A0A5K4FGM3_SCHMA Loading...

UPAR/Ly6 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FGM3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 139 aa.

						>A0A5K4FGM3_SCHMA|A0A5K4FGM3
MRIIVESSLIILTVLQLISYAFAIKCRVCLPCEEKYKKLFQITKDEILHNCGVCITAYSTFQGYQMEGRGCLLQCPPKHAISQLTPGLVNKYDCCYYDLCNRTNKLFVQYKLLMIISCLVHSLFIVCIDNNSVMLEFTI
					

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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	52.6	Low	58.7	Low	200 Å²	200	113.5 Å²	113.5	99%	0.985	58%	0.579	S	S	*	*				0	-46.5	0	-155.7	170.7	166	0	0	112.1	I3 I4 V5	M1-I3 PolarHBondContact O-N 3.17Å; M1-I4 PolarHBondContact O-N 3.21Å; M1-V5 PolarHBondContact O-N 3.25Å
2	R	56	Low	59.1	Low	188 Å²	188	112.8 Å²	112.8	71%	0.709	58%	0.577	S	S	*	*	H	α-helix	trans	-52.9	-49.1	177.8	-138.6	175	180	-166.9	-4.6	114.6	I4 V5 E6	R2-I4 VanDerWaalsContact C-N 3.3Å; R2-I4 PolarHBondContact O-N 3.24Å; R2-V5 PolarHBondContact O-N 2.93Å; R2-V5 VanDerWaalsContact O-N 3.14Å; R2-E6 PolarHBondContact O-N 3.47Å; R2-E6 VanDerWaalsContact O-N 3.08Å
3	I	57.1	Low	59.4	Low	128 Å²	128	108.8 Å²	108.8	66%	0.656	56%	0.561	S	S	*	*	H	α-helix	trans	-59.2	-36.1	-180	-59.8	172.3	0	0	0	113	M1 S7	M1-I3 PolarHBondContact O-N 3.17Å; I3-S7 WeakPolarHBondContact O-CB 3.49Å; I3-S7 PolarHBondContact O-N 3.05Å; I3-S7 PolarHBondContact O-OG 3.02Å
4	I	56.3	Low	59.7	Low	122 Å²	122	105.9 Å²	105.9	63%	0.626	55%	0.55	S	S	*	*	H	α-helix	trans	-70.4	-41.2	-179.8	-62.9	172.5	0	0	0	110	M1 R2 S8	M1-I4 PolarHBondContact O-N 3.21Å; R2-I4 VanDerWaalsContact C-N 3.3Å; R2-I4 PolarHBondContact O-N 3.24Å; I4-S8 WeakPolarHBondContact O-CB 3.49Å; I4-S8 PolarHBondContact O-N 3.04Å; I4-S8 PolarHBondContact O-OG 2.91Å
5	V	56.2	Low	59.6	Low	78 Å²	78	105.1 Å²	105.1	47%	0.473	55%	0.546	S	S	.	.	H	α-helix	trans	-67	-42.9	179.5	178.4	0	0	0	0	111.1	M1 R2 S8 L9	M1-V5 PolarHBondContact O-N 3.25Å; R2-V5 PolarHBondContact O-N 2.93Å; R2-V5 VanDerWaalsContact O-N 3.14Å; V5-S8 WeakPolarHBondContact O-CB 3.43Å; V5-S8 PolarHBondContact O-N 3.11Å; V5-L9 HydrophobicContact CG1-CD1 4.33Å; V5-L9 PolarHBondContact O-N 2.85Å
6	E	59.1	Low	59.3	Low	92 Å²	92	105.8 Å²	105.8	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-64.3	-44.2	176.9	-73.7	170	-169.6	0	0	112	R2 S8 L9 I10	R2-E6 PolarHBondContact O-N 3.47Å; R2-E6 VanDerWaalsContact O-N 3.08Å; E6-S8 VanDerWaalsContact C-N 3.26Å; E6-S8 PolarHBondContact O-N 3.21Å; E6-L9 PolarHBondContact O-N 3.43Å; E6-I10 WeakPolarHBondContact O-CG1 3.5Å; E6-I10 PolarHBondContact O-N 3.01Å
7	S	57.7	Low	59.2	Low	57 Å²	57	106.9 Å²	106.9	40%	0.399	55%	0.553	S	S	.	*	H	α-helix	trans	-60.4	-38.4	175.2	-59	0	0	0	0	111.7	I3 I10 I11	I3-S7 WeakPolarHBondContact O-CB 3.49Å; I3-S7 PolarHBondContact O-N 3.05Å; I3-S7 PolarHBondContact O-OG 3.02Å; S7-I10 PolarHBondContact O-N 2.91Å; S7-I11 WeakPolarHBondContact O-CB 3.28Å; S7-I11 WeakPolarHBondContact O-CD1 2.63Å; S7-I11 VanDerWaalsContact O-CG1 3.24Å; S7-I11 WeakPolarHBondContact O-CG1 3.45Å; S7-I11 PolarHBondContact O-N 3.27Å
8	S	57.8	Low	58.8	Low	62 Å²	62	105.1 Å²	105.1	43%	0.434	54%	0.543	S	S	.	.	H	α-helix	trans	-64.5	-43.4	177.8	-51.9	0	0	0	0	111.9	I4 V5 E6 I11 L12	I4-S8 WeakPolarHBondContact O-CB 3.49Å; I4-S8 PolarHBondContact O-N 3.04Å; I4-S8 PolarHBondContact O-OG 2.91Å; V5-S8 WeakPolarHBondContact O-CB 3.43Å; V5-S8 PolarHBondContact O-N 3.11Å; E6-S8 VanDerWaalsContact C-N 3.26Å; E6-S8 PolarHBondContact O-N 3.21Å; S8-I11 PolarHBondContact O-N 2.88Å; S8-L12 WeakPolarHBondContact O-CB 3.16Å; S8-L12 PolarHBondContact O-N 2.75Å
9	L	62.5	Low	58.1	Low	112 Å²	112	103.9 Å²	103.9	59%	0.586	55%	0.545	S	S	*	.	H	α-helix	trans	-66	-39.2	177.5	-111	124.6	0	0	0	112.1	V5 E6 L12 T13	V5-L9 HydrophobicContact CG1-CD1 4.33Å; V5-L9 PolarHBondContact O-N 2.85Å; E6-L9 PolarHBondContact O-N 3.43Å; L9-L12 PolarHBondContact O-N 2.88Å; L9-T13 WeakPolarHBondContact O-CB 3.03Å; L9-T13 WeakPolarHBondContact O-CG2 3.38Å; L9-T13 PolarHBondContact O-N 3.2Å; L9-T13 PolarHBondContact O-OG1 2.8Å
10	I	66.7	Low	57.8	Low	104 Å²	104	108.2 Å²	108.2	53%	0.533	56%	0.555	S	S	.	*	H	α-helix	trans	-65	-45.9	175.1	-66.2	166.4	0	0	0	110	E6 S7 L12 T13 V14	E6-I10 WeakPolarHBondContact O-CG1 3.5Å; E6-I10 PolarHBondContact O-N 3.01Å; S7-I10 PolarHBondContact O-N 2.91Å; I10-L12 VanDerWaalsContact C-N 3.34Å; I10-L12 PolarHBondContact O-N 2.77Å; I10-T13 WeakPolarHBondContact CA-OG1 3.49Å; I10-T13 PolarHBondContact O-N 2.85Å; I10-T13 PolarHBondContact O-OG1 3.43Å; I10-V14 HydrophobicContact CG2-CG2 4.25Å; I10-V14 WeakPolarHBondContact O-CB 3.25Å; I10-V14 WeakPolarHBondContact O-CG2 2.88Å; I10-V14 PolarHBondContact O-N 3.15Å
11	I	64.2	Low	57.6	Low	105 Å²	105	106.2 Å²	106.2	54%	0.538	56%	0.555	S	S	.	*	H	α-helix	trans	-62.1	-42.3	177.5	-69.2	165	0	0	0	110.9	S7 S8 V14 L15	S7-I11 WeakPolarHBondContact O-CB 3.28Å; S7-I11 WeakPolarHBondContact O-CD1 2.63Å; S7-I11 VanDerWaalsContact O-CG1 3.24Å; S7-I11 WeakPolarHBondContact O-CG1 3.45Å; S7-I11 PolarHBondContact O-N 3.27Å; S8-I11 PolarHBondContact O-N 2.88Å; I11-V14 PolarHBondContact O-N 2.68Å; I11-L15 HydrophobicContact CG2-CD1 3.68Å; I11-L15 HydrophobicContact CG2-CG 4.46Å; I11-L15 WeakPolarHBondContact O-CB 3.32Å; I11-L15 WeakPolarHBondContact O-CD1 3.39Å; I11-L15 WeakPolarHBondContact O-CG 3.44Å; I11-L15 PolarHBondContact O-N 2.79Å
12	L	63	Low	57.8	Low	106 Å²	106	104.6 Å²	104.6	56%	0.555	54%	0.542	S	S	*	.	H	α-helix	trans	-63.8	-44.1	178.1	-133.4	93.9	0	0	0	112.2	S8 L9 I10 L15 Q16	S8-L12 WeakPolarHBondContact O-CB 3.16Å; S8-L12 PolarHBondContact O-N 2.75Å; L9-L12 PolarHBondContact O-N 2.88Å; I10-L12 VanDerWaalsContact C-N 3.34Å; I10-L12 PolarHBondContact O-N 2.77Å; L12-L15 PolarHBondContact O-N 2.79Å; L12-Q16 WeakPolarHBondContact O-CB 3.38Å; L12-Q16 VanDerWaalsContact O-CG 3.27Å; L12-Q16 WeakPolarHBondContact O-CG 3.13Å; L12-Q16 PolarHBondContact O-N 2.03Å
13	T	63	Low	58.3	Low	61 Å²	61	97.4 Å²	97.4	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-68	-38.6	178.2	47.6	0	0	0	0	111.5	L9 I10 Q16 L17	L9-T13 WeakPolarHBondContact O-CB 3.03Å; L9-T13 WeakPolarHBondContact O-CG2 3.38Å; L9-T13 PolarHBondContact O-N 3.2Å; L9-T13 PolarHBondContact O-OG1 2.8Å; I10-T13 WeakPolarHBondContact CA-OG1 3.49Å; I10-T13 PolarHBondContact O-N 2.85Å; I10-T13 PolarHBondContact O-OG1 3.43Å; T13-Q16 PolarHBondContact O-N 3.44Å; T13-L17 WeakPolarHBondContact O-CB 3.49Å; T13-L17 WeakPolarHBondContact O-CD1 3.49Å; T13-L17 VanDerWaalsContact O-CG 3.31Å; T13-L17 WeakPolarHBondContact O-CG 3.43Å; T13-L17 PolarHBondContact O-N 3.02Å
14	V	63.9	Low	59.3	Low	67 Å²	67	91.8 Å²	91.8	41%	0.406	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-44.2	172.2	171.6	0	0	0	0	111.1	I10 I11 Q16 L17 I18	I10-V14 HydrophobicContact CG2-CG2 4.25Å; I10-V14 WeakPolarHBondContact O-CB 3.25Å; I10-V14 WeakPolarHBondContact O-CG2 2.88Å; I10-V14 PolarHBondContact O-N 3.15Å; I11-V14 PolarHBondContact O-N 2.68Å; V14-Q16 VanDerWaalsContact C-N 3.34Å; V14-Q16 PolarHBondContact O-N 2.87Å; V14-L17 WeakPolarHBondContact O-CB 3.36Å; V14-L17 PolarHBondContact O-N 3Å; V14-I18 HydrophobicContact CG1-CD1 3.74Å; V14-I18 HydrophobicContact CG1-CG1 4.38Å; V14-I18 WeakPolarHBondContact O-CB 3.42Å; V14-I18 WeakPolarHBondContact O-CD1 3.49Å; V14-I18 WeakPolarHBondContact O-CG1 3.06Å; V14-I18 PolarHBondContact O-N 3.1Å
15	L	57.5	Low	60.7	Low	94 Å²	94	90.2 Å²	90.2	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-63.2	-38.2	175.1	-81.6	160.2	0	0	0	112.5	I11 L12 I18 S19	I11-L15 HydrophobicContact CG2-CD1 3.68Å; I11-L15 HydrophobicContact CG2-CG 4.46Å; I11-L15 WeakPolarHBondContact O-CB 3.32Å; I11-L15 WeakPolarHBondContact O-CD1 3.39Å; I11-L15 WeakPolarHBondContact O-CG 3.44Å; I11-L15 PolarHBondContact O-N 2.79Å; L12-L15 PolarHBondContact O-N 2.79Å; L15-I18 PolarHBondContact O-N 3.36Å; L15-S19 WeakPolarHBondContact O-CB 3.01Å; L15-S19 PolarHBondContact O-N 2.87Å; L15-S19 PolarHBondContact O-OG 3.3Å
16	Q	55	Low	62.2	Low	116 Å²	116	86.5 Å²	86.5	54%	0.542	46%	0.461	S	S	.	.	H	α-helix	trans	-67.4	-39.3	174.6	-75.8	177.6	-19.6	0	0	111.8	L12 T13 V14 S19 Y20	L12-Q16 WeakPolarHBondContact O-CB 3.38Å; L12-Q16 VanDerWaalsContact O-CG 3.27Å; L12-Q16 WeakPolarHBondContact O-CG 3.13Å; L12-Q16 PolarHBondContact O-N 2.03Å; T13-Q16 PolarHBondContact O-N 3.44Å; V14-Q16 VanDerWaalsContact C-N 3.34Å; V14-Q16 PolarHBondContact O-N 2.87Å; Q16-S19 PolarHBondContact O-N 2.81Å; Q16-Y20 PolarHBondContact O-N 2.93Å
17	L	57.8	Low	63.5	Low	125 Å²	125	84.9 Å²	84.9	65%	0.654	45%	0.451	S	S	*	.	H	α-helix	trans	-64	-40.7	173	-79.7	160.5	0	0	0	112	T13 V14 Y20 A21	T13-L17 WeakPolarHBondContact O-CB 3.49Å; T13-L17 WeakPolarHBondContact O-CD1 3.49Å; T13-L17 VanDerWaalsContact O-CG 3.31Å; T13-L17 WeakPolarHBondContact O-CG 3.43Å; T13-L17 PolarHBondContact O-N 3.02Å; V14-L17 WeakPolarHBondContact O-CB 3.36Å; V14-L17 PolarHBondContact O-N 3Å; L17-Y20 PolarHBondContact O-N 3.25Å; L17-A21 PolarHBondContact O-N 3Å; L17-A21 VanDerWaalsContact O-N 3.16Å
18	I	52.4	Low	65	Low	75 Å²	75	83.7 Å²	83.7	39%	0.385	44%	0.441	S	S	.	.	H	α-helix	trans	-64	-42.9	175.4	-71.9	165.9	0	0	0	110.4	V14 L15 Y20 A21 F22	V14-I18 HydrophobicContact CG1-CD1 3.74Å; V14-I18 HydrophobicContact CG1-CG1 4.38Å; V14-I18 WeakPolarHBondContact O-CB 3.42Å; V14-I18 WeakPolarHBondContact O-CD1 3.49Å; V14-I18 WeakPolarHBondContact O-CG1 3.06Å; V14-I18 PolarHBondContact O-N 3.1Å; L15-I18 PolarHBondContact O-N 3.36Å; I18-Y20 VanDerWaalsContact C-N 3.31Å; I18-Y20 PolarHBondContact O-N 2.91Å; I18-A21 VanDerWaalsContact O-CB 3.28Å; I18-A21 WeakPolarHBondContact O-CB 3.47Å; I18-A21 PolarHBondContact O-N 3.35Å; I18-F22 HydrophobicContact CG2-CD2 4.08Å; I18-F22 HydrophobicContact CG2-CE2 3.31Å; I18-F22 HydrophobicContact CG2-CZ 4.1Å; I18-F22 WeakPolarHBondContact O-CD2 2.86Å
19	S	45.4	Very low	66.3	Low	82 Å²	82	80.9 Å²	80.9	57%	0.573	42%	0.421	S	S	*	.	H	α-helix	trans	-64.7	-36.6	178.2	-54.5	0	0	0	0	112.1	L15 Q16 A21	L15-S19 WeakPolarHBondContact O-CB 3.01Å; L15-S19 PolarHBondContact O-N 2.87Å; L15-S19 PolarHBondContact O-OG 3.3Å; Q16-S19 PolarHBondContact O-N 2.81Å; S19-A21 PolarHBondContact O-N 2.73Å
20	Y	52.1	Low	67.2	Low	190 Å²	190	80.2 Å²	80.2	75%	0.745	42%	0.418	S	S	*	.	H	α-helix	trans	-69.8	-16.4	172	-107.2	-86.3	0	0	0	113.7	Q16 L17 I18	Q16-Y20 PolarHBondContact O-N 2.93Å; L17-Y20 PolarHBondContact O-N 3.25Å; I18-Y20 VanDerWaalsContact C-N 3.31Å; I18-Y20 PolarHBondContact O-N 2.91Å
21	A	53.9	Low	67.8	Low	67 Å²	67	75.4 Å²	75.4	55%	0.554	39%	0.393	S	S	*	.	H	α-helix	trans	-83.9	-19.8	-178.6	0	0	0	0	0	113.6	L17 I18 S19	L17-A21 PolarHBondContact O-N 3Å; L17-A21 VanDerWaalsContact O-N 3.16Å; I18-A21 VanDerWaalsContact O-CB 3.28Å; I18-A21 WeakPolarHBondContact O-CB 3.47Å; I18-A21 PolarHBondContact O-N 3.35Å; S19-A21 PolarHBondContact O-N 2.73Å
22	F	56.6	Low	68.6	Low	165 Å²	165	71.1 Å²	71.1	72%	0.724	37%	0.372	S	S	*	.	S	Bend	trans	-92	-9.4	-170	-71.8	-62.1	0	0	0	115.9	I18	I18-F22 HydrophobicContact CG2-CD2 4.08Å; I18-F22 HydrophobicContact CG2-CE2 3.31Å; I18-F22 HydrophobicContact CG2-CZ 4.1Å; I18-F22 WeakPolarHBondContact O-CD2 2.86Å
23	A	67	Low	69.3	Low	37 Å²	37	68.8 Å²	68.8	31%	0.306	36%	0.358	S	S	.	.			trans	-136.5	94.8	-178.9	0	0	0	0	0	109.8	N50	A23-N50 HydrophobicContact CB-CB 4.36Å; A23-N50 WeakPolarHBondContact CB-OD1 3.42Å
24	I	77.9	Confident	69.9	Low	10 Å²	10	73.3 Å²	73.3	5%	0.051	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	155	174.9	73	176.3	0	0	0	110.7	N50 C51 D98	I24-N50 PolarHBondContact O-N 2.69Å; I24-C51 HydrophobicContact CG1-CB 3.81Å; I24-C51 WeakPolarHBondContact CG1-O 3.34Å; I24-C51 PolarHBondContact N-O 3.31Å; I24-C51 WeakPolarHBondContact O-CB 3.48Å; I24-C51 PolarHBondContact O-N 2.99Å; I24-D98 WeakPolarHBondContact CA-OD1 3.46Å
25	K	84.4	Confident	70.5	Confident	90 Å²	90	75.8 Å²	75.8	39%	0.391	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	134.8	173.7	-53.7	177.9	-174.7	177.8	0	109.3	I47 L48 H49 D98 L99	K25-I47 HydrophobicContact CB-CG2 4.19Å; K25-L48 CarbonylContact C-O 3.53Å; K25-L48 VanDerWaalsContact CA-O 3.26Å; K25-L48 WeakPolarHBondContact CA-O 3.48Å; K25-H49 WeakPolarHBondContact CD-ND1 3.19Å; K25-H49 WeakPolarHBondContact CE-ND1 2.94Å; K25-H49 WeakPolarHBondContact CG-ND1 3.35Å; K25-D98 HydrophobicContact CB-CB 4.33Å; K25-D98 PolarHBondContact N-OD1 3.18Å; K25-D98 CarbonylContact O-C 3.47Å; K25-D98 WeakPolarHBondContact O-CA 3.47Å; K25-L99 HydrophobicContact CB-CD2 4.46Å; K25-L99 PolarHBondContact O-N 3.37Å
26	C	87.9	Confident	71.2	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.7	178.3	-60.4	0	0	0	0	110.9	I47 L48 C51 C54 C71	C26-I47 WeakPolarHBondContact O-CA 3.17Å; C26-L48 PolarHBondContact N-O 2Å; C26-L48 PolarHBondContact O-N 3.21Å; C26-C51 HydrophobicContact CB-CB 4.36Å; C26-C51 WeakPolarHBondContact SG-CB 3.09Å; C26-C54 WeakPolarHBondContact CA-SG 3.15Å; C26-C54 HydrophobicContact CB-CB 3.71Å; C26-C54 WeakPolarHBondContact CB-SG 3.14Å; C26-C54 WeakPolarHBondContact SG-CA 3.13Å; C26-C54 WeakPolarHBondContact SG-CB 3.39Å; C26-C54 PolarHBondContact SG-N 2.78Å; C26-C54 VanDerWaalsContact SG-N 3.45Å; C26-C54 CovalentContact SG-SG 2.02Å; C26-C54 PolarHBondContact SG-SG 2.02Å; C26-C71 HydrophobicContact CB-CB 4.02Å
27	R	87.6	Confident	72	Confident	58 Å²	58	68.3 Å²	68.3	22%	0.219	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.3	168.5	-171.7	175.8	-175.6	-177.9	0.1	108.8	D45 R69 N101	R27-D45 IonicContact CZ-OD1 3.64Å; R27-D45 IonicContact CZ-OD2 3.44Å; R27-D45 IonicContact NE-OD1 2.72Å; R27-D45 PolarHBondContact NE-OD1 2.73Å; R27-D45 IonicContact NE-OD2 3.07Å; R27-D45 IonicContact NH2-OD1 3.55Å; R27-D45 PolarHBondContact NH2-OD1 3.07Å; R27-D45 IonicContact NH2-OD2 3.27Å; R27-D45 PolarHBondContact NH2-OD2 2.78Å; R27-R69 VanDerWaalsContact O-CB 3.29Å; R27-R69 WeakPolarHBondContact O-CB 3.28Å; R27-N101 PolarHBondContact N-OD1 3.46Å; R27-N101 PolarHBondContact O-ND2 3.25Å
28	V	87.9	Confident	72.6	Confident	32 Å²	32	71.3 Å²	71.3	19%	0.194	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	121.3	176	-176.9	0	0	0	0	107.6	D45 E46 L48 R69 C71	V28-D45 WeakPolarHBondContact O-CA 3.24Å; V28-E46 HydrophobicContact CB-CG 4.14Å; V28-E46 PolarHBondContact N-O 3.13Å; V28-E46 PolarHBondContact O-N 3.01Å; V28-L48 HydrophobicContact CG2-CB 3.84Å; V28-L48 HydrophobicContact CG2-CD2 4.41Å; V28-R69 WeakPolarHBondContact CA-O 3.09Å; V28-C71 HydrophobicContact CG2-CB 3.95Å
29	C	86.1	Confident	73.3	Confident	2 Å²	2	73 Å²	73	1%	0.014	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-154.3	143.6	175.5	47.8	0	0	0	0	111.5	C32 K44 D45 G68 R69	C29-C32 VanDerWaalsContact C-SG 3.57Å; C29-C32 HydrophobicContact CB-CB 4.02Å; C29-C32 WeakPolarHBondContact CB-SG 3.29Å; C29-C32 PolarHBondContact O-SG 2.76Å; C29-C32 WeakPolarHBondContact SG-CB 3.4Å; C29-C32 CovalentContact SG-SG 2.03Å; C29-C32 PolarHBondContact SG-SG 2.78Å; C29-K44 WeakPolarHBondContact CA-O 3.29Å; C29-D45 HydrophobicContact CB-CB 4.41Å; C29-G68 CarbonylContact O-C 3.58Å; C29-G68 WeakPolarHBondContact O-CA 3.42Å; C29-R69 PolarHBondContact N-O 3.49Å; C29-R69 PolarHBondContact O-N 3.33Å
30	L	80.9	Confident	74.4	Confident	99 Å²	99	72.2 Å²	72.2	52%	0.518	35%	0.345	S	S	.	.	S	Bend	trans	-155.7	117	174.4	-175.4	69.6	0	0	0	109.6	I42	L30-I42 WeakPolarHBondContact O-CB 3.4Å; L30-I42 WeakPolarHBondContact O-CG2 3.49Å
31	P	80.3	Confident	74.9	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.019	35%	0.349	C	S	.	.	S	Bend	cis	-66.9	149.2	-21.8	30.9	-33.9	0	0	0	111.2	Y36 K37 F40	P31-Y36 HydrophobicContact CB-CD2 4.49Å; P31-K37 HydrophobicContact CG-CG 4.26Å; P31-K37 WeakPolarHBondContact O-CE 3Å; P31-K37 VanDerWaalsContact O-CG 3.25Å; P31-K37 WeakPolarHBondContact O-CG 3.07Å; P31-F40 HydrophobicContact CG-CD2 4.19Å
32	C	79.3	Confident	75.4	Confident	14 Å²	14	72.2 Å²	72.2	10%	0.095	34%	0.342	C	S	.	.			trans	-77.8	-27.4	178.9	-63.9	0	0	0	0	113.1	C29 K37 E67 R69	C29-C32 VanDerWaalsContact C-SG 3.57Å; C29-C32 HydrophobicContact CB-CB 4.02Å; C29-C32 WeakPolarHBondContact CB-SG 3.29Å; C29-C32 PolarHBondContact O-SG 2.76Å; C29-C32 WeakPolarHBondContact SG-CB 3.4Å; C29-C32 CovalentContact SG-SG 2.03Å; C29-C32 PolarHBondContact SG-SG 2.78Å; C32-K37 WeakPolarHBondContact O-CE 2.94Å; C32-E67 WeakPolarHBondContact CB-O 3.39Å; C32-E67 PolarHBondContact N-O 3.48Å; C32-R69 WeakPolarHBondContact SG-CG 3.44Å
33	E	78.4	Confident	75.4	Confident	58 Å²	58	69.7 Å²	69.7	27%	0.271	34%	0.34	S	S	.	.	S	Bend	trans	-79.1	127.7	-180	-64.5	171.6	-115	0	0	111.5	K35 Y36 K37	E33-K35 VanDerWaalsContact C-N 3.27Å; E33-K35 HydrophobicContact CB-CG 4.17Å; E33-K35 PolarHBondContact O-N 2.83Å; E33-K35 WeakPolarHBondContact OE2-CE 3.49Å; E33-K35 IonicContact OE2-NZ 2.88Å; E33-K35 PolarHBondContact OE2-NZ 2.89Å; E33-Y36 HydrophobicContact CB-CD2 3.77Å; E33-Y36 HydrophobicContact CB-CE2 4.19Å; E33-Y36 HydrophobicContact CG-CD2 4.49Å; E33-Y36 PolarHBondContact O-N 3.01Å; E33-Y36 WeakPolarHBondContact OE2-CE2 3.26Å; E33-K37 PolarHBondContact O-N 2.01Å; E33-K37 VanDerWaalsContact O-N 3.17Å
34	E	75.9	Confident	75.4	Confident	156 Å²	156	75.1 Å²	75.1	73%	0.729	36%	0.357	S	S	*	.	H	α-helix	trans	-59.8	-33.1	-175.3	-66.4	-170.8	167.4	0	0	114	Y36 K37	E34-Y36 PolarHBondContact O-N 3.35Å; E34-K37 PolarHBondContact O-N 3.38Å
35	K	76.3	Confident	75.6	Confident	118 Å²	118	77.3 Å²	77.3	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-56.9	-35.5	176.3	55.3	167.7	166.4	167.5	0	112.4	E33	E33-K35 VanDerWaalsContact C-N 3.27Å; E33-K35 HydrophobicContact CB-CG 4.17Å; E33-K35 PolarHBondContact O-N 2.83Å; E33-K35 WeakPolarHBondContact OE2-CE 3.49Å; E33-K35 IonicContact OE2-NZ 2.88Å; E33-K35 PolarHBondContact OE2-NZ 2.89Å
36	Y	73.1	Confident	75.7	Confident	18 Å²	18	77.5 Å²	77.5	7%	0.071	37%	0.371	C	S	.	.	H	α-helix	trans	-91.2	-26.4	-179.4	-54.4	-52.5	0	0	0	112.2	P31 E33 E34 K38 L39 F40 Y64 Q65 M66	P31-Y36 HydrophobicContact CB-CD2 4.49Å; E33-Y36 HydrophobicContact CB-CD2 3.77Å; E33-Y36 HydrophobicContact CB-CE2 4.19Å; E33-Y36 HydrophobicContact CG-CD2 4.49Å; E33-Y36 PolarHBondContact O-N 3.01Å; E33-Y36 WeakPolarHBondContact OE2-CE2 3.26Å; E34-Y36 PolarHBondContact O-N 3.35Å; Y36-K38 PolarHBondContact O-N 2.83Å; Y36-L39 HydrophobicContact CD1-CD1 3.94Å; Y36-L39 WeakPolarHBondContact O-CA 3.44Å; Y36-L39 WeakPolarHBondContact O-CB 3.35Å; Y36-L39 PolarHBondContact O-N 3.06Å; Y36-F40 VanDerWaalsContact O-CD2 3.28Å; Y36-F40 WeakPolarHBondContact O-CD2 3.49Å; Y36-F40 PolarHBondContact O-N 2.91Å; Y36-Y64 HydrophobicContact CD1-CD1 4.5Å; Y36-Y64 AromaticContact CE1-CD1 3.69Å; Y36-Y64 HydrophobicContact CE1-CD1 3.69Å; Y36-Y64 HydrophobicContact CE1-CG 4.12Å; Y36-Q65 WeakPolarHBondContact CE2-O 3.03Å; Y36-Q65 PolarHBondContact OH-O 3.21Å; Y36-M66 HydrophobicContact CD2-CG 4.03Å; Y36-M66 HydrophobicContact CE2-CG 4.23Å; Y36-M66 HydrophobicContact CG-CG 4.37Å
37	K	71.3	Confident	75.6	Confident	36 Å²	36	81.8 Å²	81.8	16%	0.157	39%	0.393	C	S	.	.	H	α-helix	trans	-55.2	-39.2	175.5	-71	-175.6	-180	-179.7	0	112	P31 C32 E33 E34 L39 Q41 D45	P31-K37 HydrophobicContact CG-CG 4.26Å; P31-K37 WeakPolarHBondContact O-CE 3Å; P31-K37 VanDerWaalsContact O-CG 3.25Å; P31-K37 WeakPolarHBondContact O-CG 3.07Å; C32-K37 WeakPolarHBondContact O-CE 2.94Å; E33-K37 PolarHBondContact O-N 2.01Å; E33-K37 VanDerWaalsContact O-N 3.17Å; E34-K37 PolarHBondContact O-N 3.38Å; K37-L39 VanDerWaalsContact C-N 3.32Å; K37-L39 PolarHBondContact O-N 3.07Å; K37-Q41 PolarHBondContact O-N 3.29Å; K37-Q41 VanDerWaalsContact O-N 3.11Å; K37-D45 IonicContact NZ-OD2 2.75Å; K37-D45 PolarHBondContact NZ-OD2 3.26Å
38	K	69.8	Low	75.5	Confident	187 Å²	187	82.6 Å²	82.6	81%	0.813	40%	0.402	S	S	*	.	H	α-helix	trans	-66.1	-32.1	175.4	-66.2	-174.7	-179.1	-179.2	0	113.3	Y36	Y36-K38 PolarHBondContact O-N 2.83Å
39	L	68.6	Low	75.3	Confident	110 Å²	110	86 Å²	86	58%	0.576	42%	0.415	S	S	*	.	H	α-helix	trans	-77.1	-37.8	-179.2	-73.6	161.2	0	0	0	112.2	Y36 K37	Y36-L39 HydrophobicContact CD1-CD1 3.94Å; Y36-L39 WeakPolarHBondContact O-CA 3.44Å; Y36-L39 WeakPolarHBondContact O-CB 3.35Å; Y36-L39 PolarHBondContact O-N 3.06Å; K37-L39 VanDerWaalsContact C-N 3.32Å; K37-L39 PolarHBondContact O-N 3.07Å
40	F	67.6	Low	75.1	Confident	66 Å²	66	91.9 Å²	91.9	29%	0.289	45%	0.446	S	S	.	.	H	α-helix	trans	-98.9	-8.6	-173.4	-68.1	-78.3	0	0	0	114.7	P31 Y36 I42 F61 M66	P31-F40 HydrophobicContact CG-CD2 4.19Å; Y36-F40 VanDerWaalsContact O-CD2 3.28Å; Y36-F40 WeakPolarHBondContact O-CD2 3.49Å; Y36-F40 PolarHBondContact O-N 2.91Å; F40-I42 HydrophobicContact CB-CD1 4.18Å; F40-I42 HydrophobicContact CB-CG1 4.28Å; F40-I42 WeakPolarHBondContact O-CG1 3.36Å; F40-I42 PolarHBondContact O-N 3.29Å; F40-F61 HydrophobicContact CE1-CD1 4.14Å; F40-F61 HydrophobicContact CE1-CE1 4.14Å; F40-F61 HydrophobicContact CZ-CD1 4.13Å; F40-M66 HydrophobicContact CD2-CE 4.28Å; F40-M66 HydrophobicContact CD2-SD 4.34Å; F40-M66 HydrophobicContact CE1-CE 4.26Å; F40-M66 HydrophobicContact CE2-CE 3.22Å; F40-M66 HydrophobicContact CE2-SD 3.8Å; F40-M66 HydrophobicContact CZ-CE 3.22Å; F40-M66 HydrophobicContact CZ-SD 4.13Å
41	Q	63.1	Low	75.2	Confident	177 Å²	177	87.2 Å²	87.2	83%	0.827	42%	0.422	S	S	*	.			trans	54.9	18.1	-174.4	-58.1	-177.2	7.5	0	0	114.4	K37	K37-Q41 PolarHBondContact O-N 3.29Å; K37-Q41 VanDerWaalsContact O-N 3.11Å
42	I	62.8	Low	75.2	Confident	81 Å²	81	88.4 Å²	88.4	42%	0.415	44%	0.435	S	S	.	.			trans	-97.3	117.4	176.7	-55.9	166.4	0	0	0	108	L30 F40	L30-I42 WeakPolarHBondContact O-CB 3.4Å; L30-I42 WeakPolarHBondContact O-CG2 3.49Å; F40-I42 HydrophobicContact CB-CD1 4.18Å; F40-I42 HydrophobicContact CB-CG1 4.28Å; F40-I42 WeakPolarHBondContact O-CG1 3.36Å; F40-I42 PolarHBondContact O-N 3.29Å
43	T	57.8	Low	75.6	Confident	111 Å²	111	87.7 Å²	87.7	68%	0.681	43%	0.43	S	S	*	.			trans	-125.4	21.5	-170.3	45.7	0	0	0	0	114.3	D45	T43-D45 PolarHBondContact O-N 3.29Å
44	K	67	Low	76.1	Confident	151 Å²	151	85 Å²	85	66%	0.657	42%	0.417	S	S	*	.			trans	-82.8	88	173.5	-66.3	-166.8	179.3	-173.2	0	109.8	C29	C29-K44 WeakPolarHBondContact CA-O 3.29Å
45	D	81.1	Confident	76.7	Confident	57 Å²	57	78.1 Å²	78.1	31%	0.305	39%	0.386	S	S	.	.			trans	-105.6	97.7	165.3	-165.2	-21.2	0	0	0	107.7	R27 V28 C29 K37 T43	R27-D45 IonicContact CZ-OD1 3.64Å; R27-D45 IonicContact CZ-OD2 3.44Å; R27-D45 IonicContact NE-OD1 2.72Å; R27-D45 PolarHBondContact NE-OD1 2.73Å; R27-D45 IonicContact NE-OD2 3.07Å; R27-D45 IonicContact NH2-OD1 3.55Å; R27-D45 PolarHBondContact NH2-OD1 3.07Å; R27-D45 IonicContact NH2-OD2 3.27Å; R27-D45 PolarHBondContact NH2-OD2 2.78Å; V28-D45 WeakPolarHBondContact O-CA 3.24Å; C29-D45 HydrophobicContact CB-CB 4.41Å; K37-D45 IonicContact NZ-OD2 2.75Å; K37-D45 PolarHBondContact NZ-OD2 3.26Å; T43-D45 PolarHBondContact O-N 3.29Å
46	E	86.9	Confident	77.3	Confident	93 Å²	93	73.1 Å²	73.1	44%	0.435	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	158.3	-172.7	64.5	-171.1	174	0	0	111.3	V28	V28-E46 HydrophobicContact CB-CG 4.14Å; V28-E46 PolarHBondContact N-O 3.13Å; V28-E46 PolarHBondContact O-N 3.01Å
47	I	86.4	Confident	78	Confident	90 Å²	90	73.3 Å²	73.3	46%	0.462	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	112.3	171.5	-63.5	174.6	0	0	0	106.6	K25 C26 L99	K25-I47 HydrophobicContact CB-CG2 4.19Å; C26-I47 WeakPolarHBondContact O-CA 3.17Å; I47-L99 HydrophobicContact CD1-CD2 4.33Å; I47-L99 HydrophobicContact CG1-CD2 4.28Å; I47-L99 HydrophobicContact CG2-CD2 3.94Å
48	L	85.4	Confident	78.6	Confident	76 Å²	76	76.1 Å²	76.1	40%	0.398	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138.5	176.9	-162	60.7	0	0	0	109.9	K25 C26 V28 C71	K25-L48 CarbonylContact C-O 3.53Å; K25-L48 VanDerWaalsContact CA-O 3.26Å; K25-L48 WeakPolarHBondContact CA-O 3.48Å; C26-L48 PolarHBondContact N-O 2Å; C26-L48 PolarHBondContact O-N 3.21Å; V28-L48 HydrophobicContact CG2-CB 3.84Å; V28-L48 HydrophobicContact CG2-CD2 4.41Å; L48-C71 HydrophobicContact CB-CB 4.24Å; L48-C71 HydrophobicContact CD2-CB 3.8Å; L48-C71 HydrophobicContact CG-CB 4.45Å
49	H	82.8	Confident	79.1	Confident	103 Å²	103	67.8 Å²	67.8	48%	0.477	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	166	176.7	-61.1	-83	0	0	0	110.4	K25	K25-H49 WeakPolarHBondContact CD-ND1 3.19Å; K25-H49 WeakPolarHBondContact CE-ND1 2.94Å; K25-H49 WeakPolarHBondContact CG-ND1 3.35Å
50	N	82.1	Confident	79.7	Confident	125 Å²	125	65.1 Å²	65.1	67%	0.668	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	63	38.8	175.3	-55.5	-18.6	0	0	0	114.7	A23 I24	A23-N50 HydrophobicContact CB-CB 4.36Å; A23-N50 WeakPolarHBondContact CB-OD1 3.42Å; I24-N50 PolarHBondContact O-N 2.69Å
51	C	83	Confident	80	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.014	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	150.4	172	-51.3	0	0	0	0	110.7	I24 C26 C71	I24-C51 HydrophobicContact CG1-CB 3.81Å; I24-C51 WeakPolarHBondContact CG1-O 3.34Å; I24-C51 PolarHBondContact N-O 3.31Å; I24-C51 WeakPolarHBondContact O-CB 3.48Å; I24-C51 PolarHBondContact O-N 2.99Å; C26-C51 HydrophobicContact CB-CB 4.36Å; C26-C51 WeakPolarHBondContact SG-CB 3.09Å; C51-C71 WeakPolarHBondContact CA-SG 3.46Å; C51-C71 HydrophobicContact CB-CB 4.07Å; C51-C71 WeakPolarHBondContact CB-SG 3.39Å; C51-C71 WeakPolarHBondContact SG-CB 2.93Å; C51-C71 CovalentContact SG-SG 2.01Å; C51-C71 PolarHBondContact SG-SG 2.86Å
52	G	80.2	Confident	80.7	Confident	27 Å²	27	64.4 Å²	64.4	28%	0.278	33%	0.331	S	S	.	.	S	Bend	trans	-88.7	-33.7	165.8	0	0	0	0	0	112.1	L72 L73	G52-L72 CarbonylContact C-O 3.54Å; G52-L72 WeakPolarHBondContact CA-O 3.39Å; G52-L72 PolarHBondContact N-O 2.72Å; G52-L73 WeakPolarHBondContact CA-O 3.5Å
53	V	87.3	Confident	81.4	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147	178.5	72.7	0	0	0	0	110.4	L72 Q74 C75 C94 C95 Y96	V53-L72 HydrophobicContact CG1-CB 3.71Å; V53-L72 PolarHBondContact N-O 3.12Å; V53-L72 PolarHBondContact O-N 2.83Å; V53-Q74 VanDerWaalsContact CG1-C 3.46Å; V53-C75 HydrophobicContact CG1-CB 4.37Å; V53-C75 HydrophobicContact CG2-CB 4.27Å; V53-C94 HydrophobicContact CG2-CB 3.77Å; V53-C95 VanDerWaalsContact CG2-O 3.24Å; V53-C95 WeakPolarHBondContact CG2-O 3.37Å; V53-Y96 HydrophobicContact CB-CD1 3.95Å; V53-Y96 HydrophobicContact CB-CE1 3.8Å; V53-Y96 HydrophobicContact CG2-CD1 3.66Å; V53-Y96 HydrophobicContact CG2-CD2 4.46Å; V53-Y96 HydrophobicContact CG2-CE1 3.47Å; V53-Y96 VanDerWaalsContact CG2-CE1 3.47Å; V53-Y96 HydrophobicContact CG2-CE2 4.29Å; V53-Y96 HydrophobicContact CG2-CG 4.16Å
54	C	88.9	Confident	82.3	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	138.4	166.5	-47	0	0	0	0	109.7	C26 G70 C94 C95 C100 N101	C26-C54 WeakPolarHBondContact CA-SG 3.15Å; C26-C54 HydrophobicContact CB-CB 3.71Å; C26-C54 WeakPolarHBondContact CB-SG 3.14Å; C26-C54 WeakPolarHBondContact SG-CA 3.13Å; C26-C54 WeakPolarHBondContact SG-CB 3.39Å; C26-C54 PolarHBondContact SG-N 2.78Å; C26-C54 VanDerWaalsContact SG-N 3.45Å; C26-C54 CovalentContact SG-SG 2.02Å; C26-C54 PolarHBondContact SG-SG 2.02Å; C54-G70 WeakPolarHBondContact CA-O 3.39Å; C54-C94 CarbonylContact O-C 3.58Å; C54-C94 WeakPolarHBondContact O-CA 3.19Å; C54-C95 PolarHBondContact N-O 2.86Å; C54-C95 PolarHBondContact O-N 3.45Å; C54-C100 WeakPolarHBondContact CB-SG 3.37Å; C54-N101 HydrophobicContact CB-CB 3.87Å
55	I	88.7	Confident	83	Confident	13 Å²	13	63.2 Å²	63.2	7%	0.067	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.2	177.4	-172	167.7	0	0	0	109.9	R69 G70 L72 P76 L84 Y92 D93 N101	I55-R69 CarbonylContact O-C 3.53Å; I55-R69 VanDerWaalsContact O-CA 3.29Å; I55-R69 WeakPolarHBondContact O-CA 3.48Å; I55-G70 PolarHBondContact N-O 3.43Å; I55-G70 PolarHBondContact O-N 3.47Å; I55-L72 HydrophobicContact CB-CD1 4.14Å; I55-L72 HydrophobicContact CD1-CD1 3.81Å; I55-L72 HydrophobicContact CG2-CD1 3.84Å; I55-L72 HydrophobicContact CG2-CG 4.06Å; I55-P76 HydrophobicContact CD1-CG 4.05Å; I55-L84 HydrophobicContact CD1-CD2 4.36Å; I55-Y92 HydrophobicContact CD1-CD2 3.91Å; I55-Y92 HydrophobicContact CD1-CG 4.05Å; I55-Y92 HydrophobicContact CG1-CD2 4.27Å; I55-Y92 HydrophobicContact CG1-CG 4.5Å; I55-D93 WeakPolarHBondContact CA-O 3.08Å; I55-N101 PolarHBondContact O-ND2 3.37Å
56	T	89.5	Confident	83	Confident	13 Å²	13	61.3 Å²	61.3	8%	0.08	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117.8	164.9	-59.3	0	0	0	0	107.5	Y58 E67 G68 R69 Y92 D93 N101	T56-Y58 HydrophobicContact CG2-CE1 4.31Å; T56-Y58 HydrophobicContact CG2-CE2 3.91Å; T56-E67 HydrophobicContact CG2-CG 3.71Å; T56-E67 VanDerWaalsContact CG2-OE1 3.28Å; T56-E67 WeakPolarHBondContact CG2-OE1 3.45Å; T56-G68 CarbonylContact C-O 3.54Å; T56-G68 WeakPolarHBondContact CA-O 3.47Å; T56-R69 HydrophobicContact CG2-CG 4.31Å; T56-Y92 CarbonylContact O-C 3.59Å; T56-Y92 WeakPolarHBondContact O-CA 3.42Å; T56-Y92 WeakPolarHBondContact O-CB 3.41Å; T56-D93 PolarHBondContact N-O 2.85Å; T56-D93 PolarHBondContact O-N 3.01Å; T56-N101 WeakPolarHBondContact OG1-CB 3.21Å
57	A	87.3	Confident	83	Confident	21 Å²	21	58.1 Å²	58.1	17%	0.174	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.9	178.6	0	0	0	0	0	110.1	E67 G68 V89	A57-E67 WeakPolarHBondContact O-CA 3.31Å; A57-G68 PolarHBondContact N-O 3.49Å; A57-G68 PolarHBondContact O-N 2.85Å; A57-V89 HydrophobicContact CB-CG1 4.07Å; A57-V89 HydrophobicContact CB-CG2 4.45Å
58	Y	84.7	Confident	83	Confident	95 Å²	95	54.1 Å²	54.1	37%	0.373	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	122.1	175.3	-57.6	-85.8	0	0	0	108.6	T56 M66 E67 N90 K91	T56-Y58 HydrophobicContact CG2-CE1 4.31Å; T56-Y58 HydrophobicContact CG2-CE2 3.91Å; Y58-M66 WeakPolarHBondContact CA-O 3.3Å; Y58-E67 HydrophobicContact CD1-CB 4.36Å; Y58-E67 HydrophobicContact CD1-CG 4.19Å; Y58-E67 HydrophobicContact CE1-CB 4.4Å; Y58-E67 HydrophobicContact CE1-CG 3.89Å; Y58-N90 PolarHBondContact O-N 3.11Å; Y58-K91 HydrophobicContact CD2-CB 4.33Å; Y58-K91 HydrophobicContact CD2-CD 4.49Å; Y58-K91 HydrophobicContact CD2-CG 4.43Å; Y58-K91 PolarHBondContact N-O 3.45Å; Y58-K91 PolarHBondContact O-N 2.93Å
59	S	80.7	Confident	83.2	Confident	13 Å²	13	51.4 Å²	51.4	9%	0.091	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	153.3	179.8	50.3	0	0	0	0	111.4	Q65 M66 L88	S59-Q65 CarbonylContact O-C 3.52Å; S59-Q65 WeakPolarHBondContact O-CA 3.33Å; S59-M66 PolarHBondContact N-O 3.49Å; S59-M66 PolarHBondContact O-N 2.93Å; S59-M66 PolarHBondContact OG-O 3.2Å; S59-L88 WeakPolarHBondContact CA-O 3.33Å; S59-L88 WeakPolarHBondContact CB-O 3.39Å
60	T	80.5	Confident	83.4	Confident	53 Å²	53	47.1 Å²	47.1	33%	0.325	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.6	166.4	-58.9	0	0	0	0	108	Y64 L88 N90	T60-Y64 CarbonylContact C-O 3.58Å; T60-Y64 WeakPolarHBondContact CA-O 3.4Å; T60-L88 PolarHBondContact N-O 3.28Å; T60-N90 WeakPolarHBondContact CB-ND2 3Å; T60-N90 PolarHBondContact N-ND2 2.89Å; T60-N90 PolarHBondContact OG1-ND2 2.94Å
61	F	74.4	Confident	83.7	Confident	78 Å²	78	42.6 Å²	42.6	34%	0.342	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.2	177.5	-176.1	-105.6	0	0	0	109.7	F40 G63 Y64 M66 L88	F40-F61 HydrophobicContact CE1-CD1 4.14Å; F40-F61 HydrophobicContact CE1-CE1 4.14Å; F40-F61 HydrophobicContact CZ-CD1 4.13Å; F61-G63 PolarHBondContact O-N 2.04Å; F61-G63 VanDerWaalsContact O-N 3.15Å; F61-Y64 PolarHBondContact N-O 2.84Å; F61-Y64 WeakPolarHBondContact O-CB 3.25Å; F61-Y64 PolarHBondContact O-N 2.93Å; F61-M66 HydrophobicContact CB-CE 3.83Å; F61-M66 HydrophobicContact CD1-CE 4.13Å; F61-M66 HydrophobicContact CG-CE 4.47Å; F61-L88 HydrophobicContact CB-CD1 3.82Å; F61-L88 HydrophobicContact CD2-CD1 3.43Å; F61-L88 VanDerWaalsContact CD2-CD1 3.43Å; F61-L88 HydrophobicContact CE2-CD1 4.38Å; F61-L88 HydrophobicContact CG-CD1 4.01Å
62	Q	76.5	Confident	83.9	Confident	150 Å²	150	45.5 Å²	45.5	70%	0.701	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	35.6	-179.1	-61.7	-179.8	-17.2	0	0	113.8	Y64	Q62-Y64 VanDerWaalsContact C-N 3.29Å; Q62-Y64 HydrophobicContact CB-CD2 4.34Å; Q62-Y64 WeakPolarHBondContact O-CD2 3.1Å; Q62-Y64 PolarHBondContact O-N 2.89Å
63	G	77.4	Confident	84.1	Confident	65 Å²	65	51.1 Å²	51.1	67%	0.67	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-8.8	-177.6	0	0	0	0	0	115.2	F61	F61-G63 PolarHBondContact O-N 2.04Å; F61-G63 VanDerWaalsContact O-N 3.15Å
64	Y	77.2	Confident	83.9	Confident	110 Å²	110	58.9 Å²	58.9	43%	0.431	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.4	175.8	-59.2	-77.2	0	0	0	110.9	Y36 T60 F61 Q62	Y36-Y64 HydrophobicContact CD1-CD1 4.5Å; Y36-Y64 AromaticContact CE1-CD1 3.69Å; Y36-Y64 HydrophobicContact CE1-CD1 3.69Å; Y36-Y64 HydrophobicContact CE1-CG 4.12Å; T60-Y64 CarbonylContact C-O 3.58Å; T60-Y64 WeakPolarHBondContact CA-O 3.4Å; F61-Y64 PolarHBondContact N-O 2.84Å; F61-Y64 WeakPolarHBondContact O-CB 3.25Å; F61-Y64 PolarHBondContact O-N 2.93Å; Q62-Y64 VanDerWaalsContact C-N 3.29Å; Q62-Y64 HydrophobicContact CB-CD2 4.34Å; Q62-Y64 WeakPolarHBondContact O-CD2 3.1Å; Q62-Y64 PolarHBondContact O-N 2.89Å
65	Q	80.9	Confident	83.7	Confident	144 Å²	144	60.8 Å²	60.8	67%	0.673	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.6	168.2	-67.1	-178.1	-11.6	0	0	109.1	Y36 S59	Y36-Q65 WeakPolarHBondContact CE2-O 3.03Å; Y36-Q65 PolarHBondContact OH-O 3.21Å; S59-Q65 CarbonylContact O-C 3.52Å; S59-Q65 WeakPolarHBondContact O-CA 3.33Å
66	M	82.9	Confident	83.5	Confident	16 Å²	16	61.3 Å²	61.3	8%	0.079	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.5	179.8	-58.8	-179.1	-157.9	0	0	110.7	Y36 F40 Y58 S59 F61	Y36-M66 HydrophobicContact CD2-CG 4.03Å; Y36-M66 HydrophobicContact CE2-CG 4.23Å; Y36-M66 HydrophobicContact CG-CG 4.37Å; F40-M66 HydrophobicContact CD2-CE 4.28Å; F40-M66 HydrophobicContact CD2-SD 4.34Å; F40-M66 HydrophobicContact CE1-CE 4.26Å; F40-M66 HydrophobicContact CE2-CE 3.22Å; F40-M66 HydrophobicContact CE2-SD 3.8Å; F40-M66 HydrophobicContact CZ-CE 3.22Å; F40-M66 HydrophobicContact CZ-SD 4.13Å; Y58-M66 WeakPolarHBondContact CA-O 3.3Å; S59-M66 PolarHBondContact N-O 3.49Å; S59-M66 PolarHBondContact O-N 2.93Å; S59-M66 PolarHBondContact OG-O 3.2Å; F61-M66 HydrophobicContact CB-CE 3.83Å; F61-M66 HydrophobicContact CD1-CE 4.13Å; F61-M66 HydrophobicContact CG-CE 4.47Å
67	E	85.1	Confident	83	Confident	26 Å²	26	64.4 Å²	64.4	12%	0.121	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127	169.2	-169.2	-171.8	159.2	0	0	110.1	C32 T56 A57 Y58 R69	C32-E67 WeakPolarHBondContact CB-O 3.39Å; C32-E67 PolarHBondContact N-O 3.48Å; T56-E67 HydrophobicContact CG2-CG 3.71Å; T56-E67 VanDerWaalsContact CG2-OE1 3.28Å; T56-E67 WeakPolarHBondContact CG2-OE1 3.45Å; A57-E67 WeakPolarHBondContact O-CA 3.31Å; Y58-E67 HydrophobicContact CD1-CB 4.36Å; Y58-E67 HydrophobicContact CD1-CG 4.19Å; Y58-E67 HydrophobicContact CE1-CB 4.4Å; Y58-E67 HydrophobicContact CE1-CG 3.89Å; E67-R69 IonicContact OE1-CZ 2.68Å; E67-R69 IonicContact OE1-NE 3.35Å; E67-R69 PolarHBondContact OE1-NE 3.46Å; E67-R69 IonicContact OE1-NH2 3.12Å; E67-R69 PolarHBondContact OE1-NH2 3.45Å; E67-R69 IonicContact OE2-NH2 2.77Å; E67-R69 PolarHBondContact OE2-NH2 3.34Å
68	G	86.4	Confident	82.2	Confident	7 Å²	7	71.4 Å²	71.4	7%	0.072	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	145	169	0	0	0	0	0	110.6	C29 T56 A57	C29-G68 CarbonylContact O-C 3.58Å; C29-G68 WeakPolarHBondContact O-CA 3.42Å; T56-G68 CarbonylContact C-O 3.54Å; T56-G68 WeakPolarHBondContact CA-O 3.47Å; A57-G68 PolarHBondContact N-O 3.49Å; A57-G68 PolarHBondContact O-N 2.85Å
69	R	89.5	Confident	81.4	Confident	19 Å²	19	75 Å²	75	7%	0.072	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.2	177.3	-66.1	175.1	-169.8	175.1	8.9	109.9	R27 V28 C29 C32 I55 T56 E67 N101	R27-R69 VanDerWaalsContact O-CB 3.29Å; R27-R69 WeakPolarHBondContact O-CB 3.28Å; V28-R69 WeakPolarHBondContact CA-O 3.09Å; C29-R69 PolarHBondContact N-O 3.49Å; C29-R69 PolarHBondContact O-N 3.33Å; C32-R69 WeakPolarHBondContact SG-CG 3.44Å; I55-R69 CarbonylContact O-C 3.53Å; I55-R69 VanDerWaalsContact O-CA 3.29Å; I55-R69 WeakPolarHBondContact O-CA 3.48Å; T56-R69 HydrophobicContact CG2-CG 4.31Å; E67-R69 IonicContact OE1-CZ 2.68Å; E67-R69 IonicContact OE1-NE 3.35Å; E67-R69 PolarHBondContact OE1-NE 3.46Å; E67-R69 IonicContact OE1-NH2 3.12Å; E67-R69 PolarHBondContact OE1-NH2 3.45Å; E67-R69 IonicContact OE2-NH2 2.77Å; E67-R69 PolarHBondContact OE2-NH2 3.34Å; R69-N101 WeakPolarHBondContact CD-O 3.19Å; R69-N101 HydrophobicContact CG-CB 4.49Å; R69-N101 PolarHBondContact NE-O 3.24Å; R69-N101 PolarHBondContact NH1-O 3.35Å
70	G	88.1	Confident	80.5	Confident	13 Å²	13	74.5 Å²	74.5	13%	0.134	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	172.4	-174.8	0	0	0	0	0	113.9	C54 I55 N101	C54-G70 WeakPolarHBondContact CA-O 3.39Å; I55-G70 PolarHBondContact N-O 3.43Å; I55-G70 PolarHBondContact O-N 3.47Å; G70-N101 PolarHBondContact O-ND2 3.37Å
71	C	88.1	Confident	79.6	Confident	30 Å²	30	74.7 Å²	74.7	20%	0.203	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.5	175	170.3	0	0	0	0	107.2	C26 V28 L48 C51	C26-C71 HydrophobicContact CB-CB 4.02Å; V28-C71 HydrophobicContact CG2-CB 3.95Å; L48-C71 HydrophobicContact CB-CB 4.24Å; L48-C71 HydrophobicContact CD2-CB 3.8Å; L48-C71 HydrophobicContact CG-CB 4.45Å; C51-C71 WeakPolarHBondContact CA-SG 3.46Å; C51-C71 HydrophobicContact CB-CB 4.07Å; C51-C71 WeakPolarHBondContact CB-SG 3.39Å; C51-C71 WeakPolarHBondContact SG-CB 2.93Å; C51-C71 CovalentContact SG-SG 2.01Å; C51-C71 PolarHBondContact SG-SG 2.86Å
72	L	86.6	Confident	78.6	Confident	62 Å²	62	74.5 Å²	74.5	33%	0.325	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	160.9	177.9	-65.2	174	0	0	0	109.8	G52 V53 I55 P76	G52-L72 CarbonylContact C-O 3.54Å; G52-L72 WeakPolarHBondContact CA-O 3.39Å; G52-L72 PolarHBondContact N-O 2.72Å; V53-L72 HydrophobicContact CG1-CB 3.71Å; V53-L72 PolarHBondContact N-O 3.12Å; V53-L72 PolarHBondContact O-N 2.83Å; I55-L72 HydrophobicContact CB-CD1 4.14Å; I55-L72 HydrophobicContact CD1-CD1 3.81Å; I55-L72 HydrophobicContact CG2-CD1 3.84Å; I55-L72 HydrophobicContact CG2-CG 4.06Å; L72-P76 HydrophobicContact CD1-CG 4.45Å
73	L	84.4	Confident	77.6	Confident	146 Å²	146	74.7 Å²	74.7	76%	0.764	40%	0.396	S	S	*	.	S	Bend	trans	-74.7	-36.7	172.3	-69.6	173.2	0	0	0	111.7	G52	G52-L73 WeakPolarHBondContact CA-O 3.5Å
74	Q	84.1	Confident	76.7	Confident	163 Å²	163	74.6 Å²	74.6	76%	0.762	38%	0.379	S	S	*	.	S	Bend	trans	-143.2	150.2	-178.8	-64.4	-179.3	9.1	0	0	109.7	V53	V53-Q74 VanDerWaalsContact CG1-C 3.46Å
75	C	85	Confident	76	Confident	39 Å²	39	72.4 Å²	72.4	26%	0.264	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-72.8	128.3	175.9	-174.4	0	0	0	0	108.6	V53 C94 Y96	V53-C75 HydrophobicContact CG1-CB 4.37Å; V53-C75 HydrophobicContact CG2-CB 4.27Å; C75-C94 HydrophobicContact CB-CB 3.69Å; C75-C94 WeakPolarHBondContact CB-SG 3.31Å; C75-C94 WeakPolarHBondContact SG-CB 3.42Å; C75-C94 CovalentContact SG-SG 2.04Å; C75-C94 PolarHBondContact SG-SG 3.43Å; C75-Y96 VanDerWaalsContact CB-OH 3.29Å; C75-Y96 WeakPolarHBondContact CB-OH 3.37Å
76	P	83.7	Confident	74.7	Confident	24 Å²	24	70.4 Å²	70.4	16%	0.156	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-59.1	151.9	174.8	23.1	-31.4	0	0	0	110.3	I55 L72 L84 Y92	I55-P76 HydrophobicContact CD1-CG 4.05Å; L72-P76 HydrophobicContact CD1-CG 4.45Å; P76-L84 HydrophobicContact CB-CD1 4.15Å; P76-L84 HydrophobicContact CB-CG 4.44Å; P76-L84 HydrophobicContact CG-CD1 3.69Å; P76-L84 HydrophobicContact CG-CD2 4.08Å; P76-L84 HydrophobicContact CG-CG 4.22Å; P76-Y92 HydrophobicContact CG-CD2 4.42Å; P76-Y92 HydrophobicContact CG-CE1 4.35Å; P76-Y92 HydrophobicContact CG-CE2 3.85Å; P76-Y92 PolarHBondContact O-OH 3.44Å
77	P	80.1	Confident	73.4	Confident	79 Å²	79	73.4 Å²	73.4	51%	0.513	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-69.3	145.5	174.4	25.4	-29.4	0	0	0	110.2	H79 A80 Y92	P77-H79 PolarHBondContact O-N 2.78Å; P77-A80 HydrophobicContact CG-CB 3.69Å; P77-A80 WeakPolarHBondContact O-CB 3.46Å; P77-A80 PolarHBondContact O-N 2.77Å; P77-Y92 PolarHBondContact O-OH 3.43Å
78	K	70.3	Confident	72.4	Confident	168 Å²	168	74.9 Å²	74.9	73%	0.73	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-54.9	-25.5	-176.1	-72.3	-174.6	178	179.9	0	113.9	A80 I81 Y92	K78-A80 VanDerWaalsContact C-N 3.35Å; K78-I81 VanDerWaalsContact O-CD1 3.31Å; K78-I81 WeakPolarHBondContact O-CD1 3.16Å; K78-I81 VanDerWaalsContact O-CG1 3.3Å; K78-I81 WeakPolarHBondContact O-CG1 2.93Å; K78-Y92 WeakPolarHBondContact CA-OH 3.28Å; K78-Y92 PolarHBondContact N-OH 3.38Å; K78-Y92 VanDerWaalsContact N-OH 3.12Å
79	H	66.9	Low	71.5	Confident	169 Å²	169	75.3 Å²	75.3	78%	0.782	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-82.8	-13.9	-179.6	-35.1	-63.1	0	0	0	112.8	P77 I81	P77-H79 PolarHBondContact O-N 2.78Å; H79-I81 VanDerWaalsContact C-N 3.31Å; H79-I81 PolarHBondContact O-N 2.98Å
80	A	62.8	Low	70.6	Confident	4 Å²	4	79.1 Å²	79.1	3%	0.033	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-91.8	20	178.6	0	0	0	0	0	113.2	P77 K78 S82 Q83 L84	P77-A80 HydrophobicContact CG-CB 3.69Å; P77-A80 WeakPolarHBondContact O-CB 3.46Å; P77-A80 PolarHBondContact O-N 2.77Å; K78-A80 VanDerWaalsContact C-N 3.35Å; A80-S82 PolarHBondContact O-N 3.38Å; A80-Q83 HydrophobicContact CB-CB 4.09Å; A80-Q83 HydrophobicContact CB-CG 3.99Å; A80-Q83 WeakPolarHBondContact O-CA 3.24Å; A80-Q83 WeakPolarHBondContact O-CB 3.29Å; A80-Q83 PolarHBondContact O-N 3.16Å; A80-L84 PolarHBondContact O-N 3.38Å
81	I	61.5	Low	70.3	Confident	56 Å²	56	83.8 Å²	83.8	29%	0.287	46%	0.46	S	S	.	.	H	α-helix	trans	-52.9	-38	170.5	-68.2	165.6	0	0	0	110.2	K78 H79 Q83 L84 V89 Y92	K78-I81 VanDerWaalsContact O-CD1 3.31Å; K78-I81 WeakPolarHBondContact O-CD1 3.16Å; K78-I81 VanDerWaalsContact O-CG1 3.3Å; K78-I81 WeakPolarHBondContact O-CG1 2.93Å; H79-I81 VanDerWaalsContact C-N 3.31Å; H79-I81 PolarHBondContact O-N 2.98Å; I81-Q83 PolarHBondContact O-N 3.42Å; I81-L84 PolarHBondContact O-N 3.04Å; I81-V89 HydrophobicContact CG2-CB 4.47Å; I81-V89 WeakPolarHBondContact CG2-O 3.31Å; I81-Y92 HydrophobicContact CD1-CE1 4.4Å; I81-Y92 HydrophobicContact CG1-CD1 3.87Å; I81-Y92 HydrophobicContact CG1-CE1 3.46Å; I81-Y92 VanDerWaalsContact CG1-CE1 3.46Å
82	S	53.5	Low	70.2	Confident	74 Å²	74	83.2 Å²	83.2	52%	0.517	45%	0.454	S	S	.	.	H	α-helix	trans	-64	-19.5	174.1	55.3	0	0	0	0	114.5	A80 P86	A80-S82 PolarHBondContact O-N 3.38Å; S82-P86 WeakPolarHBondContact O-CB 3.47Å; S82-P86 WeakPolarHBondContact O-CD 3.39Å; S82-P86 WeakPolarHBondContact O-CG 3.46Å
83	Q	54.9	Low	70.3	Confident	155 Å²	155	83.8 Å²	83.8	72%	0.724	46%	0.457	S	S	*	.	H	α-helix	trans	-91.6	-27.3	-180	-59.9	-178.7	-11	0	0	112.6	A80 I81	A80-Q83 HydrophobicContact CB-CB 4.09Å; A80-Q83 HydrophobicContact CB-CG 3.99Å; A80-Q83 WeakPolarHBondContact O-CA 3.24Å; A80-Q83 WeakPolarHBondContact O-CB 3.29Å; A80-Q83 PolarHBondContact O-N 3.16Å; I81-Q83 PolarHBondContact O-N 3.42Å
84	L	58.1	Low	70.4	Confident	62 Å²	62	78.5 Å²	78.5	33%	0.325	43%	0.433	S	S	.	.	H	α-helix	trans	-67.4	-49.3	179.9	-78.9	152.9	0	0	0	111.2	I55 P76 A80 I81 Y92	I55-L84 HydrophobicContact CD1-CD2 4.36Å; P76-L84 HydrophobicContact CB-CD1 4.15Å; P76-L84 HydrophobicContact CB-CG 4.44Å; P76-L84 HydrophobicContact CG-CD1 3.69Å; P76-L84 HydrophobicContact CG-CD2 4.08Å; P76-L84 HydrophobicContact CG-CG 4.22Å; A80-L84 PolarHBondContact O-N 3.38Å; I81-L84 PolarHBondContact O-N 3.04Å; L84-Y92 HydrophobicContact CD1-CD1 3.53Å; L84-Y92 HydrophobicContact CD1-CE1 3.53Å; L84-Y92 HydrophobicContact CD1-CG 4.24Å
85	T	62.3	Low	70.5	Confident	64 Å²	64	71.8 Å²	71.8	39%	0.393	40%	0.403	S	S	.	.	S	Bend	trans	-166.9	101	166	-33.9	0	0	0	0	107.6	G87 L88	T85-G87 PolarHBondContact O-N 2.97Å; T85-L88 HydrophobicContact CG2-CB 3.9Å; T85-L88 HydrophobicContact CG2-CD2 3.89Å; T85-L88 PolarHBondContact O-N 2.97Å; T85-L88 VanDerWaalsContact O-N 3.1Å
86	P	53.8	Low	70.5	Confident	102 Å²	102	77 Å²	77	66%	0.662	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	126	-173.6	0.6	-2.8	0	0	0	111.3	S82 L88	S82-P86 WeakPolarHBondContact O-CB 3.47Å; S82-P86 WeakPolarHBondContact O-CD 3.39Å; S82-P86 WeakPolarHBondContact O-CG 3.46Å; P86-L88 VanDerWaalsContact C-N 3.28Å; P86-L88 PolarHBondContact O-N 3.47Å
87	G	55.8	Low	70.3	Confident	80 Å²	80	80.3 Å²	80.3	83%	0.825	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-2.4	177.8	0	0	0	0	0	115.9	T85	T85-G87 PolarHBondContact O-N 2.97Å
88	L	65.6	Low	70.3	Confident	56 Å²	56	77.3 Å²	77.3	29%	0.293	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-46	178.9	-159.7	66.8	0	0	0	111.9	S59 T60 F61 T85 P86	S59-L88 WeakPolarHBondContact CA-O 3.33Å; S59-L88 WeakPolarHBondContact CB-O 3.39Å; T60-L88 PolarHBondContact N-O 3.28Å; F61-L88 HydrophobicContact CB-CD1 3.82Å; F61-L88 HydrophobicContact CD2-CD1 3.43Å; F61-L88 VanDerWaalsContact CD2-CD1 3.43Å; F61-L88 HydrophobicContact CE2-CD1 4.38Å; F61-L88 HydrophobicContact CG-CD1 4.01Å; T85-L88 HydrophobicContact CG2-CB 3.9Å; T85-L88 HydrophobicContact CG2-CD2 3.89Å; T85-L88 PolarHBondContact O-N 2.97Å; T85-L88 VanDerWaalsContact O-N 3.1Å; P86-L88 VanDerWaalsContact C-N 3.28Å; P86-L88 PolarHBondContact O-N 3.47Å
89	V	66	Low	70.8	Confident	16 Å²	16	70.9 Å²	70.9	10%	0.097	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.5	-177.4	-178.1	0	0	0	0	110.2	A57 I81 K91	A57-V89 HydrophobicContact CB-CG1 4.07Å; A57-V89 HydrophobicContact CB-CG2 4.45Å; I81-V89 HydrophobicContact CG2-CB 4.47Å; I81-V89 WeakPolarHBondContact CG2-O 3.31Å; V89-K91 WeakPolarHBondContact CG1-O 3.46Å
90	N	70.6	Confident	71.7	Confident	100 Å²	100	63.6 Å²	63.6	54%	0.535	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-37.2	177.9	-65.6	-32.5	0	0	0	112	Y58 T60	Y58-N90 PolarHBondContact O-N 3.11Å; T60-N90 WeakPolarHBondContact CB-ND2 3Å; T60-N90 PolarHBondContact N-ND2 2.89Å; T60-N90 PolarHBondContact OG1-ND2 2.94Å
91	K	83	Confident	72.7	Confident	110 Å²	110	63.6 Å²	63.6	48%	0.478	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	147.4	-176.7	-178.2	-177.3	175.5	-156.9	0	108.8	Y58 V89 D93	Y58-K91 HydrophobicContact CD2-CB 4.33Å; Y58-K91 HydrophobicContact CD2-CD 4.49Å; Y58-K91 HydrophobicContact CD2-CG 4.43Å; Y58-K91 PolarHBondContact N-O 3.45Å; Y58-K91 PolarHBondContact O-N 2.93Å; V89-K91 WeakPolarHBondContact CG1-O 3.46Å; K91-D93 WeakPolarHBondContact CE-OD1 3.4Å; K91-D93 VanDerWaalsContact CE-OD2 3.24Å; K91-D93 WeakPolarHBondContact CE-OD2 3.27Å; K91-D93 IonicContact NZ-OD1 2.73Å; K91-D93 IonicContact NZ-OD2 2.69Å; K91-D93 PolarHBondContact NZ-OD2 3.35Å; K91-D93 VanDerWaalsContact NZ-OD2 3.07Å
92	Y	85.9	Confident	73.5	Confident	19 Å²	19	66.8 Å²	66.8	8%	0.075	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.7	162.4	67.8	-94.8	0	0	0	110.5	I55 T56 P76 P77 K78 I81 L84	I55-Y92 HydrophobicContact CD1-CD2 3.91Å; I55-Y92 HydrophobicContact CD1-CG 4.05Å; I55-Y92 HydrophobicContact CG1-CD2 4.27Å; I55-Y92 HydrophobicContact CG1-CG 4.5Å; T56-Y92 CarbonylContact O-C 3.59Å; T56-Y92 WeakPolarHBondContact O-CA 3.42Å; T56-Y92 WeakPolarHBondContact O-CB 3.41Å; P76-Y92 HydrophobicContact CG-CD2 4.42Å; P76-Y92 HydrophobicContact CG-CE1 4.35Å; P76-Y92 HydrophobicContact CG-CE2 3.85Å; P76-Y92 PolarHBondContact O-OH 3.44Å; P77-Y92 PolarHBondContact O-OH 3.43Å; K78-Y92 WeakPolarHBondContact CA-OH 3.28Å; K78-Y92 PolarHBondContact N-OH 3.38Å; K78-Y92 VanDerWaalsContact N-OH 3.12Å; I81-Y92 HydrophobicContact CD1-CE1 4.4Å; I81-Y92 HydrophobicContact CG1-CD1 3.87Å; I81-Y92 HydrophobicContact CG1-CE1 3.46Å; I81-Y92 VanDerWaalsContact CG1-CE1 3.46Å; L84-Y92 HydrophobicContact CD1-CD1 3.53Å; L84-Y92 HydrophobicContact CD1-CE1 3.53Å; L84-Y92 HydrophobicContact CD1-CG 4.24Å
93	D	87.2	Confident	73.9	Confident	73 Å²	73	68.9 Å²	68.9	39%	0.39	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.2	174.1	-65.3	-55.7	0	0	0	108.3	I55 T56 K91	I55-D93 WeakPolarHBondContact CA-O 3.08Å; T56-D93 PolarHBondContact N-O 2.85Å; T56-D93 PolarHBondContact O-N 3.01Å; K91-D93 WeakPolarHBondContact CE-OD1 3.4Å; K91-D93 VanDerWaalsContact CE-OD2 3.24Å; K91-D93 WeakPolarHBondContact CE-OD2 3.27Å; K91-D93 IonicContact NZ-OD1 2.73Å; K91-D93 IonicContact NZ-OD2 2.69Å; K91-D93 PolarHBondContact NZ-OD2 3.35Å; K91-D93 VanDerWaalsContact NZ-OD2 3.07Å
94	C	88	Confident	73.7	Confident	36 Å²	36	65.8 Å²	65.8	24%	0.243	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	149	179.1	-69.1	0	0	0	0	110.9	V53 C54 C75	V53-C94 HydrophobicContact CG2-CB 3.77Å; C54-C94 CarbonylContact O-C 3.58Å; C54-C94 WeakPolarHBondContact O-CA 3.19Å; C75-C94 HydrophobicContact CB-CB 3.69Å; C75-C94 WeakPolarHBondContact CB-SG 3.31Å; C75-C94 WeakPolarHBondContact SG-CB 3.42Å; C75-C94 CovalentContact SG-SG 2.04Å; C75-C94 PolarHBondContact SG-SG 3.43Å
95	C	86.5	Confident	73.5	Confident	21 Å²	21	71.4 Å²	71.4	14%	0.142	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	149.3	176.2	53.1	0	0	0	0	111.8	V53 C54 Y97 C100	V53-C95 VanDerWaalsContact CG2-O 3.24Å; V53-C95 WeakPolarHBondContact CG2-O 3.37Å; C54-C95 PolarHBondContact N-O 2.86Å; C54-C95 PolarHBondContact O-N 3.45Å; C95-Y97 HydrophobicContact CB-CD1 4.42Å; C95-Y97 HydrophobicContact CB-CE1 3.99Å; C95-C100 HydrophobicContact CB-CB 3.55Å; C95-C100 WeakPolarHBondContact CB-SG 3.34Å; C95-C100 PolarHBondContact O-SG 2.85Å; C95-C100 WeakPolarHBondContact SG-CB 3.48Å; C95-C100 CovalentContact SG-SG 2Å; C95-C100 PolarHBondContact SG-SG 2.88Å
96	Y	83.8	Confident	72.9	Confident	149 Å²	149	72.7 Å²	72.7	58%	0.584	38%	0.381	S	S	*	.			trans	-114.6	34.8	-164.7	-59.8	-88.3	0	0	0	113.1	V53 C75	V53-Y96 HydrophobicContact CB-CD1 3.95Å; V53-Y96 HydrophobicContact CB-CE1 3.8Å; V53-Y96 HydrophobicContact CG2-CD1 3.66Å; V53-Y96 HydrophobicContact CG2-CD2 4.46Å; V53-Y96 HydrophobicContact CG2-CE1 3.47Å; V53-Y96 VanDerWaalsContact CG2-CE1 3.47Å; V53-Y96 HydrophobicContact CG2-CE2 4.29Å; V53-Y96 HydrophobicContact CG2-CG 4.16Å; C75-Y96 VanDerWaalsContact CB-OH 3.29Å; C75-Y96 WeakPolarHBondContact CB-OH 3.37Å
97	Y	78.7	Confident	72.5	Confident	93 Å²	93	71.3 Å²	71.3	37%	0.365	37%	0.365	S	S	.	.	S	Bend	trans	-141.8	156.9	177.9	58.1	-86.4	0	0	0	111.1	C95 L99 C100 V108	C95-Y97 HydrophobicContact CB-CD1 4.42Å; C95-Y97 HydrophobicContact CB-CE1 3.99Å; Y97-L99 PolarHBondContact O-N 2.89Å; Y97-C100 HydrophobicContact CD1-CB 3.69Å; Y97-C100 HydrophobicContact CD2-CB 3.3Å; Y97-C100 HydrophobicContact CE1-CB 3.47Å; Y97-C100 VanDerWaalsContact CE1-CB 3.47Å; Y97-C100 HydrophobicContact CE2-CB 3.03Å; Y97-C100 HydrophobicContact CG-CB 3.61Å; Y97-C100 WeakPolarHBondContact O-CB 3.39Å; Y97-C100 PolarHBondContact O-N 3.3Å; Y97-C100 PolarHBondContact O-SG 2.95Å; Y97-V108 HydrophobicContact CD2-CG2 3.84Å; Y97-V108 HydrophobicContact CE2-CG2 3.15Å
98	D	81	Confident	72.2	Confident	16 Å²	16	70.8 Å²	70.8	9%	0.086	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	132.9	-174.6	-50.4	-68.1	0	0	0	112	I24 K25 C100 F107 K111	I24-D98 WeakPolarHBondContact CA-OD1 3.46Å; K25-D98 HydrophobicContact CB-CB 4.33Å; K25-D98 PolarHBondContact N-OD1 3.18Å; K25-D98 CarbonylContact O-C 3.47Å; K25-D98 WeakPolarHBondContact O-CA 3.47Å; D98-C100 PolarHBondContact O-N 3.47Å; D98-F107 HydrophobicContact CB-CD1 4.31Å; D98-F107 HydrophobicContact CB-CE1 3.51Å; D98-F107 HydrophobicContact CB-CZ 3.77Å; D98-F107 WeakPolarHBondContact O-CD1 3.48Å; D98-F107 WeakPolarHBondContact O-CE1 3.45Å; D98-K111 WeakPolarHBondContact OD2-CE 3.41Å; D98-K111 IonicContact OD2-NZ 3.66Å; D98-K111 PolarHBondContact OD2-NZ 3.35Å
99	L	81.4	Confident	71.8	Confident	33 Å²	33	73.7 Å²	73.7	17%	0.173	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	24.9	174.6	-56.4	174.2	0	0	0	112.9	K25 I47 Y97 N101 R102	K25-L99 HydrophobicContact CB-CD2 4.46Å; K25-L99 PolarHBondContact O-N 3.37Å; I47-L99 HydrophobicContact CD1-CD2 4.33Å; I47-L99 HydrophobicContact CG1-CD2 4.28Å; I47-L99 HydrophobicContact CG2-CD2 3.94Å; Y97-L99 PolarHBondContact O-N 2.89Å; L99-N101 PolarHBondContact O-N 3.41Å; L99-R102 WeakPolarHBondContact O-CB 3.35Å; L99-R102 PolarHBondContact O-N 2.76Å
100	C	85.1	Confident	71.3	Confident	16 Å²	16	80.3 Å²	80.3	11%	0.108	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.1	180	63	0	0	0	0	113.5	C54 C95 Y97 D98 R102	C54-C100 WeakPolarHBondContact CB-SG 3.37Å; C95-C100 HydrophobicContact CB-CB 3.55Å; C95-C100 WeakPolarHBondContact CB-SG 3.34Å; C95-C100 PolarHBondContact O-SG 2.85Å; C95-C100 WeakPolarHBondContact SG-CB 3.48Å; C95-C100 CovalentContact SG-SG 2Å; C95-C100 PolarHBondContact SG-SG 2.88Å; Y97-C100 HydrophobicContact CD1-CB 3.69Å; Y97-C100 HydrophobicContact CD2-CB 3.3Å; Y97-C100 HydrophobicContact CE1-CB 3.47Å; Y97-C100 VanDerWaalsContact CE1-CB 3.47Å; Y97-C100 HydrophobicContact CE2-CB 3.03Å; Y97-C100 HydrophobicContact CG-CB 3.61Å; Y97-C100 WeakPolarHBondContact O-CB 3.39Å; Y97-C100 PolarHBondContact O-N 3.3Å; Y97-C100 PolarHBondContact O-SG 2.95Å; D98-C100 PolarHBondContact O-N 3.47Å; C100-R102 PolarHBondContact O-N 2.93Å
101	N	85	Confident	70.7	Confident	5 Å²	5	79.5 Å²	79.5	3%	0.027	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	9.1	173.5	68.1	-9.5	0	0	0	112.3	R27 C54 I55 T56 R69 G70 L99	R27-N101 PolarHBondContact N-OD1 3.46Å; R27-N101 PolarHBondContact O-ND2 3.25Å; C54-N101 HydrophobicContact CB-CB 3.87Å; I55-N101 PolarHBondContact O-ND2 3.37Å; T56-N101 WeakPolarHBondContact OG1-CB 3.21Å; R69-N101 WeakPolarHBondContact CD-O 3.19Å; R69-N101 HydrophobicContact CG-CB 4.49Å; R69-N101 PolarHBondContact NE-O 3.24Å; R69-N101 PolarHBondContact NH1-O 3.35Å; G70-N101 PolarHBondContact O-ND2 3.37Å; L99-N101 PolarHBondContact O-N 3.41Å
102	R	76.9	Confident	69.7	Low	123 Å²	123	79.3 Å²	79.3	46%	0.464	38%	0.377	S	S	.	.	S	Bend	trans	-85.7	139.2	168.2	-161.9	175.9	-176.1	176.2	1.8	109.1	L99 C100 N104	L99-R102 WeakPolarHBondContact O-CB 3.35Å; L99-R102 PolarHBondContact O-N 2.76Å; C100-R102 PolarHBondContact O-N 2.93Å; R102-N104 HydrophobicContact CG-CB 4.23Å; R102-N104 PolarHBondContact O-N 2.79Å
103	T	61.5	Low	68.6	Low	118 Å²	118	84.1 Å²	84.1	72%	0.724	40%	0.404	S	S	*	.	S	Bend	trans	-60	-5.5	171.7	29.1	0	0	0	0	114.3
104	N	52.4	Low	67.5	Low	89 Å²	89	86.7 Å²	86.7	48%	0.476	42%	0.415	S	S	.	.			trans	-102.3	102.8	-175.9	-155.9	-10.8	0	0	0	111.1	R102 L106	R102-N104 HydrophobicContact CG-CB 4.23Å; R102-N104 PolarHBondContact O-N 2.79Å; N104-L106 PolarHBondContact O-N 3.44Å
105	K	52.3	Low	66.6	Low	181 Å²	181	89.7 Å²	89.7	79%	0.787	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-5	-177.3	-74.1	-178.7	176	178.3	0	115.1	F107	K105-F107 VanDerWaalsContact C-N 3.28Å; K105-F107 PolarHBondContact O-N 2.94Å
106	L	49.9	Very low	65.8	Low	90 Å²	90	93 Å²	93	47%	0.471	44%	0.443	S	S	.	.	H	α-helix	trans	-62.2	-31.1	-171.2	-145	76.8	0	0	0	113.5	N104 V108 Q109 Y110	N104-L106 PolarHBondContact O-N 3.44Å; L106-V108 PolarHBondContact O-N 3.28Å; L106-Q109 PolarHBondContact O-N 2.92Å; L106-Y110 HydrophobicContact CD2-CE2 4.09Å; L106-Y110 HydrophobicContact CG-CE2 4.18Å; L106-Y110 WeakPolarHBondContact O-CD2 3.18Å; L106-Y110 PolarHBondContact O-N 3.43Å
107	F	45.7	Very low	65.1	Low	74 Å²	74	88.2 Å²	88.2	33%	0.325	43%	0.431	S	S	.	.	H	α-helix	trans	-70.7	-32.9	-172.7	-170.2	-98.6	0	0	0	114	D98 K105 Q109 Y110 K111	D98-F107 HydrophobicContact CB-CD1 4.31Å; D98-F107 HydrophobicContact CB-CE1 3.51Å; D98-F107 HydrophobicContact CB-CZ 3.77Å; D98-F107 WeakPolarHBondContact O-CD1 3.48Å; D98-F107 WeakPolarHBondContact O-CE1 3.45Å; K105-F107 VanDerWaalsContact C-N 3.28Å; K105-F107 PolarHBondContact O-N 2.94Å; F107-Q109 VanDerWaalsContact C-N 3.28Å; F107-Q109 PolarHBondContact O-N 3.29Å; F107-Y110 PolarHBondContact O-N 2.92Å; F107-K111 HydrophobicContact CE1-CD 3.99Å; F107-K111 VanDerWaalsContact CE1-CE 3.46Å; F107-K111 HydrophobicContact CE1-CG 4.21Å; F107-K111 PolarHBondContact O-N 3.4Å
108	V	50.6	Low	64.6	Low	69 Å²	69	87.4 Å²	87.4	42%	0.418	44%	0.438	S	S	.	.	H	α-helix	trans	-64.6	-36.9	176.7	-179.6	0	0	0	0	110.9	Y97 L106 Y110 K111 L112	Y97-V108 HydrophobicContact CD2-CG2 3.84Å; Y97-V108 HydrophobicContact CE2-CG2 3.15Å; L106-V108 PolarHBondContact O-N 3.28Å; V108-Y110 VanDerWaalsContact C-N 3.34Å; V108-Y110 PolarHBondContact O-N 2.84Å; V108-K111 PolarHBondContact O-N 2.93Å; V108-L112 PolarHBondContact O-N 2.95Å
109	Q	56.3	Low	64	Low	117 Å²	117	91.7 Å²	91.7	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-65.4	-38.4	179.7	-65.5	178.5	-34	0	0	111.5	L106 F107 L112 L113	L106-Q109 PolarHBondContact O-N 2.92Å; F107-Q109 VanDerWaalsContact C-N 3.28Å; F107-Q109 PolarHBondContact O-N 3.29Å; Q109-L112 PolarHBondContact O-N 3.46Å; Q109-L113 WeakPolarHBondContact O-CB 3.23Å; Q109-L113 PolarHBondContact O-N 2.89Å
110	Y	55.2	Low	63.5	Low	154 Å²	154	93.1 Å²	93.1	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-65.9	-43.8	177.4	-85.8	-80.7	0	0	0	113.1	L106 F107 V108 L112 L113 M114	L106-Y110 HydrophobicContact CD2-CE2 4.09Å; L106-Y110 HydrophobicContact CG-CE2 4.18Å; L106-Y110 WeakPolarHBondContact O-CD2 3.18Å; L106-Y110 PolarHBondContact O-N 3.43Å; F107-Y110 PolarHBondContact O-N 2.92Å; V108-Y110 VanDerWaalsContact C-N 3.34Å; V108-Y110 PolarHBondContact O-N 2.84Å; Y110-L112 VanDerWaalsContact C-N 3.34Å; Y110-L112 PolarHBondContact O-N 3.43Å; Y110-L113 PolarHBondContact O-N 2.84Å; Y110-M114 WeakPolarHBondContact O-CG 3.3Å; Y110-M114 PolarHBondContact O-N 3Å
111	K	58.2	Low	62.5	Low	84 Å²	84	97.9 Å²	97.9	37%	0.365	49%	0.491	S	S	.	.	H	α-helix	trans	-62.9	-41.5	177	-78.1	-165.6	173.1	-179.3	0	111.8	D98 F107 V108 M114 I115	D98-K111 WeakPolarHBondContact OD2-CE 3.41Å; D98-K111 IonicContact OD2-NZ 3.66Å; D98-K111 PolarHBondContact OD2-NZ 3.35Å; F107-K111 HydrophobicContact CE1-CD 3.99Å; F107-K111 VanDerWaalsContact CE1-CE 3.46Å; F107-K111 HydrophobicContact CE1-CG 4.21Å; F107-K111 PolarHBondContact O-N 3.4Å; V108-K111 PolarHBondContact O-N 2.93Å; K111-M114 PolarHBondContact O-N 3.49Å; K111-I115 WeakPolarHBondContact O-CG1 3.21Å; K111-I115 PolarHBondContact O-N 3.28Å; K111-I115 VanDerWaalsContact O-N 3.11Å
112	L	61.6	Low	61.4	Low	105 Å²	105	101 Å²	101	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-42.7	176.1	-174.4	65	0	0	0	111.7	V108 Q109 Y110 M114 I115 I116	V108-L112 PolarHBondContact O-N 2.95Å; Q109-L112 PolarHBondContact O-N 3.46Å; Y110-L112 VanDerWaalsContact C-N 3.34Å; Y110-L112 PolarHBondContact O-N 3.43Å; L112-M114 VanDerWaalsContact C-N 3.33Å; L112-M114 PolarHBondContact O-N 3.42Å; L112-I115 PolarHBondContact O-N 2.96Å; L112-I116 HydrophobicContact CD1-CD1 4.4Å; L112-I116 HydrophobicContact CG-CD1 3.95Å; L112-I116 VanDerWaalsContact O-CG1 3.31Å; L112-I116 WeakPolarHBondContact O-CG1 3.33Å; L112-I116 PolarHBondContact O-N 3.44Å
113	L	64.5	Low	60.7	Low	120 Å²	120	100.7 Å²	100.7	63%	0.628	52%	0.52	S	S	*	.	H	α-helix	trans	-60.8	-40.9	176.9	-121.3	113.5	0	0	0	112.2	Q109 Y110 I116 S117	Q109-L113 WeakPolarHBondContact O-CB 3.23Å; Q109-L113 PolarHBondContact O-N 2.89Å; Y110-L113 PolarHBondContact O-N 2.84Å; L113-I116 PolarHBondContact O-N 3.43Å; L113-S117 WeakPolarHBondContact O-CB 3.36Å; L113-S117 PolarHBondContact O-N 2.87Å
114	M	63	Low	60.7	Low	127 Å²	127	101.4 Å²	101.4	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-65	-42	177.1	-71.5	-62.3	-64.8	0	0	111.9	Y110 K111 L112 S117 C118	Y110-M114 WeakPolarHBondContact O-CG 3.3Å; Y110-M114 PolarHBondContact O-N 3Å; K111-M114 PolarHBondContact O-N 3.49Å; L112-M114 VanDerWaalsContact C-N 3.33Å; L112-M114 PolarHBondContact O-N 3.42Å; M114-S117 PolarHBondContact O-N 3.25Å; M114-C118 PolarHBondContact O-N 3.49Å; M114-C118 PolarHBondContact O-SG 2.91Å
115	I	69.4	Low	61	Low	99 Å²	99	102.1 Å²	102.1	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-63	-46.6	175.8	-66.9	167.5	0	0	0	110.6	K111 L112 S117 C118 L119	K111-I115 WeakPolarHBondContact O-CG1 3.21Å; K111-I115 PolarHBondContact O-N 3.28Å; K111-I115 VanDerWaalsContact O-N 3.11Å; L112-I115 PolarHBondContact O-N 2.96Å; I115-S117 VanDerWaalsContact C-N 3.33Å; I115-S117 PolarHBondContact O-N 3.44Å; I115-C118 PolarHBondContact O-N 3.12Å; I115-L119 HydrophobicContact CG2-CD1 3.96Å; I115-L119 HydrophobicContact CG2-CG 4.42Å; I115-L119 WeakPolarHBondContact O-CG 3.47Å; I115-L119 PolarHBondContact O-N 3.24Å
116	I	69.7	Low	61.3	Low	90 Å²	90	97.4 Å²	97.4	46%	0.462	50%	0.502	S	S	.	.	H	α-helix	trans	-59.8	-45.7	176.6	-67.5	167.6	0	0	0	110.1	L112 L113 C118 L119 V120	L112-I116 HydrophobicContact CD1-CD1 4.4Å; L112-I116 HydrophobicContact CG-CD1 3.95Å; L112-I116 VanDerWaalsContact O-CG1 3.31Å; L112-I116 WeakPolarHBondContact O-CG1 3.33Å; L112-I116 PolarHBondContact O-N 3.44Å; L113-I116 PolarHBondContact O-N 3.43Å; I116-C118 PolarHBondContact O-N 3.43Å; I116-L119 PolarHBondContact O-N 3.07Å; I116-V120 HydrophobicContact CG2-CG2 4.23Å; I116-V120 WeakPolarHBondContact O-CB 3.24Å; I116-V120 VanDerWaalsContact O-CG2 3.23Å; I116-V120 WeakPolarHBondContact O-CG2 3.49Å; I116-V120 PolarHBondContact O-N 3.48Å
117	S	68.6	Low	61.5	Low	50 Å²	50	96.5 Å²	96.5	35%	0.35	50%	0.503	S	S	.	.	H	α-helix	trans	-59.3	-45	177.8	-175.6	0	0	0	0	111.8	L113 M114 I115 V120 H121	L113-S117 WeakPolarHBondContact O-CB 3.36Å; L113-S117 PolarHBondContact O-N 2.87Å; M114-S117 PolarHBondContact O-N 3.25Å; I115-S117 VanDerWaalsContact C-N 3.33Å; I115-S117 PolarHBondContact O-N 3.44Å; S117-V120 PolarHBondContact O-N 2.91Å; S117-H121 PolarHBondContact O-N 3.27Å; S117-H121 PolarHBondContact O-ND1 3.05Å
118	C	67.8	Low	62	Low	75 Å²	75	98.1 Å²	98.1	51%	0.507	51%	0.514	S	S	.	.	H	α-helix	trans	-63.9	-45.1	176.4	-74.2	0	0	0	0	112.2	M114 I115 I116 V120 H121 S122	M114-C118 PolarHBondContact O-N 3.49Å; M114-C118 PolarHBondContact O-SG 2.91Å; I115-C118 PolarHBondContact O-N 3.12Å; I116-C118 PolarHBondContact O-N 3.43Å; C118-V120 VanDerWaalsContact C-N 3.32Å; C118-V120 PolarHBondContact O-N 3.14Å; C118-H121 PolarHBondContact O-N 3.34Å; C118-S122 PolarHBondContact O-N 2.99Å; C118-S122 PolarHBondContact O-OG 3.4Å; C118-S122 VanDerWaalsContact O-OG 3.12Å
119	L	69.5	Low	62.1	Low	106 Å²	106	97.9 Å²	97.9	56%	0.555	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-42.6	177.4	-73.2	171	0	0	0	111.6	I115 I116 S122 L123	I115-L119 HydrophobicContact CG2-CD1 3.96Å; I115-L119 HydrophobicContact CG2-CG 4.42Å; I115-L119 WeakPolarHBondContact O-CG 3.47Å; I115-L119 PolarHBondContact O-N 3.24Å; I116-L119 PolarHBondContact O-N 3.07Å; L119-S122 PolarHBondContact O-N 3.08Å; L119-L123 WeakPolarHBondContact O-CB 3.4Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.48Å; L119-L123 PolarHBondContact O-N 3.43Å
120	V	70	Confident	62	Low	63 Å²	63	97.4 Å²	97.4	38%	0.382	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-45.8	176.4	170.7	0	0	0	0	110.7	I116 S117 C118 S122 L123 F124	I116-V120 HydrophobicContact CG2-CG2 4.23Å; I116-V120 WeakPolarHBondContact O-CB 3.24Å; I116-V120 VanDerWaalsContact O-CG2 3.23Å; I116-V120 WeakPolarHBondContact O-CG2 3.49Å; I116-V120 PolarHBondContact O-N 3.48Å; S117-V120 PolarHBondContact O-N 2.91Å; C118-V120 VanDerWaalsContact C-N 3.32Å; C118-V120 PolarHBondContact O-N 3.14Å; V120-S122 PolarHBondContact O-N 2.95Å; V120-L123 PolarHBondContact O-N 2.64Å; V120-F124 HydrophobicContact CG1-CD2 3.59Å; V120-F124 HydrophobicContact CG1-CE2 3.5Å; V120-F124 VanDerWaalsContact CG1-CE2 3.5Å; V120-F124 WeakPolarHBondContact O-CD2 3.25Å; V120-F124 PolarHBondContact O-N 2.92Å
121	H	63.5	Low	61.8	Low	117 Å²	117	95.2 Å²	95.2	54%	0.542	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-41.9	177.2	-79.2	75.6	0	0	0	112.4	S117 C118 L123 F124 I125	S117-H121 PolarHBondContact O-N 3.27Å; S117-H121 PolarHBondContact O-ND1 3.05Å; C118-H121 PolarHBondContact O-N 3.34Å; H121-L123 VanDerWaalsContact C-N 3.35Å; H121-L123 PolarHBondContact O-N 3.26Å; H121-F124 PolarHBondContact O-N 3.01Å; H121-I125 WeakPolarHBondContact O-CG1 3.47Å; H121-I125 PolarHBondContact O-N 3.2Å
122	S	63.8	Low	61.2	Low	71 Å²	71	93.8 Å²	93.8	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-40.9	175.6	-61.8	0	0	0	0	112.1	C118 L119 V120 I125 V126	C118-S122 PolarHBondContact O-N 2.99Å; C118-S122 PolarHBondContact O-OG 3.4Å; C118-S122 VanDerWaalsContact O-OG 3.12Å; L119-S122 PolarHBondContact O-N 3.08Å; V120-S122 PolarHBondContact O-N 2.95Å; S122-I125 PolarHBondContact O-N 2.95Å; S122-V126 WeakPolarHBondContact O-CG2 3.4Å; S122-V126 PolarHBondContact O-N 3.38Å; S122-V126 VanDerWaalsContact O-N 3.11Å
123	L	61.9	Low	60.5	Low	115 Å²	115	92.4 Å²	92.4	60%	0.602	51%	0.507	S	S	*	.	H	α-helix	trans	-63.1	-42.1	174	-75.1	166.5	0	0	0	111.6	L119 V120 H121 I125 V126 C127	L119-L123 WeakPolarHBondContact O-CB 3.4Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.48Å; L119-L123 PolarHBondContact O-N 3.43Å; V120-L123 PolarHBondContact O-N 2.64Å; H121-L123 VanDerWaalsContact C-N 3.35Å; H121-L123 PolarHBondContact O-N 3.26Å; L123-I125 PolarHBondContact O-N 3.4Å; L123-V126 PolarHBondContact O-N 2.92Å; L123-C127 WeakPolarHBondContact O-CB 3.34Å; L123-C127 PolarHBondContact O-N 3.11Å; L123-C127 PolarHBondContact O-SG 3.42Å; L123-C127 VanDerWaalsContact O-SG 3.34Å
124	F	60.5	Low	59.3	Low	134 Å²	134	92.7 Å²	92.7	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-61.5	-42.9	176.4	-90.5	-71.1	0	0	0	112.4	V120 H121 C127 I128	V120-F124 HydrophobicContact CG1-CD2 3.59Å; V120-F124 HydrophobicContact CG1-CE2 3.5Å; V120-F124 VanDerWaalsContact CG1-CE2 3.5Å; V120-F124 WeakPolarHBondContact O-CD2 3.25Å; V120-F124 PolarHBondContact O-N 2.92Å; H121-F124 PolarHBondContact O-N 3.01Å; F124-C127 PolarHBondContact O-N 3.39Å; F124-I128 VanDerWaalsContact O-CG1 3.25Å; F124-I128 WeakPolarHBondContact O-CG1 3.34Å; F124-I128 PolarHBondContact O-N 3.25Å
125	I	58.8	Low	58.3	Low	103 Å²	103	92.4 Å²	92.4	53%	0.528	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-47.3	177.7	-66.6	166.7	0	0	0	110.4	H121 S122 L123 C127 I128 D129	H121-I125 WeakPolarHBondContact O-CG1 3.47Å; H121-I125 PolarHBondContact O-N 3.2Å; S122-I125 PolarHBondContact O-N 2.95Å; L123-I125 PolarHBondContact O-N 3.4Å; I125-C127 VanDerWaalsContact C-N 3.34Å; I125-C127 PolarHBondContact O-N 3.34Å; I125-I128 PolarHBondContact O-N 3.25Å; I125-D129 PolarHBondContact O-N 3.07Å
126	V	58.4	Low	57	Low	82 Å²	82	95.4 Å²	95.4	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-62.8	-38.7	178.3	173.5	0	0	0	0	112	S122 L123 N130	S122-V126 WeakPolarHBondContact O-CG2 3.4Å; S122-V126 PolarHBondContact O-N 3.38Å; S122-V126 VanDerWaalsContact O-N 3.11Å; L123-V126 PolarHBondContact O-N 2.92Å; V126-N130 WeakPolarHBondContact O-CB 3.38Å; V126-N130 PolarHBondContact O-N 3.3Å; V126-N130 VanDerWaalsContact O-N 3.08Å; V126-N130 PolarHBondContact O-ND2 3.01Å
127	C	54.8	Low	55.8	Low	72 Å²	72	99.7 Å²	99.7	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-67.7	-37.4	175.8	-75.3	0	0	0	0	112.6	L123 F124 I125 N131	L123-C127 WeakPolarHBondContact O-CB 3.34Å; L123-C127 PolarHBondContact O-N 3.11Å; L123-C127 PolarHBondContact O-SG 3.42Å; L123-C127 VanDerWaalsContact O-SG 3.34Å; F124-C127 PolarHBondContact O-N 3.39Å; I125-C127 VanDerWaalsContact C-N 3.34Å; I125-C127 PolarHBondContact O-N 3.34Å; C127-N131 PolarHBondContact O-N 2.88Å
128	I	55.6	Low	54.5	Low	108 Å²	108	102.3 Å²	102.3	55%	0.554	55%	0.548	S	S	*	.	H	α-helix	trans	-68	-46.7	176.3	-69.6	167.1	0	0	0	109.9	F124 I125 N130 N131 S132	F124-I128 VanDerWaalsContact O-CG1 3.25Å; F124-I128 WeakPolarHBondContact O-CG1 3.34Å; F124-I128 PolarHBondContact O-N 3.25Å; I125-I128 PolarHBondContact O-N 3.25Å; I128-N130 VanDerWaalsContact C-N 3.33Å; I128-N130 PolarHBondContact O-N 2.76Å; I128-N131 PolarHBondContact O-N 3.15Å; I128-S132 PolarHBondContact O-N 3.06Å; I128-S132 PolarHBondContact O-OG 3.37Å
129	D	53.2	Low	53.4	Low	64 Å²	64	108.5 Å²	108.5	34%	0.342	57%	0.574	S	S	.	*	H	α-helix	trans	-60.4	-41.5	179.2	-86.1	-35.2	0	0	0	112	I125 N131 S132 V133	I125-D129 PolarHBondContact O-N 3.07Å; D129-N131 VanDerWaalsContact C-N 3.31Å; D129-N131 PolarHBondContact O-N 2.91Å; D129-S132 WeakPolarHBondContact CA-OG 3.48Å; D129-S132 PolarHBondContact O-N 3.04Å; D129-S132 PolarHBondContact O-OG 3.33Å; D129-V133 WeakPolarHBondContact O-CG2 3.38Å; D129-V133 PolarHBondContact O-N 3.08Å
130	N	53	Low	52.6	Low	107 Å²	107	108.7 Å²	108.7	57%	0.572	58%	0.575	S	S	*	*	H	α-helix	trans	-65	-31.2	174.9	-79.4	-31.6	0	0	0	113.3	V126 I128 M134	V126-N130 WeakPolarHBondContact O-CB 3.38Å; V126-N130 PolarHBondContact O-N 3.3Å; V126-N130 VanDerWaalsContact O-N 3.08Å; V126-N130 PolarHBondContact O-ND2 3.01Å; I128-N130 VanDerWaalsContact C-N 3.33Å; I128-N130 PolarHBondContact O-N 2.76Å; N130-M134 PolarHBondContact O-N 3.37Å
131	N	51.1	Low	51.7	Low	108 Å²	108	111.1 Å²	111.1	58%	0.578	59%	0.585	S	S	*	*	H	α-helix	trans	-77.8	-34.6	175.3	-83.9	-19	0	0	0	112.9	C127 I128 D129 M134 L135	C127-N131 PolarHBondContact O-N 2.88Å; I128-N131 PolarHBondContact O-N 3.15Å; D129-N131 VanDerWaalsContact C-N 3.31Å; D129-N131 PolarHBondContact O-N 2.91Å; N131-M134 PolarHBondContact O-N 3.34Å; N131-L135 PolarHBondContact O-N 3.3Å
132	S	47.4	Very low	51	Low	53 Å²	53	110.7 Å²	110.7	37%	0.371	59%	0.588	S	S	.	*	H	α-helix	trans	-68	-34.8	172.3	21.9	0	0	0	0	112.3	I128 D129 M134 L135 E136	I128-S132 PolarHBondContact O-N 3.06Å; I128-S132 PolarHBondContact O-OG 3.37Å; D129-S132 WeakPolarHBondContact CA-OG 3.48Å; D129-S132 PolarHBondContact O-N 3.04Å; D129-S132 PolarHBondContact O-OG 3.33Å; S132-M134 VanDerWaalsContact C-N 3.34Å; S132-L135 PolarHBondContact O-N 3.4Å; S132-E136 PolarHBondContact O-N 3.17Å; S132-E136 VanDerWaalsContact O-N 3.07Å
133	V	45.7	Very low	50.3	Low	77 Å²	77	113.1 Å²	113.1	47%	0.467	59%	0.593	S	S	.	*	H	α-helix	trans	-66.9	-35.7	172.1	175.7	0	0	0	0	111	D129 F137	D129-V133 WeakPolarHBondContact O-CG2 3.38Å; D129-V133 PolarHBondContact O-N 3.08Å; V133-F137 HydrophobicContact CG1-CD2 4.18Å; V133-F137 HydrophobicContact CG1-CE2 4.23Å; V133-F137 WeakPolarHBondContact O-CD2 3.35Å; V133-F137 PolarHBondContact O-N 3.23Å
134	M	40.6	Very low	49.6	Very low	126 Å²	126	112.9 Å²	112.9	62%	0.621	59%	0.592	S	S	*	*	H	α-helix	trans	-67.8	-32.9	173.6	-110.8	-143	76.7	0	0	113.4	N130 N131 S132 T138	N130-M134 PolarHBondContact O-N 3.37Å; N131-M134 PolarHBondContact O-N 3.34Å; S132-M134 VanDerWaalsContact C-N 3.34Å; M134-T138 PolarHBondContact O-OG1 2.79Å
135	L	40.6	Very low	48.8	Very low	120 Å²	120	111.5 Å²	111.5	63%	0.628	59%	0.593	S	S	*	*	H	α-helix	trans	-73.8	-34.4	176.2	-108.4	102.8	0	0	0	113.1	N131 S132 F137 T138	N131-L135 PolarHBondContact O-N 3.3Å; S132-L135 PolarHBondContact O-N 3.4Å; L135-F137 PolarHBondContact O-N 3.18Å; L135-T138 PolarHBondContact O-N 3.41Å
136	E	42.2	Very low	48.1	Very low	162 Å²	162	112.1 Å²	112.1	76%	0.757	60%	0.597	S	S	*	*	H	α-helix	trans	-71.6	-15.9	176.1	-77.5	-169.9	161.7	0	0	113.8	S132	S132-E136 PolarHBondContact O-N 3.17Å; S132-E136 VanDerWaalsContact O-N 3.07Å
137	F	44.3	Very low	47.3	Very low	181 Å²	181	114.5 Å²	114.5	79%	0.794	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	1.5	172.1	-84.5	-81.2	0	0	0	114.1	V133 L135	V133-F137 HydrophobicContact CG1-CD2 4.18Å; V133-F137 HydrophobicContact CG1-CE2 4.23Å; V133-F137 WeakPolarHBondContact O-CD2 3.35Å; V133-F137 PolarHBondContact O-N 3.23Å; L135-F137 PolarHBondContact O-N 3.18Å
138	T	42.4	Very low	46.7	Very low	104 Å²	104	118 Å²	118	64%	0.638	62%	0.615	S	S	*	*			trans	-119.8	10	-176.2	-40.3	0	0	0	0	113.8	M134 L135	M134-T138 PolarHBondContact O-OG1 2.79Å; L135-T138 PolarHBondContact O-N 3.41Å
139	I	44.5	Very low	45.9	Very low	206 Å²	206	118.9 Å²	118.9	100%	1.056	62%	0.62	S	S	*	*			trans	-120.5	0	169.4	-53.7	175.9	0	0	0	108.3

Retrieved 139 of 139 residues in 119.1 ms (Link to these results)

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