A0A087X3B5_POEFO Loading...

Methyltransferase like 24

AlphaFold DB , UniProt , Accession A0A087X3B5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 207 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	V	32.6	Very low	46.5	Very low	174 Å²	174	122.5 Å²	122.5	100%	1.055	66%	0.659	S	S	*	*				0	97.1	0	-178.4	0	0	0	0	107.1
2	T	32.1	Very low	49.3	Very low	138 Å²	138	114.8 Å²	114.8	85%	0.847	62%	0.616	S	S	*	*			trans	-87.7	109.9	-178.9	42.3	0	0	0	0	108.4
3	H	30.7	Very low	51.9	Low	162 Å²	162	106.1 Å²	106.1	75%	0.75	57%	0.569	S	S	*	*			trans	-81.2	120.1	167.7	-73.1	-69.4	0	0	0	108.5	I5	H3-I5 PolarHBondContact O-N 3.35Å
4	P	37.3	Very low	54	Low	100 Å²	100	98.6 Å²	98.6	65%	0.649	53%	0.529	S	S	*	.			trans	-72.2	120.3	171.5	15.2	-5.2	0	0	0	108.5	H6	P4-H6 PolarHBondContact O-N 2.94Å; P4-H6 VanDerWaalsContact O-N 3.1Å
5	I	38.3	Very low	55.5	Low	161 Å²	161	92.5 Å²	92.5	83%	0.826	50%	0.497	S	S	*	.			trans	-69.6	103.2	167.4	-62.2	170.6	0	0	0	106	H3 T7	H3-I5 PolarHBondContact O-N 3.35Å; I5-T7 PolarHBondContact O-N 3.1Å
6	H	41.6	Very low	56.6	Low	158 Å²	158	86.9 Å²	86.9	73%	0.731	47%	0.467	S	S	*	.			trans	-67.1	96	172.1	-93.7	-76.8	0	0	0	109.6	P4	P4-H6 PolarHBondContact O-N 2.94Å; P4-H6 VanDerWaalsContact O-N 3.1Å
7	T	40.2	Very low	57.2	Low	100 Å²	100	83.4 Å²	83.4	61%	0.613	45%	0.45	S	S	*	.			trans	2.8	106.5	155.5	49.6	0	0	0	0	116.9	I5	I5-T7 PolarHBondContact O-N 3.1Å
8	K	51.7	Low	57.1	Low	84 Å²	84	83.1 Å²	83.1	37%	0.365	45%	0.448	S	S	.	.			trans	-66	118	143.9	-171.7	-169.6	-172.2	-172.2	0	106	T10 C11 D92	K8-T10 PolarHBondContact O-N 3.37Å; K8-C11 HydrophobicContact CD-CB 4.36Å; K8-D92 VanDerWaalsContact CE-OD1 3.29Å; K8-D92 WeakPolarHBondContact CE-OD1 3.35Å; K8-D92 WeakPolarHBondContact CE-OD2 3.29Å; K8-D92 IonicContact NZ-OD1 2.61Å; K8-D92 PolarHBondContact NZ-OD1 3.27Å; K8-D92 IonicContact NZ-OD2 2.86Å; K8-D92 PolarHBondContact NZ-OD2 3.47Å
9	E	59.3	Low	56.8	Low	178 Å²	178	80.5 Å²	80.5	83%	0.832	44%	0.443	S	S	*	.	S	Bend	trans	-74.2	-23.7	-171.2	-75.6	-176	172	0	0	113.4
10	T	67.2	Low	56.6	Low	76 Å²	76	82.3 Å²	82.3	47%	0.466	46%	0.456	S	S	.	.			trans	-152	139.4	167.5	49.7	0	0	0	0	110.5	K8 H12	K8-T10 PolarHBondContact O-N 3.37Å; T10-H12 PolarHBondContact OG1-NE2 2.69Å; T10-H12 VanDerWaalsContact OG1-NE2 3.12Å
11	C	80.3	Confident	56.7	Low	17 Å²	17	85.4 Å²	85.4	12%	0.115	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	138	166.1	161.6	0	0	0	0	107.9	K8 C34 E35 D92	K8-C11 HydrophobicContact CD-CB 4.36Å; C11-C34 HydrophobicContact CB-CB 3.65Å; C11-C34 WeakPolarHBondContact CB-SG 3.3Å; C11-C34 CarbonylContact O-C 3.55Å; C11-C34 WeakPolarHBondContact O-CA 3.25Å; C11-C34 WeakPolarHBondContact SG-CB 3.34Å; C11-C34 CovalentContact SG-SG 2.04Å; C11-C34 PolarHBondContact SG-SG 3.12Å; C11-E35 PolarHBondContact O-N 3.46Å; C11-D92 VanDerWaalsContact CA-OD2 3.25Å; C11-D92 WeakPolarHBondContact CA-OD2 3.47Å
12	H	80.9	Confident	58.3	Low	30 Å²	30	81.8 Å²	81.8	14%	0.139	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.2	180	-65.8	-68	0	0	0	110.9	T10 F14 E35 H88 D92 V93	T10-H12 PolarHBondContact OG1-NE2 2.69Å; T10-H12 VanDerWaalsContact OG1-NE2 3.12Å; H12-F14 HydrophobicContact CB-CE2 4.14Å; H12-E35 IonicContact CE1-OE2 3.16Å; H12-E35 PolarHBondContact CE1-OE2 2.04Å; H12-E35 IonicContact ND1-OE2 3.29Å; H12-E35 PolarHBondContact ND1-OE2 2.86Å; H12-H88 AromaticContact CE1-CE1 3.63Å; H12-H88 AromaticContact CE1-ND1 3.61Å; H12-H88 AromaticContact CG-ND1 3.8Å; H12-H88 AromaticContact ND1-CE1 3.49Å; H12-H88 PolarHBondContact ND1-CE1 3.5Å; H12-H88 AromaticContact ND1-ND1 3.48Å; H12-H88 PolarHBondContact ND1-ND1 2.61Å; H12-H88 AromaticContact NE2-ND1 3.99Å; H12-D92 PolarHBondContact N-OD2 3.19Å; H12-D92 WeakPolarHBondContact O-CB 3.27Å; H12-D92 PolarHBondContact O-N 2.84Å; H12-V93 PolarHBondContact O-N 2.85Å
13	A	82.9	Confident	60.6	Low	1 Å²	1	78.2 Å²	78.2	1%	0.008	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.3	179	0	0	0	0	0	111.1	P15 L29 C34 E35 V36 H37 V93	A13-P15 VanDerWaalsContact C-CD 3.41Å; A13-P15 VanDerWaalsContact O-CD 3.24Å; A13-P15 WeakPolarHBondContact O-CD 3.2Å; A13-L29 HydrophobicContact CB-CB 4.42Å; A13-L29 HydrophobicContact CB-CD1 3.75Å; A13-C34 HydrophobicContact CB-CB 4.38Å; A13-E35 PolarHBondContact N-O 3.3Å; A13-V36 HydrophobicContact CB-CG2 4.24Å; A13-V36 WeakPolarHBondContact O-CA 3.5Å; A13-H37 PolarHBondContact O-N 3.29Å; A13-V93 CarbonylContact C-O 3.5Å; A13-V93 WeakPolarHBondContact CA-O 3.38Å; A13-V93 HydrophobicContact CB-CB 4.26Å
14	F	80.6	Confident	63.1	Low	1 Å²	1	73.8 Å²	73.8	0%	0.004	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	78.9	-175.4	-79	-109.8	0	0	0	109.3	H12 H37 F39 L83 H88 V91 V93 L94 K95	H12-F14 HydrophobicContact CB-CE2 4.14Å; F14-H37 HydrophobicContact CD1-CB 4.25Å; F14-H37 HydrophobicContact CE1-CB 3.96Å; F14-H37 HydrophobicContact CE2-CB 4.47Å; F14-H37 AromaticContact CE2-CD2 3.63Å; F14-H37 HydrophobicContact CZ-CB 4.01Å; F14-H37 AromaticContact CZ-CD2 3.47Å; F14-H37 VanDerWaalsContact CZ-CD2 3.47Å; F14-H37 WeakPolarHBondContact CZ-CD2 3.01Å; F14-H37 AromaticContact CZ-CG 3.8Å; F14-F39 AromaticContact CD1-CE2 3.53Å; F14-F39 HydrophobicContact CD1-CE2 3.53Å; F14-F39 AromaticContact CD1-CZ 3.75Å; F14-F39 HydrophobicContact CD1-CZ 3.75Å; F14-F39 HydrophobicContact CE1-CE2 4.01Å; F14-F39 AromaticContact CE1-CZ 3.75Å; F14-F39 HydrophobicContact CE1-CZ 3.75Å; F14-F39 HydrophobicContact CG-CE2 4.44Å; F14-L83 HydrophobicContact CD1-CD2 3.77Å; F14-L83 HydrophobicContact CE1-CD2 3.71Å; F14-L83 HydrophobicContact CG-CD2 4.27Å; F14-L83 HydrophobicContact CZ-CD2 4.18Å; F14-H88 HydrophobicContact CE2-CB 4.43Å; F14-H88 AromaticContact CE2-CD2 3.99Å; F14-H88 HydrophobicContact CZ-CB 4.23Å; F14-H88 AromaticContact CZ-CD2 3.26Å; F14-H88 WeakPolarHBondContact CZ-CD2 3.24Å; F14-H88 AromaticContact CZ-CG 3.78Å; F14-H88 AromaticContact CZ-NE2 3.73Å; F14-V91 HydrophobicContact CB-CG1 4.14Å; F14-V91 HydrophobicContact CD2-CG1 3.87Å; F14-V91 HydrophobicContact CD2-CG2 4.09Å; F14-V91 HydrophobicContact CE2-CG2 4.43Å; F14-V91 HydrophobicContact CG-CG1 4.23Å; F14-V93 PolarHBondContact N-O 3.34Å; F14-L94 HydrophobicContact CB-CD1 4.03Å; F14-L94 WeakPolarHBondContact O-CD1 3.22Å; F14-K95 PolarHBondContact O-N 3.24Å; F14-K95 VanDerWaalsContact O-N 3.1Å
15	P	76.9	Confident	65.5	Low	8 Å²	8	71.4 Å²	71.4	5%	0.052	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	124.7	168.8	30.6	-37.6	0	0	0	111.8	A13 E26 V36 H37 C38	A13-P15 VanDerWaalsContact C-CD 3.41Å; A13-P15 VanDerWaalsContact O-CD 3.24Å; A13-P15 WeakPolarHBondContact O-CD 3.2Å; P15-E26 HydrophobicContact CB-CG 3.42Å; P15-E26 VanDerWaalsContact CB-CG 3.42Å; P15-E26 VanDerWaalsContact CB-OE1 3.28Å; P15-E26 WeakPolarHBondContact CB-OE1 3.48Å; P15-E26 HydrophobicContact CG-CG 3.48Å; P15-E26 VanDerWaalsContact CG-CG 3.48Å; P15-V36 HydrophobicContact CG-CG1 3.58Å; P15-H37 WeakPolarHBondContact CD-O 3.39Å; P15-C38 HydrophobicContact CG-CB 4.43Å; P15-C38 VanDerWaalsContact CG-SG 3.55Å
16	I	72.9	Confident	67.9	Low	3 Å²	3	63.8 Å²	63.8	2%	0.015	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	112.6	174.2	-53.9	165.2	0	0	0	106.5	F39 I60 L79 L94 K95 D97 M98	I16-F39 HydrophobicContact CG1-CD2 4.08Å; I16-I60 HydrophobicContact CB-CG1 4.41Å; I16-I60 HydrophobicContact CD1-CG1 4.11Å; I16-I60 HydrophobicContact CD1-CG2 4.48Å; I16-I60 HydrophobicContact CG1-CG1 4.1Å; I16-I60 HydrophobicContact CG2-CB 4.02Å; I16-I60 HydrophobicContact CG2-CG1 3.47Å; I16-I60 VanDerWaalsContact CG2-CG1 3.47Å; I16-L79 HydrophobicContact CD1-CD1 3.8Å; I16-L79 HydrophobicContact CD1-CD2 4.07Å; I16-L94 HydrophobicContact CD1-CD1 3.66Å; I16-L94 HydrophobicContact CG1-CD1 4.41Å; I16-K95 WeakPolarHBondContact CA-O 3.33Å; I16-K95 WeakPolarHBondContact CB-O 3.38Å; I16-K95 PolarHBondContact N-O 2.98Å; I16-D97 PolarHBondContact O-N 3.47Å; I16-M98 HydrophobicContact CG2-CE 4.27Å; I16-M98 HydrophobicContact CG2-CG 3.94Å; I16-M98 HydrophobicContact CG2-SD 3.57Å; I16-M98 VanDerWaalsContact CG2-SD 3.57Å
17	S	67.8	Low	70.2	Confident	26 Å²	26	60 Å²	60	18%	0.182	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144	170.8	-178.7	0	0	0	0	109.5	G19 D97	S17-G19 VanDerWaalsContact C-N 3.33Å; S17-G19 PolarHBondContact OG-N 2.84Å; S17-D97 WeakPolarHBondContact CA-O 3.45Å; S17-D97 PolarHBondContact OG-OD2 3.3Å
18	L	54.7	Low	72.5	Confident	78 Å²	78	61.6 Å²	61.6	41%	0.408	33%	0.331	S	S	.	.	S	Bend	trans	-91.2	3.4	172.9	-69.1	177.1	0	0	0	112.8	D97 M98 E99	L18-D97 PolarHBondContact N-O 3.27Å; L18-M98 HydrophobicContact CD1-CB 4.23Å; L18-M98 WeakPolarHBondContact CD1-O 3.36Å; L18-E99 HydrophobicContact CB-CG 4.12Å; L18-E99 HydrophobicContact CD1-CB 4.27Å; L18-E99 HydrophobicContact CD1-CG 4.5Å
19	G	52.3	Low	74.3	Confident	35 Å²	35	58.6 Å²	58.6	36%	0.361	32%	0.319	S	S	.	.	S	Bend	trans	-122.7	163.9	-174.6	0	0	0	0	0	114.9	S17	S17-G19 VanDerWaalsContact C-N 3.33Å; S17-G19 PolarHBondContact OG-N 2.84Å
20	V	52.3	Low	75.8	Confident	115 Å²	115	50.5 Å²	50.5	70%	0.697	28%	0.283	S	S	*	.	S	Bend	trans	-96.1	140.7	167.4	-165.1	0	0	0	0	106.2
21	D	58.8	Low	76.8	Confident	149 Å²	149	56.8 Å²	56.8	80%	0.797	30%	0.298	S	S	*	.	S	Bend	trans	98.3	56.9	168.3	-54.5	-32.9	0	0	0	117.7
22	D	66.4	Low	77.3	Confident	98 Å²	98	59.4 Å²	59.4	52%	0.524	32%	0.317	S	S	.	.				-171.4	103.6	115.4	-177.2	19.6	0	0	0	109.5	S24	D22-S24 VanDerWaalsContact C-N 3.32Å; D22-S24 WeakPolarHBondContact OD1-CB 3.44Å; D22-S24 PolarHBondContact OD1-N 3.48Å; D22-S24 PolarHBondContact OD1-OG 3.16Å; D22-S24 PolarHBondContact OD2-OG 3.03Å
23	H	78.6	Confident	77.6	Confident	63 Å²	63	60.6 Å²	60.6	29%	0.292	34%	0.336	S	S	.	.			trans	-93.8	18.1	174.2	-65.8	-51.7	0	0	0	112.7	L25 E26 H27	H23-L25 VanDerWaalsContact C-N 3.32Å; H23-L25 PolarHBondContact O-N 2.97Å; H23-E26 VanDerWaalsContact C-OE2 3.24Å; H23-E26 WeakPolarHBondContact CA-OE2 3.29Å; H23-E26 HydrophobicContact CB-CB 4.26Å; H23-E26 PolarHBondContact O-N 2.97Å; H23-H27 WeakPolarHBondContact O-CB 3.49Å; H23-H27 PolarHBondContact O-CD2 3.33Å; H23-H27 PolarHBondContact O-N 2.93Å
24	S	85	Confident	77.9	Confident	69 Å²	69	61.1 Å²	61.1	48%	0.483	34%	0.34	S	S	.	.	H	α-helix	trans	-58.8	-42.5	-176.2	65.1	0	0	0	0	112.6	D22 F28	D22-S24 VanDerWaalsContact C-N 3.32Å; D22-S24 WeakPolarHBondContact OD1-CB 3.44Å; D22-S24 PolarHBondContact OD1-N 3.48Å; D22-S24 PolarHBondContact OD1-OG 3.16Å; D22-S24 PolarHBondContact OD2-OG 3.03Å; S24-F28 WeakPolarHBondContact O-CB 3.41Å; S24-F28 PolarHBondContact O-N 3.19Å
25	L	85.9	Confident	78.3	Confident	49 Å²	49	64 Å²	64	26%	0.257	35%	0.354	S	S	.	.	H	α-helix	trans	-66.7	-45.7	177	177.1	66.2	0	0	0	110.9	H23 F28 L29 K95 L122	H23-L25 VanDerWaalsContact C-N 3.32Å; H23-L25 PolarHBondContact O-N 2.97Å; L25-F28 WeakPolarHBondContact O-CB 3.45Å; L25-F28 PolarHBondContact O-N 3.08Å; L25-F28 VanDerWaalsContact O-N 3.16Å; L25-L29 HydrophobicContact CD1-CD1 4.11Å; L25-L29 HydrophobicContact CD1-CG 4.24Å; L25-L29 HydrophobicContact CD2-CD1 4.44Å; L25-L29 HydrophobicContact CG-CD1 3.88Å; L25-L29 HydrophobicContact CG-CG 4.4Å; L25-L29 WeakPolarHBondContact O-CB 3.14Å; L25-L29 VanDerWaalsContact O-CG 3.3Å; L25-L29 WeakPolarHBondContact O-CG 3.35Å; L25-L29 PolarHBondContact O-N 2.88Å; L25-K95 HydrophobicContact CD2-CD 4.01Å; L25-L122 HydrophobicContact CD2-CD2 3.62Å
26	E	89.9	Confident	79	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.009	35%	0.351	C	S	.	.	H	α-helix	trans	-61.4	-46.8	-178.6	-67.1	80.5	175.7	0	0	110.2	P15 H23 F28 L29 A30 V36 M53 K95	P15-E26 HydrophobicContact CB-CG 3.42Å; P15-E26 VanDerWaalsContact CB-CG 3.42Å; P15-E26 VanDerWaalsContact CB-OE1 3.28Å; P15-E26 WeakPolarHBondContact CB-OE1 3.48Å; P15-E26 HydrophobicContact CG-CG 3.48Å; P15-E26 VanDerWaalsContact CG-CG 3.48Å; H23-E26 VanDerWaalsContact C-OE2 3.24Å; H23-E26 WeakPolarHBondContact CA-OE2 3.29Å; H23-E26 HydrophobicContact CB-CB 4.26Å; H23-E26 PolarHBondContact O-N 2.97Å; E26-F28 PolarHBondContact O-N 3.48Å; E26-L29 PolarHBondContact O-N 3.31Å; E26-A30 WeakPolarHBondContact O-CB 3.33Å; E26-A30 PolarHBondContact O-N 2.63Å; E26-V36 HydrophobicContact CB-CG1 4.15Å; E26-V36 HydrophobicContact CG-CG1 4.35Å; E26-M53 HydrophobicContact CB-SD 3.69Å; E26-K95 WeakPolarHBondContact OE1-CD 3.43Å; E26-K95 IonicContact OE1-NZ 3.41Å; E26-K95 PolarHBondContact OE1-NZ 3.15Å; E26-K95 IonicContact OE2-NZ 3.8Å
27	H	89.4	Confident	79.8	Confident	77 Å²	77	63.8 Å²	63.8	36%	0.356	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-41	172.5	-77.5	-51.5	0	0	0	112.7	H23 R31 M53	H23-H27 WeakPolarHBondContact O-CB 3.49Å; H23-H27 PolarHBondContact O-CD2 3.33Å; H23-H27 PolarHBondContact O-N 2.93Å; H27-R31 WeakPolarHBondContact O-CB 3.21Å; H27-R31 WeakPolarHBondContact O-CG 3.32Å; H27-R31 PolarHBondContact O-N 2.88Å; H27-M53 WeakPolarHBondContact CE1-CE 3.34Å; H27-M53 WeakPolarHBondContact ND1-CE 3.36Å
28	F	89.3	Confident	80.9	Confident	134 Å²	134	62.9 Å²	62.9	59%	0.588	35%	0.345	S	S	*	.	H	α-helix	trans	-62.6	-43.2	176.4	174.2	-95	0	0	0	111.6	S24 L25 E26 S32	S24-F28 WeakPolarHBondContact O-CB 3.41Å; S24-F28 PolarHBondContact O-N 3.19Å; L25-F28 WeakPolarHBondContact O-CB 3.45Å; L25-F28 PolarHBondContact O-N 3.08Å; L25-F28 VanDerWaalsContact O-N 3.16Å; E26-F28 PolarHBondContact O-N 3.48Å; F28-S32 VanDerWaalsContact O-CB 3.29Å; F28-S32 WeakPolarHBondContact O-CB 3.14Å; F28-S32 PolarHBondContact O-N 2.98Å; F28-S32 PolarHBondContact O-OG 3.15Å
29	L	89.9	Confident	82.4	Confident	21 Å²	21	59.5 Å²	59.5	11%	0.11	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-45.9	177.8	-70.1	169.1	0	0	0	111.4	A13 L25 E26 R31 S32 G33 C34 V36 V93	A13-L29 HydrophobicContact CB-CB 4.42Å; A13-L29 HydrophobicContact CB-CD1 3.75Å; L25-L29 HydrophobicContact CD1-CD1 4.11Å; L25-L29 HydrophobicContact CD1-CG 4.24Å; L25-L29 HydrophobicContact CD2-CD1 4.44Å; L25-L29 HydrophobicContact CG-CD1 3.88Å; L25-L29 HydrophobicContact CG-CG 4.4Å; L25-L29 WeakPolarHBondContact O-CB 3.14Å; L25-L29 VanDerWaalsContact O-CG 3.3Å; L25-L29 WeakPolarHBondContact O-CG 3.35Å; L25-L29 PolarHBondContact O-N 2.88Å; E26-L29 PolarHBondContact O-N 3.31Å; L29-R31 PolarHBondContact O-N 3.25Å; L29-S32 CarbonylContact O-C 3.6Å; L29-S32 WeakPolarHBondContact O-CA 3.43Å; L29-S32 WeakPolarHBondContact O-CB 3.46Å; L29-S32 PolarHBondContact O-N 3.09Å; L29-S32 VanDerWaalsContact O-N 3.08Å; L29-G33 PolarHBondContact O-N 2.87Å; L29-C34 HydrophobicContact CB-CB 4.09Å; L29-C34 VanDerWaalsContact O-CB 3.3Å; L29-C34 WeakPolarHBondContact O-CB 3.08Å; L29-C34 PolarHBondContact O-N 2.87Å; L29-V36 HydrophobicContact CB-CG2 3.98Å; L29-V93 HydrophobicContact CD1-CB 4.42Å; L29-V93 HydrophobicContact CD1-CG1 4.25Å; L29-V93 HydrophobicContact CD2-CG2 4.35Å
30	A	89.4	Confident	83.9	Confident	9 Å²	9	60 Å²	60	7%	0.074	32%	0.322	C	S	.	.	H	α-helix	trans	-57.8	-50.1	176.7	0	0	0	0	0	111.5	E26 S32 G33 V36 E52 M53	E26-A30 WeakPolarHBondContact O-CB 3.33Å; E26-A30 PolarHBondContact O-N 2.63Å; A30-S32 PolarHBondContact O-N 3.33Å; A30-G33 PolarHBondContact O-N 3.13Å; A30-V36 HydrophobicContact CB-CG2 3.84Å; A30-E52 HydrophobicContact CB-CB 4.22Å; A30-M53 HydrophobicContact CB-CG 3.76Å
31	R	89.6	Confident	85.3	Confident	207 Å²	207	55.5 Å²	55.5	78%	0.781	30%	0.295	S	S	*	.	H	α-helix	trans	-65.4	-20.5	177.2	-69.4	177.1	70.2	-176.7	2.8	113.7	H27 L29 G33	H27-R31 WeakPolarHBondContact O-CB 3.21Å; H27-R31 WeakPolarHBondContact O-CG 3.32Å; H27-R31 PolarHBondContact O-N 2.88Å; L29-R31 PolarHBondContact O-N 3.25Å; R31-G33 VanDerWaalsContact C-N 3.27Å
32	S	89.2	Confident	86.4	Confident	73 Å²	73	52.3 Å²	52.3	51%	0.51	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	2.9	174.3	-58.7	0	0	0	0	112.9	F28 L29 A30	F28-S32 VanDerWaalsContact O-CB 3.29Å; F28-S32 WeakPolarHBondContact O-CB 3.14Å; F28-S32 PolarHBondContact O-N 2.98Å; F28-S32 PolarHBondContact O-OG 3.15Å; L29-S32 CarbonylContact O-C 3.6Å; L29-S32 WeakPolarHBondContact O-CA 3.43Å; L29-S32 WeakPolarHBondContact O-CB 3.46Å; L29-S32 PolarHBondContact O-N 3.09Å; L29-S32 VanDerWaalsContact O-N 3.08Å; A30-S32 PolarHBondContact O-N 3.33Å
33	G	87.4	Confident	87.2	Confident	54 Å²	54	48.8 Å²	48.8	56%	0.557	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	16	178.3	0	0	0	0	0	114.6	L29 A30 R31	L29-G33 PolarHBondContact O-N 2.87Å; A30-G33 PolarHBondContact O-N 3.13Å; R31-G33 VanDerWaalsContact C-N 3.27Å
34	C	88.9	Confident	87.4	Confident	13 Å²	13	54.2 Å²	54.2	9%	0.088	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	138.2	169.1	-57.8	0	0	0	0	110.6	C11 A13 L29 V36	C11-C34 HydrophobicContact CB-CB 3.65Å; C11-C34 WeakPolarHBondContact CB-SG 3.3Å; C11-C34 CarbonylContact O-C 3.55Å; C11-C34 WeakPolarHBondContact O-CA 3.25Å; C11-C34 WeakPolarHBondContact SG-CB 3.34Å; C11-C34 CovalentContact SG-SG 2.04Å; C11-C34 PolarHBondContact SG-SG 3.12Å; A13-C34 HydrophobicContact CB-CB 4.38Å; L29-C34 HydrophobicContact CB-CB 4.09Å; L29-C34 VanDerWaalsContact O-CB 3.3Å; L29-C34 WeakPolarHBondContact O-CB 3.08Å; L29-C34 PolarHBondContact O-N 2.87Å; C34-V36 HydrophobicContact CB-CG2 4.31Å; C34-V36 PolarHBondContact O-N 2.84Å
35	E	90.2	Very high	87.5	Confident	62 Å²	62	56.4 Å²	56.4	29%	0.29	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	116	160.8	-165.8	179	-168.3	0	0	108.4	C11 H12 A13 H37 W54	C11-E35 PolarHBondContact O-N 3.46Å; H12-E35 IonicContact CE1-OE2 3.16Å; H12-E35 PolarHBondContact CE1-OE2 2.04Å; H12-E35 IonicContact ND1-OE2 3.29Å; H12-E35 PolarHBondContact ND1-OE2 2.86Å; A13-E35 PolarHBondContact N-O 3.3Å; E35-H37 VanDerWaalsContact CG-NE2 3.33Å; E35-H37 WeakPolarHBondContact CG-NE2 3.3Å; E35-H37 IonicContact OE1-CE1 3.62Å; E35-H37 PolarHBondContact OE1-CE1 3.16Å; E35-H37 IonicContact OE1-NE2 3.46Å; E35-H37 PolarHBondContact OE1-NE2 3.49Å; E35-H37 IonicContact OE2-NE2 3.8Å; E35-W54 PolarHBondContact OE1-NE1 3.07Å; E35-W54 VanDerWaalsContact OE1-NE1 3.09Å
36	V	91	Very high	87.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.7	-174.4	-176.4	0	0	0	0	109.5	A13 P15 E26 L29 A30 C34 M53 W54	A13-V36 HydrophobicContact CB-CG2 4.24Å; A13-V36 WeakPolarHBondContact O-CA 3.5Å; P15-V36 HydrophobicContact CG-CG1 3.58Å; E26-V36 HydrophobicContact CB-CG1 4.15Å; E26-V36 HydrophobicContact CG-CG1 4.35Å; L29-V36 HydrophobicContact CB-CG2 3.98Å; A30-V36 HydrophobicContact CB-CG2 3.84Å; C34-V36 HydrophobicContact CB-CG2 4.31Å; C34-V36 PolarHBondContact O-N 2.84Å; V36-M53 HydrophobicContact CB-CB 4.22Å; V36-M53 HydrophobicContact CB-CG 3.91Å; V36-M53 HydrophobicContact CG1-CB 4.46Å; V36-M53 HydrophobicContact CG1-CG 4.14Å; V36-M53 HydrophobicContact CG1-SD 4.27Å; V36-M53 HydrophobicContact CG2-CG 4.44Å; V36-W54 PolarHBondContact O-N 3.48Å
37	H	90.6	Very high	87.3	Confident	5 Å²	5	63.9 Å²	63.9	2%	0.023	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	105.3	178.5	-61.9	-91.1	0	0	0	110.7	A13 F14 P15 E35 F39 W54 H56 H88	A13-H37 PolarHBondContact O-N 3.29Å; F14-H37 HydrophobicContact CD1-CB 4.25Å; F14-H37 HydrophobicContact CE1-CB 3.96Å; F14-H37 HydrophobicContact CE2-CB 4.47Å; F14-H37 AromaticContact CE2-CD2 3.63Å; F14-H37 HydrophobicContact CZ-CB 4.01Å; F14-H37 AromaticContact CZ-CD2 3.47Å; F14-H37 VanDerWaalsContact CZ-CD2 3.47Å; F14-H37 WeakPolarHBondContact CZ-CD2 3.01Å; F14-H37 AromaticContact CZ-CG 3.8Å; P15-H37 WeakPolarHBondContact CD-O 3.39Å; E35-H37 VanDerWaalsContact CG-NE2 3.33Å; E35-H37 WeakPolarHBondContact CG-NE2 3.3Å; E35-H37 IonicContact OE1-CE1 3.62Å; E35-H37 PolarHBondContact OE1-CE1 3.16Å; E35-H37 IonicContact OE1-NE2 3.46Å; E35-H37 PolarHBondContact OE1-NE2 3.49Å; E35-H37 IonicContact OE2-NE2 3.8Å; H37-F39 HydrophobicContact CB-CE2 4Å; H37-F39 HydrophobicContact CB-CZ 3.97Å; H37-F39 VanDerWaalsContact O-CE2 3.27Å; H37-F39 WeakPolarHBondContact O-CE2 3.36Å; H37-W54 CarbonylContact C-O 3.58Å; H37-W54 AromaticContact CE1-CD1 3.71Å; H37-W54 AromaticContact ND1-CD1 3.99Å; H37-H56 AromaticContact CG-NE2 3.86Å; H37-H56 AromaticContact ND1-CE1 3.93Å; H37-H56 AromaticContact ND1-NE2 3.08Å; H37-H56 PolarHBondContact ND1-NE2 2.71Å; H37-H88 AromaticContact CE1-NE2 3.85Å; H37-H88 AromaticContact NE2-CE1 3.8Å; H37-H88 AromaticContact NE2-NE2 3.5Å; H37-H88 PolarHBondContact NE2-NE2 2.77Å
38	C	89.4	Confident	87.4	Confident	7 Å²	7	63.3 Å²	63.3	5%	0.047	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.3	176.3	-57.8	0	0	0	0	110.3	P15 W54 F55 H56	P15-C38 HydrophobicContact CG-CB 4.43Å; P15-C38 VanDerWaalsContact CG-SG 3.55Å; C38-W54 PolarHBondContact N-O 3.39Å; C38-F55 HydrophobicContact CB-CD1 3.57Å; C38-F55 HydrophobicContact CB-CE1 3.75Å; C38-F55 HydrophobicContact CB-CG 4.2Å; C38-F55 CarbonylContact O-C 3.47Å; C38-F55 WeakPolarHBondContact O-CA 3.33Å; C38-H56 PolarHBondContact O-N 3.27Å
39	F	86.8	Confident	87.4	Confident	7 Å²	7	62.6 Å²	62.6	3%	0.031	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.1	178.1	-58.3	-84.4	0	0	0	109.9	F14 I16 H37 H56 I58 I60 I82 F86	F14-F39 AromaticContact CD1-CE2 3.53Å; F14-F39 HydrophobicContact CD1-CE2 3.53Å; F14-F39 AromaticContact CD1-CZ 3.75Å; F14-F39 HydrophobicContact CD1-CZ 3.75Å; F14-F39 HydrophobicContact CE1-CE2 4.01Å; F14-F39 AromaticContact CE1-CZ 3.75Å; F14-F39 HydrophobicContact CE1-CZ 3.75Å; F14-F39 HydrophobicContact CG-CE2 4.44Å; I16-F39 HydrophobicContact CG1-CD2 4.08Å; H37-F39 HydrophobicContact CB-CE2 4Å; H37-F39 HydrophobicContact CB-CZ 3.97Å; H37-F39 VanDerWaalsContact O-CE2 3.27Å; H37-F39 WeakPolarHBondContact O-CE2 3.36Å; F39-H56 HydrophobicContact CD1-CB 3.91Å; F39-H56 HydrophobicContact CE1-CB 4.12Å; F39-H56 AromaticContact CE1-CD2 3.88Å; F39-I58 HydrophobicContact CD1-CB 4.13Å; F39-I58 HydrophobicContact CD1-CD1 4.4Å; F39-I58 HydrophobicContact CE1-CD1 4.42Å; F39-I60 HydrophobicContact CB-CD1 4.02Å; F39-I60 HydrophobicContact CB-CG1 4.1Å; F39-I60 HydrophobicContact CD1-CD1 4.15Å; F39-I60 HydrophobicContact CD2-CD1 4.24Å; F39-I60 HydrophobicContact CG-CD1 3.85Å; F39-I60 HydrophobicContact CG-CG1 4.39Å; F39-I82 HydrophobicContact CD1-CD1 4.45Å; F39-I82 HydrophobicContact CD1-CG2 4.43Å; F39-I82 HydrophobicContact CE1-CD1 4.42Å; F39-I82 HydrophobicContact CE1-CG2 3.45Å; F39-I82 VanDerWaalsContact CE1-CG2 3.45Å; F39-I82 HydrophobicContact CE2-CG2 4.45Å; F39-I82 HydrophobicContact CZ-CG2 3.47Å; F39-I82 VanDerWaalsContact CZ-CG2 3.47Å; F39-F86 HydrophobicContact CE1-CE2 4.31Å; F39-F86 HydrophobicContact CE1-CZ 4.35Å
40	D	83.2	Confident	87.2	Confident	45 Å²	45	68.1 Å²	68.1	24%	0.241	36%	0.356	C	S	.	.			trans	-135.5	108.2	-176.5	175	2.6	0	0	0	110.2	S42 L43 H56 R57	D40-S42 VanDerWaalsContact CG-OG 3.23Å; D40-S42 PolarHBondContact O-N 2.72Å; D40-S42 WeakPolarHBondContact OD1-CA 3.19Å; D40-S42 WeakPolarHBondContact OD1-CB 3.4Å; D40-S42 PolarHBondContact OD1-N 3.09Å; D40-S42 PolarHBondContact OD1-OG 2.88Å; D40-S42 PolarHBondContact OD2-OG 3.41Å; D40-S42 VanDerWaalsContact OD2-OG 3.07Å; D40-L43 HydrophobicContact CB-CD1 4.07Å; D40-L43 HydrophobicContact CB-CG 3.92Å; D40-L43 WeakPolarHBondContact O-CD1 3.39Å; D40-L43 WeakPolarHBondContact O-CG 3.22Å; D40-L43 PolarHBondContact O-N 3.16Å; D40-H56 PolarHBondContact N-O 3.42Å; D40-R57 WeakPolarHBondContact O-CA 3.02Å
41	P	81.5	Confident	87	Confident	22 Å²	22	70.3 Å²	70.3	14%	0.143	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.5	-178.2	29.7	-34.9	0	0	0	114	Q74	P41-Q74 HydrophobicContact CB-CG 4.48Å; P41-Q74 PolarHBondContact O-NE2 3.45Å
42	S	81.8	Confident	86.9	Confident	81 Å²	81	66.7 Å²	66.7	57%	0.566	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-14.5	-178.9	80.9	0	0	0	0	113.7	D40 E44	D40-S42 VanDerWaalsContact CG-OG 3.23Å; D40-S42 PolarHBondContact O-N 2.72Å; D40-S42 WeakPolarHBondContact OD1-CA 3.19Å; D40-S42 WeakPolarHBondContact OD1-CB 3.4Å; D40-S42 PolarHBondContact OD1-N 3.09Å; D40-S42 PolarHBondContact OD1-OG 2.88Å; D40-S42 PolarHBondContact OD2-OG 3.41Å; D40-S42 VanDerWaalsContact OD2-OG 3.07Å; S42-E44 PolarHBondContact O-N 3.02Å
43	L	83.1	Confident	86.9	Confident	24 Å²	24	63.3 Å²	63.3	13%	0.126	34%	0.342	C	S	.	.			trans	-54.7	137.7	-179.5	-65.2	169	0	0	0	112.2	D40 F55 R57	D40-L43 HydrophobicContact CB-CD1 4.07Å; D40-L43 HydrophobicContact CB-CG 3.92Å; D40-L43 WeakPolarHBondContact O-CD1 3.39Å; D40-L43 WeakPolarHBondContact O-CG 3.22Å; D40-L43 PolarHBondContact O-N 3.16Å; L43-F55 HydrophobicContact CD1-CB 3.73Å; L43-F55 HydrophobicContact CD2-CB 4.44Å; L43-R57 HydrophobicContact CB-CB 4.05Å; L43-R57 HydrophobicContact CB-CG 4.1Å; L43-R57 HydrophobicContact CD1-CB 4.43Å; L43-R57 WeakPolarHBondContact O-CD 3.35Å; L43-R57 WeakPolarHBondContact O-CG 3.47Å; L43-R57 PolarHBondContact O-NE 3.13Å; L43-R57 PolarHBondContact O-NH1 3.4Å
44	E	84.8	Confident	87.1	Confident	178 Å²	178	65.1 Å²	65.1	83%	0.832	33%	0.332	S	S	*	.	S	Bend	trans	-68.2	-42.3	175.9	-64.5	-172.8	164	0	0	111.5	S42 R57	S42-E44 PolarHBondContact O-N 3.02Å; E44-R57 PolarHBondContact O-NH1 3.41Å
45	Q	85.9	Confident	87.1	Confident	115 Å²	115	65.5 Å²	65.5	54%	0.537	33%	0.332	S	S	.	.	S	Bend	trans	-97.6	149.9	-177.9	-63	178.8	69.1	0	0	111.1	H47	Q45-H47 VanDerWaalsContact C-N 3.31Å; Q45-H47 PolarHBondContact O-N 2.84Å
46	P	85.8	Confident	87.1	Confident	89 Å²	89	63 Å²	63	58%	0.578	32%	0.32	S	S	*	.	S	Bend	trans	-61.4	-37.3	179.7	-23.9	34.1	0	0	0	114	R57	P46-R57 PolarHBondContact O-N 3.39Å
47	H	86.9	Confident	86.9	Confident	119 Å²	119	66.6 Å²	66.6	55%	0.551	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	136	-179	-60.7	-55.1	0	0	0	109.4	Q45 F55 H56	Q45-H47 VanDerWaalsContact C-N 3.31Å; Q45-H47 PolarHBondContact O-N 2.84Å; H47-F55 WeakPolarHBondContact CA-O 3.27Å; H47-H56 AromaticContact CE1-ND1 3.71Å; H47-H56 AromaticContact ND1-ND1 3.2Å; H47-H56 PolarHBondContact ND1-ND1 3.37Å; H47-H56 VanDerWaalsContact ND1-ND1 3.2Å
48	L	89.8	Confident	86.7	Confident	64 Å²	64	67 Å²	67	34%	0.335	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	131.2	177.5	172.7	67.2	0	0	0	108.9	K50 F55	L48-K50 HydrophobicContact CG-CB 4.44Å; L48-F55 HydrophobicContact CB-CB 4.16Å; L48-F55 PolarHBondContact N-O 2.96Å; L48-F55 WeakPolarHBondContact O-CA 3.47Å; L48-F55 WeakPolarHBondContact O-CB 3.45Å; L48-F55 PolarHBondContact O-N 2.8Å
49	Q	89.8	Confident	86.4	Confident	119 Å²	119	68.2 Å²	68.2	56%	0.556	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	123	169.3	-163.7	-178.8	11.8	0	0	108.8	M53 W54	Q49-M53 WeakPolarHBondContact CA-O 3.48Å; Q49-M53 WeakPolarHBondContact CG-O 3.33Å; Q49-W54 HydrophobicContact CB-CE3 3.95Å; Q49-W54 HydrophobicContact CB-CZ3 3.96Å; Q49-W54 HydrophobicContact CG-CD2 4.22Å; Q49-W54 HydrophobicContact CG-CE3 3.89Å; Q49-W54 HydrophobicContact CG-CH2 4.36Å; Q49-W54 HydrophobicContact CG-CZ3 3.96Å
50	K	86.8	Confident	86.4	Confident	138 Å²	138	68.2 Å²	68.2	60%	0.6	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.8	134.6	-178.8	-177.2	-179.3	176.5	-172.6	0	109.9	L48 E52 M53 F55	L48-K50 HydrophobicContact CG-CB 4.44Å; K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 3Å; K50-M53 PolarHBondContact N-O 3.28Å; K50-M53 PolarHBondContact O-N 3.05Å; K50-F55 HydrophobicContact CB-CD2 4.25Å; K50-F55 HydrophobicContact CB-CE2 3.94Å
51	A	84.9	Confident	86.4	Confident	55 Å²	55	68.1 Å²	68.1	46%	0.455	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	47.3	176.5	0	0	0	0	0	113.4	M53	A51-M53 HydrophobicContact CB-CE 4.09Å; A51-M53 PolarHBondContact O-N 3.22Å
52	E	87	Confident	86.5	Confident	131 Å²	131	69.2 Å²	69.2	61%	0.612	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	13.5	178.5	-53.6	171.2	158.5	0	0	114.7	A30 K50	A30-E52 HydrophobicContact CB-CB 4.22Å; K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 3Å
53	M	89.9	Confident	86.3	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.01	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	153.1	178	-54.6	175	-70.8	0	0	111.2	E26 H27 A30 V36 Q49 K50 A51 F55	E26-M53 HydrophobicContact CB-SD 3.69Å; H27-M53 WeakPolarHBondContact CE1-CE 3.34Å; H27-M53 WeakPolarHBondContact ND1-CE 3.36Å; A30-M53 HydrophobicContact CB-CG 3.76Å; V36-M53 HydrophobicContact CB-CB 4.22Å; V36-M53 HydrophobicContact CB-CG 3.91Å; V36-M53 HydrophobicContact CG1-CB 4.46Å; V36-M53 HydrophobicContact CG1-CG 4.14Å; V36-M53 HydrophobicContact CG1-SD 4.27Å; V36-M53 HydrophobicContact CG2-CG 4.44Å; Q49-M53 WeakPolarHBondContact CA-O 3.48Å; Q49-M53 WeakPolarHBondContact CG-O 3.33Å; K50-M53 PolarHBondContact N-O 3.28Å; K50-M53 PolarHBondContact O-N 3.05Å; A51-M53 HydrophobicContact CB-CE 4.09Å; A51-M53 PolarHBondContact O-N 3.22Å; M53-F55 HydrophobicContact CB-CD2 4.5Å; M53-F55 HydrophobicContact CB-CE2 3.87Å; M53-F55 HydrophobicContact CB-CZ 4.41Å; M53-F55 HydrophobicContact CE-CE2 4.04Å; M53-F55 HydrophobicContact CE-CZ 3.8Å
54	W	90.3	Very high	85.6	Confident	92 Å²	92	74.5 Å²	74.5	35%	0.348	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.4	173.9	-58.2	105	0	0	0	110.3	E35 V36 H37 C38 Q49 H56	E35-W54 PolarHBondContact OE1-NE1 3.07Å; E35-W54 VanDerWaalsContact OE1-NE1 3.09Å; V36-W54 PolarHBondContact O-N 3.48Å; H37-W54 CarbonylContact C-O 3.58Å; H37-W54 AromaticContact CE1-CD1 3.71Å; H37-W54 AromaticContact ND1-CD1 3.99Å; C38-W54 PolarHBondContact N-O 3.39Å; Q49-W54 HydrophobicContact CB-CE3 3.95Å; Q49-W54 HydrophobicContact CB-CZ3 3.96Å; Q49-W54 HydrophobicContact CG-CD2 4.22Å; Q49-W54 HydrophobicContact CG-CE3 3.89Å; Q49-W54 HydrophobicContact CG-CH2 4.36Å; Q49-W54 HydrophobicContact CG-CZ3 3.96Å; W54-H56 WeakPolarHBondContact CB-NE2 3.35Å
55	F	89.8	Confident	84.7	Confident	21 Å²	21	69.8 Å²	69.8	9%	0.092	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.1	177	-67.8	-96.6	0	0	0	109.2	C38 L43 H47 L48 K50 M53	C38-F55 HydrophobicContact CB-CD1 3.57Å; C38-F55 HydrophobicContact CB-CE1 3.75Å; C38-F55 HydrophobicContact CB-CG 4.2Å; C38-F55 CarbonylContact O-C 3.47Å; C38-F55 WeakPolarHBondContact O-CA 3.33Å; L43-F55 HydrophobicContact CD1-CB 3.73Å; L43-F55 HydrophobicContact CD2-CB 4.44Å; H47-F55 WeakPolarHBondContact CA-O 3.27Å; L48-F55 HydrophobicContact CB-CB 4.16Å; L48-F55 PolarHBondContact N-O 2.96Å; L48-F55 WeakPolarHBondContact O-CA 3.47Å; L48-F55 WeakPolarHBondContact O-CB 3.45Å; L48-F55 PolarHBondContact O-N 2.8Å; K50-F55 HydrophobicContact CB-CD2 4.25Å; K50-F55 HydrophobicContact CB-CE2 3.94Å; M53-F55 HydrophobicContact CB-CD2 4.5Å; M53-F55 HydrophobicContact CB-CE2 3.87Å; M53-F55 HydrophobicContact CB-CZ 4.41Å; M53-F55 HydrophobicContact CE-CE2 4.04Å; M53-F55 HydrophobicContact CE-CZ 3.8Å
56	H	89.3	Confident	83.6	Confident	10 Å²	10	67 Å²	67	5%	0.046	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.1	-176.7	-53	-77.3	0	0	0	110.3	H37 C38 F39 D40 H47 W54 I58 F86	H37-H56 AromaticContact CG-NE2 3.86Å; H37-H56 AromaticContact ND1-CE1 3.93Å; H37-H56 AromaticContact ND1-NE2 3.08Å; H37-H56 PolarHBondContact ND1-NE2 2.71Å; C38-H56 PolarHBondContact O-N 3.27Å; F39-H56 HydrophobicContact CD1-CB 3.91Å; F39-H56 HydrophobicContact CE1-CB 4.12Å; F39-H56 AromaticContact CE1-CD2 3.88Å; D40-H56 PolarHBondContact N-O 3.42Å; H47-H56 AromaticContact CE1-ND1 3.71Å; H47-H56 AromaticContact ND1-ND1 3.2Å; H47-H56 PolarHBondContact ND1-ND1 3.37Å; H47-H56 VanDerWaalsContact ND1-ND1 3.2Å; W54-H56 WeakPolarHBondContact CB-NE2 3.35Å; H56-I58 HydrophobicContact CB-CD1 4.01Å; H56-I58 HydrophobicContact CB-CG1 4.18Å; H56-I58 PolarHBondContact O-N 2.94Å; H56-F86 AromaticContact CE1-CE1 3.33Å; H56-F86 WeakPolarHBondContact CE1-CE1 3.47Å; H56-F86 AromaticContact CE1-CZ 3.56Å; H56-F86 AromaticContact CG-CZ 3.84Å; H56-F86 AromaticContact ND1-CE1 3.79Å; H56-F86 AromaticContact ND1-CZ 3.52Å; H56-F86 AromaticContact NE2-CE1 3.6Å; H56-F86 AromaticContact NE2-CZ 3.85Å
57	R	88.1	Confident	82.5	Confident	74 Å²	74	69.4 Å²	69.4	28%	0.279	35%	0.351	S	S	.	.			trans	-78	66.2	176.6	-166.1	-168.1	179.3	157.8	3	111.6	D40 L43 E44 P46	D40-R57 WeakPolarHBondContact O-CA 3.02Å; L43-R57 HydrophobicContact CB-CB 4.05Å; L43-R57 HydrophobicContact CB-CG 4.1Å; L43-R57 HydrophobicContact CD1-CB 4.43Å; L43-R57 WeakPolarHBondContact O-CD 3.35Å; L43-R57 WeakPolarHBondContact O-CG 3.47Å; L43-R57 PolarHBondContact O-NE 3.13Å; L43-R57 PolarHBondContact O-NH1 3.4Å; E44-R57 PolarHBondContact O-NH1 3.41Å; P46-R57 PolarHBondContact O-N 3.39Å
58	I	86.3	Confident	81.2	Confident	15 Å²	15	68.1 Å²	68.1	8%	0.077	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.1	-176.8	-58.7	173.4	0	0	0	107.5	F39 H56 A75 K77 I82 F86	F39-I58 HydrophobicContact CD1-CB 4.13Å; F39-I58 HydrophobicContact CD1-CD1 4.4Å; F39-I58 HydrophobicContact CE1-CD1 4.42Å; H56-I58 HydrophobicContact CB-CD1 4.01Å; H56-I58 HydrophobicContact CB-CG1 4.18Å; H56-I58 PolarHBondContact O-N 2.94Å; I58-A75 WeakPolarHBondContact CA-O 3.15Å; I58-K77 HydrophobicContact CG2-CB 4.32Å; I58-K77 HydrophobicContact CG2-CG 4.49Å; I58-I82 HydrophobicContact CG2-CD1 3.74Å; I58-I82 HydrophobicContact CG2-CG1 4.36Å; I58-F86 HydrophobicContact CD1-CE2 4.36Å
59	S	83.8	Confident	79.7	Confident	31 Å²	31	70.4 Å²	70.4	22%	0.217	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	128.6	167.9	-168.3	0	0	0	0	108.6	A75 S76 K77	S59-A75 PolarHBondContact N-O 2.99Å; S59-S76 CarbonylContact O-C 3.58Å; S59-S76 VanDerWaalsContact O-CA 3.28Å; S59-S76 WeakPolarHBondContact O-CA 3.27Å; S59-K77 PolarHBondContact O-N 2.95Å
60	I	84.9	Confident	78	Confident	8 Å²	8	68.5 Å²	68.5	4%	0.041	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.1	167.5	-50.5	-58.1	0	0	0	108.1	I16 F39 K77 L79 I82 M98 I105	I16-I60 HydrophobicContact CB-CG1 4.41Å; I16-I60 HydrophobicContact CD1-CG1 4.11Å; I16-I60 HydrophobicContact CD1-CG2 4.48Å; I16-I60 HydrophobicContact CG1-CG1 4.1Å; I16-I60 HydrophobicContact CG2-CB 4.02Å; I16-I60 HydrophobicContact CG2-CG1 3.47Å; I16-I60 VanDerWaalsContact CG2-CG1 3.47Å; F39-I60 HydrophobicContact CB-CD1 4.02Å; F39-I60 HydrophobicContact CB-CG1 4.1Å; F39-I60 HydrophobicContact CD1-CD1 4.15Å; F39-I60 HydrophobicContact CD2-CD1 4.24Å; F39-I60 HydrophobicContact CG-CD1 3.85Å; F39-I60 HydrophobicContact CG-CG1 4.39Å; I60-K77 WeakPolarHBondContact CA-O 3.45Å; I60-L79 HydrophobicContact CG2-CB 4.49Å; I60-I82 HydrophobicContact CD1-CD1 3.01Å; I60-I82 HydrophobicContact CD1-CG1 4.49Å; I60-I82 HydrophobicContact CG1-CD1 4.48Å; I60-M98 HydrophobicContact CB-CE 3.63Å; I60-M98 HydrophobicContact CB-SD 4.16Å; I60-M98 HydrophobicContact CG2-CE 3.96Å; I60-M98 HydrophobicContact CG2-SD 4.06Å; I60-M98 WeakPolarHBondContact O-CE 3.47Å; I60-I105 HydrophobicContact CG2-CD1 4.15Å
61	D	84.9	Confident	76.4	Confident	42 Å²	42	68.1 Å²	68.1	23%	0.225	39%	0.389	C	S	.	.			trans	-137.9	162.4	-179.2	-156.4	-36.4	0	0	0	109.9	R63 K77 K78	D61-R63 PolarHBondContact OD1-N 3.33Å; D61-R63 VanDerWaalsContact OD1-N 3.12Å; D61-K77 PolarHBondContact N-O 2.88Å; D61-K78 WeakPolarHBondContact O-CA 3.34Å
62	W	82.2	Confident	75	Confident	45 Å²	45	73.1 Å²	73.1	17%	0.17	40%	0.4	C	S	.	.	S	Bend	trans	-94.5	5.3	170	65.8	98.2	0	0	0	112.2	A101 K104 I105 N108 F132 E133	W62-A101 HydrophobicContact CE3-CB 4.11Å; W62-A101 HydrophobicContact CH2-CB 4.44Å; W62-A101 HydrophobicContact CZ3-CB 3.56Å; W62-K104 HydrophobicContact CB-CB 3.8Å; W62-K104 HydrophobicContact CD2-CB 3.59Å; W62-K104 HydrophobicContact CD2-CG 4.23Å; W62-K104 HydrophobicContact CE3-CB 4.14Å; W62-K104 HydrophobicContact CG-CB 3.42Å; W62-K104 VanDerWaalsContact CG-CB 3.42Å; W62-K104 HydrophobicContact CG-CG 4.23Å; W62-I105 HydrophobicContact CB-CG1 3.97Å; W62-I105 HydrophobicContact CE3-CD1 4.45Å; W62-I105 HydrophobicContact CE3-CG1 4.31Å; W62-N108 WeakPolarHBondContact CA-ND2 3.36Å; W62-N108 VanDerWaalsContact CB-ND2 3.26Å; W62-N108 WeakPolarHBondContact CB-ND2 3.5Å; W62-N108 PolarHBondContact O-ND2 3Å; W62-F132 HydrophobicContact CH2-CB 3.6Å; W62-F132 HydrophobicContact CH2-CD2 4.42Å; W62-F132 AromaticContact CH2-CG 4Å; W62-F132 HydrophobicContact CH2-CG 4Å; W62-F132 HydrophobicContact CZ2-CB 3.82Å; W62-E133 HydrophobicContact CZ2-CG 4.27Å; W62-E133 PolarHBondContact NE1-OE2 3.17Å
63	R	77.9	Confident	73.4	Confident	137 Å²	137	78.3 Å²	78.3	52%	0.517	41%	0.414	S	S	.	.	S	Bend	trans	-130.4	142.6	174.9	-62.4	177.1	179.3	-120.1	1	110.1	D61 E133	D61-R63 PolarHBondContact OD1-N 3.33Å; D61-R63 VanDerWaalsContact OD1-N 3.12Å; R63-E133 IonicContact CZ-OE1 3.43Å; R63-E133 IonicContact CZ-OE2 3.29Å; R63-E133 VanDerWaalsContact CZ-OE2 3.29Å; R63-E133 IonicContact NE-OE1 3.47Å; R63-E133 PolarHBondContact NE-OE1 3.42Å; R63-E133 IonicContact NE-OE2 3.14Å; R63-E133 PolarHBondContact NE-OE2 3.25Å; R63-E133 VanDerWaalsContact NE-OE2 3.14Å; R63-E133 IonicContact NH2-OE1 3.08Å; R63-E133 PolarHBondContact NH2-OE1 3.35Å; R63-E133 VanDerWaalsContact NH2-OE1 3.08Å; R63-E133 IonicContact NH2-OE2 2.66Å; R63-E133 PolarHBondContact NH2-OE2 2.76Å
64	D	68.8	Low	72	Confident	80 Å²	80	82.2 Å²	82.2	43%	0.428	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-71.8	141.9	164.3	-65.5	-57.5	0	0	0	108.6	S66 K78	D64-S66 PolarHBondContact O-N 2.84Å; D64-K78 WeakPolarHBondContact OD2-CD 3.36Å; D64-K78 WeakPolarHBondContact OD2-CE 3.29Å; D64-K78 IonicContact OD2-NZ 3.85Å; D64-K78 PolarHBondContact OD2-NZ 2.9Å
65	P	66	Low	71	Confident	79 Å²	79	80.1 Å²	80.1	51%	0.513	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-59.3	130.5	178.1	21.8	-30	0	0	0	109.5	S76	P65-S76 WeakPolarHBondContact CD-O 3.49Å
66	S	63.1	Low	70.5	Confident	57 Å²	57	80.3 Å²	80.3	40%	0.399	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-61.7	130	176.1	174.9	0	0	0	0	109.7	D64 A68 I69	D64-S66 PolarHBondContact O-N 2.84Å; S66-A68 PolarHBondContact O-N 3.36Å; S66-A68 PolarHBondContact OG-N 2.82Å; S66-I69 PolarHBondContact O-N 2.85Å
67	P	61.9	Low	70.4	Confident	138 Å²	138	82.8 Å²	82.8	90%	0.896	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.7	178.8	24.6	-32.8	0	0	0	113.1
68	A	59.6	Low	70.4	Confident	93 Å²	93	80.7 Å²	80.7	77%	0.769	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-11.3	176.7	0	0	0	0	0	113.9	S66	S66-A68 PolarHBondContact O-N 3.36Å; S66-A68 PolarHBondContact OG-N 2.82Å
69	I	58.3	Low	70.3	Confident	111 Å²	111	80.3 Å²	80.3	57%	0.569	44%	0.44	S	S	*	.	S	Bend	trans	-99.2	123	178.7	-57.9	174	0	0	0	107	S66	S66-I69 PolarHBondContact O-N 2.85Å
70	A	53.4	Low	70.5	Confident	80 Å²	80	79.6 Å²	79.6	66%	0.661	44%	0.437	S	S	*	.			trans	-47.3	137.1	175.6	0	0	0	0	0	109.8	K72	A70-K72 PolarHBondContact O-N 2.52Å
71	P	54.7	Low	70.6	Confident	130 Å²	130	81.2 Å²	81.2	84%	0.844	45%	0.447	S	S	*	.			trans	-54.1	112.5	-177.9	20.5	-30.6	0	0	0	108.1
72	K	55.1	Low	70.6	Confident	160 Å²	160	79.2 Å²	79.2	70%	0.696	44%	0.436	S	S	*	.			trans	-55.7	150.8	170.3	-80.4	-177.6	176.6	177.2	0	106.9	A70 Q74	A70-K72 PolarHBondContact O-N 2.52Å; K72-Q74 CarbonylContact O-C 3.59Å; K72-Q74 PolarHBondContact O-N 3.32Å
73	R	53.5	Low	70.8	Confident	239 Å²	239	77.4 Å²	77.4	90%	0.902	43%	0.43	S	S	*	.	S	Bend	trans	-56.3	-12.8	172.7	-67.5	176.9	81.9	178.9	4.8	112.9
74	Q	60.4	Low	71.2	Confident	85 Å²	85	77.1 Å²	77.1	40%	0.397	44%	0.438	S	S	.	.	S	Bend	trans	-110.5	125.9	172.8	-77.2	163.7	-30.8	0	0	109.7	P41 K72 S76	P41-Q74 HydrophobicContact CB-CG 4.48Å; P41-Q74 PolarHBondContact O-NE2 3.45Å; K72-Q74 CarbonylContact O-C 3.59Å; K72-Q74 PolarHBondContact O-N 3.32Å; Q74-S76 PolarHBondContact O-N 3.39Å
75	A	69.9	Low	71.9	Confident	47 Å²	47	77.8 Å²	77.8	39%	0.388	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	113.5	169.9	0	0	0	0	0	108.7	I58 S59	I58-A75 WeakPolarHBondContact CA-O 3.15Å; S59-A75 PolarHBondContact N-O 2.99Å
76	S	78.8	Confident	72.7	Confident	26 Å²	26	77.1 Å²	77.1	18%	0.182	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.3	164.8	58.3	0	0	0	0	108.8	S59 P65 Q74	S59-S76 CarbonylContact O-C 3.58Å; S59-S76 VanDerWaalsContact O-CA 3.28Å; S59-S76 WeakPolarHBondContact O-CA 3.27Å; P65-S76 WeakPolarHBondContact CD-O 3.49Å; Q74-S76 PolarHBondContact O-N 3.39Å
77	K	85.9	Confident	73.5	Confident	61 Å²	61	77 Å²	77	27%	0.265	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	149.8	179.7	-66.8	-175.4	178.2	-173.7	0	110.4	I58 S59 I60 D61 T81 I82 D85	I58-K77 HydrophobicContact CG2-CB 4.32Å; I58-K77 HydrophobicContact CG2-CG 4.49Å; S59-K77 PolarHBondContact O-N 2.95Å; I60-K77 WeakPolarHBondContact CA-O 3.45Å; D61-K77 PolarHBondContact N-O 2.88Å; K77-T81 HydrophobicContact CD-CG2 4.39Å; K77-I82 HydrophobicContact CB-CD1 3.9Å; K77-I82 HydrophobicContact CB-CG1 3.76Å; K77-I82 HydrophobicContact CD-CG1 4.12Å; K77-D85 IonicContact NZ-OD2 2.84Å; K77-D85 PolarHBondContact NZ-OD2 3.5Å
78	K	88.6	Confident	74.4	Confident	31 Å²	31	71.6 Å²	71.6	14%	0.135	40%	0.402	C	S	.	.			trans	-66.3	153.8	166.4	-66.2	179.6	-179.5	165.1	0	111.3	D61 D64 A80 T81 I82 E112	D61-K78 WeakPolarHBondContact O-CA 3.34Å; D64-K78 WeakPolarHBondContact OD2-CD 3.36Å; D64-K78 WeakPolarHBondContact OD2-CE 3.29Å; D64-K78 IonicContact OD2-NZ 3.85Å; D64-K78 PolarHBondContact OD2-NZ 2.9Å; K78-A80 VanDerWaalsContact C-N 3.31Å; K78-A80 PolarHBondContact O-N 2.98Å; K78-T81 PolarHBondContact O-N 3.38Å; K78-I82 WeakPolarHBondContact O-CG1 3.35Å; K78-I82 PolarHBondContact O-N 3.29Å; K78-I82 VanDerWaalsContact O-N 3.1Å; K78-E112 WeakPolarHBondContact CD-OE1 3.31Å; K78-E112 WeakPolarHBondContact CE-OE1 3.44Å; K78-E112 IonicContact NZ-OE1 2.59Å; K78-E112 PolarHBondContact NZ-OE1 2.76Å
79	L	85.1	Confident	75.3	Confident	6 Å²	6	76.7 Å²	76.7	3%	0.031	40%	0.401	C	S	.	.	H	α-helix	trans	-60.8	-41.1	176.6	-174.9	59.3	0	0	0	111.8	I16 I60 T81 I82 L83 L94 L109	I16-L79 HydrophobicContact CD1-CD1 3.8Å; I16-L79 HydrophobicContact CD1-CD2 4.07Å; I60-L79 HydrophobicContact CG2-CB 4.49Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 2.9Å; L79-I82 PolarHBondContact O-N 2.81Å; L79-I82 VanDerWaalsContact O-N 3.13Å; L79-L83 HydrophobicContact CD1-CD2 4.49Å; L79-L83 HydrophobicContact CD1-CG 4.26Å; L79-L83 HydrophobicContact CG-CD1 4.18Å; L79-L83 HydrophobicContact CG-CG 4.27Å; L79-L83 WeakPolarHBondContact O-CG 3.26Å; L79-L83 PolarHBondContact O-N 3.1Å; L79-L94 HydrophobicContact CD2-CD1 3.65Å; L79-L94 HydrophobicContact CD2-CD2 3.56Å; L79-L94 HydrophobicContact CD2-CG 4.27Å; L79-L109 HydrophobicContact CB-CD2 3.97Å; L79-L109 HydrophobicContact CD2-CD1 4.4Å; L79-L109 HydrophobicContact CD2-CD2 3.64Å; L79-L109 HydrophobicContact CG-CD2 4.26Å
80	A	86.6	Confident	76.7	Confident	17 Å²	17	72.5 Å²	72.5	14%	0.14	38%	0.38	C	S	.	.	H	α-helix	trans	-55.4	-49.8	176.5	0	0	0	0	0	111.7	K78 I82 L83 D84 E112 V114	K78-A80 VanDerWaalsContact C-N 3.31Å; K78-A80 PolarHBondContact O-N 2.98Å; A80-I82 VanDerWaalsContact C-N 3.27Å; A80-I82 PolarHBondContact O-N 2.81Å; A80-L83 PolarHBondContact O-N 2.82Å; A80-L83 VanDerWaalsContact O-N 3.15Å; A80-D84 PolarHBondContact O-N 2.87Å; A80-E112 WeakPolarHBondContact CB-OE2 3.25Å; A80-V114 HydrophobicContact CB-CG2 3.58Å
81	T	87.3	Confident	78.5	Confident	41 Å²	41	68.8 Å²	68.8	25%	0.252	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-38.7	177.5	-48.6	0	0	0	0	112.1	K77 K78 L79 D85	K77-T81 HydrophobicContact CD-CG2 4.39Å; K78-T81 PolarHBondContact O-N 3.38Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 2.9Å; T81-D85 WeakPolarHBondContact O-CB 3.21Å; T81-D85 PolarHBondContact O-N 2.87Å
82	I	86.6	Confident	80.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.4	-45.7	176.7	-70.2	164.9	0	0	0	110.8	F39 I58 I60 K77 K78 L79 A80 D84 D85 F86	F39-I82 HydrophobicContact CD1-CD1 4.45Å; F39-I82 HydrophobicContact CD1-CG2 4.43Å; F39-I82 HydrophobicContact CE1-CD1 4.42Å; F39-I82 HydrophobicContact CE1-CG2 3.45Å; F39-I82 VanDerWaalsContact CE1-CG2 3.45Å; F39-I82 HydrophobicContact CE2-CG2 4.45Å; F39-I82 HydrophobicContact CZ-CG2 3.47Å; F39-I82 VanDerWaalsContact CZ-CG2 3.47Å; I58-I82 HydrophobicContact CG2-CD1 3.74Å; I58-I82 HydrophobicContact CG2-CG1 4.36Å; I60-I82 HydrophobicContact CD1-CD1 3.01Å; I60-I82 HydrophobicContact CD1-CG1 4.49Å; I60-I82 HydrophobicContact CG1-CD1 4.48Å; K77-I82 HydrophobicContact CB-CD1 3.9Å; K77-I82 HydrophobicContact CB-CG1 3.76Å; K77-I82 HydrophobicContact CD-CG1 4.12Å; K78-I82 WeakPolarHBondContact O-CG1 3.35Å; K78-I82 PolarHBondContact O-N 3.29Å; K78-I82 VanDerWaalsContact O-N 3.1Å; L79-I82 PolarHBondContact O-N 2.81Å; L79-I82 VanDerWaalsContact O-N 3.13Å; A80-I82 VanDerWaalsContact C-N 3.27Å; A80-I82 PolarHBondContact O-N 2.81Å; I82-D84 VanDerWaalsContact C-N 3.25Å; I82-D84 PolarHBondContact O-N 2.83Å; I82-D85 PolarHBondContact O-N 2.87Å; I82-F86 HydrophobicContact CG2-CD2 3.93Å; I82-F86 HydrophobicContact CG2-CE2 3.92Å; I82-F86 WeakPolarHBondContact O-CD2 3.38Å; I82-F86 PolarHBondContact O-N 3.11Å; I82-F86 VanDerWaalsContact O-N 3.09Å
83	L	84.7	Confident	82.1	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-39.7	177.5	-65.3	178.5	0	0	0	111.5	F14 L79 A80 G87 H88 V91 V114	F14-L83 HydrophobicContact CD1-CD2 3.77Å; F14-L83 HydrophobicContact CE1-CD2 3.71Å; F14-L83 HydrophobicContact CG-CD2 4.27Å; F14-L83 HydrophobicContact CZ-CD2 4.18Å; L79-L83 HydrophobicContact CD1-CD2 4.49Å; L79-L83 HydrophobicContact CD1-CG 4.26Å; L79-L83 HydrophobicContact CG-CD1 4.18Å; L79-L83 HydrophobicContact CG-CG 4.27Å; L79-L83 WeakPolarHBondContact O-CG 3.26Å; L79-L83 PolarHBondContact O-N 3.1Å; A80-L83 PolarHBondContact O-N 2.82Å; A80-L83 VanDerWaalsContact O-N 3.15Å; L83-G87 PolarHBondContact O-N 2.9Å; L83-H88 HydrophobicContact CD2-CB 4.41Å; L83-H88 PolarHBondContact O-N 2.85Å; L83-V91 HydrophobicContact CD1-CG2 4.06Å; L83-V91 HydrophobicContact CD2-CG2 3.46Å; L83-V91 VanDerWaalsContact CD2-CG2 3.46Å; L83-V91 HydrophobicContact CG-CG2 4.4Å; L83-V114 HydrophobicContact CD1-CG1 3.62Å
84	D	86.2	Confident	84	Confident	130 Å²	130	45 Å²	45	70%	0.695	24%	0.241	S	C	*	.	H	α-helix	trans	-65.7	-47.6	175	-77.6	-17.1	0	0	0	112.7	A80 I82 F86 G87	A80-D84 PolarHBondContact O-N 2.87Å; I82-D84 VanDerWaalsContact C-N 3.25Å; I82-D84 PolarHBondContact O-N 2.83Å; D84-F86 PolarHBondContact O-N 2.79Å; D84-G87 PolarHBondContact O-N 3.08Å
85	D	84.8	Confident	85.5	Confident	94 Å²	94	43 Å²	43	50%	0.503	23%	0.23	S	C	.	.	H	α-helix	trans	-58.8	-37	-179.9	-80.5	-19.5	0	0	0	112.3	K77 T81 I82	K77-D85 IonicContact NZ-OD2 2.84Å; K77-D85 PolarHBondContact NZ-OD2 3.5Å; T81-D85 WeakPolarHBondContact O-CB 3.21Å; T81-D85 PolarHBondContact O-N 2.87Å; I82-D85 PolarHBondContact O-N 2.87Å
86	F	82	Confident	86.3	Confident	65 Å²	65	40.9 Å²	40.9	29%	0.285	21%	0.213	S	C	.	.	H	α-helix	trans	-89.3	-6.6	178.6	-74.5	-106.3	0	0	0	112.9	F39 H56 I58 I82 D84 H88	F39-F86 HydrophobicContact CE1-CE2 4.31Å; F39-F86 HydrophobicContact CE1-CZ 4.35Å; H56-F86 AromaticContact CE1-CE1 3.33Å; H56-F86 WeakPolarHBondContact CE1-CE1 3.47Å; H56-F86 AromaticContact CE1-CZ 3.56Å; H56-F86 AromaticContact CG-CZ 3.84Å; H56-F86 AromaticContact ND1-CE1 3.79Å; H56-F86 AromaticContact ND1-CZ 3.52Å; H56-F86 AromaticContact NE2-CE1 3.6Å; H56-F86 AromaticContact NE2-CZ 3.85Å; I58-F86 HydrophobicContact CD1-CE2 4.36Å; I82-F86 HydrophobicContact CG2-CD2 3.93Å; I82-F86 HydrophobicContact CG2-CE2 3.92Å; I82-F86 WeakPolarHBondContact O-CD2 3.38Å; I82-F86 PolarHBondContact O-N 3.11Å; I82-F86 VanDerWaalsContact O-N 3.09Å; D84-F86 PolarHBondContact O-N 2.79Å; F86-H88 VanDerWaalsContact C-N 3.26Å; F86-H88 WeakPolarHBondContact CB-CD2 3.47Å; F86-H88 PolarHBondContact O-N 2.76Å
87	G	81.3	Confident	86.8	Confident	55 Å²	55	40.5 Å²	40.5	57%	0.567	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.4	17.2	-179.1	0	0	0	0	0	114.5	L83 D84 R89	L83-G87 PolarHBondContact O-N 2.9Å; D84-G87 PolarHBondContact O-N 3.08Å; G87-R89 PolarHBondContact O-N 2.79Å
88	H	80.2	Confident	86.6	Confident	24 Å²	24	37.7 Å²	37.7	11%	0.111	20%	0.197	C	C	.	.			trans	-84.1	103.3	178.8	-62.1	-71	0	0	0	110.5	H12 F14 H37 L83 F86	H12-H88 AromaticContact CE1-CE1 3.63Å; H12-H88 AromaticContact CE1-ND1 3.61Å; H12-H88 AromaticContact CG-ND1 3.8Å; H12-H88 AromaticContact ND1-CE1 3.49Å; H12-H88 PolarHBondContact ND1-CE1 3.5Å; H12-H88 AromaticContact ND1-ND1 3.48Å; H12-H88 PolarHBondContact ND1-ND1 2.61Å; H12-H88 AromaticContact NE2-ND1 3.99Å; F14-H88 HydrophobicContact CE2-CB 4.43Å; F14-H88 AromaticContact CE2-CD2 3.99Å; F14-H88 HydrophobicContact CZ-CB 4.23Å; F14-H88 AromaticContact CZ-CD2 3.26Å; F14-H88 WeakPolarHBondContact CZ-CD2 3.24Å; F14-H88 AromaticContact CZ-CG 3.78Å; F14-H88 AromaticContact CZ-NE2 3.73Å; H37-H88 AromaticContact CE1-NE2 3.85Å; H37-H88 AromaticContact NE2-CE1 3.8Å; H37-H88 AromaticContact NE2-NE2 3.5Å; H37-H88 PolarHBondContact NE2-NE2 2.77Å; L83-H88 HydrophobicContact CD2-CB 4.41Å; L83-H88 PolarHBondContact O-N 2.85Å; F86-H88 VanDerWaalsContact C-N 3.26Å; F86-H88 WeakPolarHBondContact CB-CD2 3.47Å; F86-H88 PolarHBondContact O-N 2.76Å
89	R	77.8	Confident	86.5	Confident	201 Å²	201	40.7 Å²	40.7	76%	0.758	21%	0.211	S	C	*	.			trans	-88.4	-14.2	176.2	-62.4	-176.6	179.2	-166.9	-1.8	113.6	G87 S117	G87-R89 PolarHBondContact O-N 2.79Å; R89-S117 VanDerWaalsContact O-CB 3.27Å; R89-S117 WeakPolarHBondContact O-CB 3.28Å; R89-S117 PolarHBondContact O-OG 3.22Å
90	D	88.6	Confident	86.5	Confident	23 Å²	23	40.5 Å²	40.5	12%	0.123	21%	0.211	C	C	.	.			trans	-132	114.7	-178.2	-68	-51	0	0	0	108.6	W193 P195 S196	D90-W193 HydrophobicContact CB-CZ2 4.12Å; D90-P195 WeakPolarHBondContact OD1-CA 3.12Å; D90-S196 PolarHBondContact OD1-N 2.84Å; D90-S196 VanDerWaalsContact OD1-N 3.13Å; D90-S196 WeakPolarHBondContact OD2-CB 3.21Å; D90-S196 PolarHBondContact OD2-N 2.54Å; D90-S196 PolarHBondContact OD2-OG 2.67Å
91	V	91.1	Very high	86.6	Confident	1 Å²	1	40 Å²	40	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	113.6	175.5	177.9	0	0	0	0	107.9	F14 L83 L94 S117 V118 G119	F14-V91 HydrophobicContact CB-CG1 4.14Å; F14-V91 HydrophobicContact CD2-CG1 3.87Å; F14-V91 HydrophobicContact CD2-CG2 4.09Å; F14-V91 HydrophobicContact CE2-CG2 4.43Å; F14-V91 HydrophobicContact CG-CG1 4.23Å; L83-V91 HydrophobicContact CD1-CG2 4.06Å; L83-V91 HydrophobicContact CD2-CG2 3.46Å; L83-V91 VanDerWaalsContact CD2-CG2 3.46Å; L83-V91 HydrophobicContact CG-CG2 4.4Å; V91-L94 HydrophobicContact CG1-CB 4.15Å; V91-S117 PolarHBondContact N-O 2.95Å; V91-V118 HydrophobicContact CB-CG2 4.28Å; V91-V118 CarbonylContact O-C 3.59Å; V91-V118 WeakPolarHBondContact O-CA 3.47Å; V91-G119 PolarHBondContact O-N 3.38Å
92	D	92.1	Very high	86.6	Confident	16 Å²	16	38 Å²	38	9%	0.086	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-42.1	-178.8	-70.7	-78	0	0	0	112.4	K8 C11 H12 Q120 W193	K8-D92 VanDerWaalsContact CE-OD1 3.29Å; K8-D92 WeakPolarHBondContact CE-OD1 3.35Å; K8-D92 WeakPolarHBondContact CE-OD2 3.29Å; K8-D92 IonicContact NZ-OD1 2.61Å; K8-D92 PolarHBondContact NZ-OD1 3.27Å; K8-D92 IonicContact NZ-OD2 2.86Å; K8-D92 PolarHBondContact NZ-OD2 3.47Å; C11-D92 VanDerWaalsContact CA-OD2 3.25Å; C11-D92 WeakPolarHBondContact CA-OD2 3.47Å; H12-D92 PolarHBondContact N-OD2 3.19Å; H12-D92 WeakPolarHBondContact O-CB 3.27Å; H12-D92 PolarHBondContact O-N 2.84Å; D92-Q120 WeakPolarHBondContact O-CB 3.24Å; D92-Q120 PolarHBondContact O-N 2.99Å; D92-W193 WeakPolarHBondContact OD1-CH2 3.32Å
93	V	93	Very high	86.9	Confident	13 Å²	13	38.2 Å²	38.2	8%	0.079	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	117.6	-177.9	-175.7	0	0	0	0	108.9	H12 A13 F14 L29 Q120 L122	H12-V93 PolarHBondContact O-N 2.85Å; A13-V93 CarbonylContact C-O 3.5Å; A13-V93 WeakPolarHBondContact CA-O 3.38Å; A13-V93 HydrophobicContact CB-CB 4.26Å; F14-V93 PolarHBondContact N-O 3.34Å; L29-V93 HydrophobicContact CD1-CB 4.42Å; L29-V93 HydrophobicContact CD1-CG1 4.25Å; L29-V93 HydrophobicContact CD2-CG2 4.35Å; V93-Q120 HydrophobicContact CG2-CB 4.48Å; V93-L122 HydrophobicContact CG1-CD1 3.94Å
94	L	92.6	Very high	87.3	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	118.1	168.7	177.4	58.7	0	0	0	108	F14 I16 L79 V91 L109 V118 Q120 L121 L122	F14-L94 HydrophobicContact CB-CD1 4.03Å; F14-L94 WeakPolarHBondContact O-CD1 3.22Å; I16-L94 HydrophobicContact CD1-CD1 3.66Å; I16-L94 HydrophobicContact CG1-CD1 4.41Å; L79-L94 HydrophobicContact CD2-CD1 3.65Å; L79-L94 HydrophobicContact CD2-CD2 3.56Å; L79-L94 HydrophobicContact CD2-CG 4.27Å; V91-L94 HydrophobicContact CG1-CB 4.15Å; L94-L109 HydrophobicContact CD2-CD1 3.99Å; L94-V118 HydrophobicContact CB-CG1 3.79Å; L94-V118 HydrophobicContact CB-CG2 4.42Å; L94-V118 HydrophobicContact CD2-CG1 4.43Å; L94-V118 HydrophobicContact CD2-CG2 3.99Å; L94-Q120 PolarHBondContact N-O 3.11Å; L94-L121 HydrophobicContact CB-CD1 4.19Å; L94-L121 HydrophobicContact CD2-CD1 3.94Å; L94-L121 HydrophobicContact CG-CD1 3.93Å; L94-L121 CarbonylContact O-C 3.5Å; L94-L121 WeakPolarHBondContact O-CA 3.32Å; L94-L122 PolarHBondContact O-N 2.93Å
95	K	91.6	Very high	87.4	Confident	41 Å²	41	33.2 Å²	33.2	18%	0.178	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.1	169.7	171.5	-175.7	167.2	-166.6	0	107.7	F14 I16 L25 E26 L122	F14-K95 PolarHBondContact O-N 3.24Å; F14-K95 VanDerWaalsContact O-N 3.1Å; I16-K95 WeakPolarHBondContact CA-O 3.33Å; I16-K95 WeakPolarHBondContact CB-O 3.38Å; I16-K95 PolarHBondContact N-O 2.98Å; L25-K95 HydrophobicContact CD2-CD 4.01Å; E26-K95 WeakPolarHBondContact OE1-CD 3.43Å; E26-K95 IonicContact OE1-NZ 3.41Å; E26-K95 PolarHBondContact OE1-NZ 3.15Å; E26-K95 IonicContact OE2-NZ 3.8Å; K95-L122 CarbonylContact C-O 3.55Å; K95-L122 VanDerWaalsContact CA-O 3.29Å; K95-L122 WeakPolarHBondContact CA-O 3.07Å; K95-L122 HydrophobicContact CB-CB 4.16Å; K95-L122 HydrophobicContact CG-CB 4.29Å
96	A	88.5	Confident	87.8	Confident	4 Å²	4	28.9 Å²	28.9	3%	0.033	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	111.7	179.2	0	0	0	0	0	109.7	L122 L123 E124	A96-L122 PolarHBondContact N-O 2.96Å; A96-L123 HydrophobicContact CB-CD1 3.87Å; A96-E124 PolarHBondContact O-N 3.36Å
97	D	87.7	Confident	88.4	Confident	17 Å²	17	28.1 Å²	28.1	9%	0.091	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	109	172.4	159.4	27.5	0	0	0	107	I16 S17 L18 E124 H126	I16-D97 PolarHBondContact O-N 3.47Å; S17-D97 WeakPolarHBondContact CA-O 3.45Å; S17-D97 PolarHBondContact OG-OD2 3.3Å; L18-D97 PolarHBondContact N-O 3.27Å; D97-E124 HydrophobicContact CB-CB 3.97Å; D97-H126 IonicContact OD1-CE1 2.79Å; D97-H126 PolarHBondContact OD1-CE1 3.17Å
98	M	83.1	Confident	88.9	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.01	12%	0.121	C	C	.	.			trans	-138.9	29	-164.6	-63.2	-162.5	62.3	0	0	113.7	I16 L18 I60 S100 A101 E102 I105	I16-M98 HydrophobicContact CG2-CE 4.27Å; I16-M98 HydrophobicContact CG2-CG 3.94Å; I16-M98 HydrophobicContact CG2-SD 3.57Å; I16-M98 VanDerWaalsContact CG2-SD 3.57Å; L18-M98 HydrophobicContact CD1-CB 4.23Å; L18-M98 WeakPolarHBondContact CD1-O 3.36Å; I60-M98 HydrophobicContact CB-CE 3.63Å; I60-M98 HydrophobicContact CB-SD 4.16Å; I60-M98 HydrophobicContact CG2-CE 3.96Å; I60-M98 HydrophobicContact CG2-SD 4.06Å; I60-M98 WeakPolarHBondContact O-CE 3.47Å; M98-S100 VanDerWaalsContact C-N 3.33Å; M98-S100 PolarHBondContact O-N 3.24Å; M98-A101 HydrophobicContact CB-CB 4.09Å; M98-A101 VanDerWaalsContact O-CB 3.27Å; M98-A101 WeakPolarHBondContact O-CB 3.29Å; M98-A101 PolarHBondContact O-N 3.02Å; M98-E102 HydrophobicContact CB-CB 4.46Å; M98-I105 HydrophobicContact CE-CD1 3.03Å; M98-I105 HydrophobicContact CG-CD1 4.41Å; M98-I105 HydrophobicContact SD-CD1 3.06Å; M98-I105 WeakPolarHBondContact SD-CD1 3.33Å; M98-I105 HydrophobicContact SD-CG1 4.35Å; M98-I105 HydrophobicContact SD-CG2 4.41Å
99	E	85.4	Confident	89.4	Confident	94 Å²	94	25.9 Å²	25.9	44%	0.439	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	51.9	168.9	-62.9	-66.7	167.1	0	0	112.9	L18 A101 H126	L18-E99 HydrophobicContact CB-CG 4.12Å; L18-E99 HydrophobicContact CD1-CB 4.27Å; L18-E99 HydrophobicContact CD1-CG 4.5Å; E99-A101 VanDerWaalsContact C-N 3.35Å; E99-A101 PolarHBondContact O-N 3.25Å; E99-H126 IonicContact OE2-NE2 3.67Å
100	S	86	Confident	90.1	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.014	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	-1.8	-177.8	-36.7	0	0	0	0	116.9	M98 E102 H126 H128 W129 G131	M98-S100 VanDerWaalsContact C-N 3.33Å; M98-S100 PolarHBondContact O-N 3.24Å; S100-E102 VanDerWaalsContact C-N 3.31Å; S100-E102 WeakPolarHBondContact CA-OE2 3.48Å; S100-E102 PolarHBondContact N-OE2 3.39Å; S100-H126 WeakPolarHBondContact OG-CB 3.37Å; S100-H128 PolarHBondContact OG-CE1 3.34Å; S100-W129 PolarHBondContact OG-NE1 3.33Å; S100-G131 WeakPolarHBondContact O-CA 3.44Å
101	A	87.3	Confident	90.2	Very high	6 Å²	6	23.4 Å²	23.4	5%	0.05	12%	0.12	C	C	.	.			trans	-81	-12.1	169.7	0	0	0	0	0	113	W62 M98 E99 W103 K104 I105 F132	W62-A101 HydrophobicContact CE3-CB 4.11Å; W62-A101 HydrophobicContact CH2-CB 4.44Å; W62-A101 HydrophobicContact CZ3-CB 3.56Å; M98-A101 HydrophobicContact CB-CB 4.09Å; M98-A101 VanDerWaalsContact O-CB 3.27Å; M98-A101 WeakPolarHBondContact O-CB 3.29Å; M98-A101 PolarHBondContact O-N 3.02Å; E99-A101 VanDerWaalsContact C-N 3.35Å; E99-A101 PolarHBondContact O-N 3.25Å; A101-W103 PolarHBondContact O-N 2.93Å; A101-W103 VanDerWaalsContact O-N 3.12Å; A101-K104 PolarHBondContact O-N 3.03Å; A101-I105 HydrophobicContact CB-CD1 4.32Å; A101-I105 PolarHBondContact O-N 3.14Å; A101-F132 HydrophobicContact CB-CD2 4.13Å
102	E	88.4	Confident	90.2	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-58	-29.6	-176.9	66.5	-83	-179.7	0	0	113.2	M98 S100 I105 L106 L123 E124 L125 H126	M98-E102 HydrophobicContact CB-CB 4.46Å; S100-E102 VanDerWaalsContact C-N 3.31Å; S100-E102 WeakPolarHBondContact CA-OE2 3.48Å; S100-E102 PolarHBondContact N-OE2 3.39Å; E102-I105 PolarHBondContact O-N 3.31Å; E102-L106 WeakPolarHBondContact O-CB 3.23Å; E102-L106 PolarHBondContact O-N 2.79Å; E102-L123 HydrophobicContact CB-CD1 3.93Å; E102-L123 HydrophobicContact CG-CD1 4.41Å; E102-E124 WeakPolarHBondContact CG-O 3.13Å; E102-L125 HydrophobicContact CG-CD2 4.13Å; E102-H126 WeakPolarHBondContact OE1-CB 3.34Å; E102-H126 IonicContact OE1-CG 2.77Å; E102-H126 PolarHBondContact OE1-N 3.43Å; E102-H126 IonicContact OE1-ND1 3.63Å; E102-H126 IonicContact OE2-ND1 2.67Å
103	W	92.7	Very high	90.1	Very high	3 Å²	3	28 Å²	28	1%	0.011	15%	0.15	C	C	.	.	H	α-helix	trans	-64.6	-45.9	179.5	-64.4	113.9	0	0	0	112.6	A101 I105 E107 L125 H126 L127 V134 Y144 W145 L148 L149	A101-W103 PolarHBondContact O-N 2.93Å; A101-W103 VanDerWaalsContact O-N 3.12Å; W103-I105 VanDerWaalsContact C-N 3.33Å; W103-E107 PolarHBondContact O-N 3.04Å; W103-L125 HydrophobicContact CE3-CD2 4.44Å; W103-L125 HydrophobicContact CH2-CD1 3.7Å; W103-L125 HydrophobicContact CH2-CD2 3.53Å; W103-L125 HydrophobicContact CH2-CG 4.14Å; W103-L125 HydrophobicContact CZ2-CB 4.23Å; W103-L125 HydrophobicContact CZ2-CD1 4.13Å; W103-L125 HydrophobicContact CZ2-CD2 3.69Å; W103-L125 HydrophobicContact CZ2-CG 4.24Å; W103-L125 HydrophobicContact CZ3-CD2 3.92Å; W103-H126 PolarHBondContact NE1-O 3.36Å; W103-L127 HydrophobicContact CH2-CD2 4.42Å; W103-L127 HydrophobicContact CZ2-CD2 3.64Å; W103-V134 HydrophobicContact CB-CG2 4.48Å; W103-Y144 HydrophobicContact CB-CE1 4.25Å; W103-W145 AromaticContact CD1-NE1 3.53Å; W103-W145 AromaticContact CD2-CD1 3.2Å; W103-W145 AromaticContact CD2-CG 3.94Å; W103-W145 HydrophobicContact CD2-CG 3.94Å; W103-W145 AromaticContact CD2-NE1 3.41Å; W103-W145 AromaticContact CE2-CD1 3.39Å; W103-W145 AromaticContact CE2-CD2 3.97Å; W103-W145 AromaticContact CE2-CE2 3.62Å; W103-W145 AromaticContact CE2-CG 3.8Å; W103-W145 AromaticContact CE2-NE1 3.29Å; W103-W145 VanDerWaalsContact CE2-NE1 3.29Å; W103-W145 HydrophobicContact CE3-CB 4.12Å; W103-W145 AromaticContact CE3-CD1 3.4Å; W103-W145 VanDerWaalsContact CE3-CD1 3.4Å; W103-W145 AromaticContact CE3-CG 3.92Å; W103-W145 HydrophobicContact CE3-CG 3.92Å; W103-W145 AromaticContact CG-CD1 3.72Å; W103-W145 AromaticContact CG-NE1 3.54Å; W103-W145 HydrophobicContact CH2-CB 3.52Å; W103-W145 AromaticContact CH2-CD1 3.86Å; W103-W145 HydrophobicContact CH2-CD2 4.09Å; W103-W145 AromaticContact CH2-CG 3.56Å; W103-W145 HydrophobicContact CH2-CG 3.56Å; W103-W145 HydrophobicContact CZ2-CB 4.09Å; W103-W145 AromaticContact CZ2-CD1 3.71Å; W103-W145 AromaticContact CZ2-CD2 3.72Å; W103-W145 HydrophobicContact CZ2-CD2 3.72Å; W103-W145 AromaticContact CZ2-CE2 3.84Å; W103-W145 HydrophobicContact CZ2-CE3 4.35Å; W103-W145 AromaticContact CZ2-CG 3.61Å; W103-W145 HydrophobicContact CZ2-CG 3.61Å; W103-W145 HydrophobicContact CZ2-CZ2 4.47Å; W103-W145 AromaticContact CZ2-NE1 3.87Å; W103-W145 HydrophobicContact CZ3-CB 3.55Å; W103-W145 AromaticContact CZ3-CD1 3.73Å; W103-W145 AromaticContact CZ3-CG 3.74Å; W103-W145 HydrophobicContact CZ3-CG 3.74Å; W103-W145 AromaticContact NE1-CD1 3.97Å; W103-W145 AromaticContact NE1-CE2 3.66Å; W103-W145 AromaticContact NE1-CZ2 3.91Å; W103-W145 AromaticContact NE1-NE1 3.38Å; W103-L148 HydrophobicContact CE3-CD1 4.04Å; W103-L148 VanDerWaalsContact O-CD1 3.28Å; W103-L148 WeakPolarHBondContact O-CD1 3.07Å; W103-L149 HydrophobicContact CZ3-CG 4.5Å
104	K	92.1	Very high	89.9	Confident	27 Å²	27	27.9 Å²	27.9	12%	0.117	15%	0.149	C	C	.	.	H	α-helix	trans	-72.7	-30.9	177.6	-75.1	-59.2	-171.7	-168.4	0	112.8	W62 A101 E107 N108 F132 E133 Y144	W62-K104 HydrophobicContact CB-CB 3.8Å; W62-K104 HydrophobicContact CD2-CB 3.59Å; W62-K104 HydrophobicContact CD2-CG 4.23Å; W62-K104 HydrophobicContact CE3-CB 4.14Å; W62-K104 HydrophobicContact CG-CB 3.42Å; W62-K104 VanDerWaalsContact CG-CB 3.42Å; W62-K104 HydrophobicContact CG-CG 4.23Å; A101-K104 PolarHBondContact O-N 3.03Å; K104-E107 VanDerWaalsContact CD-OE2 3.25Å; K104-E107 WeakPolarHBondContact CD-OE2 3.45Å; K104-E107 IonicContact NZ-OE1 3.97Å; K104-E107 IonicContact NZ-OE2 3.76Å; K104-E107 PolarHBondContact NZ-OE2 2.81Å; K104-E107 WeakPolarHBondContact O-CB 3.49Å; K104-N108 PolarHBondContact O-N 2.8Å; K104-N108 VanDerWaalsContact O-N 3.1Å; K104-F132 VanDerWaalsContact CG-O 3.24Å; K104-F132 WeakPolarHBondContact CG-O 3.46Å; K104-E133 WeakPolarHBondContact CE-O 3.43Å; K104-Y144 PolarHBondContact NZ-OH 2.6Å
105	I	89.8	Confident	89.9	Confident	7 Å²	7	28.1 Å²	28.1	4%	0.036	15%	0.151	C	C	.	.	H	α-helix	trans	-71.1	-45.4	176.3	-70.4	171.4	0	0	0	109.6	I60 W62 M98 A101 E102 W103 E107 N108 L109	I60-I105 HydrophobicContact CG2-CD1 4.15Å; W62-I105 HydrophobicContact CB-CG1 3.97Å; W62-I105 HydrophobicContact CE3-CD1 4.45Å; W62-I105 HydrophobicContact CE3-CG1 4.31Å; M98-I105 HydrophobicContact CE-CD1 3.03Å; M98-I105 HydrophobicContact CG-CD1 4.41Å; M98-I105 HydrophobicContact SD-CD1 3.06Å; M98-I105 WeakPolarHBondContact SD-CD1 3.33Å; M98-I105 HydrophobicContact SD-CG1 4.35Å; M98-I105 HydrophobicContact SD-CG2 4.41Å; A101-I105 HydrophobicContact CB-CD1 4.32Å; A101-I105 PolarHBondContact O-N 3.14Å; E102-I105 PolarHBondContact O-N 3.31Å; W103-I105 VanDerWaalsContact C-N 3.33Å; I105-E107 VanDerWaalsContact C-N 3.31Å; I105-E107 PolarHBondContact O-N 2.91Å; I105-N108 WeakPolarHBondContact O-CB 3.39Å; I105-N108 PolarHBondContact O-N 2.79Å; I105-N108 VanDerWaalsContact O-N 3.08Å; I105-L109 HydrophobicContact CG2-CD1 4.5Å; I105-L109 HydrophobicContact CG2-CG 4.38Å; I105-L109 WeakPolarHBondContact O-CG 3.42Å; I105-L109 PolarHBondContact O-N 3.29Å
106	L	92.7	Very high	89.9	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-58.3	-42.5	173.7	-178.9	60.2	0	0	0	112.2	E102 N108 L109 V110 L123 L148 L149 L152	E102-L106 WeakPolarHBondContact O-CB 3.23Å; E102-L106 PolarHBondContact O-N 2.79Å; L106-N108 VanDerWaalsContact C-N 3.33Å; L106-N108 PolarHBondContact O-N 3.04Å; L106-L109 PolarHBondContact O-N 3.09Å; L106-V110 WeakPolarHBondContact O-CG2 3.32Å; L106-V110 PolarHBondContact O-N 2.63Å; L106-L123 HydrophobicContact CD2-CD2 3.88Å; L106-L148 HydrophobicContact CD2-CB 3.7Å; L106-L148 HydrophobicContact CD2-CD1 4.47Å; L106-L148 HydrophobicContact CG-CB 4.14Å; L106-L149 HydrophobicContact CD2-CD2 4.34Å; L106-L152 HydrophobicContact CD1-CD1 4.01Å; L106-L152 HydrophobicContact CD1-CD2 3.63Å; L106-L152 HydrophobicContact CD1-CG 3.88Å; L106-L152 HydrophobicContact CD2-CD1 4.18Å
107	E	93.6	Very high	90	Very high	48 Å²	48	33.4 Å²	33.4	22%	0.224	18%	0.183	C	C	.	.	H	α-helix	trans	-53.4	-48.8	171.8	174.3	173.2	-96.6	0	0	111.7	W103 K104 I105 V110 L111 Y144 L148	W103-E107 PolarHBondContact O-N 3.04Å; K104-E107 VanDerWaalsContact CD-OE2 3.25Å; K104-E107 WeakPolarHBondContact CD-OE2 3.45Å; K104-E107 IonicContact NZ-OE1 3.97Å; K104-E107 IonicContact NZ-OE2 3.76Å; K104-E107 PolarHBondContact NZ-OE2 2.81Å; K104-E107 WeakPolarHBondContact O-CB 3.49Å; I105-E107 VanDerWaalsContact C-N 3.31Å; I105-E107 PolarHBondContact O-N 2.91Å; E107-V110 PolarHBondContact O-N 2.85Å; E107-L111 HydrophobicContact CG-CD1 3.89Å; E107-L111 VanDerWaalsContact O-CG 3.29Å; E107-L111 WeakPolarHBondContact O-CG 3.35Å; E107-L111 PolarHBondContact O-N 3.31Å; E107-Y144 WeakPolarHBondContact OE1-CE2 3.32Å; E107-Y144 PolarHBondContact OE1-OH 2.89Å; E107-Y144 PolarHBondContact OE2-OH 2.64Å; E107-L148 HydrophobicContact CB-CD1 4.39Å; E107-L148 HydrophobicContact CB-CD2 3.88Å
108	N	91.8	Very high	90.3	Very high	26 Å²	26	32.6 Å²	32.6	14%	0.139	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-39.3	176.4	-82.8	-17.7	0	0	0	114	W62 K104 I105 L106 V110 L111 E112	W62-N108 WeakPolarHBondContact CA-ND2 3.36Å; W62-N108 VanDerWaalsContact CB-ND2 3.26Å; W62-N108 WeakPolarHBondContact CB-ND2 3.5Å; W62-N108 PolarHBondContact O-ND2 3Å; K104-N108 PolarHBondContact O-N 2.8Å; K104-N108 VanDerWaalsContact O-N 3.1Å; I105-N108 WeakPolarHBondContact O-CB 3.39Å; I105-N108 PolarHBondContact O-N 2.79Å; I105-N108 VanDerWaalsContact O-N 3.08Å; L106-N108 VanDerWaalsContact C-N 3.33Å; L106-N108 PolarHBondContact O-N 3.04Å; N108-V110 PolarHBondContact O-N 3.07Å; N108-L111 PolarHBondContact O-N 3.38Å; N108-L111 VanDerWaalsContact O-N 3.14Å; N108-E112 WeakPolarHBondContact O-CB 3.46Å; N108-E112 WeakPolarHBondContact O-CG 3.46Å; N108-E112 PolarHBondContact O-N 3.14Å
109	L	91.1	Very high	90.8	Very high	7 Å²	7	32.6 Å²	32.6	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-37.7	177.6	-63.8	-174.5	0	0	0	111.1	L79 L94 I105 L106 G113 V114 L115	L79-L109 HydrophobicContact CB-CD2 3.97Å; L79-L109 HydrophobicContact CD2-CD1 4.4Å; L79-L109 HydrophobicContact CD2-CD2 3.64Å; L79-L109 HydrophobicContact CG-CD2 4.26Å; L94-L109 HydrophobicContact CD2-CD1 3.99Å; I105-L109 HydrophobicContact CG2-CD1 4.5Å; I105-L109 HydrophobicContact CG2-CG 4.38Å; I105-L109 WeakPolarHBondContact O-CG 3.42Å; I105-L109 PolarHBondContact O-N 3.29Å; L106-L109 PolarHBondContact O-N 3.09Å; L109-G113 PolarHBondContact O-N 2.9Å; L109-V114 HydrophobicContact CB-CB 4.45Å; L109-V114 HydrophobicContact CD2-CB 3.84Å; L109-V114 HydrophobicContact CD2-CG1 3.82Å; L109-V114 HydrophobicContact CD2-CG2 4.14Å; L109-V114 PolarHBondContact O-N 2.99Å; L109-V114 VanDerWaalsContact O-N 3.1Å; L109-L115 HydrophobicContact CB-CD2 3.97Å; L109-L115 HydrophobicContact CB-CG 4.15Å; L109-L115 HydrophobicContact CD1-CD2 4.39Å
110	V	92.6	Very high	91.3	Very high	39 Å²	39	31.9 Å²	31.9	24%	0.236	18%	0.176	C	C	.	.	H	α-helix	trans	-66.9	-51.7	173.3	172.5	0	0	0	0	110.7	L106 E107 N108 E112 G113 L115 E151	L106-V110 WeakPolarHBondContact O-CG2 3.32Å; L106-V110 PolarHBondContact O-N 2.63Å; E107-V110 PolarHBondContact O-N 2.85Å; N108-V110 PolarHBondContact O-N 3.07Å; V110-E112 PolarHBondContact O-N 2.94Å; V110-G113 PolarHBondContact O-N 2.8Å; V110-L115 HydrophobicContact CB-CD1 4.43Å; V110-L115 HydrophobicContact CG2-CD1 3.66Å; V110-E151 HydrophobicContact CB-CB 4.46Å; V110-E151 HydrophobicContact CG1-CB 3.81Å; V110-E151 HydrophobicContact CG1-CG 3.98Å; V110-E151 HydrophobicContact CG2-CB 3.73Å
111	L	92	Very high	91.7	Very high	133 Å²	133	31.9 Å²	31.9	70%	0.696	18%	0.176	S	C	*	.	H	α-helix	trans	-67.7	-35.1	-174.3	-70.1	173.6	0	0	0	113.7	E107 N108	E107-L111 HydrophobicContact CG-CD1 3.89Å; E107-L111 VanDerWaalsContact O-CG 3.29Å; E107-L111 WeakPolarHBondContact O-CG 3.35Å; E107-L111 PolarHBondContact O-N 3.31Å; N108-L111 PolarHBondContact O-N 3.38Å; N108-L111 VanDerWaalsContact O-N 3.14Å
112	E	89.6	Confident	92.1	Very high	78 Å²	78	33 Å²	33	36%	0.364	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-1.1	-178.6	-63	-174.5	170.6	0	0	112.6	K78 A80 N108 V110 V114	K78-E112 WeakPolarHBondContact CD-OE1 3.31Å; K78-E112 WeakPolarHBondContact CE-OE1 3.44Å; K78-E112 IonicContact NZ-OE1 2.59Å; K78-E112 PolarHBondContact NZ-OE1 2.76Å; A80-E112 WeakPolarHBondContact CB-OE2 3.25Å; N108-E112 WeakPolarHBondContact O-CB 3.46Å; N108-E112 WeakPolarHBondContact O-CG 3.46Å; N108-E112 PolarHBondContact O-N 3.14Å; V110-E112 PolarHBondContact O-N 2.94Å; E112-V114 HydrophobicContact CB-CG2 4.09Å; E112-V114 PolarHBondContact O-N 2.72Å
113	G	89.8	Confident	92.3	Very high	36 Å²	36	33.1 Å²	33.1	37%	0.371	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	15.8	177.1	0	0	0	0	0	114.6	L109 V110 L115 D116	L109-G113 PolarHBondContact O-N 2.9Å; V110-G113 PolarHBondContact O-N 2.8Å; G113-L115 PolarHBondContact O-N 3.23Å; G113-D116 PolarHBondContact O-N 2.95Å
114	V	90.2	Very high	92.3	Very high	10 Å²	10	35 Å²	35	6%	0.061	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-61.7	-29.1	-178.6	178.8	0	0	0	0	111.9	A80 L83 L109 E112 D116 S117	A80-V114 HydrophobicContact CB-CG2 3.58Å; L83-V114 HydrophobicContact CD1-CG1 3.62Å; L109-V114 HydrophobicContact CB-CB 4.45Å; L109-V114 HydrophobicContact CD2-CB 3.84Å; L109-V114 HydrophobicContact CD2-CG1 3.82Å; L109-V114 HydrophobicContact CD2-CG2 4.14Å; L109-V114 PolarHBondContact O-N 2.99Å; L109-V114 VanDerWaalsContact O-N 3.1Å; E112-V114 HydrophobicContact CB-CG2 4.09Å; E112-V114 PolarHBondContact O-N 2.72Å; V114-D116 PolarHBondContact O-N 2.84Å; V114-D116 VanDerWaalsContact O-N 3.14Å; V114-S117 WeakPolarHBondContact O-CB 3.46Å; V114-S117 PolarHBondContact O-N 3.2Å
115	L	92.4	Very high	92.4	Very high	7 Å²	7	34.1 Å²	34.1	4%	0.037	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-57.9	-26.8	-179	-66.7	-179.4	0	0	0	114	L109 V110 G113 S117 V118 L152 A155 F157 N190	L109-L115 HydrophobicContact CB-CD2 3.97Å; L109-L115 HydrophobicContact CB-CG 4.15Å; L109-L115 HydrophobicContact CD1-CD2 4.39Å; V110-L115 HydrophobicContact CB-CD1 4.43Å; V110-L115 HydrophobicContact CG2-CD1 3.66Å; G113-L115 PolarHBondContact O-N 3.23Å; L115-S117 PolarHBondContact O-N 2.86Å; L115-V118 PolarHBondContact O-N 3.07Å; L115-L152 HydrophobicContact CD1-CD2 3.78Å; L115-L152 HydrophobicContact CD2-CD2 3.75Å; L115-L152 HydrophobicContact CG-CD2 4.44Å; L115-A155 HydrophobicContact CB-CB 4.31Å; L115-A155 HydrophobicContact CD1-CB 3.98Å; L115-F157 HydrophobicContact CB-CE2 3.98Å; L115-F157 HydrophobicContact CD2-CE2 4.18Å; L115-F157 HydrophobicContact CD2-CZ 4.37Å; L115-N190 PolarHBondContact O-ND2 2.84Å
116	D	91.4	Very high	92.5	Very high	118 Å²	118	34.4 Å²	34.4	63%	0.631	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-68.3	-21.4	177.9	-74.5	-17.2	0	0	0	112.7	G113 V114 W193	G113-D116 PolarHBondContact O-N 2.95Å; V114-D116 PolarHBondContact O-N 2.84Å; V114-D116 VanDerWaalsContact O-N 3.14Å; D116-W193 VanDerWaalsContact O-CD1 3.3Å
117	S	90.6	Very high	92.6	Very high	38 Å²	38	35.2 Å²	35.2	27%	0.266	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-91.6	-3.9	178.8	-58.1	0	0	0	0	113	R89 V91 V114 L115 W193	R89-S117 VanDerWaalsContact O-CB 3.27Å; R89-S117 WeakPolarHBondContact O-CB 3.28Å; R89-S117 PolarHBondContact O-OG 3.22Å; V91-S117 PolarHBondContact N-O 2.95Å; V114-S117 WeakPolarHBondContact O-CB 3.46Å; V114-S117 PolarHBondContact O-N 3.2Å; L115-S117 PolarHBondContact O-N 2.86Å; S117-W193 PolarHBondContact O-NE1 3.12Å
118	V	93.4	Very high	92.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.9	-171.4	178.3	0	0	0	0	111.6	V91 L94 L115 Q120 L121 F157 N190	V91-V118 HydrophobicContact CB-CG2 4.28Å; V91-V118 CarbonylContact O-C 3.59Å; V91-V118 WeakPolarHBondContact O-CA 3.47Å; L94-V118 HydrophobicContact CB-CG1 3.79Å; L94-V118 HydrophobicContact CB-CG2 4.42Å; L94-V118 HydrophobicContact CD2-CG1 4.43Å; L94-V118 HydrophobicContact CD2-CG2 3.99Å; L115-V118 PolarHBondContact O-N 3.07Å; V118-Q120 VanDerWaalsContact CG1-O 3.29Å; V118-Q120 WeakPolarHBondContact CG1-O 3.19Å; V118-L121 HydrophobicContact CG1-CB 4.49Å; V118-F157 HydrophobicContact CB-CZ 4.08Å; V118-F157 HydrophobicContact CG1-CE1 4.25Å; V118-F157 HydrophobicContact CG1-CZ 4.1Å; V118-F157 WeakPolarHBondContact O-CZ 3.34Å; V118-N190 VanDerWaalsContact O-CB 3.27Å; V118-N190 WeakPolarHBondContact O-CB 3.06Å; V118-N190 PolarHBondContact O-ND2 2.59Å; V118-N190 VanDerWaalsContact O-ND2 3.17Å
119	G	94.4	Very high	92.6	Very high	2 Å²	2	37.4 Å²	37.4	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-45.7	178.4	0	0	0	0	0	114.4	V91 N190	V91-G119 PolarHBondContact O-N 3.38Å; G119-N190 WeakPolarHBondContact O-CB 3.33Å; G119-N190 PolarHBondContact O-N 2.77Å
120	Q	95.3	Very high	92.7	Very high	79 Å²	79	38 Å²	38	37%	0.369	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140.2	175.3	-66	-177.1	61.3	0	0	110.5	D92 V93 L94 V118 W188 V189	D92-Q120 WeakPolarHBondContact O-CB 3.24Å; D92-Q120 PolarHBondContact O-N 2.99Å; V93-Q120 HydrophobicContact CG2-CB 4.48Å; L94-Q120 PolarHBondContact N-O 3.11Å; V118-Q120 VanDerWaalsContact CG1-O 3.29Å; V118-Q120 WeakPolarHBondContact CG1-O 3.19Å; Q120-W188 WeakPolarHBondContact CA-O 3.43Å; Q120-V189 HydrophobicContact CG-CB 4.49Å; Q120-V189 HydrophobicContact CG-CG2 4.27Å
121	L	95.1	Very high	92.6	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.9	178.1	175.1	65.8	0	0	0	109.4	L94 V118 L123 L152 F157 W188	L94-L121 HydrophobicContact CB-CD1 4.19Å; L94-L121 HydrophobicContact CD2-CD1 3.94Å; L94-L121 HydrophobicContact CG-CD1 3.93Å; L94-L121 CarbonylContact O-C 3.5Å; L94-L121 WeakPolarHBondContact O-CA 3.32Å; V118-L121 HydrophobicContact CG1-CB 4.49Å; L121-L123 HydrophobicContact CG-CB 4.36Å; L121-L152 HydrophobicContact CD2-CD1 3.93Å; L121-L152 HydrophobicContact CD2-CD2 3.66Å; L121-L152 HydrophobicContact CD2-CG 4.47Å; L121-F157 HydrophobicContact CB-CD1 4.1Å; L121-F157 HydrophobicContact CB-CE1 3.69Å; L121-W188 HydrophobicContact CB-CB 4.33Å; L121-W188 PolarHBondContact N-O 3.3Å; L121-W188 PolarHBondContact O-N 3.36Å
122	L	94.6	Very high	92.4	Very high	29 Å²	29	34.4 Å²	34.4	15%	0.152	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.9	167.6	-74.7	73.8	0	0	0	107.2	L25 V93 L94 K95 A96 L186	L25-L122 HydrophobicContact CD2-CD2 3.62Å; V93-L122 HydrophobicContact CG1-CD1 3.94Å; L94-L122 PolarHBondContact O-N 2.93Å; K95-L122 CarbonylContact C-O 3.55Å; K95-L122 VanDerWaalsContact CA-O 3.29Å; K95-L122 WeakPolarHBondContact CA-O 3.07Å; K95-L122 HydrophobicContact CB-CB 4.16Å; K95-L122 HydrophobicContact CG-CB 4.29Å; A96-L122 PolarHBondContact N-O 2.96Å; L122-L186 WeakPolarHBondContact CA-O 3.41Å
123	L	93.1	Very high	92.4	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	117.9	-175.8	-176.7	67.6	0	0	0	109.2	A96 E102 L106 L121 L125 L149 T185 L186	A96-L123 HydrophobicContact CB-CD1 3.87Å; E102-L123 HydrophobicContact CB-CD1 3.93Å; E102-L123 HydrophobicContact CG-CD1 4.41Å; L106-L123 HydrophobicContact CD2-CD2 3.88Å; L121-L123 HydrophobicContact CG-CB 4.36Å; L123-L125 HydrophobicContact CD2-CD2 3.57Å; L123-L125 HydrophobicContact CD2-CG 4.48Å; L123-L125 HydrophobicContact CG-CD2 3.77Å; L123-L125 HydrophobicContact CG-CG 4.49Å; L123-L149 HydrophobicContact CD2-CD2 4.43Å; L123-T185 CarbonylContact O-C 3.59Å; L123-T185 WeakPolarHBondContact O-CA 3.18Å; L123-L186 PolarHBondContact N-O 3.25Å; L123-L186 PolarHBondContact O-N 2.95Å
124	E	93	Very high	92.4	Very high	42 Å²	42	34.8 Å²	34.8	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.3	169.9	-172.7	155.6	106.8	0	0	110.3	A96 D97 E102 H126 Y184 T185	A96-E124 PolarHBondContact O-N 3.36Å; D97-E124 HydrophobicContact CB-CB 3.97Å; E102-E124 WeakPolarHBondContact CG-O 3.13Å; E124-H126 IonicContact OE1-CE1 2.75Å; E124-H126 IonicContact OE1-NE2 2.61Å; E124-Y184 CarbonylContact C-O 3.58Å; E124-Y184 WeakPolarHBondContact CA-O 3.25Å; E124-T185 PolarHBondContact OE2-OG1 3.14Å; E124-T185 VanDerWaalsContact OE2-OG1 3.11Å
125	L	93.3	Very high	92.3	Very high	9 Å²	9	38.7 Å²	38.7	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.7	-179.9	-62.6	-175.6	0	0	0	110.6	E102 W103 L123 L127 L149 A183 Y184 L186	E102-L125 HydrophobicContact CG-CD2 4.13Å; W103-L125 HydrophobicContact CE3-CD2 4.44Å; W103-L125 HydrophobicContact CH2-CD1 3.7Å; W103-L125 HydrophobicContact CH2-CD2 3.53Å; W103-L125 HydrophobicContact CH2-CG 4.14Å; W103-L125 HydrophobicContact CZ2-CB 4.23Å; W103-L125 HydrophobicContact CZ2-CD1 4.13Å; W103-L125 HydrophobicContact CZ2-CD2 3.69Å; W103-L125 HydrophobicContact CZ2-CG 4.24Å; W103-L125 HydrophobicContact CZ3-CD2 3.92Å; L123-L125 HydrophobicContact CD2-CD2 3.57Å; L123-L125 HydrophobicContact CD2-CG 4.48Å; L123-L125 HydrophobicContact CG-CD2 3.77Å; L123-L125 HydrophobicContact CG-CG 4.49Å; L125-L127 HydrophobicContact CB-CD2 4.22Å; L125-L149 HydrophobicContact CD1-CD1 4.36Å; L125-A183 VanDerWaalsContact O-CA 3.23Å; L125-A183 WeakPolarHBondContact O-CA 3.23Å; L125-Y184 PolarHBondContact N-O 3.41Å; L125-Y184 PolarHBondContact O-N 2.99Å; L125-L186 HydrophobicContact CB-CD1 4.29Å; L125-L186 HydrophobicContact CD1-CD1 3.28Å; L125-L186 HydrophobicContact CD1-CD2 4.47Å; L125-L186 HydrophobicContact CG-CD1 3.49Å; L125-L186 VanDerWaalsContact CG-CD1 3.49Å
126	H	93.5	Very high	92.3	Very high	14 Å²	14	41.2 Å²	41.2	7%	0.065	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.6	168.7	-65.1	85.9	0	0	0	109.6	D97 E99 S100 E102 W103 E124 S182	D97-H126 IonicContact OD1-CE1 2.79Å; D97-H126 PolarHBondContact OD1-CE1 3.17Å; E99-H126 IonicContact OE2-NE2 3.67Å; S100-H126 WeakPolarHBondContact OG-CB 3.37Å; E102-H126 WeakPolarHBondContact OE1-CB 3.34Å; E102-H126 IonicContact OE1-CG 2.77Å; E102-H126 PolarHBondContact OE1-N 3.43Å; E102-H126 IonicContact OE1-ND1 3.63Å; E102-H126 IonicContact OE2-ND1 2.67Å; W103-H126 PolarHBondContact NE1-O 3.36Å; E124-H126 IonicContact OE1-CE1 2.75Å; E124-H126 IonicContact OE1-NE2 2.61Å; H126-S182 WeakPolarHBondContact CA-O 3.34Å
127	L	93.8	Very high	92.6	Very high	20 Å²	20	39.9 Å²	39.9	11%	0.105	23%	0.228	C	C	.	.			trans	-110.3	-1.7	-174.3	-55.3	-176.2	0	0	0	113.5	W103 L125 W129 W145 F172 L173 S182 Y184	W103-L127 HydrophobicContact CH2-CD2 4.42Å; W103-L127 HydrophobicContact CZ2-CD2 3.64Å; L125-L127 HydrophobicContact CB-CD2 4.22Å; L127-W129 PolarHBondContact O-N 3.21Å; L127-W145 HydrophobicContact CD2-CE3 4.12Å; L127-W145 HydrophobicContact CD2-CH2 4.12Å; L127-W145 HydrophobicContact CD2-CZ3 3.85Å; L127-F172 HydrophobicContact CB-CD2 3.98Å; L127-F172 HydrophobicContact CB-CE2 4.41Å; L127-F172 HydrophobicContact CD1-CD2 4.13Å; L127-F172 HydrophobicContact CD1-CE2 4.15Å; L127-F172 CarbonylContact O-C 3.58Å; L127-F172 VanDerWaalsContact O-CA 3.31Å; L127-F172 WeakPolarHBondContact O-CA 3.44Å; L127-L173 PolarHBondContact O-N 3.42Å; L127-S182 PolarHBondContact N-O 3.14Å; L127-Y184 HydrophobicContact CD1-CD2 3.66Å; L127-Y184 HydrophobicContact CD1-CE2 3.7Å; L127-Y184 HydrophobicContact CG-CD2 4.43Å
128	H	91.7	Very high	92.8	Very high	56 Å²	56	40.8 Å²	40.8	26%	0.259	23%	0.23	S	C	.	.	S	Bend	trans	-65.6	-20.1	-176.6	61.5	-84	0	0	0	113.7	S100 L171 H174	S100-H128 PolarHBondContact OG-CE1 3.34Å; H128-L171 HydrophobicContact CB-CB 3.8Å; H128-L171 HydrophobicContact CB-CD1 4.36Å; H128-H174 PolarHBondContact O-N 3.31Å; H128-H174 PolarHBondContact O-ND1 3.1Å
129	W	93.4	Very high	92.9	Very high	64 Å²	64	43.9 Å²	43.9	24%	0.242	25%	0.25	C	S	.	.	S	Bend	trans	-153.1	-179.6	172.9	74.9	-62.8	0	0	0	110.2	S100 L127 G131 F132 W145 H174	S100-W129 PolarHBondContact OG-NE1 3.33Å; L127-W129 PolarHBondContact O-N 3.21Å; W129-G131 VanDerWaalsContact C-N 3.29Å; W129-G131 VanDerWaalsContact CD2-N 3.31Å; W129-G131 VanDerWaalsContact CE3-N 3.32Å; W129-G131 WeakPolarHBondContact CH2-O 3.39Å; W129-G131 WeakPolarHBondContact CZ3-O 3.14Å; W129-G131 PolarHBondContact O-N 3.37Å; W129-F132 HydrophobicContact CH2-CB 4.34Å; W129-F132 AromaticContact CH2-CD1 3.84Å; W129-F132 HydrophobicContact CH2-CD1 3.84Å; W129-F132 HydrophobicContact CH2-CD2 4.12Å; W129-F132 HydrophobicContact CH2-CE1 4.12Å; W129-F132 HydrophobicContact CH2-CE2 4.39Å; W129-F132 AromaticContact CH2-CG 3.84Å; W129-F132 HydrophobicContact CH2-CG 3.84Å; W129-F132 HydrophobicContact CH2-CZ 4.38Å; W129-F132 VanDerWaalsContact CH2-N 3.28Å; W129-F132 HydrophobicContact CZ2-CD1 4.25Å; W129-F132 AromaticContact CZ2-CD2 3.85Å; W129-F132 HydrophobicContact CZ2-CD2 3.85Å; W129-F132 HydrophobicContact CZ2-CE1 4.24Å; W129-F132 AromaticContact CZ2-CE2 3.84Å; W129-F132 HydrophobicContact CZ2-CE2 3.84Å; W129-F132 HydrophobicContact CZ2-CG 4.06Å; W129-F132 HydrophobicContact CZ2-CZ 4.03Å; W129-W145 WeakPolarHBondContact O-CH2 2.98Å; W129-W145 WeakPolarHBondContact O-CZ2 3.21Å; W129-H174 WeakPolarHBondContact CB-CE1 3.43Å; W129-H174 WeakPolarHBondContact CB-NE2 3.36Å
130	A	92.9	Very high	93.1	Very high	18 Å²	18	45.7 Å²	45.7	15%	0.149	26%	0.263	C	S	.	.			trans	-66.9	-24.1	-171.9	0	0	0	0	0	115.2	V134 V141 W145 L173	A130-V134 HydrophobicContact CB-CB 4.23Å; A130-V134 HydrophobicContact CB-CG1 4.42Å; A130-V134 WeakPolarHBondContact O-CB 3.32Å; A130-V134 WeakPolarHBondContact O-CG2 3.21Å; A130-V141 HydrophobicContact CB-CG1 3.81Å; A130-V141 HydrophobicContact CB-CG2 3.93Å; A130-W145 WeakPolarHBondContact O-CZ2 3.38Å; A130-W145 PolarHBondContact O-NE1 3.45Å; A130-L173 HydrophobicContact CB-CD2 4.25Å
131	G	91.2	Very high	93.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.01	25%	0.246	C	C	.	.			trans	89.6	166.6	-169.2	0	0	0	0	0	113	S100 W129 E133 V134	S100-G131 WeakPolarHBondContact O-CA 3.44Å; W129-G131 VanDerWaalsContact C-N 3.29Å; W129-G131 VanDerWaalsContact CD2-N 3.31Å; W129-G131 VanDerWaalsContact CE3-N 3.32Å; W129-G131 WeakPolarHBondContact CH2-O 3.39Å; W129-G131 WeakPolarHBondContact CZ3-O 3.14Å; W129-G131 PolarHBondContact O-N 3.37Å; G131-E133 PolarHBondContact O-N 3.15Å; G131-V134 PolarHBondContact O-N 3.3Å
132	F	88.3	Confident	93.2	Very high	96 Å²	96	44.8 Å²	44.8	42%	0.421	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	132.3	-173.6	-68.2	-84.1	0	0	0	111.9	W62 A101 K104 W129 V134	W62-F132 HydrophobicContact CH2-CB 3.6Å; W62-F132 HydrophobicContact CH2-CD2 4.42Å; W62-F132 AromaticContact CH2-CG 4Å; W62-F132 HydrophobicContact CH2-CG 4Å; W62-F132 HydrophobicContact CZ2-CB 3.82Å; A101-F132 HydrophobicContact CB-CD2 4.13Å; K104-F132 VanDerWaalsContact CG-O 3.24Å; K104-F132 WeakPolarHBondContact CG-O 3.46Å; W129-F132 HydrophobicContact CH2-CB 4.34Å; W129-F132 AromaticContact CH2-CD1 3.84Å; W129-F132 HydrophobicContact CH2-CD1 3.84Å; W129-F132 HydrophobicContact CH2-CD2 4.12Å; W129-F132 HydrophobicContact CH2-CE1 4.12Å; W129-F132 HydrophobicContact CH2-CE2 4.39Å; W129-F132 AromaticContact CH2-CG 3.84Å; W129-F132 HydrophobicContact CH2-CG 3.84Å; W129-F132 HydrophobicContact CH2-CZ 4.38Å; W129-F132 VanDerWaalsContact CH2-N 3.28Å; W129-F132 HydrophobicContact CZ2-CD1 4.25Å; W129-F132 AromaticContact CZ2-CD2 3.85Å; W129-F132 HydrophobicContact CZ2-CD2 3.85Å; W129-F132 HydrophobicContact CZ2-CE1 4.24Å; W129-F132 AromaticContact CZ2-CE2 3.84Å; W129-F132 HydrophobicContact CZ2-CE2 3.84Å; W129-F132 HydrophobicContact CZ2-CG 4.06Å; W129-F132 HydrophobicContact CZ2-CZ 4.03Å; F132-V134 PolarHBondContact O-N 2.93Å
133	E	88.4	Confident	93.3	Very high	102 Å²	102	50 Å²	50	48%	0.477	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	24.4	176.3	-53.5	-178.3	154.9	0	0	114.3	W62 R63 K104 G131	W62-E133 HydrophobicContact CZ2-CG 4.27Å; W62-E133 PolarHBondContact NE1-OE2 3.17Å; R63-E133 IonicContact CZ-OE1 3.43Å; R63-E133 IonicContact CZ-OE2 3.29Å; R63-E133 VanDerWaalsContact CZ-OE2 3.29Å; R63-E133 IonicContact NE-OE1 3.47Å; R63-E133 PolarHBondContact NE-OE1 3.42Å; R63-E133 IonicContact NE-OE2 3.14Å; R63-E133 PolarHBondContact NE-OE2 3.25Å; R63-E133 VanDerWaalsContact NE-OE2 3.14Å; R63-E133 IonicContact NH2-OE1 3.08Å; R63-E133 PolarHBondContact NH2-OE1 3.35Å; R63-E133 VanDerWaalsContact NH2-OE1 3.08Å; R63-E133 IonicContact NH2-OE2 2.66Å; R63-E133 PolarHBondContact NH2-OE2 2.76Å; K104-E133 WeakPolarHBondContact CE-O 3.43Å; G131-E133 PolarHBondContact O-N 3.15Å
134	V	90.4	Very high	93.5	Very high	21 Å²	21	52.2 Å²	52.2	13%	0.127	29%	0.288	C	S	.	.			trans	-95.4	111.3	169.8	-174.6	0	0	0	0	107.9	W103 A130 G131 F132 V141 Y144	W103-V134 HydrophobicContact CB-CG2 4.48Å; A130-V134 HydrophobicContact CB-CB 4.23Å; A130-V134 HydrophobicContact CB-CG1 4.42Å; A130-V134 WeakPolarHBondContact O-CB 3.32Å; A130-V134 WeakPolarHBondContact O-CG2 3.21Å; G131-V134 PolarHBondContact O-N 3.3Å; F132-V134 PolarHBondContact O-N 2.93Å; V134-V141 HydrophobicContact CG1-CB 4.49Å; V134-V141 HydrophobicContact CG1-CG1 4.07Å; V134-V141 HydrophobicContact CG1-CG2 4.15Å; V134-Y144 HydrophobicContact CG1-CD1 3.68Å; V134-Y144 HydrophobicContact CG1-CE1 4.07Å; V134-Y144 HydrophobicContact CG1-CG 4.4Å; V134-Y144 HydrophobicContact CG2-CD1 4.2Å; V134-Y144 HydrophobicContact CG2-CE1 3.76Å
135	A	88.3	Confident	93.6	Very high	91 Å²	91	50.7 Å²	50.7	75%	0.752	28%	0.281	S	S	*	.			trans	-105	156.8	-176.9	0	0	0	0	0	112
136	G	93.4	Very high	93.8	Very high	61 Å²	61	56 Å²	56	63%	0.629	30%	0.304	S	S	*	.	S	Bend	trans	124.1	-179.9	176.7	0	0	0	0	0	112.8
137	D	95.8	Very high	94	Very high	90 Å²	90	58.3 Å²	58.3	48%	0.481	32%	0.321	S	S	.	.			trans	-77.5	164.3	169.2	64.5	-7.9	0	0	0	111.2	P139 S140 V141 R143	D137-P139 VanDerWaalsContact C-CD 3.48Å; D137-P139 VanDerWaalsContact C-N 3.32Å; D137-S140 WeakPolarHBondContact O-CA 3.32Å; D137-S140 WeakPolarHBondContact O-CB 3.42Å; D137-S140 PolarHBondContact O-N 3.13Å; D137-S140 WeakPolarHBondContact OD1-CB 3.49Å; D137-S140 PolarHBondContact OD1-N 3.1Å; D137-S140 VanDerWaalsContact OD1-N 3.07Å; D137-S140 PolarHBondContact OD1-OG 2.89Å; D137-V141 PolarHBondContact O-N 2.96Å; D137-R143 IonicContact OD1-NH2 3.85Å
138	D	95.3	Very high	94.1	Very high	56 Å²	56	57.9 Å²	57.9	30%	0.299	32%	0.319	S	S	.	.	H	α-helix	trans	-50.2	-44.8	-177.8	-61.8	-6.1	0	0	0	113.4	S140 V141 V142 L173 K175	D138-S140 VanDerWaalsContact C-N 3.3Å; D138-S140 PolarHBondContact O-N 3.41Å; D138-V141 PolarHBondContact O-N 2.9Å; D138-V142 WeakPolarHBondContact O-CG2 3.07Å; D138-V142 PolarHBondContact O-N 3.3Å; D138-L173 HydrophobicContact CB-CD1 3.64Å; D138-K175 WeakPolarHBondContact OD2-CE 3.45Å; D138-K175 IonicContact OD2-NZ 3.52Å; D138-K175 PolarHBondContact OD2-NZ 3.48Å
139	P	96.6	Very high	94.4	Very high	66 Å²	66	56.9 Å²	56.9	43%	0.429	32%	0.315	S	S	.	.	H	α-helix	trans	-59.9	-36.7	175	-24.8	35.9	0	0	0	113.9	D137 R143	D137-P139 VanDerWaalsContact C-CD 3.48Å; D137-P139 VanDerWaalsContact C-N 3.32Å; P139-R143 WeakPolarHBondContact O-CB 3.36Å; P139-R143 VanDerWaalsContact O-CG 3.31Å; P139-R143 WeakPolarHBondContact O-CG 3.47Å; P139-R143 PolarHBondContact O-N 3.11Å
140	S	97.3	Very high	94.6	Very high	40 Å²	40	56.9 Å²	56.9	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-68.3	-40.7	176.5	-61.5	0	0	0	0	111.9	D137 D138 R143 Y144	D137-S140 WeakPolarHBondContact O-CA 3.32Å; D137-S140 WeakPolarHBondContact O-CB 3.42Å; D137-S140 PolarHBondContact O-N 3.13Å; D137-S140 WeakPolarHBondContact OD1-CB 3.49Å; D137-S140 PolarHBondContact OD1-N 3.1Å; D137-S140 VanDerWaalsContact OD1-N 3.07Å; D137-S140 PolarHBondContact OD1-OG 2.89Å; D138-S140 VanDerWaalsContact C-N 3.3Å; D138-S140 PolarHBondContact O-N 3.41Å; S140-R143 PolarHBondContact O-N 3.34Å; S140-R143 PolarHBondContact OG-NH2 2.77Å; S140-Y144 WeakPolarHBondContact O-CB 3.2Å; S140-Y144 PolarHBondContact O-N 3.29Å
141	V	96.4	Very high	94.8	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.024	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-47.2	174.7	177.1	0	0	0	0	110.9	A130 V134 D137 D138 R143 Y144 W145 L173	A130-V141 HydrophobicContact CB-CG1 3.81Å; A130-V141 HydrophobicContact CB-CG2 3.93Å; V134-V141 HydrophobicContact CG1-CB 4.49Å; V134-V141 HydrophobicContact CG1-CG1 4.07Å; V134-V141 HydrophobicContact CG1-CG2 4.15Å; D137-V141 PolarHBondContact O-N 2.96Å; D138-V141 PolarHBondContact O-N 2.9Å; V141-R143 VanDerWaalsContact C-N 3.35Å; V141-R143 PolarHBondContact O-N 3.46Å; V141-Y144 WeakPolarHBondContact O-CB 3.49Å; V141-Y144 PolarHBondContact O-N 3.33Å; V141-Y144 VanDerWaalsContact O-N 3.14Å; V141-W145 HydrophobicContact CG1-CD2 3.91Å; V141-W145 VanDerWaalsContact CG1-CE2 3.45Å; V141-W145 HydrophobicContact CG1-CE3 4.32Å; V141-W145 HydrophobicContact CG1-CH2 4.04Å; V141-W145 HydrophobicContact CG1-CZ2 3.56Å; V141-W145 HydrophobicContact CG1-CZ3 4.37Å; V141-W145 PolarHBondContact O-N 2.82Å; V141-L173 HydrophobicContact CB-CD1 4.41Å; V141-L173 HydrophobicContact CB-CD2 4.44Å; V141-L173 HydrophobicContact CG1-CD1 4.4Å; V141-L173 HydrophobicContact CG1-CD2 3.78Å
142	V	95.9	Very high	95.1	Very high	56 Å²	56	58.9 Å²	58.9	34%	0.339	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-40.4	177.5	176	0	0	0	0	111.8	D138 Y144 W145 F146 F172 L173	D138-V142 WeakPolarHBondContact O-CG2 3.07Å; D138-V142 PolarHBondContact O-N 3.3Å; V142-Y144 VanDerWaalsContact C-N 3.3Å; V142-Y144 PolarHBondContact O-N 2.97Å; V142-W145 HydrophobicContact CG2-CE3 4.38Å; V142-W145 PolarHBondContact O-N 2.85Å; V142-F146 VanDerWaalsContact O-CB 3.28Å; V142-F146 WeakPolarHBondContact O-CB 3.45Å; V142-F146 PolarHBondContact O-N 3.34Å; V142-F172 HydrophobicContact CG2-CE1 3.85Å; V142-F172 HydrophobicContact CG2-CZ 3.66Å; V142-L173 HydrophobicContact CG2-CD1 3.84Å
143	R	97.3	Very high	95.5	Very high	140 Å²	140	57.9 Å²	57.9	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-62.1	-39.5	174.5	-79.7	-174	-65.7	-94	2.1	111.9	D137 P139 S140 V141 S147	D137-R143 IonicContact OD1-NH2 3.85Å; P139-R143 WeakPolarHBondContact O-CB 3.36Å; P139-R143 VanDerWaalsContact O-CG 3.31Å; P139-R143 WeakPolarHBondContact O-CG 3.47Å; P139-R143 PolarHBondContact O-N 3.11Å; S140-R143 PolarHBondContact O-N 3.34Å; S140-R143 PolarHBondContact OG-NH2 2.77Å; V141-R143 VanDerWaalsContact C-N 3.35Å; V141-R143 PolarHBondContact O-N 3.46Å; R143-S147 WeakPolarHBondContact O-CB 3.19Å; R143-S147 PolarHBondContact O-N 2.9Å; R143-S147 PolarHBondContact O-OG 2.61Å
144	Y	96.6	Very high	95.9	Very high	49 Å²	49	60.8 Å²	60.8	19%	0.192	33%	0.326	C	S	.	.	H	α-helix	trans	-62.4	-53.8	177.1	173.4	-107.4	0	0	0	111.3	W103 K104 E107 V134 S140 V141 V142 F146 S147 L148	W103-Y144 HydrophobicContact CB-CE1 4.25Å; K104-Y144 PolarHBondContact NZ-OH 2.6Å; E107-Y144 WeakPolarHBondContact OE1-CE2 3.32Å; E107-Y144 PolarHBondContact OE1-OH 2.89Å; E107-Y144 PolarHBondContact OE2-OH 2.64Å; V134-Y144 HydrophobicContact CG1-CD1 3.68Å; V134-Y144 HydrophobicContact CG1-CE1 4.07Å; V134-Y144 HydrophobicContact CG1-CG 4.4Å; V134-Y144 HydrophobicContact CG2-CD1 4.2Å; V134-Y144 HydrophobicContact CG2-CE1 3.76Å; S140-Y144 WeakPolarHBondContact O-CB 3.2Å; S140-Y144 PolarHBondContact O-N 3.29Å; V141-Y144 WeakPolarHBondContact O-CB 3.49Å; V141-Y144 PolarHBondContact O-N 3.33Å; V141-Y144 VanDerWaalsContact O-N 3.14Å; V142-Y144 VanDerWaalsContact C-N 3.3Å; V142-Y144 PolarHBondContact O-N 2.97Å; Y144-F146 VanDerWaalsContact C-N 3.34Å; Y144-F146 PolarHBondContact O-N 3.21Å; Y144-S147 WeakPolarHBondContact O-CB 3.45Å; Y144-S147 PolarHBondContact O-N 3.01Å; Y144-S147 VanDerWaalsContact O-N 3.11Å; Y144-L148 HydrophobicContact CD1-CD1 4.35Å; Y144-L148 HydrophobicContact CE1-CD1 3.74Å; Y144-L148 HydrophobicContact CE2-CD1 4.21Å; Y144-L148 HydrophobicContact CE2-CG 4.42Å; Y144-L148 PolarHBondContact O-N 2.71Å; Y144-L148 VanDerWaalsContact O-N 3.14Å
145	W	96.6	Very high	96.1	Very high	10 Å²	10	60.8 Å²	60.8	4%	0.038	33%	0.329	C	S	.	.	H	α-helix	trans	-54.4	-48.4	175.2	-65.5	-18.4	0	0	0	112.5	W103 L127 W129 A130 V141 V142 S147 L148 L149 F172 L173	W103-W145 AromaticContact CD1-NE1 3.53Å; W103-W145 AromaticContact CD2-CD1 3.2Å; W103-W145 AromaticContact CD2-CG 3.94Å; W103-W145 HydrophobicContact CD2-CG 3.94Å; W103-W145 AromaticContact CD2-NE1 3.41Å; W103-W145 AromaticContact CE2-CD1 3.39Å; W103-W145 AromaticContact CE2-CD2 3.97Å; W103-W145 AromaticContact CE2-CE2 3.62Å; W103-W145 AromaticContact CE2-CG 3.8Å; W103-W145 AromaticContact CE2-NE1 3.29Å; W103-W145 VanDerWaalsContact CE2-NE1 3.29Å; W103-W145 HydrophobicContact CE3-CB 4.12Å; W103-W145 AromaticContact CE3-CD1 3.4Å; W103-W145 VanDerWaalsContact CE3-CD1 3.4Å; W103-W145 AromaticContact CE3-CG 3.92Å; W103-W145 HydrophobicContact CE3-CG 3.92Å; W103-W145 AromaticContact CG-CD1 3.72Å; W103-W145 AromaticContact CG-NE1 3.54Å; W103-W145 HydrophobicContact CH2-CB 3.52Å; W103-W145 AromaticContact CH2-CD1 3.86Å; W103-W145 HydrophobicContact CH2-CD2 4.09Å; W103-W145 AromaticContact CH2-CG 3.56Å; W103-W145 HydrophobicContact CH2-CG 3.56Å; W103-W145 HydrophobicContact CZ2-CB 4.09Å; W103-W145 AromaticContact CZ2-CD1 3.71Å; W103-W145 AromaticContact CZ2-CD2 3.72Å; W103-W145 HydrophobicContact CZ2-CD2 3.72Å; W103-W145 AromaticContact CZ2-CE2 3.84Å; W103-W145 HydrophobicContact CZ2-CE3 4.35Å; W103-W145 AromaticContact CZ2-CG 3.61Å; W103-W145 HydrophobicContact CZ2-CG 3.61Å; W103-W145 HydrophobicContact CZ2-CZ2 4.47Å; W103-W145 AromaticContact CZ2-NE1 3.87Å; W103-W145 HydrophobicContact CZ3-CB 3.55Å; W103-W145 AromaticContact CZ3-CD1 3.73Å; W103-W145 AromaticContact CZ3-CG 3.74Å; W103-W145 HydrophobicContact CZ3-CG 3.74Å; W103-W145 AromaticContact NE1-CD1 3.97Å; W103-W145 AromaticContact NE1-CE2 3.66Å; W103-W145 AromaticContact NE1-CZ2 3.91Å; W103-W145 AromaticContact NE1-NE1 3.38Å; L127-W145 HydrophobicContact CD2-CE3 4.12Å; L127-W145 HydrophobicContact CD2-CH2 4.12Å; L127-W145 HydrophobicContact CD2-CZ3 3.85Å; W129-W145 WeakPolarHBondContact O-CH2 2.98Å; W129-W145 WeakPolarHBondContact O-CZ2 3.21Å; A130-W145 WeakPolarHBondContact O-CZ2 3.38Å; A130-W145 PolarHBondContact O-NE1 3.45Å; V141-W145 HydrophobicContact CG1-CD2 3.91Å; V141-W145 VanDerWaalsContact CG1-CE2 3.45Å; V141-W145 HydrophobicContact CG1-CE3 4.32Å; V141-W145 HydrophobicContact CG1-CH2 4.04Å; V141-W145 HydrophobicContact CG1-CZ2 3.56Å; V141-W145 HydrophobicContact CG1-CZ3 4.37Å; V141-W145 PolarHBondContact O-N 2.82Å; V142-W145 HydrophobicContact CG2-CE3 4.38Å; V142-W145 PolarHBondContact O-N 2.85Å; W145-S147 VanDerWaalsContact C-N 3.31Å; W145-S147 PolarHBondContact O-N 3.48Å; W145-L148 PolarHBondContact O-N 3.13Å; W145-L149 WeakPolarHBondContact O-CG 3.48Å; W145-L149 PolarHBondContact O-N 3.47Å; W145-L149 VanDerWaalsContact O-N 3.17Å; W145-F172 AromaticContact CZ3-CE2 3.92Å; W145-F172 HydrophobicContact CZ3-CE2 3.92Å; W145-F172 AromaticContact CZ3-CZ 3.95Å; W145-F172 HydrophobicContact CZ3-CZ 3.95Å; W145-L173 HydrophobicContact CH2-CD1 4.47Å; W145-L173 HydrophobicContact CH2-CD2 3.33Å; W145-L173 HydrophobicContact CH2-CG 3.83Å; W145-L173 HydrophobicContact CZ2-CD2 3.9Å; W145-L173 HydrophobicContact CZ3-CD1 4.33Å; W145-L173 HydrophobicContact CZ3-CD2 3.99Å; W145-L173 HydrophobicContact CZ3-CG 4.05Å
146	F	96.8	Very high	96.5	Very high	122 Å²	122	56.5 Å²	56.5	54%	0.535	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-41.1	178.1	177.5	-97.8	0	0	0	112.2	V142 Y144 L148 L149 K150	V142-F146 VanDerWaalsContact O-CB 3.28Å; V142-F146 WeakPolarHBondContact O-CB 3.45Å; V142-F146 PolarHBondContact O-N 3.34Å; Y144-F146 VanDerWaalsContact C-N 3.34Å; Y144-F146 PolarHBondContact O-N 3.21Å; F146-L148 PolarHBondContact O-N 3.49Å; F146-L149 PolarHBondContact O-N 2.93Å; F146-K150 HydrophobicContact CD1-CG 4.1Å; F146-K150 HydrophobicContact CE1-CD 4.45Å; F146-K150 HydrophobicContact CE1-CG 3.64Å; F146-K150 HydrophobicContact CE2-CD 4.47Å; F146-K150 HydrophobicContact CE2-CG 4.27Å; F146-K150 HydrophobicContact CZ-CD 4.09Å; F146-K150 HydrophobicContact CZ-CG 3.75Å; F146-K150 WeakPolarHBondContact O-CG 3.48Å; F146-K150 PolarHBondContact O-N 3.49Å
147	S	97.3	Very high	96.7	Very high	61 Å²	61	53.6 Å²	53.6	43%	0.427	26%	0.263	S	S	.	.	H	α-helix	trans	-63.1	-42.8	179.9	-59.6	0	0	0	0	111.5	R143 Y144 W145 L149 K150 E151	R143-S147 WeakPolarHBondContact O-CB 3.19Å; R143-S147 PolarHBondContact O-N 2.9Å; R143-S147 PolarHBondContact O-OG 2.61Å; Y144-S147 WeakPolarHBondContact O-CB 3.45Å; Y144-S147 PolarHBondContact O-N 3.01Å; Y144-S147 VanDerWaalsContact O-N 3.11Å; W145-S147 VanDerWaalsContact C-N 3.31Å; W145-S147 PolarHBondContact O-N 3.48Å; S147-L149 PolarHBondContact O-N 2.96Å; S147-K150 CarbonylContact O-C 3.54Å; S147-K150 WeakPolarHBondContact O-CB 3.5Å; S147-K150 PolarHBondContact O-N 3.26Å; S147-K150 VanDerWaalsContact O-N 3.13Å; S147-E151 WeakPolarHBondContact O-CG 3.37Å; S147-E151 PolarHBondContact O-N 3.14Å
148	L	96.8	Very high	96.8	Very high	12 Å²	12	54.7 Å²	54.7	6%	0.063	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-43.4	176.6	-67.5	176.4	0	0	0	112.5	W103 L106 E107 Y144 W145 F146 K150 E151 L152	W103-L148 HydrophobicContact CE3-CD1 4.04Å; W103-L148 VanDerWaalsContact O-CD1 3.28Å; W103-L148 WeakPolarHBondContact O-CD1 3.07Å; L106-L148 HydrophobicContact CD2-CB 3.7Å; L106-L148 HydrophobicContact CD2-CD1 4.47Å; L106-L148 HydrophobicContact CG-CB 4.14Å; E107-L148 HydrophobicContact CB-CD1 4.39Å; E107-L148 HydrophobicContact CB-CD2 3.88Å; Y144-L148 HydrophobicContact CD1-CD1 4.35Å; Y144-L148 HydrophobicContact CE1-CD1 3.74Å; Y144-L148 HydrophobicContact CE2-CD1 4.21Å; Y144-L148 HydrophobicContact CE2-CG 4.42Å; Y144-L148 PolarHBondContact O-N 2.71Å; Y144-L148 VanDerWaalsContact O-N 3.14Å; W145-L148 PolarHBondContact O-N 3.13Å; F146-L148 PolarHBondContact O-N 3.49Å; L148-K150 PolarHBondContact O-N 3.31Å; L148-E151 PolarHBondContact O-N 3.38Å; L148-E151 VanDerWaalsContact O-N 3.11Å; L148-L152 PolarHBondContact O-N 3.11Å; L148-L152 VanDerWaalsContact O-N 3.14Å
149	L	97.1	Very high	97	Very high	34 Å²	34	55.7 Å²	55.7	18%	0.178	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-31.9	174.8	-62.3	179.4	0	0	0	112	W103 L106 L123 L125 W145 F146 S147 L152 E153 W188	W103-L149 HydrophobicContact CZ3-CG 4.5Å; L106-L149 HydrophobicContact CD2-CD2 4.34Å; L123-L149 HydrophobicContact CD2-CD2 4.43Å; L125-L149 HydrophobicContact CD1-CD1 4.36Å; W145-L149 WeakPolarHBondContact O-CG 3.48Å; W145-L149 PolarHBondContact O-N 3.47Å; W145-L149 VanDerWaalsContact O-N 3.17Å; F146-L149 PolarHBondContact O-N 2.93Å; S147-L149 PolarHBondContact O-N 2.96Å; L149-L152 HydrophobicContact CD2-CD1 4.13Å; L149-L152 WeakPolarHBondContact O-CB 3.38Å; L149-L152 PolarHBondContact O-N 3.5Å; L149-E153 PolarHBondContact O-N 3.37Å; L149-W188 HydrophobicContact CD2-CZ2 4.27Å
150	K	97.7	Very high	97	Very high	64 Å²	64	57.8 Å²	57.8	28%	0.278	27%	0.268	S	S	.	.	H	α-helix	trans	-70.7	-32.7	171.9	-72.9	-50.4	-171.8	-171	0	113.4	F146 S147 L148 L152 E153 R154	F146-K150 HydrophobicContact CD1-CG 4.1Å; F146-K150 HydrophobicContact CE1-CD 4.45Å; F146-K150 HydrophobicContact CE1-CG 3.64Å; F146-K150 HydrophobicContact CE2-CD 4.47Å; F146-K150 HydrophobicContact CE2-CG 4.27Å; F146-K150 HydrophobicContact CZ-CD 4.09Å; F146-K150 HydrophobicContact CZ-CG 3.75Å; F146-K150 WeakPolarHBondContact O-CG 3.48Å; F146-K150 PolarHBondContact O-N 3.49Å; S147-K150 CarbonylContact O-C 3.54Å; S147-K150 WeakPolarHBondContact O-CB 3.5Å; S147-K150 PolarHBondContact O-N 3.26Å; S147-K150 VanDerWaalsContact O-N 3.13Å; L148-K150 PolarHBondContact O-N 3.31Å; K150-L152 VanDerWaalsContact C-N 3.32Å; K150-E153 VanDerWaalsContact CD-OE2 3.22Å; K150-E153 WeakPolarHBondContact CD-OE2 3.29Å; K150-E153 IonicContact NZ-OE1 3.52Å; K150-E153 PolarHBondContact NZ-OE1 3.48Å; K150-E153 IonicContact NZ-OE2 2.6Å; K150-E153 PolarHBondContact NZ-OE2 3.38Å; K150-E153 PolarHBondContact O-N 2.97Å; K150-R154 VanDerWaalsContact O-CG 3.31Å; K150-R154 WeakPolarHBondContact O-CG 3.33Å; K150-R154 PolarHBondContact O-N 3.05Å
151	E	97.5	Very high	96.9	Very high	61 Å²	61	63.7 Å²	63.7	29%	0.285	28%	0.284	S	S	.	.	H	α-helix	trans	-65	-36.2	172.1	-66.8	-50.4	135.4	0	0	112	V110 S147 L148 E153 R154 A155	V110-E151 HydrophobicContact CB-CB 4.46Å; V110-E151 HydrophobicContact CG1-CB 3.81Å; V110-E151 HydrophobicContact CG1-CG 3.98Å; V110-E151 HydrophobicContact CG2-CB 3.73Å; S147-E151 WeakPolarHBondContact O-CG 3.37Å; S147-E151 PolarHBondContact O-N 3.14Å; L148-E151 PolarHBondContact O-N 3.38Å; L148-E151 VanDerWaalsContact O-N 3.11Å; E151-E153 PolarHBondContact O-N 2.98Å; E151-R154 PolarHBondContact O-N 3.27Å; E151-R154 WeakPolarHBondContact OE1-CD 3.36Å; E151-R154 IonicContact OE1-CZ 2.84Å; E151-R154 IonicContact OE1-NE 3.45Å; E151-R154 IonicContact OE1-NH1 3.9Å; E151-R154 PolarHBondContact OE1-NH1 3.01Å; E151-R154 WeakPolarHBondContact OE2-CD 3.28Å; E151-A155 WeakPolarHBondContact O-CB 3.5Å; E151-A155 PolarHBondContact O-N 3.24Å
152	L	96.9	Very high	96.9	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.3	-49.6	169.8	-69.6	177.2	0	0	0	111.7	L106 L115 L121 L148 L149 K150 R154 A155 G156 F157 W188	L106-L152 HydrophobicContact CD1-CD1 4.01Å; L106-L152 HydrophobicContact CD1-CD2 3.63Å; L106-L152 HydrophobicContact CD1-CG 3.88Å; L106-L152 HydrophobicContact CD2-CD1 4.18Å; L115-L152 HydrophobicContact CD1-CD2 3.78Å; L115-L152 HydrophobicContact CD2-CD2 3.75Å; L115-L152 HydrophobicContact CG-CD2 4.44Å; L121-L152 HydrophobicContact CD2-CD1 3.93Å; L121-L152 HydrophobicContact CD2-CD2 3.66Å; L121-L152 HydrophobicContact CD2-CG 4.47Å; L148-L152 PolarHBondContact O-N 3.11Å; L148-L152 VanDerWaalsContact O-N 3.14Å; L149-L152 HydrophobicContact CD2-CD1 4.13Å; L149-L152 WeakPolarHBondContact O-CB 3.38Å; L149-L152 PolarHBondContact O-N 3.5Å; K150-L152 VanDerWaalsContact C-N 3.32Å; L152-R154 VanDerWaalsContact C-N 3.28Å; L152-R154 PolarHBondContact O-N 2.8Å; L152-A155 PolarHBondContact O-N 2.85Å; L152-G156 PolarHBondContact O-N 2.95Å; L152-F157 HydrophobicContact CB-CB 4.2Å; L152-F157 HydrophobicContact CD2-CD2 4.32Å; L152-F157 WeakPolarHBondContact O-CB 3.28Å; L152-F157 PolarHBondContact O-N 3.08Å; L152-W188 HydrophobicContact CD1-CD2 4.49Å; L152-W188 HydrophobicContact CD1-CZ2 4.44Å
153	E	97	Very high	96.7	Very high	75 Å²	75	70 Å²	70	35%	0.35	32%	0.315	S	S	.	.	H	α-helix	trans	-59.3	-39.6	178	-70.3	178.9	-170.8	0	0	112.5	L149 K150 E151 G156 R158 W188	L149-E153 PolarHBondContact O-N 3.37Å; K150-E153 VanDerWaalsContact CD-OE2 3.22Å; K150-E153 WeakPolarHBondContact CD-OE2 3.29Å; K150-E153 IonicContact NZ-OE1 3.52Å; K150-E153 PolarHBondContact NZ-OE1 3.48Å; K150-E153 IonicContact NZ-OE2 2.6Å; K150-E153 PolarHBondContact NZ-OE2 3.38Å; K150-E153 PolarHBondContact O-N 2.97Å; E151-E153 PolarHBondContact O-N 2.98Å; E153-G156 PolarHBondContact O-N 3.14Å; E153-G156 VanDerWaalsContact O-N 3.15Å; E153-R158 PolarHBondContact O-NH1 2.79Å; E153-R158 VanDerWaalsContact O-NH1 3.07Å; E153-W188 HydrophobicContact CG-CH2 4.42Å; E153-W188 HydrophobicContact CG-CZ3 3.93Å
154	R	96.5	Very high	96.5	Very high	163 Å²	163	66 Å²	66	62%	0.615	31%	0.309	S	S	*	.	H	α-helix	trans	-66.6	-38.2	177	-74.2	171.5	177.8	178.8	0.2	112.2	K150 E151 L152 G156 R192	K150-R154 VanDerWaalsContact O-CG 3.31Å; K150-R154 WeakPolarHBondContact O-CG 3.33Å; K150-R154 PolarHBondContact O-N 3.05Å; E151-R154 PolarHBondContact O-N 3.27Å; E151-R154 WeakPolarHBondContact OE1-CD 3.36Å; E151-R154 IonicContact OE1-CZ 2.84Å; E151-R154 IonicContact OE1-NE 3.45Å; E151-R154 IonicContact OE1-NH1 3.9Å; E151-R154 PolarHBondContact OE1-NH1 3.01Å; E151-R154 WeakPolarHBondContact OE2-CD 3.28Å; L152-R154 VanDerWaalsContact C-N 3.28Å; L152-R154 PolarHBondContact O-N 2.8Å; R154-G156 PolarHBondContact O-N 3.24Å; R154-R192 PolarHBondContact O-NH1 2.84Å
155	A	95.8	Very high	95.9	Very high	22 Å²	22	65.9 Å²	65.9	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-67.8	-8.7	172.9	0	0	0	0	0	113	L115 E151 L152 F157	L115-A155 HydrophobicContact CB-CB 4.31Å; L115-A155 HydrophobicContact CD1-CB 3.98Å; E151-A155 WeakPolarHBondContact O-CB 3.5Å; E151-A155 PolarHBondContact O-N 3.24Å; L152-A155 PolarHBondContact O-N 2.85Å; A155-F157 HydrophobicContact CB-CD2 4.11Å; A155-F157 HydrophobicContact CB-CE2 4.39Å
156	G	96.6	Very high	95.3	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.3	7.3	176.1	0	0	0	0	0	113.9	L152 E153 R154 V191	L152-G156 PolarHBondContact O-N 2.95Å; E153-G156 PolarHBondContact O-N 3.14Å; E153-G156 VanDerWaalsContact O-N 3.15Å; R154-G156 PolarHBondContact O-N 3.24Å; G156-V191 WeakPolarHBondContact O-CG2 3.23Å; G156-V191 PolarHBondContact O-N 3.43Å
157	F	97.9	Very high	94.8	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	143.3	171.6	-71.6	-97.6	0	0	0	111	L115 V118 L121 L152 A155 W188 V189 N190	L115-F157 HydrophobicContact CB-CE2 3.98Å; L115-F157 HydrophobicContact CD2-CE2 4.18Å; L115-F157 HydrophobicContact CD2-CZ 4.37Å; V118-F157 HydrophobicContact CB-CZ 4.08Å; V118-F157 HydrophobicContact CG1-CE1 4.25Å; V118-F157 HydrophobicContact CG1-CZ 4.1Å; V118-F157 WeakPolarHBondContact O-CZ 3.34Å; L121-F157 HydrophobicContact CB-CD1 4.1Å; L121-F157 HydrophobicContact CB-CE1 3.69Å; L152-F157 HydrophobicContact CB-CB 4.2Å; L152-F157 HydrophobicContact CD2-CD2 4.32Å; L152-F157 WeakPolarHBondContact O-CB 3.28Å; L152-F157 PolarHBondContact O-N 3.08Å; A155-F157 HydrophobicContact CB-CD2 4.11Å; A155-F157 HydrophobicContact CB-CE2 4.39Å; F157-W188 HydrophobicContact CB-CB 4.08Å; F157-W188 HydrophobicContact CB-CD2 4.48Å; F157-W188 HydrophobicContact CB-CE3 3.96Å; F157-W188 HydrophobicContact CD1-CB 3.69Å; F157-W188 HydrophobicContact CG-CB 4.34Å; F157-V189 CarbonylContact C-O 3.6Å; F157-V189 WeakPolarHBondContact CA-O 3.49Å; F157-N190 HydrophobicContact CD1-CB 3.98Å; F157-N190 HydrophobicContact CD2-CB 4.27Å; F157-N190 HydrophobicContact CE1-CB 3.72Å; F157-N190 HydrophobicContact CE2-CB 3.98Å; F157-N190 WeakPolarHBondContact CE2-ND2 3.24Å; F157-N190 HydrophobicContact CG-CB 4.27Å; F157-N190 HydrophobicContact CZ-CB 3.71Å
158	R	97.9	Very high	94.2	Very high	114 Å²	114	68.3 Å²	68.3	43%	0.43	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.8	174.3	-65.4	-65.4	179.6	-91.3	3.9	108.6	E153 F160 W188 V189 V191	E153-R158 PolarHBondContact O-NH1 2.79Å; E153-R158 VanDerWaalsContact O-NH1 3.07Å; R158-F160 PolarHBondContact O-N 2.75Å; R158-W188 WeakPolarHBondContact O-CA 3.38Å; R158-V189 HydrophobicContact CB-CG1 4.31Å; R158-V189 PolarHBondContact N-O 3.1Å; R158-V189 PolarHBondContact O-N 3.38Å; R158-V191 HydrophobicContact CB-CG1 4.36Å; R158-V191 HydrophobicContact CG-CG1 3.85Å; R158-V191 HydrophobicContact CG-CG2 4.14Å
159	L	97.9	Very high	93.7	Very high	77 Å²	77	71.4 Å²	71.4	40%	0.403	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	124.7	175.5	-174.8	62.9	0	0	0	108.6	R161 V162 L186 W188	L159-R161 WeakPolarHBondContact CD1-O 3.26Å; L159-V162 HydrophobicContact CD1-CG2 4Å; L159-V162 HydrophobicContact CD2-CG2 3.68Å; L159-V162 HydrophobicContact CG-CG2 4.08Å; L159-L186 HydrophobicContact CD1-CB 3.8Å; L159-L186 HydrophobicContact CD1-CD2 3.99Å; L159-L186 HydrophobicContact CD1-CG 4.24Å; L159-L186 HydrophobicContact CD2-CD2 4.31Å; L159-W188 HydrophobicContact CB-CD2 4.08Å; L159-W188 HydrophobicContact CB-CE3 3.69Å; L159-W188 HydrophobicContact CB-CH2 3.83Å; L159-W188 HydrophobicContact CB-CZ2 4.21Å; L159-W188 HydrophobicContact CB-CZ3 3.56Å; L159-W188 HydrophobicContact CD1-CD2 3.96Å; L159-W188 HydrophobicContact CD1-CE3 4.44Å; L159-W188 HydrophobicContact CD1-CG 4.39Å; L159-W188 HydrophobicContact CD1-CH2 4.35Å; L159-W188 HydrophobicContact CD1-CZ2 3.87Å; L159-W188 HydrophobicContact CD2-CH2 4.33Å; L159-W188 HydrophobicContact CD2-CZ2 4.38Å; L159-W188 HydrophobicContact CG-CH2 4.41Å; L159-W188 HydrophobicContact CG-CZ2 4.4Å
160	F	96.8	Very high	93.4	Very high	110 Å²	110	76.7 Å²	76.7	48%	0.482	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-15.5	177.8	71.4	-94.4	0	0	0	113	R158 S187 V189	R158-F160 PolarHBondContact O-N 2.75Å; F160-S187 WeakPolarHBondContact CD1-O 3.18Å; F160-S187 VanDerWaalsContact CE1-C 3.46Å; F160-S187 WeakPolarHBondContact CE1-O 3.49Å; F160-S187 PolarHBondContact N-O 2.64Å; F160-V189 HydrophobicContact CD1-CB 4.12Å; F160-V189 HydrophobicContact CD1-CG1 4.08Å; F160-V189 HydrophobicContact CE1-CB 4.29Å
161	R	96.3	Very high	93.1	Very high	164 Å²	164	75.7 Å²	75.7	62%	0.619	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.6	141.1	177.3	178.1	178.9	-71	-124.9	-0.3	110.9	L159 S187	L159-R161 WeakPolarHBondContact CD1-O 3.26Å; R161-S187 PolarHBondContact N-O 2.72Å; R161-S187 PolarHBondContact O-N 3Å
162	V	95.4	Very high	92.9	Very high	84 Å²	84	75.6 Å²	75.6	51%	0.509	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.3	167.6	-179.1	0	0	0	0	107.2	L159 Y184 T185 L186	L159-V162 HydrophobicContact CD1-CG2 4Å; L159-V162 HydrophobicContact CD2-CG2 3.68Å; L159-V162 HydrophobicContact CG-CG2 4.08Å; V162-Y184 HydrophobicContact CG1-CD1 4.17Å; V162-T185 WeakPolarHBondContact CA-O 3.11Å; V162-L186 HydrophobicContact CG2-CG 4.49Å
163	H	93	Very high	92.7	Very high	109 Å²	109	76 Å²	76	51%	0.505	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.5	172.5	-178	67.8	0	0	0	108.5	Y184 T185	H163-Y184 CarbonylContact O-C 3.41Å; H163-Y184 VanDerWaalsContact O-CA 3.25Å; H163-Y184 WeakPolarHBondContact O-CA 3.34Å; H163-T185 PolarHBondContact N-O 2.86Å; H163-T185 PolarHBondContact O-N 3.36Å
164	S	91.6	Very high	92.5	Very high	56 Å²	56	78.9 Å²	78.9	39%	0.392	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.1	172.5	59.2	0	0	0	0	108.8	P166	S164-P166 VanDerWaalsContact O-CD 3.24Å; S164-P166 WeakPolarHBondContact O-CD 3.31Å
165	D	85.3	Confident	92.3	Very high	45 Å²	45	76.9 Å²	76.9	24%	0.241	39%	0.386	C	S	.	.			trans	-83.1	111.4	172.5	-177	-7.4	0	0	0	109.6	S167 T168 S181 A183	D165-S167 PolarHBondContact O-N 2.95Å; D165-S167 WeakPolarHBondContact OD1-CA 3.22Å; D165-S167 VanDerWaalsContact OD1-CB 3.23Å; D165-S167 WeakPolarHBondContact OD1-CB 3.47Å; D165-S167 PolarHBondContact OD1-N 3.31Å; D165-S167 PolarHBondContact OD1-OG 3.21Å; D165-S167 PolarHBondContact OD2-OG 2.78Å; D165-T168 HydrophobicContact CB-CG2 3.98Å; D165-T168 PolarHBondContact O-OG1 2.87Å; D165-T168 WeakPolarHBondContact OD2-CG2 3.43Å; D165-S181 WeakPolarHBondContact O-CB 3.35Å; D165-S181 PolarHBondContact O-OG 3.21Å; D165-A183 HydrophobicContact CB-CB 4.28Å; D165-A183 PolarHBondContact N-O 3.32Å; D165-A183 VanDerWaalsContact N-O 3.14Å
166	P	84.1	Confident	92.1	Very high	114 Å²	114	82.4 Å²	82.4	74%	0.74	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-12.2	-179.7	33.6	-36.5	0	0	0	113.4	S164 T168	S164-P166 VanDerWaalsContact O-CD 3.24Å; S164-P166 WeakPolarHBondContact O-CD 3.31Å; P166-T168 VanDerWaalsContact C-N 3.34Å
167	S	85.6	Confident	91.6	Very high	97 Å²	97	85.9 Å²	85.9	68%	0.678	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-20	179.6	80.1	0	0	0	0	112.8	D165	D165-S167 PolarHBondContact O-N 2.95Å; D165-S167 WeakPolarHBondContact OD1-CA 3.22Å; D165-S167 VanDerWaalsContact OD1-CB 3.23Å; D165-S167 WeakPolarHBondContact OD1-CB 3.47Å; D165-S167 PolarHBondContact OD1-N 3.31Å; D165-S167 PolarHBondContact OD1-OG 3.21Å; D165-S167 PolarHBondContact OD2-OG 2.78Å
168	T	85.4	Confident	91	Very high	33 Å²	33	93.2 Å²	93.2	20%	0.202	47%	0.469	C	S	.	.	S	Bend	trans	-83.2	157.9	-179.1	74.7	0	0	0	0	113	D165 P166 S181 S182 A183	D165-T168 HydrophobicContact CB-CG2 3.98Å; D165-T168 PolarHBondContact O-OG1 2.87Å; D165-T168 WeakPolarHBondContact OD2-CG2 3.43Å; P166-T168 VanDerWaalsContact C-N 3.34Å; T168-S181 PolarHBondContact OG1-OG 3.47Å; T168-S182 WeakPolarHBondContact CB-OG 3.18Å; T168-S182 PolarHBondContact OG1-N 2.95Å; T168-S182 PolarHBondContact OG1-OG 3.38Å; T168-A183 HydrophobicContact CG2-CB 3.74Å; T168-A183 PolarHBondContact OG1-N 3.37Å
169	P	86.6	Confident	90.2	Very high	77 Å²	77	95.1 Å²	95.1	50%	0.5	49%	0.488	S	S	.	.			trans	-55.4	157.6	176.4	-26.1	35.3	0	0	0	113.3	L171 S182	P169-L171 HydrophobicContact CB-CB 4.44Å; P169-L171 HydrophobicContact CB-CD1 3.94Å; P169-L171 HydrophobicContact CB-CG 3.89Å; P169-L171 PolarHBondContact O-N 3.2Å; P169-L171 VanDerWaalsContact O-N 3.11Å; P169-S182 WeakPolarHBondContact CD-OG 3.2Å; P169-S182 WeakPolarHBondContact O-CB 3.44Å; P169-S182 PolarHBondContact O-N 2.91Å; P169-S182 PolarHBondContact O-OG 2.91Å
170	R	90.1	Very high	89.5	Confident	146 Å²	146	92.3 Å²	92.3	55%	0.551	48%	0.476	S	S	*	.			trans	-90.9	48.6	176.8	-51.5	-168.8	-178.7	166	-1.3	111.9	N176 I177 A180	R170-N176 WeakPolarHBondContact O-CA 3.27Å; R170-I177 WeakPolarHBondContact CB-O 3.49Å; R170-I177 PolarHBondContact O-N 2.79Å; R170-A180 WeakPolarHBondContact CB-O 3.43Å; R170-A180 WeakPolarHBondContact CG-O 3.28Å
171	L	91.9	Very high	89.2	Confident	43 Å²	43	87.6 Å²	87.6	23%	0.225	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134	-174.8	-66.7	175.8	0	0	0	111	H128 P169 K175 S182	H128-L171 HydrophobicContact CB-CB 3.8Å; H128-L171 HydrophobicContact CB-CD1 4.36Å; P169-L171 HydrophobicContact CB-CB 4.44Å; P169-L171 HydrophobicContact CB-CD1 3.94Å; P169-L171 HydrophobicContact CB-CG 3.89Å; P169-L171 PolarHBondContact O-N 3.2Å; P169-L171 VanDerWaalsContact O-N 3.11Å; L171-K175 WeakPolarHBondContact CA-O 3.46Å; L171-S182 WeakPolarHBondContact O-CA 3.31Å; L171-S182 WeakPolarHBondContact O-CB 3.42Å
172	F	92.7	Very high	89	Confident	58 Å²	58	80 Å²	80	25%	0.254	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	112.2	169.1	-176.2	-90.6	0	0	0	108.1	L127 V142 W145 H174 K175 I177	L127-F172 HydrophobicContact CB-CD2 3.98Å; L127-F172 HydrophobicContact CB-CE2 4.41Å; L127-F172 HydrophobicContact CD1-CD2 4.13Å; L127-F172 HydrophobicContact CD1-CE2 4.15Å; L127-F172 CarbonylContact O-C 3.58Å; L127-F172 VanDerWaalsContact O-CA 3.31Å; L127-F172 WeakPolarHBondContact O-CA 3.44Å; V142-F172 HydrophobicContact CG2-CE1 3.85Å; V142-F172 HydrophobicContact CG2-CZ 3.66Å; W145-F172 AromaticContact CZ3-CE2 3.92Å; W145-F172 HydrophobicContact CZ3-CE2 3.92Å; W145-F172 AromaticContact CZ3-CZ 3.95Å; W145-F172 HydrophobicContact CZ3-CZ 3.95Å; F172-H174 VanDerWaalsContact C-N 3.33Å; F172-H174 PolarHBondContact O-N 3.39Å; F172-K175 PolarHBondContact N-O 3.12Å; F172-K175 WeakPolarHBondContact O-CB 3.06Å; F172-K175 PolarHBondContact O-N 3.18Å; F172-I177 HydrophobicContact CB-CD1 3.62Å; F172-I177 HydrophobicContact CB-CG1 4Å; F172-I177 HydrophobicContact CD1-CD1 4.04Å; F172-I177 HydrophobicContact CG-CD1 4Å
173	L	93.1	Very high	88.8	Confident	9 Å²	9	76 Å²	76	5%	0.047	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	53.6	-174.5	-63	175.2	0	0	0	112.4	L127 A130 D138 V141 V142 W145 K175	L127-L173 PolarHBondContact O-N 3.42Å; A130-L173 HydrophobicContact CB-CD2 4.25Å; D138-L173 HydrophobicContact CB-CD1 3.64Å; V141-L173 HydrophobicContact CB-CD1 4.41Å; V141-L173 HydrophobicContact CB-CD2 4.44Å; V141-L173 HydrophobicContact CG1-CD1 4.4Å; V141-L173 HydrophobicContact CG1-CD2 3.78Å; V142-L173 HydrophobicContact CG2-CD1 3.84Å; W145-L173 HydrophobicContact CH2-CD1 4.47Å; W145-L173 HydrophobicContact CH2-CD2 3.33Å; W145-L173 HydrophobicContact CH2-CG 3.83Å; W145-L173 HydrophobicContact CZ2-CD2 3.9Å; W145-L173 HydrophobicContact CZ3-CD1 4.33Å; W145-L173 HydrophobicContact CZ3-CD2 3.99Å; W145-L173 HydrophobicContact CZ3-CG 4.05Å; L173-K175 PolarHBondContact O-N 2.96Å
174	H	92	Very high	88.9	Confident	135 Å²	135	73.5 Å²	73.5	63%	0.625	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	4.3	-176.1	-53.9	-68.8	0	0	0	116	H128 W129 F172	H128-H174 PolarHBondContact O-N 3.31Å; H128-H174 PolarHBondContact O-ND1 3.1Å; W129-H174 WeakPolarHBondContact CB-CE1 3.43Å; W129-H174 WeakPolarHBondContact CB-NE2 3.36Å; F172-H174 VanDerWaalsContact C-N 3.33Å; F172-H174 PolarHBondContact O-N 3.39Å
175	K	91.6	Very high	89	Confident	121 Å²	121	72.3 Å²	72.3	53%	0.526	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.8	177.7	-63.7	167.9	177.3	173.3	0	109.9	D138 L171 F172 L173 I177	D138-K175 WeakPolarHBondContact OD2-CE 3.45Å; D138-K175 IonicContact OD2-NZ 3.52Å; D138-K175 PolarHBondContact OD2-NZ 3.48Å; L171-K175 WeakPolarHBondContact CA-O 3.46Å; F172-K175 PolarHBondContact N-O 3.12Å; F172-K175 WeakPolarHBondContact O-CB 3.06Å; F172-K175 PolarHBondContact O-N 3.18Å; L173-K175 PolarHBondContact O-N 2.96Å; K175-I177 PolarHBondContact O-N 3.43Å
176	N	91.5	Very high	89.5	Confident	138 Å²	138	71 Å²	71	74%	0.738	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	125.9	172	-76.1	-68.2	0	0	0	109.9	R170	R170-N176 WeakPolarHBondContact O-CA 3.27Å
177	I	87.9	Confident	90.1	Very high	74 Å²	74	66.1 Å²	66.1	38%	0.379	34%	0.343	S	S	.	.			trans	-121.7	133.9	175.4	-63	-161.4	0	0	0	109.8	R170 F172 K175 A180	R170-I177 WeakPolarHBondContact CB-O 3.49Å; R170-I177 PolarHBondContact O-N 2.79Å; F172-I177 HydrophobicContact CB-CD1 3.62Å; F172-I177 HydrophobicContact CB-CG1 4Å; F172-I177 HydrophobicContact CD1-CD1 4.04Å; F172-I177 HydrophobicContact CG-CD1 4Å; K175-I177 PolarHBondContact O-N 3.43Å; I177-A180 HydrophobicContact CB-CB 3.93Å; I177-A180 HydrophobicContact CG2-CB 3.73Å
178	L	83.6	Confident	90.7	Very high	154 Å²	154	61.8 Å²	61.8	81%	0.806	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	137.4	175.4	-65	173.6	0	0	0	110	A180	L178-A180 PolarHBondContact O-N 2.84Å
179	N	82.1	Confident	91.2	Very high	153 Å²	153	62.6 Å²	62.6	82%	0.818	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	27.2	179.3	-60.2	-15.4	0	0	0	115.2
180	A	83.6	Confident	91.7	Very high	19 Å²	19	59.3 Å²	59.3	16%	0.157	30%	0.295	C	S	.	.			trans	-110.5	151.8	169.8	0	0	0	0	0	110.7	R170 I177 L178	R170-A180 WeakPolarHBondContact CB-O 3.43Å; R170-A180 WeakPolarHBondContact CG-O 3.28Å; I177-A180 HydrophobicContact CB-CB 3.93Å; I177-A180 HydrophobicContact CG2-CB 3.73Å; L178-A180 PolarHBondContact O-N 2.84Å
181	S	89.2	Confident	92	Very high	10 Å²	10	56.8 Å²	56.8	7%	0.07	30%	0.295	C	S	.	.			trans	-98.8	157.3	159.7	179.4	0	0	0	0	109.7	D165 T168 A183 Y184	D165-S181 WeakPolarHBondContact O-CB 3.35Å; D165-S181 PolarHBondContact O-OG 3.21Å; T168-S181 PolarHBondContact OG1-OG 3.47Å; S181-A183 VanDerWaalsContact C-N 3.34Å; S181-A183 PolarHBondContact OG-N 2.92Å; S181-A183 VanDerWaalsContact OG-N 3.07Å; S181-A183 PolarHBondContact OG-O 2.95Å; S181-Y184 PolarHBondContact N-OH 2.91Å; S181-Y184 WeakPolarHBondContact O-CE2 3.11Å
182	S	92.1	Very high	92.1	Very high	5 Å²	5	62.1 Å²	62.1	4%	0.035	31%	0.312	C	S	.	.	S	Bend	trans	-86	-8.8	167.8	62.2	0	0	0	0	113.4	H126 L127 T168 P169 L171	H126-S182 WeakPolarHBondContact CA-O 3.34Å; L127-S182 PolarHBondContact N-O 3.14Å; T168-S182 WeakPolarHBondContact CB-OG 3.18Å; T168-S182 PolarHBondContact OG1-N 2.95Å; T168-S182 PolarHBondContact OG1-OG 3.38Å; P169-S182 WeakPolarHBondContact CD-OG 3.2Å; P169-S182 WeakPolarHBondContact O-CB 3.44Å; P169-S182 PolarHBondContact O-N 2.91Å; P169-S182 PolarHBondContact O-OG 2.91Å; L171-S182 WeakPolarHBondContact O-CA 3.31Å; L171-S182 WeakPolarHBondContact O-CB 3.42Å
183	A	92.5	Very high	92	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.008	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.5	178.7	0	0	0	0	0	112	L125 D165 T168 S181	L125-A183 VanDerWaalsContact O-CA 3.23Å; L125-A183 WeakPolarHBondContact O-CA 3.23Å; D165-A183 HydrophobicContact CB-CB 4.28Å; D165-A183 PolarHBondContact N-O 3.32Å; D165-A183 VanDerWaalsContact N-O 3.14Å; T168-A183 HydrophobicContact CG2-CB 3.74Å; T168-A183 PolarHBondContact OG1-N 3.37Å; S181-A183 VanDerWaalsContact C-N 3.34Å; S181-A183 PolarHBondContact OG-N 2.92Å; S181-A183 VanDerWaalsContact OG-N 3.07Å; S181-A183 PolarHBondContact OG-O 2.95Å
184	Y	93.9	Very high	91.7	Very high	56 Å²	56	69.6 Å²	69.6	22%	0.22	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	129.4	174.4	-63.3	-96.3	0	0	0	110.9	E124 L125 L127 V162 H163 S181	E124-Y184 CarbonylContact C-O 3.58Å; E124-Y184 WeakPolarHBondContact CA-O 3.25Å; L125-Y184 PolarHBondContact N-O 3.41Å; L125-Y184 PolarHBondContact O-N 2.99Å; L127-Y184 HydrophobicContact CD1-CD2 3.66Å; L127-Y184 HydrophobicContact CD1-CE2 3.7Å; L127-Y184 HydrophobicContact CG-CD2 4.43Å; V162-Y184 HydrophobicContact CG1-CD1 4.17Å; H163-Y184 CarbonylContact O-C 3.41Å; H163-Y184 VanDerWaalsContact O-CA 3.25Å; H163-Y184 WeakPolarHBondContact O-CA 3.34Å; S181-Y184 PolarHBondContact N-OH 2.91Å; S181-Y184 WeakPolarHBondContact O-CE2 3.11Å
185	T	94.2	Very high	91.1	Very high	31 Å²	31	63.7 Å²	63.7	19%	0.19	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	119.2	168.3	-35.6	0	0	0	0	109.6	L123 E124 V162 H163	L123-T185 CarbonylContact O-C 3.59Å; L123-T185 WeakPolarHBondContact O-CA 3.18Å; E124-T185 PolarHBondContact OE2-OG1 3.14Å; E124-T185 VanDerWaalsContact OE2-OG1 3.11Å; V162-T185 WeakPolarHBondContact CA-O 3.11Å; H163-T185 PolarHBondContact N-O 2.86Å; H163-T185 PolarHBondContact O-N 3.36Å
186	L	96.3	Very high	90.5	Very high	16 Å²	16	60.7 Å²	60.7	8%	0.084	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.9	174.7	-64.9	91.1	0	0	0	109.6	L122 L123 L125 L159 V162 W188	L122-L186 WeakPolarHBondContact CA-O 3.41Å; L123-L186 PolarHBondContact N-O 3.25Å; L123-L186 PolarHBondContact O-N 2.95Å; L125-L186 HydrophobicContact CB-CD1 4.29Å; L125-L186 HydrophobicContact CD1-CD1 3.28Å; L125-L186 HydrophobicContact CD1-CD2 4.47Å; L125-L186 HydrophobicContact CG-CD1 3.49Å; L125-L186 VanDerWaalsContact CG-CD1 3.49Å; L159-L186 HydrophobicContact CD1-CB 3.8Å; L159-L186 HydrophobicContact CD1-CD2 3.99Å; L159-L186 HydrophobicContact CD1-CG 4.24Å; L159-L186 HydrophobicContact CD2-CD2 4.31Å; V162-L186 HydrophobicContact CG2-CG 4.49Å; L186-W188 VanDerWaalsContact CB-NE1 3.29Å; L186-W188 HydrophobicContact CD2-CZ2 3.79Å
187	S	96.4	Very high	89.4	Confident	12 Å²	12	59.2 Å²	59.2	8%	0.084	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.6	176.4	-38.1	0	0	0	0	110.7	F160 R161	F160-S187 WeakPolarHBondContact CD1-O 3.18Å; F160-S187 VanDerWaalsContact CE1-C 3.46Å; F160-S187 WeakPolarHBondContact CE1-O 3.49Å; F160-S187 PolarHBondContact N-O 2.64Å; R161-S187 PolarHBondContact N-O 2.72Å; R161-S187 PolarHBondContact O-N 3Å
188	W	97.7	Very high	88.4	Confident	6 Å²	6	57.9 Å²	57.9	2%	0.023	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145.7	-175.9	-54.9	81.8	0	0	0	111.2	Q120 L121 L149 L152 E153 F157 R158 L159 L186	Q120-W188 WeakPolarHBondContact CA-O 3.43Å; L121-W188 HydrophobicContact CB-CB 4.33Å; L121-W188 PolarHBondContact N-O 3.3Å; L121-W188 PolarHBondContact O-N 3.36Å; L149-W188 HydrophobicContact CD2-CZ2 4.27Å; L152-W188 HydrophobicContact CD1-CD2 4.49Å; L152-W188 HydrophobicContact CD1-CZ2 4.44Å; E153-W188 HydrophobicContact CG-CH2 4.42Å; E153-W188 HydrophobicContact CG-CZ3 3.93Å; F157-W188 HydrophobicContact CB-CB 4.08Å; F157-W188 HydrophobicContact CB-CD2 4.48Å; F157-W188 HydrophobicContact CB-CE3 3.96Å; F157-W188 HydrophobicContact CD1-CB 3.69Å; F157-W188 HydrophobicContact CG-CB 4.34Å; R158-W188 WeakPolarHBondContact O-CA 3.38Å; L159-W188 HydrophobicContact CB-CD2 4.08Å; L159-W188 HydrophobicContact CB-CE3 3.69Å; L159-W188 HydrophobicContact CB-CH2 3.83Å; L159-W188 HydrophobicContact CB-CZ2 4.21Å; L159-W188 HydrophobicContact CB-CZ3 3.56Å; L159-W188 HydrophobicContact CD1-CD2 3.96Å; L159-W188 HydrophobicContact CD1-CE3 4.44Å; L159-W188 HydrophobicContact CD1-CG 4.39Å; L159-W188 HydrophobicContact CD1-CH2 4.35Å; L159-W188 HydrophobicContact CD1-CZ2 3.87Å; L159-W188 HydrophobicContact CD2-CH2 4.33Å; L159-W188 HydrophobicContact CD2-CZ2 4.38Å; L159-W188 HydrophobicContact CG-CH2 4.41Å; L159-W188 HydrophobicContact CG-CZ2 4.4Å; L186-W188 VanDerWaalsContact CB-NE1 3.29Å; L186-W188 HydrophobicContact CD2-CZ2 3.79Å
189	V	97.2	Very high	87.2	Confident	50 Å²	50	53.4 Å²	53.4	30%	0.303	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.1	171.2	61.6	0	0	0	0	109.9	Q120 F157 R158 F160 V191	Q120-V189 HydrophobicContact CG-CB 4.49Å; Q120-V189 HydrophobicContact CG-CG2 4.27Å; F157-V189 CarbonylContact C-O 3.6Å; F157-V189 WeakPolarHBondContact CA-O 3.49Å; R158-V189 HydrophobicContact CB-CG1 4.31Å; R158-V189 PolarHBondContact N-O 3.1Å; R158-V189 PolarHBondContact O-N 3.38Å; F160-V189 HydrophobicContact CD1-CB 4.12Å; F160-V189 HydrophobicContact CD1-CG1 4.08Å; F160-V189 HydrophobicContact CE1-CB 4.29Å; V189-V191 HydrophobicContact CG1-CG1 4.37Å; V189-V191 PolarHBondContact O-N 3.47Å
190	N	96.6	Very high	85.8	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.048	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	106.4	175.6	-171.3	-15.3	0	0	0	109.9	L115 V118 G119 F157 R192 W193	L115-N190 PolarHBondContact O-ND2 2.84Å; V118-N190 VanDerWaalsContact O-CB 3.27Å; V118-N190 WeakPolarHBondContact O-CB 3.06Å; V118-N190 PolarHBondContact O-ND2 2.59Å; V118-N190 VanDerWaalsContact O-ND2 3.17Å; G119-N190 WeakPolarHBondContact O-CB 3.33Å; G119-N190 PolarHBondContact O-N 2.77Å; F157-N190 HydrophobicContact CD1-CB 3.98Å; F157-N190 HydrophobicContact CD2-CB 4.27Å; F157-N190 HydrophobicContact CE1-CB 3.72Å; F157-N190 HydrophobicContact CE2-CB 3.98Å; F157-N190 WeakPolarHBondContact CE2-ND2 3.24Å; F157-N190 HydrophobicContact CG-CB 4.27Å; F157-N190 HydrophobicContact CZ-CB 3.71Å; N190-R192 PolarHBondContact O-N 3.43Å; N190-R192 PolarHBondContact OD1-N 3.05Å; N190-W193 HydrophobicContact CB-CB 3.78Å; N190-W193 PolarHBondContact OD1-N 2.98Å; N190-W193 VanDerWaalsContact OD1-N 3.13Å
191	V	95.6	Very high	84.1	Confident	92 Å²	92	58.2 Å²	58.2	56%	0.558	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-4.8	-179.1	-57.3	0	0	0	0	113.2	G156 R158 V189	G156-V191 WeakPolarHBondContact O-CG2 3.23Å; G156-V191 PolarHBondContact O-N 3.43Å; R158-V191 HydrophobicContact CB-CG1 4.36Å; R158-V191 HydrophobicContact CG-CG1 3.85Å; R158-V191 HydrophobicContact CG-CG2 4.14Å; V189-V191 HydrophobicContact CG1-CG1 4.37Å; V189-V191 PolarHBondContact O-N 3.47Å
192	R	93.5	Very high	82	Confident	156 Å²	156	65.9 Å²	65.9	59%	0.589	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-9.9	176.4	-65.2	-176.1	179.2	162	2.4	113.1	R154 N190 K194	R154-R192 PolarHBondContact O-NH1 2.84Å; N190-R192 PolarHBondContact O-N 3.43Å; N190-R192 PolarHBondContact OD1-N 3.05Å; R192-K194 PolarHBondContact O-N 3.29Å
193	W	91.3	Very high	79.8	Confident	53 Å²	53	74.4 Å²	74.4	20%	0.201	36%	0.359	C	S	.	.			trans	-62	129.7	-178.8	-178.5	60.5	0	0	0	111.2	D90 D92 D116 S117 N190 P195	D90-W193 HydrophobicContact CB-CZ2 4.12Å; D92-W193 WeakPolarHBondContact OD1-CH2 3.32Å; D116-W193 VanDerWaalsContact O-CD1 3.3Å; S117-W193 PolarHBondContact O-NE1 3.12Å; N190-W193 HydrophobicContact CB-CB 3.78Å; N190-W193 PolarHBondContact OD1-N 2.98Å; N190-W193 VanDerWaalsContact OD1-N 3.13Å; W193-P195 HydrophobicContact CD2-CG 4.38Å; W193-P195 HydrophobicContact CE3-CG 4.18Å; W193-P195 HydrophobicContact CH2-CB 3.8Å; W193-P195 HydrophobicContact CH2-CG 3.69Å; W193-P195 HydrophobicContact CZ2-CB 3.65Å; W193-P195 HydrophobicContact CZ2-CG 3.95Å; W193-P195 HydrophobicContact CZ3-CB 4.43Å; W193-P195 HydrophobicContact CZ3-CG 3.84Å
194	K	86.2	Confident	77.6	Confident	171 Å²	171	83.4 Å²	83.4	74%	0.743	40%	0.397	S	S	*	.			trans	-127.4	95.8	178.8	-69.8	-179.2	-174.5	177.3	0	108	R192	R192-K194 PolarHBondContact O-N 3.29Å
195	P	80.6	Confident	75.5	Confident	11 Å²	11	88.5 Å²	88.5	7%	0.071	43%	0.427	C	S	.	.			trans	-60.4	144.3	-177.8	6.9	-12	0	0	0	111.1	D90 W193 W197 T198	D90-P195 WeakPolarHBondContact OD1-CA 3.12Å; W193-P195 HydrophobicContact CD2-CG 4.38Å; W193-P195 HydrophobicContact CE3-CG 4.18Å; W193-P195 HydrophobicContact CH2-CB 3.8Å; W193-P195 HydrophobicContact CH2-CG 3.69Å; W193-P195 HydrophobicContact CZ2-CB 3.65Å; W193-P195 HydrophobicContact CZ2-CG 3.95Å; W193-P195 HydrophobicContact CZ3-CB 4.43Å; W193-P195 HydrophobicContact CZ3-CG 3.84Å; P195-W197 HydrophobicContact CB-CD2 4.29Å; P195-W197 HydrophobicContact CB-CG 4.22Å; P195-W197 HydrophobicContact CB-CZ2 4.23Å; P195-W197 HydrophobicContact CG-CD2 4.42Å; P195-W197 HydrophobicContact CG-CH2 4.49Å; P195-W197 HydrophobicContact CG-CZ2 3.66Å; P195-W197 PolarHBondContact O-N 2.86Å; P195-W197 VanDerWaalsContact O-N 3.09Å; P195-T198 HydrophobicContact CG-CG2 3.8Å; P195-T198 WeakPolarHBondContact O-CB 3.39Å; P195-T198 PolarHBondContact O-N 3.07Å; P195-T198 PolarHBondContact O-OG1 2.66Å
196	S	78.1	Confident	73.2	Confident	58 Å²	58	93.6 Å²	93.6	41%	0.406	45%	0.452	S	S	.	.	H	α-helix	trans	-56.5	-31.4	-175.1	69.8	0	0	0	0	113.5	D90 T198 A199 H200	D90-S196 PolarHBondContact OD1-N 2.84Å; D90-S196 VanDerWaalsContact OD1-N 3.13Å; D90-S196 WeakPolarHBondContact OD2-CB 3.21Å; D90-S196 PolarHBondContact OD2-N 2.54Å; D90-S196 PolarHBondContact OD2-OG 2.67Å; S196-T198 PolarHBondContact O-N 2.87Å; S196-A199 WeakPolarHBondContact O-CB 3.43Å; S196-A199 PolarHBondContact O-N 3.14Å; S196-A199 VanDerWaalsContact O-N 3.15Å; S196-H200 PolarHBondContact O-CD2 3.47Å
197	W	69.7	Low	70.6	Confident	106 Å²	106	106.1 Å²	106.1	40%	0.402	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-20.6	175.6	60.9	-101	0	0	0	114.2	P195	P195-W197 HydrophobicContact CB-CD2 4.29Å; P195-W197 HydrophobicContact CB-CG 4.22Å; P195-W197 HydrophobicContact CB-CZ2 4.23Å; P195-W197 HydrophobicContact CG-CD2 4.42Å; P195-W197 HydrophobicContact CG-CH2 4.49Å; P195-W197 HydrophobicContact CG-CZ2 3.66Å; P195-W197 PolarHBondContact O-N 2.86Å; P195-W197 VanDerWaalsContact O-N 3.09Å
198	T	66.3	Low	69.3	Low	47 Å²	47	110.8 Å²	110.8	29%	0.288	53%	0.527	S	S	.	.	H	α-helix	trans	-73.5	-30	174.3	63.1	0	0	0	0	112.2	P195 S196 H200 K201	P195-T198 HydrophobicContact CG-CG2 3.8Å; P195-T198 WeakPolarHBondContact O-CB 3.39Å; P195-T198 PolarHBondContact O-N 3.07Å; P195-T198 PolarHBondContact O-OG1 2.66Å; S196-T198 PolarHBondContact O-N 2.87Å; T198-H200 VanDerWaalsContact C-N 3.33Å; T198-H200 PolarHBondContact O-N 3.35Å; T198-K201 PolarHBondContact O-N 3.02Å
199	A	59.1	Low	67.8	Low	60 Å²	60	116.3 Å²	116.3	50%	0.496	55%	0.554	S	S	.	*	H	α-helix	trans	-69.7	-30.2	178.1	0	0	0	0	0	112.5	S196 K201 H202	S196-A199 WeakPolarHBondContact O-CB 3.43Å; S196-A199 PolarHBondContact O-N 3.14Å; S196-A199 VanDerWaalsContact O-N 3.15Å; A199-K201 PolarHBondContact O-N 3.08Å; A199-H202 PolarHBondContact O-N 3.03Å
200	H	51.5	Low	66.2	Low	132 Å²	132	120 Å²	120	61%	0.611	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-68.6	-18.7	178.1	-70.1	-69.3	0	0	0	113.8	S196 T198 H202	S196-H200 PolarHBondContact O-CD2 3.47Å; T198-H200 VanDerWaalsContact C-N 3.33Å; T198-H200 PolarHBondContact O-N 3.35Å; H200-H202 VanDerWaalsContact C-N 3.3Å; H200-H202 PolarHBondContact O-N 3.41Å
201	K	47.9	Very low	64.4	Low	141 Å²	141	126.5 Å²	126.5	61%	0.613	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-71.5	-22.6	174.7	-72.5	-173.1	177.6	-179.7	0	113.4	T198 A199	T198-K201 PolarHBondContact O-N 3.02Å; A199-K201 PolarHBondContact O-N 3.08Å
202	H	45.8	Very low	62.5	Low	171 Å²	171	128.7 Å²	128.7	79%	0.792	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-91.1	-7.6	-178.4	-74.7	-66.7	0	0	0	114.7	A199 H200	A199-H202 PolarHBondContact O-N 3.03Å; H200-H202 VanDerWaalsContact C-N 3.3Å; H200-H202 PolarHBondContact O-N 3.41Å
203	K	46.6	Very low	60.4	Low	184 Å²	184	126.9 Å²	126.9	80%	0.8	60%	0.602	S	S	*	*	S	Bend	trans	-99.6	3.6	178.5	-74.4	-172.9	176	-178.9	0	114.5
204	K	45.2	Very low	58.2	Low	190 Å²	190	132.1 Å²	132.1	83%	0.826	63%	0.631	S	S	*	*	S	Bend	trans	-105.3	22.1	-177.1	-114.2	-177.7	-178	-179.4	0	115
205	L	49.5	Very low	56.1	Low	162 Å²	162	129.2 Å²	129.2	85%	0.848	62%	0.622	S	S	*	*			trans	-130.3	55.2	173.9	-100.6	128.9	0	0	0	110.7
206	I	47.3	Very low	54	Low	138 Å²	138	139 Å²	139	71%	0.708	67%	0.668	S	S	*	*			trans	-140.7	119.5	156.4	-51.9	-177.8	0	0	0	107.1
207	F	41.3	Very low	51.8	Low	279 Å²	279	146.4 Å²	146.4	100%	1.224	69%	0.692	S	S	*	*			trans	76.4	0	-173.9	-48	-65.7	0	0	0	116.9

Retrieved 207 of 207 residues in 267 ms (Link to these results)

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