A0A093GYA2_STRCA Loading...

SH2 domain-containing protein 1A

AlphaFold DB , UniProt , Accession A0A093GYA2, Species STRCA (Struthio camelus australis), Gene n/a, Length 125 aa.

						>A0A093GYA2_STRCA|A0A093GYA2
MESLPVYHGSITREAGEKLLLDSGLDGSYLLRDSESIPGVYCLCVLHQGYIYTYRVSKTEAGSWSAETAPGVHRRLFRKVHNLLTAFQKPDQGIVTPLQHPIVTEGKAKPPAGRKEGHDFYLQPS
					

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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	51.5	Low	82.1	Confident	177 Å²	177	61.8 Å²	61.8	87%	0.872	35%	0.349	S	S	*	.				0	134.7	0	-109	160.8	-147.5	0	0	108	S3 Y41	M1-S3 PolarHBondContact O-N 3.08Å; M1-Y41 WeakPolarHBondContact CE-OH 3.39Å
2	E	58.7	Low	83	Confident	86 Å²	86	62.1 Å²	62.1	40%	0.402	35%	0.353	S	S	.	.			trans	-57.2	130.9	169.5	-72	178	143.3	0	0	108.1	L4 K79	E2-L4 VanDerWaalsContact C-N 3.28Å; E2-L4 PolarHBondContact O-N 3.22Å; E2-K79 VanDerWaalsContact OE1-CD 3.3Å; E2-K79 WeakPolarHBondContact OE1-CD 3.33Å; E2-K79 VanDerWaalsContact OE1-CE 3.28Å; E2-K79 WeakPolarHBondContact OE1-CE 3.42Å; E2-K79 IonicContact OE1-NZ 2.75Å; E2-K79 PolarHBondContact OE1-NZ 3.49Å
3	S	72.1	Confident	83.6	Confident	90 Å²	90	66.6 Å²	66.6	63%	0.629	36%	0.361	S	S	*	.			trans	-78.3	80	-174.3	-166.4	0	0	0	0	110.1	M1 K107	M1-S3 PolarHBondContact O-N 3.08Å; S3-K107 PolarHBondContact O-NZ 3.5Å; S3-K107 WeakPolarHBondContact OG-CE 3.24Å; S3-K107 PolarHBondContact OG-NZ 3.41Å
4	L	83.9	Confident	84.3	Confident	21 Å²	21	68.6 Å²	68.6	11%	0.11	37%	0.367	C	S	.	.			trans	-70.8	128.4	177.6	-71.8	175.8	0	0	0	110.3	E2 V6 Y7 L31 V80 H81 L84	E2-L4 VanDerWaalsContact C-N 3.28Å; E2-L4 PolarHBondContact O-N 3.22Å; L4-V6 HydrophobicContact CB-CG2 4.33Å; L4-V6 PolarHBondContact O-N 3.06Å; L4-Y7 PolarHBondContact O-N 3.48Å; L4-L31 HydrophobicContact CD1-CD2 3.98Å; L4-V80 HydrophobicContact CD1-CB 4.38Å; L4-V80 HydrophobicContact CD1-CG1 3.59Å; L4-V80 HydrophobicContact CD1-CG2 3.9Å; L4-V80 HydrophobicContact CG-CG1 4.31Å; L4-H81 HydrophobicContact CD2-CB 4.29Å; L4-L84 HydrophobicContact CD1-CD1 4.09Å; L4-L84 HydrophobicContact CD2-CD1 4.24Å
5	P	87.8	Confident	84.9	Confident	55 Å²	55	66.7 Å²	66.7	36%	0.357	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-25.7	179.4	28.8	-34.9	0	0	0	112.5	Y7 V103 T104	P5-Y7 VanDerWaalsContact C-N 3.29Å; P5-V103 HydrophobicContact CB-CB 4.5Å; P5-V103 HydrophobicContact CB-CG1 3.98Å; P5-V103 VanDerWaalsContact O-CA 3.29Å; P5-V103 WeakPolarHBondContact O-CA 3.37Å; P5-T104 PolarHBondContact O-N 3.1Å; P5-T104 PolarHBondContact O-OG1 3.26Å
6	V	91.8	Very high	85.4	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.024	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	0.4	177.7	-61.5	0	0	0	0	113.8	L4 H8 Y29 L31 L84 P101 I102	L4-V6 HydrophobicContact CB-CG2 4.33Å; L4-V6 PolarHBondContact O-N 3.06Å; V6-H8 PolarHBondContact O-CD2 2.98Å; V6-H8 VanDerWaalsContact O-CD2 3.27Å; V6-Y29 HydrophobicContact CB-CE2 4.27Å; V6-Y29 HydrophobicContact CG1-CE2 3.89Å; V6-Y29 HydrophobicContact CG2-CE2 4.22Å; V6-L31 PolarHBondContact O-N 3.04Å; V6-L84 HydrophobicContact CG2-CD1 3.94Å; V6-P101 HydrophobicContact CG1-CB 3.31Å; V6-I102 WeakPolarHBondContact CA-O 3.4Å
7	Y	92.6	Very high	85.8	Confident	60 Å²	60	62.2 Å²	62.2	24%	0.235	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-91.6	118.6	179.4	175.9	-113	0	0	0	110.1	L4 P5 G9 L31 D33 Y41 T104	L4-Y7 PolarHBondContact O-N 3.48Å; P5-Y7 VanDerWaalsContact C-N 3.29Å; Y7-G9 VanDerWaalsContact CZ-CA 3.48Å; Y7-L31 CarbonylContact C-O 3.53Å; Y7-L31 WeakPolarHBondContact CA-O 3.44Å; Y7-L31 HydrophobicContact CD2-CB 4.42Å; Y7-L31 HydrophobicContact CD2-CD2 4.11Å; Y7-L31 HydrophobicContact CD2-CG 4.27Å; Y7-D33 PolarHBondContact OH-OD1 3.35Å; Y7-D33 PolarHBondContact OH-OD2 3.35Å; Y7-D33 VanDerWaalsContact OH-OD2 3.1Å; Y7-Y41 HydrophobicContact CD2-CD1 4.47Å; Y7-Y41 AromaticContact CE2-CD1 3.82Å; Y7-Y41 HydrophobicContact CE2-CD1 3.82Å; Y7-Y41 AromaticContact CE2-CE1 3.72Å; Y7-Y41 HydrophobicContact CE2-CE1 3.72Å; Y7-T104 WeakPolarHBondContact O-CG2 3.13Å
8	H	91	Very high	86.3	Confident	30 Å²	30	66.1 Å²	66.1	14%	0.139	35%	0.35	C	S	.	.			trans	-98.1	-1.8	-177.7	-69	-107.5	0	0	0	113.6	V6 I11 L31 I102 T104	V6-H8 PolarHBondContact O-CD2 2.98Å; V6-H8 VanDerWaalsContact O-CD2 3.27Å; H8-I11 HydrophobicContact CB-CD1 3.53Å; H8-I11 HydrophobicContact CB-CG1 3.79Å; H8-I11 HydrophobicContact CB-CG2 4.02Å; H8-L31 PolarHBondContact N-O 3.22Å; H8-I102 PolarHBondContact NE2-O 3.32Å; H8-T104 VanDerWaalsContact CA-CG2 3.47Å; H8-T104 HydrophobicContact CB-CG2 3.89Å; H8-T104 VanDerWaalsContact CG-CG2 3.41Å; H8-T104 VanDerWaalsContact ND1-CG2 3.27Å; H8-T104 WeakPolarHBondContact ND1-CG2 3.15Å
9	G	90.7	Very high	86.7	Confident	13 Å²	13	66.1 Å²	66.1	13%	0.134	35%	0.35	C	S	.	.			trans	68.5	-145.3	-175.7	0	0	0	0	0	112.1	Y7 I11 R32 D33	Y7-G9 VanDerWaalsContact CZ-CA 3.48Å; G9-I11 PolarHBondContact O-N 3.01Å; G9-R32 WeakPolarHBondContact O-CA 3.26Å; G9-R32 WeakPolarHBondContact O-CB 3.41Å; G9-D33 PolarHBondContact O-N 3.18Å
10	S	90.1	Very high	87.1	Confident	106 Å²	106	62.8 Å²	62.8	74%	0.741	33%	0.332	S	S	*	.	S	Bend	trans	-83.1	50.7	-175.5	64.3	0	0	0	0	113.1	D33	S10-D33 PolarHBondContact N-OD2 3.02Å
11	I	93	Very high	87.4	Confident	38 Å²	38	64 Å²	64	20%	0.195	34%	0.338	C	S	.	.			trans	-74.4	149.2	168.2	60.9	164.1	0	0	0	110.4	H8 G9 A15 L19 L30 R32	H8-I11 HydrophobicContact CB-CD1 3.53Å; H8-I11 HydrophobicContact CB-CG1 3.79Å; H8-I11 HydrophobicContact CB-CG2 4.02Å; G9-I11 PolarHBondContact O-N 3.01Å; I11-A15 HydrophobicContact CB-CB 4.39Å; I11-L19 HydrophobicContact CD1-CD1 4.27Å; I11-L30 HydrophobicContact CD1-CD1 4.26Å; I11-R32 HydrophobicContact CD1-CB 4.21Å; I11-R32 HydrophobicContact CG1-CB 3.63Å; I11-R32 HydrophobicContact CG1-CG 4.47Å
12	T	92.8	Very high	89.4	Confident	65 Å²	65	61 Å²	61	40%	0.399	33%	0.326	S	S	.	.			trans	-67.5	157.6	174.9	68	0	0	0	0	110.8	E14 A15 G16	T12-E14 VanDerWaalsContact C-N 3.27Å; T12-E14 PolarHBondContact O-N 3.35Å; T12-A15 PolarHBondContact O-N 3.28Å; T12-A15 WeakPolarHBondContact OG1-CB 3.39Å; T12-A15 PolarHBondContact OG1-N 3.15Å; T12-A15 VanDerWaalsContact OG1-N 3.17Å; T12-G16 PolarHBondContact O-N 2.94Å
13	R	91.4	Very high	90.9	Very high	121 Å²	121	58.8 Å²	58.8	46%	0.457	32%	0.32	S	S	.	.	H	α-helix	trans	-52.1	-48.8	172	179.1	179.3	60.6	151.4	3.7	111.2	A15 G16 E17 E35	R13-A15 VanDerWaalsContact C-N 3.31Å; R13-A15 PolarHBondContact O-N 3.02Å; R13-G16 PolarHBondContact O-N 3.36Å; R13-G16 VanDerWaalsContact O-N 3.14Å; R13-E17 WeakPolarHBondContact CD-OE1 3.05Å; R13-E17 HydrophobicContact CG-CG 4.22Å; R13-E17 VanDerWaalsContact CG-OE1 3.29Å; R13-E17 WeakPolarHBondContact CG-OE1 3.32Å; R13-E17 WeakPolarHBondContact O-CG 3.47Å; R13-E17 PolarHBondContact O-N 2.93Å; R13-E35 WeakPolarHBondContact CB-OE2 3.38Å; R13-E35 PolarHBondContact N-OE2 3.18Å
14	E	93.3	Very high	91.8	Very high	95 Å²	95	57.1 Å²	57.1	44%	0.444	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-37.2	-176	-62.9	69	-146.6	0	0	111.3	T12 E17 K18	T12-E14 VanDerWaalsContact C-N 3.27Å; T12-E14 PolarHBondContact O-N 3.35Å; E14-E17 PolarHBondContact O-N 3.18Å; E14-K18 WeakPolarHBondContact O-CB 3.46Å; E14-K18 PolarHBondContact O-N 2.91Å
15	A	92.6	Very high	92.3	Very high	39 Å²	39	60.1 Å²	60.1	32%	0.322	33%	0.333	S	S	.	.	H	α-helix	trans	-65.8	-42.9	174.3	0	0	0	0	0	111.8	I11 T12 R13 K18 L19	I11-A15 HydrophobicContact CB-CB 4.39Å; T12-A15 PolarHBondContact O-N 3.28Å; T12-A15 WeakPolarHBondContact OG1-CB 3.39Å; T12-A15 PolarHBondContact OG1-N 3.15Å; T12-A15 VanDerWaalsContact OG1-N 3.17Å; R13-A15 VanDerWaalsContact C-N 3.31Å; R13-A15 PolarHBondContact O-N 3.02Å; A15-K18 PolarHBondContact O-N 3.27Å; A15-L19 WeakPolarHBondContact O-CG 3.39Å; A15-L19 PolarHBondContact O-N 3.32Å; A15-L19 VanDerWaalsContact O-N 3.12Å
16	G	92.9	Very high	92.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65	-41.1	175.8	0	0	0	0	0	112.8	T12 R13 L19 L20	T12-G16 PolarHBondContact O-N 2.94Å; R13-G16 PolarHBondContact O-N 3.36Å; R13-G16 VanDerWaalsContact O-N 3.14Å; G16-L19 PolarHBondContact O-N 2.76Å; G16-L20 WeakPolarHBondContact O-CG 3.49Å; G16-L20 PolarHBondContact O-N 3.32Å; G16-L20 VanDerWaalsContact O-N 3.15Å
17	E	93.2	Very high	92.7	Very high	58 Å²	58	60.5 Å²	60.5	27%	0.271	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-45.8	176.1	-74.1	-179.9	-177.2	0	0	111.4	R13 E14 L19 L20 L21 I51	R13-E17 WeakPolarHBondContact CD-OE1 3.05Å; R13-E17 HydrophobicContact CG-CG 4.22Å; R13-E17 VanDerWaalsContact CG-OE1 3.29Å; R13-E17 WeakPolarHBondContact CG-OE1 3.32Å; R13-E17 WeakPolarHBondContact O-CG 3.47Å; R13-E17 PolarHBondContact O-N 2.93Å; E14-E17 PolarHBondContact O-N 3.18Å; E17-L19 PolarHBondContact O-N 3.37Å; E17-L20 PolarHBondContact O-N 3.49Å; E17-L21 WeakPolarHBondContact O-CB 3.26Å; E17-L21 VanDerWaalsContact O-CG 3.28Å; E17-L21 WeakPolarHBondContact O-CG 3.46Å; E17-L21 PolarHBondContact O-N 3.13Å; E17-I51 HydrophobicContact CB-CD1 3.51Å; E17-I51 HydrophobicContact CG-CB 4.3Å; E17-I51 HydrophobicContact CG-CD1 3.5Å; E17-I51 HydrophobicContact CG-CG1 4.33Å; E17-I51 HydrophobicContact CG-CG2 4.14Å
18	K	94.4	Very high	92.8	Very high	132 Å²	132	57.6 Å²	57.6	57%	0.574	32%	0.321	S	S	*	.	H	α-helix	trans	-57.8	-46.9	176.1	-170.1	-171.9	175.1	-162.8	0	111.9	E14 A15 L20 L21 D22	E14-K18 WeakPolarHBondContact O-CB 3.46Å; E14-K18 PolarHBondContact O-N 2.91Å; A15-K18 PolarHBondContact O-N 3.27Å; K18-L20 VanDerWaalsContact C-N 3.29Å; K18-L20 PolarHBondContact O-N 2.93Å; K18-L21 PolarHBondContact O-N 2.99Å; K18-D22 VanDerWaalsContact O-CB 3.3Å; K18-D22 WeakPolarHBondContact O-CB 3.35Å; K18-D22 PolarHBondContact O-N 3.13Å
19	L	93.9	Very high	93.1	Very high	65 Å²	65	56.8 Å²	56.8	34%	0.34	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-39.1	178.8	-72.1	170.7	0	0	0	112.8	I11 A15 G16 E17 S23 L30 I102	I11-L19 HydrophobicContact CD1-CD1 4.27Å; A15-L19 WeakPolarHBondContact O-CG 3.39Å; A15-L19 PolarHBondContact O-N 3.32Å; A15-L19 VanDerWaalsContact O-N 3.12Å; G16-L19 PolarHBondContact O-N 2.76Å; E17-L19 PolarHBondContact O-N 3.37Å; L19-S23 PolarHBondContact O-N 3.3Å; L19-L30 HydrophobicContact CB-CD2 4.07Å; L19-L30 HydrophobicContact CD1-CD2 4.21Å; L19-I102 HydrophobicContact CB-CG2 4.23Å
20	L	94.3	Very high	93.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-68.6	-47.1	176.7	-72.6	172.1	0	0	0	111.2	G16 E17 K18 S23 G24 S28 L30 C44 L46 I51 I102	G16-L20 WeakPolarHBondContact O-CG 3.49Å; G16-L20 PolarHBondContact O-N 3.32Å; G16-L20 VanDerWaalsContact O-N 3.15Å; E17-L20 PolarHBondContact O-N 3.49Å; K18-L20 VanDerWaalsContact C-N 3.29Å; K18-L20 PolarHBondContact O-N 2.93Å; L20-S23 WeakPolarHBondContact O-CB 3.39Å; L20-S23 PolarHBondContact O-N 3.5Å; L20-G24 PolarHBondContact O-N 2.85Å; L20-S28 WeakPolarHBondContact CD2-O 3.48Å; L20-L30 HydrophobicContact CD1-CD2 4.42Å; L20-L30 HydrophobicContact CD1-CG 4.38Å; L20-L30 HydrophobicContact CD2-CD2 4.31Å; L20-L30 HydrophobicContact CD2-CG 4.38Å; L20-L30 HydrophobicContact CG-CD2 3.95Å; L20-L30 HydrophobicContact CG-CG 4.29Å; L20-C44 HydrophobicContact CD1-CB 3.59Å; L20-L46 HydrophobicContact CB-CB 4.28Å; L20-L46 HydrophobicContact CD2-CB 4.48Å; L20-L46 WeakPolarHBondContact O-CD2 3.41Å; L20-I51 HydrophobicContact CB-CG1 4.43Å; L20-I51 HydrophobicContact CD1-CG1 4.23Å; L20-I51 HydrophobicContact CD1-CG2 3.72Å; L20-I102 HydrophobicContact CD2-CG1 3.94Å
21	L	93.2	Very high	93.5	Very high	88 Å²	88	51.4 Å²	51.4	46%	0.461	28%	0.276	S	S	.	.	H	α-helix	trans	-63.6	-39.8	178.6	-69.7	170.6	0	0	0	112.3	E17 K18 S23 G24 L46 I51	E17-L21 WeakPolarHBondContact O-CB 3.26Å; E17-L21 VanDerWaalsContact O-CG 3.28Å; E17-L21 WeakPolarHBondContact O-CG 3.46Å; E17-L21 PolarHBondContact O-N 3.13Å; K18-L21 PolarHBondContact O-N 2.99Å; L21-S23 PolarHBondContact O-N 3.08Å; L21-G24 WeakPolarHBondContact O-CA 3.34Å; L21-G24 PolarHBondContact O-N 3.49Å; L21-L46 HydrophobicContact CD2-CD1 4.14Å; L21-I51 HydrophobicContact CD1-CD1 4.04Å; L21-I51 HydrophobicContact CD2-CD1 4.16Å; L21-I51 HydrophobicContact CG-CD1 3.84Å
22	D	92.9	Very high	93.5	Very high	114 Å²	114	50.1 Å²	50.1	61%	0.61	27%	0.269	S	S	*	.	H	α-helix	trans	-62.4	-32.1	175.9	-74.8	-5.9	0	0	0	111.3	K18	K18-D22 VanDerWaalsContact O-CB 3.3Å; K18-D22 WeakPolarHBondContact O-CB 3.35Å; K18-D22 PolarHBondContact O-N 3.13Å
23	S	91.6	Very high	93.6	Very high	40 Å²	40	48.9 Å²	48.9	28%	0.28	26%	0.26	S	S	.	.	H	α-helix	trans	-69.5	-36.8	172	-173.3	0	0	0	0	112.2	L19 L20 L21 L25 S28	L19-S23 PolarHBondContact O-N 3.3Å; L20-S23 WeakPolarHBondContact O-CB 3.39Å; L20-S23 PolarHBondContact O-N 3.5Å; L21-S23 PolarHBondContact O-N 3.08Å; S23-L25 WeakPolarHBondContact O-CG 3.47Å; S23-L25 PolarHBondContact O-N 2.88Å; S23-S28 PolarHBondContact OG-OG 3.29Å
24	G	90.4	Very high	93.6	Very high	56 Å²	56	43.9 Å²	43.9	58%	0.577	24%	0.244	S	C	*	.			trans	62.2	10.4	177.8	0	0	0	0	0	115.9	L20 L21	L20-G24 PolarHBondContact O-N 2.85Å; L21-G24 WeakPolarHBondContact O-CA 3.34Å; L21-G24 PolarHBondContact O-N 3.49Å
25	L	93.8	Very high	93.4	Very high	83 Å²	83	44.9 Å²	44.9	44%	0.435	25%	0.248	S	C	.	.			trans	-104.9	129	-177.9	-62.2	173.2	0	0	0	110.8	S23 G27 S28	S23-L25 WeakPolarHBondContact O-CG 3.47Å; S23-L25 PolarHBondContact O-N 2.88Å; L25-G27 PolarHBondContact O-N 2.97Å; L25-S28 WeakPolarHBondContact CB-OG 3.38Å; L25-S28 WeakPolarHBondContact O-CB 3.48Å; L25-S28 PolarHBondContact O-N 2.98Å; L25-S28 PolarHBondContact O-OG 3.19Å
26	D	94.2	Very high	93.1	Very high	67 Å²	67	47.8 Å²	47.8	36%	0.358	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	136	174	-82.4	-13.2	0	0	0	111.5	S28 H47 Q48 H100	D26-S28 VanDerWaalsContact C-N 3.28Å; D26-H47 WeakPolarHBondContact OD1-CA 3.16Å; D26-H47 IonicContact OD2-ND1 3.72Å; D26-Q48 PolarHBondContact OD1-N 3.34Å; D26-H100 PolarHBondContact O-CD2 2.83Å
27	G	93.5	Very high	92.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	8.8	-171.7	0	0	0	0	0	113.7	L25 L46 Q99 H100	L25-G27 PolarHBondContact O-N 2.97Å; G27-L46 PolarHBondContact N-O 2.91Å; G27-Q99 PolarHBondContact O-N 2.83Å; G27-H100 PolarHBondContact O-N 3.38Å
28	S	96.1	Very high	92.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	137.5	163.8	-62	0	0	0	0	110.6	L20 S23 L25 D26 V45 L46 H100	L20-S28 WeakPolarHBondContact CD2-O 3.48Å; S23-S28 PolarHBondContact OG-OG 3.29Å; L25-S28 WeakPolarHBondContact CB-OG 3.38Å; L25-S28 WeakPolarHBondContact O-CB 3.48Å; L25-S28 PolarHBondContact O-N 2.98Å; L25-S28 PolarHBondContact O-OG 3.19Å; D26-S28 VanDerWaalsContact C-N 3.28Å; S28-V45 CarbonylContact O-C 3.55Å; S28-V45 VanDerWaalsContact O-CA 3.32Å; S28-V45 WeakPolarHBondContact O-CA 3.32Å; S28-L46 PolarHBondContact O-N 2.89Å; S28-H100 CarbonylContact C-O 3.58Å; S28-H100 VanDerWaalsContact CA-O 3.26Å; S28-H100 WeakPolarHBondContact CA-O 3.49Å
29	Y	96.1	Very high	92.3	Very high	12 Å²	12	51 Å²	51	5%	0.047	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.8	-176.5	74.1	-79.6	0	0	0	114.1	V6 L43 C44 L84 L98 H100 P101 I102	V6-Y29 HydrophobicContact CB-CE2 4.27Å; V6-Y29 HydrophobicContact CG1-CE2 3.89Å; V6-Y29 HydrophobicContact CG2-CE2 4.22Å; Y29-L43 HydrophobicContact CD2-CD1 4Å; Y29-C44 WeakPolarHBondContact CA-O 3.49Å; Y29-C44 WeakPolarHBondContact CB-O 3.44Å; Y29-L84 HydrophobicContact CE2-CD2 4.34Å; Y29-L98 HydrophobicContact CD1-CB 3.77Å; Y29-L98 HydrophobicContact CD1-CD2 4.22Å; Y29-L98 HydrophobicContact CD1-CG 4.44Å; Y29-L98 HydrophobicContact CD2-CD1 4.05Å; Y29-L98 HydrophobicContact CD2-CD2 4.23Å; Y29-L98 HydrophobicContact CD2-CG 4.49Å; Y29-L98 HydrophobicContact CE1-CB 3.75Å; Y29-L98 HydrophobicContact CE2-CB 4.48Å; Y29-L98 HydrophobicContact CE2-CD1 4.06Å; Y29-L98 HydrophobicContact CG-CB 4.15Å; Y29-L98 HydrophobicContact CG-CD1 4.38Å; Y29-L98 HydrophobicContact CG-CD2 3.83Å; Y29-L98 HydrophobicContact CG-CG 4.33Å; Y29-H100 WeakPolarHBondContact CD1-O 3.49Å; Y29-H100 PolarHBondContact N-O 2.89Å; Y29-P101 VanDerWaalsContact CE1-CA 3.47Å; Y29-P101 HydrophobicContact CE1-CB 3.82Å; Y29-P101 HydrophobicContact CE1-CG 4.46Å; Y29-I102 PolarHBondContact O-N 2.62Å
30	L	95.2	Very high	92.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	161.5	172.4	63.1	83.1	0	0	0	111.7	I11 L19 L20 R32 C44 I102	I11-L30 HydrophobicContact CD1-CD1 4.26Å; L19-L30 HydrophobicContact CB-CD2 4.07Å; L19-L30 HydrophobicContact CD1-CD2 4.21Å; L20-L30 HydrophobicContact CD1-CD2 4.42Å; L20-L30 HydrophobicContact CD1-CG 4.38Å; L20-L30 HydrophobicContact CD2-CD2 4.31Å; L20-L30 HydrophobicContact CD2-CG 4.38Å; L20-L30 HydrophobicContact CG-CD2 3.95Å; L20-L30 HydrophobicContact CG-CG 4.29Å; L30-R32 HydrophobicContact CD1-CB 4.24Å; L30-R32 HydrophobicContact CD1-CG 4.31Å; L30-C44 HydrophobicContact CD1-CB 4.06Å; L30-C44 HydrophobicContact CG-CB 4.29Å; L30-C44 PolarHBondContact N-O 3.35Å; L30-C44 PolarHBondContact O-N 3.11Å; L30-I102 HydrophobicContact CB-CB 4.21Å
31	L	94.3	Very high	92.1	Very high	6 Å²	6	50 Å²	50	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.4	173.7	-165.5	74.1	0	0	0	109.4	L4 V6 Y7 H8 Y41 C42 L43 V80	L4-L31 HydrophobicContact CD1-CD2 3.98Å; V6-L31 PolarHBondContact O-N 3.04Å; Y7-L31 CarbonylContact C-O 3.53Å; Y7-L31 WeakPolarHBondContact CA-O 3.44Å; Y7-L31 HydrophobicContact CD2-CB 4.42Å; Y7-L31 HydrophobicContact CD2-CD2 4.11Å; Y7-L31 HydrophobicContact CD2-CG 4.27Å; H8-L31 PolarHBondContact N-O 3.22Å; L31-Y41 HydrophobicContact CD2-CD1 4.47Å; L31-C42 WeakPolarHBondContact CA-O 3.44Å; L31-L43 HydrophobicContact CD1-CB 3.98Å; L31-L43 HydrophobicContact CD1-CD1 4.5Å; L31-V80 HydrophobicContact CD2-CG2 4.19Å
32	R	94.2	Very high	92.2	Very high	11 Å²	11	46.1 Å²	46.1	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	167.3	175.8	66.2	179.7	-176.8	96.2	-6.7	111	G9 I11 L30 E35 Y41 C42	G9-R32 WeakPolarHBondContact O-CA 3.26Å; G9-R32 WeakPolarHBondContact O-CB 3.41Å; I11-R32 HydrophobicContact CD1-CB 4.21Å; I11-R32 HydrophobicContact CG1-CB 3.63Å; I11-R32 HydrophobicContact CG1-CG 4.47Å; L30-R32 HydrophobicContact CD1-CB 4.24Å; L30-R32 HydrophobicContact CD1-CG 4.31Å; R32-E35 IonicContact CZ-OE2 3.65Å; R32-E35 IonicContact NH1-OE2 3.77Å; R32-E35 PolarHBondContact NH1-OE2 3.02Å; R32-E35 IonicContact NH2-OE2 2.71Å; R32-Y41 CarbonylContact O-C 3.54Å; R32-Y41 WeakPolarHBondContact O-CA 3.49Å; R32-C42 HydrophobicContact CG-CB 3.79Å; R32-C42 PolarHBondContact N-O 2.81Å; R32-C42 PolarHBondContact O-N 2.83Å
33	D	93.3	Very high	92.3	Very high	40 Å²	40	40.7 Å²	40.7	21%	0.214	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	147.3	170.2	-65.8	-33.9	0	0	0	110.9	Y7 G9 S10 Y41	Y7-D33 PolarHBondContact OH-OD1 3.35Å; Y7-D33 PolarHBondContact OH-OD2 3.35Å; Y7-D33 VanDerWaalsContact OH-OD2 3.1Å; G9-D33 PolarHBondContact O-N 3.18Å; S10-D33 PolarHBondContact N-OD2 3.02Å; D33-Y41 WeakPolarHBondContact OD1-CD1 3.3Å; D33-Y41 WeakPolarHBondContact OD1-CE1 3.48Å
34	S	91.8	Very high	92.5	Very high	16 Å²	16	38.9 Å²	38.9	11%	0.112	24%	0.243	C	C	.	.			trans	-72.5	126.7	169	-179.2	0	0	0	0	109.7	S36 I37 V40	S34-S36 VanDerWaalsContact C-N 3.25Å; S34-S36 PolarHBondContact O-N 3.37Å; S34-S36 PolarHBondContact OG-N 3.29Å; S34-S36 PolarHBondContact OG-OG 2.8Å; S34-I37 WeakPolarHBondContact CB-O 3.18Å; S34-I37 PolarHBondContact OG-N 3.33Å; S34-V40 WeakPolarHBondContact CB-O 3.32Å; S34-V40 PolarHBondContact N-O 2.83Å
35	E	89.3	Confident	92.7	Very high	115 Å²	115	36.2 Å²	36.2	54%	0.537	22%	0.216	S	C	.	.	S	Bend	trans	-70.7	-23.6	177.6	-70.1	164.8	90.3	0	0	112.6	R13 R32	R13-E35 WeakPolarHBondContact CB-OE2 3.38Å; R13-E35 PolarHBondContact N-OE2 3.18Å; R32-E35 IonicContact CZ-OE2 3.65Å; R32-E35 IonicContact NH1-OE2 3.77Å; R32-E35 PolarHBondContact NH1-OE2 3.02Å; R32-E35 IonicContact NH2-OE2 2.71Å
36	S	87.4	Confident	92.8	Very high	100 Å²	100	32.5 Å²	32.5	70%	0.699	20%	0.197	S	C	*	.	S	Bend	trans	-103.2	-24	-174.8	55.7	0	0	0	0	114.2	S34	S34-S36 VanDerWaalsContact C-N 3.25Å; S34-S36 PolarHBondContact O-N 3.37Å; S34-S36 PolarHBondContact OG-N 3.29Å; S34-S36 PolarHBondContact OG-OG 2.8Å
37	I	87.9	Confident	92.9	Very high	77 Å²	77	30.8 Å²	30.8	40%	0.395	19%	0.186	S	C	.	.	S	Bend	trans	-131.4	106.8	-172.5	-50.9	174.5	0	0	0	110.1	S34 G39 V40	S34-I37 WeakPolarHBondContact CB-O 3.18Å; S34-I37 PolarHBondContact OG-N 3.33Å; I37-G39 PolarHBondContact O-N 3.15Å; I37-V40 HydrophobicContact CB-CB 4.05Å; I37-V40 HydrophobicContact CB-CG2 3.93Å; I37-V40 HydrophobicContact CG2-CB 4.1Å; I37-V40 HydrophobicContact CG2-CG2 3.43Å; I37-V40 VanDerWaalsContact CG2-CG2 3.43Å; I37-V40 PolarHBondContact O-N 3.36Å
38	P	87.9	Confident	92.9	Very high	125 Å²	125	37.2 Å²	37.2	81%	0.812	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	136.4	175.3	-25	34.4	0	0	0	112.3	V40	P38-V40 PolarHBondContact O-N 3.05Å
39	G	86.5	Confident	92.6	Very high	55 Å²	55	39.7 Å²	39.7	57%	0.567	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	1.1	179.5	0	0	0	0	0	115.1	I37	I37-G39 PolarHBondContact O-N 3.15Å
40	V	92.1	Very high	92.5	Very high	22 Å²	22	47 Å²	47	13%	0.133	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.8	169.9	179.4	0	0	0	0	109.3	S34 I37 P38 R55	S34-V40 WeakPolarHBondContact CB-O 3.32Å; S34-V40 PolarHBondContact N-O 2.83Å; I37-V40 HydrophobicContact CB-CB 4.05Å; I37-V40 HydrophobicContact CB-CG2 3.93Å; I37-V40 HydrophobicContact CG2-CB 4.1Å; I37-V40 HydrophobicContact CG2-CG2 3.43Å; I37-V40 VanDerWaalsContact CG2-CG2 3.43Å; I37-V40 PolarHBondContact O-N 3.36Å; P38-V40 PolarHBondContact O-N 3.05Å; V40-R55 HydrophobicContact CG1-CB 4.03Å; V40-R55 HydrophobicContact CG1-CG 4.24Å
41	Y	93.4	Very high	92.5	Very high	22 Å²	22	48.8 Å²	48.8	9%	0.086	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	152.5	176.9	-58.4	-89.2	0	0	0	109.7	M1 Y7 L31 R32 D33 R55 V56 W64	M1-Y41 WeakPolarHBondContact CE-OH 3.39Å; Y7-Y41 HydrophobicContact CD2-CD1 4.47Å; Y7-Y41 AromaticContact CE2-CD1 3.82Å; Y7-Y41 HydrophobicContact CE2-CD1 3.82Å; Y7-Y41 AromaticContact CE2-CE1 3.72Å; Y7-Y41 HydrophobicContact CE2-CE1 3.72Å; L31-Y41 HydrophobicContact CD2-CD1 4.47Å; R32-Y41 CarbonylContact O-C 3.54Å; R32-Y41 WeakPolarHBondContact O-CA 3.49Å; D33-Y41 WeakPolarHBondContact OD1-CD1 3.3Å; D33-Y41 WeakPolarHBondContact OD1-CE1 3.48Å; Y41-R55 CarbonylContact O-C 3.55Å; Y41-R55 WeakPolarHBondContact O-CA 3.45Å; Y41-V56 WeakPolarHBondContact CB-O 3.49Å; Y41-V56 PolarHBondContact N-O 2.85Å; Y41-V56 PolarHBondContact O-N 3.35Å; Y41-W64 AromaticContact CD2-CH2 3.9Å; Y41-W64 HydrophobicContact CD2-CH2 3.9Å; Y41-W64 AromaticContact CD2-CZ3 3.5Å; Y41-W64 HydrophobicContact CD2-CZ3 3.5Å; Y41-W64 VanDerWaalsContact CD2-CZ3 3.5Å; Y41-W64 AromaticContact CE2-CH2 3.49Å; Y41-W64 HydrophobicContact CE2-CH2 3.49Å; Y41-W64 VanDerWaalsContact CE2-CH2 3.49Å; Y41-W64 AromaticContact CE2-CZ3 3.58Å; Y41-W64 HydrophobicContact CE2-CZ3 3.58Å; Y41-W64 HydrophobicContact CG-CZ3 4.43Å
42	C	94.4	Very high	92.5	Very high	7 Å²	7	52.8 Å²	52.8	5%	0.047	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	113.6	174.6	-68.9	0	0	0	0	108.3	L31 R32 T53	L31-C42 WeakPolarHBondContact CA-O 3.44Å; R32-C42 HydrophobicContact CG-CB 3.79Å; R32-C42 PolarHBondContact N-O 2.81Å; R32-C42 PolarHBondContact O-N 2.83Å; C42-T53 HydrophobicContact CB-CG2 3.79Å
43	L	94.9	Very high	92.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	108.3	167.1	173.1	64.6	0	0	0	107.8	Y29 L31 V45 T53 Y54 V56 L84 F87 L98	Y29-L43 HydrophobicContact CD2-CD1 4Å; L31-L43 HydrophobicContact CD1-CB 3.98Å; L31-L43 HydrophobicContact CD1-CD1 4.5Å; L43-V45 HydrophobicContact CG-CG2 4.17Å; L43-T53 WeakPolarHBondContact O-CA 3.37Å; L43-Y54 PolarHBondContact N-O 3.27Å; L43-Y54 PolarHBondContact O-N 3.32Å; L43-V56 HydrophobicContact CB-CG2 4.01Å; L43-L84 HydrophobicContact CD1-CD2 3.86Å; L43-L84 HydrophobicContact CD2-CD2 4.35Å; L43-F87 HydrophobicContact CD2-CD2 3.96Å; L43-F87 HydrophobicContact CD2-CE2 4.31Å; L43-L98 HydrophobicContact CD1-CD1 4.46Å; L43-L98 HydrophobicContact CD2-CD1 4.35Å
44	C	95.4	Very high	92.4	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.02	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.4	179.8	-60.9	0	0	0	0	109.4	L20 Y29 L30 I51 Y52	L20-C44 HydrophobicContact CD1-CB 3.59Å; Y29-C44 WeakPolarHBondContact CA-O 3.49Å; Y29-C44 WeakPolarHBondContact CB-O 3.44Å; L30-C44 HydrophobicContact CD1-CB 4.06Å; L30-C44 HydrophobicContact CG-CB 4.29Å; L30-C44 PolarHBondContact N-O 3.35Å; L30-C44 PolarHBondContact O-N 3.11Å; C44-I51 HydrophobicContact CB-CG2 4.12Å; C44-Y52 CarbonylContact C-O 3.59Å; C44-Y52 WeakPolarHBondContact CA-O 3.28Å
45	V	95.8	Very high	92.4	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	128.1	-176.8	-170.9	0	0	0	0	109.8	S28 L43 I51 Y52 Y54 T96 L98	S28-V45 CarbonylContact O-C 3.55Å; S28-V45 VanDerWaalsContact O-CA 3.32Å; S28-V45 WeakPolarHBondContact O-CA 3.32Å; L43-V45 HydrophobicContact CG-CG2 4.17Å; V45-I51 WeakPolarHBondContact O-CA 3.3Å; V45-Y52 PolarHBondContact N-O 2.75Å; V45-Y52 PolarHBondContact O-N 3.02Å; V45-Y54 HydrophobicContact CB-CE2 4.42Å; V45-Y54 HydrophobicContact CG2-CD2 4.12Å; V45-Y54 HydrophobicContact CG2-CE2 4.02Å; V45-T96 HydrophobicContact CG1-CG2 3.74Å; V45-L98 HydrophobicContact CG1-CD2 4.19Å; V45-L98 HydrophobicContact CG2-CD2 3.57Å
46	L	96.1	Very high	92.6	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.026	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.4	173.5	-177.8	64.2	0	0	0	110.4	L20 L21 G27 S28 I51	L20-L46 HydrophobicContact CB-CB 4.28Å; L20-L46 HydrophobicContact CD2-CB 4.48Å; L20-L46 WeakPolarHBondContact O-CD2 3.41Å; L21-L46 HydrophobicContact CD2-CD1 4.14Å; G27-L46 PolarHBondContact N-O 2.91Å; S28-L46 PolarHBondContact O-N 2.89Å; L46-I51 HydrophobicContact CD1-CG1 4.13Å
47	H	95.2	Very high	92.9	Very high	30 Å²	30	51.8 Å²	51.8	14%	0.139	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	126.5	168.5	-172.1	58.9	0	0	0	111.1	D26 G49 Y50 Y52 V95 T96	D26-H47 WeakPolarHBondContact OD1-CA 3.16Å; D26-H47 IonicContact OD2-ND1 3.72Å; H47-G49 PolarHBondContact O-N 3.23Å; H47-Y50 PolarHBondContact N-O 3.26Å; H47-Y50 PolarHBondContact O-N 3.15Å; H47-Y52 HydrophobicContact CB-CD2 4.09Å; H47-Y52 HydrophobicContact CB-CE2 3.91Å; H47-V95 HydrophobicContact CB-CG1 3.87Å; H47-V95 HydrophobicContact CB-CG2 4.17Å; H47-V95 WeakPolarHBondContact CD2-CG2 2.85Å; H47-T96 HydrophobicContact CB-CG2 3.97Å
48	Q	93.6	Very high	93.1	Very high	136 Å²	136	54 Å²	54	64%	0.636	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	38.2	177.6	-61	-179.8	14.1	0	0	113.3	D26 Y50	D26-Q48 PolarHBondContact OD1-N 3.34Å; Q48-Y50 VanDerWaalsContact C-N 3.26Å; Q48-Y50 WeakPolarHBondContact O-CD2 3.44Å; Q48-Y50 PolarHBondContact O-N 3.43Å
49	G	90.1	Very high	93.1	Very high	52 Å²	52	49.5 Å²	49.5	54%	0.536	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	0.2	-179	0	0	0	0	0	115.2	H47	H47-G49 PolarHBondContact O-N 3.23Å
50	Y	94	Very high	93.2	Very high	164 Å²	164	56.9 Å²	56.9	64%	0.643	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	145.1	175.2	-66.5	-84.7	0	0	0	111.6	H47 Q48	H47-Y50 PolarHBondContact N-O 3.26Å; H47-Y50 PolarHBondContact O-N 3.15Å; Q48-Y50 VanDerWaalsContact C-N 3.26Å; Q48-Y50 WeakPolarHBondContact O-CD2 3.44Å; Q48-Y50 PolarHBondContact O-N 3.43Å
51	I	94.5	Very high	92.9	Very high	38 Å²	38	60.2 Å²	60.2	20%	0.195	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	111.6	179.2	-62.9	136.8	0	0	0	109.2	E17 L20 L21 C44 V45 L46	E17-I51 HydrophobicContact CB-CD1 3.51Å; E17-I51 HydrophobicContact CG-CB 4.3Å; E17-I51 HydrophobicContact CG-CD1 3.5Å; E17-I51 HydrophobicContact CG-CG1 4.33Å; E17-I51 HydrophobicContact CG-CG2 4.14Å; L20-I51 HydrophobicContact CB-CG1 4.43Å; L20-I51 HydrophobicContact CD1-CG1 4.23Å; L20-I51 HydrophobicContact CD1-CG2 3.72Å; L21-I51 HydrophobicContact CD1-CD1 4.04Å; L21-I51 HydrophobicContact CD2-CD1 4.16Å; L21-I51 HydrophobicContact CG-CD1 3.84Å; C44-I51 HydrophobicContact CB-CG2 4.12Å; V45-I51 WeakPolarHBondContact O-CA 3.3Å; L46-I51 HydrophobicContact CD1-CG1 4.13Å
52	Y	93.9	Very high	92.7	Very high	90 Å²	90	60.6 Å²	60.6	35%	0.353	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.6	177.9	-67.1	-97.8	0	0	0	109.3	C44 V45 H47 V95	C44-Y52 CarbonylContact C-O 3.59Å; C44-Y52 WeakPolarHBondContact CA-O 3.28Å; V45-Y52 PolarHBondContact N-O 2.75Å; V45-Y52 PolarHBondContact O-N 3.02Å; H47-Y52 HydrophobicContact CB-CD2 4.09Å; H47-Y52 HydrophobicContact CB-CE2 3.91Å; Y52-V95 HydrophobicContact CD1-CB 4.2Å; Y52-V95 HydrophobicContact CD1-CG1 4.27Å; Y52-V95 HydrophobicContact CD1-CG2 4.36Å; Y52-V95 HydrophobicContact CD2-CB 4.31Å; Y52-V95 HydrophobicContact CD2-CG1 3.69Å; Y52-V95 HydrophobicContact CD2-CG2 4.24Å; Y52-V95 HydrophobicContact CE1-CB 4.33Å; Y52-V95 HydrophobicContact CE1-CG2 4.01Å; Y52-V95 HydrophobicContact CE2-CB 4.43Å; Y52-V95 HydrophobicContact CE2-CG1 4.17Å; Y52-V95 HydrophobicContact CE2-CG2 3.88Å; Y52-V95 HydrophobicContact CG-CB 4.18Å; Y52-V95 HydrophobicContact CG-CG1 3.74Å; Y52-V95 HydrophobicContact CG-CG2 4.47Å
53	T	93.1	Very high	92.6	Very high	62 Å²	62	61.6 Å²	61.6	38%	0.38	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.1	-179.6	-60.3	0	0	0	0	110.5	C42 L43	C42-T53 HydrophobicContact CB-CG2 3.79Å; L43-T53 WeakPolarHBondContact O-CA 3.37Å
54	Y	92.7	Very high	92.4	Very high	42 Å²	42	63 Å²	63	17%	0.165	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.4	176.1	-57.5	-85.9	0	0	0	109.6	L43 V45 I94 V95	L43-Y54 PolarHBondContact N-O 3.27Å; L43-Y54 PolarHBondContact O-N 3.32Å; V45-Y54 HydrophobicContact CB-CE2 4.42Å; V45-Y54 HydrophobicContact CG2-CD2 4.12Å; V45-Y54 HydrophobicContact CG2-CE2 4.02Å; Y54-I94 HydrophobicContact CD1-CG2 4.27Å; Y54-I94 HydrophobicContact CE1-CB 4.31Å; Y54-I94 HydrophobicContact CE1-CG2 3.94Å; Y54-I94 HydrophobicContact CE2-CB 4.24Å; Y54-I94 HydrophobicContact CE2-CG2 4.24Å; Y54-V95 WeakPolarHBondContact OH-CB 3.42Å; Y54-V95 PolarHBondContact OH-N 2.9Å
55	R	92.8	Very high	92.3	Very high	115 Å²	115	63 Å²	63	43%	0.434	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.7	175.6	-71.5	-173.3	-70.6	-110	0.4	109.7	V40 Y41 A66 E67	V40-R55 HydrophobicContact CG1-CB 4.03Å; V40-R55 HydrophobicContact CG1-CG 4.24Å; Y41-R55 CarbonylContact O-C 3.55Å; Y41-R55 WeakPolarHBondContact O-CA 3.45Å; R55-A66 CarbonylContact O-C 3.59Å; R55-A66 VanDerWaalsContact O-CA 3.31Å; R55-A66 WeakPolarHBondContact O-CA 3.48Å; R55-E67 HydrophobicContact CB-CB 4.07Å; R55-E67 IonicContact CZ-OE1 3.32Å; R55-E67 IonicContact CZ-OE2 3.67Å; R55-E67 IonicContact NE-OE1 2.66Å; R55-E67 IonicContact NE-OE2 2.82Å; R55-E67 PolarHBondContact NE-OE2 3.42Å; R55-E67 VanDerWaalsContact NH2-CD 3.27Å; R55-E67 IonicContact NH2-OE1 3.17Å; R55-E67 PolarHBondContact NH2-OE1 3.3Å; R55-E67 IonicContact NH2-OE2 3.83Å; R55-E67 PolarHBondContact NH2-OE2 3.49Å; R55-E67 VanDerWaalsContact NH2-OE2 3.17Å; R55-E67 PolarHBondContact O-N 3.05Å
56	V	93.4	Very high	92.1	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.7	179.3	177.9	0	0	0	0	107.8	Y41 L43 W64 S65 A66 L83	Y41-V56 WeakPolarHBondContact CB-O 3.49Å; Y41-V56 PolarHBondContact N-O 2.85Å; Y41-V56 PolarHBondContact O-N 3.35Å; L43-V56 HydrophobicContact CB-CG2 4.01Å; V56-W64 HydrophobicContact CG1-CE3 3.86Å; V56-W64 HydrophobicContact CG1-CZ3 4.28Å; V56-S65 WeakPolarHBondContact CA-O 3.31Å; V56-A66 HydrophobicContact CG2-CB 4.19Å; V56-L83 HydrophobicContact CG1-CD1 3.82Å; V56-L83 HydrophobicContact CG1-CD2 4.49Å; V56-L83 HydrophobicContact CG2-CD2 4.36Å
57	S	92.8	Very high	91.7	Very high	42 Å²	42	68 Å²	68	29%	0.294	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	158.1	-178.5	65	0	0	0	0	111.5	S65	S57-S65 PolarHBondContact N-O 3.16Å; S57-S65 PolarHBondContact O-N 3.3Å
58	K	91.6	Very high	91	Very high	124 Å²	124	69.2 Å²	69.2	54%	0.539	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.1	171.3	-163.1	177.2	-177.3	-172.6	0	108.5	G62 S63 W64	K58-G62 WeakPolarHBondContact CE-O 3.48Å; K58-S63 CarbonylContact C-O 3.59Å; K58-W64 HydrophobicContact CB-CD2 4.43Å; K58-W64 HydrophobicContact CB-CE3 4.46Å; K58-W64 HydrophobicContact CB-CZ2 4.5Å; K58-W64 HydrophobicContact CD-CZ2 4.34Å
59	T	89.4	Confident	90.3	Very high	30 Å²	30	65.7 Å²	65.7	18%	0.184	36%	0.357	C	S	.	.			trans	-68.3	160.8	173.4	61.7	0	0	0	0	111.1	A61 G62 S63 L76	T59-A61 PolarHBondContact O-N 3.21Å; T59-G62 WeakPolarHBondContact O-CA 3.45Å; T59-G62 PolarHBondContact O-N 3.44Å; T59-S63 WeakPolarHBondContact CB-O 3.37Å; T59-S63 WeakPolarHBondContact CG2-O 3.29Å; T59-S63 PolarHBondContact N-O 3.06Å; T59-S63 WeakPolarHBondContact OG1-CA 3.35Å; T59-S63 PolarHBondContact OG1-N 2.85Å; T59-S63 VanDerWaalsContact OG1-N 3.09Å; T59-S63 PolarHBondContact OG1-O 3.12Å; T59-L76 HydrophobicContact CG2-CD2 4.03Å
60	E	87.1	Confident	89.6	Confident	209 Å²	209	69.8 Å²	69.8	98%	0.977	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.7	176.2	-63.2	-179.4	158.3	0	0	112.5	G62	E60-G62 PolarHBondContact O-N 2.99Å; E60-G62 VanDerWaalsContact O-N 3.1Å
61	A	87.6	Confident	88.7	Confident	92 Å²	92	66.3 Å²	66.3	76%	0.76	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	2.1	174.2	0	0	0	0	0	113.8	T59 S63	T59-A61 PolarHBondContact O-N 3.21Å; A61-S63 VanDerWaalsContact C-N 3.32Å; A61-S63 PolarHBondContact O-N 2.67Å
62	G	88	Confident	88.1	Confident	30 Å²	30	68.4 Å²	68.4	31%	0.309	40%	0.402	S	S	.	.	S	Bend	trans	82.5	2.7	177	0	0	0	0	0	115.5	K58 T59 E60	K58-G62 WeakPolarHBondContact CE-O 3.48Å; T59-G62 WeakPolarHBondContact O-CA 3.45Å; T59-G62 PolarHBondContact O-N 3.44Å; E60-G62 PolarHBondContact O-N 2.99Å; E60-G62 VanDerWaalsContact O-N 3.1Å
63	S	92.4	Very high	87.4	Confident	28 Å²	28	72 Å²	72	20%	0.196	42%	0.422	C	S	.	.			trans	-86.9	149.8	176.5	-63.4	0	0	0	0	111.6	K58 T59 A61 F77	K58-S63 CarbonylContact C-O 3.59Å; T59-S63 WeakPolarHBondContact CB-O 3.37Å; T59-S63 WeakPolarHBondContact CG2-O 3.29Å; T59-S63 PolarHBondContact N-O 3.06Å; T59-S63 WeakPolarHBondContact OG1-CA 3.35Å; T59-S63 PolarHBondContact OG1-N 2.85Å; T59-S63 VanDerWaalsContact OG1-N 3.09Å; T59-S63 PolarHBondContact OG1-O 3.12Å; A61-S63 VanDerWaalsContact C-N 3.32Å; A61-S63 PolarHBondContact O-N 2.67Å; S63-F77 CarbonylContact C-O 3.54Å
64	W	92.1	Very high	86.9	Confident	29 Å²	29	75.7 Å²	75.7	11%	0.11	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	139.9	176.3	-69.1	86.4	0	0	0	111.6	Y41 V56 K58 L76 F77 V80 L83	Y41-W64 AromaticContact CD2-CH2 3.9Å; Y41-W64 HydrophobicContact CD2-CH2 3.9Å; Y41-W64 AromaticContact CD2-CZ3 3.5Å; Y41-W64 HydrophobicContact CD2-CZ3 3.5Å; Y41-W64 VanDerWaalsContact CD2-CZ3 3.5Å; Y41-W64 AromaticContact CE2-CH2 3.49Å; Y41-W64 HydrophobicContact CE2-CH2 3.49Å; Y41-W64 VanDerWaalsContact CE2-CH2 3.49Å; Y41-W64 AromaticContact CE2-CZ3 3.58Å; Y41-W64 HydrophobicContact CE2-CZ3 3.58Å; Y41-W64 HydrophobicContact CG-CZ3 4.43Å; V56-W64 HydrophobicContact CG1-CE3 3.86Å; V56-W64 HydrophobicContact CG1-CZ3 4.28Å; K58-W64 HydrophobicContact CB-CD2 4.43Å; K58-W64 HydrophobicContact CB-CE3 4.46Å; K58-W64 HydrophobicContact CB-CZ2 4.5Å; K58-W64 HydrophobicContact CD-CZ2 4.34Å; W64-L76 CarbonylContact O-C 3.58Å; W64-L76 WeakPolarHBondContact O-CA 3.29Å; W64-F77 HydrophobicContact CB-CB 4.38Å; W64-F77 WeakPolarHBondContact CB-O 3.47Å; W64-F77 PolarHBondContact N-O 2.83Å; W64-F77 PolarHBondContact O-N 2.99Å; W64-V80 HydrophobicContact CD2-CB 3.84Å; W64-V80 HydrophobicContact CE3-CB 4.11Å; W64-V80 HydrophobicContact CE3-CG2 4.34Å; W64-V80 HydrophobicContact CG-CB 4.22Å; W64-V80 HydrophobicContact CH2-CB 4.48Å; W64-V80 HydrophobicContact CZ2-CB 4.26Å; W64-V80 HydrophobicContact CZ2-CG1 4.47Å; W64-V80 HydrophobicContact CZ3-CB 4.4Å; W64-V80 HydrophobicContact CZ3-CG2 4.46Å; W64-L83 HydrophobicContact CB-CD1 4.35Å
65	S	91.8	Very high	86.7	Confident	3 Å²	3	78.5 Å²	78.5	2%	0.021	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.6	173.9	56.3	0	0	0	0	111.6	V56 S57 R75	V56-S65 WeakPolarHBondContact CA-O 3.31Å; S57-S65 PolarHBondContact N-O 3.16Å; S57-S65 PolarHBondContact O-N 3.3Å; S65-R75 WeakPolarHBondContact CB-O 3.46Å
66	A	91.4	Very high	86.6	Confident	7 Å²	7	78 Å²	78	6%	0.058	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	147.3	163.4	0	0	0	0	0	109.7	R55 V56 T68 L83 F87	R55-A66 CarbonylContact O-C 3.59Å; R55-A66 VanDerWaalsContact O-CA 3.31Å; R55-A66 WeakPolarHBondContact O-CA 3.48Å; V56-A66 HydrophobicContact CG2-CB 4.19Å; A66-T68 PolarHBondContact O-N 3.32Å; A66-L83 HydrophobicContact CB-CD1 4.48Å; A66-F87 HydrophobicContact CB-CE2 3.89Å; A66-F87 HydrophobicContact CB-CZ 3.77Å
67	E	88.2	Confident	86.5	Confident	105 Å²	105	79.1 Å²	79.1	49%	0.491	45%	0.449	S	S	.	.			trans	-68.5	128.7	169.6	-169.6	173.3	151.2	0	0	109.4	R55	R55-E67 HydrophobicContact CB-CB 4.07Å; R55-E67 IonicContact CZ-OE1 3.32Å; R55-E67 IonicContact CZ-OE2 3.67Å; R55-E67 IonicContact NE-OE1 2.66Å; R55-E67 IonicContact NE-OE2 2.82Å; R55-E67 PolarHBondContact NE-OE2 3.42Å; R55-E67 VanDerWaalsContact NH2-CD 3.27Å; R55-E67 IonicContact NH2-OE1 3.17Å; R55-E67 PolarHBondContact NH2-OE1 3.3Å; R55-E67 IonicContact NH2-OE2 3.83Å; R55-E67 PolarHBondContact NH2-OE2 3.49Å; R55-E67 VanDerWaalsContact NH2-OE2 3.17Å; R55-E67 PolarHBondContact O-N 3.05Å
68	T	81.2	Confident	86.4	Confident	54 Å²	54	87.5 Å²	87.5	33%	0.331	48%	0.475	S	S	.	.			trans	-116.5	154.8	-178.1	55.4	0	0	0	0	109.5	A66 V72	A66-T68 PolarHBondContact O-N 3.32Å; T68-V72 HydrophobicContact CG2-CG1 4.19Å; T68-V72 PolarHBondContact OG1-O 2.82Å
69	A	77.8	Confident	86.3	Confident	62 Å²	62	86.4 Å²	86.4	51%	0.512	47%	0.47	S	S	.	.			trans	-57.8	152.3	173.9	0	0	0	0	0	111.5	G71 V72	A69-G71 PolarHBondContact O-N 2.71Å; A69-V72 HydrophobicContact CB-CG2 4.17Å; A69-V72 WeakPolarHBondContact O-CB 3.48Å; A69-V72 PolarHBondContact O-N 2.8Å
70	P	75.8	Confident	86.3	Confident	139 Å²	139	85.4 Å²	85.4	90%	0.903	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	130.1	174	-25.2	34.1	0	0	0	111.4
71	G	75.6	Confident	86.4	Confident	90 Å²	90	80.1 Å²	80.1	93%	0.928	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	-10.2	-178.4	0	0	0	0	0	115.4	A69	A69-G71 PolarHBondContact O-N 2.71Å
72	V	80.7	Confident	86.6	Confident	82 Å²	82	79.3 Å²	79.3	50%	0.497	42%	0.422	S	S	.	.	S	Bend	trans	-87.2	132.2	172.8	179	0	0	0	0	109.9	T68 A69 R74	T68-V72 HydrophobicContact CG2-CG1 4.19Å; T68-V72 PolarHBondContact OG1-O 2.82Å; A69-V72 HydrophobicContact CB-CG2 4.17Å; A69-V72 WeakPolarHBondContact O-CB 3.48Å; A69-V72 PolarHBondContact O-N 2.8Å; V72-R74 PolarHBondContact O-N 2.81Å; V72-R74 VanDerWaalsContact O-N 3.16Å
73	H	79	Confident	86.8	Confident	167 Å²	167	78 Å²	78	77%	0.773	41%	0.407	S	S	*	.			trans	-67.1	115.5	-180	-163	82.8	0	0	0	111	R75	H73-R75 PolarHBondContact O-N 2.92Å
74	R	84	Confident	86.8	Confident	139 Å²	139	77 Å²	77	53%	0.525	40%	0.4	S	S	.	.			trans	-69.2	127.4	179.2	-170.3	171.2	72.3	-151	1.9	110.3	V72	V72-R74 PolarHBondContact O-N 2.81Å; V72-R74 VanDerWaalsContact O-N 3.16Å
75	R	88.8	Confident	86.8	Confident	101 Å²	101	78 Å²	78	38%	0.381	41%	0.41	S	S	.	.			trans	-91.2	136.2	178.2	-65.2	173.7	67.5	-168.7	8.8	110.8	S65 H73 F77	S65-R75 WeakPolarHBondContact CB-O 3.46Å; H73-R75 PolarHBondContact O-N 2.92Å; R75-F77 HydrophobicContact CB-CD2 4.42Å; R75-F77 HydrophobicContact CB-CE2 3.57Å; R75-F77 HydrophobicContact CB-CZ 3.83Å
76	L	90.6	Very high	86.8	Confident	103 Å²	103	78.4 Å²	78.4	54%	0.539	41%	0.413	S	S	.	.			trans	-106.5	130.8	177.9	-58.8	-178.6	0	0	0	109.8	T59 W64	T59-L76 HydrophobicContact CG2-CD2 4.03Å; W64-L76 CarbonylContact O-C 3.58Å; W64-L76 WeakPolarHBondContact O-CA 3.29Å
77	F	90.8	Very high	86.8	Confident	25 Å²	25	78.7 Å²	78.7	11%	0.11	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-124.1	136.4	-179.7	-59.9	-87.6	0	0	0	110.2	S63 W64 R75 K79 N82 L83 A86	S63-F77 CarbonylContact C-O 3.54Å; W64-F77 HydrophobicContact CB-CB 4.38Å; W64-F77 WeakPolarHBondContact CB-O 3.47Å; W64-F77 PolarHBondContact N-O 2.83Å; W64-F77 PolarHBondContact O-N 2.99Å; R75-F77 HydrophobicContact CB-CD2 4.42Å; R75-F77 HydrophobicContact CB-CE2 3.57Å; R75-F77 HydrophobicContact CB-CZ 3.83Å; F77-K79 PolarHBondContact O-N 2.84Å; F77-N82 HydrophobicContact CB-CB 4.46Å; F77-N82 HydrophobicContact CD1-CB 4.25Å; F77-L83 HydrophobicContact CB-CB 4.04Å; F77-L83 HydrophobicContact CD1-CB 4.39Å; F77-L83 HydrophobicContact CD2-CB 3.61Å; F77-L83 HydrophobicContact CD2-CD1 3.87Å; F77-L83 HydrophobicContact CD2-CG 3.86Å; F77-L83 HydrophobicContact CE2-CB 4.08Å; F77-L83 HydrophobicContact CE2-CD1 4.27Å; F77-L83 HydrophobicContact CE2-CG 4.01Å; F77-L83 HydrophobicContact CG-CB 3.76Å; F77-A86 HydrophobicContact CE1-CB 3.49Å; F77-A86 VanDerWaalsContact CE1-CB 3.49Å; F77-A86 HydrophobicContact CZ-CB 3.65Å
78	R	90	Very high	87	Confident	219 Å²	219	78 Å²	78	83%	0.826	41%	0.409	S	S	*	.	S	Bend	trans	-65.4	-30.8	178.7	-65.2	-174.8	-178.7	178.2	0.2	113
79	K	89.9	Confident	87.6	Confident	100 Å²	100	81.6 Å²	81.6	44%	0.435	42%	0.421	S	S	.	.	S	Bend	trans	-132.5	145.4	-177.6	-65.3	-176.6	169.4	-152.2	0	110.1	E2 F77 H81 N82 L83	E2-K79 VanDerWaalsContact OE1-CD 3.3Å; E2-K79 WeakPolarHBondContact OE1-CD 3.33Å; E2-K79 VanDerWaalsContact OE1-CE 3.28Å; E2-K79 WeakPolarHBondContact OE1-CE 3.42Å; E2-K79 IonicContact OE1-NZ 2.75Å; E2-K79 PolarHBondContact OE1-NZ 3.49Å; F77-K79 PolarHBondContact O-N 2.84Å; K79-H81 PolarHBondContact O-N 3.37Å; K79-N82 WeakPolarHBondContact O-CB 3.28Å; K79-N82 PolarHBondContact O-N 3.14Å; K79-N82 VanDerWaalsContact O-N 3.11Å; K79-L83 PolarHBondContact O-N 2.98Å
80	V	89.5	Confident	88.1	Confident	10 Å²	10	82.8 Å²	82.8	6%	0.061	42%	0.423	C	S	.	.	H	α-helix	trans	-60.5	-35.1	174.5	57.4	0	0	0	0	111.7	L4 L31 W64 N82 L83 L84	L4-V80 HydrophobicContact CD1-CB 4.38Å; L4-V80 HydrophobicContact CD1-CG1 3.59Å; L4-V80 HydrophobicContact CD1-CG2 3.9Å; L4-V80 HydrophobicContact CG-CG1 4.31Å; L31-V80 HydrophobicContact CD2-CG2 4.19Å; W64-V80 HydrophobicContact CD2-CB 3.84Å; W64-V80 HydrophobicContact CE3-CB 4.11Å; W64-V80 HydrophobicContact CE3-CG2 4.34Å; W64-V80 HydrophobicContact CG-CB 4.22Å; W64-V80 HydrophobicContact CH2-CB 4.48Å; W64-V80 HydrophobicContact CZ2-CB 4.26Å; W64-V80 HydrophobicContact CZ2-CG1 4.47Å; W64-V80 HydrophobicContact CZ3-CB 4.4Å; W64-V80 HydrophobicContact CZ3-CG2 4.46Å; V80-N82 VanDerWaalsContact C-N 3.28Å; V80-N82 PolarHBondContact O-N 3.38Å; V80-L83 WeakPolarHBondContact O-CB 3.35Å; V80-L83 PolarHBondContact O-N 3.45Å; V80-L83 VanDerWaalsContact O-N 3.15Å; V80-L84 PolarHBondContact O-N 2.88Å
81	H	89.8	Confident	88.5	Confident	98 Å²	98	83.9 Å²	83.9	45%	0.454	42%	0.421	S	S	.	.	H	α-helix	trans	-58.8	-39.2	174.9	-179.7	71.8	0	0	0	112.7	L4 K79 L83 L84 T85	L4-H81 HydrophobicContact CD2-CB 4.29Å; K79-H81 PolarHBondContact O-N 3.37Å; H81-L83 VanDerWaalsContact C-N 3.34Å; H81-L84 PolarHBondContact O-N 2.84Å; H81-T85 WeakPolarHBondContact O-CB 3.27Å; H81-T85 PolarHBondContact O-N 3.22Å; H81-T85 PolarHBondContact O-OG1 3.33Å
82	N	92	Very high	89	Confident	75 Å²	75	82.1 Å²	82.1	40%	0.401	39%	0.389	S	S	.	.	H	α-helix	trans	-70	-34.2	178.9	-65.9	4.7	0	0	0	111.7	F77 K79 V80 T85 A86	F77-N82 HydrophobicContact CB-CB 4.46Å; F77-N82 HydrophobicContact CD1-CB 4.25Å; K79-N82 WeakPolarHBondContact O-CB 3.28Å; K79-N82 PolarHBondContact O-N 3.14Å; K79-N82 VanDerWaalsContact O-N 3.11Å; V80-N82 VanDerWaalsContact C-N 3.28Å; V80-N82 PolarHBondContact O-N 3.38Å; N82-T85 PolarHBondContact O-N 3.04Å; N82-A86 WeakPolarHBondContact O-CB 3.44Å; N82-A86 PolarHBondContact O-N 2.71Å
83	L	91.6	Very high	89.2	Confident	1 Å²	1	81.7 Å²	81.7	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-62.4	-47.6	173.5	175.7	156.6	0	0	0	110.4	V56 W64 A66 F77 K79 V80 H81 T85 A86 F87	V56-L83 HydrophobicContact CG1-CD1 3.82Å; V56-L83 HydrophobicContact CG1-CD2 4.49Å; V56-L83 HydrophobicContact CG2-CD2 4.36Å; W64-L83 HydrophobicContact CB-CD1 4.35Å; A66-L83 HydrophobicContact CB-CD1 4.48Å; F77-L83 HydrophobicContact CB-CB 4.04Å; F77-L83 HydrophobicContact CD1-CB 4.39Å; F77-L83 HydrophobicContact CD2-CB 3.61Å; F77-L83 HydrophobicContact CD2-CD1 3.87Å; F77-L83 HydrophobicContact CD2-CG 3.86Å; F77-L83 HydrophobicContact CE2-CB 4.08Å; F77-L83 HydrophobicContact CE2-CD1 4.27Å; F77-L83 HydrophobicContact CE2-CG 4.01Å; F77-L83 HydrophobicContact CG-CB 3.76Å; K79-L83 PolarHBondContact O-N 2.98Å; V80-L83 WeakPolarHBondContact O-CB 3.35Å; V80-L83 PolarHBondContact O-N 3.45Å; V80-L83 VanDerWaalsContact O-N 3.15Å; H81-L83 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 3.17Å; L83-A86 WeakPolarHBondContact O-CB 3.2Å; L83-A86 PolarHBondContact O-N 2.75Å; L83-F87 HydrophobicContact CD1-CE2 4.46Å; L83-F87 HydrophobicContact CD2-CD2 3.59Å; L83-F87 HydrophobicContact CD2-CE2 3.42Å; L83-F87 VanDerWaalsContact CD2-CE2 3.42Å; L83-F87 HydrophobicContact CG-CD2 4.17Å; L83-F87 HydrophobicContact CG-CE2 3.74Å; L83-F87 HydrophobicContact CG-CZ 4.47Å; L83-F87 WeakPolarHBondContact O-CD2 3.48Å; L83-F87 PolarHBondContact O-N 3.09Å; L83-F87 VanDerWaalsContact O-N 3.13Å
84	L	91.8	Very high	89.6	Confident	7 Å²	7	75.1 Å²	75.1	4%	0.037	37%	0.372	C	S	.	.	H	α-helix	trans	-60.8	-47.3	176.6	-64.5	172.7	0	0	0	111.3	L4 V6 Y29 L43 V80 H81 A86 F87 Q88 L98	L4-L84 HydrophobicContact CD1-CD1 4.09Å; L4-L84 HydrophobicContact CD2-CD1 4.24Å; V6-L84 HydrophobicContact CG2-CD1 3.94Å; Y29-L84 HydrophobicContact CE2-CD2 4.34Å; L43-L84 HydrophobicContact CD1-CD2 3.86Å; L43-L84 HydrophobicContact CD2-CD2 4.35Å; V80-L84 PolarHBondContact O-N 2.88Å; H81-L84 PolarHBondContact O-N 2.84Å; L84-A86 VanDerWaalsContact C-N 3.27Å; L84-A86 PolarHBondContact O-N 3.17Å; L84-F87 CarbonylContact O-C 3.48Å; L84-F87 PolarHBondContact O-N 2.73Å; L84-F87 VanDerWaalsContact O-N 3.08Å; L84-Q88 WeakPolarHBondContact O-CG 3.49Å; L84-Q88 PolarHBondContact O-N 2.75Å; L84-Q88 VanDerWaalsContact O-N 3.13Å; L84-L98 HydrophobicContact CB-CD1 4.42Å; L84-L98 HydrophobicContact CD2-CD1 3.92Å
85	T	92.1	Very high	89.9	Confident	51 Å²	51	70.9 Å²	70.9	31%	0.313	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-36.5	178.5	-53.4	0	0	0	0	112	H81 N82 L83 F87 Q88	H81-T85 WeakPolarHBondContact O-CB 3.27Å; H81-T85 PolarHBondContact O-N 3.22Å; H81-T85 PolarHBondContact O-OG1 3.33Å; N82-T85 PolarHBondContact O-N 3.04Å; L83-T85 PolarHBondContact O-N 3.17Å; T85-F87 VanDerWaalsContact C-N 3.34Å; T85-Q88 WeakPolarHBondContact O-CB 3.39Å; T85-Q88 PolarHBondContact O-N 3.28Å
86	A	91.9	Very high	90.1	Very high	11 Å²	11	66.8 Å²	66.8	9%	0.091	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-45.4	174.8	0	0	0	0	0	110.7	F77 N82 L83 L84 Q88 K89 Q92	F77-A86 HydrophobicContact CE1-CB 3.49Å; F77-A86 VanDerWaalsContact CE1-CB 3.49Å; F77-A86 HydrophobicContact CZ-CB 3.65Å; N82-A86 WeakPolarHBondContact O-CB 3.44Å; N82-A86 PolarHBondContact O-N 2.71Å; L83-A86 WeakPolarHBondContact O-CB 3.2Å; L83-A86 PolarHBondContact O-N 2.75Å; L84-A86 VanDerWaalsContact C-N 3.27Å; L84-A86 PolarHBondContact O-N 3.17Å; A86-Q88 PolarHBondContact O-N 2.66Å; A86-K89 WeakPolarHBondContact O-CB 3.08Å; A86-K89 PolarHBondContact O-N 3.42Å; A86-K89 VanDerWaalsContact O-N 3.15Å; A86-Q92 VanDerWaalsContact O-CG 3.32Å; A86-Q92 WeakPolarHBondContact O-CG 3.49Å
87	F	92.1	Very high	90.3	Very high	13 Å²	13	63.6 Å²	63.6	6%	0.057	33%	0.333	C	S	.	.	H	α-helix	trans	-71.8	-6.8	178.6	-69.5	-32.1	0	0	0	115.4	L43 A66 L83 L84 T85 K89 Q92 I94 P97 L98	L43-F87 HydrophobicContact CD2-CD2 3.96Å; L43-F87 HydrophobicContact CD2-CE2 4.31Å; A66-F87 HydrophobicContact CB-CE2 3.89Å; A66-F87 HydrophobicContact CB-CZ 3.77Å; L83-F87 HydrophobicContact CD1-CE2 4.46Å; L83-F87 HydrophobicContact CD2-CD2 3.59Å; L83-F87 HydrophobicContact CD2-CE2 3.42Å; L83-F87 VanDerWaalsContact CD2-CE2 3.42Å; L83-F87 HydrophobicContact CG-CD2 4.17Å; L83-F87 HydrophobicContact CG-CE2 3.74Å; L83-F87 HydrophobicContact CG-CZ 4.47Å; L83-F87 WeakPolarHBondContact O-CD2 3.48Å; L83-F87 PolarHBondContact O-N 3.09Å; L83-F87 VanDerWaalsContact O-N 3.13Å; L84-F87 CarbonylContact O-C 3.48Å; L84-F87 PolarHBondContact O-N 2.73Å; L84-F87 VanDerWaalsContact O-N 3.08Å; T85-F87 VanDerWaalsContact C-N 3.34Å; F87-K89 PolarHBondContact O-N 2.95Å; F87-Q92 HydrophobicContact CD1-CB 3.94Å; F87-Q92 HydrophobicContact CE1-CB 4.5Å; F87-I94 HydrophobicContact CB-CD1 3.74Å; F87-I94 HydrophobicContact CD1-CD1 4.33Å; F87-I94 HydrophobicContact CD1-CG1 4.48Å; F87-I94 HydrophobicContact CD1-CG2 4.01Å; F87-I94 HydrophobicContact CE1-CG2 4Å; F87-I94 HydrophobicContact CG-CD1 4.1Å; F87-I94 HydrophobicContact CG-CG2 4.37Å; F87-I94 HydrophobicContact CZ-CG2 4.33Å; F87-P97 WeakPolarHBondContact O-CA 3.41Å; F87-L98 HydrophobicContact CB-CD1 3.61Å; F87-L98 HydrophobicContact CB-CG 3.81Å; F87-L98 PolarHBondContact O-N 2.98Å
88	Q	93.1	Very high	90.5	Very high	90 Å²	90	62.6 Å²	62.6	42%	0.421	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-14.4	168	-67.1	176.4	-29.3	0	0	112.7	L84 T85 A86 L98	L84-Q88 WeakPolarHBondContact O-CG 3.49Å; L84-Q88 PolarHBondContact O-N 2.75Å; L84-Q88 VanDerWaalsContact O-N 3.13Å; T85-Q88 WeakPolarHBondContact O-CB 3.39Å; T85-Q88 PolarHBondContact O-N 3.28Å; A86-Q88 PolarHBondContact O-N 2.66Å; Q88-L98 HydrophobicContact CG-CB 3.94Å; Q88-L98 WeakPolarHBondContact CG-O 3.33Å
89	K	91.9	Very high	90.6	Very high	130 Å²	130	57.3 Å²	57.3	57%	0.565	31%	0.313	S	S	*	.	S	Bend	trans	-86.4	152.7	178.1	-62.4	-176.5	-179.5	-176.3	0	111.1	A86 F87 Q92	A86-K89 WeakPolarHBondContact O-CB 3.08Å; A86-K89 PolarHBondContact O-N 3.42Å; A86-K89 VanDerWaalsContact O-N 3.15Å; F87-K89 PolarHBondContact O-N 2.95Å; K89-Q92 HydrophobicContact CB-CG 3.89Å; K89-Q92 WeakPolarHBondContact O-CG 3.41Å
90	P	89.6	Confident	90.9	Very high	87 Å²	87	56.1 Å²	56.1	57%	0.565	31%	0.309	S	S	*	.	S	Bend	trans	-64.3	157.9	170.6	28	-34.4	0	0	0	112.1	Q92	P90-Q92 WeakPolarHBondContact O-CG 3.39Å; P90-Q92 PolarHBondContact O-N 2.77Å; P90-Q92 PolarHBondContact O-NE2 2.77Å
91	D	84.6	Confident	91.1	Very high	162 Å²	162	58.7 Å²	58.7	87%	0.866	33%	0.326	S	S	*	.	S	Bend	trans	58.3	38.8	172.7	-54	-42.6	0	0	0	115.3
92	Q	85.9	Confident	91.3	Very high	54 Å²	54	55.2 Å²	55.2	25%	0.252	31%	0.311	S	S	.	.	S	Bend	trans	-101	11.6	-177.9	-56.1	-65	-64	0	0	114.1	A86 F87 K89 P90	A86-Q92 VanDerWaalsContact O-CG 3.32Å; A86-Q92 WeakPolarHBondContact O-CG 3.49Å; F87-Q92 HydrophobicContact CD1-CB 3.94Å; F87-Q92 HydrophobicContact CE1-CB 4.5Å; K89-Q92 HydrophobicContact CB-CG 3.89Å; K89-Q92 WeakPolarHBondContact O-CG 3.41Å; P90-Q92 WeakPolarHBondContact O-CG 3.39Å; P90-Q92 PolarHBondContact O-N 2.77Å; P90-Q92 PolarHBondContact O-NE2 2.77Å
93	G	83.4	Confident	91.2	Very high	73 Å²	73	54.3 Å²	54.3	75%	0.753	31%	0.307	S	S	*	.	S	Bend	trans	82.2	16.7	178.5	0	0	0	0	0	115
94	I	87.8	Confident	90.7	Very high	29 Å²	29	56 Å²	56	15%	0.149	32%	0.318	C	S	.	.	S	Bend	trans	-113.6	163.3	168.1	62.8	168.2	0	0	0	110.1	Y54 F87 T96 L98	Y54-I94 HydrophobicContact CD1-CG2 4.27Å; Y54-I94 HydrophobicContact CE1-CB 4.31Å; Y54-I94 HydrophobicContact CE1-CG2 3.94Å; Y54-I94 HydrophobicContact CE2-CB 4.24Å; Y54-I94 HydrophobicContact CE2-CG2 4.24Å; F87-I94 HydrophobicContact CB-CD1 3.74Å; F87-I94 HydrophobicContact CD1-CD1 4.33Å; F87-I94 HydrophobicContact CD1-CG1 4.48Å; F87-I94 HydrophobicContact CD1-CG2 4.01Å; F87-I94 HydrophobicContact CE1-CG2 4Å; F87-I94 HydrophobicContact CG-CD1 4.1Å; F87-I94 HydrophobicContact CG-CG2 4.37Å; F87-I94 HydrophobicContact CZ-CG2 4.33Å; I94-T96 VanDerWaalsContact C-N 3.32Å; I94-T96 WeakPolarHBondContact CD1-O 3.43Å; I94-T96 WeakPolarHBondContact CG1-O 3.12Å; I94-T96 PolarHBondContact O-N 2.79Å; I94-L98 HydrophobicContact CD1-CD2 4Å; I94-L98 HydrophobicContact CD1-CG 4.13Å
95	V	90.8	Very high	89.2	Confident	49 Å²	49	65 Å²	65	30%	0.297	36%	0.36	S	S	.	.	S	Bend	trans	-61.6	-38.1	-171.7	69.2	0	0	0	0	113.1	H47 Y52 Y54	H47-V95 HydrophobicContact CB-CG1 3.87Å; H47-V95 HydrophobicContact CB-CG2 4.17Å; H47-V95 WeakPolarHBondContact CD2-CG2 2.85Å; Y52-V95 HydrophobicContact CD1-CB 4.2Å; Y52-V95 HydrophobicContact CD1-CG1 4.27Å; Y52-V95 HydrophobicContact CD1-CG2 4.36Å; Y52-V95 HydrophobicContact CD2-CB 4.31Å; Y52-V95 HydrophobicContact CD2-CG1 3.69Å; Y52-V95 HydrophobicContact CD2-CG2 4.24Å; Y52-V95 HydrophobicContact CE1-CB 4.33Å; Y52-V95 HydrophobicContact CE1-CG2 4.01Å; Y52-V95 HydrophobicContact CE2-CB 4.43Å; Y52-V95 HydrophobicContact CE2-CG1 4.17Å; Y52-V95 HydrophobicContact CE2-CG2 3.88Å; Y52-V95 HydrophobicContact CG-CB 4.18Å; Y52-V95 HydrophobicContact CG-CG1 3.74Å; Y52-V95 HydrophobicContact CG-CG2 4.47Å; Y54-V95 WeakPolarHBondContact OH-CB 3.42Å; Y54-V95 PolarHBondContact OH-N 2.9Å
96	T	92.6	Very high	87.4	Confident	15 Å²	15	66.1 Å²	66.1	9%	0.092	38%	0.382	C	S	.	.	S	Bend	trans	-152	147.8	178.3	-170.1	0	0	0	0	108.8	V45 H47 I94	V45-T96 HydrophobicContact CG1-CG2 3.74Å; H47-T96 HydrophobicContact CB-CG2 3.97Å; I94-T96 VanDerWaalsContact C-N 3.32Å; I94-T96 WeakPolarHBondContact CD1-O 3.43Å; I94-T96 WeakPolarHBondContact CG1-O 3.12Å; I94-T96 PolarHBondContact O-N 2.79Å
97	P	94.7	Very high	85.4	Confident	37 Å²	37	70.9 Å²	70.9	24%	0.24	40%	0.4	C	S	.	.			trans	-58.1	146.5	175.2	-23.2	34.7	0	0	0	112	F87 Q99	F87-P97 WeakPolarHBondContact O-CA 3.41Å; P97-Q99 PolarHBondContact O-N 2.82Å
98	L	94.6	Very high	83.1	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.021	42%	0.418	C	S	.	.			trans	-69.5	119.4	173.5	-55.1	-176.1	0	0	0	109.3	Y29 L43 V45 L84 F87 Q88 I94	Y29-L98 HydrophobicContact CD1-CB 3.77Å; Y29-L98 HydrophobicContact CD1-CD2 4.22Å; Y29-L98 HydrophobicContact CD1-CG 4.44Å; Y29-L98 HydrophobicContact CD2-CD1 4.05Å; Y29-L98 HydrophobicContact CD2-CD2 4.23Å; Y29-L98 HydrophobicContact CD2-CG 4.49Å; Y29-L98 HydrophobicContact CE1-CB 3.75Å; Y29-L98 HydrophobicContact CE2-CB 4.48Å; Y29-L98 HydrophobicContact CE2-CD1 4.06Å; Y29-L98 HydrophobicContact CG-CB 4.15Å; Y29-L98 HydrophobicContact CG-CD1 4.38Å; Y29-L98 HydrophobicContact CG-CD2 3.83Å; Y29-L98 HydrophobicContact CG-CG 4.33Å; L43-L98 HydrophobicContact CD1-CD1 4.46Å; L43-L98 HydrophobicContact CD2-CD1 4.35Å; V45-L98 HydrophobicContact CG1-CD2 4.19Å; V45-L98 HydrophobicContact CG2-CD2 3.57Å; L84-L98 HydrophobicContact CB-CD1 4.42Å; L84-L98 HydrophobicContact CD2-CD1 3.92Å; F87-L98 HydrophobicContact CB-CD1 3.61Å; F87-L98 HydrophobicContact CB-CG 3.81Å; F87-L98 PolarHBondContact O-N 2.98Å; Q88-L98 HydrophobicContact CG-CB 3.94Å; Q88-L98 WeakPolarHBondContact CG-O 3.33Å; I94-L98 HydrophobicContact CD1-CD2 4Å; I94-L98 HydrophobicContact CD1-CG 4.13Å
99	Q	93.9	Very high	80.8	Confident	108 Å²	108	77.6 Å²	77.6	51%	0.505	44%	0.438	S	S	.	.			trans	-125.3	-46.8	-173.7	-70.4	179.6	90.9	0	0	112.5	G27 P97 P101	G27-Q99 PolarHBondContact O-N 2.83Å; P97-Q99 PolarHBondContact O-N 2.82Å; Q99-P101 VanDerWaalsContact O-CD 3.26Å; Q99-P101 WeakPolarHBondContact O-CD 3.4Å
100	H	94.6	Very high	78.3	Confident	74 Å²	74	76.6 Å²	76.6	34%	0.343	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	93.8	-171.4	-55.4	-65.3	0	0	0	110.8	D26 G27 S28 Y29 I102	D26-H100 PolarHBondContact O-CD2 2.83Å; G27-H100 PolarHBondContact O-N 3.38Å; S28-H100 CarbonylContact C-O 3.58Å; S28-H100 VanDerWaalsContact CA-O 3.26Å; S28-H100 WeakPolarHBondContact CA-O 3.49Å; Y29-H100 WeakPolarHBondContact CD1-O 3.49Å; Y29-H100 PolarHBondContact N-O 2.89Å; H100-I102 PolarHBondContact O-N 3.1Å
101	P	94.2	Very high	76.1	Confident	64 Å²	64	78.7 Å²	78.7	42%	0.416	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	121.2	179.2	24.9	-31.9	0	0	0	111.1	V6 Y29 Q99 V103	V6-P101 HydrophobicContact CG1-CB 3.31Å; Y29-P101 VanDerWaalsContact CE1-CA 3.47Å; Y29-P101 HydrophobicContact CE1-CB 3.82Å; Y29-P101 HydrophobicContact CE1-CG 4.46Å; Q99-P101 VanDerWaalsContact O-CD 3.26Å; Q99-P101 WeakPolarHBondContact O-CD 3.4Å; P101-V103 PolarHBondContact O-N 3Å
102	I	93.7	Very high	74.7	Confident	26 Å²	26	76 Å²	76	13%	0.133	46%	0.458	C	S	.	.			trans	-82.7	109.3	169.5	-53.3	-54.6	0	0	0	108.1	V6 H8 L19 L20 Y29 L30 H100	V6-I102 WeakPolarHBondContact CA-O 3.4Å; H8-I102 PolarHBondContact NE2-O 3.32Å; L19-I102 HydrophobicContact CB-CG2 4.23Å; L20-I102 HydrophobicContact CD2-CG1 3.94Å; Y29-I102 PolarHBondContact O-N 2.62Å; L30-I102 HydrophobicContact CB-CB 4.21Å; H100-I102 PolarHBondContact O-N 3.1Å
103	V	90.1	Very high	72.8	Confident	55 Å²	55	76.5 Å²	76.5	33%	0.333	48%	0.479	S	S	.	.			trans	-90.3	144.6	-176.8	-60.9	0	0	0	0	111.6	P5 P101 A108	P5-V103 HydrophobicContact CB-CB 4.5Å; P5-V103 HydrophobicContact CB-CG1 3.98Å; P5-V103 VanDerWaalsContact O-CA 3.29Å; P5-V103 WeakPolarHBondContact O-CA 3.37Å; P101-V103 PolarHBondContact O-N 3Å; V103-A108 HydrophobicContact CG2-CB 4.12Å
104	T	80.8	Confident	71	Confident	38 Å²	38	84.8 Å²	84.8	23%	0.233	49%	0.487	C	S	.	.			trans	-67.2	138	171.4	40.8	0	0	0	0	111.1	P5 Y7 H8 G106 K107	P5-T104 PolarHBondContact O-N 3.1Å; P5-T104 PolarHBondContact O-OG1 3.26Å; Y7-T104 WeakPolarHBondContact O-CG2 3.13Å; H8-T104 VanDerWaalsContact CA-CG2 3.47Å; H8-T104 HydrophobicContact CB-CG2 3.89Å; H8-T104 VanDerWaalsContact CG-CG2 3.41Å; H8-T104 VanDerWaalsContact ND1-CG2 3.27Å; H8-T104 WeakPolarHBondContact ND1-CG2 3.15Å; T104-G106 PolarHBondContact O-N 2.86Å; T104-K107 PolarHBondContact O-N 3.26Å
105	E	60.9	Low	69.2	Low	194 Å²	194	93.1 Å²	93.1	91%	0.907	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	6.1	-177	-76.5	-162.7	97.9	0	0	115.5
106	G	53.9	Low	66.9	Low	76 Å²	76	99.8 Å²	99.8	78%	0.784	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-6.9	165.8	0	0	0	0	0	114.7	T104	T104-G106 PolarHBondContact O-N 2.86Å
107	K	50.1	Low	64.8	Low	110 Å²	110	102 Å²	102	48%	0.478	58%	0.575	S	S	.	*	S	Bend	trans	-136.2	2.8	-176.6	-73.4	-169.9	176.5	-169.5	0	114.8	S3 T104 K109	S3-K107 PolarHBondContact O-NZ 3.5Å; S3-K107 WeakPolarHBondContact OG-CE 3.24Å; S3-K107 PolarHBondContact OG-NZ 3.41Å; T104-K107 PolarHBondContact O-N 3.26Å; K107-K109 PolarHBondContact O-N 3.37Å
108	A	44.9	Very low	62.7	Low	51 Å²	51	107.8 Å²	107.8	42%	0.421	60%	0.599	S	S	.	*			trans	-69.1	111.8	170.5	0	0	0	0	0	108.2	V103	V103-A108 HydrophobicContact CG2-CB 4.12Å
109	K	43.2	Very low	60.4	Low	193 Å²	193	115 Å²	115	84%	0.839	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-55.9	132.9	154.2	-83.7	-174.8	174.5	-177.7	0	106	K107	K107-K109 PolarHBondContact O-N 3.37Å
110	P	40.6	Very low	58.1	Low	110 Å²	110	117.3 Å²	117.3	71%	0.714	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-54.5	140.7	179.5	21.8	-31.6	0	0	0	109.1	A112	P110-A112 PolarHBondContact O-N 3.46Å
111	P	43.7	Very low	56	Low	130 Å²	130	123.2 Å²	123.2	84%	0.844	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-57	119.8	175.5	22.6	-30.9	0	0	0	108.3	G113	P111-G113 PolarHBondContact O-N 3.21Å
112	A	54.2	Low	53.9	Low	105 Å²	105	128.7 Å²	128.7	87%	0.868	69%	0.692	S	S	*	*			trans	-63.9	107.7	177.1	0	0	0	0	0	109.1	P110	P110-A112 PolarHBondContact O-N 3.46Å
113	G	46.2	Very low	51.7	Low	66 Å²	66	135.5 Å²	135.5	68%	0.68	72%	0.723	S	S	*	*			trans	62.6	90.2	150.4	0	0	0	0	0	116.9	P111	P111-G113 PolarHBondContact O-N 3.21Å
114	R	45.8	Very low	50.1	Low	247 Å²	247	138.9 Å²	138.9	93%	0.932	75%	0.746	S	S	*	*			trans	-86	99.5	143	-145.5	173	-171.9	134.5	-0.7	106.3	E116	R114-E116 PolarHBondContact O-N 2.88Å; R114-E116 VanDerWaalsContact O-N 3.08Å
115	K	49.5	Very low	48.9	Very low	203 Å²	203	146.4 Å²	146.4	88%	0.883	80%	0.8	S	S	*	*			trans	-68	101.5	168.9	-72.1	-163.9	178.2	-171.9	0	107.5	G117	K115-G117 PolarHBondContact O-N 3.43Å
116	E	42.7	Very low	48.3	Very low	190 Å²	190	144.1 Å²	144.1	89%	0.888	80%	0.795	S	S	*	*			trans	-76.6	98.2	161.5	-127.1	167.5	105.5	0	0	107	R114	R114-E116 PolarHBondContact O-N 2.88Å; R114-E116 VanDerWaalsContact O-N 3.08Å
117	G	49	Very low	48	Very low	60 Å²	60	147.6 Å²	147.6	62%	0.619	80%	0.796	S	S	*	*			trans	-94.7	118.4	162.8	0	0	0	0	0	108.2	K115	K115-G117 PolarHBondContact O-N 3.43Å
118	H	49.4	Very low	47.9	Very low	160 Å²	160	149.7 Å²	149.7	74%	0.741	81%	0.813	S	S	*	*			trans	159.6	113.1	139.1	-103.6	-112.2	0	0	0	110.8	F120	H118-F120 AromaticContact CE1-CE2 3.53Å; H118-F120 AromaticContact ND1-CD2 3.67Å; H118-F120 AromaticContact ND1-CE2 3.24Å; H118-F120 WeakPolarHBondContact ND1-CE2 3.44Å
119	D	46.3	Very low	48.1	Very low	154 Å²	154	155.5 Å²	155.5	82%	0.824	84%	0.836	S	S	*	*			trans	-169.8	92.4	135.6	-134.9	-67.3	0	0	0	107.5
120	F	46.3	Very low	48.4	Very low	157 Å²	157	153.2 Å²	153.2	69%	0.689	84%	0.836	S	S	*	*				55	108.6	98.6	-81.3	-77.5	0	0	0	115.7	H118	H118-F120 AromaticContact CE1-CE2 3.53Å; H118-F120 AromaticContact ND1-CD2 3.67Å; H118-F120 AromaticContact ND1-CE2 3.24Å; H118-F120 WeakPolarHBondContact ND1-CE2 3.44Å
121	Y	51.2	Low	48.9	Very low	199 Å²	199	156.1 Å²	156.1	78%	0.78	84%	0.844	S	S	*	*			trans	3.1	124.3	154.7	-94.4	-98.5	0	0	0	119.5
122	L	50.1	Low	49.2	Very low	178 Å²	178	157.9 Å²	157.9	93%	0.932	84%	0.844	S	S	*	*			trans	-146.3	122.1	132.4	-79.9	-180	0	0	0	110.7
123	Q	47.7	Very low	48.9	Very low	169 Å²	169	162 Å²	162	79%	0.79	84%	0.842	S	S	*	*			trans	-75.3	149.1	170.3	-68.2	176.7	-73	0	0	110.5
124	P	55.9	Low	49.1	Very low	126 Å²	126	170 Å²	170	82%	0.818	86%	0.856	S	S	*	*			trans	-94	138.5	156.5	19.4	-4.8	0	0	0	111.5
125	S	55.2	Low	49.4	Very low	197 Å²	197	163 Å²	163	100%	1.378	85%	0.849	S	S	*	*			trans	-87.6	0	158.1	-63.3	0	0	0	0	110.1

Retrieved 125 of 125 residues in 156.7 ms (Link to these results)

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