A0A077ZHS3_TRITR Loading...

LRR 9 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZHS3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 141 aa.

						>A0A077ZHS3_TRITR|A0A077ZHS3
MTCSTWDLCFLGYKIPVIENLGATHDQFDTIDFTNNDLKRIENFPTLRRVKSLFFTNNRISCLDPSVAESLPNLKTLVLTNNVFEELGDLEPLASFPKLEYLSLMGNPVTHKPLYRLFVIFTVPQVRVLDYKRVRAVVSVL
					

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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	47.3	Very low	70.3	Confident	192 Å²	192	87.4 Å²	87.4	95%	0.946	48%	0.478	S	S	*	.				0	128.5	0	-77.5	-179.8	-82.1	0	0	107.3	C3	M1-C3 PolarHBondContact O-N 2.77Å
2	T	48.9	Very low	70.9	Confident	134 Å²	134	84.2 Å²	84.2	82%	0.822	48%	0.48	S	S	*	.			trans	-72.2	111.6	170.6	46.9	0	0	0	0	107.1	S4	T2-S4 PolarHBondContact O-N 3.07Å; T2-S4 VanDerWaalsContact O-N 3.15Å
3	C	58.1	Low	71.8	Confident	70 Å²	70	90.5 Å²	90.5	47%	0.473	49%	0.493	S	S	.	.			trans	-58.1	113.9	167.8	-175.3	0	0	0	0	107.3	M1 D7 C9	M1-C3 PolarHBondContact O-N 2.77Å; C3-D7 PolarHBondContact SG-O 2.81Å; C3-C9 PolarHBondContact SG-SG 2.73Å
4	S	69.3	Low	73.1	Confident	68 Å²	68	95.3 Å²	95.3	48%	0.476	51%	0.507	S	S	.	.			trans	-69.8	165.3	175.5	-39.6	0	0	0	0	109.1	T2 W6 D7	T2-S4 PolarHBondContact O-N 3.07Å; T2-S4 VanDerWaalsContact O-N 3.15Å; S4-W6 PolarHBondContact O-N 2.92Å; S4-D7 WeakPolarHBondContact CA-OD2 3.3Å; S4-D7 WeakPolarHBondContact CB-OD2 3.1Å; S4-D7 PolarHBondContact N-OD2 3.26Å; S4-D7 PolarHBondContact O-N 3.25Å; S4-D7 PolarHBondContact OG-OD2 3.09Å
5	T	70.7	Confident	74.2	Confident	126 Å²	126	91.2 Å²	91.2	77%	0.773	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-19.5	-178.8	-42	0	0	0	0	114.4
6	W	78.1	Confident	75.5	Confident	132 Å²	132	91.1 Å²	91.1	50%	0.5	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	16.2	-178.2	-55.8	113.1	0	0	0	114	S4 Q27 D29 T30	S4-W6 PolarHBondContact O-N 2.92Å; W6-Q27 VanDerWaalsContact CE3-O 3.27Å; W6-D29 HydrophobicContact CB-CB 4.47Å; W6-D29 PolarHBondContact O-N 3.2Å; W6-D29 VanDerWaalsContact O-N 3.09Å; W6-T30 PolarHBondContact O-N 3.12Å
7	D	80	Confident	76.6	Confident	33 Å²	33	88.4 Å²	88.4	18%	0.176	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	137	176.2	-56.2	-26.6	0	0	0	109.5	C3 S4 T30	C3-D7 PolarHBondContact SG-O 2.81Å; S4-D7 WeakPolarHBondContact CA-OD2 3.3Å; S4-D7 WeakPolarHBondContact CB-OD2 3.1Å; S4-D7 PolarHBondContact N-OD2 3.26Å; S4-D7 PolarHBondContact O-N 3.25Å; S4-D7 PolarHBondContact OG-OD2 3.09Å; D7-T30 WeakPolarHBondContact CA-O 3.3Å; D7-T30 WeakPolarHBondContact OD1-CB 3.49Å; D7-T30 PolarHBondContact OD1-OG1 3.2Å
8	L	82.7	Confident	77.7	Confident	36 Å²	36	83.6 Å²	83.6	19%	0.188	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	109.2	169	179.2	61.9	0	0	0	109	F10 T24 F28 T30 I31 D32	L8-F10 HydrophobicContact CD1-CE2 4.35Å; L8-F10 HydrophobicContact CD1-CZ 4.2Å; L8-F10 HydrophobicContact CD2-CE2 3.48Å; L8-F10 VanDerWaalsContact CD2-CE2 3.48Å; L8-F10 HydrophobicContact CD2-CZ 3.68Å; L8-F10 HydrophobicContact CG-CD2 4.23Å; L8-F10 HydrophobicContact CG-CE2 3.61Å; L8-F10 HydrophobicContact CG-CZ 3.92Å; L8-T24 HydrophobicContact CD2-CG2 3.55Å; L8-F28 HydrophobicContact CB-CD1 3.95Å; L8-F28 HydrophobicContact CB-CD2 4.15Å; L8-F28 HydrophobicContact CB-CE1 4.18Å; L8-F28 HydrophobicContact CB-CE2 4.37Å; L8-F28 HydrophobicContact CB-CG 3.93Å; L8-F28 HydrophobicContact CB-CZ 4.39Å; L8-F28 HydrophobicContact CD1-CZ 4.43Å; L8-F28 HydrophobicContact CD2-CD2 4.23Å; L8-F28 HydrophobicContact CD2-CE2 4.19Å; L8-T30 PolarHBondContact N-O 3.31Å; L8-I31 HydrophobicContact CB-CG1 4.42Å; L8-I31 HydrophobicContact CB-CG2 4.29Å; L8-I31 HydrophobicContact CD2-CG2 4.35Å; L8-I31 HydrophobicContact CG-CG2 4.4Å; L8-I31 WeakPolarHBondContact O-CA 3.16Å; L8-D32 PolarHBondContact O-N 3.23Å
9	C	82	Confident	78.6	Confident	40 Å²	40	85.4 Å²	85.4	27%	0.27	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	117.1	-175	-67.2	0	0	0	0	112.1	C3 L11	C3-C9 PolarHBondContact SG-SG 2.73Å; C9-L11 HydrophobicContact CB-CG 4.26Å
10	F	76.7	Confident	79.3	Confident	57 Å²	57	87.4 Å²	87.4	25%	0.25	47%	0.468	C	S	.	.			trans	-103.7	53.6	174.1	-67.8	-72.7	0	0	0	111.6	L8 G12 Y13 I15 L21 I31 D32 F33 N36	L8-F10 HydrophobicContact CD1-CE2 4.35Å; L8-F10 HydrophobicContact CD1-CZ 4.2Å; L8-F10 HydrophobicContact CD2-CE2 3.48Å; L8-F10 VanDerWaalsContact CD2-CE2 3.48Å; L8-F10 HydrophobicContact CD2-CZ 3.68Å; L8-F10 HydrophobicContact CG-CD2 4.23Å; L8-F10 HydrophobicContact CG-CE2 3.61Å; L8-F10 HydrophobicContact CG-CZ 3.92Å; F10-G12 PolarHBondContact O-N 2.72Å; F10-Y13 HydrophobicContact CB-CD2 4.45Å; F10-I15 HydrophobicContact CB-CD1 3.62Å; F10-I15 HydrophobicContact CD1-CD1 3.87Å; F10-I15 HydrophobicContact CG-CD1 3.92Å; F10-L21 HydrophobicContact CE2-CD2 4.24Å; F10-I31 HydrophobicContact CD2-CG2 4.13Å; F10-I31 HydrophobicContact CE2-CG2 4.09Å; F10-D32 PolarHBondContact N-O 3.07Å; F10-F33 HydrophobicContact CB-CD1 4.15Å; F10-F33 AromaticContact CD2-CD1 3.77Å; F10-F33 HydrophobicContact CD2-CD1 3.77Å; F10-F33 AromaticContact CD2-CE1 3.46Å; F10-F33 HydrophobicContact CD2-CE1 3.46Å; F10-F33 VanDerWaalsContact CD2-CE1 3.46Å; F10-F33 HydrophobicContact CD2-CZ 4.09Å; F10-F33 AromaticContact CE2-CE1 3.83Å; F10-F33 HydrophobicContact CE2-CE1 3.83Å; F10-F33 HydrophobicContact CE2-CZ 4.18Å; F10-F33 HydrophobicContact CG-CD1 4.28Å; F10-F33 HydrophobicContact CG-CE1 4.25Å; F10-N36 PolarHBondContact O-ND2 2.73Å
11	L	79.4	Confident	80.1	Confident	73 Å²	73	83.4 Å²	83.4	38%	0.382	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	125.2	-171.9	-61.1	175.5	0	0	0	112.8	C9 Y13 T34	C9-L11 HydrophobicContact CB-CG 4.26Å; L11-Y13 WeakPolarHBondContact O-CD2 3.41Å; L11-Y13 PolarHBondContact O-N 2.99Å; L11-T34 HydrophobicContact CD2-CG2 4.23Å; L11-T34 WeakPolarHBondContact CD2-O 3.39Å
12	G	77.3	Confident	82.3	Confident	49 Å²	49	76.6 Å²	76.6	51%	0.505	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	12.8	163.9	0	0	0	0	0	116.4	F10 K14 N35	F10-G12 PolarHBondContact O-N 2.72Å; G12-K14 VanDerWaalsContact C-N 3.28Å; G12-K14 PolarHBondContact O-N 3Å; G12-N35 WeakPolarHBondContact CA-O 3.38Å; G12-N35 PolarHBondContact N-O 3.06Å; G12-N35 VanDerWaalsContact N-O 3.15Å
13	Y	83.2	Confident	84.4	Confident	166 Å²	166	73.7 Å²	73.7	65%	0.651	42%	0.415	S	S	*	.	S	Bend	trans	-84	2.6	-175.2	-72.6	-72.2	0	0	0	114.3	F10 L11 I15 N36	F10-Y13 HydrophobicContact CB-CD2 4.45Å; L11-Y13 WeakPolarHBondContact O-CD2 3.41Å; L11-Y13 PolarHBondContact O-N 2.99Å; Y13-I15 PolarHBondContact O-N 3.28Å; Y13-N36 PolarHBondContact N-OD1 3.33Å
14	K	89.2	Confident	86	Confident	158 Å²	158	71.1 Å²	71.1	69%	0.687	40%	0.397	S	S	*	.			trans	55	35.2	-174.4	-56.4	-178.6	178.6	179.1	0	112.3	G12 P16 N36	G12-K14 VanDerWaalsContact C-N 3.28Å; G12-K14 PolarHBondContact O-N 3Å; K14-P16 VanDerWaalsContact O-CD 3.25Å; K14-P16 WeakPolarHBondContact O-CD 3.36Å; K14-N36 PolarHBondContact N-OD1 2.81Å
15	I	90.5	Very high	87.2	Confident	34 Å²	34	74.6 Å²	74.6	17%	0.174	41%	0.406	C	S	.	.			trans	-64.4	120.3	-178.5	-64.1	167.9	0	0	0	108.3	F10 Y13 V17 N36 D37 L38	F10-I15 HydrophobicContact CB-CD1 3.62Å; F10-I15 HydrophobicContact CD1-CD1 3.87Å; F10-I15 HydrophobicContact CG-CD1 3.92Å; Y13-I15 PolarHBondContact O-N 3.28Å; I15-V17 WeakPolarHBondContact CG2-O 3.43Å; I15-N36 HydrophobicContact CB-CB 4.17Å; I15-N36 WeakPolarHBondContact CG1-OD1 3.44Å; I15-N36 PolarHBondContact N-OD1 3.16Å; I15-D37 CarbonylContact O-C 3.32Å; I15-D37 PolarHBondContact O-N 2.98Å; I15-D37 VanDerWaalsContact O-N 3.09Å; I15-L38 HydrophobicContact CG2-CD2 3.96Å; I15-L38 PolarHBondContact O-N 3Å
16	P	94.1	Very high	88.3	Confident	90 Å²	90	70.7 Å²	70.7	58%	0.584	38%	0.38	S	S	*	.			trans	-89.8	-21.2	-177.7	34.3	-33.5	0	0	0	112.8	K14	K14-P16 VanDerWaalsContact O-CD 3.25Å; K14-P16 WeakPolarHBondContact O-CD 3.36Å
17	V	95.5	Very high	89.1	Confident	45 Å²	45	69.4 Å²	69.4	27%	0.273	38%	0.38	S	S	.	.	S	Bend	trans	-144.1	145	-174.9	67.1	0	0	0	0	110.8	I15 E19	I15-V17 WeakPolarHBondContact CG2-O 3.43Å; V17-E19 HydrophobicContact CG1-CG 4.35Å
18	I	96.1	Very high	89.9	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	38%	0.38	C	S	.	.			trans	-81.1	126.2	171	-58.4	174.5	0	0	0	107.8	L21 F33 L38 N43 F44 F55	I18-L21 HydrophobicContact CG2-CD1 3.41Å; I18-L21 VanDerWaalsContact CG2-CD1 3.41Å; I18-L21 HydrophobicContact CG2-CG 3.87Å; I18-F33 HydrophobicContact CG1-CE1 4.42Å; I18-F33 HydrophobicContact CG1-CZ 4.4Å; I18-F33 HydrophobicContact CG2-CZ 4.28Å; I18-L38 HydrophobicContact CD1-CD1 4.28Å; I18-L38 HydrophobicContact CG1-CD1 4.02Å; I18-L38 HydrophobicContact CG1-CD2 3.76Å; I18-N43 WeakPolarHBondContact O-CB 3.27Å; I18-N43 PolarHBondContact O-ND2 2.78Å; I18-N43 VanDerWaalsContact O-ND2 3.13Å; I18-F44 HydrophobicContact CD1-CD2 4.48Å; I18-F44 HydrophobicContact CD1-CE2 3.45Å; I18-F44 VanDerWaalsContact CD1-CE2 3.45Å; I18-F44 HydrophobicContact CD1-CZ 3.79Å; I18-F44 HydrophobicContact CG2-CE2 4.22Å; I18-F44 HydrophobicContact CG2-CZ 4.35Å; I18-F55 HydrophobicContact CD1-CE1 3.76Å; I18-F55 HydrophobicContact CD1-CZ 3.97Å
19	E	94.3	Very high	90.5	Very high	118 Å²	118	69.4 Å²	69.4	55%	0.551	38%	0.378	S	S	*	.			trans	-154.4	168	178.5	57.3	175.6	-151.2	0	0	110.4	V17 L21	V17-E19 HydrophobicContact CG1-CG 4.35Å; E19-L21 PolarHBondContact O-N 3.38Å
20	N	93.5	Very high	91.2	Very high	125 Å²	125	68.5 Å²	68.5	67%	0.668	37%	0.371	S	S	*	.			trans	58.1	15.1	172	-59.6	-46.6	0	0	0	115.9	G22 A23	N20-G22 PolarHBondContact O-N 3.31Å; N20-G22 VanDerWaalsContact O-N 3.09Å; N20-A23 WeakPolarHBondContact O-CB 3.48Å; N20-A23 PolarHBondContact O-N 2.8Å; N20-A23 VanDerWaalsContact O-N 3.09Å
21	L	95	Very high	92.2	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.021	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-63.9	-15	176.1	-69.3	-174.8	0	0	0	113.4	F10 I18 E19 A23 T24 F33 F44 P45	F10-L21 HydrophobicContact CE2-CD2 4.24Å; I18-L21 HydrophobicContact CG2-CD1 3.41Å; I18-L21 VanDerWaalsContact CG2-CD1 3.41Å; I18-L21 HydrophobicContact CG2-CG 3.87Å; E19-L21 PolarHBondContact O-N 3.38Å; L21-A23 PolarHBondContact O-N 3.13Å; L21-T24 HydrophobicContact CD2-CG2 4.22Å; L21-T24 WeakPolarHBondContact O-CB 3.45Å; L21-T24 WeakPolarHBondContact O-CG2 3.1Å; L21-T24 PolarHBondContact O-N 2.84Å; L21-T24 VanDerWaalsContact O-N 3.08Å; L21-T24 PolarHBondContact O-OG1 2.96Å; L21-F33 HydrophobicContact CD1-CZ 4.21Å; L21-F33 HydrophobicContact CD2-CZ 4.14Å; L21-F44 HydrophobicContact CD1-CD1 3.57Å; L21-F44 HydrophobicContact CD1-CE1 3.44Å; L21-F44 VanDerWaalsContact CD1-CE1 3.44Å; L21-F44 HydrophobicContact CD1-CG 4.28Å; L21-F44 HydrophobicContact CD1-CZ 4.04Å; L21-P45 HydrophobicContact CB-CG 3.93Å
22	G	93.2	Very high	93	Very high	48 Å²	48	62.8 Å²	62.8	50%	0.495	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-60.7	-28.6	172.5	0	0	0	0	0	113	N20 T24 H25	N20-G22 PolarHBondContact O-N 3.31Å; N20-G22 VanDerWaalsContact O-N 3.09Å; G22-T24 PolarHBondContact O-N 2.9Å; G22-H25 PolarHBondContact O-N 3.15Å
23	A	93.5	Very high	93.9	Very high	74 Å²	74	60.6 Å²	60.6	61%	0.612	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-69.1	-10.6	176.5	0	0	0	0	0	113.4	N20 L21 H25	N20-A23 WeakPolarHBondContact O-CB 3.48Å; N20-A23 PolarHBondContact O-N 2.8Å; N20-A23 VanDerWaalsContact O-N 3.09Å; L21-A23 PolarHBondContact O-N 3.13Å; A23-H25 VanDerWaalsContact C-N 3.28Å; A23-H25 PolarHBondContact O-CD2 2.82Å
24	T	92.6	Very high	94.5	Very high	16 Å²	16	53.1 Å²	53.1	10%	0.098	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-79.3	-11.5	177.7	69.5	0	0	0	0	113.4	L8 L21 G22 D26 Q27 F28	L8-T24 HydrophobicContact CD2-CG2 3.55Å; L21-T24 HydrophobicContact CD2-CG2 4.22Å; L21-T24 WeakPolarHBondContact O-CB 3.45Å; L21-T24 WeakPolarHBondContact O-CG2 3.1Å; L21-T24 PolarHBondContact O-N 2.84Å; L21-T24 VanDerWaalsContact O-N 3.08Å; L21-T24 PolarHBondContact O-OG1 2.96Å; G22-T24 PolarHBondContact O-N 2.9Å; T24-D26 PolarHBondContact O-N 3.36Å; T24-Q27 PolarHBondContact O-N 3.09Å; T24-F28 HydrophobicContact CG2-CD2 4.36Å; T24-F28 HydrophobicContact CG2-CE2 4.24Å
25	H	92.9	Very high	94.9	Very high	140 Å²	140	49.4 Å²	49.4	65%	0.648	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	31.1	178.2	-58.7	-71.4	0	0	0	114.8	G22 A23 Q27	G22-H25 PolarHBondContact O-N 3.15Å; A23-H25 VanDerWaalsContact C-N 3.28Å; A23-H25 PolarHBondContact O-CD2 2.82Å; H25-Q27 HydrophobicContact CB-CG 4.16Å; H25-Q27 WeakPolarHBondContact O-CG 3.32Å; H25-Q27 PolarHBondContact O-N 3.02Å
26	D	95.3	Very high	95.2	Very high	45 Å²	45	48.1 Å²	48.1	24%	0.241	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	33.1	179.6	-162.7	28.7	0	0	0	114.2	T24 L47 R48 R49	T24-D26 PolarHBondContact O-N 3.36Å; D26-L47 HydrophobicContact CB-CD2 4.07Å; D26-L47 WeakPolarHBondContact OD1-CA 3.49Å; D26-L47 WeakPolarHBondContact OD1-CB 3.46Å; D26-R48 VanDerWaalsContact CG-N 3.26Å; D26-R48 PolarHBondContact OD1-N 3.46Å; D26-R48 WeakPolarHBondContact OD2-CB 3.36Å; D26-R48 PolarHBondContact OD2-N 3.06Å; D26-R49 VanDerWaalsContact O-CB 3.26Å; D26-R49 WeakPolarHBondContact O-CB 3.35Å; D26-R49 VanDerWaalsContact O-CD 3.3Å; D26-R49 WeakPolarHBondContact O-CD 3.21Å; D26-R49 VanDerWaalsContact OD1-CB 3.32Å; D26-R49 WeakPolarHBondContact OD1-CB 3.39Å; D26-R49 PolarHBondContact OD1-N 2.95Å; D26-R49 PolarHBondContact OD2-N 2.9Å
27	Q	94.6	Very high	95.3	Very high	105 Å²	105	46.1 Å²	46.1	49%	0.491	26%	0.257	S	S	.	.			trans	-90.1	-12.4	-175.5	-62.8	-175.4	2.5	0	0	114.5	W6 T24 H25 R49	W6-Q27 VanDerWaalsContact CE3-O 3.27Å; T24-Q27 PolarHBondContact O-N 3.09Å; H25-Q27 HydrophobicContact CB-CG 4.16Å; H25-Q27 WeakPolarHBondContact O-CG 3.32Å; H25-Q27 PolarHBondContact O-N 3.02Å; Q27-R49 VanDerWaalsContact C-CD 3.46Å; Q27-R49 VanDerWaalsContact O-CD 3.3Å; Q27-R49 WeakPolarHBondContact O-CD 3.49Å; Q27-R49 PolarHBondContact O-NE 2.91Å; Q27-R49 VanDerWaalsContact O-NE 3.09Å
28	F	95.6	Very high	95.5	Very high	41 Å²	41	44 Å²	44	18%	0.18	24%	0.244	C	C	.	.			trans	-103.5	140.8	-172.2	-57.3	-79.9	0	0	0	112.5	L8 T24 R49 V50	L8-F28 HydrophobicContact CB-CD1 3.95Å; L8-F28 HydrophobicContact CB-CD2 4.15Å; L8-F28 HydrophobicContact CB-CE1 4.18Å; L8-F28 HydrophobicContact CB-CE2 4.37Å; L8-F28 HydrophobicContact CB-CG 3.93Å; L8-F28 HydrophobicContact CB-CZ 4.39Å; L8-F28 HydrophobicContact CD1-CZ 4.43Å; L8-F28 HydrophobicContact CD2-CD2 4.23Å; L8-F28 HydrophobicContact CD2-CE2 4.19Å; T24-F28 HydrophobicContact CG2-CD2 4.36Å; T24-F28 HydrophobicContact CG2-CE2 4.24Å; F28-R49 CarbonylContact O-C 3.5Å; F28-V50 WeakPolarHBondContact O-CG2 3.26Å; F28-V50 PolarHBondContact O-N 3.39Å
29	D	96.5	Very high	95.6	Very high	27 Å²	27	50.1 Å²	50.1	14%	0.144	27%	0.271	C	S	.	.	S	Bend	trans	-85.6	-26.9	171.2	-71.8	-77.6	0	0	0	111.1	W6 R49 K51 S52	W6-D29 HydrophobicContact CB-CB 4.47Å; W6-D29 PolarHBondContact O-N 3.2Å; W6-D29 VanDerWaalsContact O-N 3.09Å; D29-R49 IonicContact OD1-NE 3Å; D29-R49 IonicContact OD1-NH2 2.76Å; D29-R49 IonicContact OD2-CZ 3.94Å; D29-R49 IonicContact OD2-NE 3.33Å; D29-R49 PolarHBondContact OD2-NE 2.85Å; D29-R49 IonicContact OD2-NH2 3.78Å; D29-R49 PolarHBondContact OD2-NH2 3.25Å; D29-K51 PolarHBondContact O-N 3.1Å; D29-K51 IonicContact OD1-NZ 2.77Å; D29-K51 PolarHBondContact OD1-NZ 2.94Å; D29-S52 PolarHBondContact O-N 3.49Å; D29-S52 VanDerWaalsContact O-N 3.13Å
30	T	97.1	Very high	95.8	Very high	22 Å²	22	49.2 Å²	49.2	14%	0.135	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.1	-176.7	-52.3	0	0	0	0	110.7	W6 D7 L8 S52 F54	W6-T30 PolarHBondContact O-N 3.12Å; D7-T30 WeakPolarHBondContact CA-O 3.3Å; D7-T30 WeakPolarHBondContact OD1-CB 3.49Å; D7-T30 PolarHBondContact OD1-OG1 3.2Å; L8-T30 PolarHBondContact N-O 3.31Å; T30-S52 WeakPolarHBondContact CA-O 3.32Å; T30-F54 HydrophobicContact CG2-CD2 3.67Å; T30-F54 HydrophobicContact CG2-CE2 3.48Å; T30-F54 VanDerWaalsContact CG2-CE2 3.48Å
31	I	96.4	Very high	96	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.2	165.1	-47.4	175.9	0	0	0	108.7	L8 F10 F33 L47 V50 S52 L53 F54	L8-I31 HydrophobicContact CB-CG1 4.42Å; L8-I31 HydrophobicContact CB-CG2 4.29Å; L8-I31 HydrophobicContact CD2-CG2 4.35Å; L8-I31 HydrophobicContact CG-CG2 4.4Å; L8-I31 WeakPolarHBondContact O-CA 3.16Å; F10-I31 HydrophobicContact CD2-CG2 4.13Å; F10-I31 HydrophobicContact CE2-CG2 4.09Å; I31-F33 HydrophobicContact CB-CE2 4.12Å; I31-F33 HydrophobicContact CG2-CD2 3.94Å; I31-F33 HydrophobicContact CG2-CE1 4.39Å; I31-F33 HydrophobicContact CG2-CE2 3.35Å; I31-F33 HydrophobicContact CG2-CZ 3.62Å; I31-L47 HydrophobicContact CD1-CD1 3.95Å; I31-V50 HydrophobicContact CD1-CG2 3.9Å; I31-V50 HydrophobicContact CG1-CG2 4.16Å; I31-S52 PolarHBondContact N-O 2.81Å; I31-S52 VanDerWaalsContact N-O 3.08Å; I31-L53 HydrophobicContact CB-CD2 3.65Å; I31-L53 HydrophobicContact CD1-CD2 4.4Å; I31-L53 HydrophobicContact CG1-CD2 4.23Å; I31-L53 WeakPolarHBondContact O-CA 3.5Å; I31-F54 PolarHBondContact O-N 3.16Å; I31-F54 VanDerWaalsContact O-N 3.07Å
32	D	96	Very high	96.1	Very high	9 Å²	9	44.9 Å²	44.9	5%	0.048	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.9	-177.8	-173.2	-0.7	0	0	0	110.7	L8 F10 T34 F54	L8-D32 PolarHBondContact O-N 3.23Å; F10-D32 PolarHBondContact N-O 3.07Å; D32-T34 WeakPolarHBondContact OD1-CA 3.46Å; D32-T34 WeakPolarHBondContact OD1-CB 3.16Å; D32-T34 PolarHBondContact OD1-N 3.11Å; D32-T34 PolarHBondContact OD1-OG1 2.9Å; D32-F54 HydrophobicContact CB-CB 4.19Å; D32-F54 HydrophobicContact CB-CD2 4.49Å; D32-F54 WeakPolarHBondContact OD1-CB 3.48Å
33	F	96.6	Very high	96.3	Very high	4 Å²	4	47 Å²	47	2%	0.018	24%	0.238	C	C	.	.			trans	-103.1	20.5	175.5	-64.7	-81.9	0	0	0	112.3	F10 I18 L21 I31 N36 L38 F44 L53 F54 F55 N58	F10-F33 HydrophobicContact CB-CD1 4.15Å; F10-F33 AromaticContact CD2-CD1 3.77Å; F10-F33 HydrophobicContact CD2-CD1 3.77Å; F10-F33 AromaticContact CD2-CE1 3.46Å; F10-F33 HydrophobicContact CD2-CE1 3.46Å; F10-F33 VanDerWaalsContact CD2-CE1 3.46Å; F10-F33 HydrophobicContact CD2-CZ 4.09Å; F10-F33 AromaticContact CE2-CE1 3.83Å; F10-F33 HydrophobicContact CE2-CE1 3.83Å; F10-F33 HydrophobicContact CE2-CZ 4.18Å; F10-F33 HydrophobicContact CG-CD1 4.28Å; F10-F33 HydrophobicContact CG-CE1 4.25Å; I18-F33 HydrophobicContact CG1-CE1 4.42Å; I18-F33 HydrophobicContact CG1-CZ 4.4Å; I18-F33 HydrophobicContact CG2-CZ 4.28Å; L21-F33 HydrophobicContact CD1-CZ 4.21Å; L21-F33 HydrophobicContact CD2-CZ 4.14Å; I31-F33 HydrophobicContact CB-CE2 4.12Å; I31-F33 HydrophobicContact CG2-CD2 3.94Å; I31-F33 HydrophobicContact CG2-CE1 4.39Å; I31-F33 HydrophobicContact CG2-CE2 3.35Å; I31-F33 HydrophobicContact CG2-CZ 3.62Å; F33-N36 VanDerWaalsContact C-ND2 3.34Å; F33-N36 PolarHBondContact O-ND2 3.12Å; F33-L38 HydrophobicContact CB-CD1 3.72Å; F33-L38 HydrophobicContact CD1-CD1 4.02Å; F33-L38 HydrophobicContact CG-CD1 3.93Å; F33-F44 HydrophobicContact CE2-CZ 4.23Å; F33-L53 HydrophobicContact CE2-CD2 4.49Å; F33-F54 WeakPolarHBondContact CA-O 3.33Å; F33-F54 PolarHBondContact N-O 3.08Å; F33-F55 HydrophobicContact CB-CD1 3.64Å; F33-F55 HydrophobicContact CB-CE1 3.84Å; F33-F55 AromaticContact CD2-CD1 3.91Å; F33-F55 HydrophobicContact CD2-CD1 3.91Å; F33-F55 AromaticContact CD2-CE1 3.27Å; F33-F55 HydrophobicContact CD2-CE1 3.27Å; F33-F55 AromaticContact CD2-CZ 3.76Å; F33-F55 HydrophobicContact CD2-CZ 3.76Å; F33-F55 AromaticContact CE2-CE1 3.94Å; F33-F55 HydrophobicContact CE2-CE1 3.94Å; F33-F55 HydrophobicContact CE2-CZ 4.11Å; F33-F55 HydrophobicContact CG-CD1 4.07Å; F33-F55 AromaticContact CG-CE1 3.73Å; F33-F55 HydrophobicContact CG-CE1 3.73Å; F33-N58 PolarHBondContact O-ND2 3.08Å
34	T	96.6	Very high	96.5	Very high	9 Å²	9	44 Å²	44	6%	0.055	21%	0.211	C	C	.	.			trans	-57.6	140.3	-178.1	-66.7	0	0	0	0	112.1	L11 D32 T56	L11-T34 HydrophobicContact CD2-CG2 4.23Å; L11-T34 WeakPolarHBondContact CD2-O 3.39Å; D32-T34 WeakPolarHBondContact OD1-CA 3.46Å; D32-T34 WeakPolarHBondContact OD1-CB 3.16Å; D32-T34 PolarHBondContact OD1-N 3.11Å; D32-T34 PolarHBondContact OD1-OG1 2.9Å; T34-T56 CarbonylContact C-O 3.57Å; T34-T56 WeakPolarHBondContact CA-O 3.48Å; T34-T56 HydrophobicContact CG2-CG2 4.39Å; T34-T56 WeakPolarHBondContact CG2-O 3.22Å
35	N	97.3	Very high	96.7	Very high	79 Å²	79	45.3 Å²	45.3	42%	0.422	22%	0.22	S	C	.	.	S	Bend	trans	60.1	55.6	-179.3	-55.3	-39.8	0	0	0	113.5	G12 T56 N57	G12-N35 WeakPolarHBondContact CA-O 3.38Å; G12-N35 PolarHBondContact N-O 3.06Å; G12-N35 VanDerWaalsContact N-O 3.15Å; N35-T56 PolarHBondContact N-O 2.85Å; N35-N57 WeakPolarHBondContact CA-O 3.43Å; N35-N57 PolarHBondContact N-O 2.98Å; N35-N57 VanDerWaalsContact OD1-CB 3.23Å; N35-N57 WeakPolarHBondContact OD1-CB 3.4Å; N35-N57 PolarHBondContact OD1-ND2 2.64Å
36	N	97	Very high	96.9	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.043	21%	0.212	C	C	.	.	S	Bend	trans	-122.5	-168.5	169.6	-73.9	-72	0	0	0	110.9	F10 Y13 K14 I15 F33 L38 N57 N58	F10-N36 PolarHBondContact O-ND2 2.73Å; Y13-N36 PolarHBondContact N-OD1 3.33Å; K14-N36 PolarHBondContact N-OD1 2.81Å; I15-N36 HydrophobicContact CB-CB 4.17Å; I15-N36 WeakPolarHBondContact CG1-OD1 3.44Å; I15-N36 PolarHBondContact N-OD1 3.16Å; F33-N36 VanDerWaalsContact C-ND2 3.34Å; F33-N36 PolarHBondContact O-ND2 3.12Å; N36-L38 HydrophobicContact CB-CG 4.33Å; N36-N57 PolarHBondContact N-O 3.32Å; N36-N58 VanDerWaalsContact CA-OD1 3.29Å; N36-N58 WeakPolarHBondContact CA-OD1 3.49Å; N36-N58 WeakPolarHBondContact CB-OD1 3.43Å; N36-N58 PolarHBondContact N-OD1 3.3Å; N36-N58 PolarHBondContact O-OD1 3.28Å
37	D	96.8	Very high	97	Very high	47 Å²	47	40.4 Å²	40.4	25%	0.251	20%	0.202	S	C	.	.			trans	-113.2	25.9	179.2	-76.3	-50.6	0	0	0	111.8	I15 K39 N58 R59	I15-D37 CarbonylContact O-C 3.32Å; I15-D37 PolarHBondContact O-N 2.98Å; I15-D37 VanDerWaalsContact O-N 3.09Å; D37-K39 PolarHBondContact O-N 3.01Å; D37-N58 PolarHBondContact N-OD1 2.86Å; D37-R59 IonicContact OD1-CZ 2.68Å; D37-R59 VanDerWaalsContact OD1-CZ 3.24Å; D37-R59 IonicContact OD1-NE 3.24Å; D37-R59 PolarHBondContact OD1-NE 3.36Å; D37-R59 IonicContact OD1-NH2 3.92Å; D37-R59 PolarHBondContact OD1-NH2 3.11Å
38	L	98.1	Very high	97.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.			trans	-61.6	135.2	-178.8	-66.2	173.9	0	0	0	110.7	I15 I18 F33 N36 F55 N58 R59 I60	I15-L38 HydrophobicContact CG2-CD2 3.96Å; I15-L38 PolarHBondContact O-N 3Å; I18-L38 HydrophobicContact CD1-CD1 4.28Å; I18-L38 HydrophobicContact CG1-CD1 4.02Å; I18-L38 HydrophobicContact CG1-CD2 3.76Å; F33-L38 HydrophobicContact CB-CD1 3.72Å; F33-L38 HydrophobicContact CD1-CD1 4.02Å; F33-L38 HydrophobicContact CG-CD1 3.93Å; N36-L38 HydrophobicContact CB-CG 4.33Å; L38-F55 HydrophobicContact CD1-CD1 3.69Å; L38-F55 HydrophobicContact CD1-CE1 3.69Å; L38-N58 HydrophobicContact CB-CB 4.27Å; L38-N58 WeakPolarHBondContact CB-OD1 3.44Å; L38-N58 PolarHBondContact N-OD1 3.27Å; L38-N58 VanDerWaalsContact N-OD1 3.07Å; L38-R59 CarbonylContact O-C 3.04Å; L38-R59 VanDerWaalsContact O-CA 3.29Å; L38-R59 WeakPolarHBondContact O-CA 3.48Å; L38-R59 PolarHBondContact O-N 3.01Å; L38-I60 HydrophobicContact CB-CD1 4.28Å; L38-I60 HydrophobicContact CB-CG1 4Å; L38-I60 WeakPolarHBondContact O-CG1 3.39Å; L38-I60 PolarHBondContact O-N 3.38Å; L38-I60 VanDerWaalsContact O-N 3.13Å
39	K	98.1	Very high	97.3	Very high	132 Å²	132	45.1 Å²	45.1	57%	0.574	21%	0.214	S	C	*	.			trans	-108.2	-21.9	177.5	-63.2	-178.2	-177.1	177.3	0	114.1	D37 R59 I60 S61	D37-K39 PolarHBondContact O-N 3.01Å; K39-R59 WeakPolarHBondContact CA-O 3.35Å; K39-R59 HydrophobicContact CG-CB 4.45Å; K39-I60 WeakPolarHBondContact O-CA 3.38Å; K39-S61 PolarHBondContact O-N 3.19Å; K39-S61 VanDerWaalsContact O-N 3.11Å
40	R	98.4	Very high	97.4	Very high	99 Å²	99	44 Å²	44	37%	0.374	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	150.3	-176.6	-47.8	-167.5	74	-138.3	-1.1	109.6	E42 C62	R40-E42 HydrophobicContact CB-CG 4.06Å; R40-E42 IonicContact CZ-OE2 2.73Å; R40-E42 IonicContact NE-OE2 2.68Å; R40-E42 IonicContact NH1-OE2 3.25Å; R40-E42 PolarHBondContact NH1-OE2 3.02Å; R40-C62 WeakPolarHBondContact CA-O 3.35Å; R40-C62 PolarHBondContact NE-SG 3.07Å
41	I	98.5	Very high	97.4	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	109.8	165	-59.5	172.2	0	0	0	106.8	F44 F55 I60 C62 L63 D64 V67 L79	I41-F44 HydrophobicContact CG2-CD2 4.35Å; I41-F44 HydrophobicContact CG2-CE2 3.72Å; I41-F55 HydrophobicContact CD1-CD2 3.92Å; I41-F55 HydrophobicContact CD1-CE2 3.8Å; I41-F55 HydrophobicContact CD1-CG 4.46Å; I41-F55 HydrophobicContact CD1-CZ 4.26Å; I41-F55 HydrophobicContact CG1-CD2 4.5Å; I41-F55 HydrophobicContact CG1-CE1 4.41Å; I41-F55 HydrophobicContact CG1-CE2 4.15Å; I41-F55 HydrophobicContact CG1-CZ 4.1Å; I41-F55 HydrophobicContact CG2-CE2 4.41Å; I41-F55 HydrophobicContact CG2-CZ 4.22Å; I41-I60 HydrophobicContact CD1-CD1 4.07Å; I41-I60 HydrophobicContact CD1-CG2 4.13Å; I41-I60 HydrophobicContact CG1-CD1 3.81Å; I41-I60 HydrophobicContact CG1-CG2 3.9Å; I41-C62 PolarHBondContact N-O 3.45Å; I41-C62 VanDerWaalsContact N-O 3.1Å; I41-L63 HydrophobicContact CB-CD1 3.56Å; I41-L63 HydrophobicContact CD1-CD1 4.33Å; I41-L63 HydrophobicContact CG2-CD1 3.47Å; I41-L63 VanDerWaalsContact CG2-CD1 3.47Å; I41-D64 WeakPolarHBondContact O-CB 3.37Å; I41-D64 PolarHBondContact O-N 3.43Å; I41-V67 HydrophobicContact CG2-CG1 4.18Å; I41-V67 HydrophobicContact CG2-CG2 4.43Å; I41-L79 HydrophobicContact CD1-CD2 3.45Å; I41-L79 VanDerWaalsContact CD1-CD2 3.45Å
42	E	97.8	Very high	97.5	Very high	34 Å²	34	48.5 Å²	48.5	16%	0.159	23%	0.229	C	C	.	.			trans	-158.5	179.3	-172.5	58.9	-178.7	177.1	0	0	109.6	R40 F44 D64	R40-E42 HydrophobicContact CB-CG 4.06Å; R40-E42 IonicContact CZ-OE2 2.73Å; R40-E42 IonicContact NE-OE2 2.68Å; R40-E42 IonicContact NH1-OE2 3.25Å; R40-E42 PolarHBondContact NH1-OE2 3.02Å; E42-F44 VanDerWaalsContact C-N 3.29Å; E42-F44 VanDerWaalsContact O-CD2 3.3Å; E42-F44 WeakPolarHBondContact O-CD2 3.44Å; E42-F44 PolarHBondContact O-N 3.37Å; E42-D64 HydrophobicContact CB-CB 4.08Å
43	N	96	Very high	97.6	Very high	92 Å²	92	48.2 Å²	48.2	49%	0.492	23%	0.227	S	C	.	.			trans	59.4	32.2	170.1	-56.6	-29.7	0	0	0	115.4	I18	I18-N43 WeakPolarHBondContact O-CB 3.27Å; I18-N43 PolarHBondContact O-ND2 2.78Å; I18-N43 VanDerWaalsContact O-ND2 3.13Å
44	F	97.8	Very high	97.7	Very high	12 Å²	12	51 Å²	51	5%	0.053	24%	0.239	C	C	.	.			trans	-83.1	125.4	171.1	-79.5	-94.1	0	0	0	110.6	I18 L21 F33 I41 E42 L47 L53 F55 V67 S70 L71	I18-F44 HydrophobicContact CD1-CD2 4.48Å; I18-F44 HydrophobicContact CD1-CE2 3.45Å; I18-F44 VanDerWaalsContact CD1-CE2 3.45Å; I18-F44 HydrophobicContact CD1-CZ 3.79Å; I18-F44 HydrophobicContact CG2-CE2 4.22Å; I18-F44 HydrophobicContact CG2-CZ 4.35Å; L21-F44 HydrophobicContact CD1-CD1 3.57Å; L21-F44 HydrophobicContact CD1-CE1 3.44Å; L21-F44 VanDerWaalsContact CD1-CE1 3.44Å; L21-F44 HydrophobicContact CD1-CG 4.28Å; L21-F44 HydrophobicContact CD1-CZ 4.04Å; F33-F44 HydrophobicContact CE2-CZ 4.23Å; I41-F44 HydrophobicContact CG2-CD2 4.35Å; I41-F44 HydrophobicContact CG2-CE2 3.72Å; E42-F44 VanDerWaalsContact C-N 3.29Å; E42-F44 VanDerWaalsContact O-CD2 3.3Å; E42-F44 WeakPolarHBondContact O-CD2 3.44Å; E42-F44 PolarHBondContact O-N 3.37Å; F44-L47 HydrophobicContact CD1-CD1 4.16Å; F44-L53 HydrophobicContact CE1-CD1 3.99Å; F44-L53 HydrophobicContact CE1-CD2 4.22Å; F44-L53 HydrophobicContact CZ-CD1 3.89Å; F44-L53 HydrophobicContact CZ-CD2 4.44Å; F44-F55 HydrophobicContact CE2-CZ 4.42Å; F44-F55 HydrophobicContact CZ-CZ 4.03Å; F44-V67 HydrophobicContact CB-CG1 4.46Å; F44-V67 HydrophobicContact CD2-CG1 3.85Å; F44-V67 HydrophobicContact CD2-CG2 4.19Å; F44-V67 HydrophobicContact CE2-CG1 4.44Å; F44-V67 HydrophobicContact CG-CG1 4.26Å; F44-S70 VanDerWaalsContact O-CB 3.32Å; F44-S70 WeakPolarHBondContact O-CB 3.5Å; F44-S70 PolarHBondContact O-OG 2.81Å; F44-L71 HydrophobicContact CB-CG 4.45Å; F44-L71 HydrophobicContact CD1-CD1 3.93Å; F44-L71 HydrophobicContact CD1-CD2 3.81Å; F44-L71 HydrophobicContact CD1-CG 4.19Å; F44-L71 HydrophobicContact CE1-CD1 4.15Å; F44-L71 HydrophobicContact CE1-CD2 4.44Å; F44-L71 HydrophobicContact CG-CD1 4.12Å; F44-L71 HydrophobicContact CG-CD2 4.39Å; F44-L71 HydrophobicContact CG-CG 4.36Å
45	P	97	Very high	97.8	Very high	44 Å²	44	50.6 Å²	50.6	29%	0.286	24%	0.237	S	C	.	.			trans	-67.5	169.3	161.2	33.7	-36.1	0	0	0	109.2	L21 L47 S70	L21-P45 HydrophobicContact CB-CG 3.93Å; P45-L47 HydrophobicContact CG-CD1 4.4Å; P45-L47 HydrophobicContact CG-CD2 3.97Å; P45-L47 HydrophobicContact CG-CG 4.02Å; P45-L47 PolarHBondContact O-N 3.08Å; P45-S70 WeakPolarHBondContact O-CB 3.21Å
46	T	97.8	Very high	97.8	Very high	78 Å²	78	48.1 Å²	48.1	48%	0.479	23%	0.225	S	C	.	.			trans	-62.3	109.4	171.8	-52.5	0	0	0	0	110.3	R48 S70	T46-R48 HydrophobicContact CG2-CG 3.99Å; T46-S70 CarbonylContact C-O 3.44Å; T46-S70 WeakPolarHBondContact CA-O 3.47Å
47	L	97.8	Very high	97.9	Very high	4 Å²	4	51 Å²	51	2%	0.021	24%	0.24	C	C	.	.			trans	-118	98	175.2	-58.2	175.9	0	0	0	108.6	D26 I31 F44 P45 V50 S70 L71	D26-L47 HydrophobicContact CB-CD2 4.07Å; D26-L47 WeakPolarHBondContact OD1-CA 3.49Å; D26-L47 WeakPolarHBondContact OD1-CB 3.46Å; I31-L47 HydrophobicContact CD1-CD1 3.95Å; F44-L47 HydrophobicContact CD1-CD1 4.16Å; P45-L47 HydrophobicContact CG-CD1 4.4Å; P45-L47 HydrophobicContact CG-CD2 3.97Å; P45-L47 HydrophobicContact CG-CG 4.02Å; P45-L47 PolarHBondContact O-N 3.08Å; L47-V50 HydrophobicContact CB-CB 4.23Å; L47-V50 HydrophobicContact CB-CG2 3.78Å; L47-V50 HydrophobicContact CD1-CG2 3.91Å; L47-V50 HydrophobicContact CG-CG2 4.44Å; L47-S70 PolarHBondContact N-O 2.86Å; L47-L71 HydrophobicContact CB-CD2 3.87Å; L47-L71 HydrophobicContact CD1-CD2 4.39Å; L47-L71 HydrophobicContact CG-CD2 4.49Å
48	R	97.8	Very high	98	Very high	153 Å²	153	49.2 Å²	49.2	58%	0.577	23%	0.23	S	C	*	.	S	Bend	trans	-80.8	-20.8	-177.2	-58.9	-176.3	-178.5	-78.5	-2.6	111.7	D26 T46 P72 N73	D26-R48 VanDerWaalsContact CG-N 3.26Å; D26-R48 PolarHBondContact OD1-N 3.46Å; D26-R48 WeakPolarHBondContact OD2-CB 3.36Å; D26-R48 PolarHBondContact OD2-N 3.06Å; T46-R48 HydrophobicContact CG2-CG 3.99Å; R48-P72 HydrophobicContact CG-CG 4.25Å; R48-N73 WeakPolarHBondContact O-CB 3.4Å; R48-N73 PolarHBondContact O-ND2 3.35Å
49	R	97.8	Very high	98	Very high	92 Å²	92	56 Å²	56	35%	0.347	26%	0.256	S	S	.	.	S	Bend	trans	-82.8	-32	-178.5	-169.3	177.6	171.7	95	7.5	112.7	D26 Q27 F28 D29 K51	D26-R49 VanDerWaalsContact O-CB 3.26Å; D26-R49 WeakPolarHBondContact O-CB 3.35Å; D26-R49 VanDerWaalsContact O-CD 3.3Å; D26-R49 WeakPolarHBondContact O-CD 3.21Å; D26-R49 VanDerWaalsContact OD1-CB 3.32Å; D26-R49 WeakPolarHBondContact OD1-CB 3.39Å; D26-R49 PolarHBondContact OD1-N 2.95Å; D26-R49 PolarHBondContact OD2-N 2.9Å; Q27-R49 VanDerWaalsContact C-CD 3.46Å; Q27-R49 VanDerWaalsContact O-CD 3.3Å; Q27-R49 WeakPolarHBondContact O-CD 3.49Å; Q27-R49 PolarHBondContact O-NE 2.91Å; Q27-R49 VanDerWaalsContact O-NE 3.09Å; F28-R49 CarbonylContact O-C 3.5Å; D29-R49 IonicContact OD1-NE 3Å; D29-R49 IonicContact OD1-NH2 2.76Å; D29-R49 IonicContact OD2-CZ 3.94Å; D29-R49 IonicContact OD2-NE 3.33Å; D29-R49 PolarHBondContact OD2-NE 2.85Å; D29-R49 IonicContact OD2-NH2 3.78Å; D29-R49 PolarHBondContact OD2-NH2 3.25Å; R49-K51 PolarHBondContact O-N 2.93Å
50	V	98.1	Very high	98	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.012	23%	0.228	C	C	.	.			trans	-59.1	124.7	-178.2	174.5	0	0	0	0	110.9	F28 I31 L47 L53 L71 N73 L74	F28-V50 WeakPolarHBondContact O-CG2 3.26Å; F28-V50 PolarHBondContact O-N 3.39Å; I31-V50 HydrophobicContact CD1-CG2 3.9Å; I31-V50 HydrophobicContact CG1-CG2 4.16Å; L47-V50 HydrophobicContact CB-CB 4.23Å; L47-V50 HydrophobicContact CB-CG2 3.78Å; L47-V50 HydrophobicContact CD1-CG2 3.91Å; L47-V50 HydrophobicContact CG-CG2 4.44Å; V50-L53 HydrophobicContact CG1-CD2 3.94Å; V50-L53 HydrophobicContact CG1-CG 4.03Å; V50-L71 HydrophobicContact CB-CD2 4.38Å; V50-L71 HydrophobicContact CG1-CD2 4.46Å; V50-N73 CarbonylContact O-C 3.55Å; V50-L74 HydrophobicContact CG1-CD1 4.2Å
51	K	98.4	Very high	98	Very high	94 Å²	94	47.4 Å²	47.4	41%	0.409	23%	0.228	S	C	.	.			trans	-117.3	-24.9	177.8	-69.5	163.4	-168.7	145.5	0	112.3	D29 R49 K75 T76	D29-K51 PolarHBondContact O-N 3.1Å; D29-K51 IonicContact OD1-NZ 2.77Å; D29-K51 PolarHBondContact OD1-NZ 2.94Å; R49-K51 PolarHBondContact O-N 2.93Å; K51-K75 PolarHBondContact O-N 3.07Å; K51-T76 PolarHBondContact O-N 2.58Å
52	S	98.5	Very high	97.9	Very high	24 Å²	24	48.9 Å²	48.9	17%	0.168	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130.1	-175.4	-59.1	0	0	0	0	111.3	D29 T30 I31 T76	D29-S52 PolarHBondContact O-N 3.49Å; D29-S52 VanDerWaalsContact O-N 3.13Å; T30-S52 WeakPolarHBondContact CA-O 3.32Å; I31-S52 PolarHBondContact N-O 2.81Å; I31-S52 VanDerWaalsContact N-O 3.08Å; S52-T76 WeakPolarHBondContact CA-O 3.47Å
53	L	98.4	Very high	98	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	132.1	170.8	-72	179.4	0	0	0	110.7	I31 F33 F44 V50 F55 L71 L74 T76 L77 V78	I31-L53 HydrophobicContact CB-CD2 3.65Å; I31-L53 HydrophobicContact CD1-CD2 4.4Å; I31-L53 HydrophobicContact CG1-CD2 4.23Å; I31-L53 WeakPolarHBondContact O-CA 3.5Å; F33-L53 HydrophobicContact CE2-CD2 4.49Å; F44-L53 HydrophobicContact CE1-CD1 3.99Å; F44-L53 HydrophobicContact CE1-CD2 4.22Å; F44-L53 HydrophobicContact CZ-CD1 3.89Å; F44-L53 HydrophobicContact CZ-CD2 4.44Å; V50-L53 HydrophobicContact CG1-CD2 3.94Å; V50-L53 HydrophobicContact CG1-CG 4.03Å; L53-F55 HydrophobicContact CB-CD2 4.3Å; L53-F55 HydrophobicContact CB-CE2 3.78Å; L53-F55 HydrophobicContact CD1-CE2 3.98Å; L53-F55 HydrophobicContact CD1-CZ 4.32Å; L53-F55 HydrophobicContact CG-CE2 4.39Å; L53-L71 HydrophobicContact CD1-CD1 3.47Å; L53-L71 VanDerWaalsContact CD1-CD1 3.47Å; L53-L74 HydrophobicContact CB-CD1 4.08Å; L53-L74 HydrophobicContact CD1-CD1 3.94Å; L53-L74 HydrophobicContact CD1-CD2 4.26Å; L53-L74 HydrophobicContact CG-CD1 3.67Å; L53-T76 PolarHBondContact N-O 2.83Å; L53-L77 HydrophobicContact CB-CD1 3.89Å; L53-V78 PolarHBondContact O-N 2.77Å
54	F	98.1	Very high	98.1	Very high	64 Å²	64	45.3 Å²	45.3	28%	0.281	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.3	177.2	-61	-93.1	0	0	0	109.8	T30 I31 D32 F33 V78	T30-F54 HydrophobicContact CG2-CD2 3.67Å; T30-F54 HydrophobicContact CG2-CE2 3.48Å; T30-F54 VanDerWaalsContact CG2-CE2 3.48Å; I31-F54 PolarHBondContact O-N 3.16Å; I31-F54 VanDerWaalsContact O-N 3.07Å; D32-F54 HydrophobicContact CB-CB 4.19Å; D32-F54 HydrophobicContact CB-CD2 4.49Å; D32-F54 WeakPolarHBondContact OD1-CB 3.48Å; F33-F54 WeakPolarHBondContact CA-O 3.33Å; F33-F54 PolarHBondContact N-O 3.08Å; F54-V78 HydrophobicContact CD1-CB 3.72Å; F54-V78 HydrophobicContact CD1-CG1 4.23Å; F54-V78 HydrophobicContact CD1-CG2 3.63Å; F54-V78 HydrophobicContact CE1-CB 4.27Å; F54-V78 HydrophobicContact CE1-CG2 3.65Å; F54-V78 HydrophobicContact CG-CB 4.48Å
55	F	98.4	Very high	98	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.241	C	C	.	.			trans	-127.8	26.7	179.8	-69.1	-75.4	0	0	0	111.4	I18 F33 L38 I41 F44 L53 N57 N58 I60 L77 V78 L79 N82	I18-F55 HydrophobicContact CD1-CE1 3.76Å; I18-F55 HydrophobicContact CD1-CZ 3.97Å; F33-F55 HydrophobicContact CB-CD1 3.64Å; F33-F55 HydrophobicContact CB-CE1 3.84Å; F33-F55 AromaticContact CD2-CD1 3.91Å; F33-F55 HydrophobicContact CD2-CD1 3.91Å; F33-F55 AromaticContact CD2-CE1 3.27Å; F33-F55 HydrophobicContact CD2-CE1 3.27Å; F33-F55 AromaticContact CD2-CZ 3.76Å; F33-F55 HydrophobicContact CD2-CZ 3.76Å; F33-F55 AromaticContact CE2-CE1 3.94Å; F33-F55 HydrophobicContact CE2-CE1 3.94Å; F33-F55 HydrophobicContact CE2-CZ 4.11Å; F33-F55 HydrophobicContact CG-CD1 4.07Å; F33-F55 AromaticContact CG-CE1 3.73Å; F33-F55 HydrophobicContact CG-CE1 3.73Å; L38-F55 HydrophobicContact CD1-CD1 3.69Å; L38-F55 HydrophobicContact CD1-CE1 3.69Å; I41-F55 HydrophobicContact CD1-CD2 3.92Å; I41-F55 HydrophobicContact CD1-CE2 3.8Å; I41-F55 HydrophobicContact CD1-CG 4.46Å; I41-F55 HydrophobicContact CD1-CZ 4.26Å; I41-F55 HydrophobicContact CG1-CD2 4.5Å; I41-F55 HydrophobicContact CG1-CE1 4.41Å; I41-F55 HydrophobicContact CG1-CE2 4.15Å; I41-F55 HydrophobicContact CG1-CZ 4.1Å; I41-F55 HydrophobicContact CG2-CE2 4.41Å; I41-F55 HydrophobicContact CG2-CZ 4.22Å; F44-F55 HydrophobicContact CE2-CZ 4.42Å; F44-F55 HydrophobicContact CZ-CZ 4.03Å; L53-F55 HydrophobicContact CB-CD2 4.3Å; L53-F55 HydrophobicContact CB-CE2 3.78Å; L53-F55 HydrophobicContact CD1-CE2 3.98Å; L53-F55 HydrophobicContact CD1-CZ 4.32Å; L53-F55 HydrophobicContact CG-CE2 4.39Å; F55-N57 PolarHBondContact O-N 2.84Å; F55-N58 PolarHBondContact O-ND2 3.06Å; F55-I60 HydrophobicContact CB-CD1 3.64Å; F55-I60 HydrophobicContact CD1-CD1 3.64Å; F55-I60 HydrophobicContact CE1-CD1 4.41Å; F55-I60 HydrophobicContact CG-CD1 3.71Å; F55-L77 HydrophobicContact CD2-CD1 3.86Å; F55-L77 HydrophobicContact CE2-CD1 3.92Å; F55-V78 PolarHBondContact N-O 2.79Å; F55-L79 HydrophobicContact CB-CD2 4.09Å; F55-L79 HydrophobicContact CD2-CD2 3.95Å; F55-L79 HydrophobicContact CG-CD2 4.34Å; F55-N82 PolarHBondContact O-ND2 2.89Å
56	T	98.3	Very high	97.9	Very high	27 Å²	27	49.1 Å²	49.1	17%	0.166	25%	0.247	C	C	.	.			trans	-57.8	137.3	-174.7	-56.1	0	0	0	0	110.6	T34 N35 N58 T80	T34-T56 CarbonylContact C-O 3.57Å; T34-T56 WeakPolarHBondContact CA-O 3.48Å; T34-T56 HydrophobicContact CG2-CG2 4.39Å; T34-T56 WeakPolarHBondContact CG2-O 3.22Å; N35-T56 PolarHBondContact N-O 2.85Å; T56-N58 PolarHBondContact O-ND2 3.2Å; T56-T80 CarbonylContact C-O 3.11Å; T56-T80 VanDerWaalsContact CA-O 3.26Å; T56-T80 WeakPolarHBondContact CA-O 3.46Å; T56-T80 HydrophobicContact CG2-CG2 4.33Å
57	N	98.1	Very high	97.9	Very high	67 Å²	67	45.5 Å²	45.5	36%	0.358	23%	0.225	S	C	.	.	S	Bend	trans	56	64.1	179.3	-55.4	-29.3	0	0	0	112.8	N35 N36 F55 T80 N81	N35-N57 WeakPolarHBondContact CA-O 3.43Å; N35-N57 PolarHBondContact N-O 2.98Å; N35-N57 VanDerWaalsContact OD1-CB 3.23Å; N35-N57 WeakPolarHBondContact OD1-CB 3.4Å; N35-N57 PolarHBondContact OD1-ND2 2.64Å; N36-N57 PolarHBondContact N-O 3.32Å; F55-N57 PolarHBondContact O-N 2.84Å; N57-T80 PolarHBondContact N-O 3.42Å; N57-N81 WeakPolarHBondContact CA-O 3.46Å; N57-N81 PolarHBondContact N-O 2.96Å; N57-N81 WeakPolarHBondContact OD1-CB 3.32Å; N57-N81 PolarHBondContact OD1-ND2 3.09Å
58	N	98.5	Very high	97.9	Very high	11 Å²	11	45.7 Å²	45.7	6%	0.059	23%	0.227	C	C	.	.	S	Bend	trans	-125	-163.2	169.1	-83.6	-86.9	0	0	0	109.1	F33 N36 D37 L38 F55 T56 I60 N81 N82	F33-N58 PolarHBondContact O-ND2 3.08Å; N36-N58 VanDerWaalsContact CA-OD1 3.29Å; N36-N58 WeakPolarHBondContact CA-OD1 3.49Å; N36-N58 WeakPolarHBondContact CB-OD1 3.43Å; N36-N58 PolarHBondContact N-OD1 3.3Å; N36-N58 PolarHBondContact O-OD1 3.28Å; D37-N58 PolarHBondContact N-OD1 2.86Å; L38-N58 HydrophobicContact CB-CB 4.27Å; L38-N58 WeakPolarHBondContact CB-OD1 3.44Å; L38-N58 PolarHBondContact N-OD1 3.27Å; L38-N58 VanDerWaalsContact N-OD1 3.07Å; F55-N58 PolarHBondContact O-ND2 3.06Å; T56-N58 PolarHBondContact O-ND2 3.2Å; N58-I60 HydrophobicContact CB-CD1 4.1Å; N58-I60 HydrophobicContact CB-CG1 3.98Å; N58-N81 PolarHBondContact N-O 2.93Å; N58-N82 WeakPolarHBondContact CA-OD1 3.39Å; N58-N82 WeakPolarHBondContact CB-OD1 3.3Å; N58-N82 PolarHBondContact O-OD1 3.13Å
59	R	98.1	Very high	98	Very high	141 Å²	141	46 Å²	46	53%	0.532	24%	0.235	S	C	.	.			trans	-123.7	34.1	177.1	-51	-175.4	-160.2	-162.3	5.2	111.1	D37 L38 K39 S61 N82 V83	D37-R59 IonicContact OD1-CZ 2.68Å; D37-R59 VanDerWaalsContact OD1-CZ 3.24Å; D37-R59 IonicContact OD1-NE 3.24Å; D37-R59 PolarHBondContact OD1-NE 3.36Å; D37-R59 IonicContact OD1-NH2 3.92Å; D37-R59 PolarHBondContact OD1-NH2 3.11Å; L38-R59 CarbonylContact O-C 3.04Å; L38-R59 VanDerWaalsContact O-CA 3.29Å; L38-R59 WeakPolarHBondContact O-CA 3.48Å; L38-R59 PolarHBondContact O-N 3.01Å; K39-R59 WeakPolarHBondContact CA-O 3.35Å; K39-R59 HydrophobicContact CG-CB 4.45Å; R59-S61 PolarHBondContact O-N 2.94Å; R59-N82 PolarHBondContact N-OD1 3.02Å; R59-V83 VanDerWaalsContact C-CG2 3.47Å; R59-V83 VanDerWaalsContact O-CG2 3.25Å; R59-V83 WeakPolarHBondContact O-CG2 3.25Å
60	I	98.8	Very high	98	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.226	C	C	.	.			trans	-72.6	124.6	-174.6	-58.1	167.8	0	0	0	109.1	L38 K39 I41 F55 N58 C62 L79 N82 V83 F84	L38-I60 HydrophobicContact CB-CD1 4.28Å; L38-I60 HydrophobicContact CB-CG1 4Å; L38-I60 WeakPolarHBondContact O-CG1 3.39Å; L38-I60 PolarHBondContact O-N 3.38Å; L38-I60 VanDerWaalsContact O-N 3.13Å; K39-I60 WeakPolarHBondContact O-CA 3.38Å; I41-I60 HydrophobicContact CD1-CD1 4.07Å; I41-I60 HydrophobicContact CD1-CG2 4.13Å; I41-I60 HydrophobicContact CG1-CD1 3.81Å; I41-I60 HydrophobicContact CG1-CG2 3.9Å; F55-I60 HydrophobicContact CB-CD1 3.64Å; F55-I60 HydrophobicContact CD1-CD1 3.64Å; F55-I60 HydrophobicContact CE1-CD1 4.41Å; F55-I60 HydrophobicContact CG-CD1 3.71Å; N58-I60 HydrophobicContact CB-CD1 4.1Å; N58-I60 HydrophobicContact CB-CG1 3.98Å; I60-C62 WeakPolarHBondContact CG2-O 3.42Å; I60-L79 HydrophobicContact CD1-CD2 4.49Å; I60-N82 HydrophobicContact CB-CB 4.24Å; I60-N82 VanDerWaalsContact CB-OD1 3.27Å; I60-N82 WeakPolarHBondContact CB-OD1 3.27Å; I60-N82 WeakPolarHBondContact CG1-OD1 3.21Å; I60-N82 PolarHBondContact N-OD1 3.3Å; I60-V83 CarbonylContact O-C 3.57Å; I60-V83 WeakPolarHBondContact O-CG2 3.41Å; I60-V83 PolarHBondContact O-N 2.86Å; I60-F84 HydrophobicContact CB-CE2 4.13Å; I60-F84 HydrophobicContact CG2-CE2 3.53Å; I60-F84 HydrophobicContact CG2-CZ 3.69Å; I60-F84 PolarHBondContact O-N 3.02Å
61	S	98.2	Very high	98	Very high	51 Å²	51	42.6 Å²	42.6	36%	0.357	23%	0.225	S	C	.	.			trans	-113.6	-12.6	173.7	56.1	0	0	0	0	113.1	K39 R59	K39-S61 PolarHBondContact O-N 3.19Å; K39-S61 VanDerWaalsContact O-N 3.11Å; R59-S61 PolarHBondContact O-N 2.94Å
62	C	97.2	Very high	98	Very high	34 Å²	34	39.4 Å²	39.4	23%	0.23	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	154.6	-176.9	61	0	0	0	0	113.4	R40 I41 I60	R40-C62 WeakPolarHBondContact CA-O 3.35Å; R40-C62 PolarHBondContact NE-SG 3.07Å; I41-C62 PolarHBondContact N-O 3.45Å; I41-C62 VanDerWaalsContact N-O 3.1Å; I60-C62 WeakPolarHBondContact CG2-O 3.42Å
63	L	98.5	Very high	98	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.042	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	123.6	178.3	169.8	58.3	0	0	0	108.5	I41 P65 V67 P92 L93 F96	I41-L63 HydrophobicContact CB-CD1 3.56Å; I41-L63 HydrophobicContact CD1-CD1 4.33Å; I41-L63 HydrophobicContact CG2-CD1 3.47Å; I41-L63 VanDerWaalsContact CG2-CD1 3.47Å; L63-P65 WeakPolarHBondContact O-CD 3.42Å; L63-V67 HydrophobicContact CD1-CB 4.1Å; L63-V67 HydrophobicContact CD1-CG1 4.27Å; L63-V67 HydrophobicContact CD1-CG2 4.33Å; L63-P92 HydrophobicContact CB-CB 4.27Å; L63-P92 HydrophobicContact CD2-CB 4.03Å; L63-P92 HydrophobicContact CG-CB 3.97Å; L63-L93 HydrophobicContact CD2-CD2 3.52Å; L63-L93 HydrophobicContact CD2-CG 4.09Å; L63-F96 HydrophobicContact CD1-CE2 4.4Å; L63-F96 HydrophobicContact CD1-CZ 4.18Å; L63-F96 HydrophobicContact CD2-CE2 3.54Å; L63-F96 HydrophobicContact CD2-CZ 4.11Å; L63-F96 HydrophobicContact CG-CE2 4.37Å
64	D	97.8	Very high	98	Very high	43 Å²	43	40.4 Å²	40.4	23%	0.23	22%	0.218	C	C	.	.			trans	-67.1	124.2	174	-171.7	-49.5	0	0	0	109.9	I41 E42 S66 V67	I41-D64 WeakPolarHBondContact O-CB 3.37Å; I41-D64 PolarHBondContact O-N 3.43Å; E42-D64 HydrophobicContact CB-CB 4.08Å; D64-S66 PolarHBondContact O-N 2.85Å; D64-S66 VanDerWaalsContact O-N 3.15Å; D64-S66 WeakPolarHBondContact OD1-CB 3.49Å; D64-S66 PolarHBondContact OD1-N 2.91Å; D64-S66 PolarHBondContact OD1-OG 2.79Å; D64-V67 HydrophobicContact CB-CG2 4.02Å; D64-V67 WeakPolarHBondContact O-CB 3.3Å; D64-V67 WeakPolarHBondContact O-CG2 3.32Å; D64-V67 PolarHBondContact O-N 3.43Å; D64-V67 VanDerWaalsContact O-N 3.11Å
65	P	95.6	Very high	98	Very high	78 Å²	78	41 Å²	41	51%	0.506	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28	-178.6	-25.4	34.1	0	0	0	114.8	L63 V67 P92	L63-P65 WeakPolarHBondContact O-CD 3.42Å; P65-V67 PolarHBondContact O-N 2.88Å; P65-P92 HydrophobicContact CG-CB 4.32Å; P65-P92 HydrophobicContact CG-CG 4.19Å
66	S	96.3	Very high	98.1	Very high	58 Å²	58	42.4 Å²	42.4	41%	0.406	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-19.2	-179.9	66.2	0	0	0	0	113.4	D64 A68 E69	D64-S66 PolarHBondContact O-N 2.85Å; D64-S66 VanDerWaalsContact O-N 3.15Å; D64-S66 WeakPolarHBondContact OD1-CB 3.49Å; D64-S66 PolarHBondContact OD1-N 2.91Å; D64-S66 PolarHBondContact OD1-OG 2.79Å; S66-A68 PolarHBondContact O-N 3.3Å; S66-E69 WeakPolarHBondContact O-CB 3.03Å; S66-E69 PolarHBondContact O-N 3.2Å
67	V	98.2	Very high	98.1	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-29.9	-179	173	0	0	0	0	111.9	I41 F44 L63 D64 P65 E69 S70 L71 F96	I41-V67 HydrophobicContact CG2-CG1 4.18Å; I41-V67 HydrophobicContact CG2-CG2 4.43Å; F44-V67 HydrophobicContact CB-CG1 4.46Å; F44-V67 HydrophobicContact CD2-CG1 3.85Å; F44-V67 HydrophobicContact CD2-CG2 4.19Å; F44-V67 HydrophobicContact CE2-CG1 4.44Å; F44-V67 HydrophobicContact CG-CG1 4.26Å; L63-V67 HydrophobicContact CD1-CB 4.1Å; L63-V67 HydrophobicContact CD1-CG1 4.27Å; L63-V67 HydrophobicContact CD1-CG2 4.33Å; D64-V67 HydrophobicContact CB-CG2 4.02Å; D64-V67 WeakPolarHBondContact O-CB 3.3Å; D64-V67 WeakPolarHBondContact O-CG2 3.32Å; D64-V67 PolarHBondContact O-N 3.43Å; D64-V67 VanDerWaalsContact O-N 3.11Å; P65-V67 PolarHBondContact O-N 2.88Å; V67-E69 VanDerWaalsContact C-N 3.25Å; V67-E69 PolarHBondContact O-N 3.23Å; V67-S70 PolarHBondContact O-N 3.12Å; V67-S70 VanDerWaalsContact O-N 3.14Å; V67-L71 HydrophobicContact CG1-CD1 3.64Å; V67-L71 HydrophobicContact CG1-CG 4.21Å; V67-L71 PolarHBondContact O-N 2.94Å; V67-F96 HydrophobicContact CB-CZ 4.27Å; V67-F96 HydrophobicContact CG1-CE1 4.14Å; V67-F96 HydrophobicContact CG1-CZ 3.88Å
68	A	98	Very high	98.1	Very high	7 Å²	7	38.5 Å²	38.5	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-32.2	177.1	0	0	0	0	0	112.9	S66 S95 F96	S66-A68 PolarHBondContact O-N 3.3Å; A68-S95 VanDerWaalsContact CB-CB 3.46Å; A68-S95 WeakPolarHBondContact CB-O 3.2Å; A68-F96 HydrophobicContact CB-CD1 4.12Å; A68-F96 HydrophobicContact CB-CD2 4.08Å; A68-F96 HydrophobicContact CB-CE1 4.17Å; A68-F96 HydrophobicContact CB-CE2 4.1Å; A68-F96 HydrophobicContact CB-CG 4.09Å; A68-F96 HydrophobicContact CB-CZ 4.16Å
69	E	97.9	Very high	98.1	Very high	160 Å²	160	38 Å²	38	75%	0.748	21%	0.205	S	C	*	.	H	α-helix	trans	-71	-34.3	175.4	-58.9	-178.3	-171.6	0	0	111.6	S66 V67	S66-E69 WeakPolarHBondContact O-CB 3.03Å; S66-E69 PolarHBondContact O-N 3.2Å; V67-E69 VanDerWaalsContact C-N 3.25Å; V67-E69 PolarHBondContact O-N 3.23Å
70	S	98.3	Very high	98.2	Very high	21 Å²	21	32.2 Å²	32.2	15%	0.147	19%	0.185	C	C	.	.	H	α-helix	trans	-74.1	-25.1	177.2	-72.5	0	0	0	0	113.5	F44 P45 T46 L47 V67 P72	F44-S70 VanDerWaalsContact O-CB 3.32Å; F44-S70 WeakPolarHBondContact O-CB 3.5Å; F44-S70 PolarHBondContact O-OG 2.81Å; P45-S70 WeakPolarHBondContact O-CB 3.21Å; T46-S70 CarbonylContact C-O 3.44Å; T46-S70 WeakPolarHBondContact CA-O 3.47Å; L47-S70 PolarHBondContact N-O 2.86Å; V67-S70 PolarHBondContact O-N 3.12Å; V67-S70 VanDerWaalsContact O-N 3.14Å; S70-P72 VanDerWaalsContact O-CD 3.27Å; S70-P72 WeakPolarHBondContact O-CD 3.46Å
71	L	98.4	Very high	98.2	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.204	C	C	.	.			trans	-122.2	59.9	-173.9	-58.9	179.4	0	0	0	112.8	F44 L47 V50 L53 V67 N73 L74 F96	F44-L71 HydrophobicContact CB-CG 4.45Å; F44-L71 HydrophobicContact CD1-CD1 3.93Å; F44-L71 HydrophobicContact CD1-CD2 3.81Å; F44-L71 HydrophobicContact CD1-CG 4.19Å; F44-L71 HydrophobicContact CE1-CD1 4.15Å; F44-L71 HydrophobicContact CE1-CD2 4.44Å; F44-L71 HydrophobicContact CG-CD1 4.12Å; F44-L71 HydrophobicContact CG-CD2 4.39Å; F44-L71 HydrophobicContact CG-CG 4.36Å; L47-L71 HydrophobicContact CB-CD2 3.87Å; L47-L71 HydrophobicContact CD1-CD2 4.39Å; L47-L71 HydrophobicContact CG-CD2 4.49Å; V50-L71 HydrophobicContact CB-CD2 4.38Å; V50-L71 HydrophobicContact CG1-CD2 4.46Å; L53-L71 HydrophobicContact CD1-CD1 3.47Å; L53-L71 VanDerWaalsContact CD1-CD1 3.47Å; V67-L71 HydrophobicContact CG1-CD1 3.64Å; V67-L71 HydrophobicContact CG1-CG 4.21Å; V67-L71 PolarHBondContact O-N 2.94Å; L71-N73 PolarHBondContact O-N 3.17Å; L71-L74 HydrophobicContact CB-CB 4.13Å; L71-L74 HydrophobicContact CD1-CD2 4.33Å; L71-L74 PolarHBondContact O-N 2.82Å; L71-L74 VanDerWaalsContact O-N 3.16Å; L71-F96 HydrophobicContact CB-CE1 4.23Å; L71-F96 HydrophobicContact CD1-CE1 4.33Å
72	P	98	Very high	98.2	Very high	28 Å²	28	33.6 Å²	33.6	18%	0.182	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-12	-170	28.7	-37.6	0	0	0	114.4	R48 S70	R48-P72 HydrophobicContact CG-CG 4.25Å; S70-P72 VanDerWaalsContact O-CD 3.27Å; S70-P72 WeakPolarHBondContact O-CD 3.46Å
73	N	98.6	Very high	98.3	Very high	44 Å²	44	35.2 Å²	35.2	24%	0.235	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	9.4	-178.4	-69.1	-49.6	0	0	0	114.1	R48 V50 L71 K75 K98	R48-N73 WeakPolarHBondContact O-CB 3.4Å; R48-N73 PolarHBondContact O-ND2 3.35Å; V50-N73 CarbonylContact O-C 3.55Å; L71-N73 PolarHBondContact O-N 3.17Å; N73-K75 PolarHBondContact O-N 3.03Å; N73-K98 WeakPolarHBondContact OD1-CE 3.42Å; N73-K98 PolarHBondContact OD1-NZ 2.88Å
74	L	98.7	Very high	98.3	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	20%	0.195	C	C	.	.			trans	-62.6	123.4	177.2	-169.3	71.4	0	0	0	110.5	V50 L53 L71 L77 F96 K98 L99	V50-L74 HydrophobicContact CG1-CD1 4.2Å; L53-L74 HydrophobicContact CB-CD1 4.08Å; L53-L74 HydrophobicContact CD1-CD1 3.94Å; L53-L74 HydrophobicContact CD1-CD2 4.26Å; L53-L74 HydrophobicContact CG-CD1 3.67Å; L71-L74 HydrophobicContact CB-CB 4.13Å; L71-L74 HydrophobicContact CD1-CD2 4.33Å; L71-L74 PolarHBondContact O-N 2.82Å; L71-L74 VanDerWaalsContact O-N 3.16Å; L74-L77 HydrophobicContact CD2-CB 4.34Å; L74-L77 HydrophobicContact CD2-CD1 4.49Å; L74-F96 HydrophobicContact CB-CD1 4.14Å; L74-F96 HydrophobicContact CD2-CD1 3.64Å; L74-F96 HydrophobicContact CD2-CE1 3.6Å; L74-F96 HydrophobicContact CD2-CZ 4.47Å; L74-F96 HydrophobicContact CG-CD1 4.5Å; L74-K98 CarbonylContact O-C 3.53Å; L74-L99 PolarHBondContact O-N 2.82Å
75	K	98.8	Very high	98.3	Very high	77 Å²	77	38.5 Å²	38.5	34%	0.335	21%	0.211	S	C	.	.			trans	-112	-34.4	178.6	-68.4	-165.3	169.5	-144.8	0	113.3	K51 N73 K98 E100 Y101	K51-K75 PolarHBondContact O-N 3.07Å; N73-K75 PolarHBondContact O-N 3.03Å; K75-K98 WeakPolarHBondContact CA-O 3.34Å; K75-K98 HydrophobicContact CG-CB 4.42Å; K75-E100 IonicContact NZ-OE1 3.07Å; K75-E100 PolarHBondContact NZ-OE1 2.75Å; K75-E100 PolarHBondContact O-N 3.14Å; K75-Y101 PolarHBondContact O-N 2.92Å
76	T	98.9	Very high	98.4	Very high	30 Å²	30	39 Å²	39	18%	0.184	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.9	-175.1	-58.2	0	0	0	0	109.6	K51 S52 L53 V78 Y101	K51-T76 PolarHBondContact O-N 2.58Å; S52-T76 WeakPolarHBondContact CA-O 3.47Å; L53-T76 PolarHBondContact N-O 2.83Å; T76-V78 HydrophobicContact CG2-CG2 4.07Å; T76-Y101 WeakPolarHBondContact CA-O 3.33Å
77	L	98.8	Very high	98.5	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	114.9	174.8	-177.5	59.3	0	0	0	109.7	L53 F55 L74 L79 L93 L99 Y101 L102 S103	L53-L77 HydrophobicContact CB-CD1 3.89Å; F55-L77 HydrophobicContact CD2-CD1 3.86Å; F55-L77 HydrophobicContact CE2-CD1 3.92Å; L74-L77 HydrophobicContact CD2-CB 4.34Å; L74-L77 HydrophobicContact CD2-CD1 4.49Å; L77-L79 HydrophobicContact CD1-CD2 4.21Å; L77-L79 HydrophobicContact CD1-CG 4.33Å; L77-L79 HydrophobicContact CD2-CD1 3.95Å; L77-L79 HydrophobicContact CD2-CG 4.36Å; L77-L79 HydrophobicContact CG-CD1 4.09Å; L77-L79 HydrophobicContact CG-CD2 4.36Å; L77-L79 HydrophobicContact CG-CG 3.98Å; L77-L93 HydrophobicContact CD2-CD2 3.55Å; L77-L99 HydrophobicContact CB-CD1 3.7Å; L77-Y101 PolarHBondContact N-O 3.02Å; L77-L102 HydrophobicContact CB-CD1 4.34Å; L77-L102 HydrophobicContact CD2-CD1 4.43Å; L77-L102 HydrophobicContact CG-CD1 4.44Å; L77-L102 WeakPolarHBondContact O-CA 3.23Å; L77-S103 PolarHBondContact O-N 3.42Å; L77-S103 VanDerWaalsContact O-N 3.12Å
78	V	98.8	Very high	98.5	Very high	10 Å²	10	39.6 Å²	39.6	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	108.3	-179.7	-178.3	0	0	0	0	109.3	L53 F54 F55 T76 T80	L53-V78 PolarHBondContact O-N 2.77Å; F54-V78 HydrophobicContact CD1-CB 3.72Å; F54-V78 HydrophobicContact CD1-CG1 4.23Å; F54-V78 HydrophobicContact CD1-CG2 3.63Å; F54-V78 HydrophobicContact CE1-CB 4.27Å; F54-V78 HydrophobicContact CE1-CG2 3.65Å; F54-V78 HydrophobicContact CG-CB 4.48Å; F55-V78 PolarHBondContact N-O 2.79Å; T76-V78 HydrophobicContact CG2-CG2 4.07Å; V78-T80 WeakPolarHBondContact CG1-OG1 3.46Å
79	L	98.8	Very high	98.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.			trans	-110	21.1	-179.5	-62.1	166.3	0	0	0	111.7	I41 F55 I60 L77 N81 N82 F84 L102 S103 L104 N107	I41-L79 HydrophobicContact CD1-CD2 3.45Å; I41-L79 VanDerWaalsContact CD1-CD2 3.45Å; F55-L79 HydrophobicContact CB-CD2 4.09Å; F55-L79 HydrophobicContact CD2-CD2 3.95Å; F55-L79 HydrophobicContact CG-CD2 4.34Å; I60-L79 HydrophobicContact CD1-CD2 4.49Å; L77-L79 HydrophobicContact CD1-CD2 4.21Å; L77-L79 HydrophobicContact CD1-CG 4.33Å; L77-L79 HydrophobicContact CD2-CD1 3.95Å; L77-L79 HydrophobicContact CD2-CG 4.36Å; L77-L79 HydrophobicContact CG-CD1 4.09Å; L77-L79 HydrophobicContact CG-CD2 4.36Å; L77-L79 HydrophobicContact CG-CG 3.98Å; L79-N81 PolarHBondContact O-N 3.09Å; L79-N82 VanDerWaalsContact C-ND2 3.35Å; L79-N82 WeakPolarHBondContact O-CB 3.34Å; L79-N82 PolarHBondContact O-ND2 3.39Å; L79-F84 HydrophobicContact CD1-CE2 4.01Å; L79-F84 HydrophobicContact CD1-CZ 4.37Å; L79-F84 HydrophobicContact CD2-CE2 4.22Å; L79-L102 HydrophobicContact CD1-CD1 4.27Å; L79-S103 CarbonylContact C-O 3.53Å; L79-S103 WeakPolarHBondContact CA-O 3.35Å; L79-S103 WeakPolarHBondContact CB-O 3.46Å; L79-S103 PolarHBondContact N-O 3.46Å; L79-L104 HydrophobicContact CB-CD2 4.03Å; L79-L104 HydrophobicContact CD1-CD2 3.73Å; L79-N107 PolarHBondContact O-ND2 2.71Å
80	T	98.7	Very high	98.6	Very high	20 Å²	20	34.3 Å²	34.3	12%	0.123	19%	0.189	C	C	.	.			trans	-53.3	136	-177.1	-55.5	0	0	0	0	111.6	T56 N57 V78 N82 S103 M105	T56-T80 CarbonylContact C-O 3.11Å; T56-T80 VanDerWaalsContact CA-O 3.26Å; T56-T80 WeakPolarHBondContact CA-O 3.46Å; T56-T80 HydrophobicContact CG2-CG2 4.33Å; N57-T80 PolarHBondContact N-O 3.42Å; V78-T80 WeakPolarHBondContact CG1-OG1 3.46Å; T80-N82 PolarHBondContact O-ND2 3.38Å; T80-S103 PolarHBondContact OG1-OG 3.04Å; T80-M105 CarbonylContact C-O 3.22Å; T80-M105 WeakPolarHBondContact CA-O 3.29Å; T80-M105 HydrophobicContact CG2-CB 4.23Å
81	N	98.7	Very high	98.5	Very high	75 Å²	75	38.8 Å²	38.8	40%	0.401	21%	0.207	S	C	.	.	S	Bend	trans	53.9	61.3	-179.5	-58.1	-20.2	0	0	0	112.7	N57 N58 L79 M105	N57-N81 WeakPolarHBondContact CA-O 3.46Å; N57-N81 PolarHBondContact N-O 2.96Å; N57-N81 WeakPolarHBondContact OD1-CB 3.32Å; N57-N81 PolarHBondContact OD1-ND2 3.09Å; N58-N81 PolarHBondContact N-O 2.93Å; L79-N81 PolarHBondContact O-N 3.09Å; N81-M105 PolarHBondContact N-O 3.45Å
82	N	98.8	Very high	98.5	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.027	21%	0.214	C	C	.	.			trans	-120.5	-163.1	167.5	-82.7	-78.6	0	0	0	108.9	F55 N58 R59 I60 L79 T80 F84 N107	F55-N82 PolarHBondContact O-ND2 2.89Å; N58-N82 WeakPolarHBondContact CA-OD1 3.39Å; N58-N82 WeakPolarHBondContact CB-OD1 3.3Å; N58-N82 PolarHBondContact O-OD1 3.13Å; R59-N82 PolarHBondContact N-OD1 3.02Å; I60-N82 HydrophobicContact CB-CB 4.24Å; I60-N82 VanDerWaalsContact CB-OD1 3.27Å; I60-N82 WeakPolarHBondContact CB-OD1 3.27Å; I60-N82 WeakPolarHBondContact CG1-OD1 3.21Å; I60-N82 PolarHBondContact N-OD1 3.3Å; L79-N82 VanDerWaalsContact C-ND2 3.35Å; L79-N82 WeakPolarHBondContact O-CB 3.34Å; L79-N82 PolarHBondContact O-ND2 3.39Å; T80-N82 PolarHBondContact O-ND2 3.38Å; N82-F84 HydrophobicContact CB-CD2 4.31Å; N82-N107 VanDerWaalsContact CA-OD1 3.27Å; N82-N107 WeakPolarHBondContact CA-OD1 3.5Å; N82-N107 WeakPolarHBondContact CB-OD1 3.15Å; N82-N107 PolarHBondContact N-OD1 3.48Å; N82-N107 PolarHBondContact O-OD1 2.89Å
83	V	98.6	Very high	98.6	Very high	67 Å²	67	38.6 Å²	38.6	41%	0.406	21%	0.206	S	C	.	.			trans	-127.8	32.4	-172.9	-61.5	0	0	0	0	112.5	R59 I60 E85 N107	R59-V83 VanDerWaalsContact C-CG2 3.47Å; R59-V83 VanDerWaalsContact O-CG2 3.25Å; R59-V83 WeakPolarHBondContact O-CG2 3.25Å; I60-V83 CarbonylContact O-C 3.57Å; I60-V83 WeakPolarHBondContact O-CG2 3.41Å; I60-V83 PolarHBondContact O-N 2.86Å; V83-E85 PolarHBondContact O-N 2.83Å; V83-N107 PolarHBondContact N-OD1 3.4Å; V83-N107 VanDerWaalsContact N-OD1 3.17Å
84	F	98.7	Very high	98.5	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	21%	0.211	C	C	.	.			trans	-60.8	123.7	166.5	-76.5	-89.7	0	0	0	109.2	I60 L79 N82 D89 L90 L104 N107 P108 V109	I60-F84 HydrophobicContact CB-CE2 4.13Å; I60-F84 HydrophobicContact CG2-CE2 3.53Å; I60-F84 HydrophobicContact CG2-CZ 3.69Å; I60-F84 PolarHBondContact O-N 3.02Å; L79-F84 HydrophobicContact CD1-CE2 4.01Å; L79-F84 HydrophobicContact CD1-CZ 4.37Å; L79-F84 HydrophobicContact CD2-CE2 4.22Å; N82-F84 HydrophobicContact CB-CD2 4.31Å; F84-D89 HydrophobicContact CD1-CB 3.73Å; F84-D89 HydrophobicContact CE1-CB 4.35Å; F84-L90 HydrophobicContact CB-CD2 4.26Å; F84-L90 HydrophobicContact CD1-CD2 3.79Å; F84-L90 HydrophobicContact CE1-CD2 4.4Å; F84-L90 HydrophobicContact CG-CD2 4.12Å; F84-L104 HydrophobicContact CD2-CD2 4.39Å; F84-N107 HydrophobicContact CB-CB 4.24Å; F84-N107 WeakPolarHBondContact CD2-OD1 3.02Å; F84-N107 PolarHBondContact N-OD1 2.86Å; F84-N107 VanDerWaalsContact N-OD1 3.07Å; F84-P108 VanDerWaalsContact O-CD 3.28Å; F84-P108 WeakPolarHBondContact O-CD 3.5Å; F84-V109 HydrophobicContact CB-CG1 4.01Å; F84-V109 WeakPolarHBondContact O-CB 3.44Å; F84-V109 PolarHBondContact O-N 3.07Å
85	E	98.5	Very high	98.5	Very high	119 Å²	119	41.6 Å²	41.6	56%	0.556	23%	0.233	S	C	*	.			trans	-108.6	-54.2	-168.9	-171.7	168.1	-176.8	0	0	111.1	V83 D89 P108 V109 K112	V83-E85 PolarHBondContact O-N 2.83Å; E85-D89 PolarHBondContact N-OD2 2.8Å; E85-P108 HydrophobicContact CG-CB 4.49Å; E85-V109 VanDerWaalsContact O-CA 3.27Å; E85-V109 WeakPolarHBondContact O-CA 3.29Å; E85-V109 WeakPolarHBondContact O-CB 3.39Å; E85-K112 WeakPolarHBondContact O-CD 3.49Å; E85-K112 WeakPolarHBondContact O-CE 3.42Å
86	E	98.4	Very high	98.5	Very high	89 Å²	89	38 Å²	38	42%	0.416	22%	0.218	S	C	.	.	S	Bend	trans	-96	152.1	-174.2	-64.3	-58.2	145.3	0	0	113	G88 D89 K112	E86-G88 PolarHBondContact O-N 2.79Å; E86-D89 PolarHBondContact N-OD2 3.08Å; E86-D89 WeakPolarHBondContact O-CB 3.09Å; E86-D89 PolarHBondContact O-N 3.13Å; E86-D89 VanDerWaalsContact O-N 3.16Å; E86-K112 WeakPolarHBondContact OE1-CE 3.36Å; E86-K112 IonicContact OE1-NZ 2.59Å; E86-K112 PolarHBondContact OE1-NZ 3.02Å; E86-K112 WeakPolarHBondContact OE2-CE 3.35Å; E86-K112 IonicContact OE2-NZ 3.52Å; E86-K112 PolarHBondContact OE2-NZ 3.21Å
87	L	98.5	Very high	98.4	Very high	38 Å²	38	40.6 Å²	40.6	20%	0.199	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-60.4	-37.7	175.9	-66.2	176.3	0	0	0	111.2	D89 L90 V109 K112 Y115 F118	L87-D89 PolarHBondContact O-N 3.41Å; L87-L90 WeakPolarHBondContact O-CB 3.29Å; L87-L90 PolarHBondContact O-N 3.1Å; L87-L90 VanDerWaalsContact O-N 3.1Å; L87-V109 HydrophobicContact CD2-CG2 3.83Å; L87-K112 HydrophobicContact CD2-CB 4.34Å; L87-K112 HydrophobicContact CG-CB 4.48Å; L87-K112 HydrophobicContact CG-CD 4.24Å; L87-Y115 HydrophobicContact CD2-CD2 4.24Å; L87-F118 HydrophobicContact CB-CD1 3.94Å; L87-F118 HydrophobicContact CB-CD2 4.07Å; L87-F118 HydrophobicContact CB-CE1 3.9Å; L87-F118 HydrophobicContact CB-CE2 4.01Å; L87-F118 HydrophobicContact CB-CG 4.03Å; L87-F118 HydrophobicContact CB-CZ 3.93Å; L87-F118 HydrophobicContact CD1-CB 4.22Å; L87-F118 HydrophobicContact CD1-CD2 4.06Å; L87-F118 HydrophobicContact CD1-CG 4.09Å; L87-F118 HydrophobicContact CD2-CB 4.09Å; L87-F118 HydrophobicContact CD2-CD1 4.05Å; L87-F118 HydrophobicContact CD2-CG 4.05Å; L87-F118 HydrophobicContact CG-CD1 4.45Å; L87-F118 HydrophobicContact CG-CG 4.28Å; L87-F118 WeakPolarHBondContact O-CE1 3.46Å; L87-F118 WeakPolarHBondContact O-CZ 3.08Å
88	G	97.7	Very high	98.4	Very high	35 Å²	35	45.1 Å²	45.1	36%	0.361	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-60.7	-28	177.2	0	0	0	0	0	113.8	E86 L90 E91	E86-G88 PolarHBondContact O-N 2.79Å; G88-L90 PolarHBondContact O-N 3.07Å; G88-E91 WeakPolarHBondContact O-CB 3.41Å; G88-E91 WeakPolarHBondContact O-CG 3.22Å; G88-E91 PolarHBondContact O-N 3.04Å; G88-E91 VanDerWaalsContact O-N 3.11Å
89	D	98.1	Very high	98.4	Very high	54 Å²	54	44.6 Å²	44.6	29%	0.289	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-63.1	-18.1	177.6	-56.6	-28.9	0	0	0	112.3	F84 E85 E86 L87	F84-D89 HydrophobicContact CD1-CB 3.73Å; F84-D89 HydrophobicContact CE1-CB 4.35Å; E85-D89 PolarHBondContact N-OD2 2.8Å; E86-D89 PolarHBondContact N-OD2 3.08Å; E86-D89 WeakPolarHBondContact O-CB 3.09Å; E86-D89 PolarHBondContact O-N 3.13Å; E86-D89 VanDerWaalsContact O-N 3.16Å; L87-D89 PolarHBondContact O-N 3.41Å
90	L	98.6	Very high	98.4	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-92.9	-9.8	-178.2	-53	-177.5	0	0	0	113.3	F84 L87 G88 P92 L93 L104 V109 Y115 F118 V119	F84-L90 HydrophobicContact CB-CD2 4.26Å; F84-L90 HydrophobicContact CD1-CD2 3.79Å; F84-L90 HydrophobicContact CE1-CD2 4.4Å; F84-L90 HydrophobicContact CG-CD2 4.12Å; L87-L90 WeakPolarHBondContact O-CB 3.29Å; L87-L90 PolarHBondContact O-N 3.1Å; L87-L90 VanDerWaalsContact O-N 3.1Å; G88-L90 PolarHBondContact O-N 3.07Å; L90-P92 VanDerWaalsContact C-N 3.34Å; L90-L93 HydrophobicContact CB-CD1 4.06Å; L90-L93 HydrophobicContact CD2-CD1 4.11Å; L90-L93 VanDerWaalsContact O-CB 3.22Å; L90-L93 WeakPolarHBondContact O-CB 3.22Å; L90-L93 WeakPolarHBondContact O-CG 3.49Å; L90-L93 PolarHBondContact O-N 3.29Å; L90-L104 HydrophobicContact CD1-CD1 3.84Å; L90-L104 HydrophobicContact CD2-CD1 3.92Å; L90-L104 HydrophobicContact CD2-CD2 3.83Å; L90-V109 HydrophobicContact CD1-CG1 4.21Å; L90-V109 HydrophobicContact CD1-CG2 3.86Å; L90-V109 HydrophobicContact CD2-CG1 4.5Å; L90-V109 HydrophobicContact CG-CG2 4.39Å; L90-Y115 HydrophobicContact CD1-CD2 4.35Å; L90-Y115 HydrophobicContact CD1-CE2 3.93Å; L90-F118 HydrophobicContact CB-CE1 4.38Å; L90-V119 HydrophobicContact CD1-CG2 3.7Å
91	E	98.1	Very high	98.4	Very high	115 Å²	115	51.3 Å²	51.3	54%	0.537	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-54.8	-39.8	179.8	-70.3	178.2	178.3	0	0	114	G88 L93 A94 F118 T122	G88-E91 WeakPolarHBondContact O-CB 3.41Å; G88-E91 WeakPolarHBondContact O-CG 3.22Å; G88-E91 PolarHBondContact O-N 3.04Å; G88-E91 VanDerWaalsContact O-N 3.11Å; E91-L93 PolarHBondContact O-N 3.01Å; E91-A94 VanDerWaalsContact O-CB 3.25Å; E91-A94 WeakPolarHBondContact O-CB 3.42Å; E91-A94 PolarHBondContact O-N 3.43Å; E91-F118 HydrophobicContact CG-CZ 4.26Å; E91-T122 HydrophobicContact CG-CG2 4.39Å
92	P	98.5	Very high	98.4	Very high	24 Å²	24	48 Å²	48	16%	0.156	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-59.1	-21	177.7	-26.7	37.1	0	0	0	114.3	L63 P65 L90 A94 S95	L63-P92 HydrophobicContact CB-CB 4.27Å; L63-P92 HydrophobicContact CD2-CB 4.03Å; L63-P92 HydrophobicContact CG-CB 3.97Å; P65-P92 HydrophobicContact CG-CB 4.32Å; P65-P92 HydrophobicContact CG-CG 4.19Å; L90-P92 VanDerWaalsContact C-N 3.34Å; P92-A94 PolarHBondContact O-N 2.84Å; P92-S95 WeakPolarHBondContact O-CB 3.37Å; P92-S95 PolarHBondContact O-N 3.11Å
93	L	98.6	Very high	98.4	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-64.1	-26.1	176.7	-63.9	170.8	0	0	0	112.4	L63 L77 L90 E91 S95 F96 L99 L102 V123	L63-L93 HydrophobicContact CD2-CD2 3.52Å; L63-L93 HydrophobicContact CD2-CG 4.09Å; L77-L93 HydrophobicContact CD2-CD2 3.55Å; L90-L93 HydrophobicContact CB-CD1 4.06Å; L90-L93 HydrophobicContact CD2-CD1 4.11Å; L90-L93 VanDerWaalsContact O-CB 3.22Å; L90-L93 WeakPolarHBondContact O-CB 3.22Å; L90-L93 WeakPolarHBondContact O-CG 3.49Å; L90-L93 PolarHBondContact O-N 3.29Å; E91-L93 PolarHBondContact O-N 3.01Å; L93-S95 PolarHBondContact O-N 2.85Å; L93-F96 PolarHBondContact O-N 3.41Å; L93-L99 HydrophobicContact CB-CD2 4.48Å; L93-L99 HydrophobicContact CD2-CD2 4.34Å; L93-L102 HydrophobicContact CD1-CD1 4.32Å; L93-L102 HydrophobicContact CD1-CD2 3.85Å; L93-V123 HydrophobicContact CB-CG1 4.29Å; L93-V123 HydrophobicContact CB-CG2 3.76Å
94	A	98.1	Very high	98.4	Very high	40 Å²	40	44.7 Å²	44.7	33%	0.331	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-59.4	-28.1	177.4	0	0	0	0	0	112.4	E91 P92 F96 T122 Q125	E91-A94 VanDerWaalsContact O-CB 3.25Å; E91-A94 WeakPolarHBondContact O-CB 3.42Å; E91-A94 PolarHBondContact O-N 3.43Å; P92-A94 PolarHBondContact O-N 2.84Å; A94-F96 VanDerWaalsContact C-N 3.33Å; A94-F96 PolarHBondContact O-N 2.92Å; A94-T122 HydrophobicContact CB-CG2 4.38Å; A94-T122 WeakPolarHBondContact CB-O 3.4Å; A94-Q125 PolarHBondContact O-NE2 2.9Å
95	S	98	Very high	98.4	Very high	68 Å²	68	48.6 Å²	48.6	48%	0.476	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-75.6	-15.7	-175.8	-58.5	0	0	0	0	114.1	A68 P92 L93 P97	A68-S95 VanDerWaalsContact CB-CB 3.46Å; A68-S95 WeakPolarHBondContact CB-O 3.2Å; P92-S95 WeakPolarHBondContact O-CB 3.37Å; P92-S95 PolarHBondContact O-N 3.11Å; L93-S95 PolarHBondContact O-N 2.85Å; S95-P97 VanDerWaalsContact O-CD 3.22Å; S95-P97 WeakPolarHBondContact O-CD 3.26Å
96	F	98.5	Very high	98.4	Very high	3 Å²	3	45 Å²	45	1%	0.013	25%	0.254	C	S	.	.			trans	-78.7	107.9	-179.3	-70.7	-92.1	0	0	0	111.1	L63 V67 A68 L71 L74 L93 A94 K98 L99 Q125	L63-F96 HydrophobicContact CD1-CE2 4.4Å; L63-F96 HydrophobicContact CD1-CZ 4.18Å; L63-F96 HydrophobicContact CD2-CE2 3.54Å; L63-F96 HydrophobicContact CD2-CZ 4.11Å; L63-F96 HydrophobicContact CG-CE2 4.37Å; V67-F96 HydrophobicContact CB-CZ 4.27Å; V67-F96 HydrophobicContact CG1-CE1 4.14Å; V67-F96 HydrophobicContact CG1-CZ 3.88Å; A68-F96 HydrophobicContact CB-CD1 4.12Å; A68-F96 HydrophobicContact CB-CD2 4.08Å; A68-F96 HydrophobicContact CB-CE1 4.17Å; A68-F96 HydrophobicContact CB-CE2 4.1Å; A68-F96 HydrophobicContact CB-CG 4.09Å; A68-F96 HydrophobicContact CB-CZ 4.16Å; L71-F96 HydrophobicContact CB-CE1 4.23Å; L71-F96 HydrophobicContact CD1-CE1 4.33Å; L74-F96 HydrophobicContact CB-CD1 4.14Å; L74-F96 HydrophobicContact CD2-CD1 3.64Å; L74-F96 HydrophobicContact CD2-CE1 3.6Å; L74-F96 HydrophobicContact CD2-CZ 4.47Å; L74-F96 HydrophobicContact CG-CD1 4.5Å; L93-F96 PolarHBondContact O-N 3.41Å; A94-F96 VanDerWaalsContact C-N 3.33Å; A94-F96 PolarHBondContact O-N 2.92Å; F96-K98 PolarHBondContact O-N 3.33Å; F96-K98 VanDerWaalsContact O-N 3.1Å; F96-L99 HydrophobicContact CB-CB 3.74Å; F96-L99 HydrophobicContact CB-CD2 4.38Å; F96-L99 PolarHBondContact O-N 3.45Å; F96-Q125 PolarHBondContact O-NE2 3.4Å
97	P	97.3	Very high	98.4	Very high	84 Å²	84	40.8 Å²	40.8	55%	0.545	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-19.2	-165.4	27.9	-36.4	0	0	0	114.2	S95	S95-P97 VanDerWaalsContact O-CD 3.22Å; S95-P97 WeakPolarHBondContact O-CD 3.26Å
98	K	98.6	Very high	98.5	Very high	96 Å²	96	41.7 Å²	41.7	42%	0.417	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	10.8	-175.4	-59.6	-165.7	-172.7	175.4	0	114	N73 L74 K75 F96 E100	N73-K98 WeakPolarHBondContact OD1-CE 3.42Å; N73-K98 PolarHBondContact OD1-NZ 2.88Å; L74-K98 CarbonylContact O-C 3.53Å; K75-K98 WeakPolarHBondContact CA-O 3.34Å; K75-K98 HydrophobicContact CG-CB 4.42Å; F96-K98 PolarHBondContact O-N 3.33Å; F96-K98 VanDerWaalsContact O-N 3.1Å; K98-E100 PolarHBondContact O-N 3.15Å
99	L	98.8	Very high	98.5	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.225	C	C	.	.			trans	-66.1	117.1	-178.1	-175.1	65.1	0	0	0	110.6	L74 L77 L93 F96 V123 Q125 V126	L74-L99 PolarHBondContact O-N 2.82Å; L77-L99 HydrophobicContact CB-CD1 3.7Å; L93-L99 HydrophobicContact CB-CD2 4.48Å; L93-L99 HydrophobicContact CD2-CD2 4.34Å; F96-L99 HydrophobicContact CB-CB 3.74Å; F96-L99 HydrophobicContact CB-CD2 4.38Å; F96-L99 PolarHBondContact O-N 3.45Å; L99-V123 HydrophobicContact CD2-CG1 4.27Å; L99-Q125 HydrophobicContact CB-CG 4.25Å; L99-Q125 CarbonylContact O-C 3.59Å; L99-Q125 WeakPolarHBondContact O-CG 3.46Å; L99-V126 HydrophobicContact CD2-CG2 4.2Å; L99-V126 HydrophobicContact CG-CG2 4.17Å; L99-V126 PolarHBondContact O-N 3.48Å
100	E	98.7	Very high	98.5	Very high	54 Å²	54	39.1 Å²	39.1	25%	0.252	22%	0.222	S	C	.	.			trans	-116.6	-35	-176.1	-73.8	172.3	-148.7	0	0	111.9	K75 K98 R127 V128	K75-E100 IonicContact NZ-OE1 3.07Å; K75-E100 PolarHBondContact NZ-OE1 2.75Å; K75-E100 PolarHBondContact O-N 3.14Å; K98-E100 PolarHBondContact O-N 3.15Å; E100-R127 HydrophobicContact CB-CG 4.41Å; E100-R127 HydrophobicContact CG-CG 4.36Å; E100-R127 PolarHBondContact O-N 3.32Å; E100-V128 PolarHBondContact O-N 3.39Å
101	Y	98.9	Very high	98.5	Very high	106 Å²	106	46.9 Å²	46.9	42%	0.416	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.2	-175.4	-53.7	-92.5	0	0	0	109.8	K75 T76 L77 V128	K75-Y101 PolarHBondContact O-N 2.92Å; T76-Y101 WeakPolarHBondContact CA-O 3.33Å; L77-Y101 PolarHBondContact N-O 3.02Å; Y101-V128 HydrophobicContact CD1-CB 3.75Å; Y101-V128 HydrophobicContact CD1-CG1 4.46Å; Y101-V128 HydrophobicContact CD1-CG2 3.78Å; Y101-V128 HydrophobicContact CE1-CB 4.26Å; Y101-V128 HydrophobicContact CE1-CG2 3.75Å
102	L	98.8	Very high	98.5	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.4	-178.9	178.1	60.9	0	0	0	109.8	L77 L79 L93 L104 V119 V126 V128 L129 D130	L77-L102 HydrophobicContact CB-CD1 4.34Å; L77-L102 HydrophobicContact CD2-CD1 4.43Å; L77-L102 HydrophobicContact CG-CD1 4.44Å; L77-L102 WeakPolarHBondContact O-CA 3.23Å; L79-L102 HydrophobicContact CD1-CD1 4.27Å; L93-L102 HydrophobicContact CD1-CD1 4.32Å; L93-L102 HydrophobicContact CD1-CD2 3.85Å; L102-L104 HydrophobicContact CD1-CD1 4.47Å; L102-L104 HydrophobicContact CD1-CG 4.21Å; L102-L104 HydrophobicContact CD2-CD1 3.93Å; L102-L104 HydrophobicContact CG-CD1 4.2Å; L102-L104 HydrophobicContact CG-CG 4.26Å; L102-V119 HydrophobicContact CD2-CG1 3.89Å; L102-V126 HydrophobicContact CB-CG1 4.15Å; L102-V126 HydrophobicContact CB-CG2 4.14Å; L102-V126 HydrophobicContact CD2-CG2 4.28Å; L102-V128 PolarHBondContact N-O 3.11Å; L102-L129 HydrophobicContact CB-CD1 4.12Å; L102-L129 HydrophobicContact CD2-CD1 3.92Å; L102-L129 HydrophobicContact CG-CD1 3.92Å; L102-L129 CarbonylContact O-C 3.42Å; L102-L129 WeakPolarHBondContact O-CA 3.21Å; L102-D130 PolarHBondContact O-N 2.59Å
103	S	98.8	Very high	98.5	Very high	4 Å²	4	48.4 Å²	48.4	3%	0.028	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	121.8	169	-178.6	0	0	0	0	109.4	L77 L79 T80	L77-S103 PolarHBondContact O-N 3.42Å; L77-S103 VanDerWaalsContact O-N 3.12Å; L79-S103 CarbonylContact C-O 3.53Å; L79-S103 WeakPolarHBondContact CA-O 3.35Å; L79-S103 WeakPolarHBondContact CB-O 3.46Å; L79-S103 PolarHBondContact N-O 3.46Å; T80-S103 PolarHBondContact OG1-OG 3.04Å
104	L	98.8	Very high	98.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.303	C	S	.	.			trans	-117.7	6.9	173	-73.6	159.4	0	0	0	110.8	L79 F84 L90 L102 G106 N107 T110 Y115 V119 D130	L79-L104 HydrophobicContact CB-CD2 4.03Å; L79-L104 HydrophobicContact CD1-CD2 3.73Å; F84-L104 HydrophobicContact CD2-CD2 4.39Å; L90-L104 HydrophobicContact CD1-CD1 3.84Å; L90-L104 HydrophobicContact CD2-CD1 3.92Å; L90-L104 HydrophobicContact CD2-CD2 3.83Å; L102-L104 HydrophobicContact CD1-CD1 4.47Å; L102-L104 HydrophobicContact CD1-CG 4.21Å; L102-L104 HydrophobicContact CD2-CD1 3.93Å; L102-L104 HydrophobicContact CG-CD1 4.2Å; L102-L104 HydrophobicContact CG-CG 4.26Å; L104-G106 PolarHBondContact O-N 3.49Å; L104-N107 VanDerWaalsContact O-CB 3.29Å; L104-N107 WeakPolarHBondContact O-CB 3.35Å; L104-N107 PolarHBondContact O-N 2.62Å; L104-N107 VanDerWaalsContact O-N 3.08Å; L104-N107 PolarHBondContact O-ND2 2.84Å; L104-T110 HydrophobicContact CB-CG2 4.2Å; L104-T110 WeakPolarHBondContact O-CG2 3.15Å; L104-Y115 VanDerWaalsContact CB-OH 3.3Å; L104-Y115 WeakPolarHBondContact CB-OH 3.28Å; L104-Y115 HydrophobicContact CD1-CE2 3.97Å; L104-Y115 VanDerWaalsContact CD1-OH 3.27Å; L104-Y115 WeakPolarHBondContact CD1-OH 3.36Å; L104-V119 HydrophobicContact CD1-CG2 4.38Å; L104-D130 PolarHBondContact N-OD1 3.09Å
105	M	98.7	Very high	98.4	Very high	83 Å²	83	53.2 Å²	53.2	41%	0.409	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.4	135.4	176.1	-67.9	-174.2	64.5	0	0	112.5	T80 N81 N107 D130 Y131	T80-M105 CarbonylContact C-O 3.22Å; T80-M105 WeakPolarHBondContact CA-O 3.29Å; T80-M105 HydrophobicContact CG2-CB 4.23Å; N81-M105 PolarHBondContact N-O 3.45Å; M105-N107 VanDerWaalsContact C-N 3.27Å; M105-N107 PolarHBondContact O-N 2.88Å; M105-D130 HydrophobicContact CG-CB 3.63Å; M105-D130 WeakPolarHBondContact CG-OD1 3.2Å; M105-D130 PolarHBondContact N-OD1 3.45Å; M105-D130 VanDerWaalsContact N-OD1 3.1Å; M105-D130 HydrophobicContact SD-CB 4.24Å; M105-Y131 HydrophobicContact SD-CD2 3.49Å; M105-Y131 WeakPolarHBondContact SD-CD2 2.77Å; M105-Y131 HydrophobicContact SD-CE2 3.73Å
106	G	98.7	Very high	98.4	Very high	44 Å²	44	53.7 Å²	53.7	45%	0.454	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	7.2	179.1	0	0	0	0	0	115.1	L104	L104-G106 PolarHBondContact O-N 3.49Å
107	N	98.9	Very high	98.3	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.305	C	S	.	.	S	Bend	trans	-89.7	145.5	166.5	-71.9	-99.2	0	0	0	110.8	L79 N82 V83 F84 L104 M105 V109 T110	L79-N107 PolarHBondContact O-ND2 2.71Å; N82-N107 VanDerWaalsContact CA-OD1 3.27Å; N82-N107 WeakPolarHBondContact CA-OD1 3.5Å; N82-N107 WeakPolarHBondContact CB-OD1 3.15Å; N82-N107 PolarHBondContact N-OD1 3.48Å; N82-N107 PolarHBondContact O-OD1 2.89Å; V83-N107 PolarHBondContact N-OD1 3.4Å; V83-N107 VanDerWaalsContact N-OD1 3.17Å; F84-N107 HydrophobicContact CB-CB 4.24Å; F84-N107 WeakPolarHBondContact CD2-OD1 3.02Å; F84-N107 PolarHBondContact N-OD1 2.86Å; F84-N107 VanDerWaalsContact N-OD1 3.07Å; L104-N107 VanDerWaalsContact O-CB 3.29Å; L104-N107 WeakPolarHBondContact O-CB 3.35Å; L104-N107 PolarHBondContact O-N 2.62Å; L104-N107 VanDerWaalsContact O-N 3.08Å; L104-N107 PolarHBondContact O-ND2 2.84Å; M105-N107 VanDerWaalsContact C-N 3.27Å; M105-N107 PolarHBondContact O-N 2.88Å; N107-V109 HydrophobicContact CB-CG1 3.92Å; N107-V109 PolarHBondContact O-N 3.48Å; N107-T110 HydrophobicContact CB-CG2 4.43Å; N107-T110 WeakPolarHBondContact O-CB 3.35Å; N107-T110 WeakPolarHBondContact O-CG2 3.43Å; N107-T110 PolarHBondContact O-N 3.23Å; N107-T110 PolarHBondContact O-OG1 3.23Å
108	P	98.7	Very high	98.3	Very high	56 Å²	56	56.4 Å²	56.4	36%	0.364	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-52	-37.8	176.1	-26.7	32.6	0	0	0	114.2	F84 E85 T110 H111	F84-P108 VanDerWaalsContact O-CD 3.28Å; F84-P108 WeakPolarHBondContact O-CD 3.5Å; E85-P108 HydrophobicContact CG-CB 4.49Å; P108-T110 PolarHBondContact O-N 3.21Å; P108-H111 PolarHBondContact O-N 3.05Å
109	V	98.7	Very high	98.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-55.2	-27.5	178.4	71.1	0	0	0	0	113.4	F84 E85 L87 L90 N107 H111 K112 Y115	F84-V109 HydrophobicContact CB-CG1 4.01Å; F84-V109 WeakPolarHBondContact O-CB 3.44Å; F84-V109 PolarHBondContact O-N 3.07Å; E85-V109 VanDerWaalsContact O-CA 3.27Å; E85-V109 WeakPolarHBondContact O-CA 3.29Å; E85-V109 WeakPolarHBondContact O-CB 3.39Å; L87-V109 HydrophobicContact CD2-CG2 3.83Å; L90-V109 HydrophobicContact CD1-CG1 4.21Å; L90-V109 HydrophobicContact CD1-CG2 3.86Å; L90-V109 HydrophobicContact CD2-CG1 4.5Å; L90-V109 HydrophobicContact CG-CG2 4.39Å; N107-V109 HydrophobicContact CB-CG1 3.92Å; N107-V109 PolarHBondContact O-N 3.48Å; V109-H111 PolarHBondContact O-N 3.15Å; V109-K112 HydrophobicContact CG2-CD 4.48Å; V109-K112 WeakPolarHBondContact O-CB 3.03Å; V109-K112 PolarHBondContact O-N 3.17Å; V109-Y115 HydrophobicContact CG1-CD2 4.43Å; V109-Y115 HydrophobicContact CG1-CE2 4.21Å; V109-Y115 HydrophobicContact CG2-CD2 4.15Å
110	T	98.7	Very high	98.2	Very high	35 Å²	35	53.3 Å²	53.3	22%	0.215	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-66.7	-17.2	179.8	65.2	0	0	0	0	113.6	L104 N107 P108 Y115	L104-T110 HydrophobicContact CB-CG2 4.2Å; L104-T110 WeakPolarHBondContact O-CG2 3.15Å; N107-T110 HydrophobicContact CB-CG2 4.43Å; N107-T110 WeakPolarHBondContact O-CB 3.35Å; N107-T110 WeakPolarHBondContact O-CG2 3.43Å; N107-T110 PolarHBondContact O-N 3.23Å; N107-T110 PolarHBondContact O-OG1 3.23Å; P108-T110 PolarHBondContact O-N 3.21Å; T110-Y115 HydrophobicContact CG2-CE1 4.01Å; T110-Y115 HydrophobicContact CG2-CE2 4.37Å
111	H	98.4	Very high	98.1	Very high	164 Å²	164	59.1 Å²	59.1	76%	0.759	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-89.9	-7	175.8	-60.5	-62.1	0	0	0	113.4	P108 V109	P108-H111 PolarHBondContact O-N 3.05Å; V109-H111 PolarHBondContact O-N 3.15Å
112	K	98.5	Very high	98.1	Very high	62 Å²	62	55.5 Å²	55.5	27%	0.27	29%	0.29	S	S	.	.	S	Bend	trans	-71.9	144.6	-179.3	-72.5	-171.7	178.2	-99.8	0	111.6	E85 E86 L87 V109 L114 Y115	E85-K112 WeakPolarHBondContact O-CD 3.49Å; E85-K112 WeakPolarHBondContact O-CE 3.42Å; E86-K112 WeakPolarHBondContact OE1-CE 3.36Å; E86-K112 IonicContact OE1-NZ 2.59Å; E86-K112 PolarHBondContact OE1-NZ 3.02Å; E86-K112 WeakPolarHBondContact OE2-CE 3.35Å; E86-K112 IonicContact OE2-NZ 3.52Å; E86-K112 PolarHBondContact OE2-NZ 3.21Å; L87-K112 HydrophobicContact CD2-CB 4.34Å; L87-K112 HydrophobicContact CG-CB 4.48Å; L87-K112 HydrophobicContact CG-CD 4.24Å; V109-K112 HydrophobicContact CG2-CD 4.48Å; V109-K112 WeakPolarHBondContact O-CB 3.03Å; V109-K112 PolarHBondContact O-N 3.17Å; K112-L114 PolarHBondContact O-N 3.43Å; K112-Y115 VanDerWaalsContact O-CB 3.29Å; K112-Y115 WeakPolarHBondContact O-CB 3.44Å; K112-Y115 PolarHBondContact O-N 3.03Å
113	P	97.8	Very high	98	Very high	110 Å²	110	55.3 Å²	55.3	71%	0.714	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	140	171.8	-25.3	34.2	0	0	0	111	Y115	P113-Y115 PolarHBondContact O-N 3.18Å
114	L	95.3	Very high	97.9	Very high	127 Å²	127	59.3 Å²	59.3	67%	0.665	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	8.6	177.6	-47.6	176.8	0	0	0	115.6	K112 R116 L117 F118	K112-L114 PolarHBondContact O-N 3.43Å; L114-R116 VanDerWaalsContact C-N 3.31Å; L114-R116 PolarHBondContact O-N 3.06Å; L114-R116 VanDerWaalsContact O-N 3.13Å; L114-L117 HydrophobicContact CB-CB 4.49Å; L114-L117 HydrophobicContact CD2-CD1 3.92Å; L114-L117 WeakPolarHBondContact O-CA 3.08Å; L114-L117 WeakPolarHBondContact O-CB 3.27Å; L114-L117 PolarHBondContact O-N 3.27Å; L114-F118 PolarHBondContact O-N 3.04Å
115	Y	98.2	Very high	97.8	Very high	15 Å²	15	61.2 Å²	61.2	6%	0.059	32%	0.324	C	S	.	.	H	α-helix	trans	-40.5	-55.2	-180	158.3	-106.9	0	0	0	113.6	L87 L90 L104 V109 T110 K112 P113 L117 F118 V119 D130	L87-Y115 HydrophobicContact CD2-CD2 4.24Å; L90-Y115 HydrophobicContact CD1-CD2 4.35Å; L90-Y115 HydrophobicContact CD1-CE2 3.93Å; L104-Y115 VanDerWaalsContact CB-OH 3.3Å; L104-Y115 WeakPolarHBondContact CB-OH 3.28Å; L104-Y115 HydrophobicContact CD1-CE2 3.97Å; L104-Y115 VanDerWaalsContact CD1-OH 3.27Å; L104-Y115 WeakPolarHBondContact CD1-OH 3.36Å; V109-Y115 HydrophobicContact CG1-CD2 4.43Å; V109-Y115 HydrophobicContact CG1-CE2 4.21Å; V109-Y115 HydrophobicContact CG2-CD2 4.15Å; T110-Y115 HydrophobicContact CG2-CE1 4.01Å; T110-Y115 HydrophobicContact CG2-CE2 4.37Å; K112-Y115 VanDerWaalsContact O-CB 3.29Å; K112-Y115 WeakPolarHBondContact O-CB 3.44Å; K112-Y115 PolarHBondContact O-N 3.03Å; P113-Y115 PolarHBondContact O-N 3.18Å; Y115-L117 VanDerWaalsContact C-N 3.34Å; Y115-L117 PolarHBondContact O-N 2.7Å; Y115-F118 PolarHBondContact O-N 3.06Å; Y115-V119 HydrophobicContact CD2-CG2 4.03Å; Y115-V119 HydrophobicContact CE2-CG2 3.53Å; Y115-V119 WeakPolarHBondContact O-CG2 3.27Å; Y115-V119 PolarHBondContact O-N 3.18Å; Y115-D130 WeakPolarHBondContact CE1-OD2 3.41Å; Y115-D130 PolarHBondContact OH-OD2 3.19Å; Y115-D130 VanDerWaalsContact OH-OD2 3.13Å
116	R	97.7	Very high	97.8	Very high	78 Å²	78	57.5 Å²	57.5	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-40.7	-179.1	179	169.7	-171.2	85.1	-0.5	112.6	L114 I120 L129 K132 R133	L114-R116 VanDerWaalsContact C-N 3.31Å; L114-R116 PolarHBondContact O-N 3.06Å; L114-R116 VanDerWaalsContact O-N 3.13Å; R116-I120 HydrophobicContact CG-CD1 3.74Å; R116-I120 WeakPolarHBondContact O-CB 3.27Å; R116-I120 WeakPolarHBondContact O-CD1 3.48Å; R116-I120 WeakPolarHBondContact O-CG1 3.29Å; R116-I120 PolarHBondContact O-N 3.16Å; R116-I120 VanDerWaalsContact O-N 3.11Å; R116-L129 HydrophobicContact CG-CD2 4.16Å; R116-L129 PolarHBondContact NH1-O 3.13Å; R116-K132 PolarHBondContact NH2-O 3.1Å; R116-R133 PolarHBondContact NH2-O 2.68Å; R116-R133 VanDerWaalsContact NH2-O 3.16Å
117	L	96.7	Very high	97.7	Very high	97 Å²	97	62.7 Å²	62.7	51%	0.508	31%	0.312	S	S	.	.	H	α-helix	trans	-68.5	-41.8	179.4	-72.3	170.4	0	0	0	111	L114 Y115 I120 F121	L114-L117 HydrophobicContact CB-CB 4.49Å; L114-L117 HydrophobicContact CD2-CD1 3.92Å; L114-L117 WeakPolarHBondContact O-CA 3.08Å; L114-L117 WeakPolarHBondContact O-CB 3.27Å; L114-L117 PolarHBondContact O-N 3.27Å; Y115-L117 VanDerWaalsContact C-N 3.34Å; Y115-L117 PolarHBondContact O-N 2.7Å; L117-I120 PolarHBondContact O-N 3.11Å; L117-F121 WeakPolarHBondContact O-CB 3.45Å; L117-F121 PolarHBondContact O-N 3.17Å
118	F	97.9	Very high	97.7	Very high	48 Å²	48	64.3 Å²	64.3	21%	0.211	32%	0.321	C	S	.	.	H	α-helix	trans	-56.9	-52.2	174.7	-179.6	-87.3	0	0	0	110.9	L87 L90 E91 L114 Y115 I120 F121 T122	L87-F118 HydrophobicContact CB-CD1 3.94Å; L87-F118 HydrophobicContact CB-CD2 4.07Å; L87-F118 HydrophobicContact CB-CE1 3.9Å; L87-F118 HydrophobicContact CB-CE2 4.01Å; L87-F118 HydrophobicContact CB-CG 4.03Å; L87-F118 HydrophobicContact CB-CZ 3.93Å; L87-F118 HydrophobicContact CD1-CB 4.22Å; L87-F118 HydrophobicContact CD1-CD2 4.06Å; L87-F118 HydrophobicContact CD1-CG 4.09Å; L87-F118 HydrophobicContact CD2-CB 4.09Å; L87-F118 HydrophobicContact CD2-CD1 4.05Å; L87-F118 HydrophobicContact CD2-CG 4.05Å; L87-F118 HydrophobicContact CG-CD1 4.45Å; L87-F118 HydrophobicContact CG-CG 4.28Å; L87-F118 WeakPolarHBondContact O-CE1 3.46Å; L87-F118 WeakPolarHBondContact O-CZ 3.08Å; L90-F118 HydrophobicContact CB-CE1 4.38Å; E91-F118 HydrophobicContact CG-CZ 4.26Å; L114-F118 PolarHBondContact O-N 3.04Å; Y115-F118 PolarHBondContact O-N 3.06Å; F118-I120 VanDerWaalsContact C-N 3.35Å; F118-I120 PolarHBondContact O-N 3.05Å; F118-F121 PolarHBondContact O-N 3.23Å; F118-T122 HydrophobicContact CE1-CG2 4.29Å; F118-T122 HydrophobicContact CZ-CG2 4.39Å; F118-T122 WeakPolarHBondContact O-CB 3.36Å; F118-T122 PolarHBondContact O-N 3.07Å; F118-T122 PolarHBondContact O-OG1 2.95Å
119	V	98.2	Very high	97.7	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-42.2	-179.7	177.2	0	0	0	0	111.9	L90 L102 L104 Y115 F121 V123 L129	L90-V119 HydrophobicContact CD1-CG2 3.7Å; L102-V119 HydrophobicContact CD2-CG1 3.89Å; L104-V119 HydrophobicContact CD1-CG2 4.38Å; Y115-V119 HydrophobicContact CD2-CG2 4.03Å; Y115-V119 HydrophobicContact CE2-CG2 3.53Å; Y115-V119 WeakPolarHBondContact O-CG2 3.27Å; Y115-V119 PolarHBondContact O-N 3.18Å; V119-F121 VanDerWaalsContact C-N 3.31Å; V119-F121 PolarHBondContact O-N 3.49Å; V119-V123 HydrophobicContact CG1-CG2 4.45Å; V119-V123 WeakPolarHBondContact O-CA 3.39Å; V119-V123 WeakPolarHBondContact O-CB 3.35Å; V119-V123 PolarHBondContact O-N 2.91Å; V119-L129 HydrophobicContact CB-CD2 3.75Å; V119-L129 HydrophobicContact CG1-CD1 3.92Å; V119-L129 HydrophobicContact CG1-CD2 3.67Å; V119-L129 HydrophobicContact CG1-CG 4.41Å; V119-L129 HydrophobicContact CG2-CD2 4.42Å
120	I	97.2	Very high	97.7	Very high	30 Å²	30	62.7 Å²	62.7	15%	0.154	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-38.2	178.4	-70.4	166.7	0	0	0	111.5	R116 L117 F118 P124 V134 V137	R116-I120 HydrophobicContact CG-CD1 3.74Å; R116-I120 WeakPolarHBondContact O-CB 3.27Å; R116-I120 WeakPolarHBondContact O-CD1 3.48Å; R116-I120 WeakPolarHBondContact O-CG1 3.29Å; R116-I120 PolarHBondContact O-N 3.16Å; R116-I120 VanDerWaalsContact O-N 3.11Å; L117-I120 PolarHBondContact O-N 3.11Å; F118-I120 VanDerWaalsContact C-N 3.35Å; F118-I120 PolarHBondContact O-N 3.05Å; I120-P124 WeakPolarHBondContact O-CA 3.37Å; I120-V134 HydrophobicContact CD1-CG1 3.95Å; I120-V134 HydrophobicContact CD1-CG2 4.25Å; I120-V134 HydrophobicContact CG1-CG1 3.88Å; I120-V134 HydrophobicContact CG1-CG2 3.96Å; I120-V134 HydrophobicContact CG2-CG1 3.93Å; I120-V137 HydrophobicContact CG2-CG2 4.07Å
121	F	97	Very high	97.7	Very high	175 Å²	175	68.8 Å²	68.8	77%	0.768	33%	0.33	S	S	*	.	H	α-helix	trans	-73.4	-46.9	179	179.3	-97.4	0	0	0	112.1	L117 F118 V119	L117-F121 WeakPolarHBondContact O-CB 3.45Å; L117-F121 PolarHBondContact O-N 3.17Å; F118-F121 PolarHBondContact O-N 3.23Å; V119-F121 VanDerWaalsContact C-N 3.31Å; V119-F121 PolarHBondContact O-N 3.49Å
122	T	97.5	Very high	97.7	Very high	30 Å²	30	67.8 Å²	67.8	18%	0.184	32%	0.324	C	S	.	.	H	α-helix	trans	-76	-31.4	-175.6	-56	0	0	0	0	112.5	E91 A94 F118 P124	E91-T122 HydrophobicContact CG-CG2 4.39Å; A94-T122 HydrophobicContact CB-CG2 4.38Å; A94-T122 WeakPolarHBondContact CB-O 3.4Å; F118-T122 HydrophobicContact CE1-CG2 4.29Å; F118-T122 HydrophobicContact CZ-CG2 4.39Å; F118-T122 WeakPolarHBondContact O-CB 3.36Å; F118-T122 PolarHBondContact O-N 3.07Å; F118-T122 PolarHBondContact O-OG1 2.95Å; T122-P124 VanDerWaalsContact C-CD 3.42Å; T122-P124 WeakPolarHBondContact O-CD 3.42Å
123	V	97.4	Very high	97.6	Very high	1 Å²	1	74.4 Å²	74.4	1%	0.006	35%	0.347	C	S	.	.			trans	-123.4	65.6	-177.3	-160.3	0	0	0	0	110.3	L93 L99 V119 Q125 V126	L93-V123 HydrophobicContact CB-CG1 4.29Å; L93-V123 HydrophobicContact CB-CG2 3.76Å; L99-V123 HydrophobicContact CD2-CG1 4.27Å; V119-V123 HydrophobicContact CG1-CG2 4.45Å; V119-V123 WeakPolarHBondContact O-CA 3.39Å; V119-V123 WeakPolarHBondContact O-CB 3.35Å; V119-V123 PolarHBondContact O-N 2.91Å; V123-Q125 VanDerWaalsContact C-OE1 3.28Å; V123-Q125 HydrophobicContact CG1-CG 4.21Å; V123-Q125 PolarHBondContact O-N 3.35Å; V123-V126 HydrophobicContact CB-CG2 4.12Å; V123-V126 HydrophobicContact CG1-CG2 3.59Å; V123-V126 PolarHBondContact O-N 2.91Å; V123-V126 VanDerWaalsContact O-N 3.08Å
124	P	96.1	Very high	97.6	Very high	88 Å²	88	70.6 Å²	70.6	57%	0.571	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.7	-168.3	27.5	-37.4	0	0	0	115	I120 T122 V126	I120-P124 WeakPolarHBondContact O-CA 3.37Å; T122-P124 VanDerWaalsContact C-CD 3.42Å; T122-P124 WeakPolarHBondContact O-CD 3.42Å; P124-V126 VanDerWaalsContact C-N 3.32Å
125	Q	97	Very high	97.3	Very high	40 Å²	40	74.6 Å²	74.6	19%	0.187	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-22.4	175.6	60.1	-89.3	45.3	0	0	113.3	A94 F96 L99 V123 R127	A94-Q125 PolarHBondContact O-NE2 2.9Å; F96-Q125 PolarHBondContact O-NE2 3.4Å; L99-Q125 HydrophobicContact CB-CG 4.25Å; L99-Q125 CarbonylContact O-C 3.59Å; L99-Q125 WeakPolarHBondContact O-CG 3.46Å; V123-Q125 VanDerWaalsContact C-OE1 3.28Å; V123-Q125 HydrophobicContact CG1-CG 4.21Å; V123-Q125 PolarHBondContact O-N 3.35Å; Q125-R127 PolarHBondContact O-N 2.89Å
126	V	98.3	Very high	96	Very high	5 Å²	5	78.3 Å²	78.3	3%	0.03	36%	0.361	C	S	.	.			trans	-65.5	127.2	-179.2	171.6	0	0	0	0	110.7	L99 L102 V123 P124 V128 L129 V134	L99-V126 HydrophobicContact CD2-CG2 4.2Å; L99-V126 HydrophobicContact CG-CG2 4.17Å; L99-V126 PolarHBondContact O-N 3.48Å; L102-V126 HydrophobicContact CB-CG1 4.15Å; L102-V126 HydrophobicContact CB-CG2 4.14Å; L102-V126 HydrophobicContact CD2-CG2 4.28Å; V123-V126 HydrophobicContact CB-CG2 4.12Å; V123-V126 HydrophobicContact CG1-CG2 3.59Å; V123-V126 PolarHBondContact O-N 2.91Å; V123-V126 VanDerWaalsContact O-N 3.08Å; P124-V126 VanDerWaalsContact C-N 3.32Å; V126-V128 WeakPolarHBondContact CG1-O 3.25Å; V126-L129 HydrophobicContact CG1-CB 4.07Å; V126-V134 HydrophobicContact CG1-CG2 4.33Å
127	R	98.3	Very high	94.4	Very high	154 Å²	154	78.7 Å²	78.7	58%	0.581	37%	0.372	S	S	*	.	S	Bend	trans	-104.5	-27.8	-179.8	-56.1	-52.6	-172.9	178.1	0.3	112.7	E100 Q125 R133 V134	E100-R127 HydrophobicContact CB-CG 4.41Å; E100-R127 HydrophobicContact CG-CG 4.36Å; E100-R127 PolarHBondContact O-N 3.32Å; Q125-R127 PolarHBondContact O-N 2.89Å; R127-R133 WeakPolarHBondContact O-CA 3.25Å; R127-V134 PolarHBondContact O-N 2.68Å
128	V	98.6	Very high	92.4	Very high	34 Å²	34	79.8 Å²	79.8	21%	0.206	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	117.4	176.8	-177.2	0	0	0	0	108.1	E100 Y101 L102 V126	E100-V128 PolarHBondContact O-N 3.39Å; Y101-V128 HydrophobicContact CD1-CB 3.75Å; Y101-V128 HydrophobicContact CD1-CG1 4.46Å; Y101-V128 HydrophobicContact CD1-CG2 3.78Å; Y101-V128 HydrophobicContact CE1-CB 4.26Å; Y101-V128 HydrophobicContact CE1-CG2 3.75Å; L102-V128 PolarHBondContact N-O 3.11Å; V126-V128 WeakPolarHBondContact CG1-O 3.25Å
129	L	98.7	Very high	90.1	Very high	0 Å²	0	82.3 Å²	82.3	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.7	176.8	176.3	62.6	0	0	0	108.9	L102 R116 V119 V126 Y131 K132 V134	L102-L129 HydrophobicContact CB-CD1 4.12Å; L102-L129 HydrophobicContact CD2-CD1 3.92Å; L102-L129 HydrophobicContact CG-CD1 3.92Å; L102-L129 CarbonylContact O-C 3.42Å; L102-L129 WeakPolarHBondContact O-CA 3.21Å; R116-L129 HydrophobicContact CG-CD2 4.16Å; R116-L129 PolarHBondContact NH1-O 3.13Å; V119-L129 HydrophobicContact CB-CD2 3.75Å; V119-L129 HydrophobicContact CG1-CD1 3.92Å; V119-L129 HydrophobicContact CG1-CD2 3.67Å; V119-L129 HydrophobicContact CG1-CG 4.41Å; V119-L129 HydrophobicContact CG2-CD2 4.42Å; V126-L129 HydrophobicContact CG1-CB 4.07Å; L129-Y131 VanDerWaalsContact C-N 3.32Å; L129-Y131 PolarHBondContact O-N 3.1Å; L129-K132 PolarHBondContact N-O 3.28Å; L129-K132 WeakPolarHBondContact O-CB 3.39Å; L129-K132 PolarHBondContact O-N 3.13Å; L129-K132 VanDerWaalsContact O-O 3.05Å; L129-V134 HydrophobicContact CB-CG2 4.22Å
130	D	98.5	Very high	87.2	Confident	23 Å²	23	88.5 Å²	88.5	12%	0.123	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	49.2	-178	-56.4	-41.4	0	0	0	111.9	L102 L104 M105 Y115 K132	L102-D130 PolarHBondContact O-N 2.59Å; L104-D130 PolarHBondContact N-OD1 3.09Å; M105-D130 HydrophobicContact CG-CB 3.63Å; M105-D130 WeakPolarHBondContact CG-OD1 3.2Å; M105-D130 PolarHBondContact N-OD1 3.45Å; M105-D130 VanDerWaalsContact N-OD1 3.1Å; M105-D130 HydrophobicContact SD-CB 4.24Å; Y115-D130 WeakPolarHBondContact CE1-OD2 3.41Å; Y115-D130 PolarHBondContact OH-OD2 3.19Å; Y115-D130 VanDerWaalsContact OH-OD2 3.13Å; D130-K132 PolarHBondContact O-N 3.39Å
131	Y	97.9	Very high	84.5	Confident	163 Å²	163	98.4 Å²	98.4	64%	0.639	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	14.5	-176.3	-52.8	-83.1	0	0	0	114.8	M105 L129	M105-Y131 HydrophobicContact SD-CD2 3.49Å; M105-Y131 WeakPolarHBondContact SD-CD2 2.77Å; M105-Y131 HydrophobicContact SD-CE2 3.73Å; L129-Y131 VanDerWaalsContact C-N 3.32Å; L129-Y131 PolarHBondContact O-N 3.1Å
132	K	98	Very high	83.9	Confident	143 Å²	143	94.6 Å²	94.6	62%	0.622	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.2	175.8	-66.3	177.7	-176.5	175.4	0	110.3	R116 L129 D130 V134	R116-K132 PolarHBondContact NH2-O 3.1Å; L129-K132 PolarHBondContact N-O 3.28Å; L129-K132 WeakPolarHBondContact O-CB 3.39Å; L129-K132 PolarHBondContact O-N 3.13Å; L129-K132 VanDerWaalsContact O-O 3.05Å; D130-K132 PolarHBondContact O-N 3.39Å; K132-V134 PolarHBondContact O-N 3.35Å
133	R	97.9	Very high	83.1	Confident	200 Å²	200	97.9 Å²	97.9	76%	0.755	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.5	131.1	176.3	-171.7	172.6	-179.7	172.7	1	111	R116 R127 R135	R116-R133 PolarHBondContact NH2-O 2.68Å; R116-R133 VanDerWaalsContact NH2-O 3.16Å; R127-R133 WeakPolarHBondContact O-CA 3.25Å; R133-R135 PolarHBondContact O-N 2.81Å
134	V	96.8	Very high	82.3	Confident	30 Å²	30	103.3 Å²	103.3	18%	0.182	53%	0.525	C	S	.	.			trans	-72.1	112.4	167	177.8	0	0	0	0	106.7	I120 V126 R127 L129 K132	I120-V134 HydrophobicContact CD1-CG1 3.95Å; I120-V134 HydrophobicContact CD1-CG2 4.25Å; I120-V134 HydrophobicContact CG1-CG1 3.88Å; I120-V134 HydrophobicContact CG1-CG2 3.96Å; I120-V134 HydrophobicContact CG2-CG1 3.93Å; V126-V134 HydrophobicContact CG1-CG2 4.33Å; R127-V134 PolarHBondContact O-N 2.68Å; L129-V134 HydrophobicContact CB-CG2 4.22Å; K132-V134 PolarHBondContact O-N 3.35Å
135	R	88.6	Confident	81.5	Confident	212 Å²	212	104.2 Å²	104.2	80%	0.8	52%	0.522	S	S	*	.			trans	-85.8	147.1	170.5	-62.8	-176.8	-178.3	-173.5	-0.4	107.1	R133 V137	R133-R135 PolarHBondContact O-N 2.81Å; R135-V137 PolarHBondContact O-N 3.2Å
136	A	72.1	Confident	80.6	Confident	92 Å²	92	108.3 Å²	108.3	76%	0.76	54%	0.543	S	S	*	.			trans	-49.6	122.4	173.2	0	0	0	0	0	108.4	V138	A136-V138 PolarHBondContact O-N 3.16Å; A136-V138 VanDerWaalsContact O-N 3.11Å
137	V	63.8	Low	79.4	Confident	86 Å²	86	115.1 Å²	115.1	52%	0.521	58%	0.578	S	S	.	*			trans	-67.2	111.3	164.2	-175.9	0	0	0	0	103.2	I120 R135 S139	I120-V137 HydrophobicContact CG2-CG2 4.07Å; R135-V137 PolarHBondContact O-N 3.2Å; V137-S139 VanDerWaalsContact C-N 3.29Å; V137-S139 PolarHBondContact O-N 3.29Å
138	V	53.9	Low	78	Confident	120 Å²	120	112.4 Å²	112.4	73%	0.727	58%	0.577	S	S	*	*			trans	-60.9	106.1	167.2	-177.2	0	0	0	0	103.7	A136 V140	A136-V138 PolarHBondContact O-N 3.16Å; A136-V138 VanDerWaalsContact O-N 3.11Å; V138-V140 VanDerWaalsContact C-N 3.33Å; V138-V140 PolarHBondContact O-N 3Å
139	S	50.9	Low	76.5	Confident	101 Å²	101	118.4 Å²	118.4	71%	0.706	61%	0.606	S	S	*	*			trans	-56.9	104.1	172	-56.2	0	0	0	0	106.2	V137 L141	V137-S139 VanDerWaalsContact C-N 3.29Å; V137-S139 PolarHBondContact O-N 3.29Å; S139-L141 PolarHBondContact O-N 2.76Å
140	V	36.6	Very low	74.6	Confident	131 Å²	131	128.3 Å²	128.3	79%	0.794	66%	0.656	S	S	*	*			trans	-88.8	71.6	163.7	-171.3	0	0	0	0	105.3	V138	V138-V140 VanDerWaalsContact C-N 3.33Å; V138-V140 PolarHBondContact O-N 3Å
141	L	40.3	Very low	72.4	Confident	238 Å²	238	137.8 Å²	137.8	100%	1.246	71%	0.705	S	S	*	*			trans	-145.4	0	161.9	-71.6	-177.9	0	0	0	107.5	S139	S139-L141 PolarHBondContact O-N 2.76Å

Retrieved 141 of 141 residues in 366.3 ms (Link to these results)

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