A0A4W5KP14_9TELE Loading...

ARF like GTPase 8B

AlphaFold DB , UniProt , Accession A0A4W5KP14, Species 9TELE (Hucho hucho, huchen), Gene n/a, Length 183 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.3	Low	70.3	Confident	200 Å²	200	121 Å²	121	99%	0.985	60%	0.603	S	S	*	*				0	-55.2	0	-144	-179.1	-72.4	0	0	111.5	A3 L4 I5	M1-A3 PolarHBondContact O-N 3.32Å; M1-L4 PolarHBondContact O-N 3.16Å; M1-I5 HydrophobicContact CG-CD1 4.42Å; M1-I5 WeakPolarHBondContact O-CG1 3.41Å; M1-I5 PolarHBondContact O-N 3.2Å; M1-I5 VanDerWaalsContact O-N 3.16Å
2	L	62.3	Low	70	Confident	136 Å²	136	119.3 Å²	119.3	71%	0.712	59%	0.589	S	S	*	*	H	α-helix	trans	-57.4	-43.1	176.5	-78.4	152	0	0	0	114.9	L4 I5 N6	L2-L4 VanDerWaalsContact C-N 3.29Å; L2-L4 PolarHBondContact O-N 3.11Å; L2-I5 PolarHBondContact O-N 3.43Å; L2-N6 WeakPolarHBondContact O-CB 3.47Å; L2-N6 PolarHBondContact O-N 2.89Å
3	A	67	Low	69.6	Low	71 Å²	71	122.2 Å²	122.2	59%	0.587	59%	0.589	S	S	*	*	H	α-helix	trans	-65.1	-30.8	178.1	0	0	0	0	0	113.6	M1 R7	M1-A3 PolarHBondContact O-N 3.32Å; A3-R7 WeakPolarHBondContact O-CG 3.42Å; A3-R7 PolarHBondContact O-N 3.35Å; A3-R7 VanDerWaalsContact O-N 3.11Å
4	L	73	Confident	69.2	Low	129 Å²	129	116.6 Å²	116.6	68%	0.675	57%	0.569	S	S	*	*	H	α-helix	trans	-74.4	-41.7	178	-142.1	100.7	0	0	0	110.4	M1 L2 R7 L8	M1-L4 PolarHBondContact O-N 3.16Å; L2-L4 VanDerWaalsContact C-N 3.29Å; L2-L4 PolarHBondContact O-N 3.11Å; L4-R7 PolarHBondContact O-N 3.25Å; L4-L8 WeakPolarHBondContact O-CB 3.42Å; L4-L8 PolarHBondContact O-N 3.43Å
5	I	79.6	Confident	68.5	Low	87 Å²	87	115.2 Å²	115.2	45%	0.446	57%	0.565	S	S	.	*	H	α-helix	trans	-64.9	-42.1	176	-65.2	165.7	0	0	0	110.6	M1 L2 L8 L9	M1-I5 HydrophobicContact CG-CD1 4.42Å; M1-I5 WeakPolarHBondContact O-CG1 3.41Å; M1-I5 PolarHBondContact O-N 3.2Å; M1-I5 VanDerWaalsContact O-N 3.16Å; L2-I5 PolarHBondContact O-N 3.43Å; I5-L8 PolarHBondContact O-N 2.81Å; I5-L9 HydrophobicContact CG2-CD1 3.82Å; I5-L9 HydrophobicContact CG2-CG 4.4Å; I5-L9 WeakPolarHBondContact O-CB 3.42Å; I5-L9 WeakPolarHBondContact O-CG 3.32Å; I5-L9 PolarHBondContact O-N 2.83Å
6	N	74.4	Confident	67.8	Low	86 Å²	86	118 Å²	118	46%	0.46	57%	0.573	S	S	.	*	H	α-helix	trans	-63.5	-44.8	175.8	-73.8	-10	0	0	0	111.9	L2 L8 L9 D10	L2-N6 WeakPolarHBondContact O-CB 3.47Å; L2-N6 PolarHBondContact O-N 2.89Å; N6-L8 VanDerWaalsContact C-N 3.28Å; N6-L8 PolarHBondContact O-N 3.25Å; N6-L9 PolarHBondContact O-N 3.35Å; N6-D10 WeakPolarHBondContact O-CB 3.36Å; N6-D10 PolarHBondContact O-N 2.99Å
7	R	70.3	Confident	67.6	Low	197 Å²	197	122.2 Å²	122.2	74%	0.743	58%	0.582	S	S	*	*	H	α-helix	trans	-60.3	-38.2	173.8	-78.9	-177.7	177.7	-176.9	-0.4	112.7	A3 L4 W11	A3-R7 WeakPolarHBondContact O-CG 3.42Å; A3-R7 PolarHBondContact O-N 3.35Å; A3-R7 VanDerWaalsContact O-N 3.11Å; L4-R7 PolarHBondContact O-N 3.25Å; R7-W11 VanDerWaalsContact O-CB 3.32Å; R7-W11 WeakPolarHBondContact O-CB 3.44Å; R7-W11 PolarHBondContact O-N 3.47Å
8	L	75.2	Confident	67.7	Low	97 Å²	97	123.9 Å²	123.9	51%	0.508	59%	0.586	S	S	.	*	H	α-helix	trans	-70.8	-38.6	178.9	-144.1	123.3	0	0	0	111.3	L4 I5 N6 W11 F12	L4-L8 WeakPolarHBondContact O-CB 3.42Å; L4-L8 PolarHBondContact O-N 3.43Å; I5-L8 PolarHBondContact O-N 2.81Å; N6-L8 VanDerWaalsContact C-N 3.28Å; N6-L8 PolarHBondContact O-N 3.25Å; L8-W11 PolarHBondContact O-N 2.96Å; L8-F12 HydrophobicContact CD2-CD2 3.98Å; L8-F12 HydrophobicContact CD2-CE2 3.94Å; L8-F12 WeakPolarHBondContact O-CB 3.35Å; L8-F12 WeakPolarHBondContact O-CD2 3.38Å; L8-F12 PolarHBondContact O-N 2.76Å
9	L	76.1	Confident	68.4	Low	86 Å²	86	120.7 Å²	120.7	45%	0.45	57%	0.571	S	S	.	*	H	α-helix	trans	-67.7	-40	173.7	-78.2	166.8	0	0	0	112.4	I5 N6 W11 F12 R13	I5-L9 HydrophobicContact CG2-CD1 3.82Å; I5-L9 HydrophobicContact CG2-CG 4.4Å; I5-L9 WeakPolarHBondContact O-CB 3.42Å; I5-L9 WeakPolarHBondContact O-CG 3.32Å; I5-L9 PolarHBondContact O-N 2.83Å; N6-L9 PolarHBondContact O-N 3.35Å; L9-W11 VanDerWaalsContact C-N 3.34Å; L9-F12 PolarHBondContact O-N 3.46Å; L9-R13 WeakPolarHBondContact O-CB 3.29Å; L9-R13 VanDerWaalsContact O-CG 3.29Å; L9-R13 WeakPolarHBondContact O-CG 3.35Å; L9-R13 PolarHBondContact O-N 2.68Å
10	D	70	Confident	69.3	Low	94 Å²	94	120.4 Å²	120.4	50%	0.503	57%	0.569	S	S	.	*	H	α-helix	trans	-66	-39.3	175	-69.8	-26.7	0	0	0	111	N6 R13 S14	N6-D10 WeakPolarHBondContact O-CB 3.36Å; N6-D10 PolarHBondContact O-N 2.99Å; D10-R13 PolarHBondContact O-N 2.88Å; D10-S14 WeakPolarHBondContact O-CB 3.41Å; D10-S14 PolarHBondContact O-N 3.36Å
11	W	69.5	Low	70.3	Confident	148 Å²	148	114.6 Å²	114.6	56%	0.561	54%	0.542	S	S	*	.	H	α-helix	trans	-62.8	-47.8	172.1	180	76.2	0	0	0	111.6	R7 L8 L9 R13 S14 L15	R7-W11 VanDerWaalsContact O-CB 3.32Å; R7-W11 WeakPolarHBondContact O-CB 3.44Å; R7-W11 PolarHBondContact O-N 3.47Å; L8-W11 PolarHBondContact O-N 2.96Å; L9-W11 VanDerWaalsContact C-N 3.34Å; W11-R13 PolarHBondContact O-N 3.08Å; W11-S14 PolarHBondContact O-N 2.83Å; W11-S14 PolarHBondContact O-OG 3.48Å; W11-L15 HydrophobicContact CD2-CD1 3.84Å; W11-L15 HydrophobicContact CE3-CD1 3.8Å; W11-L15 HydrophobicContact CH2-CD1 3.61Å; W11-L15 HydrophobicContact CZ2-CD1 3.64Å; W11-L15 HydrophobicContact CZ3-CD1 3.68Å; W11-L15 PolarHBondContact O-N 3.42Å; W11-L15 VanDerWaalsContact O-N 3.08Å
12	F	67.1	Low	72.1	Confident	100 Å²	100	108.4 Å²	108.4	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-60.4	-43.1	174.4	-101	-83.3	0	0	0	112.2	L8 L9 S14 L15 F16	L8-F12 HydrophobicContact CD2-CD2 3.98Å; L8-F12 HydrophobicContact CD2-CE2 3.94Å; L8-F12 WeakPolarHBondContact O-CB 3.35Å; L8-F12 WeakPolarHBondContact O-CD2 3.38Å; L8-F12 PolarHBondContact O-N 2.76Å; L9-F12 PolarHBondContact O-N 3.46Å; F12-S14 VanDerWaalsContact C-N 3.34Å; F12-S14 PolarHBondContact O-N 3.18Å; F12-L15 WeakPolarHBondContact O-CB 3.12Å; F12-L15 PolarHBondContact O-N 2.85Å; F12-F16 HydrophobicContact CD1-CD2 4.44Å; F12-F16 AromaticContact CD1-CE2 3.92Å; F12-F16 HydrophobicContact CD1-CE2 3.92Å; F12-F16 HydrophobicContact CE1-CE2 4.37Å; F12-F16 VanDerWaalsContact O-CD2 3.25Å; F12-F16 WeakPolarHBondContact O-CD2 3.31Å; F12-F16 PolarHBondContact O-N 3.32Å
13	R	64.7	Low	73.6	Confident	157 Å²	157	102 Å²	102	59%	0.592	48%	0.477	S	S	*	.	H	α-helix	trans	-63	-42.3	175.3	-77.3	174	175.2	-175.4	-2.9	111.1	L9 D10 W11 L15 F16 W17	L9-R13 WeakPolarHBondContact O-CB 3.29Å; L9-R13 VanDerWaalsContact O-CG 3.29Å; L9-R13 WeakPolarHBondContact O-CG 3.35Å; L9-R13 PolarHBondContact O-N 2.68Å; D10-R13 PolarHBondContact O-N 2.88Å; W11-R13 PolarHBondContact O-N 3.08Å; R13-L15 PolarHBondContact O-N 3.08Å; R13-F16 PolarHBondContact O-N 3.21Å; R13-F16 VanDerWaalsContact O-N 3.08Å; R13-W17 WeakPolarHBondContact O-CB 3.43Å; R13-W17 PolarHBondContact O-N 3.24Å
14	S	64.6	Low	75	Confident	44 Å²	44	98.6 Å²	98.6	31%	0.308	45%	0.449	S	S	.	.	H	α-helix	trans	-60.7	-31.5	176.3	80.1	0	0	0	0	112.4	D10 W11 F12 N64	D10-S14 WeakPolarHBondContact O-CB 3.41Å; D10-S14 PolarHBondContact O-N 3.36Å; W11-S14 PolarHBondContact O-N 2.83Å; W11-S14 PolarHBondContact O-OG 3.48Å; F12-S14 VanDerWaalsContact C-N 3.34Å; F12-S14 PolarHBondContact O-N 3.18Å; S14-N64 PolarHBondContact O-ND2 3.31Å; S14-N64 PolarHBondContact O-OD1 2.94Å
15	L	58	Low	76.2	Confident	96 Å²	96	92.4 Å²	92.4	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-70.5	-29	175.8	-78.2	159.5	0	0	0	113.8	W11 F12 R13	W11-L15 HydrophobicContact CD2-CD1 3.84Å; W11-L15 HydrophobicContact CE3-CD1 3.8Å; W11-L15 HydrophobicContact CH2-CD1 3.61Å; W11-L15 HydrophobicContact CZ2-CD1 3.64Å; W11-L15 HydrophobicContact CZ3-CD1 3.68Å; W11-L15 PolarHBondContact O-N 3.42Å; W11-L15 VanDerWaalsContact O-N 3.08Å; F12-L15 WeakPolarHBondContact O-CB 3.12Å; F12-L15 PolarHBondContact O-N 2.85Å; R13-L15 PolarHBondContact O-N 3.08Å
16	F	57.7	Low	77	Confident	160 Å²	160	88.3 Å²	88.3	70%	0.702	40%	0.395	S	S	*	.	H	α-helix	trans	-103.6	-24.4	-175	-74.9	-73.1	0	0	0	114.2	F12 R13	F12-F16 HydrophobicContact CD1-CD2 4.44Å; F12-F16 AromaticContact CD1-CE2 3.92Å; F12-F16 HydrophobicContact CD1-CE2 3.92Å; F12-F16 HydrophobicContact CE1-CE2 4.37Å; F12-F16 VanDerWaalsContact O-CD2 3.25Å; F12-F16 WeakPolarHBondContact O-CD2 3.31Å; F12-F16 PolarHBondContact O-N 3.32Å; R13-F16 PolarHBondContact O-N 3.21Å; R13-F16 VanDerWaalsContact O-N 3.08Å
17	W	64.8	Low	78.1	Confident	189 Å²	189	84.2 Å²	84.2	72%	0.716	37%	0.374	S	S	*	.			trans	-112	116.2	-174.4	-60.9	93.3	0	0	0	110.5	R13	R13-W17 WeakPolarHBondContact O-CB 3.43Å; R13-W17 PolarHBondContact O-N 3.24Å
18	K	68.8	Low	79.4	Confident	153 Å²	153	75.4 Å²	75.4	67%	0.665	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-84.8	123.2	169.2	-68.6	-177	-179.6	-179.5	0	108.8	N64	K18-N64 CarbonylContact C-O 3.49Å; K18-N64 WeakPolarHBondContact CA-O 3.47Å
19	E	82.1	Confident	80.2	Confident	63 Å²	63	73.9 Å²	73.9	29%	0.294	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.2	172	-67.8	-179.3	-172.6	0	0	108.9	N64 V65 T66 S181 K182	E19-N64 PolarHBondContact N-O 3.37Å; E19-V65 HydrophobicContact CB-CG2 4.3Å; E19-V65 CarbonylContact O-C 3.54Å; E19-V65 VanDerWaalsContact O-CA 3.32Å; E19-V65 WeakPolarHBondContact O-CA 3.46Å; E19-T66 PolarHBondContact O-N 3.34Å; E19-S181 PolarHBondContact OE2-OG 3.35Å; E19-K182 WeakPolarHBondContact OE1-CE 3.49Å; E19-K182 IonicContact OE1-NZ 3.88Å; E19-K182 VanDerWaalsContact OE2-CG 3.31Å; E19-K182 WeakPolarHBondContact OE2-CG 3.31Å
20	E	85.8	Confident	81.1	Confident	114 Å²	114	75.9 Å²	75.9	53%	0.533	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.7	170.6	-66.3	-158.3	165.2	0	0	109.3	T66 K68	E20-T66 WeakPolarHBondContact CA-O 3.25Å; E20-K68 WeakPolarHBondContact OE2-CE 3.46Å; E20-K68 IonicContact OE2-NZ 3.75Å; E20-K68 PolarHBondContact OE2-NZ 2.86Å
21	M	90.1	Very high	82.3	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.1	173.5	-174.3	-170	-163.7	0	0	108.5	L23 V65 T66 I67 K68 N90 A91 L177 H180	M21-L23 HydrophobicContact SD-CD2 4.32Å; M21-V65 HydrophobicContact CB-CG1 4.35Å; M21-T66 PolarHBondContact N-O 2.92Å; M21-I67 CarbonylContact O-C 3.45Å; M21-I67 WeakPolarHBondContact O-CA 3.49Å; M21-K68 PolarHBondContact O-N 2.8Å; M21-N90 WeakPolarHBondContact CA-OD1 3.32Å; M21-N90 HydrophobicContact CE-CB 3.67Å; M21-N90 HydrophobicContact CG-CB 3.67Å; M21-A91 HydrophobicContact CE-CB 3.81Å; M21-L177 HydrophobicContact CE-CB 4.49Å; M21-L177 HydrophobicContact CE-CD2 4.12Å; M21-L177 VanDerWaalsContact CE-O 3.31Å; M21-L177 WeakPolarHBondContact CE-O 3.42Å; M21-L177 HydrophobicContact SD-CB 4.27Å; M21-H180 HydrophobicContact CE-CB 3.95Å
22	E	92.9	Very high	83.5	Confident	69 Å²	69	65 Å²	65	32%	0.322	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.2	167.3	-54.6	-158.3	173.6	0	0	109.1	K68 V89 N90	E22-K68 HydrophobicContact CG-CB 4.17Å; E22-K68 HydrophobicContact CG-CD 4.06Å; E22-K68 HydrophobicContact CG-CG 4.42Å; E22-K68 WeakPolarHBondContact OE1-CD 3.48Å; E22-K68 IonicContact OE1-NZ 2.88Å; E22-K68 PolarHBondContact OE1-NZ 2.92Å; E22-V89 WeakPolarHBondContact O-CB 3.43Å; E22-N90 PolarHBondContact N-OD1 3.14Å; E22-N90 WeakPolarHBondContact O-CB 3.46Å; E22-N90 PolarHBondContact O-N 2.92Å; E22-N90 PolarHBondContact O-OD1 3.09Å
23	L	94.3	Very high	84.8	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.2	173.3	70.7	81.6	0	0	0	110.3	M21 I67 K68 I69 W70 A91 V93 L177	M21-L23 HydrophobicContact SD-CD2 4.32Å; L23-I67 HydrophobicContact CD2-CG2 3.42Å; L23-I67 VanDerWaalsContact CD2-CG2 3.42Å; L23-I67 HydrophobicContact CG-CG2 3.79Å; L23-K68 PolarHBondContact N-O 3.21Å; L23-I69 HydrophobicContact CD1-CB 4.17Å; L23-I69 HydrophobicContact CD1-CD1 4.48Å; L23-I69 HydrophobicContact CD1-CG1 3.87Å; L23-I69 HydrophobicContact CD1-CG2 3.75Å; L23-I69 HydrophobicContact CD2-CG1 4.46Å; L23-I69 HydrophobicContact CG-CG1 4.05Å; L23-I69 WeakPolarHBondContact O-CA 3.46Å; L23-W70 PolarHBondContact O-N 3.25Å; L23-W70 VanDerWaalsContact O-N 3.09Å; L23-A91 VanDerWaalsContact CA-O 3.31Å; L23-A91 WeakPolarHBondContact CA-O 3.37Å; L23-A91 VanDerWaalsContact CB-O 3.3Å; L23-A91 WeakPolarHBondContact CB-O 3.43Å; L23-V93 HydrophobicContact CD1-CG2 4.04Å; L23-V93 HydrophobicContact CD2-CG2 4.34Å; L23-L177 HydrophobicContact CD2-CD1 3.71Å; L23-L177 HydrophobicContact CD2-CD2 3.56Å; L23-L177 HydrophobicContact CD2-CG 4.18Å
24	T	96.4	Very high	86	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.9	175.8	-73.3	0	0	0	0	110.3	V26 W70 I72 Y85 C86 A91 V93	T24-V26 HydrophobicContact CG2-CG1 3.66Å; T24-W70 HydrophobicContact CG2-CB 4.44Å; T24-I72 HydrophobicContact CG2-CG1 4.09Å; T24-Y85 PolarHBondContact OG1-O 2.9Å; T24-C86 WeakPolarHBondContact CG2-SG 3.3Å; T24-A91 PolarHBondContact N-O 3.28Å; T24-V93 PolarHBondContact O-N 3.19Å
25	L	96.9	Very high	87.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	110.4	179.1	-179.1	61.7	0	0	0	109.3	K33 F36 V37 I69 W70 I72 V93 M95	L25-K33 HydrophobicContact CD1-CG 4.13Å; L25-K33 HydrophobicContact CD2-CB 3.64Å; L25-K33 HydrophobicContact CD2-CG 4.15Å; L25-K33 VanDerWaalsContact CD2-O 3.3Å; L25-K33 WeakPolarHBondContact CD2-O 3.35Å; L25-K33 HydrophobicContact CG-CB 3.82Å; L25-K33 HydrophobicContact CG-CD 4.03Å; L25-K33 HydrophobicContact CG-CG 3.78Å; L25-F36 HydrophobicContact CD2-CD1 3.97Å; L25-V37 HydrophobicContact CD2-CG2 3.46Å; L25-V37 VanDerWaalsContact CD2-CG2 3.46Å; L25-I69 HydrophobicContact CB-CG2 4.04Å; L25-W70 PolarHBondContact N-O 2.88Å; L25-I72 PolarHBondContact O-N 3.37Å; L25-V93 WeakPolarHBondContact CA-O 3.42Å; L25-V93 HydrophobicContact CD1-CB 3.82Å; L25-V93 HydrophobicContact CD1-CG1 3.54Å; L25-M95 HydrophobicContact CD1-CB 4.17Å; L25-M95 HydrophobicContact CD1-CE 4.07Å
26	V	97.4	Very high	89	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	167.2	-175.1	-75.9	0	0	0	0	110.9	T24 I72 W82 I92 V93 Y94 M95 L114	T24-V26 HydrophobicContact CG2-CG1 3.66Å; V26-I72 HydrophobicContact CG1-CB 4.1Å; V26-I72 HydrophobicContact CG1-CG1 4.1Å; V26-W82 HydrophobicContact CB-CD2 4.08Å; V26-W82 HydrophobicContact CB-CE3 4.31Å; V26-W82 HydrophobicContact CB-CG 4.33Å; V26-W82 HydrophobicContact CG1-CB 4.04Å; V26-W82 HydrophobicContact CG1-CD2 4.01Å; V26-W82 HydrophobicContact CG1-CG 3.73Å; V26-I92 HydrophobicContact CG2-CG2 3.8Å; V26-V93 PolarHBondContact N-O 2.94Å; V26-Y94 HydrophobicContact CG2-CD2 3.96Å; V26-Y94 WeakPolarHBondContact O-CA 3.26Å; V26-M95 PolarHBondContact O-N 3.08Å; V26-L114 HydrophobicContact CG2-CD2 3.91Å
27	G	97.5	Very high	90.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	18%	0.184	C	C	.	.			trans	138.9	168.4	-174.5	0	0	0	0	0	111.5	K33 G74 W82	G27-K33 PolarHBondContact O-NZ 2.96Å; G27-G74 VanDerWaalsContact O-CA 3.29Å; G27-G74 WeakPolarHBondContact O-CA 3.47Å; G27-W82 WeakPolarHBondContact O-CZ2 3.31Å
28	L	96.5	Very high	91.7	Very high	13 Å²	13	33.1 Å²	33.1	7%	0.068	16%	0.155	C	C	.	.	S	Bend	trans	-58.5	158.8	-176.4	-60.8	-173.6	0	0	0	112.7	S31 K33 R79 K103 A106 E110	L28-S31 WeakPolarHBondContact O-CB 3.44Å; L28-S31 PolarHBondContact O-N 3.39Å; L28-S31 PolarHBondContact O-OG 3.25Å; L28-K33 PolarHBondContact O-NZ 3.34Å; L28-R79 VanDerWaalsContact CD2-NH2 3.33Å; L28-K103 HydrophobicContact CD1-CB 3.97Å; L28-A106 HydrophobicContact CD1-CB 4.26Å; L28-E110 HydrophobicContact CD2-CG 4.2Å
29	Q	93.9	Very high	92.7	Very high	64 Å²	64	26.3 Å²	26.3	30%	0.299	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	148.4	172.2	59.5	175.3	15.8	0	0	111.1	S31 G74	Q29-S31 PolarHBondContact O-N 2.96Å; Q29-G74 PolarHBondContact N-O 3.44Å
30	Y	93.6	Very high	92.9	Very high	129 Å²	129	24.3 Å²	24.3	51%	0.506	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	6.1	-178.6	-49.4	-73.4	0	0	0	117.2	G32 P51 K131	Y30-G32 PolarHBondContact O-N 3.44Å; Y30-P51 HydrophobicContact CD1-CG 3.85Å; Y30-P51 HydrophobicContact CE1-CG 3.14Å; Y30-P51 HydrophobicContact CE2-CG 4.29Å; Y30-P51 WeakPolarHBondContact OH-CG 3.48Å; Y30-K131 VanDerWaalsContact O-CE 3.31Å; Y30-K131 WeakPolarHBondContact O-CE 3.44Å; Y30-K131 PolarHBondContact O-NZ 3.22Å
31	S	96.1	Very high	92.7	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.014	11%	0.109	C	C	.	.	S	Bend	trans	-67.7	-12.5	173.3	54.1	0	0	0	0	114.9	L28 Q29 K33 M95 N130	L28-S31 WeakPolarHBondContact O-CB 3.44Å; L28-S31 PolarHBondContact O-N 3.39Å; L28-S31 PolarHBondContact O-OG 3.25Å; Q29-S31 PolarHBondContact O-N 2.96Å; S31-K33 PolarHBondContact OG-NZ 3.48Å; S31-M95 WeakPolarHBondContact CB-O 3.32Å; S31-M95 WeakPolarHBondContact O-CG 3.47Å; S31-N130 PolarHBondContact O-ND2 2.77Å
32	G	94.4	Very high	91.9	Very high	12 Å²	12	24.7 Å²	24.7	12%	0.124	13%	0.133	C	C	.	.	S	Bend	trans	94	22.1	177.6	0	0	0	0	0	115	Y30 T35 F36	Y30-G32 PolarHBondContact O-N 3.44Å; G32-T35 WeakPolarHBondContact O-CB 3.37Å; G32-T35 PolarHBondContact O-N 3.29Å; G32-F36 WeakPolarHBondContact O-CB 3.49Å; G32-F36 PolarHBondContact O-N 3.16Å
33	K	94.3	Very high	90.5	Very high	12 Å²	12	23 Å²	23	5%	0.052	13%	0.133	C	C	.	.	H	α-helix	trans	-53.3	-57.4	176.1	-67	-174.7	-61.1	-67.1	0	113.3	L25 G27 L28 S31 T35 F36 V37 D71 I72 M95	L25-K33 HydrophobicContact CD1-CG 4.13Å; L25-K33 HydrophobicContact CD2-CB 3.64Å; L25-K33 HydrophobicContact CD2-CG 4.15Å; L25-K33 VanDerWaalsContact CD2-O 3.3Å; L25-K33 WeakPolarHBondContact CD2-O 3.35Å; L25-K33 HydrophobicContact CG-CB 3.82Å; L25-K33 HydrophobicContact CG-CD 4.03Å; L25-K33 HydrophobicContact CG-CG 3.78Å; G27-K33 PolarHBondContact O-NZ 2.96Å; L28-K33 PolarHBondContact O-NZ 3.34Å; S31-K33 PolarHBondContact OG-NZ 3.48Å; K33-T35 VanDerWaalsContact C-N 3.26Å; K33-T35 PolarHBondContact O-N 3.34Å; K33-F36 WeakPolarHBondContact O-CB 3.39Å; K33-F36 PolarHBondContact O-N 3.07Å; K33-F36 VanDerWaalsContact O-N 3.11Å; K33-V37 WeakPolarHBondContact O-CG2 3.45Å; K33-V37 PolarHBondContact O-N 3.35Å; K33-D71 WeakPolarHBondContact CB-OD1 3.42Å; K33-I72 WeakPolarHBondContact CE-O 3.18Å; K33-M95 HydrophobicContact CD-CB 4.49Å; K33-M95 HydrophobicContact CG-CB 3.68Å; K33-M95 HydrophobicContact CG-CG 4.11Å
34	T	90.7	Very high	88.8	Confident	21 Å²	21	29.6 Å²	29.6	13%	0.129	16%	0.164	C	C	.	.	H	α-helix	trans	-65.5	-33.3	-178.3	-37.9	0	0	0	0	112	V37 N38 M49 T52 D71	T34-V37 PolarHBondContact O-N 3.47Å; T34-N38 PolarHBondContact O-N 3.33Å; T34-M49 VanDerWaalsContact CB-CE 3.5Å; T34-M49 HydrophobicContact CG2-CE 3.18Å; T34-T52 PolarHBondContact OG1-OG1 3.4Å; T34-D71 WeakPolarHBondContact CB-OD2 3.41Å; T34-D71 PolarHBondContact OG1-OD2 3.1Å
35	T	92.3	Very high	87	Confident	20 Å²	20	33.3 Å²	33.3	12%	0.123	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-47.9	171.8	-51.2	0	0	0	0	111.2	G32 K33 V37 N38 V39 F45 C164	G32-T35 WeakPolarHBondContact O-CB 3.37Å; G32-T35 PolarHBondContact O-N 3.29Å; K33-T35 VanDerWaalsContact C-N 3.26Å; K33-T35 PolarHBondContact O-N 3.34Å; T35-V37 VanDerWaalsContact C-N 3.32Å; T35-V37 PolarHBondContact O-N 2.78Å; T35-N38 WeakPolarHBondContact O-CB 3.33Å; T35-N38 PolarHBondContact O-N 3.31Å; T35-V39 HydrophobicContact CG2-CG2 4.5Å; T35-V39 VanDerWaalsContact O-CG2 3.31Å; T35-V39 WeakPolarHBondContact O-CG2 3.47Å; T35-V39 PolarHBondContact O-N 2.96Å; T35-F45 HydrophobicContact CG2-CD2 3.34Å; T35-F45 HydrophobicContact CG2-CE2 3.41Å; T35-F45 VanDerWaalsContact CG2-CE2 3.41Å; T35-C164 HydrophobicContact CG2-CB 3.78Å
36	F	93.5	Very high	85.3	Confident	1 Å²	1	35.9 Å²	35.9	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-56.2	-48.4	175.3	175.1	-101	0	0	0	110.8	L25 G32 K33 N38 V39 I40 M95 L128 I170 T173	L25-F36 HydrophobicContact CD2-CD1 3.97Å; G32-F36 WeakPolarHBondContact O-CB 3.49Å; G32-F36 PolarHBondContact O-N 3.16Å; K33-F36 WeakPolarHBondContact O-CB 3.39Å; K33-F36 PolarHBondContact O-N 3.07Å; K33-F36 VanDerWaalsContact O-N 3.11Å; F36-N38 PolarHBondContact O-N 2.82Å; F36-V39 PolarHBondContact O-N 2.74Å; F36-I40 HydrophobicContact CD1-CD1 4.18Å; F36-I40 HydrophobicContact CD2-CG2 4.4Å; F36-I40 HydrophobicContact CE1-CD1 3.76Å; F36-I40 HydrophobicContact CE1-CG2 4.36Å; F36-I40 HydrophobicContact CE2-CG2 3.98Å; F36-I40 HydrophobicContact CZ-CD1 4.28Å; F36-I40 HydrophobicContact CZ-CG2 3.95Å; F36-I40 WeakPolarHBondContact O-CG1 3.29Å; F36-I40 PolarHBondContact O-N 2.84Å; F36-M95 HydrophobicContact CB-CE 3.46Å; F36-M95 VanDerWaalsContact CB-CE 3.46Å; F36-M95 HydrophobicContact CD1-CE 4.08Å; F36-M95 HydrophobicContact CD2-CE 3.98Å; F36-M95 HydrophobicContact CG-CE 3.57Å; F36-L128 HydrophobicContact CD2-CD1 4.33Å; F36-L128 HydrophobicContact CE2-CD1 3.91Å; F36-L128 HydrophobicContact CZ-CD1 4.04Å; F36-I170 HydrophobicContact CD2-CD1 4.07Å; F36-I170 HydrophobicContact CE2-CD1 4.09Å; F36-T173 HydrophobicContact CE2-CG2 3.81Å; F36-T173 HydrophobicContact CZ-CG2 3.65Å
37	V	90.6	Very high	83.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58.8	-44	176.8	-179.2	0	0	0	0	111.8	L25 K33 T34 T35 I40 S41 R58 I69 D71	L25-V37 HydrophobicContact CD2-CG2 3.46Å; L25-V37 VanDerWaalsContact CD2-CG2 3.46Å; K33-V37 WeakPolarHBondContact O-CG2 3.45Å; K33-V37 PolarHBondContact O-N 3.35Å; T34-V37 PolarHBondContact O-N 3.47Å; T35-V37 VanDerWaalsContact C-N 3.32Å; T35-V37 PolarHBondContact O-N 2.78Å; V37-I40 VanDerWaalsContact O-CG1 3.27Å; V37-I40 WeakPolarHBondContact O-CG1 3.28Å; V37-S41 VanDerWaalsContact O-CB 3.23Å; V37-S41 WeakPolarHBondContact O-CB 3.31Å; V37-S41 PolarHBondContact O-N 3.24Å; V37-S41 PolarHBondContact O-OG 3.22Å; V37-R58 HydrophobicContact CG1-CB 3.87Å; V37-R58 HydrophobicContact CG1-CG 3.93Å; V37-I69 HydrophobicContact CG2-CG2 3.87Å; V37-D71 HydrophobicContact CG2-CB 4.41Å
38	N	88.5	Confident	81.2	Confident	22 Å²	22	50.1 Å²	50.1	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-58.9	-48.9	175.1	-73.5	-11.6	0	0	0	111.5	T34 T35 F36 I40 S41 S42 M49 R58	T34-N38 PolarHBondContact O-N 3.33Å; T35-N38 WeakPolarHBondContact O-CB 3.33Å; T35-N38 PolarHBondContact O-N 3.31Å; F36-N38 PolarHBondContact O-N 2.82Å; N38-I40 VanDerWaalsContact C-N 3.34Å; N38-I40 PolarHBondContact O-N 3.33Å; N38-S41 PolarHBondContact O-N 3.48Å; N38-S41 VanDerWaalsContact O-N 3.12Å; N38-S42 PolarHBondContact O-N 3.08Å; N38-S42 PolarHBondContact O-OG 3.43Å; N38-S42 VanDerWaalsContact O-OG 3.09Å; N38-M49 WeakPolarHBondContact ND2-CE 3.32Å; N38-M49 PolarHBondContact ND2-SD 3.47Å; N38-R58 PolarHBondContact OD1-NH1 3.29Å; N38-R58 PolarHBondContact OD1-NH2 3.21Å; N38-R58 VanDerWaalsContact OD1-NH2 3.12Å
39	V	89.5	Confident	79.6	Confident	10 Å²	10	52.2 Å²	52.2	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-43.8	-177.1	169.8	0	0	0	0	111.2	T35 F36 G43 F45 C164 K167 I170	T35-V39 HydrophobicContact CG2-CG2 4.5Å; T35-V39 VanDerWaalsContact O-CG2 3.31Å; T35-V39 WeakPolarHBondContact O-CG2 3.47Å; T35-V39 PolarHBondContact O-N 2.96Å; F36-V39 PolarHBondContact O-N 2.74Å; V39-G43 WeakPolarHBondContact O-CA 3.39Å; V39-G43 PolarHBondContact O-N 3.04Å; V39-F45 HydrophobicContact CG2-CB 4.48Å; V39-C164 HydrophobicContact CG2-CB 4.32Å; V39-C164 WeakPolarHBondContact CG2-O 3.39Å; V39-K167 HydrophobicContact CG1-CG 4.13Å; V39-I170 HydrophobicContact CG1-CG1 4.39Å; V39-I170 HydrophobicContact CG1-CG2 4.3Å
40	I	85.9	Confident	78.2	Confident	20 Å²	20	56.1 Å²	56.1	10%	0.103	30%	0.301	C	S	.	.	H	α-helix	trans	-76	-24.1	177.8	66.5	176.2	0	0	0	113.3	F36 V37 N38 V60 I69 I170 L174	F36-I40 HydrophobicContact CD1-CD1 4.18Å; F36-I40 HydrophobicContact CD2-CG2 4.4Å; F36-I40 HydrophobicContact CE1-CD1 3.76Å; F36-I40 HydrophobicContact CE1-CG2 4.36Å; F36-I40 HydrophobicContact CE2-CG2 3.98Å; F36-I40 HydrophobicContact CZ-CD1 4.28Å; F36-I40 HydrophobicContact CZ-CG2 3.95Å; F36-I40 WeakPolarHBondContact O-CG1 3.29Å; F36-I40 PolarHBondContact O-N 2.84Å; V37-I40 VanDerWaalsContact O-CG1 3.27Å; V37-I40 WeakPolarHBondContact O-CG1 3.28Å; N38-I40 VanDerWaalsContact C-N 3.34Å; N38-I40 PolarHBondContact O-N 3.33Å; I40-V60 HydrophobicContact CD1-CG2 4.29Å; I40-V60 HydrophobicContact CG1-CG2 4.16Å; I40-V60 VanDerWaalsContact O-CG1 3.23Å; I40-V60 WeakPolarHBondContact O-CG1 3.24Å; I40-I69 HydrophobicContact CD1-CD1 3.23Å; I40-I69 HydrophobicContact CG1-CD1 4.4Å; I40-I170 HydrophobicContact CG2-CG2 3.85Å; I40-L174 HydrophobicContact CB-CD2 4.32Å; I40-L174 HydrophobicContact CG2-CD1 4.22Å; I40-L174 HydrophobicContact CG2-CD2 4.05Å; I40-L174 HydrophobicContact CG2-CG 4.34Å
41	S	81.4	Confident	76.6	Confident	52 Å²	52	51.5 Å²	51.5	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-83.1	-49.2	-178.7	-56.3	0	0	0	0	112.8	V37 N38 V60	V37-S41 VanDerWaalsContact O-CB 3.23Å; V37-S41 WeakPolarHBondContact O-CB 3.31Å; V37-S41 PolarHBondContact O-N 3.24Å; V37-S41 PolarHBondContact O-OG 3.22Å; N38-S41 PolarHBondContact O-N 3.48Å; N38-S41 VanDerWaalsContact O-N 3.12Å; S41-V60 WeakPolarHBondContact OG-CG2 3.5Å
42	S	72.7	Confident	75.3	Confident	71 Å²	71	52.7 Å²	52.7	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-121.5	-5.1	-169.9	61.2	0	0	0	0	113.4	N38 Q44	N38-S42 PolarHBondContact O-N 3.08Å; N38-S42 PolarHBondContact O-OG 3.43Å; N38-S42 VanDerWaalsContact O-OG 3.09Å; S42-Q44 PolarHBondContact O-N 3.36Å; S42-Q44 PolarHBondContact OG-N 3.17Å
43	G	63.3	Low	74.2	Confident	32 Å²	32	57 Å²	57	33%	0.33	32%	0.318	S	S	.	.	S	Bend	trans	68	6.9	-172.5	0	0	0	0	0	113.6	V39 K167	V39-G43 WeakPolarHBondContact O-CA 3.39Å; V39-G43 PolarHBondContact O-N 3.04Å; G43-K167 VanDerWaalsContact O-CE 3.26Å; G43-K167 WeakPolarHBondContact O-CE 3.35Å; G43-K167 PolarHBondContact O-NZ 2.87Å
44	Q	59.7	Low	73.5	Confident	141 Å²	141	57.1 Å²	57.1	66%	0.659	32%	0.322	S	S	*	.			trans	-106	133.2	-177.8	-66.6	-176.2	-10.7	0	0	111.1	S42	S42-Q44 PolarHBondContact O-N 3.36Å; S42-Q44 PolarHBondContact OG-N 3.17Å
45	F	57.5	Low	73	Confident	77 Å²	77	60.9 Å²	60.9	34%	0.338	34%	0.337	S	S	.	.			trans	-94.9	144.9	168.1	173.1	-106.1	0	0	0	108.9	T35 V39 E47 K165	T35-F45 HydrophobicContact CG2-CD2 3.34Å; T35-F45 HydrophobicContact CG2-CE2 3.41Å; T35-F45 VanDerWaalsContact CG2-CE2 3.41Å; V39-F45 HydrophobicContact CG2-CB 4.48Å; F45-E47 HydrophobicContact CD1-CG 4.16Å; F45-E47 HydrophobicContact CE1-CB 4.34Å; F45-E47 HydrophobicContact CE1-CG 3.29Å; F45-E47 HydrophobicContact CZ-CG 3.92Å; F45-K165 HydrophobicContact CE1-CG 4.07Å; F45-K165 HydrophobicContact CE2-CB 4.3Å; F45-K165 HydrophobicContact CZ-CB 4.28Å; F45-K165 HydrophobicContact CZ-CG 4.19Å
46	S	61.4	Low	72.6	Confident	54 Å²	54	63.2 Å²	63.2	38%	0.378	35%	0.349	S	S	.	.			trans	-130.6	126.5	173.7	179.9	0	0	0	0	107.5	M49	S46-M49 VanDerWaalsContact O-CG 3.31Å; S46-M49 WeakPolarHBondContact O-CG 3.28Å
47	E	51.5	Low	72.3	Confident	148 Å²	148	66.8 Å²	66.8	69%	0.692	37%	0.367	S	S	*	.	S	Bend	trans	-71.6	-34.5	-178.1	-77.6	-175.4	159.2	0	0	112	F45 M49	F45-E47 HydrophobicContact CD1-CG 4.16Å; F45-E47 HydrophobicContact CE1-CB 4.34Å; F45-E47 HydrophobicContact CE1-CG 3.29Å; F45-E47 HydrophobicContact CZ-CG 3.92Å; E47-M49 VanDerWaalsContact C-N 3.33Å; E47-M49 PolarHBondContact O-N 2.98Å; E47-M49 VanDerWaalsContact O-N 3.11Å
48	D	58.6	Low	72	Confident	151 Å²	151	70 Å²	70	81%	0.807	38%	0.379	S	S	*	.			trans	-90.7	53.8	-174.3	-62.5	-42.8	0	0	0	113.3
49	M	62.4	Low	71.8	Confident	57 Å²	57	74.8 Å²	74.8	28%	0.281	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-86.7	117.4	178.6	-68.7	-67.8	-72.1	0	0	112	T34 N38 S46 E47	T34-M49 VanDerWaalsContact CB-CE 3.5Å; T34-M49 HydrophobicContact CG2-CE 3.18Å; N38-M49 WeakPolarHBondContact ND2-CE 3.32Å; N38-M49 PolarHBondContact ND2-SD 3.47Å; S46-M49 VanDerWaalsContact O-CG 3.31Å; S46-M49 WeakPolarHBondContact O-CG 3.28Å; E47-M49 VanDerWaalsContact C-N 3.33Å; E47-M49 PolarHBondContact O-N 2.98Å; E47-M49 VanDerWaalsContact O-N 3.11Å
50	I	64.6	Low	71.5	Confident	147 Å²	147	74.7 Å²	74.7	75%	0.754	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-81.2	143.1	173.4	-58.7	173.5	0	0	0	109.5	T52	I50-T52 PolarHBondContact O-N 2.95Å
51	P	59	Low	71.3	Confident	31 Å²	31	77.9 Å²	77.9	20%	0.201	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-53.7	135.4	175	-28.9	36.4	0	0	0	114	Y30 V53	Y30-P51 HydrophobicContact CD1-CG 3.85Å; Y30-P51 HydrophobicContact CE1-CG 3.14Å; Y30-P51 HydrophobicContact CE2-CG 4.29Å; Y30-P51 WeakPolarHBondContact OH-CG 3.48Å; P51-V53 PolarHBondContact O-N 3.32Å
52	T	69.4	Low	70.9	Confident	27 Å²	27	80 Å²	80	17%	0.166	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-58.8	127.7	174.4	-52.1	0	0	0	0	111.7	T34 I50 D71	T34-T52 PolarHBondContact OG1-OG1 3.4Å; I50-T52 PolarHBondContact O-N 2.95Å; T52-D71 PolarHBondContact OG1-OD2 3.4Å
53	V	72.5	Confident	71.1	Confident	104 Å²	104	79.7 Å²	79.7	63%	0.63	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-93.7	117.4	170.1	-179.1	0	0	0	0	108.1	P51 F55 F78	P51-V53 PolarHBondContact O-N 3.32Å; V53-F55 PolarHBondContact O-N 3.01Å; V53-F78 HydrophobicContact CG1-CE2 4.43Å; V53-F78 HydrophobicContact CG1-CZ 3.89Å
54	G	78.6	Confident	71.9	Confident	13 Å²	13	81.4 Å²	81.4	13%	0.134	43%	0.431	C	S	.	.	S	Bend	trans	81.8	-115.3	179.1	0	0	0	0	0	112.7	G73 F78	G54-G73 PolarHBondContact O-N 3.42Å; G54-F78 VanDerWaalsContact N-CE2 3.29Å
55	F	80.9	Confident	72.9	Confident	100 Å²	100	75.1 Å²	75.1	44%	0.439	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	153.1	-178.7	61	-87.8	0	0	0	110.7	V53 W70 D71 I72 M81 Y85	V53-F55 PolarHBondContact O-N 3.01Å; F55-W70 HydrophobicContact CD2-CE3 4.31Å; F55-W70 HydrophobicContact CD2-CZ3 4.06Å; F55-W70 HydrophobicContact CE2-CZ3 4.32Å; F55-D71 CarbonylContact C-O 3.56Å; F55-D71 WeakPolarHBondContact CA-O 3.22Å; F55-I72 HydrophobicContact CB-CD1 3.56Å; F55-M81 HydrophobicContact CD1-SD 4.35Å; F55-Y85 HydrophobicContact CD1-CE2 4.34Å; F55-Y85 AromaticContact CD1-CZ 3.99Å; F55-Y85 WeakPolarHBondContact CD1-OH 3.39Å; F55-Y85 HydrophobicContact CD2-CE1 4.11Å; F55-Y85 AromaticContact CD2-CZ 4Å; F55-Y85 VanDerWaalsContact CE1-OH 3.22Å; F55-Y85 WeakPolarHBondContact CE1-OH 3.31Å; F55-Y85 HydrophobicContact CE2-CE1 4.46Å; F55-Y85 WeakPolarHBondContact CE2-OH 3.45Å; F55-Y85 HydrophobicContact CG-CE1 4.32Å; F55-Y85 HydrophobicContact CG-CE2 4.43Å; F55-Y85 AromaticContact CG-CZ 3.89Å; F55-Y85 WeakPolarHBondContact CZ-OH 3.49Å
56	N	83.8	Confident	74.2	Confident	70 Å²	70	72.1 Å²	72.1	37%	0.374	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	135.8	173	-168.4	-20.7	0	0	0	109.3	D71	N56-D71 PolarHBondContact N-O 3.49Å; N56-D71 PolarHBondContact O-N 3.26Å
57	M	86.1	Confident	75.5	Confident	76 Å²	76	69.6 Å²	69.6	37%	0.374	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125	171.9	-176.3	-145.4	63.6	0	0	109.2	K59 I69 W70	M57-K59 HydrophobicContact CE-CG 4.17Å; M57-I69 CarbonylContact C-O 3.53Å; M57-I69 WeakPolarHBondContact CA-O 3.31Å; M57-W70 HydrophobicContact CB-CD2 4.2Å; M57-W70 HydrophobicContact CB-CE3 3.72Å; M57-W70 HydrophobicContact CB-CH2 3.93Å; M57-W70 HydrophobicContact CB-CZ2 4.38Å; M57-W70 HydrophobicContact CB-CZ3 3.59Å; M57-W70 HydrophobicContact CG-CD2 4.24Å; M57-W70 HydrophobicContact CG-CE3 4.25Å; M57-W70 HydrophobicContact CG-CH2 4.11Å; M57-W70 HydrophobicContact CG-CZ2 4.09Å; M57-W70 HydrophobicContact CG-CZ3 4.2Å; M57-W70 HydrophobicContact SD-CH2 4.41Å; M57-W70 HydrophobicContact SD-CZ2 4.38Å
58	R	85.3	Confident	77.4	Confident	67 Å²	67	64.1 Å²	64.1	25%	0.253	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	145.4	171.9	-58.9	-145.6	-163.6	159.7	-3.1	111.4	V37 N38 I69	V37-R58 HydrophobicContact CG1-CB 3.87Å; V37-R58 HydrophobicContact CG1-CG 3.93Å; N38-R58 PolarHBondContact OD1-NH1 3.29Å; N38-R58 PolarHBondContact OD1-NH2 3.21Å; N38-R58 VanDerWaalsContact OD1-NH2 3.12Å; R58-I69 PolarHBondContact N-O 2.8Å; R58-I69 PolarHBondContact O-N 3.32Å
59	K	84.3	Confident	79	Confident	122 Å²	122	57 Å²	57	53%	0.53	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.3	174.1	-62.2	-167.8	179.3	-178.1	0	109.3	M57 I67 K68	M57-K59 HydrophobicContact CE-CG 4.17Å; K59-I67 CarbonylContact C-O 3.57Å; K59-I67 WeakPolarHBondContact CA-O 3.31Å; K59-K68 HydrophobicContact CD-CG 4.45Å; K59-K68 HydrophobicContact CG-CG 4.21Å
60	V	83.4	Confident	80.4	Confident	8 Å²	8	57.1 Å²	57.1	5%	0.048	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.1	177.3	-178	0	0	0	0	107.9	I40 S41 I67 I69	I40-V60 HydrophobicContact CD1-CG2 4.29Å; I40-V60 HydrophobicContact CG1-CG2 4.16Å; I40-V60 VanDerWaalsContact O-CG1 3.23Å; I40-V60 WeakPolarHBondContact O-CG1 3.24Å; S41-V60 WeakPolarHBondContact OG-CG2 3.5Å; V60-I67 PolarHBondContact N-O 2.92Å; V60-I67 PolarHBondContact O-N 3.47Å; V60-I69 HydrophobicContact CG2-CD1 4.03Å
61	T	80.9	Confident	81.6	Confident	87 Å²	87	50.1 Å²	50.1	53%	0.534	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120	176.5	-51	0	0	0	0	108.9	V65	T61-V65 WeakPolarHBondContact CA-O 3.38Å
62	K	73.9	Confident	83	Confident	97 Å²	97	48.6 Å²	48.6	42%	0.422	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	113.9	174.6	-170.2	172.4	-178.1	179.7	0	109.4	N64 V65 L174	K62-N64 PolarHBondContact O-N 3.01Å; K62-V65 PolarHBondContact N-O 3.17Å; K62-V65 PolarHBondContact O-N 2.75Å; K62-L174 HydrophobicContact CD-CD1 3.89Å
63	G	75.4	Confident	83.8	Confident	65 Å²	65	47.3 Å²	47.3	67%	0.67	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	-123.9	-171.2	0	0	0	0	0	110.7
64	N	80.2	Confident	84.6	Confident	67 Å²	67	42.6 Å²	42.6	36%	0.358	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	4.2	-179.4	-55.5	-34	0	0	0	113.2	S14 K18 E19 K62	S14-N64 PolarHBondContact O-ND2 3.31Å; S14-N64 PolarHBondContact O-OD1 2.94Å; K18-N64 CarbonylContact C-O 3.49Å; K18-N64 WeakPolarHBondContact CA-O 3.47Å; E19-N64 PolarHBondContact N-O 3.37Å; K62-N64 PolarHBondContact O-N 3.01Å
65	V	80.3	Confident	85	Confident	10 Å²	10	43.9 Å²	43.9	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.4	179.9	-172.6	0	0	0	0	110.2	E19 M21 T61 K62 I67 I178	E19-V65 HydrophobicContact CB-CG2 4.3Å; E19-V65 CarbonylContact O-C 3.54Å; E19-V65 VanDerWaalsContact O-CA 3.32Å; E19-V65 WeakPolarHBondContact O-CA 3.46Å; M21-V65 HydrophobicContact CB-CG1 4.35Å; T61-V65 WeakPolarHBondContact CA-O 3.38Å; K62-V65 PolarHBondContact N-O 3.17Å; K62-V65 PolarHBondContact O-N 2.75Å; V65-I67 HydrophobicContact CG1-CG1 3.94Å; V65-I178 HydrophobicContact CB-CG1 4.47Å; V65-I178 HydrophobicContact CG2-CG1 4.24Å; V65-I178 HydrophobicContact CG2-CG2 4.06Å
66	T	86.4	Confident	85.4	Confident	14 Å²	14	43.3 Å²	43.3	9%	0.086	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	113.2	169.3	-56.8	0	0	0	0	108.9	E19 E20 M21	E19-T66 PolarHBondContact O-N 3.34Å; E20-T66 WeakPolarHBondContact CA-O 3.25Å; M21-T66 PolarHBondContact N-O 2.92Å
67	I	88.4	Confident	85.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.3	-179.4	-50.4	177.4	0	0	0	108.6	M21 L23 K59 V60 V65 I69 L174	M21-I67 CarbonylContact O-C 3.45Å; M21-I67 WeakPolarHBondContact O-CA 3.49Å; L23-I67 HydrophobicContact CD2-CG2 3.42Å; L23-I67 VanDerWaalsContact CD2-CG2 3.42Å; L23-I67 HydrophobicContact CG-CG2 3.79Å; K59-I67 CarbonylContact C-O 3.57Å; K59-I67 WeakPolarHBondContact CA-O 3.31Å; V60-I67 PolarHBondContact N-O 2.92Å; V60-I67 PolarHBondContact O-N 3.47Å; V65-I67 HydrophobicContact CG1-CG1 3.94Å; I67-I69 HydrophobicContact CB-CG1 4.42Å; I67-I69 HydrophobicContact CG2-CD1 4.04Å; I67-I69 HydrophobicContact CG2-CG1 3.6Å; I67-L174 HydrophobicContact CD1-CD2 4.49Å
68	K	90.1	Very high	85.8	Confident	32 Å²	32	45 Å²	45	14%	0.139	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121	167.5	-53.9	-176.9	-159	148.5	0	108.3	E20 M21 E22 L23 K59	E20-K68 WeakPolarHBondContact OE2-CE 3.46Å; E20-K68 IonicContact OE2-NZ 3.75Å; E20-K68 PolarHBondContact OE2-NZ 2.86Å; M21-K68 PolarHBondContact O-N 2.8Å; E22-K68 HydrophobicContact CG-CB 4.17Å; E22-K68 HydrophobicContact CG-CD 4.06Å; E22-K68 HydrophobicContact CG-CG 4.42Å; E22-K68 WeakPolarHBondContact OE1-CD 3.48Å; E22-K68 IonicContact OE1-NZ 2.88Å; E22-K68 PolarHBondContact OE1-NZ 2.92Å; L23-K68 PolarHBondContact N-O 3.21Å; K59-K68 HydrophobicContact CD-CG 4.45Å; K59-K68 HydrophobicContact CG-CG 4.21Å
69	I	92.5	Very high	86	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118.5	-173.7	-55.4	179	0	0	0	108.7	L23 L25 V37 I40 M57 R58 V60 I67	L23-I69 HydrophobicContact CD1-CB 4.17Å; L23-I69 HydrophobicContact CD1-CD1 4.48Å; L23-I69 HydrophobicContact CD1-CG1 3.87Å; L23-I69 HydrophobicContact CD1-CG2 3.75Å; L23-I69 HydrophobicContact CD2-CG1 4.46Å; L23-I69 HydrophobicContact CG-CG1 4.05Å; L23-I69 WeakPolarHBondContact O-CA 3.46Å; L25-I69 HydrophobicContact CB-CG2 4.04Å; V37-I69 HydrophobicContact CG2-CG2 3.87Å; I40-I69 HydrophobicContact CD1-CD1 3.23Å; I40-I69 HydrophobicContact CG1-CD1 4.4Å; M57-I69 CarbonylContact C-O 3.53Å; M57-I69 WeakPolarHBondContact CA-O 3.31Å; R58-I69 PolarHBondContact N-O 2.8Å; R58-I69 PolarHBondContact O-N 3.32Å; V60-I69 HydrophobicContact CG2-CD1 4.03Å; I67-I69 HydrophobicContact CB-CG1 4.42Å; I67-I69 HydrophobicContact CG2-CD1 4.04Å; I67-I69 HydrophobicContact CG2-CG1 3.6Å
70	W	92.4	Very high	86.2	Confident	60 Å²	60	43.1 Å²	43.1	23%	0.227	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	100.5	169.5	-63.3	101.1	0	0	0	109.5	L23 T24 L25 F55 M57 I72 Y85	L23-W70 PolarHBondContact O-N 3.25Å; L23-W70 VanDerWaalsContact O-N 3.09Å; T24-W70 HydrophobicContact CG2-CB 4.44Å; L25-W70 PolarHBondContact N-O 2.88Å; F55-W70 HydrophobicContact CD2-CE3 4.31Å; F55-W70 HydrophobicContact CD2-CZ3 4.06Å; F55-W70 HydrophobicContact CE2-CZ3 4.32Å; M57-W70 HydrophobicContact CB-CD2 4.2Å; M57-W70 HydrophobicContact CB-CE3 3.72Å; M57-W70 HydrophobicContact CB-CH2 3.93Å; M57-W70 HydrophobicContact CB-CZ2 4.38Å; M57-W70 HydrophobicContact CB-CZ3 3.59Å; M57-W70 HydrophobicContact CG-CD2 4.24Å; M57-W70 HydrophobicContact CG-CE3 4.25Å; M57-W70 HydrophobicContact CG-CH2 4.11Å; M57-W70 HydrophobicContact CG-CZ2 4.09Å; M57-W70 HydrophobicContact CG-CZ3 4.2Å; M57-W70 HydrophobicContact SD-CH2 4.41Å; M57-W70 HydrophobicContact SD-CZ2 4.38Å; W70-I72 HydrophobicContact CB-CD1 4.06Å; W70-I72 PolarHBondContact O-N 2.79Å; W70-Y85 HydrophobicContact CB-CD1 4.4Å; W70-Y85 AromaticContact CD2-CD1 3.78Å; W70-Y85 HydrophobicContact CD2-CD1 3.78Å; W70-Y85 HydrophobicContact CD2-CE1 4.15Å; W70-Y85 AromaticContact CE3-CD1 3.65Å; W70-Y85 HydrophobicContact CE3-CD1 3.65Å; W70-Y85 AromaticContact CE3-CE1 3.58Å; W70-Y85 HydrophobicContact CE3-CE1 3.58Å; W70-Y85 HydrophobicContact CG-CD1 4.11Å; W70-Y85 HydrophobicContact CH2-CE1 4.34Å; W70-Y85 HydrophobicContact CZ3-CD1 4.18Å; W70-Y85 AromaticContact CZ3-CE1 3.67Å; W70-Y85 HydrophobicContact CZ3-CE1 3.67Å
71	D	89.4	Confident	86.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	108.1	171.3	178.3	27.6	0	0	0	109.2	K33 T34 V37 T52 F55 N56	K33-D71 WeakPolarHBondContact CB-OD1 3.42Å; T34-D71 WeakPolarHBondContact CB-OD2 3.41Å; T34-D71 PolarHBondContact OG1-OD2 3.1Å; V37-D71 HydrophobicContact CG2-CB 4.41Å; T52-D71 PolarHBondContact OG1-OD2 3.4Å; F55-D71 CarbonylContact C-O 3.56Å; F55-D71 WeakPolarHBondContact CA-O 3.22Å; N56-D71 PolarHBondContact N-O 3.49Å; N56-D71 PolarHBondContact O-N 3.26Å
72	I	89.4	Confident	87.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	138.4	-176.6	-47.1	-60	0	0	0	110.7	T24 L25 V26 K33 F55 W70 G74 M81 W82 Y85	T24-I72 HydrophobicContact CG2-CG1 4.09Å; L25-I72 PolarHBondContact O-N 3.37Å; V26-I72 HydrophobicContact CG1-CB 4.1Å; V26-I72 HydrophobicContact CG1-CG1 4.1Å; K33-I72 WeakPolarHBondContact CE-O 3.18Å; F55-I72 HydrophobicContact CB-CD1 3.56Å; W70-I72 HydrophobicContact CB-CD1 4.06Å; W70-I72 PolarHBondContact O-N 2.79Å; I72-G74 PolarHBondContact O-N 3.35Å; I72-M81 HydrophobicContact CG2-CB 4.36Å; I72-M81 HydrophobicContact CG2-CE 4.3Å; I72-W82 VanDerWaalsContact CG2-CD1 3.49Å; I72-Y85 HydrophobicContact CD1-CD1 4.04Å; I72-Y85 HydrophobicContact CD1-CD2 3.94Å; I72-Y85 HydrophobicContact CD1-CG 3.67Å
73	G	86.3	Confident	88.1	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.204	C	C	.	.			trans	-55.1	136.3	176	0	0	0	0	0	112.8	G54 F78 W82	G54-G73 PolarHBondContact O-N 3.42Å; G73-F78 WeakPolarHBondContact O-CB 3.44Å; G73-W82 PolarHBondContact O-NE1 2.99Å; G73-W82 VanDerWaalsContact O-NE1 3.12Å
74	G	87.7	Confident	88.9	Confident	5 Å²	5	43.4 Å²	43.4	5%	0.052	21%	0.205	C	C	.	.			trans	-89.3	-1.9	-177.3	0	0	0	0	0	115.5	G27 Q29 I72	G27-G74 VanDerWaalsContact O-CA 3.29Å; G27-G74 WeakPolarHBondContact O-CA 3.47Å; Q29-G74 PolarHBondContact N-O 3.44Å; I72-G74 PolarHBondContact O-N 3.35Å
75	Q	88	Confident	89.5	Confident	40 Å²	40	43 Å²	43	19%	0.187	20%	0.199	C	C	.	.	S	Bend	trans	-69.1	147	178.5	-72.3	170.6	10.7	0	0	110.6	R77 F78	Q75-R77 HydrophobicContact CB-CG 4.14Å; Q75-R77 PolarHBondContact O-N 2.79Å; Q75-R77 VanDerWaalsContact O-N 3.1Å; Q75-R77 VanDerWaalsContact OE1-CZ 3.23Å; Q75-F78 HydrophobicContact CB-CD2 3.88Å; Q75-F78 HydrophobicContact CB-CE2 4.31Å; Q75-F78 PolarHBondContact O-N 2.92Å
76	P	88.7	Confident	90.2	Very high	88 Å²	88	42.5 Å²	42.5	57%	0.571	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-48.1	-42.3	179.4	-29.9	35.5	0	0	0	114.2	F78 R79	P76-F78 PolarHBondContact O-N 3.27Å; P76-R79 PolarHBondContact O-N 2.83Å; P76-R79 VanDerWaalsContact O-N 3.13Å
77	R	89.8	Confident	90.5	Very high	156 Å²	156	47.6 Å²	47.6	59%	0.589	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-59.8	-19.2	178.6	66.8	175.5	173.4	171.1	0.1	115.2	Q75	Q75-R77 HydrophobicContact CB-CG 4.14Å; Q75-R77 PolarHBondContact O-N 2.79Å; Q75-R77 VanDerWaalsContact O-N 3.1Å; Q75-R77 VanDerWaalsContact OE1-CZ 3.23Å
78	F	88.8	Confident	90.6	Very high	25 Å²	25	51 Å²	51	11%	0.11	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-103.8	-8.1	-178.3	-62.2	-44.7	0	0	0	113.3	V53 G54 G73 Q75 P76 S80 M81	V53-F78 HydrophobicContact CG1-CE2 4.43Å; V53-F78 HydrophobicContact CG1-CZ 3.89Å; G54-F78 VanDerWaalsContact N-CE2 3.29Å; G73-F78 WeakPolarHBondContact O-CB 3.44Å; Q75-F78 HydrophobicContact CB-CD2 3.88Å; Q75-F78 HydrophobicContact CB-CE2 4.31Å; Q75-F78 PolarHBondContact O-N 2.92Å; P76-F78 PolarHBondContact O-N 3.27Å; F78-S80 VanDerWaalsContact C-N 3.27Å; F78-S80 PolarHBondContact O-N 3.19Å; F78-M81 HydrophobicContact CB-CE 3.52Å; F78-M81 HydrophobicContact CD1-CE 3.31Å; F78-M81 HydrophobicContact CE1-CE 4.28Å; F78-M81 HydrophobicContact CG-CE 3.69Å; F78-M81 VanDerWaalsContact O-CB 3.31Å; F78-M81 WeakPolarHBondContact O-CB 3.32Å; F78-M81 PolarHBondContact O-N 3.05Å
79	R	88.8	Confident	90.9	Very high	63 Å²	63	50 Å²	50	24%	0.238	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-29.4	-175.9	-63	-174.7	-174.9	158.7	1	113.4	L28 P76 M81 W82 E110	L28-R79 VanDerWaalsContact CD2-NH2 3.33Å; P76-R79 PolarHBondContact O-N 2.83Å; P76-R79 VanDerWaalsContact O-N 3.13Å; R79-M81 PolarHBondContact O-N 2.91Å; R79-W82 HydrophobicContact CB-CD2 4.38Å; R79-W82 HydrophobicContact CG-CD2 4.42Å; R79-W82 HydrophobicContact CG-CH2 4.23Å; R79-W82 HydrophobicContact CG-CZ2 3.84Å; R79-W82 VanDerWaalsContact O-CB 3.31Å; R79-W82 WeakPolarHBondContact O-CB 3.49Å; R79-W82 PolarHBondContact O-N 2.93Å; R79-E110 VanDerWaalsContact CD-CD 3.42Å; R79-E110 WeakPolarHBondContact CD-OE1 3.39Å; R79-E110 WeakPolarHBondContact CD-OE2 3.35Å; R79-E110 IonicContact CZ-OE1 3.7Å; R79-E110 IonicContact NE-OE1 2.66Å; R79-E110 IonicContact NH1-OE1 2.64Å; R79-E110 PolarHBondContact NH1-OE1 2.83Å
80	S	88.6	Confident	91	Very high	87 Å²	87	52.1 Å²	52.1	61%	0.608	26%	0.257	S	S	*	.	H	α-helix	trans	-62.3	-20.5	172.7	60	0	0	0	0	113.5	F78	F78-S80 VanDerWaalsContact C-N 3.27Å; F78-S80 PolarHBondContact O-N 3.19Å
81	M	90.3	Very high	91.2	Very high	36 Å²	36	49.2 Å²	49.2	18%	0.177	25%	0.246	C	C	.	.	H	α-helix	trans	-81.1	-23.3	175	-59.7	-172.5	-60.7	0	0	112.2	F55 I72 F78 R79 E83 R84 Y85	F55-M81 HydrophobicContact CD1-SD 4.35Å; I72-M81 HydrophobicContact CG2-CB 4.36Å; I72-M81 HydrophobicContact CG2-CE 4.3Å; F78-M81 HydrophobicContact CB-CE 3.52Å; F78-M81 HydrophobicContact CD1-CE 3.31Å; F78-M81 HydrophobicContact CE1-CE 4.28Å; F78-M81 HydrophobicContact CG-CE 3.69Å; F78-M81 VanDerWaalsContact O-CB 3.31Å; F78-M81 WeakPolarHBondContact O-CB 3.32Å; F78-M81 PolarHBondContact O-N 3.05Å; R79-M81 PolarHBondContact O-N 2.91Å; M81-E83 VanDerWaalsContact C-N 3.32Å; M81-E83 PolarHBondContact O-N 2.91Å; M81-R84 PolarHBondContact O-N 2.88Å; M81-Y85 HydrophobicContact CB-CD2 4.02Å; M81-Y85 HydrophobicContact CB-CE2 4.14Å; M81-Y85 WeakPolarHBondContact O-CD2 3.42Å; M81-Y85 PolarHBondContact O-N 2.81Å
82	W	94.3	Very high	91.7	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.011	25%	0.246	C	C	.	.	H	α-helix	trans	-55.7	-49.1	-175.5	-65.3	7.1	0	0	0	111.3	V26 G27 I72 G73 R79 R84 Y85 C86 Y94 E110 L114	V26-W82 HydrophobicContact CB-CD2 4.08Å; V26-W82 HydrophobicContact CB-CE3 4.31Å; V26-W82 HydrophobicContact CB-CG 4.33Å; V26-W82 HydrophobicContact CG1-CB 4.04Å; V26-W82 HydrophobicContact CG1-CD2 4.01Å; V26-W82 HydrophobicContact CG1-CG 3.73Å; G27-W82 WeakPolarHBondContact O-CZ2 3.31Å; I72-W82 VanDerWaalsContact CG2-CD1 3.49Å; G73-W82 PolarHBondContact O-NE1 2.99Å; G73-W82 VanDerWaalsContact O-NE1 3.12Å; R79-W82 HydrophobicContact CB-CD2 4.38Å; R79-W82 HydrophobicContact CG-CD2 4.42Å; R79-W82 HydrophobicContact CG-CH2 4.23Å; R79-W82 HydrophobicContact CG-CZ2 3.84Å; R79-W82 VanDerWaalsContact O-CB 3.31Å; R79-W82 WeakPolarHBondContact O-CB 3.49Å; R79-W82 PolarHBondContact O-N 2.93Å; W82-R84 VanDerWaalsContact C-N 3.3Å; W82-R84 PolarHBondContact O-N 3.42Å; W82-Y85 PolarHBondContact O-N 3.19Å; W82-C86 WeakPolarHBondContact O-CB 3.27Å; W82-C86 PolarHBondContact O-N 3.3Å; W82-C86 PolarHBondContact O-SG 3.36Å; W82-Y94 HydrophobicContact CZ3-CE2 4.02Å; W82-E110 HydrophobicContact CH2-CB 4.32Å; W82-E110 HydrophobicContact CZ3-CB 3.93Å; W82-L114 HydrophobicContact CB-CD1 3.88Å; W82-L114 HydrophobicContact CE3-CD2 4.32Å
83	E	93.8	Very high	92.1	Very high	42 Å²	42	49.2 Å²	49.2	20%	0.196	25%	0.246	C	C	.	.	H	α-helix	trans	-55.9	-44.9	176.5	-175.8	-169.3	138.6	0	0	111.8	M81 Y85 C86 R87 K117 Q119	M81-E83 VanDerWaalsContact C-N 3.32Å; M81-E83 PolarHBondContact O-N 2.91Å; E83-Y85 PolarHBondContact O-N 3.24Å; E83-C86 PolarHBondContact O-N 3.33Å; E83-R87 WeakPolarHBondContact O-CG 3.2Å; E83-R87 IonicContact OE1-CZ 3.96Å; E83-R87 IonicContact OE1-NE 2.62Å; E83-R87 IonicContact OE1-NH2 3.42Å; E83-R87 PolarHBondContact OE1-NH2 2.85Å; E83-K117 HydrophobicContact CB-CG 4.42Å; E83-K117 HydrophobicContact CG-CB 4.12Å; E83-K117 HydrophobicContact CG-CD 4.39Å; E83-K117 HydrophobicContact CG-CG 3.89Å; E83-K117 WeakPolarHBondContact OE2-CD 3.45Å; E83-K117 WeakPolarHBondContact OE2-CE 3.34Å; E83-Q119 PolarHBondContact OE1-OE1 3.01Å
84	R	92.1	Very high	92.7	Very high	181 Å²	181	49.2 Å²	49.2	68%	0.683	25%	0.246	S	C	*	.	H	α-helix	trans	-64.8	-42.6	-176.6	-63.6	-178	179.5	-170.9	-1.7	112.1	M81 W82	M81-R84 PolarHBondContact O-N 2.88Å; W82-R84 VanDerWaalsContact C-N 3.3Å; W82-R84 PolarHBondContact O-N 3.42Å
85	Y	93.2	Very high	93.2	Very high	58 Å²	58	49 Å²	49	23%	0.227	24%	0.244	C	C	.	.	H	α-helix	trans	-84.2	-14.4	-177.9	-75.1	-89.7	0	0	0	113.4	T24 F55 W70 I72 M81 W82 E83 V89	T24-Y85 PolarHBondContact OG1-O 2.9Å; F55-Y85 HydrophobicContact CD1-CE2 4.34Å; F55-Y85 AromaticContact CD1-CZ 3.99Å; F55-Y85 WeakPolarHBondContact CD1-OH 3.39Å; F55-Y85 HydrophobicContact CD2-CE1 4.11Å; F55-Y85 AromaticContact CD2-CZ 4Å; F55-Y85 VanDerWaalsContact CE1-OH 3.22Å; F55-Y85 WeakPolarHBondContact CE1-OH 3.31Å; F55-Y85 HydrophobicContact CE2-CE1 4.46Å; F55-Y85 WeakPolarHBondContact CE2-OH 3.45Å; F55-Y85 HydrophobicContact CG-CE1 4.32Å; F55-Y85 HydrophobicContact CG-CE2 4.43Å; F55-Y85 AromaticContact CG-CZ 3.89Å; F55-Y85 WeakPolarHBondContact CZ-OH 3.49Å; W70-Y85 HydrophobicContact CB-CD1 4.4Å; W70-Y85 AromaticContact CD2-CD1 3.78Å; W70-Y85 HydrophobicContact CD2-CD1 3.78Å; W70-Y85 HydrophobicContact CD2-CE1 4.15Å; W70-Y85 AromaticContact CE3-CD1 3.65Å; W70-Y85 HydrophobicContact CE3-CD1 3.65Å; W70-Y85 AromaticContact CE3-CE1 3.58Å; W70-Y85 HydrophobicContact CE3-CE1 3.58Å; W70-Y85 HydrophobicContact CG-CD1 4.11Å; W70-Y85 HydrophobicContact CH2-CE1 4.34Å; W70-Y85 HydrophobicContact CZ3-CD1 4.18Å; W70-Y85 AromaticContact CZ3-CE1 3.67Å; W70-Y85 HydrophobicContact CZ3-CE1 3.67Å; I72-Y85 HydrophobicContact CD1-CD1 4.04Å; I72-Y85 HydrophobicContact CD1-CD2 3.94Å; I72-Y85 HydrophobicContact CD1-CG 3.67Å; M81-Y85 HydrophobicContact CB-CD2 4.02Å; M81-Y85 HydrophobicContact CB-CE2 4.14Å; M81-Y85 WeakPolarHBondContact O-CD2 3.42Å; M81-Y85 PolarHBondContact O-N 2.81Å; W82-Y85 PolarHBondContact O-N 3.19Å; E83-Y85 PolarHBondContact O-N 3.24Å; Y85-V89 WeakPolarHBondContact O-CG1 3.35Å
86	C	95.1	Very high	93.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-83.6	-9.1	172.9	-66.7	0	0	0	0	113.2	T24 W82 E83 G88 V89 I92 L120 I123	T24-C86 WeakPolarHBondContact CG2-SG 3.3Å; W82-C86 WeakPolarHBondContact O-CB 3.27Å; W82-C86 PolarHBondContact O-N 3.3Å; W82-C86 PolarHBondContact O-SG 3.36Å; E83-C86 PolarHBondContact O-N 3.33Å; C86-G88 PolarHBondContact O-N 3.12Å; C86-V89 VanDerWaalsContact O-CG2 3.28Å; C86-V89 WeakPolarHBondContact O-CG2 3.17Å; C86-I92 HydrophobicContact CB-CD1 3.89Å; C86-I92 HydrophobicContact CB-CG1 4.12Å; C86-L120 VanDerWaalsContact C-CD2 3.45Å; C86-L120 HydrophobicContact CB-CD1 3.67Å; C86-L120 HydrophobicContact CB-CD2 3.52Å; C86-L120 HydrophobicContact CB-CG 4.27Å; C86-L120 WeakPolarHBondContact O-CD2 3.33Å; C86-I123 VanDerWaalsContact O-CD1 3.28Å; C86-I123 WeakPolarHBondContact O-CD1 3.31Å
87	R	93.7	Very high	94.1	Very high	121 Å²	121	44.2 Å²	44.2	46%	0.457	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	130.7	-178.9	-71.5	173.9	-167.9	-179.2	-0	111.1	E83 V89 Q119 L120	E83-R87 WeakPolarHBondContact O-CG 3.2Å; E83-R87 IonicContact OE1-CZ 3.96Å; E83-R87 IonicContact OE1-NE 2.62Å; E83-R87 IonicContact OE1-NH2 3.42Å; E83-R87 PolarHBondContact OE1-NH2 2.85Å; R87-V89 PolarHBondContact O-N 2.99Å; R87-Q119 HydrophobicContact CG-CB 4Å; R87-L120 HydrophobicContact CG-CD2 3.9Å
88	G	90.3	Very high	94.5	Very high	73 Å²	73	36.8 Å²	36.8	75%	0.753	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	9.1	173.5	0	0	0	0	0	115.1	C86	C86-G88 PolarHBondContact O-N 3.12Å
89	V	95.2	Very high	95	Very high	12 Å²	12	36.2 Å²	36.2	7%	0.073	19%	0.187	C	C	.	.			trans	-77.2	153.3	173.8	-56.2	0	0	0	0	110.8	E22 Y85 C86 R87 A91 I92 I123	E22-V89 WeakPolarHBondContact O-CB 3.43Å; Y85-V89 WeakPolarHBondContact O-CG1 3.35Å; C86-V89 VanDerWaalsContact O-CG2 3.28Å; C86-V89 WeakPolarHBondContact O-CG2 3.17Å; R87-V89 PolarHBondContact O-N 2.99Å; V89-A91 VanDerWaalsContact C-N 3.34Å; V89-A91 VanDerWaalsContact CG2-O 3.3Å; V89-A91 WeakPolarHBondContact CG2-O 3.36Å; V89-I92 HydrophobicContact CG2-CG1 3.99Å; V89-I123 HydrophobicContact CG2-CD1 4.38Å; V89-I123 HydrophobicContact CG2-CG2 3.94Å
90	N	95.8	Very high	95.4	Very high	44 Å²	44	34.8 Å²	34.8	24%	0.235	18%	0.184	C	C	.	.	S	Bend	trans	-68.8	-34.2	174.4	-61.4	93	0	0	0	112	M21 E22 P124	M21-N90 WeakPolarHBondContact CA-OD1 3.32Å; M21-N90 HydrophobicContact CE-CB 3.67Å; M21-N90 HydrophobicContact CG-CB 3.67Å; E22-N90 PolarHBondContact N-OD1 3.14Å; E22-N90 WeakPolarHBondContact O-CB 3.46Å; E22-N90 PolarHBondContact O-N 2.92Å; E22-N90 PolarHBondContact O-OD1 3.09Å; N90-P124 WeakPolarHBondContact O-CD 3.15Å
91	A	96.9	Very high	95.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	152.7	177.8	0	0	0	0	0	112.3	M21 L23 T24 V89 P124 W176 L177	M21-A91 HydrophobicContact CE-CB 3.81Å; L23-A91 VanDerWaalsContact CA-O 3.31Å; L23-A91 WeakPolarHBondContact CA-O 3.37Å; L23-A91 VanDerWaalsContact CB-O 3.3Å; L23-A91 WeakPolarHBondContact CB-O 3.43Å; T24-A91 PolarHBondContact N-O 3.28Å; V89-A91 VanDerWaalsContact C-N 3.34Å; V89-A91 VanDerWaalsContact CG2-O 3.3Å; V89-A91 WeakPolarHBondContact CG2-O 3.36Å; A91-P124 WeakPolarHBondContact CA-O 3.31Å; A91-W176 HydrophobicContact CB-CH2 4.13Å; A91-W176 HydrophobicContact CB-CZ3 3.81Å; A91-L177 HydrophobicContact CB-CD2 4.44Å
92	I	98.1	Very high	96	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.3	169.5	-63.3	167.5	0	0	0	108.2	V26 C86 V89 L115 L120 I123 P124 V125 L126	V26-I92 HydrophobicContact CG2-CG2 3.8Å; C86-I92 HydrophobicContact CB-CD1 3.89Å; C86-I92 HydrophobicContact CB-CG1 4.12Å; V89-I92 HydrophobicContact CG2-CG1 3.99Å; I92-L115 HydrophobicContact CD1-CD2 4.47Å; I92-L120 HydrophobicContact CD1-CD1 4.28Å; I92-I123 HydrophobicContact CD1-CB 4.38Å; I92-I123 HydrophobicContact CD1-CG2 4.08Å; I92-I123 HydrophobicContact CG1-CG2 3.9Å; I92-P124 PolarHBondContact N-O 3.33Å; I92-V125 HydrophobicContact CB-CG2 4.35Å; I92-V125 WeakPolarHBondContact O-CA 3.47Å; I92-L126 PolarHBondContact O-N 3.08Å
93	V	98.3	Very high	96.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	115.2	169.3	-177	0	0	0	0	108.3	L23 T24 L25 V26 L126 L128 L177	L23-V93 HydrophobicContact CD1-CG2 4.04Å; L23-V93 HydrophobicContact CD2-CG2 4.34Å; T24-V93 PolarHBondContact O-N 3.19Å; L25-V93 WeakPolarHBondContact CA-O 3.42Å; L25-V93 HydrophobicContact CD1-CB 3.82Å; L25-V93 HydrophobicContact CD1-CG1 3.54Å; V26-V93 PolarHBondContact N-O 2.94Å; V93-L126 CarbonylContact C-O 3.43Å; V93-L126 WeakPolarHBondContact CA-O 3.48Å; V93-L128 HydrophobicContact CG1-CD1 3.53Å; V93-L128 HydrophobicContact CG1-CG 3.94Å; V93-L177 HydrophobicContact CG2-CD2 3.89Å
94	Y	98.6	Very high	96.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	109	179.7	-167.2	-89.4	0	0	0	110.6	V26 W82 V96 S107 L111 L126 V127 L128	V26-Y94 HydrophobicContact CG2-CD2 3.96Å; V26-Y94 WeakPolarHBondContact O-CA 3.26Å; W82-Y94 HydrophobicContact CZ3-CE2 4.02Å; Y94-V96 HydrophobicContact CD1-CG2 3.71Å; Y94-V96 HydrophobicContact CE1-CG2 3.63Å; Y94-S107 VanDerWaalsContact CE1-OG 3.31Å; Y94-S107 WeakPolarHBondContact CE1-OG 3.28Å; Y94-S107 PolarHBondContact OH-O 2.81Å; Y94-S107 PolarHBondContact OH-OG 2.83Å; Y94-L111 HydrophobicContact CD1-CB 4.37Å; Y94-L111 HydrophobicContact CD1-CD1 4.11Å; Y94-L111 HydrophobicContact CD1-CD2 4.37Å; Y94-L111 HydrophobicContact CD2-CB 4.4Å; Y94-L111 HydrophobicContact CD2-CD1 3.69Å; Y94-L111 HydrophobicContact CE1-CB 3.95Å; Y94-L111 HydrophobicContact CE1-CD1 4.5Å; Y94-L111 HydrophobicContact CE2-CB 3.97Å; Y94-L111 HydrophobicContact CE2-CD1 4.11Å; Y94-L111 HydrophobicContact CG-CD1 3.7Å; Y94-L126 PolarHBondContact N-O 2.99Å; Y94-V127 WeakPolarHBondContact O-CA 3.27Å; Y94-L128 PolarHBondContact O-N 3.09Å
95	M	98.6	Very high	96.5	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.6	-174.9	-168.2	70.9	73.2	0	0	111.7	L25 V26 S31 K33 F36 L128 N130	L25-M95 HydrophobicContact CD1-CB 4.17Å; L25-M95 HydrophobicContact CD1-CE 4.07Å; V26-M95 PolarHBondContact O-N 3.08Å; S31-M95 WeakPolarHBondContact CB-O 3.32Å; S31-M95 WeakPolarHBondContact O-CG 3.47Å; K33-M95 HydrophobicContact CD-CB 4.49Å; K33-M95 HydrophobicContact CG-CB 3.68Å; K33-M95 HydrophobicContact CG-CG 4.11Å; F36-M95 HydrophobicContact CB-CE 3.46Å; F36-M95 VanDerWaalsContact CB-CE 3.46Å; F36-M95 HydrophobicContact CD1-CE 4.08Å; F36-M95 HydrophobicContact CD2-CE 3.98Å; F36-M95 HydrophobicContact CG-CE 3.57Å; M95-L128 HydrophobicContact CE-CB 4.2Å; M95-L128 HydrophobicContact CE-CD1 3.85Å; M95-L128 HydrophobicContact SD-CB 3.65Å; M95-L128 HydrophobicContact SD-CD1 4.41Å; M95-N130 HydrophobicContact CG-CB 4.37Å; M95-N130 HydrophobicContact SD-CB 3.49Å; M95-N130 WeakPolarHBondContact SD-CB 3.49Å
96	V	98.4	Very high	96.7	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.1	177.2	-175.2	0	0	0	0	109.2	Y94 A98 V127 L128 N130 L143 L147	Y94-V96 HydrophobicContact CD1-CG2 3.71Å; Y94-V96 HydrophobicContact CE1-CG2 3.63Å; V96-A98 PolarHBondContact O-N 2.96Å; V96-V127 HydrophobicContact CG2-CG1 4.25Å; V96-L128 PolarHBondContact N-O 3.11Å; V96-N130 PolarHBondContact O-N 2.89Å; V96-L143 HydrophobicContact CG1-CD2 4.19Å; V96-L147 HydrophobicContact CG2-CD1 3.98Å
97	D	98.2	Very high	96.8	Very high	24 Å²	24	42.5 Å²	42.5	13%	0.128	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	104.6	165.3	-172.2	-21.7	0	0	0	108.3	A99 D100 K131	D97-A99 PolarHBondContact O-N 3.24Å; D97-A99 WeakPolarHBondContact OD1-CB 3.36Å; D97-A99 PolarHBondContact OD1-N 2.84Å; D97-D100 HydrophobicContact CB-CB 3.93Å; D97-D100 PolarHBondContact O-N 2.85Å; D97-D100 PolarHBondContact OD1-N 2.88Å; D97-K131 WeakPolarHBondContact OD1-CD 3.43Å; D97-K131 VanDerWaalsContact OD2-CE 3.23Å; D97-K131 WeakPolarHBondContact OD2-CE 3.49Å; D97-K131 IonicContact OD2-NZ 2.81Å; D97-K131 PolarHBondContact OD2-NZ 2.67Å
98	A	98.3	Very high	97.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-69.7	-20.9	-177.9	0	0	0	0	0	112.3	V96 N130 A137 L138 L143	V96-A98 PolarHBondContact O-N 2.96Å; A98-N130 VanDerWaalsContact CB-O 3.27Å; A98-N130 WeakPolarHBondContact CB-O 3.49Å; A98-N130 PolarHBondContact N-O 3.27Å; A98-A137 HydrophobicContact CB-CB 4.18Å; A98-A137 CarbonylContact O-C 3.6Å; A98-A137 WeakPolarHBondContact O-CA 3.38Å; A98-L138 HydrophobicContact CB-CB 4.38Å; A98-L138 WeakPolarHBondContact O-CG 3.4Å; A98-L138 PolarHBondContact O-N 3.48Å; A98-L143 HydrophobicContact CB-CD1 4.35Å
99	A	97.9	Very high	97.4	Very high	14 Å²	14	40.2 Å²	40.2	12%	0.116	20%	0.195	C	C	.	.	S	Bend	trans	-86.9	-21.5	-178.3	0	0	0	0	0	113.1	D97 R101 K131 L134 S136 A137	D97-A99 PolarHBondContact O-N 3.24Å; D97-A99 WeakPolarHBondContact OD1-CB 3.36Å; D97-A99 PolarHBondContact OD1-N 2.84Å; A99-R101 PolarHBondContact O-N 2.85Å; A99-K131 HydrophobicContact CB-CB 4.39Å; A99-L134 HydrophobicContact CB-CB 3.8Å; A99-L134 HydrophobicContact CB-CD1 3.54Å; A99-L134 HydrophobicContact CB-CG 4.27Å; A99-S136 WeakPolarHBondContact CB-OG 3.35Å; A99-S136 PolarHBondContact O-OG 3.19Å; A99-S136 VanDerWaalsContact O-OG 3.08Å; A99-A137 HydrophobicContact CB-CB 4.47Å
100	D	97.1	Very high	97.6	Very high	32 Å²	32	41.6 Å²	41.6	17%	0.171	20%	0.2	C	C	.	.			trans	-92.4	78.6	178.2	-170.6	-15.5	0	0	0	111.7	D97 E102 K103 V104	D97-D100 HydrophobicContact CB-CB 3.93Å; D97-D100 PolarHBondContact O-N 2.85Å; D97-D100 PolarHBondContact OD1-N 2.88Å; D100-E102 PolarHBondContact O-N 2.85Å; D100-K103 PolarHBondContact O-N 3.31Å; D100-K103 PolarHBondContact OD1-N 3.33Å; D100-K103 WeakPolarHBondContact OD2-CD 3.3Å; D100-K103 VanDerWaalsContact OD2-CE 3.28Å; D100-K103 WeakPolarHBondContact OD2-CE 3.31Å; D100-K103 WeakPolarHBondContact OD2-CG 3.46Å; D100-K103 IonicContact OD2-NZ 2.83Å; D100-K103 PolarHBondContact OD2-NZ 3.47Å; D100-V104 WeakPolarHBondContact O-CG2 3.3Å
101	R	95.3	Very high	97.7	Very high	129 Å²	129	39.5 Å²	39.5	49%	0.487	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-27.8	-175.3	-63.5	-176.5	180	-162.2	-2.8	113.9	A99 K103 V104 S136 L138	A99-R101 PolarHBondContact O-N 2.85Å; R101-K103 VanDerWaalsContact C-N 3.31Å; R101-V104 PolarHBondContact O-N 3.1Å; R101-S136 PolarHBondContact NE-O 3.07Å; R101-S136 PolarHBondContact NH2-O 3.16Å; R101-L138 HydrophobicContact CG-CD2 4.34Å; R101-L138 HydrophobicContact CG-CG 4.42Å
102	E	96.4	Very high	97.7	Very high	180 Å²	180	41.4 Å²	41.4	84%	0.841	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-33.9	-179.9	-63.4	-176.7	173.6	0	0	111.4	D100	D100-E102 PolarHBondContact O-N 2.85Å
103	K	96.3	Very high	97.7	Very high	87 Å²	87	45.5 Å²	45.5	38%	0.378	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.8	-179.2	-65.6	-169.5	-167.5	120.1	0	114.4	L28 D100 R101 E105 A106 S107	L28-K103 HydrophobicContact CD1-CB 3.97Å; D100-K103 PolarHBondContact O-N 3.31Å; D100-K103 PolarHBondContact OD1-N 3.33Å; D100-K103 WeakPolarHBondContact OD2-CD 3.3Å; D100-K103 VanDerWaalsContact OD2-CE 3.28Å; D100-K103 WeakPolarHBondContact OD2-CE 3.31Å; D100-K103 WeakPolarHBondContact OD2-CG 3.46Å; D100-K103 IonicContact OD2-NZ 2.83Å; D100-K103 PolarHBondContact OD2-NZ 3.47Å; R101-K103 VanDerWaalsContact C-N 3.31Å; K103-E105 VanDerWaalsContact C-N 3.33Å; K103-E105 PolarHBondContact O-N 2.91Å; K103-A106 PolarHBondContact O-N 2.88Å; K103-S107 WeakPolarHBondContact O-CB 3.44Å; K103-S107 PolarHBondContact O-N 2.79Å
104	V	96.9	Very high	97.7	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.03	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-41.1	-177.6	174.5	0	0	0	0	111.7	D100 R101 S107 R108 L138 K146 L147	D100-V104 WeakPolarHBondContact O-CG2 3.3Å; R101-V104 PolarHBondContact O-N 3.1Å; V104-S107 WeakPolarHBondContact O-CB 3.47Å; V104-S107 PolarHBondContact O-N 3.09Å; V104-R108 PolarHBondContact O-N 2.78Å; V104-L138 HydrophobicContact CG1-CD1 4.38Å; V104-L138 HydrophobicContact CG2-CD1 3.76Å; V104-K146 HydrophobicContact CG1-CB 3.71Å; V104-K146 HydrophobicContact CG1-CD 4.28Å; V104-L147 HydrophobicContact CG1-CD2 4.01Å
105	E	97.6	Very high	97.6	Very high	122 Å²	122	46.2 Å²	46.2	57%	0.57	22%	0.224	S	C	*	.	H	α-helix	trans	-65.1	-44.1	177.6	-176.9	175.5	-167.5	0	0	111.9	K103 S107 R108 N109	K103-E105 VanDerWaalsContact C-N 3.33Å; K103-E105 PolarHBondContact O-N 2.91Å; E105-S107 VanDerWaalsContact C-N 3.26Å; E105-S107 PolarHBondContact O-N 3.3Å; E105-R108 WeakPolarHBondContact O-CB 3.28Å; E105-R108 PolarHBondContact O-N 3.06Å; E105-R108 IonicContact OE1-NH2 3.94Å; E105-N109 VanDerWaalsContact O-CG 3.26Å; E105-N109 PolarHBondContact O-N 3.42Å; E105-N109 PolarHBondContact O-ND2 3.12Å; E105-N109 PolarHBondContact O-OD1 3.38Å
106	A	97.3	Very high	97.5	Very high	45 Å²	45	51.9 Å²	51.9	37%	0.372	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-38.7	174.5	0	0	0	0	0	111.2	L28 K103 N109 E110	L28-A106 HydrophobicContact CD1-CB 4.26Å; K103-A106 PolarHBondContact O-N 2.88Å; A106-N109 PolarHBondContact O-N 3.03Å; A106-E110 WeakPolarHBondContact O-CG 3.44Å; A106-E110 PolarHBondContact O-N 3.25Å; A106-E110 VanDerWaalsContact O-N 3.13Å
107	S	98.1	Very high	97.5	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.014	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-42.5	176.7	-154.7	0	0	0	0	111.5	Y94 K103 V104 E105 N109 E110 L111	Y94-S107 VanDerWaalsContact CE1-OG 3.31Å; Y94-S107 WeakPolarHBondContact CE1-OG 3.28Å; Y94-S107 PolarHBondContact OH-O 2.81Å; Y94-S107 PolarHBondContact OH-OG 2.83Å; K103-S107 WeakPolarHBondContact O-CB 3.44Å; K103-S107 PolarHBondContact O-N 2.79Å; V104-S107 WeakPolarHBondContact O-CB 3.47Å; V104-S107 PolarHBondContact O-N 3.09Å; E105-S107 VanDerWaalsContact C-N 3.26Å; E105-S107 PolarHBondContact O-N 3.3Å; S107-N109 PolarHBondContact O-N 3.43Å; S107-E110 PolarHBondContact O-N 3.21Å; S107-L111 PolarHBondContact O-N 3.22Å
108	R	98.4	Very high	97.3	Very high	79 Å²	79	58.9 Å²	58.9	30%	0.298	29%	0.293	S	S	.	.	H	α-helix	trans	-54.2	-53.8	173.1	-179.9	-169.8	72.4	178	-2.6	110.5	V104 E105 E110 L111 H112 K146 L147	V104-R108 PolarHBondContact O-N 2.78Å; E105-R108 WeakPolarHBondContact O-CB 3.28Å; E105-R108 PolarHBondContact O-N 3.06Å; E105-R108 IonicContact OE1-NH2 3.94Å; R108-E110 VanDerWaalsContact C-N 3.26Å; R108-E110 PolarHBondContact O-N 2.95Å; R108-L111 WeakPolarHBondContact O-CB 3.12Å; R108-L111 PolarHBondContact O-N 2.97Å; R108-L111 VanDerWaalsContact O-N 3.09Å; R108-H112 PolarHBondContact O-CD2 3.33Å; R108-H112 VanDerWaalsContact O-CD2 3.24Å; R108-H112 PolarHBondContact O-N 3.1Å; R108-K146 WeakPolarHBondContact CD-O 3.37Å; R108-L147 HydrophobicContact CB-CD2 4.02Å; R108-L147 WeakPolarHBondContact CG-O 3.44Å
109	N	98	Very high	97.1	Very high	67 Å²	67	63.4 Å²	63.4	36%	0.358	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-39.4	-175.2	-61.6	-14.4	0	0	0	111.2	E105 A106 S107 N113	E105-N109 VanDerWaalsContact O-CG 3.26Å; E105-N109 PolarHBondContact O-N 3.42Å; E105-N109 PolarHBondContact O-ND2 3.12Å; E105-N109 PolarHBondContact O-OD1 3.38Å; A106-N109 PolarHBondContact O-N 3.03Å; S107-N109 PolarHBondContact O-N 3.43Å; N109-N113 VanDerWaalsContact O-CB 3.24Å; N109-N113 WeakPolarHBondContact O-CB 3.12Å; N109-N113 PolarHBondContact O-N 3.46Å; N109-N113 PolarHBondContact O-ND2 3.48Å
110	E	98	Very high	97.1	Very high	41 Å²	41	62.8 Å²	62.8	19%	0.192	31%	0.308	C	S	.	.	H	α-helix	trans	-69.9	-34.5	175.8	-69.2	-63.8	169.1	0	0	113.8	L28 R79 W82 A106 S107 R108 L114	L28-E110 HydrophobicContact CD2-CG 4.2Å; R79-E110 VanDerWaalsContact CD-CD 3.42Å; R79-E110 WeakPolarHBondContact CD-OE1 3.39Å; R79-E110 WeakPolarHBondContact CD-OE2 3.35Å; R79-E110 IonicContact CZ-OE1 3.7Å; R79-E110 IonicContact NE-OE1 2.66Å; R79-E110 IonicContact NH1-OE1 2.64Å; R79-E110 PolarHBondContact NH1-OE1 2.83Å; W82-E110 HydrophobicContact CH2-CB 4.32Å; W82-E110 HydrophobicContact CZ3-CB 3.93Å; A106-E110 WeakPolarHBondContact O-CG 3.44Å; A106-E110 PolarHBondContact O-N 3.25Å; A106-E110 VanDerWaalsContact O-N 3.13Å; S107-E110 PolarHBondContact O-N 3.21Å; R108-E110 VanDerWaalsContact C-N 3.26Å; R108-E110 PolarHBondContact O-N 2.95Å; E110-L114 WeakPolarHBondContact O-CB 3.36Å; E110-L114 PolarHBondContact O-N 3.46Å; E110-L114 VanDerWaalsContact O-N 3.1Å
111	L	98.4	Very high	97	Very high	0 Å²	0	68 Å²	68	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-53.9	172.7	174.7	61.2	0	0	0	110.4	Y94 S107 R108 N113 L114 L115 V127 L149 I152	Y94-L111 HydrophobicContact CD1-CB 4.37Å; Y94-L111 HydrophobicContact CD1-CD1 4.11Å; Y94-L111 HydrophobicContact CD1-CD2 4.37Å; Y94-L111 HydrophobicContact CD2-CB 4.4Å; Y94-L111 HydrophobicContact CD2-CD1 3.69Å; Y94-L111 HydrophobicContact CE1-CB 3.95Å; Y94-L111 HydrophobicContact CE1-CD1 4.5Å; Y94-L111 HydrophobicContact CE2-CB 3.97Å; Y94-L111 HydrophobicContact CE2-CD1 4.11Å; Y94-L111 HydrophobicContact CG-CD1 3.7Å; S107-L111 PolarHBondContact O-N 3.22Å; R108-L111 WeakPolarHBondContact O-CB 3.12Å; R108-L111 PolarHBondContact O-N 2.97Å; R108-L111 VanDerWaalsContact O-N 3.09Å; L111-N113 PolarHBondContact O-N 2.77Å; L111-L114 WeakPolarHBondContact O-CB 3.23Å; L111-L114 PolarHBondContact O-N 3.09Å; L111-L114 VanDerWaalsContact O-N 3.12Å; L111-L115 HydrophobicContact CD1-CD1 3.72Å; L111-L115 HydrophobicContact CD1-CD2 4.46Å; L111-L115 HydrophobicContact CD1-CG 3.99Å; L111-L115 HydrophobicContact CG-CD1 4.09Å; L111-L115 WeakPolarHBondContact O-CG 3.46Å; L111-L115 PolarHBondContact O-N 2.91Å; L111-V127 HydrophobicContact CD2-CG2 4.33Å; L111-L149 HydrophobicContact CD2-CD2 3.6Å; L111-I152 HydrophobicContact CD2-CD1 4.41Å
112	H	98.4	Very high	97	Very high	39 Å²	39	63.9 Å²	63.9	18%	0.181	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-44.7	-179.1	-75.7	-99	0	0	0	111.4	R108 L114 L115 D116 L147 N148	R108-H112 PolarHBondContact O-CD2 3.33Å; R108-H112 VanDerWaalsContact O-CD2 3.24Å; R108-H112 PolarHBondContact O-N 3.1Å; H112-L114 PolarHBondContact O-N 3.28Å; H112-L115 PolarHBondContact O-N 3Å; H112-L115 VanDerWaalsContact O-N 3.09Å; H112-D116 WeakPolarHBondContact O-CB 3.46Å; H112-D116 VanDerWaalsContact O-CG 3.27Å; H112-D116 PolarHBondContact O-N 3.5Å; H112-L147 PolarHBondContact NE2-O 3.13Å; H112-N148 PolarHBondContact CE1-O 3.12Å
113	N	97.4	Very high	97.1	Very high	86 Å²	86	56.2 Å²	56.2	46%	0.46	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-32.8	174.8	-75.2	-17.9	0	0	0	113.8	N109 L111 K117	N109-N113 VanDerWaalsContact O-CB 3.24Å; N109-N113 WeakPolarHBondContact O-CB 3.12Å; N109-N113 PolarHBondContact O-N 3.46Å; N109-N113 PolarHBondContact O-ND2 3.48Å; L111-N113 PolarHBondContact O-N 2.77Å; N113-K117 WeakPolarHBondContact O-CE 3.4Å
114	L	97.5	Very high	97.2	Very high	8 Å²	8	53.3 Å²	53.3	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-73.9	-43.7	175.8	179	66.3	0	0	0	110.9	V26 W82 E110 L111 H112 D116 K117 L120	V26-L114 HydrophobicContact CG2-CD2 3.91Å; W82-L114 HydrophobicContact CB-CD1 3.88Å; W82-L114 HydrophobicContact CE3-CD2 4.32Å; E110-L114 WeakPolarHBondContact O-CB 3.36Å; E110-L114 PolarHBondContact O-N 3.46Å; E110-L114 VanDerWaalsContact O-N 3.1Å; L111-L114 WeakPolarHBondContact O-CB 3.23Å; L111-L114 PolarHBondContact O-N 3.09Å; L111-L114 VanDerWaalsContact O-N 3.12Å; H112-L114 PolarHBondContact O-N 3.28Å; L114-D116 VanDerWaalsContact C-N 3.33Å; L114-K117 VanDerWaalsContact O-CB 3.32Å; L114-K117 WeakPolarHBondContact O-CB 3.24Å; L114-K117 WeakPolarHBondContact O-CG 3.5Å; L114-K117 PolarHBondContact O-N 2.7Å; L114-L120 HydrophobicContact CD1-CD1 3.57Å; L114-L120 HydrophobicContact CG-CD1 3.92Å; L114-L120 WeakPolarHBondContact O-CD1 3.45Å
115	L	97.6	Very high	97.3	Very high	8 Å²	8	53.1 Å²	53.1	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-75.5	-22.9	-176.2	-59.1	-177.1	0	0	0	113.1	I92 L111 H112 K117 V125 I152 R155	I92-L115 HydrophobicContact CD1-CD2 4.47Å; L111-L115 HydrophobicContact CD1-CD1 3.72Å; L111-L115 HydrophobicContact CD1-CD2 4.46Å; L111-L115 HydrophobicContact CD1-CG 3.99Å; L111-L115 HydrophobicContact CG-CD1 4.09Å; L111-L115 WeakPolarHBondContact O-CG 3.46Å; L111-L115 PolarHBondContact O-N 2.91Å; H112-L115 PolarHBondContact O-N 3Å; H112-L115 VanDerWaalsContact O-N 3.09Å; L115-K117 PolarHBondContact O-N 2.92Å; L115-K117 VanDerWaalsContact O-N 3.14Å; L115-V125 HydrophobicContact CD1-CG2 4.25Å; L115-V125 HydrophobicContact CD2-CG2 3.65Å; L115-I152 HydrophobicContact CD1-CD1 3.54Å; L115-I152 HydrophobicContact CD1-CG1 4.16Å; L115-I152 HydrophobicContact CD1-CG2 4.12Å; L115-R155 PolarHBondContact O-NH2 2.62Å
116	D	96.7	Very high	97.3	Very high	118 Å²	118	47.3 Å²	47.3	63%	0.631	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-9.1	170.9	-76	-9.5	0	0	0	113.5	H112 L114 P118	H112-D116 WeakPolarHBondContact O-CB 3.46Å; H112-D116 VanDerWaalsContact O-CG 3.27Å; H112-D116 PolarHBondContact O-N 3.5Å; L114-D116 VanDerWaalsContact C-N 3.33Å; D116-P118 VanDerWaalsContact O-CD 3.31Å; D116-P118 WeakPolarHBondContact O-CD 3.37Å
117	K	96.6	Very high	97.4	Very high	79 Å²	79	45.1 Å²	45.1	34%	0.343	24%	0.238	S	C	.	.			trans	-74	118.5	179.2	-58.6	-55.4	-177	-168	0	110.4	E83 N113 L114 L115 Q119 L120	E83-K117 HydrophobicContact CB-CG 4.42Å; E83-K117 HydrophobicContact CG-CB 4.12Å; E83-K117 HydrophobicContact CG-CD 4.39Å; E83-K117 HydrophobicContact CG-CG 3.89Å; E83-K117 WeakPolarHBondContact OE2-CD 3.45Å; E83-K117 WeakPolarHBondContact OE2-CE 3.34Å; N113-K117 WeakPolarHBondContact O-CE 3.4Å; L114-K117 VanDerWaalsContact O-CB 3.32Å; L114-K117 WeakPolarHBondContact O-CB 3.24Å; L114-K117 WeakPolarHBondContact O-CG 3.5Å; L114-K117 PolarHBondContact O-N 2.7Å; L115-K117 PolarHBondContact O-N 2.92Å; L115-K117 VanDerWaalsContact O-N 3.14Å; K117-Q119 PolarHBondContact O-N 2.88Å; K117-Q119 VanDerWaalsContact O-N 3.08Å; K117-L120 HydrophobicContact CB-CD1 4.19Å; K117-L120 HydrophobicContact CB-CG 4.04Å; K117-L120 PolarHBondContact O-N 3Å
118	P	95.1	Very high	97.4	Very high	96 Å²	96	45 Å²	45	62%	0.623	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-58.9	-28.8	-177.8	-25.5	34.8	0	0	0	113.5	D116 L120 Q121	D116-P118 VanDerWaalsContact O-CD 3.31Å; D116-P118 WeakPolarHBondContact O-CD 3.37Å; P118-L120 PolarHBondContact O-N 3.32Å; P118-Q121 WeakPolarHBondContact O-CB 3.33Å; P118-Q121 PolarHBondContact O-N 3.43Å
119	Q	94.9	Very high	97.4	Very high	95 Å²	95	41.3 Å²	41.3	44%	0.444	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-70.4	-11.5	179.6	-53.2	82.7	7	0	0	113.3	E83 R87 K117	E83-Q119 PolarHBondContact OE1-OE1 3.01Å; R87-Q119 HydrophobicContact CG-CB 4Å; K117-Q119 PolarHBondContact O-N 2.88Å; K117-Q119 VanDerWaalsContact O-N 3.08Å
120	L	96.8	Very high	97.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-108.4	7.3	-180	-52.8	-171.8	0	0	0	112.4	C86 R87 I92 L114 K117 P118 G122 I123 R155	C86-L120 VanDerWaalsContact C-CD2 3.45Å; C86-L120 HydrophobicContact CB-CD1 3.67Å; C86-L120 HydrophobicContact CB-CD2 3.52Å; C86-L120 HydrophobicContact CB-CG 4.27Å; C86-L120 WeakPolarHBondContact O-CD2 3.33Å; R87-L120 HydrophobicContact CG-CD2 3.9Å; I92-L120 HydrophobicContact CD1-CD1 4.28Å; L114-L120 HydrophobicContact CD1-CD1 3.57Å; L114-L120 HydrophobicContact CG-CD1 3.92Å; L114-L120 WeakPolarHBondContact O-CD1 3.45Å; K117-L120 HydrophobicContact CB-CD1 4.19Å; K117-L120 HydrophobicContact CB-CG 4.04Å; K117-L120 PolarHBondContact O-N 3Å; P118-L120 PolarHBondContact O-N 3.32Å; L120-G122 PolarHBondContact O-N 3.49Å; L120-I123 HydrophobicContact CB-CD1 4.31Å; L120-I123 HydrophobicContact CD2-CD1 4.15Å; L120-I123 WeakPolarHBondContact O-CG1 3.36Å; L120-I123 PolarHBondContact O-N 3.31Å; L120-R155 PolarHBondContact O-NH1 3.26Å
121	Q	95.7	Very high	97.4	Very high	142 Å²	142	38.9 Å²	38.9	66%	0.664	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	136.7	-176.6	-171.4	177.2	2.2	0	0	111.4	P118 I123	P118-Q121 WeakPolarHBondContact O-CB 3.33Å; P118-Q121 PolarHBondContact O-N 3.43Å; Q121-I123 PolarHBondContact O-N 2.94Å
122	G	95.6	Very high	97.4	Very high	43 Å²	43	44.4 Å²	44.4	44%	0.443	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	-8.6	176.8	0	0	0	0	0	115.9	L120 P124	L120-G122 PolarHBondContact O-N 3.49Å; G122-P124 WeakPolarHBondContact O-CD 3.45Å
123	I	97.6	Very high	97.3	Very high	18 Å²	18	45.2 Å²	45.2	9%	0.092	24%	0.236	C	C	.	.			trans	-67.9	123.5	177.1	-57.4	178.5	0	0	0	109.3	C86 V89 I92 L120 Q121 R155	C86-I123 VanDerWaalsContact O-CD1 3.28Å; C86-I123 WeakPolarHBondContact O-CD1 3.31Å; V89-I123 HydrophobicContact CG2-CD1 4.38Å; V89-I123 HydrophobicContact CG2-CG2 3.94Å; I92-I123 HydrophobicContact CD1-CB 4.38Å; I92-I123 HydrophobicContact CD1-CG2 4.08Å; I92-I123 HydrophobicContact CG1-CG2 3.9Å; L120-I123 HydrophobicContact CB-CD1 4.31Å; L120-I123 HydrophobicContact CD2-CD1 4.15Å; L120-I123 WeakPolarHBondContact O-CG1 3.36Å; L120-I123 PolarHBondContact O-N 3.31Å; Q121-I123 PolarHBondContact O-N 2.94Å; I123-R155 WeakPolarHBondContact O-CD 3.39Å
124	P	98.1	Very high	97.3	Very high	27 Å²	27	44.5 Å²	44.5	18%	0.175	23%	0.231	C	C	.	.			trans	-58.1	142.8	177	-25.5	34.7	0	0	0	112.9	N90 A91 I92 G122 E156 W176	N90-P124 WeakPolarHBondContact O-CD 3.15Å; A91-P124 WeakPolarHBondContact CA-O 3.31Å; I92-P124 PolarHBondContact N-O 3.33Å; G122-P124 WeakPolarHBondContact O-CD 3.45Å; P124-E156 WeakPolarHBondContact CA-O 3.34Å; P124-E156 HydrophobicContact CB-CB 4.31Å; P124-W176 HydrophobicContact CB-CH2 3.79Å; P124-W176 HydrophobicContact CB-CZ2 4.18Å
125	V	98.5	Very high	97.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	126.6	-178.6	-179.2	0	0	0	0	110.9	I92 L115 V127 E156 I157 C158	I92-V125 HydrophobicContact CB-CG2 4.35Å; I92-V125 WeakPolarHBondContact O-CA 3.47Å; L115-V125 HydrophobicContact CD1-CG2 4.25Å; L115-V125 HydrophobicContact CD2-CG2 3.65Å; V125-V127 HydrophobicContact CG1-CG2 4.09Å; V125-E156 PolarHBondContact N-O 3.08Å; V125-I157 HydrophobicContact CB-CD1 4.31Å; V125-I157 HydrophobicContact CB-CG1 4.1Å; V125-I157 HydrophobicContact CG1-CD1 4.23Å; V125-I157 HydrophobicContact CG1-CG1 4.28Å; V125-I157 VanDerWaalsContact O-CA 3.32Å; V125-I157 WeakPolarHBondContact O-CA 3.31Å; V125-C158 PolarHBondContact O-N 3.22Å
126	L	98.6	Very high	97	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	112.3	168.2	-178.3	62.8	0	0	0	110	I92 V93 Y94 L128 C158 Y160 T173 W176	I92-L126 PolarHBondContact O-N 3.08Å; V93-L126 CarbonylContact C-O 3.43Å; V93-L126 WeakPolarHBondContact CA-O 3.48Å; Y94-L126 PolarHBondContact N-O 2.99Å; L126-L128 HydrophobicContact CD1-CD2 4.26Å; L126-L128 HydrophobicContact CD2-CD2 3.91Å; L126-L128 HydrophobicContact CD2-CG 4.43Å; L126-L128 HydrophobicContact CG-CD2 3.82Å; L126-L128 HydrophobicContact CG-CG 4.24Å; L126-C158 HydrophobicContact CD1-CB 3.85Å; L126-Y160 HydrophobicContact CD1-CD2 3.82Å; L126-Y160 HydrophobicContact CD1-CE2 3.94Å; L126-Y160 HydrophobicContact CD1-CG 4.43Å; L126-T173 HydrophobicContact CD2-CG2 3.9Å; L126-W176 HydrophobicContact CB-CD2 4.32Å; L126-W176 HydrophobicContact CB-CE3 3.84Å; L126-W176 HydrophobicContact CB-CH2 3.93Å; L126-W176 HydrophobicContact CB-CZ2 4.4Å; L126-W176 HydrophobicContact CB-CZ3 3.63Å; L126-W176 HydrophobicContact CD1-CD2 4.21Å; L126-W176 HydrophobicContact CD1-CE3 4.46Å; L126-W176 HydrophobicContact CD1-CG 4.45Å; L126-W176 HydrophobicContact CD2-CD2 4.13Å; L126-W176 HydrophobicContact CD2-CE3 3.71Å; L126-W176 HydrophobicContact CD2-CZ3 4.3Å; L126-W176 HydrophobicContact CG-CD2 4.46Å; L126-W176 HydrophobicContact CG-CE3 4.22Å; L126-W176 HydrophobicContact CG-CZ3 4.5Å
127	V	98.8	Very high	97.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	123.6	174.2	-178.3	0	0	0	0	109.3	Y94 V96 L111 V125 L147 L149 I157 C158 C159 Y160	Y94-V127 WeakPolarHBondContact O-CA 3.27Å; V96-V127 HydrophobicContact CG2-CG1 4.25Å; L111-V127 HydrophobicContact CD2-CG2 4.33Å; V125-V127 HydrophobicContact CG1-CG2 4.09Å; V127-L147 HydrophobicContact CG1-CD1 3.71Å; V127-L149 HydrophobicContact CB-CD1 4.24Å; V127-L149 HydrophobicContact CG1-CD1 4.45Å; V127-L149 HydrophobicContact CG2-CD1 4Å; V127-L149 HydrophobicContact CG2-CD2 4.15Å; V127-I157 HydrophobicContact CG2-CD1 4.23Å; V127-I157 HydrophobicContact CG2-CG1 4.36Å; V127-C158 PolarHBondContact N-O 3.47Å; V127-C159 HydrophobicContact CB-CB 4.25Å; V127-C159 CarbonylContact O-C 3.59Å; V127-C159 VanDerWaalsContact O-CA 3.28Å; V127-C159 WeakPolarHBondContact O-CA 3.45Å; V127-Y160 PolarHBondContact O-N 3.34Å
128	L	98.8	Very high	97.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	110.9	177.1	-62.1	-177.3	0	0	0	110	F36 V93 Y94 M95 V96 L126 N130 Y160 V162 T173	F36-L128 HydrophobicContact CD2-CD1 4.33Å; F36-L128 HydrophobicContact CE2-CD1 3.91Å; F36-L128 HydrophobicContact CZ-CD1 4.04Å; V93-L128 HydrophobicContact CG1-CD1 3.53Å; V93-L128 HydrophobicContact CG1-CG 3.94Å; Y94-L128 PolarHBondContact O-N 3.09Å; M95-L128 HydrophobicContact CE-CB 4.2Å; M95-L128 HydrophobicContact CE-CD1 3.85Å; M95-L128 HydrophobicContact SD-CB 3.65Å; M95-L128 HydrophobicContact SD-CD1 4.41Å; V96-L128 PolarHBondContact N-O 3.11Å; L126-L128 HydrophobicContact CD1-CD2 4.26Å; L126-L128 HydrophobicContact CD2-CD2 3.91Å; L126-L128 HydrophobicContact CD2-CG 4.43Å; L126-L128 HydrophobicContact CG-CD2 3.82Å; L126-L128 HydrophobicContact CG-CG 4.24Å; L128-N130 PolarHBondContact O-N 2.81Å; L128-Y160 WeakPolarHBondContact CA-O 3.23Å; L128-Y160 HydrophobicContact CD2-CD2 4.38Å; L128-V162 HydrophobicContact CB-CG2 4.17Å; L128-V162 HydrophobicContact CD2-CG1 4.01Å; L128-T173 HydrophobicContact CD1-CG2 3.78Å; L128-T173 HydrophobicContact CD2-CG2 4.03Å
129	G	98.6	Very high	97.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	91.6	168.3	0	0	0	0	0	110.5	Y160 S161 V162	G129-Y160 PolarHBondContact N-O 3.12Å; G129-S161 WeakPolarHBondContact O-CA 3.44Å; G129-V162 PolarHBondContact O-N 3.02Å
130	N	98.3	Very high	97.2	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	166.5	-175.9	-174.2	36.1	0	0	0	112.7	S31 M95 V96 A98 L128 V162 C164	S31-N130 PolarHBondContact O-ND2 2.77Å; M95-N130 HydrophobicContact CG-CB 4.37Å; M95-N130 HydrophobicContact SD-CB 3.49Å; M95-N130 WeakPolarHBondContact SD-CB 3.49Å; V96-N130 PolarHBondContact O-N 2.89Å; A98-N130 VanDerWaalsContact CB-O 3.27Å; A98-N130 WeakPolarHBondContact CB-O 3.49Å; A98-N130 PolarHBondContact N-O 3.27Å; L128-N130 PolarHBondContact O-N 2.81Å; N130-V162 CarbonylContact C-O 3.57Å; N130-V162 VanDerWaalsContact CA-O 3.31Å; N130-V162 WeakPolarHBondContact CA-O 3.31Å; N130-V162 HydrophobicContact CB-CG2 3.98Å; N130-C164 PolarHBondContact OD1-N 3.3Å; N130-C164 PolarHBondContact OD1-SG 2.84Å
131	K	97.6	Very high	97.3	Very high	54 Å²	54	51.1 Å²	51.1	24%	0.235	27%	0.272	C	S	.	.			trans	68.9	33.4	-177.1	-43.8	-170.3	-167.3	172.5	0	113.7	Y30 D97 A99 D133 L134 A137 V162	Y30-K131 VanDerWaalsContact O-CE 3.31Å; Y30-K131 WeakPolarHBondContact O-CE 3.44Å; Y30-K131 PolarHBondContact O-NZ 3.22Å; D97-K131 WeakPolarHBondContact OD1-CD 3.43Å; D97-K131 VanDerWaalsContact OD2-CE 3.23Å; D97-K131 WeakPolarHBondContact OD2-CE 3.49Å; D97-K131 IonicContact OD2-NZ 2.81Å; D97-K131 PolarHBondContact OD2-NZ 2.67Å; A99-K131 HydrophobicContact CB-CB 4.39Å; K131-D133 WeakPolarHBondContact CA-OD1 3.39Å; K131-D133 PolarHBondContact O-N 2.82Å; K131-D133 VanDerWaalsContact O-N 3.11Å; K131-L134 HydrophobicContact CB-CD1 3.94Å; K131-L134 HydrophobicContact CB-CG 4.27Å; K131-L134 HydrophobicContact CD-CD1 4.11Å; K131-L134 WeakPolarHBondContact O-CB 3.33Å; K131-L134 PolarHBondContact O-N 2.99Å; K131-A137 WeakPolarHBondContact O-CB 3.3Å; K131-V162 PolarHBondContact N-O 3.03Å; K131-V162 VanDerWaalsContact N-O 3.16Å
132	R	97.3	Very high	97.4	Very high	116 Å²	116	47.7 Å²	47.7	44%	0.438	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-24.3	174	-172.9	-173.5	-174.4	-173.5	7.6	113.5	L134 S161 V162 D168 N169	R132-L134 PolarHBondContact O-N 3.03Å; R132-S161 VanDerWaalsContact CD-OG 3.26Å; R132-S161 WeakPolarHBondContact CD-OG 3.01Å; R132-S161 WeakPolarHBondContact CG-OG 3.42Å; R132-V162 VanDerWaalsContact CB-O 3.28Å; R132-V162 WeakPolarHBondContact CB-O 3.35Å; R132-V162 PolarHBondContact N-O 3.22Å; R132-V162 VanDerWaalsContact N-O 3.07Å; R132-D168 WeakPolarHBondContact CD-OD2 3.47Å; R132-D168 IonicContact CZ-OD2 3.72Å; R132-D168 IonicContact NE-OD2 2.7Å; R132-D168 IonicContact NH1-OD2 3.44Å; R132-D168 PolarHBondContact NH1-OD2 2.57Å; R132-N169 PolarHBondContact NH1-ND2 3.23Å
133	D	96.8	Very high	97.5	Very high	56 Å²	56	45.6 Å²	45.6	30%	0.299	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18	174.9	53.5	-76.9	0	0	0	113.9	K131 S163 E166	K131-D133 WeakPolarHBondContact CA-OD1 3.39Å; K131-D133 PolarHBondContact O-N 2.82Å; K131-D133 VanDerWaalsContact O-N 3.11Å; D133-S163 WeakPolarHBondContact OD1-CB 3.29Å; D133-S163 PolarHBondContact OD1-OG 3.18Å; D133-E166 HydrophobicContact CB-CG 3.82Å
134	L	97	Very high	97.5	Very high	70 Å²	70	47.7 Å²	47.7	37%	0.366	25%	0.245	S	C	.	.	S	Bend	trans	-86.7	138.5	179.9	-61.7	179.5	0	0	0	111.9	A99 K131 R132 S136 A137	A99-L134 HydrophobicContact CB-CB 3.8Å; A99-L134 HydrophobicContact CB-CD1 3.54Å; A99-L134 HydrophobicContact CB-CG 4.27Å; K131-L134 HydrophobicContact CB-CD1 3.94Å; K131-L134 HydrophobicContact CB-CG 4.27Å; K131-L134 HydrophobicContact CD-CD1 4.11Å; K131-L134 WeakPolarHBondContact O-CB 3.33Å; K131-L134 PolarHBondContact O-N 2.99Å; R132-L134 PolarHBondContact O-N 3.03Å; L134-S136 PolarHBondContact O-N 3.3Å; L134-S136 VanDerWaalsContact O-N 3.09Å; L134-A137 WeakPolarHBondContact O-CB 3.48Å; L134-A137 PolarHBondContact O-N 2.88Å
135	P	94.9	Very high	97.5	Very high	137 Å²	137	53.6 Å²	53.6	89%	0.89	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-25.5	-177.2	-25.6	33.7	0	0	0	115.5	A137	P135-A137 VanDerWaalsContact C-N 3.31Å
136	S	95.5	Very high	97.5	Very high	53 Å²	53	58.3 Å²	58.3	37%	0.371	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-5.6	179	60.5	0	0	0	0	113.7	A99 R101 L134 L138	A99-S136 WeakPolarHBondContact CB-OG 3.35Å; A99-S136 PolarHBondContact O-OG 3.19Å; A99-S136 VanDerWaalsContact O-OG 3.08Å; R101-S136 PolarHBondContact NE-O 3.07Å; R101-S136 PolarHBondContact NH2-O 3.16Å; L134-S136 PolarHBondContact O-N 3.3Å; L134-S136 VanDerWaalsContact O-N 3.09Å; S136-L138 PolarHBondContact O-N 3.04Å
137	A	97.8	Very high	97.5	Very high	20 Å²	20	58.3 Å²	58.3	17%	0.165	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-59.7	134.9	-174	0	0	0	0	0	112.4	A98 A99 K131 L134 P135	A98-A137 HydrophobicContact CB-CB 4.18Å; A98-A137 CarbonylContact O-C 3.6Å; A98-A137 WeakPolarHBondContact O-CA 3.38Å; A99-A137 HydrophobicContact CB-CB 4.47Å; K131-A137 WeakPolarHBondContact O-CB 3.3Å; L134-A137 WeakPolarHBondContact O-CB 3.48Å; L134-A137 PolarHBondContact O-N 2.88Å; P135-A137 VanDerWaalsContact C-N 3.31Å
138	L	97.8	Very high	97.5	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-71.6	138.1	170	-61.7	172.5	0	0	0	110	A98 R101 V104 S136 Q142 L143 K146	A98-L138 HydrophobicContact CB-CB 4.38Å; A98-L138 WeakPolarHBondContact O-CG 3.4Å; A98-L138 PolarHBondContact O-N 3.48Å; R101-L138 HydrophobicContact CG-CD2 4.34Å; R101-L138 HydrophobicContact CG-CG 4.42Å; V104-L138 HydrophobicContact CG1-CD1 4.38Å; V104-L138 HydrophobicContact CG2-CD1 3.76Å; S136-L138 PolarHBondContact O-N 3.04Å; L138-Q142 HydrophobicContact CB-CB 4.08Å; L138-Q142 HydrophobicContact CD2-CB 4.06Å; L138-L143 HydrophobicContact CB-CD2 4.19Å; L138-L143 HydrophobicContact CB-CG 3.93Å; L138-L143 HydrophobicContact CD1-CD2 4.11Å; L138-K146 HydrophobicContact CD1-CD 3.59Å; L138-K146 HydrophobicContact CD2-CD 4.05Å; L138-K146 HydrophobicContact CG-CD 4.49Å
139	D	96.1	Very high	97.5	Very high	75 Å²	75	61.9 Å²	61.9	40%	0.401	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-76	173.7	168.9	70.8	32.6	0	0	0	111.7	K141 Q142 L143	D139-K141 VanDerWaalsContact C-N 3.32Å; D139-K141 PolarHBondContact O-N 3.02Å; D139-K141 PolarHBondContact OD1-N 3.18Å; D139-Q142 VanDerWaalsContact N-OE1 3.09Å; D139-Q142 PolarHBondContact O-N 3.38Å; D139-Q142 WeakPolarHBondContact OD1-CB 3.27Å; D139-Q142 VanDerWaalsContact OD1-CG 3.31Å; D139-Q142 WeakPolarHBondContact OD1-CG 3.23Å; D139-Q142 PolarHBondContact OD1-N 3.42Å; D139-L143 WeakPolarHBondContact O-CG 3.31Å; D139-L143 PolarHBondContact O-N 2.87Å
140	E	95.8	Very high	97.4	Very high	88 Å²	88	65.8 Å²	65.8	41%	0.411	34%	0.338	S	S	.	.	H	α-helix	trans	-57.1	-42.2	-178.8	-171.1	-172.4	136.7	0	0	112.9	L143 I144 C159	E140-L143 PolarHBondContact O-N 3.45Å; E140-I144 HydrophobicContact CG-CD1 4.12Å; E140-I144 VanDerWaalsContact O-CG1 3.29Å; E140-I144 WeakPolarHBondContact O-CG1 3.2Å; E140-I144 PolarHBondContact O-N 2.9Å; E140-C159 HydrophobicContact CG-CB 4.32Å; E140-C159 VanDerWaalsContact CG-O 3.31Å; E140-C159 WeakPolarHBondContact CG-O 3.38Å
141	K	97.3	Very high	97.4	Very high	168 Å²	168	68.2 Å²	68.2	73%	0.73	36%	0.359	S	S	*	.	H	α-helix	trans	-67.1	-43.3	-178.6	-67.6	-177.9	178.7	179	0	111	D139 L143 I144 E145	D139-K141 VanDerWaalsContact C-N 3.32Å; D139-K141 PolarHBondContact O-N 3.02Å; D139-K141 PolarHBondContact OD1-N 3.18Å; K141-L143 VanDerWaalsContact C-N 3.31Å; K141-L143 PolarHBondContact O-N 3.4Å; K141-I144 PolarHBondContact O-N 2.62Å; K141-E145 PolarHBondContact O-N 2.97Å
142	Q	98.1	Very high	97.4	Very high	70 Å²	70	66.5 Å²	66.5	33%	0.327	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-35.8	176.8	-69	175.3	-31.7	0	0	112.1	L138 D139 K146	L138-Q142 HydrophobicContact CB-CB 4.08Å; L138-Q142 HydrophobicContact CD2-CB 4.06Å; D139-Q142 VanDerWaalsContact N-OE1 3.09Å; D139-Q142 PolarHBondContact O-N 3.38Å; D139-Q142 WeakPolarHBondContact OD1-CB 3.27Å; D139-Q142 VanDerWaalsContact OD1-CG 3.31Å; D139-Q142 WeakPolarHBondContact OD1-CG 3.23Å; D139-Q142 PolarHBondContact OD1-N 3.42Å; Q142-K146 VanDerWaalsContact O-CB 3.27Å; Q142-K146 WeakPolarHBondContact O-CB 3.19Å; Q142-K146 WeakPolarHBondContact O-CG 3.35Å; Q142-K146 PolarHBondContact O-N 3.04Å
143	L	98.3	Very high	97.4	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-66.5	-46	173.8	-75.4	162.5	0	0	0	111.5	V96 A98 L138 D139 E140 K141 E145 K146 L147	V96-L143 HydrophobicContact CG1-CD2 4.19Å; A98-L143 HydrophobicContact CB-CD1 4.35Å; L138-L143 HydrophobicContact CB-CD2 4.19Å; L138-L143 HydrophobicContact CB-CG 3.93Å; L138-L143 HydrophobicContact CD1-CD2 4.11Å; D139-L143 WeakPolarHBondContact O-CG 3.31Å; D139-L143 PolarHBondContact O-N 2.87Å; E140-L143 PolarHBondContact O-N 3.45Å; K141-L143 VanDerWaalsContact C-N 3.31Å; K141-L143 PolarHBondContact O-N 3.4Å; L143-E145 VanDerWaalsContact C-N 3.28Å; L143-E145 PolarHBondContact O-N 3.43Å; L143-K146 PolarHBondContact O-N 3.09Å; L143-L147 HydrophobicContact CB-CD1 4.42Å; L143-L147 HydrophobicContact CD2-CD1 4.2Å; L143-L147 WeakPolarHBondContact O-CB 3.35Å; L143-L147 VanDerWaalsContact O-CG 3.3Å; L143-L147 WeakPolarHBondContact O-CG 3.26Å; L143-L147 PolarHBondContact O-N 2.89Å
144	I	98.4	Very high	97.3	Very high	61 Å²	61	70.2 Å²	70.2	31%	0.313	38%	0.375	S	S	.	.	H	α-helix	trans	-55	-46.6	176.2	-71.5	163.1	0	0	0	110.7	E140 K141 N148 L149 C159	E140-I144 HydrophobicContact CG-CD1 4.12Å; E140-I144 VanDerWaalsContact O-CG1 3.29Å; E140-I144 WeakPolarHBondContact O-CG1 3.2Å; E140-I144 PolarHBondContact O-N 2.9Å; K141-I144 PolarHBondContact O-N 2.62Å; I144-N148 PolarHBondContact O-N 2.8Å; I144-N148 VanDerWaalsContact O-N 3.17Å; I144-L149 HydrophobicContact CG1-CD1 4.07Å; I144-L149 HydrophobicContact CG2-CB 4.4Å; I144-L149 PolarHBondContact O-N 2.72Å; I144-C159 HydrophobicContact CD1-CB 4.39Å; I144-C159 HydrophobicContact CG1-CB 3.94Å
145	E	98.3	Very high	97.4	Very high	151 Å²	151	68 Å²	68	71%	0.706	36%	0.362	S	S	*	.	H	α-helix	trans	-67	-54.6	178.8	-173.7	-176.4	176.5	0	0	112	K141 L143 L147 N148	K141-E145 PolarHBondContact O-N 2.97Å; L143-E145 VanDerWaalsContact C-N 3.28Å; L143-E145 PolarHBondContact O-N 3.43Å; E145-L147 VanDerWaalsContact C-N 3.33Å; E145-L147 PolarHBondContact O-N 3.18Å; E145-N148 PolarHBondContact O-N 3.39Å
146	K	98.3	Very high	97.5	Very high	99 Å²	99	66.3 Å²	66.3	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-68.4	-30.2	-174.3	-76.4	178	169.6	-77.6	0	113.5	V104 R108 L138 Q142 L143 N148	V104-K146 HydrophobicContact CG1-CB 3.71Å; V104-K146 HydrophobicContact CG1-CD 4.28Å; R108-K146 WeakPolarHBondContact CD-O 3.37Å; L138-K146 HydrophobicContact CD1-CD 3.59Å; L138-K146 HydrophobicContact CD2-CD 4.05Å; L138-K146 HydrophobicContact CG-CD 4.49Å; Q142-K146 VanDerWaalsContact O-CB 3.27Å; Q142-K146 WeakPolarHBondContact O-CB 3.19Å; Q142-K146 WeakPolarHBondContact O-CG 3.35Å; Q142-K146 PolarHBondContact O-N 3.04Å; L143-K146 PolarHBondContact O-N 3.09Å; K146-N148 VanDerWaalsContact C-N 3.29Å
147	L	98.6	Very high	97.6	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-1.3	173.8	-59.3	172.1	0	0	0	112.3	V96 V104 R108 H112 V127 L143 E145 L149	V96-L147 HydrophobicContact CG2-CD1 3.98Å; V104-L147 HydrophobicContact CG1-CD2 4.01Å; R108-L147 HydrophobicContact CB-CD2 4.02Å; R108-L147 WeakPolarHBondContact CG-O 3.44Å; H112-L147 PolarHBondContact NE2-O 3.13Å; V127-L147 HydrophobicContact CG1-CD1 3.71Å; L143-L147 HydrophobicContact CB-CD1 4.42Å; L143-L147 HydrophobicContact CD2-CD1 4.2Å; L143-L147 WeakPolarHBondContact O-CB 3.35Å; L143-L147 VanDerWaalsContact O-CG 3.3Å; L143-L147 WeakPolarHBondContact O-CG 3.26Å; L143-L147 PolarHBondContact O-N 2.89Å; E145-L147 VanDerWaalsContact C-N 3.33Å; E145-L147 PolarHBondContact O-N 3.18Å; L147-L149 VanDerWaalsContact C-N 3.27Å; L147-L149 HydrophobicContact CB-CD2 3.51Å; L147-L149 HydrophobicContact CB-CG 3.87Å; L147-L149 HydrophobicContact CD1-CD2 4.34Å; L147-L149 PolarHBondContact O-N 3.39Å
148	N	98.3	Very high	97.7	Very high	67 Å²	67	66.3 Å²	66.3	36%	0.358	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	47.1	-178.5	-169.5	30.5	0	0	0	112.2	H112 I144 E145 K146 S150 A151	H112-N148 PolarHBondContact CE1-O 3.12Å; I144-N148 PolarHBondContact O-N 2.8Å; I144-N148 VanDerWaalsContact O-N 3.17Å; E145-N148 PolarHBondContact O-N 3.39Å; K146-N148 VanDerWaalsContact C-N 3.29Å; N148-S150 PolarHBondContact O-N 3.25Å; N148-A151 VanDerWaalsContact ND2-CB 3.33Å; N148-A151 WeakPolarHBondContact ND2-CB 3.48Å; N148-A151 PolarHBondContact O-N 3.47Å
149	L	98.3	Very high	97.7	Very high	8 Å²	8	66.5 Å²	66.5	4%	0.042	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-67.8	-26.3	-174.4	-57.2	-172.4	0	0	0	112	L111 V127 I144 L147 A151 I152 I157 C159	L111-L149 HydrophobicContact CD2-CD2 3.6Å; V127-L149 HydrophobicContact CB-CD1 4.24Å; V127-L149 HydrophobicContact CG1-CD1 4.45Å; V127-L149 HydrophobicContact CG2-CD1 4Å; V127-L149 HydrophobicContact CG2-CD2 4.15Å; I144-L149 HydrophobicContact CG1-CD1 4.07Å; I144-L149 HydrophobicContact CG2-CB 4.4Å; I144-L149 PolarHBondContact O-N 2.72Å; L147-L149 VanDerWaalsContact C-N 3.27Å; L147-L149 HydrophobicContact CB-CD2 3.51Å; L147-L149 HydrophobicContact CB-CG 3.87Å; L147-L149 HydrophobicContact CD1-CD2 4.34Å; L147-L149 PolarHBondContact O-N 3.39Å; L149-A151 PolarHBondContact O-N 3.36Å; L149-I152 HydrophobicContact CD2-CD1 4.24Å; L149-I152 WeakPolarHBondContact O-CB 3.42Å; L149-I152 PolarHBondContact O-N 2.86Å; L149-I152 VanDerWaalsContact O-N 3.08Å; L149-I157 HydrophobicContact CB-CD1 4.31Å; L149-I157 HydrophobicContact CD2-CD1 3.95Å; L149-I157 HydrophobicContact CG-CD1 4.49Å; L149-C159 HydrophobicContact CD1-CB 3.82Å
150	S	97.1	Very high	97.8	Very high	82 Å²	82	65.3 Å²	65.3	57%	0.573	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-63.8	-19.5	176.1	49.9	0	0	0	0	114.5	N148 I152	N148-S150 PolarHBondContact O-N 3.25Å; S150-I152 VanDerWaalsContact C-N 3.3Å
151	A	97.6	Very high	97.9	Very high	56 Å²	56	61.4 Å²	61.4	46%	0.463	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-77.9	-16.4	175.3	0	0	0	0	0	112.9	N148 L149 Q153	N148-A151 VanDerWaalsContact ND2-CB 3.33Å; N148-A151 WeakPolarHBondContact ND2-CB 3.48Å; N148-A151 PolarHBondContact O-N 3.47Å; L149-A151 PolarHBondContact O-N 3.36Å; A151-Q153 PolarHBondContact O-N 3.22Å
152	I	97.9	Very high	97.9	Very high	17 Å²	17	53.4 Å²	53.4	9%	0.087	28%	0.275	C	S	.	.			trans	-87.9	105.5	178.4	-60.1	159.2	0	0	0	107.6	L111 L115 L149 S150 R155 I157	L111-I152 HydrophobicContact CD2-CD1 4.41Å; L115-I152 HydrophobicContact CD1-CD1 3.54Å; L115-I152 HydrophobicContact CD1-CG1 4.16Å; L115-I152 HydrophobicContact CD1-CG2 4.12Å; L149-I152 HydrophobicContact CD2-CD1 4.24Å; L149-I152 WeakPolarHBondContact O-CB 3.42Å; L149-I152 PolarHBondContact O-N 2.86Å; L149-I152 VanDerWaalsContact O-N 3.08Å; S150-I152 VanDerWaalsContact C-N 3.3Å; I152-R155 HydrophobicContact CG2-CG 3.77Å; I152-I157 HydrophobicContact CB-CD1 4.33Å; I152-I157 HydrophobicContact CD1-CD1 3.56Å; I152-I157 HydrophobicContact CG2-CD1 4.3Å
153	Q	96.5	Very high	97.9	Very high	173 Å²	173	50.1 Å²	50.1	81%	0.808	26%	0.26	S	S	*	.			trans	-120.3	-1.2	-175.5	-60.6	-166.8	-14.7	0	0	113.7	A151	A151-Q153 PolarHBondContact O-N 3.22Å
154	D	96.4	Very high	97.8	Very high	78 Å²	78	50.2 Å²	50.2	42%	0.417	26%	0.261	S	S	.	.	S	Bend	trans	-91.2	2	-174.4	72.9	-37.3	0	0	0	113.8
155	R	97.6	Very high	97.5	Very high	24 Å²	24	51.8 Å²	51.8	9%	0.091	27%	0.265	C	S	.	.	S	Bend	trans	-159.7	164.5	-175.5	64.8	-165.7	69.1	-145.9	3.1	111.3	L115 L120 I123 I152	L115-R155 PolarHBondContact O-NH2 2.62Å; L120-R155 PolarHBondContact O-NH1 3.26Å; I123-R155 WeakPolarHBondContact O-CD 3.39Å; I152-R155 HydrophobicContact CG2-CG 3.77Å
156	E	97.8	Very high	97.4	Very high	100 Å²	100	50.4 Å²	50.4	47%	0.467	26%	0.259	S	S	.	.			trans	-66.8	132.1	165.2	-178.8	174.5	162.9	0	0	110.1	P124 V125 W176 H180	P124-E156 WeakPolarHBondContact CA-O 3.34Å; P124-E156 HydrophobicContact CB-CB 4.31Å; V125-E156 PolarHBondContact N-O 3.08Å; E156-W176 PolarHBondContact OE1-NE1 3.3Å; E156-H180 IonicContact OE1-CE1 3.75Å; E156-H180 PolarHBondContact OE1-CE1 3.34Å; E156-H180 IonicContact OE1-NE2 3.25Å; E156-H180 PolarHBondContact OE1-NE2 3.1Å; E156-H180 IonicContact OE2-NE2 3.21Å; E156-H180 PolarHBondContact OE2-NE2 2.86Å
157	I	98.1	Very high	97.2	Very high	46 Å²	46	50.9 Å²	50.9	24%	0.236	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	130.7	173.5	-168.3	161.1	0	0	0	110.6	V125 V127 L149 I152	V125-I157 HydrophobicContact CB-CD1 4.31Å; V125-I157 HydrophobicContact CB-CG1 4.1Å; V125-I157 HydrophobicContact CG1-CD1 4.23Å; V125-I157 HydrophobicContact CG1-CG1 4.28Å; V125-I157 VanDerWaalsContact O-CA 3.32Å; V125-I157 WeakPolarHBondContact O-CA 3.31Å; V127-I157 HydrophobicContact CG2-CD1 4.23Å; V127-I157 HydrophobicContact CG2-CG1 4.36Å; L149-I157 HydrophobicContact CB-CD1 4.31Å; L149-I157 HydrophobicContact CD2-CD1 3.95Å; L149-I157 HydrophobicContact CG-CD1 4.49Å; I152-I157 HydrophobicContact CB-CD1 4.33Å; I152-I157 HydrophobicContact CD1-CD1 3.56Å; I152-I157 HydrophobicContact CG2-CD1 4.3Å
158	C	98.1	Very high	97.1	Very high	28 Å²	28	53.7 Å²	53.7	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.6	176.6	-172.2	0	0	0	0	109.7	V125 L126 V127 Y160 W176	V125-C158 PolarHBondContact O-N 3.22Å; L126-C158 HydrophobicContact CD1-CB 3.85Å; V127-C158 PolarHBondContact N-O 3.47Å; C158-Y160 WeakPolarHBondContact SG-CE1 3.31Å; C158-Y160 VanDerWaalsContact SG-CZ 3.54Å; C158-W176 HydrophobicContact CB-CZ2 4.47Å
159	C	98.6	Very high	97	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.041	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	129.7	177.6	-171.5	0	0	0	0	110.3	V127 E140 I144 L149	V127-C159 HydrophobicContact CB-CB 4.25Å; V127-C159 CarbonylContact O-C 3.59Å; V127-C159 VanDerWaalsContact O-CA 3.28Å; V127-C159 WeakPolarHBondContact O-CA 3.45Å; E140-C159 HydrophobicContact CG-CB 4.32Å; E140-C159 VanDerWaalsContact CG-O 3.31Å; E140-C159 WeakPolarHBondContact CG-O 3.38Å; I144-C159 HydrophobicContact CD1-CB 4.39Å; I144-C159 HydrophobicContact CG1-CB 3.94Å; L149-C159 HydrophobicContact CD1-CB 3.82Å
160	Y	98.4	Very high	96.8	Very high	50 Å²	50	52.6 Å²	52.6	20%	0.196	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.4	171.5	-62.3	-35	0	0	0	111.1	L126 V127 L128 G129 C158 I172 W176	L126-Y160 HydrophobicContact CD1-CD2 3.82Å; L126-Y160 HydrophobicContact CD1-CE2 3.94Å; L126-Y160 HydrophobicContact CD1-CG 4.43Å; V127-Y160 PolarHBondContact O-N 3.34Å; L128-Y160 WeakPolarHBondContact CA-O 3.23Å; L128-Y160 HydrophobicContact CD2-CD2 4.38Å; G129-Y160 PolarHBondContact N-O 3.12Å; C158-Y160 WeakPolarHBondContact SG-CE1 3.31Å; C158-Y160 VanDerWaalsContact SG-CZ 3.54Å; Y160-I172 HydrophobicContact CD1-CD1 4.14Å; Y160-I172 HydrophobicContact CD2-CD1 4.13Å; Y160-I172 HydrophobicContact CD2-CG1 4.18Å; Y160-I172 HydrophobicContact CE1-CD1 4.34Å; Y160-I172 HydrophobicContact CE2-CD1 4.31Å; Y160-I172 HydrophobicContact CE2-CG1 4.27Å; Y160-I172 HydrophobicContact CG-CD1 4.07Å; Y160-W176 HydrophobicContact CE2-CB 4.12Å; Y160-W176 HydrophobicContact CE2-CG 4.49Å
161	S	97.9	Very high	96.5	Very high	5 Å²	5	52.9 Å²	52.9	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.7	165.4	-169.9	0	0	0	0	109.2	G129 R132 N169	G129-S161 WeakPolarHBondContact O-CA 3.44Å; R132-S161 VanDerWaalsContact CD-OG 3.26Å; R132-S161 WeakPolarHBondContact CD-OG 3.01Å; R132-S161 WeakPolarHBondContact CG-OG 3.42Å; S161-N169 WeakPolarHBondContact O-CB 3.35Å; S161-N169 PolarHBondContact O-ND2 3.24Å
162	V	98	Very high	96.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.255	C	S	.	.			trans	-133.8	158.1	-172.7	-56.3	0	0	0	0	111.8	L128 G129 N130 K131 R132 N169 I170	L128-V162 HydrophobicContact CB-CG2 4.17Å; L128-V162 HydrophobicContact CD2-CG1 4.01Å; G129-V162 PolarHBondContact O-N 3.02Å; N130-V162 CarbonylContact C-O 3.57Å; N130-V162 VanDerWaalsContact CA-O 3.31Å; N130-V162 WeakPolarHBondContact CA-O 3.31Å; N130-V162 HydrophobicContact CB-CG2 3.98Å; K131-V162 PolarHBondContact N-O 3.03Å; K131-V162 VanDerWaalsContact N-O 3.16Å; R132-V162 VanDerWaalsContact CB-O 3.28Å; R132-V162 WeakPolarHBondContact CB-O 3.35Å; R132-V162 PolarHBondContact N-O 3.22Å; R132-V162 VanDerWaalsContact N-O 3.07Å; V162-N169 HydrophobicContact CB-CB 4.46Å; V162-N169 HydrophobicContact CG1-CB 3.88Å; V162-I170 HydrophobicContact CB-CD1 4.38Å
163	S	97.4	Very high	96.1	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.014	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-125.9	113.5	164	177.1	0	0	0	0	109.6	D133 K165 E166 K167 D168	D133-S163 WeakPolarHBondContact OD1-CB 3.29Å; D133-S163 PolarHBondContact OD1-OG 3.18Å; S163-K165 PolarHBondContact O-N 2.97Å; S163-K165 PolarHBondContact OG-N 2.98Å; S163-E166 PolarHBondContact OG-N 3.29Å; S163-K167 CarbonylContact O-C 3.57Å; S163-K167 WeakPolarHBondContact O-CA 3.47Å; S163-K167 PolarHBondContact O-N 2.64Å; S163-D168 PolarHBondContact N-O 3.05Å; S163-D168 VanDerWaalsContact N-O 3.1Å; S163-D168 PolarHBondContact O-N 2.68Å
164	C	95.3	Very high	95.9	Very high	2 Å²	2	44 Å²	44	1%	0.014	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-29.6	170.4	-64.1	0	0	0	0	112.1	T35 V39 N130	T35-C164 HydrophobicContact CG2-CB 3.78Å; V39-C164 HydrophobicContact CG2-CB 4.32Å; V39-C164 WeakPolarHBondContact CG2-O 3.39Å; N130-C164 PolarHBondContact OD1-N 3.3Å; N130-C164 PolarHBondContact OD1-SG 2.84Å
165	K	93.9	Very high	95.6	Very high	93 Å²	93	46.2 Å²	46.2	40%	0.404	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-53.3	-179.1	180	-179.7	172.2	178	0	110.9	F45 S163 K167	F45-K165 HydrophobicContact CE1-CG 4.07Å; F45-K165 HydrophobicContact CE2-CB 4.3Å; F45-K165 HydrophobicContact CZ-CB 4.28Å; F45-K165 HydrophobicContact CZ-CG 4.19Å; S163-K165 PolarHBondContact O-N 2.97Å; S163-K165 PolarHBondContact OG-N 2.98Å; K165-K167 VanDerWaalsContact C-N 3.31Å
166	E	94.6	Very high	95.4	Very high	122 Å²	122	45.7 Å²	45.7	57%	0.57	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-2.7	-178.7	-57.1	-54.9	146.3	0	0	113	D133 S163 D168	D133-E166 HydrophobicContact CB-CG 3.82Å; S163-E166 PolarHBondContact OG-N 3.29Å; E166-D168 PolarHBondContact O-N 3.37Å
167	K	94.4	Very high	95.2	Very high	109 Å²	109	41 Å²	41	47%	0.474	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	26.7	-175.7	-53.3	174.8	179	171.7	0	113.7	V39 G43 S163 K165 I170	V39-K167 HydrophobicContact CG1-CG 4.13Å; G43-K167 VanDerWaalsContact O-CE 3.26Å; G43-K167 WeakPolarHBondContact O-CE 3.35Å; G43-K167 PolarHBondContact O-NZ 2.87Å; S163-K167 CarbonylContact O-C 3.57Å; S163-K167 WeakPolarHBondContact O-CA 3.47Å; S163-K167 PolarHBondContact O-N 2.64Å; K165-K167 VanDerWaalsContact C-N 3.31Å; K167-I170 HydrophobicContact CB-CG1 4.41Å
168	D	95.9	Very high	94.7	Very high	60 Å²	60	41.3 Å²	41.3	32%	0.321	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-72.5	133.3	176.5	-172.2	28.7	0	0	0	111	R132 S163 E166 I170	R132-D168 WeakPolarHBondContact CD-OD2 3.47Å; R132-D168 IonicContact CZ-OD2 3.72Å; R132-D168 IonicContact NE-OD2 2.7Å; R132-D168 IonicContact NH1-OD2 3.44Å; R132-D168 PolarHBondContact NH1-OD2 2.57Å; S163-D168 PolarHBondContact N-O 3.05Å; S163-D168 VanDerWaalsContact N-O 3.1Å; S163-D168 PolarHBondContact O-N 2.68Å; E166-D168 PolarHBondContact O-N 3.37Å; D168-I170 PolarHBondContact O-N 2.83Å; D168-I170 VanDerWaalsContact O-N 3.12Å
169	N	96.5	Very high	94.3	Very high	39 Å²	39	46.9 Å²	46.9	21%	0.209	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	16.2	179.9	-71.4	-24.6	0	0	0	116.5	R132 S161 V162 D171 I172 T173	R132-N169 PolarHBondContact NH1-ND2 3.23Å; S161-N169 WeakPolarHBondContact O-CB 3.35Å; S161-N169 PolarHBondContact O-ND2 3.24Å; V162-N169 HydrophobicContact CB-CB 4.46Å; V162-N169 HydrophobicContact CG1-CB 3.88Å; N169-D171 VanDerWaalsContact C-N 3.31Å; N169-I172 HydrophobicContact CB-CD1 3.79Å; N169-I172 HydrophobicContact CB-CG1 3.83Å; N169-I172 VanDerWaalsContact O-CG1 3.24Å; N169-I172 WeakPolarHBondContact O-CG1 3.22Å; N169-T173 WeakPolarHBondContact O-CB 3.4Å; N169-T173 PolarHBondContact O-N 2.95Å; N169-T173 PolarHBondContact O-OG1 3.48Å
170	I	93.9	Very high	93.9	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.067	23%	0.227	C	C	.	.	H	α-helix	trans	-71.3	-30.2	175	-57.4	-58.6	0	0	0	111.4	F36 V39 I40 V162 K167 D168 T173 L174	F36-I170 HydrophobicContact CD2-CD1 4.07Å; F36-I170 HydrophobicContact CE2-CD1 4.09Å; V39-I170 HydrophobicContact CG1-CG1 4.39Å; V39-I170 HydrophobicContact CG1-CG2 4.3Å; I40-I170 HydrophobicContact CG2-CG2 3.85Å; V162-I170 HydrophobicContact CB-CD1 4.38Å; K167-I170 HydrophobicContact CB-CG1 4.41Å; D168-I170 PolarHBondContact O-N 2.83Å; D168-I170 VanDerWaalsContact O-N 3.12Å; I170-T173 WeakPolarHBondContact O-CB 3.22Å; I170-L174 HydrophobicContact CG2-CD1 4.22Å; I170-L174 VanDerWaalsContact O-CG 3.31Å; I170-L174 WeakPolarHBondContact O-CG 3.45Å; I170-L174 PolarHBondContact O-N 2.77Å
171	D	90.9	Very high	93.1	Very high	88 Å²	88	45.8 Å²	45.8	47%	0.471	22%	0.221	S	C	.	.	H	α-helix	trans	-65.8	-50.5	176.6	60.6	-24.7	0	0	0	112.6	N169 T173 L174 Q175	N169-D171 VanDerWaalsContact C-N 3.31Å; D171-T173 VanDerWaalsContact C-N 3.26Å; D171-T173 PolarHBondContact O-N 3.46Å; D171-L174 PolarHBondContact O-N 2.95Å; D171-Q175 WeakPolarHBondContact O-CG 3.43Å; D171-Q175 PolarHBondContact O-N 2.87Å
172	I	94.2	Very high	91.7	Very high	48 Å²	48	52.6 Å²	52.6	25%	0.246	25%	0.25	C	C	.	.	H	α-helix	trans	-65.3	-32.5	176.9	64.4	169.1	0	0	0	111.7	Y160 N169 Q175 W176	Y160-I172 HydrophobicContact CD1-CD1 4.14Å; Y160-I172 HydrophobicContact CD2-CD1 4.13Å; Y160-I172 HydrophobicContact CD2-CG1 4.18Å; Y160-I172 HydrophobicContact CE1-CD1 4.34Å; Y160-I172 HydrophobicContact CE2-CD1 4.31Å; Y160-I172 HydrophobicContact CE2-CG1 4.27Å; Y160-I172 HydrophobicContact CG-CD1 4.07Å; N169-I172 HydrophobicContact CB-CD1 3.79Å; N169-I172 HydrophobicContact CB-CG1 3.83Å; N169-I172 VanDerWaalsContact O-CG1 3.24Å; N169-I172 WeakPolarHBondContact O-CG1 3.22Å; I172-Q175 PolarHBondContact O-N 2.84Å; I172-W176 PolarHBondContact O-N 2.99Å
173	T	94.7	Very high	89.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-48	173	-63.1	0	0	0	0	110.6	F36 L126 L128 N169 I170 D171 Q175 W176 L177	F36-T173 HydrophobicContact CE2-CG2 3.81Å; F36-T173 HydrophobicContact CZ-CG2 3.65Å; L126-T173 HydrophobicContact CD2-CG2 3.9Å; L128-T173 HydrophobicContact CD1-CG2 3.78Å; L128-T173 HydrophobicContact CD2-CG2 4.03Å; N169-T173 WeakPolarHBondContact O-CB 3.4Å; N169-T173 PolarHBondContact O-N 2.95Å; N169-T173 PolarHBondContact O-OG1 3.48Å; I170-T173 WeakPolarHBondContact O-CB 3.22Å; D171-T173 VanDerWaalsContact C-N 3.26Å; D171-T173 PolarHBondContact O-N 3.46Å; T173-Q175 VanDerWaalsContact C-N 3.34Å; T173-Q175 PolarHBondContact O-N 3.34Å; T173-W176 PolarHBondContact O-N 3.32Å; T173-L177 HydrophobicContact CG2-CD1 4.45Å; T173-L177 WeakPolarHBondContact O-CG 3.41Å; T173-L177 PolarHBondContact O-N 2.85Å; T173-L177 VanDerWaalsContact O-N 3.1Å
174	L	91.1	Very high	89.1	Confident	11 Å²	11	63.9 Å²	63.9	6%	0.058	32%	0.323	C	S	.	.	H	α-helix	trans	-67.1	-35	177.6	-71.5	169.7	0	0	0	112.2	I40 K62 I67 I170 D171 L177 I178	I40-L174 HydrophobicContact CB-CD2 4.32Å; I40-L174 HydrophobicContact CG2-CD1 4.22Å; I40-L174 HydrophobicContact CG2-CD2 4.05Å; I40-L174 HydrophobicContact CG2-CG 4.34Å; K62-L174 HydrophobicContact CD-CD1 3.89Å; I67-L174 HydrophobicContact CD1-CD2 4.49Å; I170-L174 HydrophobicContact CG2-CD1 4.22Å; I170-L174 VanDerWaalsContact O-CG 3.31Å; I170-L174 WeakPolarHBondContact O-CG 3.45Å; I170-L174 PolarHBondContact O-N 2.77Å; D171-L174 PolarHBondContact O-N 2.95Å; L174-L177 HydrophobicContact CD2-CD1 4.5Å; L174-L177 PolarHBondContact O-N 3.19Å; L174-I178 WeakPolarHBondContact O-CB 3.16Å; L174-I178 WeakPolarHBondContact O-CD1 3.12Å; L174-I178 WeakPolarHBondContact O-CG1 3.42Å; L174-I178 PolarHBondContact O-N 2.91Å
175	Q	90.8	Very high	88.8	Confident	125 Å²	125	67.1 Å²	67.1	58%	0.584	34%	0.339	S	S	*	.	H	α-helix	trans	-62.9	-46.1	174.6	-72.9	172.7	4.7	0	0	111.6	D171 I172 T173 L177 I178 Q179	D171-Q175 WeakPolarHBondContact O-CG 3.43Å; D171-Q175 PolarHBondContact O-N 2.87Å; I172-Q175 PolarHBondContact O-N 2.84Å; T173-Q175 VanDerWaalsContact C-N 3.34Å; T173-Q175 PolarHBondContact O-N 3.34Å; Q175-L177 VanDerWaalsContact C-N 3.32Å; Q175-L177 PolarHBondContact O-N 3.12Å; Q175-I178 PolarHBondContact O-N 2.65Å; Q175-Q179 PolarHBondContact O-N 3.13Å
176	W	93.8	Very high	88.5	Confident	13 Å²	13	65.7 Å²	65.7	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-44.9	176.3	-172.6	93.6	0	0	0	110.9	A91 P124 L126 E156 C158 Y160 I172 T173 I178 Q179 H180	A91-W176 HydrophobicContact CB-CH2 4.13Å; A91-W176 HydrophobicContact CB-CZ3 3.81Å; P124-W176 HydrophobicContact CB-CH2 3.79Å; P124-W176 HydrophobicContact CB-CZ2 4.18Å; L126-W176 HydrophobicContact CB-CD2 4.32Å; L126-W176 HydrophobicContact CB-CE3 3.84Å; L126-W176 HydrophobicContact CB-CH2 3.93Å; L126-W176 HydrophobicContact CB-CZ2 4.4Å; L126-W176 HydrophobicContact CB-CZ3 3.63Å; L126-W176 HydrophobicContact CD1-CD2 4.21Å; L126-W176 HydrophobicContact CD1-CE3 4.46Å; L126-W176 HydrophobicContact CD1-CG 4.45Å; L126-W176 HydrophobicContact CD2-CD2 4.13Å; L126-W176 HydrophobicContact CD2-CE3 3.71Å; L126-W176 HydrophobicContact CD2-CZ3 4.3Å; L126-W176 HydrophobicContact CG-CD2 4.46Å; L126-W176 HydrophobicContact CG-CE3 4.22Å; L126-W176 HydrophobicContact CG-CZ3 4.5Å; E156-W176 PolarHBondContact OE1-NE1 3.3Å; C158-W176 HydrophobicContact CB-CZ2 4.47Å; Y160-W176 HydrophobicContact CE2-CB 4.12Å; Y160-W176 HydrophobicContact CE2-CG 4.49Å; I172-W176 PolarHBondContact O-N 2.99Å; T173-W176 PolarHBondContact O-N 3.32Å; W176-I178 PolarHBondContact O-N 3.11Å; W176-Q179 PolarHBondContact O-N 2.92Å; W176-H180 AromaticContact CD1-CE1 3.92Å; W176-H180 AromaticContact CD2-CE1 3.73Å; W176-H180 AromaticContact CD2-ND1 3.58Å; W176-H180 AromaticContact CE2-CE1 3.22Å; W176-H180 AromaticContact CE2-ND1 3.56Å; W176-H180 AromaticContact CE2-NE2 3.91Å; W176-H180 AromaticContact CE3-ND1 3.81Å; W176-H180 AromaticContact CZ2-CE1 3.44Å; W176-H180 VanDerWaalsContact CZ2-CE1 3.44Å; W176-H180 WeakPolarHBondContact CZ2-CE1 3.28Å; W176-H180 AromaticContact CZ2-ND1 3.8Å; W176-H180 AromaticContact CZ2-NE2 3.66Å; W176-H180 AromaticContact NE1-CE1 3.34Å; W176-H180 PolarHBondContact NE1-CE1 2.92Å; W176-H180 VanDerWaalsContact NE1-CE1 3.34Å; W176-H180 AromaticContact NE1-ND1 3.97Å; W176-H180 PolarHBondContact O-N 2.84Å; W176-H180 PolarHBondContact O-ND1 2.89Å
177	L	91.8	Very high	88.2	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-45	177.4	-69.9	174	0	0	0	112.8	M21 L23 A91 V93 T173 L174 Q175 Q179 H180 S181	M21-L177 HydrophobicContact CE-CB 4.49Å; M21-L177 HydrophobicContact CE-CD2 4.12Å; M21-L177 VanDerWaalsContact CE-O 3.31Å; M21-L177 WeakPolarHBondContact CE-O 3.42Å; M21-L177 HydrophobicContact SD-CB 4.27Å; L23-L177 HydrophobicContact CD2-CD1 3.71Å; L23-L177 HydrophobicContact CD2-CD2 3.56Å; L23-L177 HydrophobicContact CD2-CG 4.18Å; A91-L177 HydrophobicContact CB-CD2 4.44Å; V93-L177 HydrophobicContact CG2-CD2 3.89Å; T173-L177 HydrophobicContact CG2-CD1 4.45Å; T173-L177 WeakPolarHBondContact O-CG 3.41Å; T173-L177 PolarHBondContact O-N 2.85Å; T173-L177 VanDerWaalsContact O-N 3.1Å; L174-L177 HydrophobicContact CD2-CD1 4.5Å; L174-L177 PolarHBondContact O-N 3.19Å; Q175-L177 VanDerWaalsContact C-N 3.32Å; Q175-L177 PolarHBondContact O-N 3.12Å; L177-Q179 VanDerWaalsContact C-N 3.28Å; L177-Q179 PolarHBondContact O-N 3.06Å; L177-H180 CarbonylContact O-C 3.43Å; L177-H180 PolarHBondContact O-N 2.66Å; L177-H180 VanDerWaalsContact O-N 3.07Å; L177-S181 PolarHBondContact O-N 3.44Å; L177-S181 VanDerWaalsContact O-N 3.16Å
178	I	88.4	Confident	87.8	Confident	53 Å²	53	59.4 Å²	59.4	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-64.8	-33	178.1	-70.1	164.5	0	0	0	111.5	V65 L174 Q175 W176 H180 S181	V65-I178 HydrophobicContact CB-CG1 4.47Å; V65-I178 HydrophobicContact CG2-CG1 4.24Å; V65-I178 HydrophobicContact CG2-CG2 4.06Å; L174-I178 WeakPolarHBondContact O-CB 3.16Å; L174-I178 WeakPolarHBondContact O-CD1 3.12Å; L174-I178 WeakPolarHBondContact O-CG1 3.42Å; L174-I178 PolarHBondContact O-N 2.91Å; Q175-I178 PolarHBondContact O-N 2.65Å; W176-I178 PolarHBondContact O-N 3.11Å; I178-H180 PolarHBondContact O-N 3.42Å; I178-S181 PolarHBondContact O-N 3.47Å; I178-S181 PolarHBondContact O-OG 3.11Å
179	Q	89.4	Confident	87.2	Confident	145 Å²	145	59.4 Å²	59.4	68%	0.678	31%	0.312	S	S	*	.	H	α-helix	trans	-65	-29.7	174.7	-175.3	174.3	-10.4	0	0	112	Q175 W176 L177	Q175-Q179 PolarHBondContact O-N 3.13Å; W176-Q179 PolarHBondContact O-N 2.92Å; L177-Q179 VanDerWaalsContact C-N 3.28Å; L177-Q179 PolarHBondContact O-N 3.06Å
180	H	90.3	Very high	86.6	Confident	23 Å²	23	60.9 Å²	60.9	11%	0.106	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4.8	-179.8	-67.1	81.6	0	0	0	113.7	M21 E156 W176 L177 I178	M21-H180 HydrophobicContact CE-CB 3.95Å; E156-H180 IonicContact OE1-CE1 3.75Å; E156-H180 PolarHBondContact OE1-CE1 3.34Å; E156-H180 IonicContact OE1-NE2 3.25Å; E156-H180 PolarHBondContact OE1-NE2 3.1Å; E156-H180 IonicContact OE2-NE2 3.21Å; E156-H180 PolarHBondContact OE2-NE2 2.86Å; W176-H180 AromaticContact CD1-CE1 3.92Å; W176-H180 AromaticContact CD2-CE1 3.73Å; W176-H180 AromaticContact CD2-ND1 3.58Å; W176-H180 AromaticContact CE2-CE1 3.22Å; W176-H180 AromaticContact CE2-ND1 3.56Å; W176-H180 AromaticContact CE2-NE2 3.91Å; W176-H180 AromaticContact CE3-ND1 3.81Å; W176-H180 AromaticContact CZ2-CE1 3.44Å; W176-H180 VanDerWaalsContact CZ2-CE1 3.44Å; W176-H180 WeakPolarHBondContact CZ2-CE1 3.28Å; W176-H180 AromaticContact CZ2-ND1 3.8Å; W176-H180 AromaticContact CZ2-NE2 3.66Å; W176-H180 AromaticContact NE1-CE1 3.34Å; W176-H180 PolarHBondContact NE1-CE1 2.92Å; W176-H180 VanDerWaalsContact NE1-CE1 3.34Å; W176-H180 AromaticContact NE1-ND1 3.97Å; W176-H180 PolarHBondContact O-N 2.84Å; W176-H180 PolarHBondContact O-ND1 2.89Å; L177-H180 CarbonylContact O-C 3.43Å; L177-H180 PolarHBondContact O-N 2.66Å; L177-H180 VanDerWaalsContact O-N 3.07Å; I178-H180 PolarHBondContact O-N 3.42Å
181	S	82.6	Confident	86	Confident	9 Å²	9	64.5 Å²	64.5	6%	0.063	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-20	171.8	62.5	0	0	0	0	112.8	E19 L177 I178	E19-S181 PolarHBondContact OE2-OG 3.35Å; L177-S181 PolarHBondContact O-N 3.44Å; L177-S181 VanDerWaalsContact O-N 3.16Å; I178-S181 PolarHBondContact O-N 3.47Å; I178-S181 PolarHBondContact O-OG 3.11Å
182	K	67.9	Low	85.6	Confident	148 Å²	148	62.6 Å²	62.6	64%	0.643	33%	0.327	S	S	*	.			trans	-94.4	98.5	-177.9	-59.3	-177.8	-172.5	-167.1	0	109.5	E19	E19-K182 WeakPolarHBondContact OE1-CE 3.49Å; E19-K182 IonicContact OE1-NZ 3.88Å; E19-K182 VanDerWaalsContact OE2-CG 3.31Å; E19-K182 WeakPolarHBondContact OE2-CG 3.31Å
183	S	52.2	Low	84.8	Confident	175 Å²	175	63.9 Å²	63.9	100%	1.224	34%	0.335	S	S	*	.			trans	-132.1	0	162.8	-72.6	0	0	0	0	109.3

Retrieved 183 of 183 residues in 1429.2 ms (Link to these results)

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