y102-V106 WeakPolarHBondContact O-CB 3.44Å; Y102-V106 WeakPolarHBondContact O-CG2 3.41Å; Y102-L139 HydrophobicContact CD1-CG 4.37Å; Y102-L139 HydrophobicContact CD2-CD2 3.98Å; Y102-L139 HydrophobicContact CE1-CD2 4.05Å; Y102-L139 HydrophobicContact CE1-CG 4.06Å; Y102-L139 HydrophobicContact CE2-CD2 3.39Å; Y102-L139 HydrophobicContact CE2-CG 4.22Å; Y102-L139 HydrophobicContact CG-CD1 4.48Å; Y102-L139 HydrophobicContact CG-CD2 4.49Å; Y102-L139 VanDerWaalsContact CZ-CD2 3.42Å; Y102-Q143 HydrophobicContact CD1-CB 4.46Å; Y102-Q143 HydrophobicContact CD1-CG 4.35Å
103	G	71.3	Confident	64.6	Low	22 Å²	22	52 Å²	52	23%	0.227	28%	0.278	C	S	.	.	H	α-helix	trans	83.1	164.8	-178.5	0	0	0	0	0	114.1	L98 F99 D105 T107	L98-G103 PolarHBondContact O-N 3.02Å; F99-G103 WeakPolarHBondContact O-CA 3.48Å; F99-G103 PolarHBondContact O-N 3.06Å; G103-D105 VanDerWaalsContact C-N 3.29Å; G103-D105 PolarHBondContact O-N 2.8Å; G103-T107 PolarHBondContact O-N 2.82Å; G103-T107 PolarHBondContact O-OG1 2.9Å
104	C	78.9	Confident	65.9	Low	55 Å²	55	52.2 Å²	52.2	37%	0.372	28%	0.276	S	S	.	.	H	α-helix	trans	-56.2	-41.8	-179.6	-63.8	0	0	0	0	113.1	F99 T107 R108	F99-C104 HydrophobicContact CD1-CB 4.07Å; F99-C104 WeakPolarHBondContact CD1-SG 3.13Å; F99-C104 HydrophobicContact CE1-CB 3.95Å; C104-T107 WeakPolarHBondContact O-CB 3.29Å; C104-T107 PolarHBondContact O-N 3.37Å; C104-R108 WeakPolarHBondContact O-CG 3.31Å; C104-R108 PolarHBondContact O-N 2.91Å
105	D	80.7	Confident	67.4	Low	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-70.9	-37.3	-171	-77.8	0.8	0	0	0	112.6	G103 T107 R108 L109 V217 P218 H219 H220	G103-D105 VanDerWaalsContact C-N 3.29Å; G103-D105 PolarHBondContact O-N 2.8Å; D105-T107 VanDerWaalsContact C-N 3.34Å; D105-R108 PolarHBondContact O-N 3.2Å; D105-L109 PolarHBondContact O-N 2.76Å; D105-V217 HydrophobicContact CB-CB 3.81Å; D105-V217 HydrophobicContact CB-CG1 3.72Å; D105-V217 WeakPolarHBondContact OD2-CA 3.28Å; D105-P218 WeakPolarHBondContact OD1-CD 3.09Å; D105-H219 IonicContact OD1-CE1 3.66Å; D105-H219 IonicContact OD1-CG 3.7Å; D105-H219 IonicContact OD1-ND1 2.74Å; D105-H219 PolarHBondContact OD1-ND1 2.95Å; D105-H219 WeakPolarHBondContact OD2-CB 3.14Å; D105-H219 IonicContact OD2-CG 4Å; D105-H219 PolarHBondContact OD2-N 3.25Å; D105-H219 IonicContact OD2-ND1 3.75Å; D105-H220 WeakPolarHBondContact CB-ND1 3.48Å; D105-H220 IonicContact OD2-CE1 3.7Å; D105-H220 IonicContact OD2-CG 2.77Å; D105-H220 PolarHBondContact OD2-N 2.84Å; D105-H220 VanDerWaalsContact OD2-N 3.12Å; D105-H220 IonicContact OD2-ND1 2.7Å; D105-H220 PolarHBondContact OD2-ND1 2.88Å
106	V	77.6	Confident	69.2	Low	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.6	-40.6	172.7	176.2	0	0	0	0	110.3	Y102 L109 L110 L139 I142 I146	Y102-V106 HydrophobicContact CD1-CG1 4.39Å; Y102-V106 HydrophobicContact CG-CG1 4.27Å; Y102-V106 WeakPolarHBondContact O-CB 3.44Å; Y102-V106 WeakPolarHBondContact O-CG2 3.41Å; V106-L109 PolarHBondContact O-N 3.26Å; V106-L110 VanDerWaalsContact O-CB 3.31Å; V106-L110 WeakPolarHBondContact O-CB 3.42Å; V106-L110 PolarHBondContact O-N 3.4Å; V106-L139 HydrophobicContact CG1-CD1 3.73Å; V106-I142 HydrophobicContact CG1-CG2 4.16Å; V106-I146 HydrophobicContact CB-CD1 4.47Å; V106-I146 HydrophobicContact CG2-CD1 3.64Å
107	T	74.2	Confident	71	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.055	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-44.8	175.1	-57.6	0	0	0	0	111.8	L98 F99 G103 C104 D105 L110 V111 W123	L98-T107 HydrophobicContact CD2-CG2 3.52Å; L98-T107 VanDerWaalsContact CD2-OG1 3.32Å; L98-T107 WeakPolarHBondContact CD2-OG1 3.44Å; L98-T107 HydrophobicContact CG-CG2 4.43Å; L98-T107 VanDerWaalsContact CG-OG1 3.32Å; L98-T107 WeakPolarHBondContact CG-OG1 3.04Å; F99-T107 HydrophobicContact CD2-CG2 4.5Å; F99-T107 HydrophobicContact CE1-CG2 4.38Å; F99-T107 HydrophobicContact CE2-CG2 3.72Å; F99-T107 HydrophobicContact CZ-CG2 3.67Å; G103-T107 PolarHBondContact O-N 2.82Å; G103-T107 PolarHBondContact O-OG1 2.9Å; C104-T107 WeakPolarHBondContact O-CB 3.29Å; C104-T107 PolarHBondContact O-N 3.37Å; D105-T107 VanDerWaalsContact C-N 3.34Å; T107-L110 WeakPolarHBondContact O-CB 3.42Å; T107-L110 PolarHBondContact O-N 2.89Å; T107-V111 VanDerWaalsContact O-CG2 3.25Å; T107-V111 WeakPolarHBondContact O-CG2 3.38Å; T107-V111 PolarHBondContact O-N 2.91Å; T107-W123 HydrophobicContact CG2-CH2 4.47Å
108	R	80.8	Confident	72.4	Confident	117 Å²	117	61.7 Å²	61.7	44%	0.442	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-49.3	176.6	-72.7	172.1	68.4	88.8	1.5	111.2	C104 D105 L110 V111 T112 P215 F216	C104-R108 WeakPolarHBondContact O-CG 3.31Å; C104-R108 PolarHBondContact O-N 2.91Å; D105-R108 PolarHBondContact O-N 3.2Å; R108-L110 VanDerWaalsContact C-N 3.3Å; R108-L110 PolarHBondContact O-N 3.28Å; R108-V111 WeakPolarHBondContact O-CB 3.4Å; R108-V111 PolarHBondContact O-N 3.41Å; R108-V111 VanDerWaalsContact O-N 3.14Å; R108-T112 PolarHBondContact O-N 3.21Å; R108-T112 VanDerWaalsContact O-N 3.09Å; R108-T112 PolarHBondContact O-OG1 2.99Å; R108-P215 PolarHBondContact NH2-O 3.46Å; R108-F216 WeakPolarHBondContact CB-O 3.1Å; R108-F216 WeakPolarHBondContact CD-O 3.45Å; R108-F216 PolarHBondContact NE-O 2.98Å; R108-F216 VanDerWaalsContact NE-O 3.13Å
109	L	80.4	Confident	73.6	Confident	21 Å²	21	63.2 Å²	63.2	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-39	176.3	-83.6	173.4	0	0	0	112.2	D105 V106 V111 T112 A113 I142 W145 I146 F216 V217	D105-L109 PolarHBondContact O-N 2.76Å; V106-L109 PolarHBondContact O-N 3.26Å; L109-V111 VanDerWaalsContact C-N 3.33Å; L109-V111 PolarHBondContact O-N 2.92Å; L109-T112 PolarHBondContact O-N 2.94Å; L109-T112 PolarHBondContact O-OG1 2.78Å; L109-A113 WeakPolarHBondContact O-CB 3.34Å; L109-A113 PolarHBondContact O-N 2.83Å; L109-I142 HydrophobicContact CB-CG2 3.81Å; L109-I142 HydrophobicContact CD1-CG2 4.18Å; L109-W145 HydrophobicContact CD1-CZ3 4.21Å; L109-I146 HydrophobicContact CD1-CD1 3.37Å; L109-I146 HydrophobicContact CD1-CG1 3.77Å; L109-F216 HydrophobicContact CD2-CB 3.62Å; L109-F216 HydrophobicContact CD2-CG 4.14Å; L109-F216 HydrophobicContact CG-CB 4.09Å; L109-V217 HydrophobicContact CD1-CG1 3.22Å; L109-V217 HydrophobicContact CG-CG1 3.66Å
110	L	76.9	Confident	74.4	Confident	11 Å²	11	66.7 Å²	66.7	6%	0.058	37%	0.37	C	S	.	.	H	α-helix	trans	-57.2	-50.4	173.8	-177	71.1	0	0	0	109.6	L98 V106 T107 R108 T112 A113 R121 W123 L125 L139 I142	L98-L110 HydrophobicContact CD2-CD2 4.38Å; V106-L110 VanDerWaalsContact O-CB 3.31Å; V106-L110 WeakPolarHBondContact O-CB 3.42Å; V106-L110 PolarHBondContact O-N 3.4Å; T107-L110 WeakPolarHBondContact O-CB 3.42Å; T107-L110 PolarHBondContact O-N 2.89Å; R108-L110 VanDerWaalsContact C-N 3.3Å; R108-L110 PolarHBondContact O-N 3.28Å; L110-T112 PolarHBondContact O-N 2.84Å; L110-A113 PolarHBondContact O-N 2.86Å; L110-R121 PolarHBondContact O-NH1 2.85Å; L110-R121 PolarHBondContact O-NH2 2.6Å; L110-W123 HydrophobicContact CD2-CH2 4.22Å; L110-L125 HydrophobicContact CD2-CD2 3.58Å; L110-L139 HydrophobicContact CD1-CD1 4.21Å; L110-L139 HydrophobicContact CD2-CD1 4.07Å; L110-L139 HydrophobicContact CG-CD1 4.49Å; L110-I142 HydrophobicContact CB-CD1 4.15Å; L110-I142 HydrophobicContact CD1-CD1 3.94Å
111	V	76.4	Confident	75.2	Confident	62 Å²	62	62.4 Å²	62.4	38%	0.376	35%	0.346	S	S	.	.	H	α-helix	trans	-56.9	-33.1	178.8	176.5	0	0	0	0	112.5	T107 R108 L109 R121 W123	T107-V111 VanDerWaalsContact O-CG2 3.25Å; T107-V111 WeakPolarHBondContact O-CG2 3.38Å; T107-V111 PolarHBondContact O-N 2.91Å; R108-V111 WeakPolarHBondContact O-CB 3.4Å; R108-V111 PolarHBondContact O-N 3.41Å; R108-V111 VanDerWaalsContact O-N 3.14Å; L109-V111 VanDerWaalsContact C-N 3.33Å; L109-V111 PolarHBondContact O-N 2.92Å; V111-R121 PolarHBondContact O-NH1 3.37Å; V111-W123 HydrophobicContact CG2-CH2 3.52Å; V111-W123 HydrophobicContact CG2-CZ3 3.56Å
112	T	80.8	Confident	75.7	Confident	71 Å²	71	59.7 Å²	59.7	44%	0.436	34%	0.339	S	S	.	.	H	α-helix	trans	-99.1	-21.1	-175.6	58.4	0	0	0	0	115	R108 L109 L110 F216	R108-T112 PolarHBondContact O-N 3.21Å; R108-T112 VanDerWaalsContact O-N 3.09Å; R108-T112 PolarHBondContact O-OG1 2.99Å; L109-T112 PolarHBondContact O-N 2.94Å; L109-T112 PolarHBondContact O-OG1 2.78Å; L110-T112 PolarHBondContact O-N 2.84Å; T112-F216 HydrophobicContact CG2-CD1 4.13Å; T112-F216 HydrophobicContact CG2-CE1 4.17Å
113	A	75.3	Confident	75.7	Confident	61 Å²	61	58.4 Å²	58.4	50%	0.504	33%	0.334	S	S	.	.	H	α-helix	trans	-84.9	-34.2	-169.3	0	0	0	0	0	115.2	L109 L110 I142	L109-A113 WeakPolarHBondContact O-CB 3.34Å; L109-A113 PolarHBondContact O-N 2.83Å; L110-A113 PolarHBondContact O-N 2.86Å; A113-I142 HydrophobicContact CB-CD1 3.97Å
114	N	66.7	Low	75.1	Confident	89 Å²	89	60.1 Å²	60.1	48%	0.476	34%	0.338	S	S	.	.	S	Bend	trans	-96.9	-12.8	-164.1	-70.1	-12.3	0	0	0	115.3
115	A	71.5	Confident	73.8	Confident	28 Å²	28	58.8 Å²	58.8	23%	0.231	33%	0.327	C	S	.	.	S	Bend	trans	-147.8	141.2	-174.5	0	0	0	0	0	108.9	S119 R121	A115-S119 WeakPolarHBondContact CB-OG 3.34Å; A115-R121 HydrophobicContact CB-CB 4.25Å; A115-R121 HydrophobicContact CB-CG 4.3Å
116	S	79.5	Confident	72.1	Confident	65 Å²	65	60.4 Å²	60.4	46%	0.455	34%	0.336	S	S	.	.			trans	-63.5	150	172.4	80.3	0	0	0	0	109.4	Q118 S119	S116-Q118 PolarHBondContact O-N 3.47Å; S116-S119 PolarHBondContact N-OG 2.86Å; S116-S119 PolarHBondContact O-N 2.93Å; S116-S119 PolarHBondContact O-OG 2.83Å; S116-S119 VanDerWaalsContact OG-CB 3.29Å; S116-S119 WeakPolarHBondContact OG-CB 3.45Å; S116-S119 PolarHBondContact OG-N 2.83Å; S116-S119 VanDerWaalsContact OG-N 3.1Å; S116-S119 PolarHBondContact OG-OG 2.85Å
117	P	82.1	Confident	70.1	Confident	138 Å²	138	60.6 Å²	60.6	90%	0.896	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-24	178.4	-25.8	33.4	0	0	0	114.2
118	Q	80.8	Confident	68	Low	177 Å²	177	63 Å²	63	83%	0.827	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-16	179.1	-63.9	178.1	-9.6	0	0	113.2	S116	S116-Q118 PolarHBondContact O-N 3.47Å
119	S	78.7	Confident	65.9	Low	50 Å²	50	63.3 Å²	63.3	35%	0.35	35%	0.352	S	S	.	.	S	Bend	trans	-84.1	146.6	179.5	65.8	0	0	0	0	111.6	A115 S116 R121	A115-S119 WeakPolarHBondContact CB-OG 3.34Å; S116-S119 PolarHBondContact N-OG 2.86Å; S116-S119 PolarHBondContact O-N 2.93Å; S116-S119 PolarHBondContact O-OG 2.83Å; S116-S119 VanDerWaalsContact OG-CB 3.29Å; S116-S119 WeakPolarHBondContact OG-CB 3.45Å; S116-S119 PolarHBondContact OG-N 2.83Å; S116-S119 VanDerWaalsContact OG-N 3.1Å; S116-S119 PolarHBondContact OG-OG 2.85Å; S119-R121 PolarHBondContact O-N 3.38Å
120	H	72.6	Confident	63.4	Low	137 Å²	137	69.8 Å²	69.8	63%	0.634	38%	0.377	S	S	*	.			trans	-64.9	133.2	169.8	-63.3	-68	0	0	0	109.9	Y35	Y35-H120 AromaticContact CD2-ND1 3.78Å; Y35-H120 AromaticContact CE2-CE1 3.83Å; Y35-H120 AromaticContact CE2-ND1 3.36Å; Y35-H120 WeakPolarHBondContact CE2-ND1 3.45Å
121	R	70.2	Confident	61.2	Low	29 Å²	29	73.9 Å²	73.9	11%	0.109	40%	0.398	C	S	.	.			trans	-106.3	127.8	176.3	-174.5	-177.3	-173.8	119.4	7.4	110	Y35 L110 V111 A115 S119	Y35-R121 VanDerWaalsContact O-O 3.08Å; L110-R121 PolarHBondContact O-NH1 2.85Å; L110-R121 PolarHBondContact O-NH2 2.6Å; V111-R121 PolarHBondContact O-NH1 3.37Å; A115-R121 HydrophobicContact CB-CB 4.25Å; A115-R121 HydrophobicContact CB-CG 4.3Å; S119-R121 PolarHBondContact O-N 3.38Å
122	C	69	Low	59.2	Low	47 Å²	47	75.2 Å²	75.2	32%	0.318	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.6	163.6	-176.9	0	0	0	0	108.7	V37 N124	V37-C122 VanDerWaalsContact CG2-SG 3.53Å; C122-N124 VanDerWaalsContact C-N 3.33Å; C122-N124 PolarHBondContact O-N 3.46Å
123	W	65.4	Low	56.8	Low	37 Å²	37	82.6 Å²	82.6	14%	0.14	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	83	176.5	-164.3	-97.6	0	0	0	110.5	Y35 M68 L98 T107 L110 V111 L125	Y35-W123 PolarHBondContact O-N 2.86Å; M68-W123 HydrophobicContact CE-CB 4.48Å; L98-W123 HydrophobicContact CD2-CZ2 4.03Å; T107-W123 HydrophobicContact CG2-CH2 4.47Å; L110-W123 HydrophobicContact CD2-CH2 4.22Å; V111-W123 HydrophobicContact CG2-CH2 3.52Å; V111-W123 HydrophobicContact CG2-CZ3 3.56Å; W123-L125 HydrophobicContact CZ2-CD1 3.93Å; W123-L125 HydrophobicContact CZ2-CD2 4.08Å; W123-L125 HydrophobicContact CZ2-CG 4.1Å; W123-L125 VanDerWaalsContact NE1-CG 3.29Å
124	N	57.9	Low	54.8	Low	59 Å²	59	85.7 Å²	85.7	32%	0.316	43%	0.429	S	S	.	.			trans	-104.7	66.5	-177.5	62.3	-5.1	0	0	0	111.9	C122 D126 S135	C122-N124 VanDerWaalsContact C-N 3.33Å; C122-N124 PolarHBondContact O-N 3.46Å; N124-D126 PolarHBondContact O-N 2.92Å; N124-S135 WeakPolarHBondContact ND2-CB 3.48Å; N124-S135 WeakPolarHBondContact O-CB 3.4Å; N124-S135 PolarHBondContact O-OG 3.47Å
125	L	52.4	Low	53.5	Low	26 Å²	26	82.1 Å²	82.1	14%	0.136	41%	0.411	C	S	.	.	S	Bend	trans	-64.4	-20.3	173.1	-72.8	178.1	0	0	0	112.4	V76 L95 L98 L110 W123	V76-L125 HydrophobicContact CG1-CD1 4.17Å; L95-L125 HydrophobicContact CB-CB 4.5Å; L95-L125 HydrophobicContact CD1-CB 3.37Å; L95-L125 HydrophobicContact CD2-CB 4.24Å; L95-L125 HydrophobicContact CD2-CD1 3.92Å; L95-L125 HydrophobicContact CG-CB 3.4Å; L95-L125 HydrophobicContact CG-CD1 3.79Å; L95-L125 HydrophobicContact CG-CG 4.23Å; L98-L125 HydrophobicContact CB-CD1 4.48Å; L98-L125 HydrophobicContact CD1-CD2 3.75Å; L98-L125 HydrophobicContact CD2-CD1 3.98Å; L98-L125 HydrophobicContact CD2-CD2 3.66Å; L98-L125 HydrophobicContact CD2-CG 4.47Å; L98-L125 HydrophobicContact CG-CD2 4.25Å; L110-L125 HydrophobicContact CD2-CD2 3.58Å; W123-L125 HydrophobicContact CZ2-CD1 3.93Å; W123-L125 HydrophobicContact CZ2-CD2 4.08Å; W123-L125 HydrophobicContact CZ2-CG 4.1Å; W123-L125 VanDerWaalsContact NE1-CG 3.29Å
126	D	45.9	Very low	52.2	Low	34 Å²	34	86.1 Å²	86.1	18%	0.182	42%	0.423	C	S	.	.			trans	-119.7	90	-178.5	-74.9	3	0	0	0	111.1	C94 L95 N124 F128	C94-D126 VanDerWaalsContact CA-OD1 3.3Å; C94-D126 WeakPolarHBondContact CA-OD1 3.33Å; C94-D126 HydrophobicContact CB-CB 4.29Å; C94-D126 WeakPolarHBondContact CB-OD1 3.28Å; C94-D126 WeakPolarHBondContact CB-OD2 3.44Å; C94-D126 PolarHBondContact SG-OD1 3.1Å; L95-D126 WeakPolarHBondContact CA-OD1 3.32Å; L95-D126 WeakPolarHBondContact CB-OD1 3.4Å; L95-D126 WeakPolarHBondContact CB-OD2 3.44Å; L95-D126 HydrophobicContact CD1-CB 3.49Å; L95-D126 VanDerWaalsContact CD1-CB 3.49Å; L95-D126 WeakPolarHBondContact CD1-OD1 3.35Å; L95-D126 VanDerWaalsContact CD1-OD2 3.27Å; L95-D126 WeakPolarHBondContact CD1-OD2 3.4Å; L95-D126 PolarHBondContact N-OD1 3.5Å; N124-D126 PolarHBondContact O-N 2.92Å; D126-F128 HydrophobicContact CB-CB 4.36Å; D126-F128 PolarHBondContact O-N 3.44Å
127	G	34.7	Very low	50.8	Low	5 Å²	5	85.9 Å²	85.9	5%	0.052	43%	0.425	C	S	.	.			trans	-72.4	66.9	156.8	0	0	0	0	0	109.8	I132 S135	G127-I132 WeakPolarHBondContact O-CG1 3.34Å; G127-S135 PolarHBondContact N-OG 3.34Å
128	F	31.2	Very low	49.6	Very low	59 Å²	59	80 Å²	80	26%	0.259	39%	0.39	S	S	.	.			trans	-80.1	-32.3	-167.6	-141.7	-92.8	0	0	0	114.8	F92 C94 D126	F92-F128 HydrophobicContact CD1-CE1 4.22Å; F92-F128 HydrophobicContact CD1-CE2 4.3Å; F92-F128 AromaticContact CD1-CZ 3.82Å; F92-F128 HydrophobicContact CD1-CZ 3.82Å; F92-F128 HydrophobicContact CD2-CE1 4.1Å; F92-F128 AromaticContact CD2-CZ 3.85Å; F92-F128 HydrophobicContact CD2-CZ 3.85Å; F92-F128 AromaticContact CE1-CD1 3.92Å; F92-F128 HydrophobicContact CE1-CD1 3.92Å; F92-F128 AromaticContact CE1-CE1 3.43Å; F92-F128 HydrophobicContact CE1-CE1 3.43Å; F92-F128 VanDerWaalsContact CE1-CE1 3.43Å; F92-F128 HydrophobicContact CE1-CE2 4.07Å; F92-F128 HydrophobicContact CE1-CG 4.48Å; F92-F128 AromaticContact CE1-CZ 3.48Å; F92-F128 HydrophobicContact CE1-CZ 3.48Å; F92-F128 VanDerWaalsContact CE1-CZ 3.48Å; F92-F128 HydrophobicContact CE2-CD1 4.34Å; F92-F128 AromaticContact CE2-CE1 3.29Å; F92-F128 HydrophobicContact CE2-CE1 3.29Å; F92-F128 AromaticContact CE2-CZ 3.53Å; F92-F128 HydrophobicContact CE2-CZ 3.53Å; F92-F128 HydrophobicContact CG-CZ 4.02Å; F92-F128 AromaticContact CZ-CD1 3.59Å; F92-F128 HydrophobicContact CZ-CD1 3.59Å; F92-F128 AromaticContact CZ-CE1 2.91Å; F92-F128 HydrophobicContact CZ-CE1 2.91Å; F92-F128 HydrophobicContact CZ-CE2 4.35Å; F92-F128 AromaticContact CZ-CZ 3.36Å; F92-F128 HydrophobicContact CZ-CZ 3.36Å; C94-F128 HydrophobicContact CB-CD2 3.38Å; C94-F128 HydrophobicContact CB-CE2 3.47Å; C94-F128 VanDerWaalsContact CB-CE2 3.47Å; C94-F128 VanDerWaalsContact SG-CD2 3.55Å; D126-F128 HydrophobicContact CB-CB 4.36Å; D126-F128 PolarHBondContact O-N 3.44Å
129	F	35	Very low	48.9	Very low	123 Å²	123	72.5 Å²	72.5	54%	0.539	36%	0.355	S	S	.	.	S	Bend	trans	-144.6	-11.6	-179.6	-116.3	-93.1	0	0	0	120
130	Y	29.2	Very low	48.4	Very low	158 Å²	158	78.4 Å²	78.4	62%	0.62	37%	0.37	S	S	*	.	S	Bend	trans	-143.8	-4.3	172.5	-144.1	-114.2	0	0	0	117.7	G49	G49-Y130 PolarHBondContact O-OH 2.67Å
131	L	30.5	Very low	48.4	Very low	97 Å²	97	73.7 Å²	73.7	51%	0.508	36%	0.357	S	S	.	.			trans	-110.2	33.8	169.1	-78.1	166.3	0	0	0	112.5	R133 I134	L131-R133 PolarHBondContact O-N 3.4Å; L131-I134 PolarHBondContact O-N 3.28Å
132	I	33.3	Very low	48.8	Very low	89 Å²	89	73.1 Å²	73.1	46%	0.456	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.6	-172.6	-75.9	171.4	0	0	0	114.6	G127	G127-I132 WeakPolarHBondContact O-CG1 3.34Å
133	R	30.1	Very low	49.2	Very low	226 Å²	226	72.6 Å²	72.6	85%	0.853	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-24.7	179.9	-89.3	-175.2	168.6	179.3	-2.3	116.4	L131 A137	L131-R133 PolarHBondContact O-N 3.4Å; R133-A137 VanDerWaalsContact O-CB 3.25Å; R133-A137 WeakPolarHBondContact O-CB 3.35Å
134	I	34.9	Very low	49.9	Very low	127 Å²	127	75 Å²	75	65%	0.651	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-40.1	-165.5	-55.1	179.3	0	0	0	112.6	L131 G138	L131-I134 PolarHBondContact O-N 3.28Å; I134-G138 PolarHBondContact O-N 3.25Å
135	S	39.3	Very low	51.1	Low	13 Å²	13	76.2 Å²	76.2	9%	0.091	37%	0.365	C	S	.	.	H	α-helix	trans	-85.4	-35.7	-177.6	89.6	0	0	0	0	114.2	N124 G127 A137 G138 L139	N124-S135 WeakPolarHBondContact ND2-CB 3.48Å; N124-S135 WeakPolarHBondContact O-CB 3.4Å; N124-S135 PolarHBondContact O-OG 3.47Å; G127-S135 PolarHBondContact N-OG 3.34Å; S135-A137 VanDerWaalsContact C-N 3.26Å; S135-A137 PolarHBondContact O-N 2.97Å; S135-G138 PolarHBondContact O-N 3.2Å; S135-L139 PolarHBondContact O-N 2.91Å
136	K	43.5	Very low	52.5	Low	113 Å²	113	75 Å²	75	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-62.9	-33.5	170.3	-75	-173.4	179.9	178.3	0	111.9	R140	K136-R140 WeakPolarHBondContact O-CB 2.88Å; K136-R140 PolarHBondContact O-N 2.59Å
137	A	49.4	Very low	54.3	Low	60 Å²	60	77 Å²	77	50%	0.496	37%	0.37	S	S	.	.	H	α-helix	trans	-67.3	-36.9	175.8	0	0	0	0	0	112.1	R133 S135 G141	R133-A137 VanDerWaalsContact O-CB 3.25Å; R133-A137 WeakPolarHBondContact O-CB 3.35Å; S135-A137 VanDerWaalsContact C-N 3.26Å; S135-A137 PolarHBondContact O-N 2.97Å; A137-G141 VanDerWaalsContact O-CA 3.26Å; A137-G141 WeakPolarHBondContact O-CA 3.5Å; A137-G141 PolarHBondContact O-N 2.65Å
138	G	58.3	Low	56.6	Low	15 Å²	15	80.6 Å²	80.6	16%	0.155	38%	0.382	C	S	.	.	H	α-helix	trans	-65.3	-55.8	176.7	0	0	0	0	0	112.5	I134 S135 G141 I142	I134-G138 PolarHBondContact O-N 3.25Å; S135-G138 PolarHBondContact O-N 3.2Å; G138-G141 PolarHBondContact O-N 3.37Å; G138-I142 VanDerWaalsContact O-CG1 3.32Å; G138-I142 WeakPolarHBondContact O-CG1 3.48Å; G138-I142 PolarHBondContact O-N 3.49Å
139	L	64.6	Low	59.1	Low	18 Å²	18	78.1 Å²	78.1	9%	0.094	37%	0.371	C	S	.	.	H	α-helix	trans	-66.8	-45.6	-177.7	-171.8	65	0	0	0	112.3	L98 Y102 V106 L110 S135 G141 I142 Q143	L98-L139 HydrophobicContact CD1-CD1 3.95Å; L98-L139 HydrophobicContact CD1-CD2 3.92Å; Y102-L139 HydrophobicContact CD1-CG 4.37Å; Y102-L139 HydrophobicContact CD2-CD2 3.98Å; Y102-L139 HydrophobicContact CE1-CD2 4.05Å; Y102-L139 HydrophobicContact CE1-CG 4.06Å; Y102-L139 HydrophobicContact CE2-CD2 3.39Å; Y102-L139 HydrophobicContact CE2-CG 4.22Å; Y102-L139 HydrophobicContact CG-CD1 4.48Å; Y102-L139 HydrophobicContact CG-CD2 4.49Å; Y102-L139 VanDerWaalsContact CZ-CD2 3.42Å; V106-L139 HydrophobicContact CG1-CD1 3.73Å; L110-L139 HydrophobicContact CD1-CD1 4.21Å; L110-L139 HydrophobicContact CD2-CD1 4.07Å; L110-L139 HydrophobicContact CG-CD1 4.49Å; S135-L139 PolarHBondContact O-N 2.91Å; L139-G141 VanDerWaalsContact C-N 3.27Å; L139-G141 PolarHBondContact O-N 2.95Å; L139-I142 PolarHBondContact O-N 2.93Å; L139-Q143 WeakPolarHBondContact O-CB 3.2Å; L139-Q143 PolarHBondContact O-N 3.41Å
140	R	69.1	Low	61.3	Low	175 Å²	175	75 Å²	75	66%	0.66	36%	0.356	S	S	*	.	H	α-helix	trans	-64.7	-35	175.1	-170	178.3	-178.6	-174.3	0.3	111.2	K136 N144	K136-R140 WeakPolarHBondContact O-CB 2.88Å; K136-R140 PolarHBondContact O-N 2.59Å; R140-N144 WeakPolarHBondContact O-CB 3.48Å; R140-N144 PolarHBondContact O-N 3.41Å; R140-N144 PolarHBondContact O-ND2 3.02Å; R140-N144 PolarHBondContact O-OD1 3.3Å
141	G	73.6	Confident	63.9	Low	37 Å²	37	73.9 Å²	73.9	38%	0.381	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-49.3	175.4	0	0	0	0	0	111.9	A137 G138 L139 N144 W145	A137-G141 VanDerWaalsContact O-CA 3.26Å; A137-G141 WeakPolarHBondContact O-CA 3.5Å; A137-G141 PolarHBondContact O-N 2.65Å; G138-G141 PolarHBondContact O-N 3.37Å; L139-G141 VanDerWaalsContact C-N 3.27Å; L139-G141 PolarHBondContact O-N 2.95Å; G141-N144 PolarHBondContact O-N 2.58Å; G141-W145 VanDerWaalsContact O-CB 3.25Å; G141-W145 WeakPolarHBondContact O-CB 3.29Å; G141-W145 PolarHBondContact O-N 2.54Å
142	I	77.2	Confident	66.4	Low	18 Å²	18	69.9 Å²	69.9	9%	0.092	33%	0.33	C	S	.	.	H	α-helix	trans	-62.1	-49.2	176.6	-67.5	168.4	0	0	0	110.4	V106 L109 L110 A113 G138 L139 N144 W145 I146	V106-I142 HydrophobicContact CG1-CG2 4.16Å; L109-I142 HydrophobicContact CB-CG2 3.81Å; L109-I142 HydrophobicContact CD1-CG2 4.18Å; L110-I142 HydrophobicContact CB-CD1 4.15Å; L110-I142 HydrophobicContact CD1-CD1 3.94Å; A113-I142 HydrophobicContact CB-CD1 3.97Å; G138-I142 VanDerWaalsContact O-CG1 3.32Å; G138-I142 WeakPolarHBondContact O-CG1 3.48Å; G138-I142 PolarHBondContact O-N 3.49Å; L139-I142 PolarHBondContact O-N 2.93Å; I142-N144 PolarHBondContact O-N 3.32Å; I142-W145 PolarHBondContact O-N 3Å; I142-I146 HydrophobicContact CG2-CD1 3.79Å; I142-I146 HydrophobicContact CG2-CG1 4.38Å; I142-I146 WeakPolarHBondContact O-CG1 3.43Å; I142-I146 PolarHBondContact O-N 3.06Å
143	Q	78	Confident	68.8	Low	36 Å²	36	67.4 Å²	67.4	17%	0.168	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-47.4	178.3	-173.5	65.5	46.7	0	0	111.8	Y102 L139 W145 I146 N147	Y102-Q143 HydrophobicContact CD1-CB 4.46Å; Y102-Q143 HydrophobicContact CD1-CG 4.35Å; L139-Q143 WeakPolarHBondContact O-CB 3.2Å; L139-Q143 PolarHBondContact O-N 3.41Å; Q143-W145 VanDerWaalsContact C-N 3.28Å; Q143-W145 PolarHBondContact O-N 3.13Å; Q143-I146 PolarHBondContact O-N 3.26Å; Q143-N147 PolarHBondContact NE2-OD1 3.38Å; Q143-N147 VanDerWaalsContact O-CB 3.28Å; Q143-N147 WeakPolarHBondContact O-CB 3.34Å; Q143-N147 PolarHBondContact O-N 3.03Å
144	N	80.9	Confident	71.4	Confident	86 Å²	86	58.7 Å²	58.7	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-62.4	-38.5	178.7	-74.2	-11.7	0	0	0	111.6	R140 G141 I142 R148	R140-N144 WeakPolarHBondContact O-CB 3.48Å; R140-N144 PolarHBondContact O-N 3.41Å; R140-N144 PolarHBondContact O-ND2 3.02Å; R140-N144 PolarHBondContact O-OD1 3.3Å; G141-N144 PolarHBondContact O-N 2.58Å; I142-N144 PolarHBondContact O-N 3.32Å; N144-R148 WeakPolarHBondContact O-CB 3.32Å; N144-R148 PolarHBondContact O-N 2.9Å
145	W	82.1	Confident	73.7	Confident	86 Å²	86	53.6 Å²	53.6	33%	0.326	27%	0.27	S	S	.	.	H	α-helix	trans	-66.8	-48	178	179	80.2	0	0	0	111.3	L109 G141 I142 Q143 R148 V149 M213	L109-W145 HydrophobicContact CD1-CZ3 4.21Å; G141-W145 VanDerWaalsContact O-CB 3.25Å; G141-W145 WeakPolarHBondContact O-CB 3.29Å; G141-W145 PolarHBondContact O-N 2.54Å; I142-W145 PolarHBondContact O-N 3Å; Q143-W145 VanDerWaalsContact C-N 3.28Å; Q143-W145 PolarHBondContact O-N 3.13Å; W145-R148 WeakPolarHBondContact O-CB 3.25Å; W145-R148 PolarHBondContact O-N 2.97Å; W145-V149 HydrophobicContact CD2-CG2 4.46Å; W145-V149 HydrophobicContact CZ2-CG2 4.25Å; W145-V149 WeakPolarHBondContact O-CG2 3.46Å; W145-V149 PolarHBondContact O-N 3.3Å; W145-M213 HydrophobicContact CH2-CE 3.47Å; W145-M213 VanDerWaalsContact CH2-CE 3.47Å; W145-M213 HydrophobicContact CH2-CG 4.06Å; W145-M213 HydrophobicContact CH2-SD 3.39Å; W145-M213 WeakPolarHBondContact CH2-SD 3.25Å; W145-M213 HydrophobicContact CZ2-SD 4.13Å; W145-M213 HydrophobicContact CZ3-CE 3.45Å; W145-M213 VanDerWaalsContact CZ3-CE 3.45Å; W145-M213 HydrophobicContact CZ3-SD 4.05Å
146	I	82.6	Confident	75.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-50.2	175.3	-69.4	173.4	0	0	0	111	V106 L109 I142 Q143 R148 V149 Y150	V106-I146 HydrophobicContact CB-CD1 4.47Å; V106-I146 HydrophobicContact CG2-CD1 3.64Å; L109-I146 HydrophobicContact CD1-CD1 3.37Å; L109-I146 HydrophobicContact CD1-CG1 3.77Å; I142-I146 HydrophobicContact CG2-CD1 3.79Å; I142-I146 HydrophobicContact CG2-CG1 4.38Å; I142-I146 WeakPolarHBondContact O-CG1 3.43Å; I142-I146 PolarHBondContact O-N 3.06Å; Q143-I146 PolarHBondContact O-N 3.26Å; I146-R148 PolarHBondContact O-N 3.31Å; I146-V149 WeakPolarHBondContact O-CB 3.25Å; I146-V149 PolarHBondContact O-N 3.45Å; I146-Y150 HydrophobicContact CG2-CD2 3.76Å; I146-Y150 HydrophobicContact CG2-CE2 3.12Å; I146-Y150 WeakPolarHBondContact O-CD2 3.25Å; I146-Y150 PolarHBondContact O-N 3.12Å
147	N	82.5	Confident	77.6	Confident	77 Å²	77	51.5 Å²	51.5	41%	0.412	27%	0.266	S	S	.	.	H	α-helix	trans	-58.2	-37.1	177.8	-74.2	-5.2	0	0	0	111.7	Q143 Y150 W151	Q143-N147 PolarHBondContact NE2-OD1 3.38Å; Q143-N147 VanDerWaalsContact O-CB 3.28Å; Q143-N147 WeakPolarHBondContact O-CB 3.34Å; Q143-N147 PolarHBondContact O-N 3.03Å; N147-Y150 PolarHBondContact O-N 2.88Å; N147-W151 WeakPolarHBondContact O-CB 3.31Å; N147-W151 PolarHBondContact O-N 3.45Å
148	R	82.8	Confident	79.2	Confident	80 Å²	80	54.5 Å²	54.5	30%	0.302	27%	0.27	S	S	.	.	H	α-helix	trans	-67.7	-41.5	176.2	178.9	172	-73.3	174.3	-8.7	111.7	N144 W145 I146 Y150 W151 I152 F186 V187	N144-R148 WeakPolarHBondContact O-CB 3.32Å; N144-R148 PolarHBondContact O-N 2.9Å; W145-R148 WeakPolarHBondContact O-CB 3.25Å; W145-R148 PolarHBondContact O-N 2.97Å; I146-R148 PolarHBondContact O-N 3.31Å; R148-Y150 VanDerWaalsContact C-N 3.35Å; R148-W151 PolarHBondContact O-N 2.8Å; R148-I152 HydrophobicContact CG-CD1 4.09Å; R148-I152 WeakPolarHBondContact O-CD1 3.38Å; R148-I152 WeakPolarHBondContact O-CG1 3.38Å; R148-I152 PolarHBondContact O-N 3.18Å; R148-F186 HydrophobicContact CG-CE1 4.49Å; R148-V187 PolarHBondContact NH1-O 3.29Å
149	V	83.3	Confident	80.2	Confident	7 Å²	7	56.8 Å²	56.8	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-47.6	173.9	173.8	0	0	0	0	110.1	W145 I146 W151 I152 V153 L209 L210 M213	W145-V149 HydrophobicContact CD2-CG2 4.46Å; W145-V149 HydrophobicContact CZ2-CG2 4.25Å; W145-V149 WeakPolarHBondContact O-CG2 3.46Å; W145-V149 PolarHBondContact O-N 3.3Å; I146-V149 WeakPolarHBondContact O-CB 3.25Å; I146-V149 PolarHBondContact O-N 3.45Å; V149-W151 PolarHBondContact O-N 2.78Å; V149-I152 PolarHBondContact O-N 2.84Å; V149-V153 WeakPolarHBondContact O-CG2 3.47Å; V149-V153 PolarHBondContact O-N 3.23Å; V149-L209 HydrophobicContact CG2-CD2 4.46Å; V149-L210 HydrophobicContact CG1-CD2 3.73Å; V149-M213 HydrophobicContact CG1-SD 4.4Å
150	Y	82.8	Confident	80.8	Confident	56 Å²	56	58.2 Å²	58.2	22%	0.22	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-45.2	176.6	-69.9	-49.9	0	0	0	113.2	I146 N147 R148 I152 V153 A154 H220 L221	I146-Y150 HydrophobicContact CG2-CD2 3.76Å; I146-Y150 HydrophobicContact CG2-CE2 3.12Å; I146-Y150 WeakPolarHBondContact O-CD2 3.25Å; I146-Y150 PolarHBondContact O-N 3.12Å; N147-Y150 PolarHBondContact O-N 2.88Å; R148-Y150 VanDerWaalsContact C-N 3.35Å; Y150-I152 VanDerWaalsContact C-N 3.28Å; Y150-I152 PolarHBondContact O-N 3.39Å; Y150-V153 PolarHBondContact O-N 2.94Å; Y150-A154 VanDerWaalsContact O-CB 3.28Å; Y150-A154 WeakPolarHBondContact O-CB 3.45Å; Y150-A154 PolarHBondContact O-N 3.09Å; Y150-H220 HydrophobicContact CE1-CB 3.84Å; Y150-H220 HydrophobicContact CE2-CB 4.3Å; Y150-H220 AromaticContact CE2-CD2 3.27Å; Y150-H220 WeakPolarHBondContact CE2-CD2 3.33Å; Y150-H220 AromaticContact CE2-CG 3.98Å; Y150-H220 AromaticContact CE2-NE2 3.93Å; Y150-H220 AromaticContact CZ-CD2 3.27Å; Y150-H220 AromaticContact CZ-CG 3.53Å; Y150-H220 WeakPolarHBondContact OH-CB 3.07Å; Y150-H220 PolarHBondContact OH-CD2 3.41Å; Y150-L221 HydrophobicContact CE1-CD2 4.32Å
151	W	83	Confident	81.4	Confident	136 Å²	136	56.5 Å²	56.5	52%	0.515	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-41.8	179.9	177.7	73.4	0	0	0	111.4	N147 R148 V149 T155 F186 L193	N147-W151 WeakPolarHBondContact O-CB 3.31Å; N147-W151 PolarHBondContact O-N 3.45Å; R148-W151 PolarHBondContact O-N 2.8Å; V149-W151 PolarHBondContact O-N 2.78Å; W151-T155 WeakPolarHBondContact O-CB 3.33Å; W151-T155 PolarHBondContact O-N 2.96Å; W151-T155 PolarHBondContact O-OG1 3.47Å; W151-F186 HydrophobicContact CE3-CE1 4.33Å; W151-F186 HydrophobicContact CE3-CZ 4.4Å; W151-F186 HydrophobicContact CH2-CZ 4.4Å; W151-F186 AromaticContact CZ3-CE1 3.86Å; W151-F186 HydrophobicContact CZ3-CE1 3.86Å; W151-F186 AromaticContact CZ3-CZ 3.6Å; W151-F186 HydrophobicContact CZ3-CZ 3.6Å; W151-L193 HydrophobicContact CH2-CD1 4.48Å; W151-L193 HydrophobicContact CH2-CD2 3.58Å; W151-L193 HydrophobicContact CH2-CG 4.49Å; W151-L193 HydrophobicContact CZ2-CD2 3.69Å; W151-L193 HydrophobicContact CZ3-CD1 4.37Å; W151-L193 HydrophobicContact CZ3-CD2 4.22Å
152	I	82.9	Confident	81.8	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.062	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-50.3	174.6	-64.8	160.5	0	0	0	111	R148 V149 Y150 T155 I156 F186 F202 L206	R148-I152 HydrophobicContact CG-CD1 4.09Å; R148-I152 WeakPolarHBondContact O-CD1 3.38Å; R148-I152 WeakPolarHBondContact O-CG1 3.38Å; R148-I152 PolarHBondContact O-N 3.18Å; V149-I152 PolarHBondContact O-N 2.84Å; Y150-I152 VanDerWaalsContact C-N 3.28Å; Y150-I152 PolarHBondContact O-N 3.39Å; I152-T155 PolarHBondContact O-N 3.07Å; I152-I156 HydrophobicContact CG2-CD1 3.7Å; I152-I156 HydrophobicContact CG2-CG1 4.44Å; I152-I156 VanDerWaalsContact O-CG1 3.29Å; I152-I156 WeakPolarHBondContact O-CG1 3.37Å; I152-I156 PolarHBondContact O-N 3.39Å; I152-F186 HydrophobicContact CD1-CD1 3.26Å; I152-F186 HydrophobicContact CD1-CE1 3.32Å; I152-F186 HydrophobicContact CD1-CG 4.24Å; I152-F186 HydrophobicContact CD1-CZ 4.32Å; I152-F186 HydrophobicContact CG1-CD1 3.76Å; I152-F186 HydrophobicContact CG1-CE1 3.24Å; I152-F186 HydrophobicContact CG1-CZ 3.88Å; I152-F202 HydrophobicContact CG2-CE1 3.99Å; I152-F202 HydrophobicContact CG2-CZ 4.28Å; I152-L206 HydrophobicContact CG2-CD2 3.86Å
153	V	84.2	Confident	81.6	Confident	38 Å²	38	63.1 Å²	63.1	23%	0.23	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-49.7	-179.4	173.8	0	0	0	0	110.5	V149 Y150 T155 I156 V157 L206 L210	V149-V153 WeakPolarHBondContact O-CG2 3.47Å; V149-V153 PolarHBondContact O-N 3.23Å; Y150-V153 PolarHBondContact O-N 2.94Å; V153-T155 PolarHBondContact O-N 2.83Å; V153-I156 PolarHBondContact O-N 3.3Å; V153-V157 HydrophobicContact CG1-CG2 4.36Å; V153-V157 WeakPolarHBondContact O-CB 3.39Å; V153-V157 VanDerWaalsContact O-CG2 3.27Å; V153-V157 WeakPolarHBondContact O-CG2 3.23Å; V153-V157 PolarHBondContact O-N 2.91Å; V153-L206 HydrophobicContact CG2-CD1 4.15Å; V153-L206 HydrophobicContact CG2-CD2 3.82Å; V153-L206 HydrophobicContact CG2-CG 4.16Å; V153-L210 HydrophobicContact CG2-CD1 3.89Å; V153-L210 HydrophobicContact CG2-CD2 4.04Å; V153-L210 HydrophobicContact CG2-CG 4.49Å
154	A	84.7	Confident	81.1	Confident	43 Å²	43	64.7 Å²	64.7	36%	0.355	35%	0.347	S	S	.	.	H	α-helix	trans	-57.9	-47.8	179.7	0	0	0	0	0	111	Y150 I156 V157 E158	Y150-A154 VanDerWaalsContact O-CB 3.28Å; Y150-A154 WeakPolarHBondContact O-CB 3.45Å; Y150-A154 PolarHBondContact O-N 3.09Å; A154-I156 PolarHBondContact O-N 3.44Å; A154-V157 PolarHBondContact O-N 3.09Å; A154-E158 WeakPolarHBondContact O-CG 3.29Å; A154-E158 PolarHBondContact O-N 3.42Å
155	T	81.8	Confident	80.3	Confident	19 Å²	19	63 Å²	63	12%	0.117	34%	0.342	C	S	.	.	H	α-helix	trans	-68.8	-36.5	-179.7	-52	0	0	0	0	113.1	W151 I152 V153 V157 E158 Q159 L193	W151-T155 WeakPolarHBondContact O-CB 3.33Å; W151-T155 PolarHBondContact O-N 2.96Å; W151-T155 PolarHBondContact O-OG1 3.47Å; I152-T155 PolarHBondContact O-N 3.07Å; V153-T155 PolarHBondContact O-N 2.83Å; T155-V157 VanDerWaalsContact C-N 3.34Å; T155-E158 PolarHBondContact O-N 3.41Å; T155-Q159 HydrophobicContact CG2-CG 4.43Å; T155-Q159 WeakPolarHBondContact O-CB 3.43Å; T155-Q159 VanDerWaalsContact O-CG 3.3Å; T155-Q159 WeakPolarHBondContact O-CG 3.49Å; T155-Q159 PolarHBondContact O-N 3.38Å; T155-L193 HydrophobicContact CG2-CD2 3.17Å; T155-L193 HydrophobicContact CG2-CG 4Å
156	I	81.1	Confident	79	Confident	9 Å²	9	64.3 Å²	64.3	5%	0.046	36%	0.363	C	S	.	.	H	α-helix	trans	-62.5	-44.7	173.4	-69.9	170.6	0	0	0	109.9	I152 V153 A154 Q159 R160 A197 F202 L206	I152-I156 HydrophobicContact CG2-CD1 3.7Å; I152-I156 HydrophobicContact CG2-CG1 4.44Å; I152-I156 VanDerWaalsContact O-CG1 3.29Å; I152-I156 WeakPolarHBondContact O-CG1 3.37Å; I152-I156 PolarHBondContact O-N 3.39Å; V153-I156 PolarHBondContact O-N 3.3Å; A154-I156 PolarHBondContact O-N 3.44Å; I156-Q159 PolarHBondContact O-N 3.31Å; I156-R160 HydrophobicContact CG2-CG 4.37Å; I156-R160 VanDerWaalsContact O-CG 3.25Å; I156-R160 WeakPolarHBondContact O-CG 3.32Å; I156-R160 PolarHBondContact O-N 3.04Å; I156-A197 HydrophobicContact CG1-CB 4.03Å; I156-F202 HydrophobicContact CD1-CD1 4.32Å; I156-F202 HydrophobicContact CD1-CE1 4.07Å; I156-L206 HydrophobicContact CD1-CD2 3.69Å
157	V	83.8	Confident	78	Confident	74 Å²	74	71.8 Å²	71.8	45%	0.448	40%	0.398	S	S	.	.	H	α-helix	trans	-61.2	-47.1	177.6	170.7	0	0	0	0	111.1	V153 A154 T155 Q159 R160 L161	V153-V157 HydrophobicContact CG1-CG2 4.36Å; V153-V157 WeakPolarHBondContact O-CB 3.39Å; V153-V157 VanDerWaalsContact O-CG2 3.27Å; V153-V157 WeakPolarHBondContact O-CG2 3.23Å; V153-V157 PolarHBondContact O-N 2.91Å; A154-V157 PolarHBondContact O-N 3.09Å; T155-V157 VanDerWaalsContact C-N 3.34Å; V157-Q159 VanDerWaalsContact C-N 3.32Å; V157-Q159 PolarHBondContact O-N 3.24Å; V157-R160 PolarHBondContact O-N 2.88Å; V157-L161 HydrophobicContact CG1-CD1 3.9Å; V157-L161 HydrophobicContact CG1-CG 4.34Å; V157-L161 VanDerWaalsContact O-CG 3.3Å; V157-L161 WeakPolarHBondContact O-CG 3.3Å; V157-L161 PolarHBondContact O-N 3.48Å
158	E	83.5	Confident	76.8	Confident	123 Å²	123	69.1 Å²	69.1	58%	0.575	39%	0.389	S	S	*	.	H	α-helix	trans	-58.8	-41.5	175.9	-74.2	169.9	-177.7	0	0	112.3	A154 T155 L161 S162	A154-E158 WeakPolarHBondContact O-CG 3.29Å; A154-E158 PolarHBondContact O-N 3.42Å; T155-E158 PolarHBondContact O-N 3.41Å; E158-L161 PolarHBondContact O-N 3.24Å; E158-S162 WeakPolarHBondContact O-CB 3.3Å; E158-S162 PolarHBondContact O-N 2.93Å; E158-S162 PolarHBondContact O-OG 3.35Å
159	Q	79.3	Confident	75.9	Confident	62 Å²	62	72.2 Å²	72.2	29%	0.29	40%	0.404	S	S	.	.	H	α-helix	trans	-66.1	-39.3	176	-74.5	-178.1	3.7	0	0	112.2	T155 I156 V157 S162 V163	T155-Q159 HydrophobicContact CG2-CG 4.43Å; T155-Q159 WeakPolarHBondContact O-CB 3.43Å; T155-Q159 VanDerWaalsContact O-CG 3.3Å; T155-Q159 WeakPolarHBondContact O-CG 3.49Å; T155-Q159 PolarHBondContact O-N 3.38Å; I156-Q159 PolarHBondContact O-N 3.31Å; V157-Q159 VanDerWaalsContact C-N 3.32Å; V157-Q159 PolarHBondContact O-N 3.24Å; Q159-S162 WeakPolarHBondContact CA-OG 3.43Å; Q159-S162 PolarHBondContact O-N 3.17Å; Q159-S162 PolarHBondContact O-OG 3.38Å; Q159-V163 WeakPolarHBondContact O-CG2 3.27Å; Q159-V163 PolarHBondContact O-N 3.05Å; Q159-V163 VanDerWaalsContact O-N 3.09Å
160	R	76.9	Confident	75	Confident	48 Å²	48	78.3 Å²	78.3	18%	0.181	44%	0.442	C	S	.	.	H	α-helix	trans	-65.6	-42.7	175.9	-69.1	-73.5	-177.3	-138.6	-5.5	111.9	I156 V157 S162 G164 S165 E167 G168 A197 E203	I156-R160 HydrophobicContact CG2-CG 4.37Å; I156-R160 VanDerWaalsContact O-CG 3.25Å; I156-R160 WeakPolarHBondContact O-CG 3.32Å; I156-R160 PolarHBondContact O-N 3.04Å; V157-R160 PolarHBondContact O-N 2.88Å; R160-S162 VanDerWaalsContact C-N 3.33Å; R160-S162 PolarHBondContact O-N 3.34Å; R160-G164 PolarHBondContact O-N 3.19Å; R160-S165 VanDerWaalsContact CD-O 3.32Å; R160-S165 WeakPolarHBondContact CD-O 3.48Å; R160-E167 PolarHBondContact NH1-O 2.99Å; R160-G168 VanDerWaalsContact NH1-CA 3.33Å; R160-G168 VanDerWaalsContact NH1-N 3.18Å; R160-A197 PolarHBondContact NH2-O 3.41Å; R160-E203 IonicContact CZ-OE2 3.49Å; R160-E203 IonicContact NE-OE2 3.38Å; R160-E203 PolarHBondContact NE-OE2 3.01Å; R160-E203 IonicContact NH2-OE2 2.78Å; R160-E203 PolarHBondContact NH2-OE2 3.46Å
161	L	83.2	Confident	74.3	Confident	140 Å²	140	77 Å²	77	73%	0.733	44%	0.439	S	S	*	.	H	α-helix	trans	-64.8	-37.1	177.6	-69.4	173.5	0	0	0	112	V157 E158	V157-L161 HydrophobicContact CG1-CD1 3.9Å; V157-L161 HydrophobicContact CG1-CG 4.34Å; V157-L161 VanDerWaalsContact O-CG 3.3Å; V157-L161 WeakPolarHBondContact O-CG 3.3Å; V157-L161 PolarHBondContact O-N 3.48Å; E158-L161 PolarHBondContact O-N 3.24Å
162	S	80.7	Confident	74.1	Confident	94 Å²	94	74.7 Å²	74.7	66%	0.657	44%	0.437	S	S	*	.	H	α-helix	trans	-75.5	-33.1	178.9	56.5	0	0	0	0	114.4	E158 Q159 R160	E158-S162 WeakPolarHBondContact O-CB 3.3Å; E158-S162 PolarHBondContact O-N 2.93Å; E158-S162 PolarHBondContact O-OG 3.35Å; Q159-S162 WeakPolarHBondContact CA-OG 3.43Å; Q159-S162 PolarHBondContact O-N 3.17Å; Q159-S162 PolarHBondContact O-OG 3.38Å; R160-S162 VanDerWaalsContact C-N 3.33Å; R160-S162 PolarHBondContact O-N 3.34Å
163	V	74.2	Confident	73.9	Confident	99 Å²	99	77.6 Å²	77.6	60%	0.6	46%	0.463	S	S	*	.	H	α-helix	trans	-83.8	-16.6	-179.3	178.5	0	0	0	0	112.2	Q159 S165	Q159-V163 WeakPolarHBondContact O-CG2 3.27Å; Q159-V163 PolarHBondContact O-N 3.05Å; Q159-V163 VanDerWaalsContact O-N 3.09Å; V163-S165 PolarHBondContact O-N 3.49Å
164	G	67.2	Low	73.7	Confident	69 Å²	69	81 Å²	81	71%	0.711	48%	0.484	S	S	*	.			trans	65.7	3.9	-176.2	0	0	0	0	0	114.1	R160	R160-G164 PolarHBondContact O-N 3.19Å
165	S	63	Low	73.3	Confident	51 Å²	51	80.9 Å²	80.9	36%	0.357	48%	0.479	S	S	.	.			trans	-106.2	120.5	174.9	-178.8	0	0	0	0	109.6	R160 V163 E167	R160-S165 VanDerWaalsContact CD-O 3.32Å; R160-S165 WeakPolarHBondContact CD-O 3.48Å; V163-S165 PolarHBondContact O-N 3.49Å; S165-E167 PolarHBondContact O-N 3.38Å; S165-E167 PolarHBondContact OG-N 2.89Å; S165-E167 PolarHBondContact OG-O 2.78Å
166	C	56.2	Low	73	Confident	113 Å²	113	80.4 Å²	80.4	76%	0.764	48%	0.476	S	S	*	.			trans	-73.8	-9.1	174.3	-62.6	0	0	0	0	113.1
167	E	60	Low	72.7	Confident	157 Å²	157	83.5 Å²	83.5	73%	0.734	49%	0.492	S	S	*	.	S	Bend	trans	-111.9	137.1	-174	-64.7	-174.8	169.8	0	0	112.2	R160 S165	R160-E167 PolarHBondContact NH1-O 2.99Å; S165-E167 PolarHBondContact O-N 3.38Å; S165-E167 PolarHBondContact OG-N 2.89Å; S165-E167 PolarHBondContact OG-O 2.78Å
168	G	58.1	Low	72.2	Confident	22 Å²	22	83.4 Å²	83.4	23%	0.227	50%	0.495	C	S	.	.			trans	-57	138.4	172.7	0	0	0	0	0	111	R160 E198	R160-G168 VanDerWaalsContact NH1-CA 3.33Å; R160-G168 VanDerWaalsContact NH1-N 3.18Å; G168-E198 CarbonylContact C-O 3.59Å; G168-E198 VanDerWaalsContact CA-O 3.29Å; G168-E198 WeakPolarHBondContact CA-O 3.29Å
169	K	64	Low	71.7	Confident	144 Å²	144	78.7 Å²	78.7	63%	0.626	47%	0.473	S	S	*	.			trans	-69.4	133.2	166	-70.3	-177.1	179.4	178.9	0	107.1	T171 E198	K169-T171 PolarHBondContact O-N 3.19Å; K169-E198 HydrophobicContact CB-CG 4.49Å; K169-E198 CarbonylContact O-C 3.56Å
170	T	64.2	Low	71.3	Confident	136 Å²	136	81.1 Å²	81.1	83%	0.834	48%	0.483	S	S	*	.			trans	-54.7	109.9	176.3	51.3	0	0	0	0	109.9
171	T	69.2	Low	70.7	Confident	27 Å²	27	84.8 Å²	84.8	17%	0.166	50%	0.502	C	S	.	.			trans	-66.7	149.3	165.9	31.8	0	0	0	0	109	K169 T175 E176 E198	K169-T171 PolarHBondContact O-N 3.19Å; T171-T175 HydrophobicContact CG2-CG2 4.47Å; T171-E176 WeakPolarHBondContact CB-OE1 3.28Å; T171-E176 VanDerWaalsContact OG1-CD 3.3Å; T171-E176 WeakPolarHBondContact OG1-CG 3.37Å; T171-E176 PolarHBondContact OG1-OE1 2.75Å; T171-E198 HydrophobicContact CG2-CB 4.04Å
172	D	78	Confident	69.8	Low	88 Å²	88	78.7 Å²	78.7	47%	0.471	47%	0.472	S	S	.	.			trans	-67.3	149.1	176	65	-69.4	0	0	0	110.6	T174 T175 E176	D172-T174 PolarHBondContact O-N 3.26Å; D172-T174 VanDerWaalsContact O-N 3.1Å; D172-T174 WeakPolarHBondContact OD2-CB 3.37Å; D172-T174 PolarHBondContact OD2-N 2.87Å; D172-T175 VanDerWaalsContact CG-OG1 3.27Å; D172-T175 PolarHBondContact O-N 3.48Å; D172-T175 WeakPolarHBondContact OD1-CB 3.49Å; D172-T175 PolarHBondContact OD1-OG1 3.12Å; D172-T175 PolarHBondContact OD2-N 2.77Å; D172-T175 PolarHBondContact OD2-OG1 2.6Å; D172-E176 PolarHBondContact O-N 2.93Å
173	A	78.9	Confident	68.7	Low	74 Å²	74	84.8 Å²	84.8	61%	0.612	48%	0.481	S	S	*	.	H	α-helix	trans	-56.9	-31.5	-175.2	0	0	0	0	0	113.1	E176 D177	A173-E176 PolarHBondContact O-N 3.26Å; A173-D177 WeakPolarHBondContact O-CB 3.34Å; A173-D177 PolarHBondContact O-N 3.37Å
174	T	79.8	Confident	68.1	Low	109 Å²	109	85.3 Å²	85.3	67%	0.669	48%	0.48	S	S	*	.	H	α-helix	trans	-70.4	-43.1	178	-52.4	0	0	0	0	111.8	D172 E176 D177 S178	D172-T174 PolarHBondContact O-N 3.26Å; D172-T174 VanDerWaalsContact O-N 3.1Å; D172-T174 WeakPolarHBondContact OD2-CB 3.37Å; D172-T174 PolarHBondContact OD2-N 2.87Å; T174-E176 VanDerWaalsContact C-N 3.34Å; T174-D177 PolarHBondContact O-N 2.82Å; T174-S178 WeakPolarHBondContact O-CB 3.33Å; T174-S178 PolarHBondContact O-N 3.35Å
175	T	76.5	Confident	67.4	Low	40 Å²	40	85.3 Å²	85.3	25%	0.245	46%	0.459	C	S	.	.	H	α-helix	trans	-61.6	-43.5	172	-64.4	0	0	0	0	111.2	T171 D172 D177 S178 L179 T195	T171-T175 HydrophobicContact CG2-CG2 4.47Å; D172-T175 VanDerWaalsContact CG-OG1 3.27Å; D172-T175 PolarHBondContact O-N 3.48Å; D172-T175 WeakPolarHBondContact OD1-CB 3.49Å; D172-T175 PolarHBondContact OD1-OG1 3.12Å; D172-T175 PolarHBondContact OD2-N 2.77Å; D172-T175 PolarHBondContact OD2-OG1 2.6Å; T175-D177 PolarHBondContact O-N 3.13Å; T175-S178 WeakPolarHBondContact O-CB 3.2Å; T175-S178 PolarHBondContact O-N 2.95Å; T175-L179 HydrophobicContact CG2-CD1 4.11Å; T175-L179 HydrophobicContact CG2-CG 4.34Å; T175-L179 VanDerWaalsContact O-CG 3.32Å; T175-L179 WeakPolarHBondContact O-CG 2.74Å; T175-L179 PolarHBondContact O-N 3.26Å; T175-T195 HydrophobicContact CG2-CG2 3.5Å
176	E	76.1	Confident	67	Low	9 Å²	9	84.3 Å²	84.3	4%	0.042	45%	0.449	C	S	.	.	H	α-helix	trans	-60.9	-45.5	176.4	-81.6	-54.3	135	0	0	112.7	T171 D172 A173 T174 S178 L179 K180 S199 E201	T171-E176 WeakPolarHBondContact CB-OE1 3.28Å; T171-E176 VanDerWaalsContact OG1-CD 3.3Å; T171-E176 WeakPolarHBondContact OG1-CG 3.37Å; T171-E176 PolarHBondContact OG1-OE1 2.75Å; D172-E176 PolarHBondContact O-N 2.93Å; A173-E176 PolarHBondContact O-N 3.26Å; T174-E176 VanDerWaalsContact C-N 3.34Å; E176-S178 VanDerWaalsContact C-N 3.28Å; E176-S178 PolarHBondContact O-N 2.91Å; E176-L179 PolarHBondContact O-N 2.89Å; E176-K180 WeakPolarHBondContact O-CB 3.44Å; E176-K180 VanDerWaalsContact O-CG 3.28Å; E176-K180 WeakPolarHBondContact O-CG 3.49Å; E176-K180 PolarHBondContact O-N 2.91Å; E176-S199 VanDerWaalsContact CD-OG 3.31Å; E176-S199 WeakPolarHBondContact OE1-CB 3.2Å; E176-S199 PolarHBondContact OE1-OG 3.28Å; E176-S199 PolarHBondContact OE2-OG 3.46Å; E176-E201 WeakPolarHBondContact OE2-CB 3.47Å
177	D	74.6	Confident	66.8	Low	74 Å²	74	82.4 Å²	82.4	40%	0.396	43%	0.433	S	S	.	.	H	α-helix	trans	-63.7	-37	176.5	-78.9	-15.1	0	0	0	112.1	A173 T174 T175 K180 E181	A173-D177 WeakPolarHBondContact O-CB 3.34Å; A173-D177 PolarHBondContact O-N 3.37Å; T174-D177 PolarHBondContact O-N 2.82Å; T175-D177 PolarHBondContact O-N 3.13Å; D177-K180 PolarHBondContact O-N 2.76Å; D177-K180 IonicContact OD1-NZ 3.61Å; D177-E181 WeakPolarHBondContact O-CG 3.39Å; D177-E181 PolarHBondContact O-N 3.1Å
178	S	72.9	Confident	66.5	Low	72 Å²	72	83.4 Å²	83.4	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-60.8	-50.2	171.6	-165.3	0	0	0	0	110.8	T174 T175 E176 K180 E181 A182	T174-S178 WeakPolarHBondContact O-CB 3.33Å; T174-S178 PolarHBondContact O-N 3.35Å; T175-S178 WeakPolarHBondContact O-CB 3.2Å; T175-S178 PolarHBondContact O-N 2.95Å; E176-S178 VanDerWaalsContact C-N 3.28Å; E176-S178 PolarHBondContact O-N 2.91Å; S178-K180 VanDerWaalsContact C-N 3.34Å; S178-K180 PolarHBondContact O-N 3.01Å; S178-E181 PolarHBondContact O-N 2.93Å; S178-A182 WeakPolarHBondContact O-CA 3.38Å; S178-A182 WeakPolarHBondContact O-CB 3.45Å; S178-A182 PolarHBondContact O-N 3.24Å
179	L	72.5	Confident	66.8	Low	24 Å²	24	90 Å²	90	13%	0.126	46%	0.455	C	S	.	.	H	α-helix	trans	-60.5	-40.2	178.6	-70.3	175.1	0	0	0	112.3	T175 E176 A182 R183 C191 T195	T175-L179 HydrophobicContact CG2-CD1 4.11Å; T175-L179 HydrophobicContact CG2-CG 4.34Å; T175-L179 VanDerWaalsContact O-CG 3.32Å; T175-L179 WeakPolarHBondContact O-CG 2.74Å; T175-L179 PolarHBondContact O-N 3.26Å; E176-L179 PolarHBondContact O-N 2.89Å; L179-A182 CarbonylContact O-C 3.49Å; L179-A182 WeakPolarHBondContact O-CA 3.35Å; L179-A182 PolarHBondContact O-N 2.77Å; L179-R183 PolarHBondContact O-N 2.95Å; L179-C191 HydrophobicContact CD2-CB 4.18Å; L179-T195 HydrophobicContact CD1-CG2 4.45Å
180	K	70.4	Confident	66.7	Low	114 Å²	114	89.9 Å²	89.9	50%	0.496	46%	0.455	S	S	.	.	H	α-helix	trans	-62.4	-49.2	176	-75.2	172.4	-170.3	167.5	0	112.2	E176 D177 S178 A182	E176-K180 WeakPolarHBondContact O-CB 3.44Å; E176-K180 VanDerWaalsContact O-CG 3.28Å; E176-K180 WeakPolarHBondContact O-CG 3.49Å; E176-K180 PolarHBondContact O-N 2.91Å; D177-K180 PolarHBondContact O-N 2.76Å; D177-K180 IonicContact OD1-NZ 3.61Å; S178-K180 VanDerWaalsContact C-N 3.34Å; S178-K180 PolarHBondContact O-N 3.01Å; K180-A182 PolarHBondContact O-N 2.93Å
181	E	65.9	Low	66.7	Low	125 Å²	125	85 Å²	85	58%	0.584	43%	0.426	S	S	*	.	H	α-helix	trans	-60.1	-30.7	172.1	-73.2	-154.8	148.1	0	0	111.3	D177 S178 R183 R252	D177-E181 WeakPolarHBondContact O-CG 3.39Å; D177-E181 PolarHBondContact O-N 3.1Å; S178-E181 PolarHBondContact O-N 2.93Å; E181-R183 VanDerWaalsContact C-N 3.3Å; E181-R183 PolarHBondContact O-N 3.04Å; E181-R252 VanDerWaalsContact CD-NH2 3.31Å; E181-R252 IonicContact OE1-CZ 3.86Å; E181-R252 IonicContact OE1-NH2 2.67Å; E181-R252 PolarHBondContact OE1-NH2 2.84Å
182	A	63.6	Low	67	Low	12 Å²	12	87.9 Å²	87.9	10%	0.099	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	29.2	-170.8	0	0	0	0	0	114.6	S178 L179 K180 N184 Y185	S178-A182 WeakPolarHBondContact O-CA 3.38Å; S178-A182 WeakPolarHBondContact O-CB 3.45Å; S178-A182 PolarHBondContact O-N 3.24Å; L179-A182 CarbonylContact O-C 3.49Å; L179-A182 WeakPolarHBondContact O-CA 3.35Å; L179-A182 PolarHBondContact O-N 2.77Å; K180-A182 PolarHBondContact O-N 2.93Å; A182-N184 PolarHBondContact O-N 3.09Å; A182-Y185 VanDerWaalsContact CA-CD2 3.44Å; A182-Y185 HydrophobicContact CB-CD2 3.32Å; A182-Y185 HydrophobicContact CB-CE2 4.15Å; A182-Y185 HydrophobicContact CB-CG 3.94Å; A182-Y185 WeakPolarHBondContact O-CB 3.46Å; A182-Y185 PolarHBondContact O-N 3.42Å
183	R	58.5	Low	66.7	Low	221 Å²	221	85 Å²	85	83%	0.834	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-24.2	-175.1	-133.8	-179.7	81.8	-176.1	6.8	116.1	L179 E181	L179-R183 PolarHBondContact O-N 2.95Å; E181-R183 VanDerWaalsContact C-N 3.3Å; E181-R183 PolarHBondContact O-N 3.04Å
184	N	59.8	Low	66.6	Low	111 Å²	111	87.8 Å²	87.8	59%	0.594	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-0	177.2	-69.3	-23.2	0	0	0	114.4	A182 V187 R188	A182-N184 PolarHBondContact O-N 3.09Å; N184-V187 WeakPolarHBondContact O-CB 3.08Å; N184-V187 PolarHBondContact O-N 2.93Å; N184-R188 PolarHBondContact O-N 2.96Å
185	Y	54.4	Low	66.3	Low	69 Å²	69	84.5 Å²	84.5	27%	0.271	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-20.1	-167.9	-93.7	-68.1	0	0	0	115.3	A182 V187 R188 Q189 K190	A182-Y185 VanDerWaalsContact CA-CD2 3.44Å; A182-Y185 HydrophobicContact CB-CD2 3.32Å; A182-Y185 HydrophobicContact CB-CE2 4.15Å; A182-Y185 HydrophobicContact CB-CG 3.94Å; A182-Y185 WeakPolarHBondContact O-CB 3.46Å; A182-Y185 PolarHBondContact O-N 3.42Å; Y185-V187 PolarHBondContact O-N 3.39Å; Y185-R188 HydrophobicContact CD1-CB 3.87Å; Y185-R188 HydrophobicContact CE1-CB 4.5Å; Y185-R188 CarbonylContact O-C 3.52Å; Y185-R188 VanDerWaalsContact O-CA 3.28Å; Y185-R188 WeakPolarHBondContact O-CA 3.37Å; Y185-R188 PolarHBondContact O-N 3Å; Y185-Q189 PolarHBondContact O-N 3.46Å; Y185-K190 HydrophobicContact CD1-CB 3.5Å; Y185-K190 VanDerWaalsContact CD1-CB 3.5Å; Y185-K190 HydrophobicContact CD1-CD 3.27Å; Y185-K190 HydrophobicContact CD1-CG 3.3Å; Y185-K190 HydrophobicContact CE1-CB 4.25Å; Y185-K190 HydrophobicContact CE1-CD 3.08Å; Y185-K190 HydrophobicContact CE1-CG 3.63Å; Y185-K190 HydrophobicContact CG-CB 3.97Å; Y185-K190 HydrophobicContact CG-CD 4.18Å; Y185-K190 HydrophobicContact CG-CG 4.25Å; Y185-K190 VanDerWaalsContact CZ-NZ 3.3Å; Y185-K190 PolarHBondContact O-N 3.47Å; Y185-K190 VanDerWaalsContact O-N 3.11Å; Y185-K190 PolarHBondContact OH-NZ 3.26Å
186	F	52.7	Low	66.2	Low	30 Å²	30	82.7 Å²	82.7	13%	0.132	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-35.8	169.2	-162.3	-88.8	0	0	0	110.7	R148 W151 I152 R188 Q189 L193 V196	R148-F186 HydrophobicContact CG-CE1 4.49Å; W151-F186 HydrophobicContact CE3-CE1 4.33Å; W151-F186 HydrophobicContact CE3-CZ 4.4Å; W151-F186 HydrophobicContact CH2-CZ 4.4Å; W151-F186 AromaticContact CZ3-CE1 3.86Å; W151-F186 HydrophobicContact CZ3-CE1 3.86Å; W151-F186 AromaticContact CZ3-CZ 3.6Å; W151-F186 HydrophobicContact CZ3-CZ 3.6Å; I152-F186 HydrophobicContact CD1-CD1 3.26Å; I152-F186 HydrophobicContact CD1-CE1 3.32Å; I152-F186 HydrophobicContact CD1-CG 4.24Å; I152-F186 HydrophobicContact CD1-CZ 4.32Å; I152-F186 HydrophobicContact CG1-CD1 3.76Å; I152-F186 HydrophobicContact CG1-CE1 3.24Å; I152-F186 HydrophobicContact CG1-CZ 3.88Å; F186-R188 PolarHBondContact O-N 2.92Å; F186-Q189 PolarHBondContact O-N 3.18Å; F186-L193 HydrophobicContact CE2-CD1 4.05Å; F186-L193 HydrophobicContact CZ-CD1 3.74Å; F186-V196 HydrophobicContact CD2-CG2 3.9Å; F186-V196 HydrophobicContact CE2-CG2 4.2Å
187	V	53	Low	66.1	Low	73 Å²	73	82.5 Å²	82.5	44%	0.442	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.9	169.4	-173.2	0	0	0	0	111.3	R148 N184 Y185	R148-V187 PolarHBondContact NH1-O 3.29Å; N184-V187 WeakPolarHBondContact O-CB 3.08Å; N184-V187 PolarHBondContact O-N 2.93Å; Y185-V187 PolarHBondContact O-N 3.39Å
188	R	54.6	Low	66.2	Low	178 Å²	178	81.9 Å²	81.9	67%	0.672	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	13.1	177	-58.9	-178.1	170.9	-168.3	-3.8	115	N184 Y185 F186 K190	N184-R188 PolarHBondContact O-N 2.96Å; Y185-R188 HydrophobicContact CD1-CB 3.87Å; Y185-R188 HydrophobicContact CE1-CB 4.5Å; Y185-R188 CarbonylContact O-C 3.52Å; Y185-R188 VanDerWaalsContact O-CA 3.28Å; Y185-R188 WeakPolarHBondContact O-CA 3.37Å; Y185-R188 PolarHBondContact O-N 3Å; F186-R188 PolarHBondContact O-N 2.92Å; R188-K190 PolarHBondContact O-N 2.87Å
189	Q	62.8	Low	66.5	Low	159 Å²	159	78.4 Å²	78.4	74%	0.743	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	31.2	176	-58.6	178.7	-22.8	0	0	116.8	Y185 F186	Y185-Q189 PolarHBondContact O-N 3.46Å; F186-Q189 PolarHBondContact O-N 3.18Å
190	K	61.6	Low	66.9	Low	142 Å²	142	80 Å²	80	62%	0.617	38%	0.377	S	S	*	.			trans	-91.4	-13.3	179	-77	-154.4	-171.1	166.9	0	116.7	Y185 R188	Y185-K190 HydrophobicContact CD1-CB 3.5Å; Y185-K190 VanDerWaalsContact CD1-CB 3.5Å; Y185-K190 HydrophobicContact CD1-CD 3.27Å; Y185-K190 HydrophobicContact CD1-CG 3.3Å; Y185-K190 HydrophobicContact CE1-CB 4.25Å; Y185-K190 HydrophobicContact CE1-CD 3.08Å; Y185-K190 HydrophobicContact CE1-CG 3.63Å; Y185-K190 HydrophobicContact CG-CB 3.97Å; Y185-K190 HydrophobicContact CG-CD 4.18Å; Y185-K190 HydrophobicContact CG-CG 4.25Å; Y185-K190 VanDerWaalsContact CZ-NZ 3.3Å; Y185-K190 PolarHBondContact O-N 3.47Å; Y185-K190 VanDerWaalsContact O-N 3.11Å; Y185-K190 PolarHBondContact OH-NZ 3.26Å; R188-K190 PolarHBondContact O-N 2.87Å
191	C	65.5	Low	67.3	Low	34 Å²	34	78.2 Å²	78.2	23%	0.23	37%	0.371	C	S	.	.	S	Bend	trans	-121	144.5	-177.2	-58.9	0	0	0	0	110.5	L179 V196	L179-C191 HydrophobicContact CD2-CB 4.18Å; C191-V196 HydrophobicContact CB-CG2 4.08Å
192	T	74.3	Confident	68	Low	88 Å²	88	74.4 Å²	74.4	54%	0.54	35%	0.352	S	S	.	.			trans	-75.3	146.7	174.3	80.1	0	0	0	0	110.3	K194 T195 V196	T192-K194 PolarHBondContact O-N 2.92Å; T192-T195 PolarHBondContact O-N 3.49Å; T192-T195 PolarHBondContact OG1-N 3.29Å; T192-T195 PolarHBondContact OG1-OG1 2.95Å; T192-V196 WeakPolarHBondContact O-CG2 3.43Å; T192-V196 PolarHBondContact O-N 3.44Å
193	L	73.3	Confident	68.8	Low	28 Å²	28	75.3 Å²	75.3	15%	0.147	35%	0.354	C	S	.	.	H	α-helix	trans	-63.6	-28.6	-178.8	-172	65.1	0	0	0	112.9	W151 T155 F186 V196 A197	W151-L193 HydrophobicContact CH2-CD1 4.48Å; W151-L193 HydrophobicContact CH2-CD2 3.58Å; W151-L193 HydrophobicContact CH2-CG 4.49Å; W151-L193 HydrophobicContact CZ2-CD2 3.69Å; W151-L193 HydrophobicContact CZ3-CD1 4.37Å; W151-L193 HydrophobicContact CZ3-CD2 4.22Å; T155-L193 HydrophobicContact CG2-CD2 3.17Å; T155-L193 HydrophobicContact CG2-CG 4Å; F186-L193 HydrophobicContact CE2-CD1 4.05Å; F186-L193 HydrophobicContact CZ-CD1 3.74Å; L193-V196 WeakPolarHBondContact O-CB 3.44Å; L193-V196 PolarHBondContact O-N 3.27Å; L193-A197 PolarHBondContact O-N 3.28Å
194	K	75.1	Confident	70	Confident	131 Å²	131	73 Å²	73	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-64.1	-49.2	175.3	-174.4	-177.7	176.7	-173.8	0	111.5	T192 V196 A197 E198	T192-K194 PolarHBondContact O-N 2.92Å; K194-V196 PolarHBondContact O-N 3.43Å; K194-A197 PolarHBondContact O-N 2.79Å; K194-E198 VanDerWaalsContact CE-OE1 3.25Å; K194-E198 WeakPolarHBondContact CE-OE1 3.36Å; K194-E198 WeakPolarHBondContact O-CG 3.03Å; K194-E198 PolarHBondContact O-N 3.19Å; K194-E198 VanDerWaalsContact O-N 3.12Å
195	T	74.5	Confident	71.1	Confident	41 Å²	41	71.1 Å²	71.1	25%	0.252	34%	0.341	S	S	.	.	H	α-helix	trans	-56.6	-39.4	176.3	-49.4	0	0	0	0	111.3	T175 L179 T192 E198 S199	T175-T195 HydrophobicContact CG2-CG2 3.5Å; L179-T195 HydrophobicContact CD1-CG2 4.45Å; T192-T195 PolarHBondContact O-N 3.49Å; T192-T195 PolarHBondContact OG1-N 3.29Å; T192-T195 PolarHBondContact OG1-OG1 2.95Å; T195-E198 PolarHBondContact O-N 3.06Å; T195-S199 PolarHBondContact O-N 3.2Å
196	V	73.8	Confident	72.6	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-69.6	-38.4	-178.8	169.8	0	0	0	0	112.4	F186 C191 T192 L193 K194 E198 F202	F186-V196 HydrophobicContact CD2-CG2 3.9Å; F186-V196 HydrophobicContact CE2-CG2 4.2Å; C191-V196 HydrophobicContact CB-CG2 4.08Å; T192-V196 WeakPolarHBondContact O-CG2 3.43Å; T192-V196 PolarHBondContact O-N 3.44Å; L193-V196 WeakPolarHBondContact O-CB 3.44Å; L193-V196 PolarHBondContact O-N 3.27Å; K194-V196 PolarHBondContact O-N 3.43Å; V196-E198 VanDerWaalsContact C-N 3.34Å; V196-F202 HydrophobicContact CB-CD1 4.45Å; V196-F202 HydrophobicContact CG1-CD1 3.2Å; V196-F202 HydrophobicContact CG1-CD2 3.83Å; V196-F202 HydrophobicContact CG1-CE1 3.05Å; V196-F202 HydrophobicContact CG1-CE2 3.69Å; V196-F202 HydrophobicContact CG1-CG 3.59Å; V196-F202 HydrophobicContact CG1-CZ 3.31Å
197	A	73.7	Confident	74.2	Confident	6 Å²	6	74.4 Å²	74.4	5%	0.05	35%	0.353	C	S	.	.	H	α-helix	trans	-74.7	-24.3	177.9	0	0	0	0	0	113.5	I156 R160 L193 K194	I156-A197 HydrophobicContact CG1-CB 4.03Å; R160-A197 PolarHBondContact NH2-O 3.41Å; L193-A197 PolarHBondContact O-N 3.28Å; K194-A197 PolarHBondContact O-N 2.79Å
198	E	77.7	Confident	75.9	Confident	60 Å²	60	72.7 Å²	72.7	28%	0.28	34%	0.344	S	S	.	.	H	α-helix	trans	-76.3	-32.8	175.5	-71.3	170.8	169.3	0	0	111.4	G168 K169 T171 K194 T195 V196 P200	G168-E198 CarbonylContact C-O 3.59Å; G168-E198 VanDerWaalsContact CA-O 3.29Å; G168-E198 WeakPolarHBondContact CA-O 3.29Å; K169-E198 HydrophobicContact CB-CG 4.49Å; K169-E198 CarbonylContact O-C 3.56Å; T171-E198 HydrophobicContact CG2-CB 4.04Å; K194-E198 VanDerWaalsContact CE-OE1 3.25Å; K194-E198 WeakPolarHBondContact CE-OE1 3.36Å; K194-E198 WeakPolarHBondContact O-CG 3.03Å; K194-E198 PolarHBondContact O-N 3.19Å; K194-E198 VanDerWaalsContact O-N 3.12Å; T195-E198 PolarHBondContact O-N 3.06Å; V196-E198 VanDerWaalsContact C-N 3.34Å; E198-P200 VanDerWaalsContact O-CD 3.31Å; E198-P200 WeakPolarHBondContact O-CD 3.01Å
199	S	78.9	Confident	77.5	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.326	C	S	.	.			trans	-68.1	113.4	-179.1	174.6	0	0	0	0	114	E176 T195 E201 F202 E203	E176-S199 VanDerWaalsContact CD-OG 3.31Å; E176-S199 WeakPolarHBondContact OE1-CB 3.2Å; E176-S199 PolarHBondContact OE1-OG 3.28Å; E176-S199 PolarHBondContact OE2-OG 3.46Å; T195-S199 PolarHBondContact O-N 3.2Å; S199-E201 VanDerWaalsContact C-N 3.33Å; S199-E201 PolarHBondContact O-N 3.35Å; S199-F202 PolarHBondContact O-N 3.07Å; S199-F202 WeakPolarHBondContact OG-CB 3.26Å; S199-F202 PolarHBondContact OG-N 3.23Å; S199-E203 PolarHBondContact O-N 2.97Å; S199-E203 VanDerWaalsContact O-N 3.13Å
200	P	80.5	Confident	78.6	Confident	56 Å²	56	60.5 Å²	60.5	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-67.9	-31.8	175.1	24.6	-27.7	0	0	0	112.5	E198 E203 R204	E198-P200 VanDerWaalsContact O-CD 3.31Å; E198-P200 WeakPolarHBondContact O-CD 3.01Å; P200-E203 PolarHBondContact O-N 3.19Å; P200-R204 WeakPolarHBondContact O-CB 3.33Å; P200-R204 PolarHBondContact O-N 3.11Å
201	E	79.5	Confident	80	Confident	78 Å²	78	55 Å²	55	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-66	-41.2	175.3	-69.4	79.4	179.4	0	0	111.8	E176 S199 R204 S205	E176-E201 WeakPolarHBondContact OE2-CB 3.47Å; S199-E201 VanDerWaalsContact C-N 3.33Å; S199-E201 PolarHBondContact O-N 3.35Å; E201-R204 PolarHBondContact O-N 3.47Å; E201-S205 WeakPolarHBondContact O-CB 3.28Å; E201-S205 PolarHBondContact O-N 2.69Å; E201-S205 PolarHBondContact O-OG 2.85Å
202	F	79.7	Confident	81.1	Confident	44 Å²	44	57.3 Å²	57.3	19%	0.193	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-45.8	174.6	-175	-84.4	0	0	0	110.7	I152 I156 V196 S199 R204 S205 L206	I152-F202 HydrophobicContact CG2-CE1 3.99Å; I152-F202 HydrophobicContact CG2-CZ 4.28Å; I156-F202 HydrophobicContact CD1-CD1 4.32Å; I156-F202 HydrophobicContact CD1-CE1 4.07Å; V196-F202 HydrophobicContact CB-CD1 4.45Å; V196-F202 HydrophobicContact CG1-CD1 3.2Å; V196-F202 HydrophobicContact CG1-CD2 3.83Å; V196-F202 HydrophobicContact CG1-CE1 3.05Å; V196-F202 HydrophobicContact CG1-CE2 3.69Å; V196-F202 HydrophobicContact CG1-CG 3.59Å; V196-F202 HydrophobicContact CG1-CZ 3.31Å; S199-F202 PolarHBondContact O-N 3.07Å; S199-F202 WeakPolarHBondContact OG-CB 3.26Å; S199-F202 PolarHBondContact OG-N 3.23Å; F202-R204 VanDerWaalsContact C-N 3.32Å; F202-R204 PolarHBondContact O-N 3.12Å; F202-S205 CarbonylContact O-C 3.6Å; F202-S205 WeakPolarHBondContact O-CB 3.33Å; F202-S205 PolarHBondContact O-N 3.38Å; F202-S205 VanDerWaalsContact O-N 3.12Å; F202-L206 HydrophobicContact CD1-CB 4.5Å; F202-L206 HydrophobicContact CE1-CB 4.22Å; F202-L206 HydrophobicContact CE1-CD2 4.19Å; F202-L206 WeakPolarHBondContact O-CB 3.27Å; F202-L206 PolarHBondContact O-N 2.92Å
203	E	80.6	Confident	81.7	Confident	31 Å²	31	53.7 Å²	53.7	15%	0.145	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-44.2	178	-171.5	175.6	156.3	0	0	111.2	R160 S199 P200 S205 L206 R207	R160-E203 IonicContact CZ-OE2 3.49Å; R160-E203 IonicContact NE-OE2 3.38Å; R160-E203 PolarHBondContact NE-OE2 3.01Å; R160-E203 IonicContact NH2-OE2 2.78Å; R160-E203 PolarHBondContact NH2-OE2 3.46Å; S199-E203 PolarHBondContact O-N 2.97Å; S199-E203 VanDerWaalsContact O-N 3.13Å; P200-E203 PolarHBondContact O-N 3.19Å; E203-S205 VanDerWaalsContact C-N 3.33Å; E203-S205 PolarHBondContact O-N 2.84Å; E203-L206 PolarHBondContact O-N 2.74Å; E203-R207 WeakPolarHBondContact O-CG 3.18Å; E203-R207 PolarHBondContact O-N 3.13Å; E203-R207 IonicContact OE1-CZ 3.33Å; E203-R207 IonicContact OE1-NE 3.37Å; E203-R207 PolarHBondContact OE1-NE 3.09Å; E203-R207 IonicContact OE1-NH2 2.65Å; E203-R207 PolarHBondContact OE1-NH2 3.25Å
204	R	83.7	Confident	82.5	Confident	174 Å²	174	53.2 Å²	53.2	66%	0.657	26%	0.257	S	S	*	.	H	α-helix	trans	-60.8	-42.7	174.2	-171.7	175.4	-175.8	164.5	-1.2	111.8	P200 E201 F202 R207 C208	P200-R204 WeakPolarHBondContact O-CB 3.33Å; P200-R204 PolarHBondContact O-N 3.11Å; E201-R204 PolarHBondContact O-N 3.47Å; F202-R204 VanDerWaalsContact C-N 3.32Å; F202-R204 PolarHBondContact O-N 3.12Å; R204-R207 PolarHBondContact O-N 3.28Å; R204-C208 PolarHBondContact O-N 3.25Å; R204-C208 PolarHBondContact O-SG 2.98Å
205	S	84	Confident	83	Confident	71 Å²	71	50 Å²	50	50%	0.497	25%	0.25	S	C	.	.	H	α-helix	trans	-64	-40.9	177.4	-61.1	0	0	0	0	112	E201 F202 E203 C208 L209	E201-S205 WeakPolarHBondContact O-CB 3.28Å; E201-S205 PolarHBondContact O-N 2.69Å; E201-S205 PolarHBondContact O-OG 2.85Å; F202-S205 CarbonylContact O-C 3.6Å; F202-S205 WeakPolarHBondContact O-CB 3.33Å; F202-S205 PolarHBondContact O-N 3.38Å; F202-S205 VanDerWaalsContact O-N 3.12Å; E203-S205 VanDerWaalsContact C-N 3.33Å; E203-S205 PolarHBondContact O-N 2.84Å; S205-C208 PolarHBondContact O-N 3.45Å; S205-L209 WeakPolarHBondContact O-CB 3.36Å; S205-L209 PolarHBondContact O-N 3.14Å
206	L	84.9	Confident	83.5	Confident	16 Å²	16	52.4 Å²	52.4	8%	0.084	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-45.7	175.6	-176.7	61.6	0	0	0	110.8	I152 V153 I156 F202 E203 C208 L209 L210	I152-L206 HydrophobicContact CG2-CD2 3.86Å; V153-L206 HydrophobicContact CG2-CD1 4.15Å; V153-L206 HydrophobicContact CG2-CD2 3.82Å; V153-L206 HydrophobicContact CG2-CG 4.16Å; I156-L206 HydrophobicContact CD1-CD2 3.69Å; F202-L206 HydrophobicContact CD1-CB 4.5Å; F202-L206 HydrophobicContact CE1-CB 4.22Å; F202-L206 HydrophobicContact CE1-CD2 4.19Å; F202-L206 WeakPolarHBondContact O-CB 3.27Å; F202-L206 PolarHBondContact O-N 2.92Å; E203-L206 PolarHBondContact O-N 2.74Å; L206-C208 VanDerWaalsContact C-N 3.34Å; L206-C208 PolarHBondContact O-N 2.83Å; L206-L209 HydrophobicContact CD1-CD2 4.4Å; L206-L209 WeakPolarHBondContact O-CB 3.47Å; L206-L209 PolarHBondContact O-N 3.41Å; L206-L209 VanDerWaalsContact O-N 3.09Å; L206-L210 HydrophobicContact CG-CD1 4.48Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.35Å; L206-L210 PolarHBondContact O-N 3.48Å
207	R	86	Confident	84.1	Confident	151 Å²	151	52.4 Å²	52.4	57%	0.57	26%	0.256	S	S	*	.	H	α-helix	trans	-56.5	-46.8	174	-72.1	174.5	-175.9	-164.9	1.7	111.7	E203 R204 L209 L210 I211	E203-R207 WeakPolarHBondContact O-CG 3.18Å; E203-R207 PolarHBondContact O-N 3.13Å; E203-R207 IonicContact OE1-CZ 3.33Å; E203-R207 IonicContact OE1-NE 3.37Å; E203-R207 PolarHBondContact OE1-NE 3.09Å; E203-R207 IonicContact OE1-NH2 2.65Å; E203-R207 PolarHBondContact OE1-NH2 3.25Å; R204-R207 PolarHBondContact O-N 3.28Å; R207-L209 VanDerWaalsContact C-N 3.33Å; R207-L209 PolarHBondContact O-N 3.25Å; R207-L210 PolarHBondContact O-N 3.21Å; R207-I211 WeakPolarHBondContact O-CG1 3.25Å; R207-I211 PolarHBondContact O-N 2.67Å; R207-I211 VanDerWaalsContact O-N 3.07Å
208	C	88.8	Confident	84.5	Confident	37 Å²	37	52.9 Å²	52.9	25%	0.25	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-42.9	174.6	-69.9	0	0	0	0	111.9	R204 S205 L206 I211 M212 P229	R204-C208 PolarHBondContact O-N 3.25Å; R204-C208 PolarHBondContact O-SG 2.98Å; S205-C208 PolarHBondContact O-N 3.45Å; L206-C208 VanDerWaalsContact C-N 3.34Å; L206-C208 PolarHBondContact O-N 2.83Å; C208-I211 PolarHBondContact O-N 3.43Å; C208-M212 HydrophobicContact CB-CE 4.32Å; C208-M212 WeakPolarHBondContact O-CB 3.46Å; C208-M212 WeakPolarHBondContact O-CE 3.31Å; C208-M212 VanDerWaalsContact O-CG 3.29Å; C208-M212 WeakPolarHBondContact O-CG 3.32Å; C208-M212 PolarHBondContact O-N 2.94Å; C208-P229 HydrophobicContact CB-CB 4.19Å; C208-P229 HydrophobicContact CB-CG 4.5Å
209	L	87.8	Confident	84.6	Confident	57 Å²	57	56.3 Å²	56.3	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-46.6	176.8	177.5	64.4	0	0	0	111.5	V149 S205 L206 R207 I211 M212 M213	V149-L209 HydrophobicContact CG2-CD2 4.46Å; S205-L209 WeakPolarHBondContact O-CB 3.36Å; S205-L209 PolarHBondContact O-N 3.14Å; L206-L209 HydrophobicContact CD1-CD2 4.4Å; L206-L209 WeakPolarHBondContact O-CB 3.47Å; L206-L209 PolarHBondContact O-N 3.41Å; L206-L209 VanDerWaalsContact O-N 3.09Å; R207-L209 VanDerWaalsContact C-N 3.33Å; R207-L209 PolarHBondContact O-N 3.25Å; L209-I211 PolarHBondContact O-N 3.35Å; L209-M212 PolarHBondContact O-N 3.41Å; L209-M213 HydrophobicContact CD1-CG 4.13Å; L209-M213 HydrophobicContact CD1-SD 4.02Å; L209-M213 HydrophobicContact CD2-SD 4.39Å; L209-M213 HydrophobicContact CG-CG 4.38Å; L209-M213 HydrophobicContact CG-SD 3.84Å; L209-M213 WeakPolarHBondContact O-CB 3.32Å; L209-M213 VanDerWaalsContact O-CG 3.23Å; L209-M213 WeakPolarHBondContact O-CG 3.39Å; L209-M213 PolarHBondContact O-N 3.36Å
210	L	87.5	Confident	84.1	Confident	25 Å²	25	59.9 Å²	59.9	13%	0.131	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-44	179.1	-61.7	174.6	0	0	0	111.4	V149 V153 L206 R207 M212 M213 Q214 L221	V149-L210 HydrophobicContact CG1-CD2 3.73Å; V153-L210 HydrophobicContact CG2-CD1 3.89Å; V153-L210 HydrophobicContact CG2-CD2 4.04Å; V153-L210 HydrophobicContact CG2-CG 4.49Å; L206-L210 HydrophobicContact CG-CD1 4.48Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.35Å; L206-L210 PolarHBondContact O-N 3.48Å; R207-L210 PolarHBondContact O-N 3.21Å; L210-M212 PolarHBondContact O-N 2.96Å; L210-M213 PolarHBondContact O-N 3.32Å; L210-Q214 PolarHBondContact O-N 3.48Å; L210-L221 HydrophobicContact CB-CD1 4.12Å; L210-L221 HydrophobicContact CB-CD2 4.31Å; L210-L221 HydrophobicContact CD2-CD1 4.07Å; L210-L221 HydrophobicContact CD2-CD2 3.7Å; L210-L221 HydrophobicContact CG-CD2 4.39Å; L210-L221 VanDerWaalsContact O-CD1 3.25Å; L210-L221 WeakPolarHBondContact O-CD1 3.46Å
211	I	89.8	Confident	83.6	Confident	25 Å²	25	57.9 Å²	57.9	13%	0.128	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-42.9	176.1	-61	164.7	0	0	0	111	R207 C208 L209 M213 Q214 Q226 W228	R207-I211 WeakPolarHBondContact O-CG1 3.25Å; R207-I211 PolarHBondContact O-N 2.67Å; R207-I211 VanDerWaalsContact O-N 3.07Å; C208-I211 PolarHBondContact O-N 3.43Å; L209-I211 PolarHBondContact O-N 3.35Å; I211-M213 VanDerWaalsContact C-N 3.26Å; I211-M213 PolarHBondContact O-N 2.76Å; I211-Q214 WeakPolarHBondContact O-CB 3.34Å; I211-Q214 PolarHBondContact O-N 3.15Å; I211-Q226 HydrophobicContact CD1-CB 4.08Å; I211-Q226 HydrophobicContact CG1-CB 4.15Å; I211-W228 HydrophobicContact CG2-CE3 4.1Å; I211-W228 HydrophobicContact CG2-CZ3 4.49Å
212	M	89.3	Confident	83.1	Confident	84 Å²	84	59.6 Å²	59.6	41%	0.414	30%	0.295	S	S	.	.	H	α-helix	trans	-67.3	-25.8	178.2	-72.3	-173.4	-66	0	0	113.6	C208 L209 L210 Q214 P215 W228 P229	C208-M212 HydrophobicContact CB-CE 4.32Å; C208-M212 WeakPolarHBondContact O-CB 3.46Å; C208-M212 WeakPolarHBondContact O-CE 3.31Å; C208-M212 VanDerWaalsContact O-CG 3.29Å; C208-M212 WeakPolarHBondContact O-CG 3.32Å; C208-M212 PolarHBondContact O-N 2.94Å; L209-M212 PolarHBondContact O-N 3.41Å; L210-M212 PolarHBondContact O-N 2.96Å; M212-Q214 VanDerWaalsContact C-N 3.3Å; M212-P215 WeakPolarHBondContact O-CD 3.42Å; M212-W228 HydrophobicContact CB-CH2 4.17Å; M212-W228 HydrophobicContact CG-CH2 4.02Å; M212-W228 HydrophobicContact CG-CZ2 3.93Å; M212-P229 HydrophobicContact CG-CG 3.81Å; M212-P229 HydrophobicContact SD-CG 4.42Å
213	M	87.5	Confident	83	Confident	12 Å²	12	59 Å²	59	6%	0.059	30%	0.296	C	S	.	.	H	α-helix	trans	-75.9	-18.9	176.1	-79.5	178.6	64.6	0	0	112.7	W145 V149 L209 L210 I211 P215 F216 V217 L221	W145-M213 HydrophobicContact CH2-CE 3.47Å; W145-M213 VanDerWaalsContact CH2-CE 3.47Å; W145-M213 HydrophobicContact CH2-CG 4.06Å; W145-M213 HydrophobicContact CH2-SD 3.39Å; W145-M213 WeakPolarHBondContact CH2-SD 3.25Å; W145-M213 HydrophobicContact CZ2-SD 4.13Å; W145-M213 HydrophobicContact CZ3-CE 3.45Å; W145-M213 VanDerWaalsContact CZ3-CE 3.45Å; W145-M213 HydrophobicContact CZ3-SD 4.05Å; V149-M213 HydrophobicContact CG1-SD 4.4Å; L209-M213 HydrophobicContact CD1-CG 4.13Å; L209-M213 HydrophobicContact CD1-SD 4.02Å; L209-M213 HydrophobicContact CD2-SD 4.39Å; L209-M213 HydrophobicContact CG-CG 4.38Å; L209-M213 HydrophobicContact CG-SD 3.84Å; L209-M213 WeakPolarHBondContact O-CB 3.32Å; L209-M213 VanDerWaalsContact O-CG 3.23Å; L209-M213 WeakPolarHBondContact O-CG 3.39Å; L209-M213 PolarHBondContact O-N 3.36Å; L210-M213 PolarHBondContact O-N 3.32Å; I211-M213 VanDerWaalsContact C-N 3.26Å; I211-M213 PolarHBondContact O-N 2.76Å; M213-P215 VanDerWaalsContact C-CD 3.46Å; M213-F216 PolarHBondContact O-N 3.04Å; M213-V217 HydrophobicContact CB-CG2 3.75Å; M213-V217 HydrophobicContact CE-CG2 3.74Å; M213-V217 WeakPolarHBondContact O-CG2 3.26Å; M213-V217 PolarHBondContact O-N 2.89Å; M213-L221 HydrophobicContact CB-CD1 3.79Å
214	Q	88.4	Confident	82.6	Confident	17 Å²	17	66.5 Å²	66.5	8%	0.079	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-43.1	-173.6	-174.9	61.1	3.6	0	0	115.7	L210 I211 M212 F216 P218 L221 V223 W224	L210-Q214 PolarHBondContact O-N 3.48Å; I211-Q214 WeakPolarHBondContact O-CB 3.34Å; I211-Q214 PolarHBondContact O-N 3.15Å; M212-Q214 VanDerWaalsContact C-N 3.3Å; Q214-F216 PolarHBondContact O-N 3.39Å; Q214-F216 VanDerWaalsContact O-N 3.13Å; Q214-P218 WeakPolarHBondContact O-CA 3.36Å; Q214-P218 WeakPolarHBondContact O-CD 3.3Å; Q214-L221 PolarHBondContact NE2-O 2.88Å; Q214-L221 VanDerWaalsContact OE1-CB 3.29Å; Q214-L221 PolarHBondContact OE1-O 3.4Å; Q214-V223 HydrophobicContact CB-CG2 3.83Å; Q214-V223 HydrophobicContact CG-CG2 3.82Å; Q214-W224 VanDerWaalsContact NE2-CE2 3.27Å
215	P	87.4	Confident	82.5	Confident	65 Å²	65	67.2 Å²	67.2	42%	0.422	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23	178.6	-23.3	36.1	0	0	0	113.3	R108 M212 M213 W228	R108-P215 PolarHBondContact NH2-O 3.46Å; M212-P215 WeakPolarHBondContact O-CD 3.42Å; M213-P215 VanDerWaalsContact C-CD 3.46Å; P215-W228 HydrophobicContact CG-CH2 4.38Å; P215-W228 HydrophobicContact CG-CZ3 4.21Å
216	F	84.9	Confident	82.5	Confident	91 Å²	91	69.7 Å²	69.7	40%	0.399	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-38.4	-176.6	-55.2	-77.2	0	0	0	112.4	R108 L109 T112 M213 Q214 P218	R108-F216 WeakPolarHBondContact CB-O 3.1Å; R108-F216 WeakPolarHBondContact CD-O 3.45Å; R108-F216 PolarHBondContact NE-O 2.98Å; R108-F216 VanDerWaalsContact NE-O 3.13Å; L109-F216 HydrophobicContact CD2-CB 3.62Å; L109-F216 HydrophobicContact CD2-CG 4.14Å; L109-F216 HydrophobicContact CG-CB 4.09Å; T112-F216 HydrophobicContact CG2-CD1 4.13Å; T112-F216 HydrophobicContact CG2-CE1 4.17Å; M213-F216 PolarHBondContact O-N 3.04Å; Q214-F216 PolarHBondContact O-N 3.39Å; Q214-F216 VanDerWaalsContact O-N 3.13Å; F216-P218 VanDerWaalsContact C-CD 3.41Å; F216-P218 WeakPolarHBondContact O-CD 3.4Å
217	V	84.7	Confident	82.8	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	37%	0.371	C	S	.	.			trans	-127	59.3	-175.8	-61.2	0	0	0	0	113.7	D105 L109 M213 H219 H220 L221	D105-V217 HydrophobicContact CB-CB 3.81Å; D105-V217 HydrophobicContact CB-CG1 3.72Å; D105-V217 WeakPolarHBondContact OD2-CA 3.28Å; L109-V217 HydrophobicContact CD1-CG1 3.22Å; L109-V217 HydrophobicContact CG-CG1 3.66Å; M213-V217 HydrophobicContact CB-CG2 3.75Å; M213-V217 HydrophobicContact CE-CG2 3.74Å; M213-V217 WeakPolarHBondContact O-CG2 3.26Å; M213-V217 PolarHBondContact O-N 2.89Å; V217-H219 VanDerWaalsContact C-N 3.29Å; V217-H219 PolarHBondContact O-N 3.22Å; V217-H220 PolarHBondContact O-N 3.39Å; V217-L221 HydrophobicContact CG2-CD1 3.85Å; V217-L221 HydrophobicContact CG2-CG 4.45Å
218	P	83.6	Confident	83	Confident	16 Å²	16	78.1 Å²	78.1	10%	0.104	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-22.4	-170	26.5	-36.2	0	0	0	115.1	D105 Q214 F216 W224	D105-P218 WeakPolarHBondContact OD1-CD 3.09Å; Q214-P218 WeakPolarHBondContact O-CA 3.36Å; Q214-P218 WeakPolarHBondContact O-CD 3.3Å; F216-P218 VanDerWaalsContact C-CD 3.41Å; F216-P218 WeakPolarHBondContact O-CD 3.4Å; P218-W224 HydrophobicContact CB-CH2 3.77Å; P218-W224 HydrophobicContact CB-CZ2 3.54Å
219	H	78.3	Confident	83	Confident	133 Å²	133	77.7 Å²	77.7	62%	0.616	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-29.7	-175	-56.3	88.2	0	0	0	111.8	D105 V217	D105-H219 IonicContact OD1-CE1 3.66Å; D105-H219 IonicContact OD1-CG 3.7Å; D105-H219 IonicContact OD1-ND1 2.74Å; D105-H219 PolarHBondContact OD1-ND1 2.95Å; D105-H219 WeakPolarHBondContact OD2-CB 3.14Å; D105-H219 IonicContact OD2-CG 4Å; D105-H219 PolarHBondContact OD2-N 3.25Å; D105-H219 IonicContact OD2-ND1 3.75Å; V217-H219 VanDerWaalsContact C-N 3.29Å; V217-H219 PolarHBondContact O-N 3.22Å
220	H	69.4	Low	83	Confident	75 Å²	75	79.6 Å²	79.6	35%	0.347	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.6	179.7	-66.5	80.2	0	0	0	114	D105 Y150 V217	D105-H220 WeakPolarHBondContact CB-ND1 3.48Å; D105-H220 IonicContact OD2-CE1 3.7Å; D105-H220 IonicContact OD2-CG 2.77Å; D105-H220 PolarHBondContact OD2-N 2.84Å; D105-H220 VanDerWaalsContact OD2-N 3.12Å; D105-H220 IonicContact OD2-ND1 2.7Å; D105-H220 PolarHBondContact OD2-ND1 2.88Å; Y150-H220 HydrophobicContact CE1-CB 3.84Å; Y150-H220 HydrophobicContact CE2-CB 4.3Å; Y150-H220 AromaticContact CE2-CD2 3.27Å; Y150-H220 WeakPolarHBondContact CE2-CD2 3.33Å; Y150-H220 AromaticContact CE2-CG 3.98Å; Y150-H220 AromaticContact CE2-NE2 3.93Å; Y150-H220 AromaticContact CZ-CD2 3.27Å; Y150-H220 AromaticContact CZ-CG 3.53Å; Y150-H220 WeakPolarHBondContact OH-CB 3.07Å; Y150-H220 PolarHBondContact OH-CD2 3.41Å; V217-H220 PolarHBondContact O-N 3.39Å
221	L	69.5	Low	82.7	Confident	13 Å²	13	82.9 Å²	82.9	7%	0.068	42%	0.424	C	S	.	.			trans	-129.3	92	-175.9	-60	177.1	0	0	0	108.7	Y150 L210 M213 Q214 V217 V223	Y150-L221 HydrophobicContact CE1-CD2 4.32Å; L210-L221 HydrophobicContact CB-CD1 4.12Å; L210-L221 HydrophobicContact CB-CD2 4.31Å; L210-L221 HydrophobicContact CD2-CD1 4.07Å; L210-L221 HydrophobicContact CD2-CD2 3.7Å; L210-L221 HydrophobicContact CG-CD2 4.39Å; L210-L221 VanDerWaalsContact O-CD1 3.25Å; L210-L221 WeakPolarHBondContact O-CD1 3.46Å; M213-L221 HydrophobicContact CB-CD1 3.79Å; Q214-L221 PolarHBondContact NE2-O 2.88Å; Q214-L221 VanDerWaalsContact OE1-CB 3.29Å; Q214-L221 PolarHBondContact OE1-O 3.4Å; V217-L221 HydrophobicContact CG2-CD1 3.85Å; V217-L221 HydrophobicContact CG2-CG 4.45Å; L221-V223 HydrophobicContact CB-CG2 4.22Å; L221-V223 PolarHBondContact O-N 2.89Å
222	P	68.7	Low	82.2	Confident	114 Å²	114	85.6 Å²	85.6	74%	0.74	44%	0.439	S	S	*	.			trans	-77.4	59.3	178.6	32	-35.1	0	0	0	111.1
223	V	77.6	Confident	81.7	Confident	33 Å²	33	90 Å²	90	20%	0.2	46%	0.456	C	S	.	.			trans	-101.7	23.4	-176.1	-63	0	0	0	0	112.7	Q214 L221 E225 Q226	Q214-V223 HydrophobicContact CB-CG2 3.83Å; Q214-V223 HydrophobicContact CG-CG2 3.82Å; L221-V223 HydrophobicContact CB-CG2 4.22Å; L221-V223 PolarHBondContact O-N 2.89Å; V223-E225 PolarHBondContact O-N 3.2Å; V223-E225 VanDerWaalsContact O-N 3.09Å; V223-Q226 HydrophobicContact CB-CB 4.26Å; V223-Q226 HydrophobicContact CB-CG 3.88Å; V223-Q226 HydrophobicContact CG1-CG 4.35Å; V223-Q226 WeakPolarHBondContact O-CB 3.03Å; V223-Q226 PolarHBondContact O-N 2.78Å
224	W	73.4	Confident	81.4	Confident	188 Å²	188	93.9 Å²	93.9	71%	0.712	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.3	-173.4	-63.9	100.8	0	0	0	114.8	Q214 P218	Q214-W224 VanDerWaalsContact NE2-CE2 3.27Å; P218-W224 HydrophobicContact CB-CH2 3.77Å; P218-W224 HydrophobicContact CB-CZ2 3.54Å
225	E	80.9	Confident	81	Confident	189 Å²	189	94.9 Å²	94.9	88%	0.883	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.1	-178.4	-61.3	-179.8	169.5	0	0	113.2	V223	V223-E225 PolarHBondContact O-N 3.2Å; V223-E225 VanDerWaalsContact O-N 3.09Å
226	Q	84.9	Confident	80.9	Confident	123 Å²	123	96.2 Å²	96.2	58%	0.575	50%	0.499	S	S	*	.	S	Bend	trans	-76.6	139.4	-179.7	-63.6	-63.1	-41.7	0	0	111	I211 V223	I211-Q226 HydrophobicContact CD1-CB 4.08Å; I211-Q226 HydrophobicContact CG1-CB 4.15Å; V223-Q226 HydrophobicContact CB-CB 4.26Å; V223-Q226 HydrophobicContact CB-CG 3.88Å; V223-Q226 HydrophobicContact CG1-CG 4.35Å; V223-Q226 WeakPolarHBondContact O-CB 3.03Å; V223-Q226 PolarHBondContact O-N 2.78Å
227	K	89.6	Confident	81	Confident	184 Å²	184	93.9 Å²	93.9	80%	0.8	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-66.7	140.1	173.5	-66	-176.2	-178.7	178.5	0	109.7
228	W	90.2	Very high	81.3	Confident	159 Å²	159	95.1 Å²	95.1	60%	0.602	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-55.3	136.2	170.7	-168	-101.6	0	0	0	109.9	I211 M212 P215 A230	I211-W228 HydrophobicContact CG2-CE3 4.1Å; I211-W228 HydrophobicContact CG2-CZ3 4.49Å; M212-W228 HydrophobicContact CB-CH2 4.17Å; M212-W228 HydrophobicContact CG-CH2 4.02Å; M212-W228 HydrophobicContact CG-CZ2 3.93Å; P215-W228 HydrophobicContact CG-CH2 4.38Å; P215-W228 HydrophobicContact CG-CZ3 4.21Å; W228-A230 PolarHBondContact O-N 3.32Å
229	P	90.3	Very high	81.9	Confident	28 Å²	28	94.4 Å²	94.4	18%	0.182	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-59.7	128.5	-178.7	23.2	-34	0	0	0	110.5	C208 M212	C208-P229 HydrophobicContact CB-CB 4.19Å; C208-P229 HydrophobicContact CB-CG 4.5Å; M212-P229 HydrophobicContact CG-CG 3.81Å; M212-P229 HydrophobicContact SD-CG 4.42Å
230	A	87.3	Confident	82.7	Confident	97 Å²	97	90.2 Å²	90.2	80%	0.802	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-78.7	143	172.3	0	0	0	0	0	109.9	W228 D232	W228-A230 PolarHBondContact O-N 3.32Å; A230-D232 PolarHBondContact O-N 2.88Å
231	A	80.7	Confident	84	Confident	94 Å²	94	86.6 Å²	86.6	78%	0.777	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-60.6	132.5	172.1	0	0	0	0	0	109.9	K233	A231-K233 PolarHBondContact O-N 3.25Å
232	D	80.7	Confident	85.3	Confident	83 Å²	83	87.8 Å²	87.8	44%	0.444	46%	0.463	S	S	.	.			trans	-74.4	110.6	175.4	-175.9	-0.2	0	0	0	109.6	A230 S234 A235	A230-D232 PolarHBondContact O-N 2.88Å; D232-S234 VanDerWaalsContact CG-OG 3.31Å; D232-S234 PolarHBondContact O-N 3.24Å; D232-S234 WeakPolarHBondContact OD1-CB 2.78Å; D232-S234 PolarHBondContact OD1-N 3.34Å; D232-S234 PolarHBondContact OD1-OG 2.81Å; D232-S234 PolarHBondContact OD2-OG 3.42Å; D232-A235 HydrophobicContact CB-CB 4.07Å; D232-A235 WeakPolarHBondContact O-CB 3.32Å; D232-A235 PolarHBondContact O-N 2.97Å
233	K	78.3	Confident	86.5	Confident	176 Å²	176	82.7 Å²	82.7	77%	0.765	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.1	178.3	-62	-176.3	-179.2	-178.1	0	112.7	A231 S255	A231-K233 PolarHBondContact O-N 3.25Å; K233-S255 VanDerWaalsContact O-CB 3.26Å; K233-S255 WeakPolarHBondContact O-CB 3.28Å
234	S	81.4	Confident	87.3	Confident	94 Å²	94	85.7 Å²	85.7	66%	0.657	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-6.2	177.3	70.8	0	0	0	0	113	D232	D232-S234 VanDerWaalsContact CG-OG 3.31Å; D232-S234 PolarHBondContact O-N 3.24Å; D232-S234 WeakPolarHBondContact OD1-CB 2.78Å; D232-S234 PolarHBondContact OD1-N 3.34Å; D232-S234 PolarHBondContact OD1-OG 2.81Å; D232-S234 PolarHBondContact OD2-OG 3.42Å
235	A	79.6	Confident	88.2	Confident	38 Å²	38	79.7 Å²	79.7	31%	0.314	44%	0.441	S	S	.	.	S	Bend	trans	-67	139.9	179.9	0	0	0	0	0	111.7	D232 M237 S255	D232-A235 HydrophobicContact CB-CB 4.07Å; D232-A235 WeakPolarHBondContact O-CB 3.32Å; D232-A235 PolarHBondContact O-N 2.97Å; A235-M237 PolarHBondContact O-N 3.41Å; A235-S255 PolarHBondContact O-N 2.9Å
236	D	84.7	Confident	88.8	Confident	93 Å²	93	77.7 Å²	77.7	50%	0.497	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	127	172.2	-70.9	-18.5	0	0	0	110.5	R252 I253	D236-R252 HydrophobicContact CB-CB 4.28Å; D236-I253 CarbonylContact C-O 3.56Å; D236-I253 WeakPolarHBondContact CA-O 3.44Å
237	M	88	Confident	89.3	Confident	41 Å²	41	79 Å²	79	20%	0.202	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	153	165.4	-63.8	-64.6	-172.2	0	0	109.9	A235 R252 I253 F258	A235-M237 PolarHBondContact O-N 3.41Å; M237-R252 WeakPolarHBondContact O-CA 3.32Å; M237-I253 HydrophobicContact CB-CG1 4.41Å; M237-I253 PolarHBondContact N-O 3.42Å; M237-I253 PolarHBondContact O-N 3.45Å; M237-F258 HydrophobicContact CB-CB 3.7Å; M237-F258 HydrophobicContact CB-CD1 4.28Å; M237-F258 HydrophobicContact CB-CD2 3.42Å; M237-F258 VanDerWaalsContact CB-CD2 3.42Å; M237-F258 HydrophobicContact CB-CE2 4.17Å; M237-F258 HydrophobicContact CB-CG 3.52Å; M237-F258 HydrophobicContact CG-CB 3.78Å; M237-F258 HydrophobicContact CG-CD1 4.06Å; M237-F258 HydrophobicContact CG-CD2 4.12Å; M237-F258 HydrophobicContact CG-CG 3.71Å
238	V	91	Very high	89.5	Confident	27 Å²	27	71.3 Å²	71.3	16%	0.164	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.8	-177.4	177.5	0	0	0	0	109.7	I240 R250 I251 G297 G298	V238-I240 HydrophobicContact CG1-CG1 4.05Å; V238-R250 HydrophobicContact CG1-CG 3.37Å; V238-I251 CarbonylContact C-O 3.22Å; V238-I251 WeakPolarHBondContact CA-O 3.25Å; V238-G297 WeakPolarHBondContact O-CA 3.18Å; V238-G298 PolarHBondContact O-N 2.92Å
239	L	95	Very high	89.8	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	116.3	167.8	-179.2	68	0	0	0	109.2	I251 I253 L261 A266 L290 G298 L300	L239-I251 HydrophobicContact CB-CB 4.33Å; L239-I251 PolarHBondContact N-O 3.37Å; L239-I251 PolarHBondContact O-N 3.44Å; L239-I253 HydrophobicContact CB-CD1 4.47Å; L239-L261 HydrophobicContact CD1-CD2 4.1Å; L239-L261 HydrophobicContact CD2-CD2 4.06Å; L239-A266 HydrophobicContact CD2-CB 4.24Å; L239-L290 HydrophobicContact CD1-CD1 3.82Å; L239-G298 WeakPolarHBondContact CA-O 3.39Å; L239-L300 HydrophobicContact CD1-CB 4.26Å
240	I	95.4	Very high	89.9	Confident	45 Å²	45	69.7 Å²	69.7	23%	0.231	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120	176.9	-57.6	178.1	0	0	0	108.7	V238 Q242 R247 G298 R299 L300	V238-I240 HydrophobicContact CG1-CG1 4.05Å; I240-Q242 HydrophobicContact CG2-CG 3.97Å; I240-R247 HydrophobicContact CG2-CB 4.43Å; I240-R247 HydrophobicContact CG2-CG 3.82Å; I240-G298 PolarHBondContact N-O 2.99Å; I240-R299 HydrophobicContact CB-CG 4.44Å; I240-R299 CarbonylContact O-C 3.51Å; I240-R299 VanDerWaalsContact O-CA 3.28Å; I240-R299 WeakPolarHBondContact O-CA 3.39Å; I240-L300 PolarHBondContact O-N 3.11Å
241	V	96.7	Very high	90.2	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.9	174.4	-174.4	0	0	0	0	108.9	V248 E249 I251 A270 V276 L300 L302	V241-V248 PolarHBondContact O-N 2.93Å; V241-E249 HydrophobicContact CB-CB 4.18Å; V241-E249 HydrophobicContact CG2-CB 4.35Å; V241-E249 PolarHBondContact N-O 3.06Å; V241-E249 PolarHBondContact O-N 2.71Å; V241-I251 HydrophobicContact CG2-CD1 3.66Å; V241-I251 HydrophobicContact CG2-CG1 4.24Å; V241-A270 HydrophobicContact CG1-CB 4.27Å; V241-A270 HydrophobicContact CG2-CB 3.82Å; V241-V276 HydrophobicContact CG1-CG2 4.15Å; V241-L300 HydrophobicContact CG1-CD2 4.49Å; V241-L302 HydrophobicContact CG1-CD1 3.82Å; V241-L302 HydrophobicContact CG1-CG 4.33Å
242	Q	96.3	Very high	90.7	Very high	37 Å²	37	65.2 Å²	65.2	17%	0.173	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.7	178.3	-54.3	-171.2	-78.6	0	0	110.4	I240 K246 L300 L301 L302	I240-Q242 HydrophobicContact CG2-CG 3.97Å; Q242-K246 CarbonylContact C-O 3.39Å; Q242-K246 WeakPolarHBondContact CA-O 3.22Å; Q242-L300 PolarHBondContact N-O 2.93Å; Q242-L301 HydrophobicContact CB-CD2 4Å; Q242-L301 HydrophobicContact CG-CD2 4.24Å; Q242-L302 PolarHBondContact O-N 2.74Å
243	M	95	Very high	91.2	Very high	7 Å²	7	62 Å²	62	3%	0.034	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120	173.8	-66.9	176.7	72.2	0	0	109.1	G245 K246 V248 Q279 L280 L302 V304	M243-G245 PolarHBondContact O-N 2.74Å; M243-K246 PolarHBondContact N-O 2.68Å; M243-K246 WeakPolarHBondContact O-CB 3.49Å; M243-K246 PolarHBondContact O-N 3.24Å; M243-V248 HydrophobicContact CB-CG2 3.69Å; M243-V248 HydrophobicContact CG-CB 4.5Å; M243-V248 HydrophobicContact CG-CG2 3.61Å; M243-V248 HydrophobicContact SD-CB 4.44Å; M243-V248 HydrophobicContact SD-CG1 4.28Å; M243-V248 HydrophobicContact SD-CG2 3.76Å; M243-Q279 HydrophobicContact CE-CB 3.68Å; M243-Q279 HydrophobicContact SD-CB 3.59Å; M243-Q279 VanDerWaalsContact SD-CB 3.59Å; M243-Q279 HydrophobicContact SD-CG 4.5Å; M243-Q279 PolarHBondContact SD-OE1 2.68Å; M243-L280 HydrophobicContact CE-CD2 3.77Å; M243-L280 HydrophobicContact CE-CG 3.7Å; M243-L302 WeakPolarHBondContact CA-O 3.07Å; M243-L302 HydrophobicContact CG-CB 3.98Å; M243-L302 HydrophobicContact CG-CD1 3.94Å; M243-L302 HydrophobicContact CG-CG 4.44Å; M243-V304 HydrophobicContact CE-CB 4.37Å; M243-V304 HydrophobicContact CE-CG1 3.66Å; M243-V304 HydrophobicContact CE-CG2 3.93Å
244	N	93.9	Very high	91.8	Very high	96 Å²	96	55.8 Å²	55.8	51%	0.513	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	43.1	-175.1	-64.8	-11.1	0	0	0	112.9	K246 L302 Q303 V304	N244-K246 VanDerWaalsContact C-N 3.26Å; N244-K246 PolarHBondContact O-N 2.76Å; N244-L302 PolarHBondContact N-O 2.8Å; N244-Q303 WeakPolarHBondContact OD1-CA 3.05Å; N244-V304 WeakPolarHBondContact ND2-CG2 3.48Å; N244-V304 PolarHBondContact ND2-O 2.57Å; N244-V304 PolarHBondContact OD1-N 3.17Å; N244-V304 PolarHBondContact OD1-O 2.76Å
245	G	92.1	Very high	92	Very high	62 Å²	62	51.8 Å²	51.8	64%	0.639	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-12.8	-179.3	0	0	0	0	0	115.6	M243	M243-G245 PolarHBondContact O-N 2.74Å
246	K	93.9	Very high	92.3	Very high	148 Å²	148	57.3 Å²	57.3	64%	0.643	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.3	176.6	-172.1	179.6	178.3	-176.7	0	110.4	Q242 M243 N244 V248	Q242-K246 CarbonylContact C-O 3.39Å; Q242-K246 WeakPolarHBondContact CA-O 3.22Å; M243-K246 PolarHBondContact N-O 2.68Å; M243-K246 WeakPolarHBondContact O-CB 3.49Å; M243-K246 PolarHBondContact O-N 3.24Å; N244-K246 VanDerWaalsContact C-N 3.26Å; N244-K246 PolarHBondContact O-N 2.76Å; K246-V248 PolarHBondContact O-N 3.39Å
247	R	95.1	Very high	92.5	Very high	149 Å²	149	55.4 Å²	55.4	56%	0.562	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	127.3	172.1	174.8	176.3	162.7	-157.5	-11.3	110	I240	I240-R247 HydrophobicContact CG2-CB 4.43Å; I240-R247 HydrophobicContact CG2-CG 3.82Å
248	V	94.2	Very high	92.6	Very high	24 Å²	24	53.6 Å²	53.6	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-49.5	-179.5	179.4	0	0	0	0	110.6	V241 M243 K246 V276	V241-V248 PolarHBondContact O-N 2.93Å; M243-V248 HydrophobicContact CB-CG2 3.69Å; M243-V248 HydrophobicContact CG-CB 4.5Å; M243-V248 HydrophobicContact CG-CG2 3.61Å; M243-V248 HydrophobicContact SD-CB 4.44Å; M243-V248 HydrophobicContact SD-CG1 4.28Å; M243-V248 HydrophobicContact SD-CG2 3.76Å; K246-V248 PolarHBondContact O-N 3.39Å; V248-V276 HydrophobicContact CG1-CG2 4.12Å
249	E	95.2	Very high	92.5	Very high	50 Å²	50	57.8 Å²	57.8	23%	0.234	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	156.1	-174.8	-167.3	51.8	-87.2	0	0	111.8	V241 I251 Y273 S275 V276	V241-E249 HydrophobicContact CB-CB 4.18Å; V241-E249 HydrophobicContact CG2-CB 4.35Å; V241-E249 PolarHBondContact N-O 3.06Å; V241-E249 PolarHBondContact O-N 2.71Å; E249-I251 HydrophobicContact CG-CG1 3.95Å; E249-Y273 HydrophobicContact CG-CD1 3.99Å; E249-Y273 HydrophobicContact CG-CG 4.02Å; E249-S275 WeakPolarHBondContact OE2-CB 3.24Å; E249-S275 PolarHBondContact OE2-OG 2.82Å; E249-V276 HydrophobicContact CB-CG2 3.91Å
250	R	94.1	Very high	92.2	Very high	103 Å²	103	61.5 Å²	61.5	39%	0.389	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	105.1	172.1	-177	-171.8	179	-162.1	2	108.9	V238	V238-R250 HydrophobicContact CG1-CG 3.37Å
251	I	93.9	Very high	92.1	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	128.5	-177	-54.1	176.5	0	0	0	108.5	V238 L239 V241 E249 I253 A270 Y273	V238-I251 CarbonylContact C-O 3.22Å; V238-I251 WeakPolarHBondContact CA-O 3.25Å; L239-I251 HydrophobicContact CB-CB 4.33Å; L239-I251 PolarHBondContact N-O 3.37Å; L239-I251 PolarHBondContact O-N 3.44Å; V241-I251 HydrophobicContact CG2-CD1 3.66Å; V241-I251 HydrophobicContact CG2-CG1 4.24Å; E249-I251 HydrophobicContact CG-CG1 3.95Å; I251-I253 HydrophobicContact CG2-CG2 3.76Å; I251-A270 HydrophobicContact CD1-CB 4.27Å; I251-Y273 HydrophobicContact CB-CE2 4.26Å; I251-Y273 HydrophobicContact CD1-CD2 3.7Å; I251-Y273 HydrophobicContact CD1-CE2 3.68Å; I251-Y273 HydrophobicContact CG1-CD2 3.92Å; I251-Y273 HydrophobicContact CG1-CE2 3.63Å; I251-Y273 HydrophobicContact CG2-CE2 3.73Å
252	R	91.2	Very high	92	Very high	95 Å²	95	63.5 Å²	63.5	36%	0.358	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.1	170.1	-65	-176.5	-172.6	-176.6	2.5	108.6	E181 D236 M237	E181-R252 VanDerWaalsContact CD-NH2 3.31Å; E181-R252 IonicContact OE1-CZ 3.86Å; E181-R252 IonicContact OE1-NH2 2.67Å; E181-R252 PolarHBondContact OE1-NH2 2.84Å; D236-R252 HydrophobicContact CB-CB 4.28Å; M237-R252 WeakPolarHBondContact O-CA 3.32Å
253	I	91.1	Very high	91.9	Very high	14 Å²	14	65.7 Å²	65.7	7%	0.072	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	149.4	178.1	61.6	179.5	0	0	0	109.7	D236 M237 L239 I251 F258 L261 L269	D236-I253 CarbonylContact C-O 3.56Å; D236-I253 WeakPolarHBondContact CA-O 3.44Å; M237-I253 HydrophobicContact CB-CG1 4.41Å; M237-I253 PolarHBondContact N-O 3.42Å; M237-I253 PolarHBondContact O-N 3.45Å; L239-I253 HydrophobicContact CB-CD1 4.47Å; I251-I253 HydrophobicContact CG2-CG2 3.76Å; I253-F258 HydrophobicContact CD1-CB 3.98Å; I253-F258 HydrophobicContact CD1-CD2 3.81Å; I253-F258 HydrophobicContact CD1-CG 4.38Å; I253-F258 HydrophobicContact CG1-CB 4.08Å; I253-F258 HydrophobicContact CG1-CD2 4.11Å; I253-L261 HydrophobicContact CD1-CD1 4.45Å; I253-L261 HydrophobicContact CD1-CD2 4.01Å; I253-L269 HydrophobicContact CG2-CD1 4.22Å
254	S	89.1	Confident	91.9	Very high	46 Å²	46	72.2 Å²	72.2	32%	0.322	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	150.5	176.8	64.4	0	0	0	0	111.3	E256 T257 F258	S254-E256 PolarHBondContact O-N 3.02Å; S254-T257 PolarHBondContact O-N 3.21Å; S254-T257 PolarHBondContact OG-N 3.21Å; S254-T257 PolarHBondContact OG-OG1 3.39Å; S254-F258 WeakPolarHBondContact O-CB 3.19Å; S254-F258 PolarHBondContact O-N 3.3Å
255	S	86.4	Confident	92	Very high	11 Å²	11	71.2 Å²	71.2	8%	0.077	36%	0.361	C	S	.	.	H	α-helix	trans	-57.7	-32.5	176.6	-171.5	0	0	0	0	112.7	K233 A235 F258 N259	K233-S255 VanDerWaalsContact O-CB 3.26Å; K233-S255 WeakPolarHBondContact O-CB 3.28Å; A235-S255 PolarHBondContact O-N 2.9Å; S255-F258 PolarHBondContact O-N 3.46Å; S255-N259 WeakPolarHBondContact O-CB 3.25Å; S255-N259 PolarHBondContact O-N 2.97Å; S255-N259 PolarHBondContact O-ND2 3.16Å
256	E	85.7	Confident	92.2	Very high	154 Å²	154	68.3 Å²	68.3	72%	0.72	33%	0.33	S	S	*	.	H	α-helix	trans	-62.2	-51.9	176.2	-65.8	179	176.6	0	0	111.3	S254 F258 N259 S260	S254-E256 PolarHBondContact O-N 3.02Å; E256-F258 VanDerWaalsContact C-N 3.28Å; E256-F258 PolarHBondContact O-N 3.43Å; E256-N259 PolarHBondContact O-N 2.83Å; E256-S260 PolarHBondContact O-N 3.29Å; E256-S260 PolarHBondContact O-OG 2.75Å
257	T	89.1	Confident	92.3	Very high	53 Å²	53	62.7 Å²	62.7	33%	0.325	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-37.6	176.4	-53.3	0	0	0	0	111.6	S254 S260 L261 L269	S254-T257 PolarHBondContact O-N 3.21Å; S254-T257 PolarHBondContact OG-N 3.21Å; S254-T257 PolarHBondContact OG-OG1 3.39Å; T257-S260 PolarHBondContact O-N 3.02Å; T257-S260 PolarHBondContact O-OG 3.02Å; T257-L261 PolarHBondContact O-N 3.24Å; T257-L269 HydrophobicContact CG2-CD1 4.46Å
258	F	90.9	Very high	92.3	Very high	3 Å²	3	57.4 Å²	57.4	1%	0.013	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-40.1	178.6	-173.8	-87.7	0	0	0	112.3	M237 I253 S254 S255 E256 S260 L261 L292 G297 G298	M237-F258 HydrophobicContact CB-CB 3.7Å; M237-F258 HydrophobicContact CB-CD1 4.28Å; M237-F258 HydrophobicContact CB-CD2 3.42Å; M237-F258 VanDerWaalsContact CB-CD2 3.42Å; M237-F258 HydrophobicContact CB-CE2 4.17Å; M237-F258 HydrophobicContact CB-CG 3.52Å; M237-F258 HydrophobicContact CG-CB 3.78Å; M237-F258 HydrophobicContact CG-CD1 4.06Å; M237-F258 HydrophobicContact CG-CD2 4.12Å; M237-F258 HydrophobicContact CG-CG 3.71Å; I253-F258 HydrophobicContact CD1-CB 3.98Å; I253-F258 HydrophobicContact CD1-CD2 3.81Å; I253-F258 HydrophobicContact CD1-CG 4.38Å; I253-F258 HydrophobicContact CG1-CB 4.08Å; I253-F258 HydrophobicContact CG1-CD2 4.11Å; S254-F258 WeakPolarHBondContact O-CB 3.19Å; S254-F258 PolarHBondContact O-N 3.3Å; S255-F258 PolarHBondContact O-N 3.46Å; E256-F258 VanDerWaalsContact C-N 3.28Å; E256-F258 PolarHBondContact O-N 3.43Å; F258-S260 VanDerWaalsContact C-N 3.29Å; F258-S260 PolarHBondContact O-N 3.25Å; F258-L261 VanDerWaalsContact O-CB 3.22Å; F258-L261 WeakPolarHBondContact O-CB 3.41Å; F258-L261 PolarHBondContact O-N 3.41Å; F258-L292 HydrophobicContact CE1-CD2 4.34Å; F258-L292 HydrophobicContact CE2-CD2 4Å; F258-L292 HydrophobicContact CZ-CB 4.4Å; F258-L292 HydrophobicContact CZ-CD2 3.71Å; F258-G297 WeakPolarHBondContact CZ-O 3.35Å; F258-G298 VanDerWaalsContact CE2-N 3.31Å
259	N	87.3	Confident	92.3	Very high	115 Å²	115	57.7 Å²	57.7	62%	0.615	30%	0.3	S	S	*	.	H	α-helix	trans	-72.9	-22.5	-178.5	-69.7	-30.1	0	0	0	113	S255 E256	S255-N259 WeakPolarHBondContact O-CB 3.25Å; S255-N259 PolarHBondContact O-N 2.97Å; S255-N259 PolarHBondContact O-ND2 3.16Å; E256-N259 PolarHBondContact O-N 2.83Å
260	S	90.1	Very high	92.3	Very high	77 Å²	77	55.3 Å²	55.3	54%	0.538	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	13	174.3	67.9	0	0	0	0	113.2	E256 T257 F258 D262	E256-S260 PolarHBondContact O-N 3.29Å; E256-S260 PolarHBondContact O-OG 2.75Å; T257-S260 PolarHBondContact O-N 3.02Å; T257-S260 PolarHBondContact O-OG 3.02Å; F258-S260 VanDerWaalsContact C-N 3.29Å; F258-S260 PolarHBondContact O-N 3.25Å; S260-D262 PolarHBondContact O-N 3.37Å
261	L	92.8	Very high	92.3	Very high	12 Å²	12	53.9 Å²	53.9	6%	0.063	29%	0.287	C	S	.	.			trans	-78.3	118.9	-172.4	-165.3	70.2	0	0	0	110.9	L239 I253 T257 F258 I265 A266 L269 L290 L292	L239-L261 HydrophobicContact CD1-CD2 4.1Å; L239-L261 HydrophobicContact CD2-CD2 4.06Å; I253-L261 HydrophobicContact CD1-CD1 4.45Å; I253-L261 HydrophobicContact CD1-CD2 4.01Å; T257-L261 PolarHBondContact O-N 3.24Å; F258-L261 VanDerWaalsContact O-CB 3.22Å; F258-L261 WeakPolarHBondContact O-CB 3.41Å; F258-L261 PolarHBondContact O-N 3.41Å; L261-I265 HydrophobicContact CD1-CB 4.14Å; L261-I265 HydrophobicContact CD1-CG2 3.69Å; L261-A266 HydrophobicContact CD1-CB 4.09Å; L261-A266 HydrophobicContact CD2-CB 3.98Å; L261-A266 HydrophobicContact CG-CB 3.96Å; L261-L269 HydrophobicContact CD1-CD1 3.75Å; L261-L290 HydrophobicContact CB-CD2 4.48Å; L261-L290 HydrophobicContact CD2-CD1 4.12Å; L261-L290 HydrophobicContact CD2-CD2 4.16Å; L261-L290 HydrophobicContact CG-CD2 4.02Å; L261-L292 HydrophobicContact CD2-CD2 4.14Å
262	D	94.5	Very high	92.4	Very high	75 Å²	75	60.9 Å²	60.9	40%	0.401	32%	0.318	S	S	.	.			trans	-104	175.5	167	65.6	31.8	0	0	0	111.2	S260 E264 I265 A266 L290	S260-D262 PolarHBondContact O-N 3.37Å; D262-E264 VanDerWaalsContact C-N 3.29Å; D262-E264 PolarHBondContact O-N 3.38Å; D262-E264 PolarHBondContact OD1-N 3.24Å; D262-E264 VanDerWaalsContact OD1-N 3.11Å; D262-I265 VanDerWaalsContact OD1-CB 3.31Å; D262-I265 WeakPolarHBondContact OD1-CB 3.42Å; D262-I265 WeakPolarHBondContact OD1-CG1 3.06Å; D262-I265 PolarHBondContact OD1-N 3.42Å; D262-I265 WeakPolarHBondContact OD2-CD1 3.44Å; D262-A266 WeakPolarHBondContact O-CB 3.39Å; D262-A266 PolarHBondContact O-N 3.28Å; D262-L290 WeakPolarHBondContact O-CD2 3.43Å
263	E	95.2	Very high	92.6	Very high	84 Å²	84	60.5 Å²	60.5	39%	0.393	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-35.2	-176.4	-50.6	-159.8	130.9	0	0	112.6	L267 Y288 L290	E263-L267 WeakPolarHBondContact O-CB 3.25Å; E263-L267 PolarHBondContact O-N 3.23Å; E263-Y288 HydrophobicContact CB-CD2 4.05Å; E263-Y288 HydrophobicContact CB-CE2 3.67Å; E263-L290 HydrophobicContact CB-CB 4.39Å; E263-L290 HydrophobicContact CG-CB 3.82Å; E263-L290 PolarHBondContact OE1-N 3.19Å; E263-L290 VanDerWaalsContact OE1-N 3.07Å
264	E	94.8	Very high	92.7	Very high	144 Å²	144	63.5 Å²	63.5	67%	0.673	34%	0.339	S	S	*	.	H	α-helix	trans	-73.3	-45.6	-178.1	-64.9	-173	178.4	0	0	111.6	D262 A266 L267 G268	D262-E264 VanDerWaalsContact C-N 3.29Å; D262-E264 PolarHBondContact O-N 3.38Å; D262-E264 PolarHBondContact OD1-N 3.24Å; D262-E264 VanDerWaalsContact OD1-N 3.11Å; E264-A266 VanDerWaalsContact C-N 3.34Å; E264-L267 PolarHBondContact O-N 2.82Å; E264-G268 PolarHBondContact O-N 3.25Å
265	I	95	Very high	92.9	Very high	75 Å²	75	62.7 Å²	62.7	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-63.6	-43	175.2	-62.9	167.6	0	0	0	109.4	L261 D262 L267 G268 L269	L261-I265 HydrophobicContact CD1-CB 4.14Å; L261-I265 HydrophobicContact CD1-CG2 3.69Å; D262-I265 VanDerWaalsContact OD1-CB 3.31Å; D262-I265 WeakPolarHBondContact OD1-CB 3.42Å; D262-I265 WeakPolarHBondContact OD1-CG1 3.06Å; D262-I265 PolarHBondContact OD1-N 3.42Å; D262-I265 WeakPolarHBondContact OD2-CD1 3.44Å; I265-L267 PolarHBondContact O-N 2.91Å; I265-G268 PolarHBondContact O-N 2.84Å; I265-L269 HydrophobicContact CG2-CD1 4.16Å; I265-L269 HydrophobicContact CG2-CG 4.41Å; I265-L269 WeakPolarHBondContact O-CB 3.39Å; I265-L269 VanDerWaalsContact O-CG 3.3Å; I265-L269 WeakPolarHBondContact O-CG 3.39Å; I265-L269 PolarHBondContact O-N 3.3Å
266	A	95.8	Very high	93.3	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.1	-44.9	176.3	0	0	0	0	0	111.9	L239 L261 D262 E264 L269 A270 L290 L300	L239-A266 HydrophobicContact CD2-CB 4.24Å; L261-A266 HydrophobicContact CD1-CB 4.09Å; L261-A266 HydrophobicContact CD2-CB 3.98Å; L261-A266 HydrophobicContact CG-CB 3.96Å; D262-A266 WeakPolarHBondContact O-CB 3.39Å; D262-A266 PolarHBondContact O-N 3.28Å; E264-A266 VanDerWaalsContact C-N 3.34Å; A266-L269 PolarHBondContact O-N 2.82Å; A266-A270 WeakPolarHBondContact O-CB 2.96Å; A266-A270 PolarHBondContact O-N 3.33Å; A266-L290 HydrophobicContact CB-CD1 3.78Å; A266-L290 HydrophobicContact CB-CD2 4.09Å; A266-L290 HydrophobicContact CB-CG 4.47Å; A266-L300 HydrophobicContact CB-CD1 4.1Å; A266-L300 HydrophobicContact CB-CD2 4.43Å
267	L	95.8	Very high	93.7	Very high	31 Å²	31	60.1 Å²	60.1	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-45.6	175.4	-177.1	63.8	0	0	0	111.3	E263 E264 I265 L269 A270 M271 L285 Y288 L302	E263-L267 WeakPolarHBondContact O-CB 3.25Å; E263-L267 PolarHBondContact O-N 3.23Å; E264-L267 PolarHBondContact O-N 2.82Å; I265-L267 PolarHBondContact O-N 2.91Å; L267-L269 VanDerWaalsContact C-N 3.29Å; L267-L269 PolarHBondContact O-N 2.7Å; L267-A270 PolarHBondContact O-N 3.39Å; L267-A270 VanDerWaalsContact O-N 3.16Å; L267-M271 HydrophobicContact CD1-CG 4.32Å; L267-M271 HydrophobicContact CG-CG 4.41Å; L267-M271 WeakPolarHBondContact O-CB 3.38Å; L267-M271 VanDerWaalsContact O-CG 3.27Å; L267-M271 WeakPolarHBondContact O-CG 3.39Å; L267-M271 PolarHBondContact O-N 2.69Å; L267-L285 HydrophobicContact CD1-CD2 4.23Å; L267-L285 HydrophobicContact CD2-CD2 4.22Å; L267-Y288 HydrophobicContact CD2-CD1 4.07Å; L267-Y288 HydrophobicContact CD2-CD2 4.42Å; L267-Y288 HydrophobicContact CD2-CE1 3.89Å; L267-Y288 HydrophobicContact CD2-CE2 4.23Å; L267-Y288 HydrophobicContact CD2-CG 4.34Å; L267-L302 HydrophobicContact CD1-CD2 3.83Å
268	G	95.4	Very high	93.8	Very high	38 Å²	38	63.7 Å²	63.7	39%	0.392	33%	0.331	S	S	.	.	H	α-helix	trans	-58.8	-38.7	176.2	0	0	0	0	0	112.8	E264 I265	E264-G268 PolarHBondContact O-N 3.25Å; I265-G268 PolarHBondContact O-N 2.84Å
269	L	95	Very high	93.7	Very high	29 Å²	29	66.9 Å²	66.9	15%	0.152	35%	0.346	C	S	.	.	H	α-helix	trans	-67.3	-45	173.3	-73.3	172.6	0	0	0	112	I253 T257 L261 I265 A266 L267 M271 K272 Y273	I253-L269 HydrophobicContact CG2-CD1 4.22Å; T257-L269 HydrophobicContact CG2-CD1 4.46Å; L261-L269 HydrophobicContact CD1-CD1 3.75Å; I265-L269 HydrophobicContact CG2-CD1 4.16Å; I265-L269 HydrophobicContact CG2-CG 4.41Å; I265-L269 WeakPolarHBondContact O-CB 3.39Å; I265-L269 VanDerWaalsContact O-CG 3.3Å; I265-L269 WeakPolarHBondContact O-CG 3.39Å; I265-L269 PolarHBondContact O-N 3.3Å; A266-L269 PolarHBondContact O-N 2.82Å; L267-L269 VanDerWaalsContact C-N 3.29Å; L267-L269 PolarHBondContact O-N 2.7Å; L269-M271 VanDerWaalsContact C-N 3.31Å; L269-M271 PolarHBondContact O-N 3.06Å; L269-K272 HydrophobicContact CD2-CD 4.39Å; L269-K272 WeakPolarHBondContact O-CB 3.27Å; L269-K272 PolarHBondContact O-N 3.4Å; L269-K272 VanDerWaalsContact O-N 3.12Å; L269-Y273 WeakPolarHBondContact O-CD2 3.14Å
270	A	95.3	Very high	93.8	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-41	177.9	0	0	0	0	0	112.1	V241 I251 A266 L267 K272 Y273 V276 L300	V241-A270 HydrophobicContact CG1-CB 4.27Å; V241-A270 HydrophobicContact CG2-CB 3.82Å; I251-A270 HydrophobicContact CD1-CB 4.27Å; A266-A270 WeakPolarHBondContact O-CB 2.96Å; A266-A270 PolarHBondContact O-N 3.33Å; L267-A270 PolarHBondContact O-N 3.39Å; L267-A270 VanDerWaalsContact O-N 3.16Å; A270-K272 PolarHBondContact O-N 3.07Å; A270-K272 VanDerWaalsContact O-N 3.1Å; A270-Y273 PolarHBondContact O-N 2.76Å; A270-Y273 VanDerWaalsContact O-N 3.13Å; A270-V276 HydrophobicContact CB-CG1 4.43Å; A270-V276 WeakPolarHBondContact O-CB 3.21Å; A270-L300 HydrophobicContact CB-CD2 3.53Å
271	M	94.3	Very high	93.7	Very high	74 Å²	74	63.3 Å²	63.3	37%	0.365	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-7	177.2	-69.3	-58.7	-73	0	0	113.7	L267 L269 V276 K277 L280	L267-M271 HydrophobicContact CD1-CG 4.32Å; L267-M271 HydrophobicContact CG-CG 4.41Å; L267-M271 WeakPolarHBondContact O-CB 3.38Å; L267-M271 VanDerWaalsContact O-CG 3.27Å; L267-M271 WeakPolarHBondContact O-CG 3.39Å; L267-M271 PolarHBondContact O-N 2.69Å; L269-M271 VanDerWaalsContact C-N 3.31Å; L269-M271 PolarHBondContact O-N 3.06Å; M271-V276 HydrophobicContact SD-CG1 4.39Å; M271-K277 WeakPolarHBondContact O-CE 3.3Å; M271-L280 HydrophobicContact CE-CD1 4.1Å; M271-L280 HydrophobicContact SD-CD1 3.28Å; M271-L280 WeakPolarHBondContact SD-CD1 3.01Å
272	K	95.1	Very high	93	Very high	149 Å²	149	70.9 Å²	70.9	65%	0.648	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.2	171.6	-67.7	175.3	-176.7	-179.9	0	112.5	L269 A270	L269-K272 HydrophobicContact CD2-CD 4.39Å; L269-K272 WeakPolarHBondContact O-CB 3.27Å; L269-K272 PolarHBondContact O-N 3.4Å; L269-K272 VanDerWaalsContact O-N 3.12Å; A270-K272 PolarHBondContact O-N 3.07Å; A270-K272 VanDerWaalsContact O-N 3.1Å
273	Y	95.2	Very high	92.8	Very high	87 Å²	87	71.4 Å²	71.4	34%	0.341	36%	0.362	S	S	.	.	S	Bend	trans	-88.2	132.7	-174	-70.4	-97.2	0	0	0	111.8	E249 I251 L269 A270 S275 V276 K277	E249-Y273 HydrophobicContact CG-CD1 3.99Å; E249-Y273 HydrophobicContact CG-CG 4.02Å; I251-Y273 HydrophobicContact CB-CE2 4.26Å; I251-Y273 HydrophobicContact CD1-CD2 3.7Å; I251-Y273 HydrophobicContact CD1-CE2 3.68Å; I251-Y273 HydrophobicContact CG1-CD2 3.92Å; I251-Y273 HydrophobicContact CG1-CE2 3.63Å; I251-Y273 HydrophobicContact CG2-CE2 3.73Å; L269-Y273 WeakPolarHBondContact O-CD2 3.14Å; A270-Y273 PolarHBondContact O-N 2.76Å; A270-Y273 VanDerWaalsContact O-N 3.13Å; Y273-S275 VanDerWaalsContact C-N 3.31Å; Y273-S275 PolarHBondContact O-N 3.1Å; Y273-V276 PolarHBondContact O-N 2.64Å; Y273-K277 PolarHBondContact O-N 3.22Å; Y273-K277 VanDerWaalsContact O-N 3.12Å
274	S	93.9	Very high	92.5	Very high	77 Å²	77	76.6 Å²	76.6	54%	0.538	38%	0.38	S	S	.	.	H	α-helix	trans	-61.7	-38.3	-179.2	52	0	0	0	0	112.5	V276 K277 E278	S274-V276 PolarHBondContact O-N 2.88Å; S274-K277 PolarHBondContact O-N 3.13Å; S274-K277 VanDerWaalsContact O-N 3.14Å; S274-E278 WeakPolarHBondContact O-CB 3.37Å; S274-E278 WeakPolarHBondContact O-CG 3.34Å; S274-E278 PolarHBondContact O-N 3.04Å
275	S	93.5	Very high	92.4	Very high	28 Å²	28	73 Å²	73	20%	0.196	37%	0.365	C	S	.	.	H	α-helix	trans	-53.4	-38.6	176.3	56.4	0	0	0	0	112.9	E249 Y273 Q279	E249-S275 WeakPolarHBondContact OE2-CB 3.24Å; E249-S275 PolarHBondContact OE2-OG 2.82Å; Y273-S275 VanDerWaalsContact C-N 3.31Å; Y273-S275 PolarHBondContact O-N 3.1Å; S275-Q279 WeakPolarHBondContact O-CG 3.45Å
276	V	93.9	Very high	92.3	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-79	-45.6	177.8	-178.2	0	0	0	0	110.6	V241 V248 E249 A270 M271 Y273 S274 E278 Q279 L280 L302	V241-V276 HydrophobicContact CG1-CG2 4.15Å; V248-V276 HydrophobicContact CG1-CG2 4.12Å; E249-V276 HydrophobicContact CB-CG2 3.91Å; A270-V276 HydrophobicContact CB-CG1 4.43Å; A270-V276 WeakPolarHBondContact O-CB 3.21Å; M271-V276 HydrophobicContact SD-CG1 4.39Å; Y273-V276 PolarHBondContact O-N 2.64Å; S274-V276 PolarHBondContact O-N 2.88Å; V276-E278 PolarHBondContact O-N 3.29Å; V276-Q279 PolarHBondContact O-N 3.48Å; V276-L280 HydrophobicContact CG1-CD1 3.81Å; V276-L280 PolarHBondContact O-N 2.97Å; V276-L302 HydrophobicContact CG1-CD1 4.22Å
277	K	94	Very high	92.2	Very high	111 Å²	111	80.9 Å²	80.9	48%	0.483	40%	0.397	S	S	.	.	H	α-helix	trans	-58.5	-45.3	178.3	-70.2	-174.8	-174.3	-177.5	0	112.6	M271 Y273 S274 Q279 L280 S281	M271-K277 WeakPolarHBondContact O-CE 3.3Å; Y273-K277 PolarHBondContact O-N 3.22Å; Y273-K277 VanDerWaalsContact O-N 3.12Å; S274-K277 PolarHBondContact O-N 3.13Å; S274-K277 VanDerWaalsContact O-N 3.14Å; K277-Q279 VanDerWaalsContact C-N 3.34Å; K277-Q279 PolarHBondContact O-N 3.04Å; K277-L280 PolarHBondContact O-N 3.44Å; K277-S281 PolarHBondContact O-N 2.93Å
278	E	91.6	Very high	92.2	Very high	129 Å²	129	83.2 Å²	83.2	60%	0.603	40%	0.404	S	S	*	.	H	α-helix	trans	-61.2	-44.3	-179.2	-75.9	172.4	-163.4	0	0	111	S274 V276 L280 S281	S274-E278 WeakPolarHBondContact O-CB 3.37Å; S274-E278 WeakPolarHBondContact O-CG 3.34Å; S274-E278 PolarHBondContact O-N 3.04Å; V276-E278 PolarHBondContact O-N 3.29Å; E278-L280 VanDerWaalsContact C-N 3.33Å; E278-L280 PolarHBondContact O-N 3.34Å; E278-S281 PolarHBondContact O-N 2.81Å; E278-S281 PolarHBondContact O-OG 3.46Å
279	Q	89.3	Confident	92.3	Very high	70 Å²	70	88.7 Å²	88.7	33%	0.327	41%	0.413	S	S	.	.	H	α-helix	trans	-71.7	-27.5	179.3	-69.2	-167.7	16.7	0	0	113.6	M243 S275 V276 K277	M243-Q279 HydrophobicContact CE-CB 3.68Å; M243-Q279 HydrophobicContact SD-CB 3.59Å; M243-Q279 VanDerWaalsContact SD-CB 3.59Å; M243-Q279 HydrophobicContact SD-CG 4.5Å; M243-Q279 PolarHBondContact SD-OE1 2.68Å; S275-Q279 WeakPolarHBondContact O-CG 3.45Å; V276-Q279 PolarHBondContact O-N 3.48Å; K277-Q279 VanDerWaalsContact C-N 3.34Å; K277-Q279 PolarHBondContact O-N 3.04Å
280	L	89.7	Confident	92.4	Very high	21 Å²	21	88.5 Å²	88.5	11%	0.11	41%	0.412	C	S	.	.	H	α-helix	trans	-80.9	-26.5	173.9	-78.5	167.9	0	0	0	112.8	M243 M271 V276 K277 E278 Q282 K283 L285 V304	M243-L280 HydrophobicContact CE-CD2 3.77Å; M243-L280 HydrophobicContact CE-CG 3.7Å; M271-L280 HydrophobicContact CE-CD1 4.1Å; M271-L280 HydrophobicContact SD-CD1 3.28Å; M271-L280 WeakPolarHBondContact SD-CD1 3.01Å; V276-L280 HydrophobicContact CG1-CD1 3.81Å; V276-L280 PolarHBondContact O-N 2.97Å; K277-L280 PolarHBondContact O-N 3.44Å; E278-L280 VanDerWaalsContact C-N 3.33Å; E278-L280 PolarHBondContact O-N 3.34Å; L280-Q282 PolarHBondContact O-N 2.98Å; L280-K283 PolarHBondContact O-N 3.14Å; L280-L285 HydrophobicContact CD2-CB 4.31Å; L280-L285 HydrophobicContact CD2-CD1 4.34Å; L280-V304 HydrophobicContact CD2-CG1 3.49Å; L280-V304 VanDerWaalsContact CD2-CG1 3.49Å
281	S	87.2	Confident	92.3	Very high	95 Å²	95	92.2 Å²	92.2	66%	0.664	43%	0.429	S	S	*	.	H	α-helix	trans	-59.7	-25.2	-177.4	68.9	0	0	0	0	113.8	K277 E278	K277-S281 PolarHBondContact O-N 2.93Å; E278-S281 PolarHBondContact O-N 2.81Å; E278-S281 PolarHBondContact O-OG 3.46Å
282	Q	79.5	Confident	92.3	Very high	172 Å²	172	92.5 Å²	92.5	80%	0.804	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	3.9	-179.6	-62.2	-178.6	-14.1	0	0	113.5	L280	L280-Q282 PolarHBondContact O-N 2.98Å
283	K	89	Confident	91.9	Very high	86 Å²	86	87.6 Å²	87.6	37%	0.374	42%	0.416	S	S	.	.	S	Bend	trans	-144.8	155.5	-168.7	-57.6	-176	-178.2	177.5	0	112.3	L280 V304 V305	L280-K283 PolarHBondContact O-N 3.14Å; K283-V304 HydrophobicContact CB-CB 3.95Å; K283-V304 HydrophobicContact CB-CG2 4.42Å; K283-V304 HydrophobicContact CD-CB 3.98Å; K283-V304 HydrophobicContact CD-CG2 3.51Å; K283-V305 CarbonylContact C-O 3.6Å; K283-V305 WeakPolarHBondContact CA-O 3.39Å
284	Y	89	Confident	91	Very high	193 Å²	193	88.4 Å²	88.4	76%	0.757	43%	0.432	S	S	*	.			trans	-95.7	128.4	174	-64.6	-83.4	0	0	0	110.4	R286 V304 V305	Y284-R286 PolarHBondContact O-N 3.07Å; Y284-V304 CarbonylContact O-C 3.59Å; Y284-V304 VanDerWaalsContact O-CA 3.27Å; Y284-V304 WeakPolarHBondContact O-CA 3.35Å; Y284-V305 PolarHBondContact N-O 3.23Å; Y284-V305 PolarHBondContact O-N 3.26Å
285	L	92.6	Very high	90.1	Very high	68 Å²	68	89.1 Å²	89.1	36%	0.356	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	110.3	173	-175.4	68.3	0	0	0	109.3	L267 L280 Y288 L302 V304	L267-L285 HydrophobicContact CD1-CD2 4.23Å; L267-L285 HydrophobicContact CD2-CD2 4.22Å; L280-L285 HydrophobicContact CD2-CB 4.31Å; L280-L285 HydrophobicContact CD2-CD1 4.34Å; L285-Y288 HydrophobicContact CD2-CD1 3.97Å; L285-L302 HydrophobicContact CD1-CB 3.97Å; L285-L302 HydrophobicContact CD1-CD2 4.12Å; L285-V304 HydrophobicContact CD1-CG1 4.05Å
286	R	92.9	Very high	89.4	Confident	193 Å²	193	95 Å²	95	73%	0.728	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	-43.7	179	179.9	-178.2	179.6	-179.2	0.7	112.1	Y284 Q303 V305	Y284-R286 PolarHBondContact O-N 3.07Å; R286-Q303 HydrophobicContact CB-CB 4.45Å; R286-Q303 PolarHBondContact N-O 3.31Å; R286-V305 HydrophobicContact CB-CG2 3.98Å; R286-V305 HydrophobicContact CG-CG2 4.46Å
287	S	94.5	Very high	89.1	Confident	47 Å²	47	95.4 Å²	95.4	33%	0.329	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	160.6	178.8	70.5	0	0	0	0	110.7	Q303	S287-Q303 PolarHBondContact N-O 3.16Å; S287-Q303 PolarHBondContact O-N 3.11Å; S287-Q303 WeakPolarHBondContact OG-CB 3.2Å; S287-Q303 VanDerWaalsContact OG-CD 3.26Å; S287-Q303 WeakPolarHBondContact OG-CG 3.17Å; S287-Q303 PolarHBondContact OG-OE1 3.11Å
288	Y	96.2	Very high	89.1	Confident	80 Å²	80	90.3 Å²	90.3	31%	0.314	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155	170.1	58.6	-82.5	0	0	0	110.3	E263 L267 L285 L301	E263-Y288 HydrophobicContact CB-CD2 4.05Å; E263-Y288 HydrophobicContact CB-CE2 3.67Å; L267-Y288 HydrophobicContact CD2-CD1 4.07Å; L267-Y288 HydrophobicContact CD2-CD2 4.42Å; L267-Y288 HydrophobicContact CD2-CE1 3.89Å; L267-Y288 HydrophobicContact CD2-CE2 4.23Å; L267-Y288 HydrophobicContact CD2-CG 4.34Å; L285-Y288 HydrophobicContact CD2-CD1 3.97Å; Y288-L301 CarbonylContact C-O 3.48Å; Y288-L301 WeakPolarHBondContact CA-O 3.33Å
289	R	96.2	Very high	89.3	Confident	153 Å²	153	90.1 Å²	90.1	58%	0.577	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.9	137.9	176.9	179.2	-175.8	-65.7	-175.1	-2.9	110.1	E291 L301	R289-E291 HydrophobicContact CG-CG 4.48Å; R289-L301 HydrophobicContact CB-CB 4.48Å; R289-L301 PolarHBondContact N-O 2.82Å; R289-L301 PolarHBondContact O-N 2.77Å
290	L	96.6	Very high	89.7	Confident	25 Å²	25	86.8 Å²	86.8	13%	0.131	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.3	171.5	-172.8	62.7	0	0	0	111.3	L239 L261 D262 E263 A266 L292	L239-L290 HydrophobicContact CD1-CD1 3.82Å; L261-L290 HydrophobicContact CB-CD2 4.48Å; L261-L290 HydrophobicContact CD2-CD1 4.12Å; L261-L290 HydrophobicContact CD2-CD2 4.16Å; L261-L290 HydrophobicContact CG-CD2 4.02Å; D262-L290 WeakPolarHBondContact O-CD2 3.43Å; E263-L290 HydrophobicContact CB-CB 4.39Å; E263-L290 HydrophobicContact CG-CB 3.82Å; E263-L290 PolarHBondContact OE1-N 3.19Å; E263-L290 VanDerWaalsContact OE1-N 3.07Å; A266-L290 HydrophobicContact CB-CD1 3.78Å; A266-L290 HydrophobicContact CB-CD2 4.09Å; A266-L290 HydrophobicContact CB-CG 4.47Å; L290-L292 HydrophobicContact CD1-CD2 3.81Å; L290-L292 HydrophobicContact CD1-CG 4.5Å; L290-L292 HydrophobicContact CD2-CD1 4.08Å; L290-L292 HydrophobicContact CD2-CD2 3.93Å; L290-L292 HydrophobicContact CD2-CG 4.01Å; L290-L292 HydrophobicContact CG-CD2 3.76Å; L290-L292 HydrophobicContact CG-CG 3.92Å
291	E	94.9	Very high	90.1	Very high	79 Å²	79	88 Å²	88	37%	0.369	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	109.2	172.5	-63.8	-177.2	168.5	0	0	109.4	R289 G298 R299 L301	R289-E291 HydrophobicContact CG-CG 4.48Å; E291-G298 CarbonylContact O-C 3.1Å; E291-G298 VanDerWaalsContact O-CA 3.27Å; E291-G298 WeakPolarHBondContact O-CA 3.47Å; E291-R299 HydrophobicContact CB-CB 4.35Å; E291-R299 PolarHBondContact N-O 3Å; E291-R299 PolarHBondContact O-N 3.31Å; E291-L301 HydrophobicContact CG-CD1 4.24Å; E291-L301 WeakPolarHBondContact OE1-CD1 3.23Å
292	L	93.3	Very high	90.5	Very high	80 Å²	80	83.5 Å²	83.5	42%	0.419	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.9	179.2	-58.4	-179.1	0	0	0	111.3	F258 L261 L290	F258-L292 HydrophobicContact CE1-CD2 4.34Å; F258-L292 HydrophobicContact CE2-CD2 4Å; F258-L292 HydrophobicContact CZ-CB 4.4Å; F258-L292 HydrophobicContact CZ-CD2 3.71Å; L261-L292 HydrophobicContact CD2-CD2 4.14Å; L290-L292 HydrophobicContact CD1-CD2 3.81Å; L290-L292 HydrophobicContact CD1-CG 4.5Å; L290-L292 HydrophobicContact CD2-CD1 4.08Å; L290-L292 HydrophobicContact CD2-CD2 3.93Å; L290-L292 HydrophobicContact CD2-CG 4.01Å; L290-L292 HydrophobicContact CG-CD2 3.76Å; L290-L292 HydrophobicContact CG-CG 3.92Å
293	S	87.4	Confident	91.3	Very high	45 Å²	45	80 Å²	80	32%	0.315	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	107.8	168.9	-176.3	0	0	0	0	108.9	A295 L296 G297	S293-A295 PolarHBondContact O-N 3.33Å; S293-L296 PolarHBondContact O-N 2.73Å; S293-G297 CarbonylContact C-O 3.58Å; S293-G297 WeakPolarHBondContact CA-O 3.41Å; S293-G297 WeakPolarHBondContact CB-O 3.23Å; S293-G297 PolarHBondContact N-O 3.43Å; S293-G297 PolarHBondContact O-N 2.91Å
294	P	75.7	Confident	91.4	Very high	104 Å²	104	76.3 Å²	76.3	68%	0.675	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-27.1	-174.7	-29.2	34.9	0	0	0	114.8
295	A	75.2	Confident	91.4	Very high	93 Å²	93	73.2 Å²	73.2	77%	0.769	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-19.9	-179.6	0	0	0	0	0	114.7	S293	S293-A295 PolarHBondContact O-N 3.33Å
296	L	78.2	Confident	91.4	Very high	152 Å²	152	73.5 Å²	73.5	80%	0.796	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-9	-171.2	-60.5	175.8	0	0	0	113.6	S293	S293-L296 PolarHBondContact O-N 2.73Å
297	G	88.8	Confident	91.3	Very high	8 Å²	8	67.2 Å²	67.2	8%	0.082	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	94.9	-159.5	-170.8	0	0	0	0	0	112	V238 F258 S293	V238-G297 WeakPolarHBondContact O-CA 3.18Å; F258-G297 WeakPolarHBondContact CZ-O 3.35Å; S293-G297 CarbonylContact C-O 3.58Å; S293-G297 WeakPolarHBondContact CA-O 3.41Å; S293-G297 WeakPolarHBondContact CB-O 3.23Å; S293-G297 PolarHBondContact N-O 3.43Å; S293-G297 PolarHBondContact O-N 2.91Å
298	G	94	Very high	91.1	Very high	3 Å²	3	68.3 Å²	68.3	3%	0.031	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	161.3	-172.2	0	0	0	0	0	112.5	V238 L239 I240 F258 E291	V238-G298 PolarHBondContact O-N 2.92Å; L239-G298 WeakPolarHBondContact CA-O 3.39Å; I240-G298 PolarHBondContact N-O 2.99Å; F258-G298 VanDerWaalsContact CE2-N 3.31Å; E291-G298 CarbonylContact O-C 3.1Å; E291-G298 VanDerWaalsContact O-CA 3.27Å; E291-G298 WeakPolarHBondContact O-CA 3.47Å
299	R	96.1	Very high	90.8	Very high	126 Å²	126	67.6 Å²	67.6	48%	0.475	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.1	172.1	-58.4	179.7	-176.3	173.7	1.7	109.6	I240 E291 L301	I240-R299 HydrophobicContact CB-CG 4.44Å; I240-R299 CarbonylContact O-C 3.51Å; I240-R299 VanDerWaalsContact O-CA 3.28Å; I240-R299 WeakPolarHBondContact O-CA 3.39Å; E291-R299 HydrophobicContact CB-CB 4.35Å; E291-R299 PolarHBondContact N-O 3Å; E291-R299 PolarHBondContact O-N 3.31Å; R299-L301 HydrophobicContact CB-CD2 4.28Å
300	L	97.2	Very high	90.5	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	113.5	167	-179.5	67.1	0	0	0	108	L239 I240 V241 Q242 A266 A270 L302	L239-L300 HydrophobicContact CD1-CB 4.26Å; I240-L300 PolarHBondContact O-N 3.11Å; V241-L300 HydrophobicContact CG1-CD2 4.49Å; Q242-L300 PolarHBondContact N-O 2.93Å; A266-L300 HydrophobicContact CB-CD1 4.1Å; A266-L300 HydrophobicContact CB-CD2 4.43Å; A270-L300 HydrophobicContact CB-CD2 3.53Å; L300-L302 HydrophobicContact CD1-CD2 4.3Å; L300-L302 HydrophobicContact CD2-CD2 3.96Å; L300-L302 HydrophobicContact CD2-CG 4.5Å; L300-L302 HydrophobicContact CG-CD2 3.85Å; L300-L302 HydrophobicContact CG-CG 4.35Å
301	L	96.8	Very high	90.1	Very high	45 Å²	45	64.8 Å²	64.8	24%	0.236	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.9	-179.9	-54	-178.8	0	0	0	108.8	Q242 Y288 R289 E291 R299	Q242-L301 HydrophobicContact CB-CD2 4Å; Q242-L301 HydrophobicContact CG-CD2 4.24Å; Y288-L301 CarbonylContact C-O 3.48Å; Y288-L301 WeakPolarHBondContact CA-O 3.33Å; R289-L301 HydrophobicContact CB-CB 4.48Å; R289-L301 PolarHBondContact N-O 2.82Å; R289-L301 PolarHBondContact O-N 2.77Å; E291-L301 HydrophobicContact CG-CD1 4.24Å; E291-L301 WeakPolarHBondContact OE1-CD1 3.23Å; R299-L301 HydrophobicContact CB-CD2 4.28Å
302	L	96.4	Very high	89.7	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	123.9	176.8	-54.1	-179.4	0	0	0	109	V241 Q242 M243 N244 L267 V276 L285 L300	V241-L302 HydrophobicContact CG1-CD1 3.82Å; V241-L302 HydrophobicContact CG1-CG 4.33Å; Q242-L302 PolarHBondContact O-N 2.74Å; M243-L302 WeakPolarHBondContact CA-O 3.07Å; M243-L302 HydrophobicContact CG-CB 3.98Å; M243-L302 HydrophobicContact CG-CD1 3.94Å; M243-L302 HydrophobicContact CG-CG 4.44Å; N244-L302 PolarHBondContact N-O 2.8Å; L267-L302 HydrophobicContact CD1-CD2 3.83Å; V276-L302 HydrophobicContact CG1-CD1 4.22Å; L285-L302 HydrophobicContact CD1-CB 3.97Å; L285-L302 HydrophobicContact CD1-CD2 4.12Å; L300-L302 HydrophobicContact CD1-CD2 4.3Å; L300-L302 HydrophobicContact CD2-CD2 3.96Å; L300-L302 HydrophobicContact CD2-CG 4.5Å; L300-L302 HydrophobicContact CG-CD2 3.85Å; L300-L302 HydrophobicContact CG-CG 4.35Å
303	Q	95.6	Very high	89.5	Confident	99 Å²	99	62.5 Å²	62.5	46%	0.463	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.3	169.1	-65	-168.8	-15.2	0	0	109.3	N244 R286 S287	N244-Q303 WeakPolarHBondContact OD1-CA 3.05Å; R286-Q303 HydrophobicContact CB-CB 4.45Å; R286-Q303 PolarHBondContact N-O 3.31Å; S287-Q303 PolarHBondContact N-O 3.16Å; S287-Q303 PolarHBondContact O-N 3.11Å; S287-Q303 WeakPolarHBondContact OG-CB 3.2Å; S287-Q303 VanDerWaalsContact OG-CD 3.26Å; S287-Q303 WeakPolarHBondContact OG-CG 3.17Å; S287-Q303 PolarHBondContact OG-OE1 3.11Å
304	V	92.6	Very high	89.6	Confident	8 Å²	8	64 Å²	64	5%	0.048	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.4	-177.6	-64.6	0	0	0	0	111.3	M243 N244 L280 K283 Y284 L285	M243-V304 HydrophobicContact CE-CB 4.37Å; M243-V304 HydrophobicContact CE-CG1 3.66Å; M243-V304 HydrophobicContact CE-CG2 3.93Å; N244-V304 WeakPolarHBondContact ND2-CG2 3.48Å; N244-V304 PolarHBondContact ND2-O 2.57Å; N244-V304 PolarHBondContact OD1-N 3.17Å; N244-V304 PolarHBondContact OD1-O 2.76Å; L280-V304 HydrophobicContact CD2-CG1 3.49Å; L280-V304 VanDerWaalsContact CD2-CG1 3.49Å; K283-V304 HydrophobicContact CB-CB 3.95Å; K283-V304 HydrophobicContact CB-CG2 4.42Å; K283-V304 HydrophobicContact CD-CB 3.98Å; K283-V304 HydrophobicContact CD-CG2 3.51Å; Y284-V304 CarbonylContact O-C 3.59Å; Y284-V304 VanDerWaalsContact O-CA 3.27Å; Y284-V304 WeakPolarHBondContact O-CA 3.35Å; L285-V304 HydrophobicContact CD1-CG1 4.05Å
305	V	89	Confident	90.9	Very high	128 Å²	128	60.4 Å²	60.4	78%	0.776	34%	0.335	S	S	*	.			trans	-118.1	0	179.6	-178.5	0	0	0	0	109.8	K283 Y284 R286	K283-V305 CarbonylContact C-O 3.6Å; K283-V305 WeakPolarHBondContact CA-O 3.39Å; Y284-V305 PolarHBondContact N-O 3.23Å; Y284-V305 PolarHBondContact O-N 3.26Å; R286-V305 HydrophobicContact CB-CG2 3.98Å; R286-V305 HydrophobicContact CG-CG2 4.46Å

Retrieved 305 of 305 residues in 1073 ms (Link to these results)

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