A0A087XHC7_POEFO Loading...

Protein phosphatase 1L

Acts as a suppressor of the SAPK signaling pathways by associating with and dephosphorylating MAP3K7/TAK1 and MAP3K5, and by attenuating the association between MAP3K7/TAK1 and MAP2K4 or MAP2K6.

AlphaFold DB , UniProt , Accession A0A087XHC7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 363 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.3	Very low	60.4	Low	243 Å²	243	124.7 Å²	124.7	100%	1.197	70%	0.699	S	S	*	*				0	103.6	0	-70.4	-155.6	-68.8	0	0	108.1
2	I	39.9	Very low	61.5	Low	166 Å²	166	122.3 Å²	122.3	85%	0.851	68%	0.682	S	S	*	*			trans	-115.9	108.8	166.7	-62.9	171.6	0	0	0	103.7
3	G	45.8	Very low	62.3	Low	69 Å²	69	115.4 Å²	115.4	71%	0.711	66%	0.655	S	S	*	*			trans	-85.6	115.4	179.5	0	0	0	0	0	109.4	T5	G3-T5 PolarHBondContact O-N 2.73Å
4	D	54.1	Low	63.1	Low	136 Å²	136	118.4 Å²	118.4	73%	0.727	65%	0.651	S	S	*	*			trans	-66.4	107.6	172.8	-82	-21.7	0	0	0	110.1	M6	D4-M6 HydrophobicContact CB-CE 4.44Å; D4-M6 PolarHBondContact O-N 2.97Å; D4-M6 VanDerWaalsContact O-N 3.15Å
5	T	59.9	Low	63.8	Low	131 Å²	131	116.2 Å²	116.2	80%	0.804	64%	0.637	S	S	*	*			trans	-77.3	93	168	41.7	0	0	0	0	109.3	G3 T7	G3-T5 PolarHBondContact O-N 2.73Å; T5-T7 PolarHBondContact O-N 3.15Å; T5-T7 VanDerWaalsContact O-N 3.12Å
6	M	62	Low	64.1	Low	113 Å²	113	114.5 Å²	114.5	56%	0.557	62%	0.624	S	S	*	*			trans	-62.2	112.3	169.8	-73.6	-77.3	141.9	0	0	109.4	D4	D4-M6 HydrophobicContact CB-CE 4.44Å; D4-M6 PolarHBondContact O-N 2.97Å; D4-M6 VanDerWaalsContact O-N 3.15Å
7	T	76.1	Confident	64.3	Low	89 Å²	89	118.8 Å²	118.8	55%	0.546	63%	0.629	S	S	.	*			trans	-71.7	147.9	178.1	54.4	0	0	0	0	110.8	T5 L9 S10 L11	T5-T7 PolarHBondContact O-N 3.15Å; T5-T7 VanDerWaalsContact O-N 3.12Å; T7-L9 PolarHBondContact O-N 2.93Å; T7-S10 WeakPolarHBondContact O-CB 3.36Å; T7-S10 PolarHBondContact O-N 3.15Å; T7-S10 PolarHBondContact O-OG 3.12Å; T7-L11 PolarHBondContact O-N 3.25Å
8	L	68.1	Low	64.5	Low	136 Å²	136	120.3 Å²	120.3	71%	0.712	63%	0.626	S	S	*	*	H	α-helix	trans	-50.6	-34	177.9	-163	84.7	0	0	0	112.7	S10 L11 L12	L8-S10 VanDerWaalsContact C-N 3.34Å; L8-S10 PolarHBondContact O-N 3.24Å; L8-L11 PolarHBondContact O-N 2.97Å; L8-L12 HydrophobicContact CD2-CD1 4.45Å; L8-L12 HydrophobicContact CG-CD1 4.41Å; L8-L12 PolarHBondContact O-N 3.39Å
9	L	69.1	Low	64.7	Low	150 Å²	150	121 Å²	121	79%	0.785	62%	0.624	S	S	*	*	H	α-helix	trans	-63	-37.6	176.7	-137.1	87.5	0	0	0	112.6	T7 G13	T7-L9 PolarHBondContact O-N 2.93Å; L9-G13 PolarHBondContact O-N 3.47Å
10	S	73.3	Confident	64.6	Low	39 Å²	39	119.9 Å²	119.9	27%	0.273	62%	0.618	S	S	.	*	H	α-helix	trans	-70.9	-34.6	178	74.9	0	0	0	0	112.3	T7 L8 R14	T7-S10 WeakPolarHBondContact O-CB 3.36Å; T7-S10 PolarHBondContact O-N 3.15Å; T7-S10 PolarHBondContact O-OG 3.12Å; L8-S10 VanDerWaalsContact C-N 3.34Å; L8-S10 PolarHBondContact O-N 3.24Å; S10-R14 WeakPolarHBondContact O-CG 3.27Å; S10-R14 PolarHBondContact O-N 3.02Å; S10-R14 VanDerWaalsContact O-N 3.07Å
11	L	74.1	Confident	64.9	Low	100 Å²	100	118.6 Å²	118.6	52%	0.524	61%	0.612	S	S	.	*	H	α-helix	trans	-69.6	-46.7	175.9	-172.4	70.7	0	0	0	110.9	T7 L8 G13 R14 I15	T7-L11 PolarHBondContact O-N 3.25Å; L8-L11 PolarHBondContact O-N 2.97Å; L11-G13 VanDerWaalsContact C-N 3.35Å; L11-G13 PolarHBondContact O-N 3.1Å; L11-R14 PolarHBondContact O-N 2.86Å; L11-I15 HydrophobicContact CG-CD1 4.1Å; L11-I15 WeakPolarHBondContact O-CG1 3.45Å; L11-I15 PolarHBondContact O-N 3.19Å
12	L	73.5	Confident	66.7	Low	96 Å²	96	112 Å²	112	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-59	-44	173.5	-97.5	150.1	0	0	0	111.9	L8 R14 I15 M16	L8-L12 HydrophobicContact CD2-CD1 4.45Å; L8-L12 HydrophobicContact CG-CD1 4.41Å; L8-L12 PolarHBondContact O-N 3.39Å; L12-R14 VanDerWaalsContact C-N 3.31Å; L12-R14 PolarHBondContact O-N 2.81Å; L12-I15 PolarHBondContact O-N 3.04Å; L12-M16 VanDerWaalsContact O-CB 3.31Å; L12-M16 WeakPolarHBondContact O-CB 3.44Å; L12-M16 VanDerWaalsContact O-CG 3.26Å; L12-M16 WeakPolarHBondContact O-CG 3.49Å; L12-M16 PolarHBondContact O-N 3.15Å
13	G	72.2	Confident	68.5	Low	32 Å²	32	108.7 Å²	108.7	33%	0.33	56%	0.564	S	S	.	*	H	α-helix	trans	-61.9	-35.4	176.1	0	0	0	0	0	113.5	L9 L11 R17	L9-G13 PolarHBondContact O-N 3.47Å; L11-G13 VanDerWaalsContact C-N 3.35Å; L11-G13 PolarHBondContact O-N 3.1Å; G13-R17 WeakPolarHBondContact O-CG 3.45Å; G13-R17 PolarHBondContact O-N 3.28Å
14	R	73.7	Confident	70.2	Confident	158 Å²	158	111.1 Å²	111.1	60%	0.596	56%	0.556	S	S	*	*	H	α-helix	trans	-72.6	-42.3	175.4	-76.2	177.2	-179.9	178.5	2.3	112.2	S10 L11 L12 R17 Y18	S10-R14 WeakPolarHBondContact O-CG 3.27Å; S10-R14 PolarHBondContact O-N 3.02Å; S10-R14 VanDerWaalsContact O-N 3.07Å; L11-R14 PolarHBondContact O-N 2.86Å; L12-R14 VanDerWaalsContact C-N 3.31Å; L12-R14 PolarHBondContact O-N 2.81Å; R14-R17 PolarHBondContact O-N 2.94Å; R14-Y18 WeakPolarHBondContact O-CB 3.45Å; R14-Y18 PolarHBondContact O-N 3.21Å
15	I	72.6	Confident	71.4	Confident	85 Å²	85	107.3 Å²	107.3	44%	0.436	54%	0.538	S	S	.	.	H	α-helix	trans	-63.3	-46.2	177	-67.5	167.4	0	0	0	110.6	L11 L12 R17 Y18 F19	L11-I15 HydrophobicContact CG-CD1 4.1Å; L11-I15 WeakPolarHBondContact O-CG1 3.45Å; L11-I15 PolarHBondContact O-N 3.19Å; L12-I15 PolarHBondContact O-N 3.04Å; I15-R17 VanDerWaalsContact C-N 3.34Å; I15-R17 PolarHBondContact O-N 3.23Å; I15-Y18 PolarHBondContact O-N 2.97Å; I15-Y18 VanDerWaalsContact O-N 3.16Å; I15-F19 HydrophobicContact CG2-CD2 4Å; I15-F19 PolarHBondContact O-N 2.88Å
16	M	69.4	Low	72.4	Confident	89 Å²	89	104.6 Å²	104.6	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-53.2	-48.5	173.4	-81.2	-79.7	-41	0	0	111.9	L12 L20 L21	L12-M16 VanDerWaalsContact O-CB 3.31Å; L12-M16 WeakPolarHBondContact O-CB 3.44Å; L12-M16 VanDerWaalsContact O-CG 3.26Å; L12-M16 WeakPolarHBondContact O-CG 3.49Å; L12-M16 PolarHBondContact O-N 3.15Å; M16-L20 HydrophobicContact CE-CB 4.49Å; M16-L20 HydrophobicContact CE-CD1 3.98Å; M16-L20 WeakPolarHBondContact O-CB 3.4Å; M16-L20 PolarHBondContact O-N 2.85Å; M16-L20 HydrophobicContact SD-CD1 3.54Å; M16-L20 VanDerWaalsContact SD-CD1 3.54Å; M16-L21 PolarHBondContact O-N 3.13Å
17	R	67.8	Low	73.4	Confident	188 Å²	188	105.6 Å²	105.6	71%	0.709	52%	0.52	S	S	*	.	H	α-helix	trans	-65.6	-38.6	177.5	-75.6	-178.5	-159.2	-172.5	5.5	113	G13 R14 I15 L21	G13-R17 WeakPolarHBondContact O-CG 3.45Å; G13-R17 PolarHBondContact O-N 3.28Å; R14-R17 PolarHBondContact O-N 2.94Å; I15-R17 VanDerWaalsContact C-N 3.34Å; I15-R17 PolarHBondContact O-N 3.23Å; R17-L21 HydrophobicContact CG-CD1 3.9Å
18	Y	67.9	Low	73.7	Confident	146 Å²	146	107 Å²	107	57%	0.573	52%	0.523	S	S	*	.	H	α-helix	trans	-78	-27.4	-173	-153.7	-101.1	0	0	0	113.6	R14 I15 R22	R14-Y18 WeakPolarHBondContact O-CB 3.45Å; R14-Y18 PolarHBondContact O-N 3.21Å; I15-Y18 PolarHBondContact O-N 2.97Å; I15-Y18 VanDerWaalsContact O-N 3.16Å; Y18-R22 VanDerWaalsContact CZ-NH2 3.32Å; Y18-R22 WeakPolarHBondContact O-CG 3.5Å; Y18-R22 PolarHBondContact O-NE 2.85Å
19	F	67.1	Low	74.4	Confident	133 Å²	133	105 Å²	105	58%	0.583	51%	0.513	S	S	*	.	H	α-helix	trans	-112.8	-39.1	-176.3	-71.3	-80.3	0	0	0	114.3	I15 T25	I15-F19 HydrophobicContact CG2-CD2 4Å; I15-F19 PolarHBondContact O-N 2.88Å; F19-T25 PolarHBondContact O-OG1 2.77Å
20	L	63.5	Low	75.2	Confident	98 Å²	98	101.7 Å²	101.7	51%	0.513	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-25.4	-172.1	-72.4	163.6	0	0	0	114	M16	M16-L20 HydrophobicContact CE-CB 4.49Å; M16-L20 HydrophobicContact CE-CD1 3.98Å; M16-L20 WeakPolarHBondContact O-CB 3.4Å; M16-L20 PolarHBondContact O-N 2.85Å; M16-L20 HydrophobicContact SD-CD1 3.54Å; M16-L20 VanDerWaalsContact SD-CD1 3.54Å
21	L	71.1	Confident	75.9	Confident	94 Å²	94	103.2 Å²	103.2	49%	0.492	51%	0.505	S	S	.	.	S	Bend	trans	-103.5	15	-177.7	-63.8	168.7	0	0	0	113.5	M16 R17 L26	M16-L21 PolarHBondContact O-N 3.13Å; R17-L21 HydrophobicContact CG-CD1 3.9Å; L21-L26 HydrophobicContact CD2-CD1 4.5Å
22	R	78.6	Confident	76.3	Confident	104 Å²	104	101.2 Å²	101.2	39%	0.392	50%	0.5	S	S	.	.			trans	-67.5	137	169.7	-73.8	-165.6	-173.5	-167.5	-1.2	109.7	Y18 E24 T25 L26	Y18-R22 VanDerWaalsContact CZ-NH2 3.32Å; Y18-R22 WeakPolarHBondContact O-CG 3.5Å; Y18-R22 PolarHBondContact O-NE 2.85Å; R22-E24 WeakPolarHBondContact CB-OE2 3.49Å; R22-E24 PolarHBondContact O-N 3.09Å; R22-E24 VanDerWaalsContact O-N 3.14Å; R22-T25 PolarHBondContact O-N 2.91Å; R22-T25 VanDerWaalsContact O-N 3.09Å; R22-L26 PolarHBondContact O-N 3.22Å
23	P	78.9	Confident	76.8	Confident	97 Å²	97	101 Å²	101	63%	0.63	50%	0.499	S	S	*	.	H	α-helix	trans	-51.9	-37.4	178.9	-26.2	34	0	0	0	112.9	F27	P23-F27 VanDerWaalsContact O-CB 3.22Å; P23-F27 WeakPolarHBondContact O-CB 3.39Å; P23-F27 PolarHBondContact O-N 3.24Å
24	E	81.6	Confident	77.2	Confident	119 Å²	119	102.4 Å²	102.4	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-69.9	-41.4	-179.2	-54.7	78.8	-172.9	0	0	112	R22 F27 L28	R22-E24 WeakPolarHBondContact CB-OE2 3.49Å; R22-E24 PolarHBondContact O-N 3.09Å; R22-E24 VanDerWaalsContact O-N 3.14Å; E24-F27 PolarHBondContact O-N 3.46Å; E24-L28 WeakPolarHBondContact O-CB 3.16Å; E24-L28 WeakPolarHBondContact O-CG 3.11Å; E24-L28 PolarHBondContact O-N 2.94Å
25	T	78.6	Confident	77.3	Confident	56 Å²	56	99 Å²	99	34%	0.344	50%	0.5	S	S	.	.	H	α-helix	trans	-66.3	-42.5	177.3	-48.4	0	0	0	0	110.8	F19 R22 F27 L28 L29	F19-T25 PolarHBondContact O-OG1 2.77Å; R22-T25 PolarHBondContact O-N 2.91Å; R22-T25 VanDerWaalsContact O-N 3.09Å; T25-F27 VanDerWaalsContact C-N 3.35Å; T25-L28 PolarHBondContact O-N 2.91Å; T25-L29 WeakPolarHBondContact O-CB 3.41Å; T25-L29 PolarHBondContact O-N 3.07Å
26	L	80.7	Confident	77.5	Confident	74 Å²	74	102.4 Å²	102.4	39%	0.387	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-40.9	176.2	-69.1	171.4	0	0	0	111.2	L21 R22 L29 C30	L21-L26 HydrophobicContact CD2-CD1 4.5Å; R22-L26 PolarHBondContact O-N 3.22Å; L26-L29 PolarHBondContact O-N 3.05Å; L26-C30 PolarHBondContact O-N 3.38Å; L26-C30 PolarHBondContact O-SG 3.03Å
27	F	83.6	Confident	77.9	Confident	134 Å²	134	100.9 Å²	100.9	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-64.1	-44.9	177.1	-175.8	-108.6	0	0	0	112.5	P23 E24 T25 L29 C30 I31	P23-F27 VanDerWaalsContact O-CB 3.22Å; P23-F27 WeakPolarHBondContact O-CB 3.39Å; P23-F27 PolarHBondContact O-N 3.24Å; E24-F27 PolarHBondContact O-N 3.46Å; T25-F27 VanDerWaalsContact C-N 3.35Å; F27-L29 VanDerWaalsContact C-N 3.34Å; F27-L29 PolarHBondContact O-N 3.36Å; F27-C30 PolarHBondContact O-N 3.3Å; F27-I31 HydrophobicContact CD1-CD1 3.74Å; F27-I31 HydrophobicContact CE1-CD1 3.28Å; F27-I31 HydrophobicContact CE1-CG1 4.32Å; F27-I31 HydrophobicContact CE2-CD1 4.34Å; F27-I31 HydrophobicContact CG-CD1 4.46Å; F27-I31 HydrophobicContact CZ-CD1 3.62Å; F27-I31 HydrophobicContact CZ-CG1 4.35Å; F27-I31 WeakPolarHBondContact O-CG1 3.38Å; F27-I31 PolarHBondContact O-N 2.85Å
28	L	82.6	Confident	78.2	Confident	118 Å²	118	99.3 Å²	99.3	62%	0.618	50%	0.501	S	S	*	.	H	α-helix	trans	-62.5	-40.5	175.1	-76.6	170.1	0	0	0	112	E24 T25 I31 S32	E24-L28 WeakPolarHBondContact O-CB 3.16Å; E24-L28 WeakPolarHBondContact O-CG 3.11Å; E24-L28 PolarHBondContact O-N 2.94Å; T25-L28 PolarHBondContact O-N 2.91Å; L28-I31 PolarHBondContact O-N 2.82Å; L28-S32 PolarHBondContact O-N 3.28Å; L28-S32 PolarHBondContact O-OG 2.91Å
29	L	83.3	Confident	78.2	Confident	96 Å²	96	97.8 Å²	97.8	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-61.8	-45.9	174.8	-176.7	67.4	0	0	0	110.8	T25 L26 F27 I31 S32 L33	T25-L29 WeakPolarHBondContact O-CB 3.41Å; T25-L29 PolarHBondContact O-N 3.07Å; L26-L29 PolarHBondContact O-N 3.05Å; F27-L29 VanDerWaalsContact C-N 3.34Å; F27-L29 PolarHBondContact O-N 3.36Å; L29-I31 PolarHBondContact O-N 2.86Å; L29-S32 WeakPolarHBondContact CA-OG 3.31Å; L29-S32 PolarHBondContact O-N 3.25Å; L29-S32 PolarHBondContact O-OG 2.75Å; L29-L33 HydrophobicContact CD1-CD1 4.47Å; L29-L33 HydrophobicContact CG-CD1 4.13Å; L29-L33 WeakPolarHBondContact O-CB 3.34Å; L29-L33 WeakPolarHBondContact O-CG 3.41Å; L29-L33 PolarHBondContact O-N 3.17Å
30	C	86.3	Confident	78	Confident	80 Å²	80	96.7 Å²	96.7	54%	0.541	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-42.9	175.7	-71.7	0	0	0	0	112.4	L26 F27 L33 A34	L26-C30 PolarHBondContact O-N 3.38Å; L26-C30 PolarHBondContact O-SG 3.03Å; F27-C30 PolarHBondContact O-N 3.3Å; C30-L33 PolarHBondContact O-N 3.08Å; C30-A34 VanDerWaalsContact O-CB 3.3Å; C30-A34 WeakPolarHBondContact O-CB 3.35Å; C30-A34 PolarHBondContact O-N 3.3Å
31	I	87.2	Confident	78	Confident	70 Å²	70	97.8 Å²	97.8	36%	0.359	50%	0.495	S	S	.	.	H	α-helix	trans	-62.7	-46	175	-71	173.4	0	0	0	110.7	F27 L28 L29 L33 A34 L35	F27-I31 HydrophobicContact CD1-CD1 3.74Å; F27-I31 HydrophobicContact CE1-CD1 3.28Å; F27-I31 HydrophobicContact CE1-CG1 4.32Å; F27-I31 HydrophobicContact CE2-CD1 4.34Å; F27-I31 HydrophobicContact CG-CD1 4.46Å; F27-I31 HydrophobicContact CZ-CD1 3.62Å; F27-I31 HydrophobicContact CZ-CG1 4.35Å; F27-I31 WeakPolarHBondContact O-CG1 3.38Å; F27-I31 PolarHBondContact O-N 2.85Å; L28-I31 PolarHBondContact O-N 2.82Å; L29-I31 PolarHBondContact O-N 2.86Å; I31-L33 VanDerWaalsContact C-N 3.29Å; I31-L33 PolarHBondContact O-N 2.78Å; I31-A34 PolarHBondContact O-N 2.94Å; I31-L35 HydrophobicContact CG2-CD1 3.77Å; I31-L35 HydrophobicContact CG2-CG 4.17Å; I31-L35 WeakPolarHBondContact O-CB 3.48Å; I31-L35 WeakPolarHBondContact O-CG 3.42Å; I31-L35 PolarHBondContact O-N 2.99Å
32	S	82.3	Confident	77.6	Confident	58 Å²	58	95.1 Å²	95.1	41%	0.406	48%	0.483	S	S	.	.	H	α-helix	trans	-62.2	-37.7	178.8	66.9	0	0	0	0	112.4	L28 L29 W36	L28-S32 PolarHBondContact O-N 3.28Å; L28-S32 PolarHBondContact O-OG 2.91Å; L29-S32 WeakPolarHBondContact CA-OG 3.31Å; L29-S32 PolarHBondContact O-N 3.25Å; L29-S32 PolarHBondContact O-OG 2.75Å; S32-W36 WeakPolarHBondContact O-CB 3.41Å; S32-W36 PolarHBondContact O-N 2.83Å
33	L	84.1	Confident	76.7	Confident	93 Å²	93	96 Å²	96	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-71.7	-36.2	176.7	-72.7	171.7	0	0	0	111.6	L29 C30 I31 S37	L29-L33 HydrophobicContact CD1-CD1 4.47Å; L29-L33 HydrophobicContact CG-CD1 4.13Å; L29-L33 WeakPolarHBondContact O-CB 3.34Å; L29-L33 WeakPolarHBondContact O-CG 3.41Å; L29-L33 PolarHBondContact O-N 3.17Å; C30-L33 PolarHBondContact O-N 3.08Å; I31-L33 VanDerWaalsContact C-N 3.29Å; I31-L33 PolarHBondContact O-N 2.78Å; L33-S37 WeakPolarHBondContact O-CB 3.22Å; L33-S37 PolarHBondContact O-N 3.09Å
34	A	79.7	Confident	75.8	Confident	61 Å²	61	98.8 Å²	98.8	50%	0.504	50%	0.5	S	S	.	.	H	α-helix	trans	-68.7	-42	174.9	0	0	0	0	0	111.8	C30 I31 S37 Y38	C30-A34 VanDerWaalsContact O-CB 3.3Å; C30-A34 WeakPolarHBondContact O-CB 3.35Å; C30-A34 PolarHBondContact O-N 3.3Å; I31-A34 PolarHBondContact O-N 2.94Å; A34-S37 PolarHBondContact O-N 2.71Å; A34-Y38 VanDerWaalsContact O-CB 3.25Å; A34-Y38 WeakPolarHBondContact O-CB 3.39Å; A34-Y38 PolarHBondContact O-N 3.15Å
35	L	76.6	Confident	74.8	Confident	86 Å²	86	95.1 Å²	95.1	45%	0.45	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-44.4	173.4	-71.6	173.9	0	0	0	110.9	I31 S37 Y38 F39	I31-L35 HydrophobicContact CG2-CD1 3.77Å; I31-L35 HydrophobicContact CG2-CG 4.17Å; I31-L35 WeakPolarHBondContact O-CB 3.48Å; I31-L35 WeakPolarHBondContact O-CG 3.42Å; I31-L35 PolarHBondContact O-N 2.99Å; L35-S37 PolarHBondContact O-N 3.09Å; L35-Y38 PolarHBondContact O-N 3Å; L35-F39 HydrophobicContact CB-CD2 4.26Å; L35-F39 HydrophobicContact CB-CE2 4.34Å; L35-F39 HydrophobicContact CD2-CE2 4.17Å; L35-F39 WeakPolarHBondContact O-CB 3.31Å; L35-F39 WeakPolarHBondContact O-CD2 3.41Å; L35-F39 PolarHBondContact O-N 3.44Å
36	W	77.9	Confident	73.8	Confident	157 Å²	157	96.7 Å²	96.7	60%	0.595	49%	0.488	S	S	*	.	H	α-helix	trans	-60.4	-45.5	174.5	-177.4	76.3	0	0	0	111.1	S32 F40	S32-W36 WeakPolarHBondContact O-CB 3.41Å; S32-W36 PolarHBondContact O-N 2.83Å; W36-F40 AromaticContact CD1-CD2 3.33Å; W36-F40 AromaticContact CD1-CE2 3.36Å; W36-F40 HydrophobicContact CD2-CD2 4.44Å; W36-F40 AromaticContact CG-CD2 3.98Å; W36-F40 HydrophobicContact CG-CD2 3.98Å; W36-F40 HydrophobicContact CG-CE2 4.38Å; W36-F40 AromaticContact NE1-CD2 3.4Å; W36-F40 AromaticContact NE1-CE2 3.43Å; W36-F40 VanDerWaalsContact O-CB 3.29Å; W36-F40 WeakPolarHBondContact O-CB 3.42Å; W36-F40 VanDerWaalsContact O-CD2 3.29Å; W36-F40 WeakPolarHBondContact O-CD2 3.42Å; W36-F40 PolarHBondContact O-N 3.26Å
37	S	75.9	Confident	72.9	Confident	57 Å²	57	97.5 Å²	97.5	40%	0.399	50%	0.496	S	S	.	.	H	α-helix	trans	-60.1	-47.8	173.8	-178.4	0	0	0	0	111.3	L33 A34 L35 F40 H41	L33-S37 WeakPolarHBondContact O-CB 3.22Å; L33-S37 PolarHBondContact O-N 3.09Å; A34-S37 PolarHBondContact O-N 2.71Å; L35-S37 PolarHBondContact O-N 3.09Å; S37-F40 PolarHBondContact O-N 3.49Å; S37-H41 WeakPolarHBondContact O-CA 3.49Å; S37-H41 WeakPolarHBondContact O-CB 3.3Å; S37-H41 PolarHBondContact O-N 3.32Å
38	Y	75.6	Confident	71.8	Confident	154 Å²	154	96.2 Å²	96.2	60%	0.604	49%	0.494	S	S	*	.	H	α-helix	trans	-60.4	-54.3	178.9	-179.1	-101.2	0	0	0	111.9	A34 L35 F40 H41 T42	A34-Y38 VanDerWaalsContact O-CB 3.25Å; A34-Y38 WeakPolarHBondContact O-CB 3.39Å; A34-Y38 PolarHBondContact O-N 3.15Å; L35-Y38 PolarHBondContact O-N 3Å; Y38-F40 VanDerWaalsContact C-N 3.33Å; Y38-F40 PolarHBondContact O-N 3.35Å; Y38-H41 PolarHBondContact O-N 2.9Å; Y38-T42 HydrophobicContact CD2-CG2 4.43Å; Y38-T42 HydrophobicContact CE1-CG2 4.37Å; Y38-T42 HydrophobicContact CE2-CG2 4.2Å; Y38-T42 VanDerWaalsContact O-CG2 3.25Å; Y38-T42 WeakPolarHBondContact O-CG2 3.41Å; Y38-T42 PolarHBondContact O-N 2.46Å; Y38-T42 PolarHBondContact O-OG1 2.85Å
39	F	68.3	Low	70.8	Confident	115 Å²	115	94.4 Å²	94.4	50%	0.504	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-33.9	-179.6	-77.1	-65.3	0	0	0	113.1	L35 T42 V45	L35-F39 HydrophobicContact CB-CD2 4.26Å; L35-F39 HydrophobicContact CB-CE2 4.34Å; L35-F39 HydrophobicContact CD2-CE2 4.17Å; L35-F39 WeakPolarHBondContact O-CB 3.31Å; L35-F39 WeakPolarHBondContact O-CD2 3.41Å; L35-F39 PolarHBondContact O-N 3.44Å; F39-T42 PolarHBondContact O-OG1 3.46Å; F39-V45 WeakPolarHBondContact O-CB 3.19Å; F39-V45 WeakPolarHBondContact O-CG1 3.32Å; F39-V45 VanDerWaalsContact O-CG2 3.25Å; F39-V45 WeakPolarHBondContact O-CG2 3.19Å
40	F	62.4	Low	69.9	Low	109 Å²	109	96.1 Å²	96.1	48%	0.478	49%	0.491	S	S	.	.	H	α-helix	trans	-95.4	-5	179.8	-73.7	-88.4	0	0	0	113.8	W36 S37 Y38 K46	W36-F40 AromaticContact CD1-CD2 3.33Å; W36-F40 AromaticContact CD1-CE2 3.36Å; W36-F40 HydrophobicContact CD2-CD2 4.44Å; W36-F40 AromaticContact CG-CD2 3.98Å; W36-F40 HydrophobicContact CG-CD2 3.98Å; W36-F40 HydrophobicContact CG-CE2 4.38Å; W36-F40 AromaticContact NE1-CD2 3.4Å; W36-F40 AromaticContact NE1-CE2 3.43Å; W36-F40 VanDerWaalsContact O-CB 3.29Å; W36-F40 WeakPolarHBondContact O-CB 3.42Å; W36-F40 VanDerWaalsContact O-CD2 3.29Å; W36-F40 WeakPolarHBondContact O-CD2 3.42Å; W36-F40 PolarHBondContact O-N 3.26Å; S37-F40 PolarHBondContact O-N 3.49Å; Y38-F40 VanDerWaalsContact C-N 3.33Å; Y38-F40 PolarHBondContact O-N 3.35Å; F40-K46 VanDerWaalsContact O-CE 3.23Å; F40-K46 WeakPolarHBondContact O-CE 3.48Å; F40-K46 WeakPolarHBondContact O-CG 3.4Å
41	H	63.8	Low	68.5	Low	121 Å²	121	95.9 Å²	95.9	56%	0.56	49%	0.491	S	S	*	.	H	α-helix	trans	-108.8	-11.6	173.5	-79.4	33.3	0	0	0	115.2	S37 Y38 D43 K46	S37-H41 WeakPolarHBondContact O-CA 3.49Å; S37-H41 WeakPolarHBondContact O-CB 3.3Å; S37-H41 PolarHBondContact O-N 3.32Å; Y38-H41 PolarHBondContact O-N 2.9Å; H41-D43 PolarHBondContact O-N 3.26Å; H41-K46 PolarHBondContact O-NZ 3.12Å
42	T	61.9	Low	67	Low	38 Å²	38	95.7 Å²	95.7	23%	0.233	50%	0.495	C	S	.	.	S	Bend	trans	-60.2	129.4	166.6	48.4	0	0	0	0	109.7	Y38 F39 E44 V45 K46	Y38-T42 HydrophobicContact CD2-CG2 4.43Å; Y38-T42 HydrophobicContact CE1-CG2 4.37Å; Y38-T42 HydrophobicContact CE2-CG2 4.2Å; Y38-T42 VanDerWaalsContact O-CG2 3.25Å; Y38-T42 WeakPolarHBondContact O-CG2 3.41Å; Y38-T42 PolarHBondContact O-N 2.46Å; Y38-T42 PolarHBondContact O-OG1 2.85Å; F39-T42 PolarHBondContact O-OG1 3.46Å; T42-E44 PolarHBondContact O-N 2.92Å; T42-E44 VanDerWaalsContact O-N 3.16Å; T42-V45 PolarHBondContact O-N 3.22Å; T42-V45 VanDerWaalsContact O-N 3.17Å; T42-V45 WeakPolarHBondContact OG1-CG2 3.38Å; T42-K46 PolarHBondContact O-N 3.5Å; T42-K46 VanDerWaalsContact O-N 3.14Å
43	D	60.5	Low	66	Low	122 Å²	122	99.9 Å²	99.9	65%	0.652	50%	0.502	S	S	*	.	H	α-helix	trans	-60.4	-27.1	-177.2	-70.5	-39.8	0	0	0	111.9	H41 T47	H41-D43 PolarHBondContact O-N 3.26Å; D43-T47 WeakPolarHBondContact O-CB 3.19Å; D43-T47 PolarHBondContact O-N 3.13Å; D43-T47 PolarHBondContact O-OG1 3.16Å
44	E	60.1	Low	65.1	Low	156 Å²	156	98.4 Å²	98.4	73%	0.729	50%	0.495	S	S	*	.	H	α-helix	trans	-64.1	-48.6	174.6	-67.3	-177.4	170	0	0	112.5	T42 T47 I48	T42-E44 PolarHBondContact O-N 2.92Å; T42-E44 VanDerWaalsContact O-N 3.16Å; E44-T47 PolarHBondContact O-N 3.2Å; E44-I48 VanDerWaalsContact O-CG1 3.25Å; E44-I48 WeakPolarHBondContact O-CG1 3.34Å; E44-I48 PolarHBondContact O-N 2.93Å
45	V	59.9	Low	63.9	Low	43 Å²	43	97.8 Å²	97.8	26%	0.261	49%	0.49	S	S	.	.	H	α-helix	trans	-70.8	-38	179.8	178.2	0	0	0	0	110.8	F39 T42 T47 I48 V49	F39-V45 WeakPolarHBondContact O-CB 3.19Å; F39-V45 WeakPolarHBondContact O-CG1 3.32Å; F39-V45 VanDerWaalsContact O-CG2 3.25Å; F39-V45 WeakPolarHBondContact O-CG2 3.19Å; T42-V45 PolarHBondContact O-N 3.22Å; T42-V45 VanDerWaalsContact O-N 3.17Å; T42-V45 WeakPolarHBondContact OG1-CG2 3.38Å; V45-T47 VanDerWaalsContact C-N 3.28Å; V45-T47 PolarHBondContact O-N 3.14Å; V45-I48 PolarHBondContact O-N 2.91Å; V45-V49 HydrophobicContact CG1-CG2 4.16Å; V45-V49 WeakPolarHBondContact O-CB 3.35Å; V45-V49 VanDerWaalsContact O-CG2 3.27Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 3.05Å
46	K	58.3	Low	63	Low	88 Å²	88	97.5 Å²	97.5	38%	0.383	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-39.7	171.5	-77	172.9	172	157	0	111.7	F40 H41 T42 K50	F40-K46 VanDerWaalsContact O-CE 3.23Å; F40-K46 WeakPolarHBondContact O-CE 3.48Å; F40-K46 WeakPolarHBondContact O-CG 3.4Å; H41-K46 PolarHBondContact O-NZ 3.12Å; T42-K46 PolarHBondContact O-N 3.5Å; T42-K46 VanDerWaalsContact O-N 3.14Å; K46-K50 WeakPolarHBondContact O-CB 3.48Å; K46-K50 PolarHBondContact O-N 3.09Å
47	T	60.5	Low	62.2	Low	92 Å²	92	95.9 Å²	95.9	56%	0.564	49%	0.488	S	S	*	.	H	α-helix	trans	-68.6	-42.4	177.2	-59	0	0	0	0	111.2	D43 E44 V45 K50 S51	D43-T47 WeakPolarHBondContact O-CB 3.19Å; D43-T47 PolarHBondContact O-N 3.13Å; D43-T47 PolarHBondContact O-OG1 3.16Å; E44-T47 PolarHBondContact O-N 3.2Å; V45-T47 VanDerWaalsContact C-N 3.28Å; V45-T47 PolarHBondContact O-N 3.14Å; T47-K50 PolarHBondContact O-N 3.38Å; T47-S51 WeakPolarHBondContact O-CB 3.35Å; T47-S51 PolarHBondContact O-N 3.49Å
48	I	59.7	Low	61.4	Low	107 Å²	107	98.6 Å²	98.6	55%	0.549	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-51.2	175.5	-67.9	163	0	0	0	110.4	E44 V45 K50 S51 S52	E44-I48 VanDerWaalsContact O-CG1 3.25Å; E44-I48 WeakPolarHBondContact O-CG1 3.34Å; E44-I48 PolarHBondContact O-N 2.93Å; V45-I48 PolarHBondContact O-N 2.91Å; I48-K50 VanDerWaalsContact C-N 3.33Å; I48-K50 PolarHBondContact O-N 3.08Å; I48-S51 PolarHBondContact O-N 2.7Å; I48-S52 WeakPolarHBondContact O-CB 3.49Å; I48-S52 PolarHBondContact O-N 3.31Å; I48-S52 PolarHBondContact O-OG 3.3Å
49	V	61.7	Low	60.4	Low	79 Å²	79	95.1 Å²	95.1	48%	0.479	49%	0.491	S	S	.	.	H	α-helix	trans	-62.6	-40.1	179.2	172.2	0	0	0	0	111.3	V45 R53	V45-V49 HydrophobicContact CG1-CG2 4.16Å; V45-V49 WeakPolarHBondContact O-CB 3.35Å; V45-V49 VanDerWaalsContact O-CG2 3.27Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 3.05Å; V49-R53 WeakPolarHBondContact O-CB 3.44Å; V49-R53 PolarHBondContact O-N 2.8Å
50	K	64.9	Low	59.8	Low	132 Å²	132	96.9 Å²	96.9	57%	0.574	50%	0.498	S	S	*	.	H	α-helix	trans	-64.7	-47.1	175.4	-176.2	179.6	176.9	-170.6	0	111	K46 T47 I48 R53 D54	K46-K50 WeakPolarHBondContact O-CB 3.48Å; K46-K50 PolarHBondContact O-N 3.09Å; T47-K50 PolarHBondContact O-N 3.38Å; I48-K50 VanDerWaalsContact C-N 3.33Å; I48-K50 PolarHBondContact O-N 3.08Å; K50-R53 PolarHBondContact O-N 2.85Å; K50-D54 WeakPolarHBondContact CG-OD2 3.22Å; K50-D54 VanDerWaalsContact O-CB 3.27Å; K50-D54 WeakPolarHBondContact O-CB 3.47Å; K50-D54 PolarHBondContact O-N 3.44Å
51	S	57.3	Low	59.6	Low	76 Å²	76	93.4 Å²	93.4	53%	0.531	49%	0.493	S	S	.	.	H	α-helix	trans	-59.6	-46.5	176.5	-177.9	0	0	0	0	111.7	T47 I48 R53 D54 A55	T47-S51 WeakPolarHBondContact O-CB 3.35Å; T47-S51 PolarHBondContact O-N 3.49Å; I48-S51 PolarHBondContact O-N 2.7Å; S51-R53 PolarHBondContact O-N 2.94Å; S51-D54 PolarHBondContact O-N 3.4Å; S51-A55 VanDerWaalsContact O-CB 3.29Å; S51-A55 WeakPolarHBondContact O-CB 3.4Å; S51-A55 PolarHBondContact O-N 2.66Å
52	S	55	Low	59.1	Low	66 Å²	66	91.1 Å²	91.1	46%	0.462	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-41.7	174.7	-56.8	0	0	0	0	112.2	I48 A55 V56	I48-S52 WeakPolarHBondContact O-CB 3.49Å; I48-S52 PolarHBondContact O-N 3.31Å; I48-S52 PolarHBondContact O-OG 3.3Å; S52-A55 PolarHBondContact O-N 3.27Å; S52-V56 VanDerWaalsContact O-CG2 3.28Å; S52-V56 WeakPolarHBondContact O-CG2 3.39Å; S52-V56 PolarHBondContact O-N 2.83Å
53	R	62.2	Low	58.7	Low	145 Å²	145	92.8 Å²	92.8	55%	0.547	49%	0.492	S	S	.	.	H	α-helix	trans	-67.5	-39.9	178.2	-167.3	-178.1	82	160.8	1.9	111.8	V49 K50 S51 V56 K57	V49-R53 WeakPolarHBondContact O-CB 3.44Å; V49-R53 PolarHBondContact O-N 2.8Å; K50-R53 PolarHBondContact O-N 2.85Å; S51-R53 PolarHBondContact O-N 2.94Å; R53-V56 PolarHBondContact O-N 3.16Å; R53-K57 WeakPolarHBondContact O-CB 3.49Å; R53-K57 WeakPolarHBondContact O-CG 3.49Å; R53-K57 PolarHBondContact O-N 3.13Å
54	D	64.7	Low	58.4	Low	63 Å²	63	89.6 Å²	89.6	34%	0.337	48%	0.482	S	S	.	.	H	α-helix	trans	-71.1	-37.2	179.3	-67.8	-14.7	0	0	0	110.2	K50 S51 K57 M58	K50-D54 WeakPolarHBondContact CG-OD2 3.22Å; K50-D54 VanDerWaalsContact O-CB 3.27Å; K50-D54 WeakPolarHBondContact O-CB 3.47Å; K50-D54 PolarHBondContact O-N 3.44Å; S51-D54 PolarHBondContact O-N 3.4Å; D54-K57 PolarHBondContact O-N 3.29Å; D54-M58 VanDerWaalsContact O-CB 3.31Å; D54-M58 WeakPolarHBondContact O-CB 3.46Å; D54-M58 PolarHBondContact O-N 2.89Å
55	A	54.9	Low	58.2	Low	48 Å²	48	87.8 Å²	87.8	40%	0.397	47%	0.474	S	S	.	.	H	α-helix	trans	-61	-47.3	169.3	0	0	0	0	0	112	S51 S52 K57 M58 V59	S51-A55 VanDerWaalsContact O-CB 3.29Å; S51-A55 WeakPolarHBondContact O-CB 3.4Å; S51-A55 PolarHBondContact O-N 2.66Å; S52-A55 PolarHBondContact O-N 3.27Å; A55-K57 VanDerWaalsContact C-N 3.33Å; A55-K57 PolarHBondContact O-N 3.15Å; A55-M58 PolarHBondContact O-N 2.93Å; A55-V59 VanDerWaalsContact O-CG2 3.29Å; A55-V59 WeakPolarHBondContact O-CG2 3.36Å; A55-V59 PolarHBondContact O-N 3.41Å
56	V	56.8	Low	57.6	Low	80 Å²	80	90.2 Å²	90.2	49%	0.485	48%	0.483	S	S	.	.	H	α-helix	trans	-63.2	-38.7	176.1	170.3	0	0	0	0	111.7	S52 R53 K60	S52-V56 VanDerWaalsContact O-CG2 3.28Å; S52-V56 WeakPolarHBondContact O-CG2 3.39Å; S52-V56 PolarHBondContact O-N 2.83Å; R53-V56 PolarHBondContact O-N 3.16Å; V56-K60 HydrophobicContact CG1-CD 4.31Å; V56-K60 WeakPolarHBondContact O-CB 3.26Å; V56-K60 WeakPolarHBondContact O-CG 3.3Å; V56-K60 PolarHBondContact O-N 3.41Å
57	K	62.1	Low	57.2	Low	122 Å²	122	92.7 Å²	92.7	53%	0.53	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-40.9	174.5	-83.1	-176.1	174.9	-171.3	0	111.9	R53 D54 A55 K60 G61	R53-K57 WeakPolarHBondContact O-CB 3.49Å; R53-K57 WeakPolarHBondContact O-CG 3.49Å; R53-K57 PolarHBondContact O-N 3.13Å; D54-K57 PolarHBondContact O-N 3.29Å; A55-K57 VanDerWaalsContact C-N 3.33Å; A55-K57 PolarHBondContact O-N 3.15Å; K57-K60 PolarHBondContact O-N 2.78Å; K57-G61 PolarHBondContact O-N 3.01Å
58	M	59.2	Low	56.8	Low	115 Å²	115	95.8 Å²	95.8	57%	0.567	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-43.5	176.8	-167.4	-169.2	-56	0	0	111	D54 A55 G61 K62	D54-M58 VanDerWaalsContact O-CB 3.31Å; D54-M58 WeakPolarHBondContact O-CB 3.46Å; D54-M58 PolarHBondContact O-N 2.89Å; A55-M58 PolarHBondContact O-N 2.93Å; M58-G61 PolarHBondContact O-N 2.81Å; M58-K62 WeakPolarHBondContact O-CB 3.27Å; M58-K62 PolarHBondContact O-N 2.8Å
59	V	54.7	Low	56.3	Low	81 Å²	81	94.7 Å²	94.7	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-47.7	174.4	171.7	0	0	0	0	110.7	A55 G61 K62 V63	A55-V59 VanDerWaalsContact O-CG2 3.29Å; A55-V59 WeakPolarHBondContact O-CG2 3.36Å; A55-V59 PolarHBondContact O-N 3.41Å; V59-G61 VanDerWaalsContact C-N 3.32Å; V59-G61 PolarHBondContact O-N 2.93Å; V59-K62 PolarHBondContact O-N 3.43Å; V59-V63 HydrophobicContact CG1-CG2 4.32Å; V59-V63 WeakPolarHBondContact O-CB 3.37Å; V59-V63 WeakPolarHBondContact O-CG2 3.12Å; V59-V63 PolarHBondContact O-N 3.43Å
60	K	54.9	Low	55.6	Low	151 Å²	151	96.8 Å²	96.8	66%	0.657	51%	0.51	S	S	*	.	H	α-helix	trans	-62.8	-38.1	176.5	-77	-176.2	176.6	-173.9	0	112.7	V56 K57 A64	V56-K60 HydrophobicContact CG1-CD 4.31Å; V56-K60 WeakPolarHBondContact O-CB 3.26Å; V56-K60 WeakPolarHBondContact O-CG 3.3Å; V56-K60 PolarHBondContact O-N 3.41Å; K57-K60 PolarHBondContact O-N 2.78Å; K60-A64 WeakPolarHBondContact O-CB 3.49Å; K60-A64 PolarHBondContact O-N 3.39Å
61	G	57.3	Low	54.8	Low	36 Å²	36	101.2 Å²	101.2	37%	0.371	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-48.7	175.1	0	0	0	0	0	111.7	K57 M58 V59 V63 A64 E65	K57-G61 PolarHBondContact O-N 3.01Å; M58-G61 PolarHBondContact O-N 2.81Å; V59-G61 VanDerWaalsContact C-N 3.32Å; V59-G61 PolarHBondContact O-N 2.93Å; G61-V63 PolarHBondContact O-N 3.02Å; G61-A64 PolarHBondContact O-N 2.85Å; G61-E65 PolarHBondContact O-N 3.15Å
62	K	54.5	Low	54	Low	74 Å²	74	105.7 Å²	105.7	32%	0.322	54%	0.54	S	S	.	.	H	α-helix	trans	-63.2	-40.4	175.9	-81	-167.8	168.1	-158.1	0	112.9	M58 V59 A64 E65 M66 R101	M58-K62 WeakPolarHBondContact O-CB 3.27Å; M58-K62 PolarHBondContact O-N 2.8Å; V59-K62 PolarHBondContact O-N 3.43Å; K62-A64 VanDerWaalsContact C-N 3.33Å; K62-A64 PolarHBondContact O-N 3.48Å; K62-E65 PolarHBondContact O-N 3.27Å; K62-M66 WeakPolarHBondContact O-CB 3.25Å; K62-M66 VanDerWaalsContact O-CG 3.26Å; K62-M66 WeakPolarHBondContact O-CG 3.39Å; K62-M66 PolarHBondContact O-N 2.83Å; K62-R101 VanDerWaalsContact NZ-CZ 3.25Å; K62-R101 VanDerWaalsContact NZ-NH1 3.18Å
63	V	53.3	Low	53.5	Low	73 Å²	73	103.9 Å²	103.9	44%	0.442	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-40	175.1	170.7	0	0	0	0	110.7	V59 G61 M66 M67	V59-V63 HydrophobicContact CG1-CG2 4.32Å; V59-V63 WeakPolarHBondContact O-CB 3.37Å; V59-V63 WeakPolarHBondContact O-CG2 3.12Å; V59-V63 PolarHBondContact O-N 3.43Å; G61-V63 PolarHBondContact O-N 3.02Å; V63-M66 PolarHBondContact O-N 2.84Å; V63-M67 HydrophobicContact CG1-SD 4.38Å; V63-M67 WeakPolarHBondContact O-CB 3.38Å; V63-M67 VanDerWaalsContact O-CG 3.28Å; V63-M67 WeakPolarHBondContact O-CG 3.49Å; V63-M67 PolarHBondContact O-N 3.45Å
64	A	55	Low	52.7	Low	54 Å²	54	97.5 Å²	97.5	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-67.2	-38.9	175.2	0	0	0	0	0	112.5	K60 G61 K62 M67 Q68	K60-A64 WeakPolarHBondContact O-CB 3.49Å; K60-A64 PolarHBondContact O-N 3.39Å; G61-A64 PolarHBondContact O-N 2.85Å; K62-A64 VanDerWaalsContact C-N 3.33Å; K62-A64 PolarHBondContact O-N 3.48Å; A64-M67 PolarHBondContact O-N 3.04Å; A64-Q68 PolarHBondContact O-N 3.4Å
65	E	54.1	Low	51.8	Low	119 Å²	119	100.9 Å²	100.9	56%	0.556	53%	0.529	S	S	*	.	H	α-helix	trans	-66	-43.6	173.2	-82.3	179.6	160.3	0	0	112.1	G61 K62 M67 Q68 N69	G61-E65 PolarHBondContact O-N 3.15Å; K62-E65 PolarHBondContact O-N 3.27Å; E65-M67 VanDerWaalsContact C-N 3.34Å; E65-M67 PolarHBondContact O-N 2.94Å; E65-Q68 PolarHBondContact O-N 3.5Å; E65-N69 WeakPolarHBondContact O-CB 3.38Å; E65-N69 PolarHBondContact O-N 3.23Å
66	M	48.2	Very low	51.5	Low	93 Å²	93	102.1 Å²	102.1	46%	0.458	54%	0.535	S	S	.	.	H	α-helix	trans	-60.3	-44.5	174.6	-73.9	174.7	98.4	0	0	110.9	K62 V63 Q68 N69 D70 L78	K62-M66 WeakPolarHBondContact O-CB 3.25Å; K62-M66 VanDerWaalsContact O-CG 3.26Å; K62-M66 WeakPolarHBondContact O-CG 3.39Å; K62-M66 PolarHBondContact O-N 2.83Å; V63-M66 PolarHBondContact O-N 2.84Å; M66-Q68 VanDerWaalsContact C-N 3.3Å; M66-Q68 PolarHBondContact O-N 3.35Å; M66-N69 PolarHBondContact O-N 2.91Å; M66-D70 PolarHBondContact O-N 3.01Å; M66-L78 HydrophobicContact CE-CD2 4.08Å
67	M	50.8	Low	51.2	Low	141 Å²	141	101.7 Å²	101.7	70%	0.695	53%	0.532	S	S	*	.	H	α-helix	trans	-66.4	-27.2	176.3	-75.4	-172	140.1	0	0	113.7	V63 A64 E65	V63-M67 HydrophobicContact CG1-SD 4.38Å; V63-M67 WeakPolarHBondContact O-CB 3.38Å; V63-M67 VanDerWaalsContact O-CG 3.28Å; V63-M67 WeakPolarHBondContact O-CG 3.49Å; V63-M67 PolarHBondContact O-N 3.45Å; A64-M67 PolarHBondContact O-N 3.04Å; E65-M67 VanDerWaalsContact C-N 3.34Å; E65-M67 PolarHBondContact O-N 2.94Å
68	Q	52.5	Low	50.8	Low	157 Å²	157	98.4 Å²	98.4	73%	0.734	52%	0.52	S	S	*	.	H	α-helix	trans	-79.8	-36.2	171.8	-84.1	-173.9	-18.5	0	0	112.4	A64 E65 M66	A64-Q68 PolarHBondContact O-N 3.4Å; E65-Q68 PolarHBondContact O-N 3.5Å; M66-Q68 VanDerWaalsContact C-N 3.3Å; M66-Q68 PolarHBondContact O-N 3.35Å
69	N	47.5	Very low	50.6	Low	83 Å²	83	98.1 Å²	98.1	44%	0.444	52%	0.521	S	S	.	.	H	α-helix	trans	-78.3	-17.2	-178.9	-82.9	-10.7	0	0	0	114.4	E65 M66 R71 L72 G73 G74	E65-N69 WeakPolarHBondContact O-CB 3.38Å; E65-N69 PolarHBondContact O-N 3.23Å; M66-N69 PolarHBondContact O-N 2.91Å; N69-R71 PolarHBondContact O-N 3.2Å; N69-L72 PolarHBondContact O-N 2.83Å; N69-G73 PolarHBondContact O-N 3.44Å; N69-G74 PolarHBondContact O-N 3.24Å
70	D	48	Very low	50.7	Low	124 Å²	124	97.2 Å²	97.2	66%	0.663	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.8	172.7	-91.8	-12	0	0	0	113.7	M66	M66-D70 PolarHBondContact O-N 3.01Å
71	R	48.2	Very low	50.8	Low	225 Å²	225	92.7 Å²	92.7	85%	0.849	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-13.2	174	-66.6	-171.3	-172.7	-171.2	2.4	114.6	N69	N69-R71 PolarHBondContact O-N 3.2Å
72	L	41.1	Very low	51.3	Low	169 Å²	169	93.3 Å²	93.3	89%	0.885	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.2	4.6	-174.6	-109.9	112.4	0	0	0	117.5	N69	N69-L72 PolarHBondContact O-N 2.83Å
73	G	44.1	Very low	51.9	Low	28 Å²	28	93.7 Å²	93.7	29%	0.289	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	169.3	12.3	178.6	0	0	0	0	0	118.7	N69 L75 S76	N69-G73 PolarHBondContact O-N 3.44Å; G73-L75 PolarHBondContact O-N 3.33Å; G73-L75 VanDerWaalsContact O-N 3.16Å; G73-S76 PolarHBondContact O-N 2.88Å; G73-S76 PolarHBondContact O-OG 3.32Å
74	G	45.3	Very low	53.2	Low	12 Å²	12	94.2 Å²	94.2	12%	0.124	50%	0.504	C	S	.	.	H	α-helix	trans	-57.2	-30	-177	0	0	0	0	0	115.5	N69 L78	N69-G74 PolarHBondContact O-N 3.24Å; G74-L78 PolarHBondContact O-N 3.24Å
75	L	46.2	Very low	54.9	Low	133 Å²	133	93.5 Å²	93.5	70%	0.696	49%	0.494	S	S	*	.	H	α-helix	trans	-69.1	-36.4	179.7	-145.7	78.8	0	0	0	112.6	G73 D79	G73-L75 PolarHBondContact O-N 3.33Å; G73-L75 VanDerWaalsContact O-N 3.16Å; L75-D79 WeakPolarHBondContact O-CB 3.46Å; L75-D79 VanDerWaalsContact O-CG 3.28Å; L75-D79 PolarHBondContact O-N 2.91Å
76	S	48.3	Very low	56.9	Low	75 Å²	75	92 Å²	92	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-75.3	-25.7	-176.9	62.2	0	0	0	0	113.5	G73 A80	G73-S76 PolarHBondContact O-N 2.88Å; G73-S76 PolarHBondContact O-OG 3.32Å; S76-A80 WeakPolarHBondContact O-CB 3.45Å; S76-A80 PolarHBondContact O-N 2.93Å
77	V	50.6	Low	59.1	Low	71 Å²	71	92.2 Å²	92.2	43%	0.43	48%	0.483	S	S	.	.	H	α-helix	trans	-73.4	-43.6	174.8	179.3	0	0	0	0	110.4	A80 E81	V77-A80 PolarHBondContact O-N 3.45Å; V77-E81 WeakPolarHBondContact O-CB 3.3Å; V77-E81 WeakPolarHBondContact O-CG 3.46Å; V77-E81 PolarHBondContact O-N 3.08Å
78	L	53.6	Low	61.3	Low	53 Å²	53	88.7 Å²	88.7	28%	0.277	46%	0.464	S	S	.	.	H	α-helix	trans	-65	-42.2	174.2	-70.1	168.4	0	0	0	111.2	M66 G74 A80 E81 F82	M66-L78 HydrophobicContact CE-CD2 4.08Å; G74-L78 PolarHBondContact O-N 3.24Å; L78-A80 VanDerWaalsContact C-N 3.27Å; L78-A80 PolarHBondContact O-N 2.55Å; L78-E81 PolarHBondContact O-N 2.9Å; L78-F82 HydrophobicContact CD2-CE2 4.14Å; L78-F82 WeakPolarHBondContact O-CD2 3.28Å; L78-F82 PolarHBondContact O-N 3.39Å
79	D	55.3	Low	63.3	Low	109 Å²	109	86.6 Å²	86.6	58%	0.583	45%	0.452	S	S	*	.	H	α-helix	trans	-62.6	-33.1	175.7	-76.2	-20.2	0	0	0	112.5	L75 S83	L75-D79 WeakPolarHBondContact O-CB 3.46Å; L75-D79 VanDerWaalsContact O-CG 3.28Å; L75-D79 PolarHBondContact O-N 2.91Å; D79-S83 WeakPolarHBondContact O-CA 3.41Å; D79-S83 WeakPolarHBondContact O-CB 3.36Å; D79-S83 PolarHBondContact O-N 3.12Å; D79-S83 VanDerWaalsContact O-N 3.12Å
80	A	55.7	Low	65.4	Low	62 Å²	62	84.4 Å²	84.4	51%	0.512	44%	0.441	S	S	.	.	H	α-helix	trans	-73	-42.8	173.3	0	0	0	0	0	112.5	S76 V77 L78 F82 S83	S76-A80 WeakPolarHBondContact O-CB 3.45Å; S76-A80 PolarHBondContact O-N 2.93Å; V77-A80 PolarHBondContact O-N 3.45Å; L78-A80 VanDerWaalsContact C-N 3.27Å; L78-A80 PolarHBondContact O-N 2.55Å; A80-F82 VanDerWaalsContact C-N 3.28Å; A80-F82 PolarHBondContact O-N 3.28Å; A80-S83 VanDerWaalsContact O-CB 3.25Å; A80-S83 WeakPolarHBondContact O-CB 3.2Å; A80-S83 PolarHBondContact O-N 3.15Å; A80-S83 PolarHBondContact O-OG 2.66Å
81	E	57.1	Low	67.3	Low	56 Å²	56	85.5 Å²	85.5	26%	0.262	45%	0.447	S	S	.	.	H	α-helix	trans	-65.8	-27.6	178.3	-75.1	-174.7	162.6	0	0	112.8	V77 L78 F336	V77-E81 WeakPolarHBondContact O-CB 3.3Å; V77-E81 WeakPolarHBondContact O-CG 3.46Å; V77-E81 PolarHBondContact O-N 3.08Å; L78-E81 PolarHBondContact O-N 2.9Å; E81-F336 HydrophobicContact CB-CZ 4.23Å; E81-F336 HydrophobicContact CG-CZ 4.34Å; E81-F336 WeakPolarHBondContact OE2-CZ 3.21Å
82	F	68.5	Low	69.4	Low	49 Å²	49	76.3 Å²	76.3	22%	0.215	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	10.7	175.8	-65.5	-70.6	0	0	0	114.1	L78 A80 K84 T85 I98 L333 F336	L78-F82 HydrophobicContact CD2-CE2 4.14Å; L78-F82 WeakPolarHBondContact O-CD2 3.28Å; L78-F82 PolarHBondContact O-N 3.39Å; A80-F82 VanDerWaalsContact C-N 3.28Å; A80-F82 PolarHBondContact O-N 3.28Å; F82-K84 PolarHBondContact O-N 3.17Å; F82-K84 VanDerWaalsContact O-N 3.11Å; F82-T85 PolarHBondContact O-OG1 3.2Å; F82-I98 HydrophobicContact CD1-CG2 4.13Å; F82-I98 HydrophobicContact CE1-CD1 4.17Å; F82-I98 HydrophobicContact CE1-CG2 4.36Å; F82-L333 HydrophobicContact CD1-CD2 4.45Å; F82-L333 HydrophobicContact CE1-CD2 3.41Å; F82-L333 VanDerWaalsContact CE1-CD2 3.41Å; F82-L333 HydrophobicContact CZ-CD2 3.69Å; F82-F336 HydrophobicContact CZ-CD1 4.33Å; F82-F336 HydrophobicContact CZ-CE1 4.32Å
83	S	65.8	Low	72.1	Confident	82 Å²	82	68.3 Å²	68.3	57%	0.573	37%	0.372	S	S	*	.	S	Bend	trans	-59.3	-26.6	-172.6	60.2	0	0	0	0	114.6	D79 A80	D79-S83 WeakPolarHBondContact O-CA 3.41Å; D79-S83 WeakPolarHBondContact O-CB 3.36Å; D79-S83 PolarHBondContact O-N 3.12Å; D79-S83 VanDerWaalsContact O-N 3.12Å; A80-S83 VanDerWaalsContact O-CB 3.25Å; A80-S83 WeakPolarHBondContact O-CB 3.2Å; A80-S83 PolarHBondContact O-N 3.15Å; A80-S83 PolarHBondContact O-OG 2.66Å
84	K	80.9	Confident	74.7	Confident	84 Å²	84	67 Å²	67	37%	0.365	36%	0.359	S	S	.	.	S	Bend	trans	-121.5	93.3	169.5	-65.9	-165.4	-156.3	152.7	0	110.4	F82 Q99 M105	F82-K84 PolarHBondContact O-N 3.17Å; F82-K84 VanDerWaalsContact O-N 3.11Å; K84-Q99 HydrophobicContact CB-CB 4.1Å; K84-Q99 VanDerWaalsContact CD-OE1 3.27Å; K84-Q99 PolarHBondContact O-N 2.99Å; K84-Q99 VanDerWaalsContact O-N 3.11Å; K84-M105 HydrophobicContact CD-CB 4.37Å
85	T	91.4	Very high	77.2	Confident	39 Å²	39	66.4 Å²	66.4	24%	0.239	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.1	172	-59.8	0	0	0	0	108.9	F82 E87 Y96 S97 I98	F82-T85 PolarHBondContact O-OG1 3.2Å; T85-E87 HydrophobicContact CG2-CG 3.87Å; T85-Y96 HydrophobicContact CG2-CE1 4.13Å; T85-Y96 HydrophobicContact CG2-CE2 3.75Å; T85-Y96 VanDerWaalsContact CG2-CZ 3.48Å; T85-Y96 WeakPolarHBondContact CG2-OH 3.42Å; T85-S97 CarbonylContact C-O 3.41Å; T85-S97 VanDerWaalsContact CA-O 3.31Å; T85-S97 WeakPolarHBondContact CA-O 3.47Å; T85-I98 HydrophobicContact CG2-CG2 4.22Å
86	W	95.3	Very high	79.7	Confident	87 Å²	87	60.5 Å²	60.5	33%	0.33	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.9	170.6	-60.6	-27.5	0	0	0	110.9	S97 M105 D107 F109	W86-S97 PolarHBondContact N-O 3Å; W86-S97 PolarHBondContact O-N 2.9Å; W86-S97 PolarHBondContact O-OG 3.32Å; W86-M105 HydrophobicContact CE3-CE 4.01Å; W86-M105 HydrophobicContact CE3-CG 4.29Å; W86-M105 HydrophobicContact CH2-CB 4.46Å; W86-M105 HydrophobicContact CH2-CG 3.71Å; W86-M105 HydrophobicContact CZ2-CG 4.09Å; W86-M105 HydrophobicContact CZ3-CE 4.12Å; W86-M105 HydrophobicContact CZ3-CG 3.83Å; W86-D107 WeakPolarHBondContact CZ3-O 3.26Å; W86-F109 HydrophobicContact CB-CE1 3.98Å; W86-F109 HydrophobicContact CE3-CE1 4.48Å
87	E	94.9	Very high	82	Confident	98 Å²	98	56.9 Å²	56.9	46%	0.458	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	136.2	-176.4	-47.6	-169.8	-168.4	0	0	108.8	T85 V95 Y96 H325 K329	T85-E87 HydrophobicContact CG2-CG 3.87Å; E87-V95 WeakPolarHBondContact CA-O 3.4Å; E87-Y96 HydrophobicContact CB-CD2 4.45Å; E87-Y96 HydrophobicContact CG-CD2 3.73Å; E87-Y96 HydrophobicContact CG-CE2 3.58Å; E87-Y96 VanDerWaalsContact OE1-CE2 3.25Å; E87-Y96 WeakPolarHBondContact OE1-CE2 3.21Å; E87-H325 IonicContact OE2-CE1 3.1Å; E87-H325 PolarHBondContact OE2-CE1 3.24Å; E87-H325 VanDerWaalsContact OE2-CE1 3.27Å; E87-H325 IonicContact OE2-NE2 3.87Å; E87-H325 PolarHBondContact OE2-NE2 3.35Å; E87-K329 IonicContact OE1-NZ 3.85Å
88	F	96.4	Very high	84.2	Confident	67 Å²	67	53.5 Å²	53.5	29%	0.294	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	139.1	168.2	175	-88.4	0	0	0	108.6	N90 V93 A94 V95 F109 V111	F88-N90 HydrophobicContact CE1-CB 4.26Å; F88-N90 HydrophobicContact CZ-CB 4.3Å; F88-V93 HydrophobicContact CD1-CG1 4.45Å; F88-V93 HydrophobicContact CE1-CB 4.36Å; F88-V93 HydrophobicContact CE1-CG1 4.28Å; F88-A94 CarbonylContact O-C 3.5Å; F88-A94 VanDerWaalsContact O-CA 3.25Å; F88-A94 WeakPolarHBondContact O-CA 3.26Å; F88-V95 HydrophobicContact CB-CB 4.1Å; F88-V95 HydrophobicContact CB-CG2 4.14Å; F88-V95 HydrophobicContact CD1-CG2 4.19Å; F88-V95 PolarHBondContact N-O 3.39Å; F88-V95 PolarHBondContact O-N 3.18Å; F88-F109 HydrophobicContact CB-CE2 3.64Å; F88-F109 HydrophobicContact CB-CZ 3.85Å; F88-F109 HydrophobicContact CG-CE2 4.3Å; F88-V111 HydrophobicContact CD1-CB 4.34Å; F88-V111 HydrophobicContact CD1-CG2 4.06Å; F88-V111 HydrophobicContact CE1-CB 3.86Å; F88-V111 HydrophobicContact CE1-CG1 3.68Å; F88-V111 HydrophobicContact CE1-CG2 4.01Å; F88-V111 HydrophobicContact CZ-CB 4.01Å; F88-V111 HydrophobicContact CZ-CG1 3.92Å
89	K	94.8	Very high	86.2	Confident	112 Å²	112	52 Å²	52	49%	0.487	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	133.5	174.4	-171.6	-178.4	178.4	-170.2	0	111.1	V93 A94	K89-V93 WeakPolarHBondContact CA-O 3.31Å; K89-A94 HydrophobicContact CG-CB 4.37Å
90	N	91.7	Very high	88	Confident	37 Å²	37	47.1 Å²	47.1	20%	0.198	24%	0.243	C	C	.	.			trans	-131.7	-165.9	164.5	72.2	21.3	0	0	0	109.7	F88 N92 V93	F88-N90 HydrophobicContact CE1-CB 4.26Å; F88-N90 HydrophobicContact CZ-CB 4.3Å; N90-N92 PolarHBondContact O-N 3.07Å; N90-N92 PolarHBondContact OD1-N 3.39Å; N90-N92 VanDerWaalsContact OD1-N 3.16Å; N90-N92 PolarHBondContact OD1-OD1 3.01Å; N90-V93 PolarHBondContact N-O 2.96Å; N90-V93 WeakPolarHBondContact OD1-CA 3.45Å; N90-V93 VanDerWaalsContact OD1-CB 3.26Å; N90-V93 WeakPolarHBondContact OD1-CB 3.23Å; N90-V93 PolarHBondContact OD1-N 3.47Å; N90-V93 PolarHBondContact OD1-O 3.32Å
91	N	88	Confident	89.7	Confident	147 Å²	147	48.5 Å²	48.5	79%	0.786	24%	0.235	S	C	*	.	S	Bend	trans	-57.7	-32.9	-172.7	-69.2	-14.2	0	0	0	114.4	F326	N91-F326 WeakPolarHBondContact O-CZ 3.38Å
92	N	93.4	Very high	91.4	Very high	33 Å²	33	50.1 Å²	50.1	18%	0.176	24%	0.239	C	C	.	.	S	Bend	trans	-137.2	2.6	-174.4	72.8	-50.8	0	0	0	114	N90 V349 K350	N90-N92 PolarHBondContact O-N 3.07Å; N90-N92 PolarHBondContact OD1-N 3.39Å; N90-N92 VanDerWaalsContact OD1-N 3.16Å; N90-N92 PolarHBondContact OD1-OD1 3.01Å; N92-V349 CarbonylContact O-C 3.43Å; N92-V349 WeakPolarHBondContact O-CA 3.4Å; N92-K350 HydrophobicContact CB-CB 4.31Å; N92-K350 PolarHBondContact ND2-O 2.91Å; N92-K350 VanDerWaalsContact ND2-O 3.15Å; N92-K350 PolarHBondContact O-N 3.3Å
93	V	96.8	Very high	92.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.2	177.9	-175.2	0	0	0	0	109.2	F88 K89 N90 V111 F124 M347 V348 V349	F88-V93 HydrophobicContact CD1-CG1 4.45Å; F88-V93 HydrophobicContact CE1-CB 4.36Å; F88-V93 HydrophobicContact CE1-CG1 4.28Å; K89-V93 WeakPolarHBondContact CA-O 3.31Å; N90-V93 PolarHBondContact N-O 2.96Å; N90-V93 WeakPolarHBondContact OD1-CA 3.45Å; N90-V93 VanDerWaalsContact OD1-CB 3.26Å; N90-V93 WeakPolarHBondContact OD1-CB 3.23Å; N90-V93 PolarHBondContact OD1-N 3.47Å; N90-V93 PolarHBondContact OD1-O 3.32Å; V93-V111 HydrophobicContact CG1-CG1 4.1Å; V93-V111 HydrophobicContact CG1-CG2 4.07Å; V93-V111 HydrophobicContact CG2-CG1 4.5Å; V93-F124 HydrophobicContact CG1-CE1 4.27Å; V93-F124 HydrophobicContact CG2-CE1 3.63Å; V93-F124 HydrophobicContact CG2-CZ 4.11Å; V93-M347 HydrophobicContact CG1-CG 4.07Å; V93-M347 HydrophobicContact CG1-SD 4.22Å; V93-V348 CarbonylContact C-O 3.53Å; V93-V348 WeakPolarHBondContact CA-O 3.36Å; V93-V349 HydrophobicContact CG1-CG2 3.97Å; V93-V349 HydrophobicContact CG2-CB 4.47Å; V93-V349 HydrophobicContact CG2-CG1 4.03Å; V93-V349 HydrophobicContact CG2-CG2 4.1Å
94	A	98.1	Very high	93.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	141.5	168.1	0	0	0	0	0	110.4	F88 K89 H325 F326 M347 V348	F88-A94 CarbonylContact O-C 3.5Å; F88-A94 VanDerWaalsContact O-CA 3.25Å; F88-A94 WeakPolarHBondContact O-CA 3.26Å; K89-A94 HydrophobicContact CG-CB 4.37Å; A94-H325 VanDerWaalsContact CB-C 3.49Å; A94-H325 HydrophobicContact CB-CB 3.75Å; A94-H325 VanDerWaalsContact CB-O 3.3Å; A94-H325 WeakPolarHBondContact CB-O 3.29Å; A94-F326 HydrophobicContact CB-CD2 3.66Å; A94-F326 HydrophobicContact CB-CE2 4.07Å; A94-F326 HydrophobicContact CB-CG 4.43Å; A94-M347 CarbonylContact O-C 3.57Å; A94-M347 VanDerWaalsContact O-CA 3.31Å; A94-M347 WeakPolarHBondContact O-CA 3.33Å; A94-V348 PolarHBondContact N-O 3.46Å; A94-V348 PolarHBondContact O-N 3.16Å
95	V	98.6	Very high	94.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136.9	173.3	-164.5	0	0	0	0	108.2	E87 F88 F109 V111 T345 V346 M347	E87-V95 WeakPolarHBondContact CA-O 3.4Å; F88-V95 HydrophobicContact CB-CB 4.1Å; F88-V95 HydrophobicContact CB-CG2 4.14Å; F88-V95 HydrophobicContact CD1-CG2 4.19Å; F88-V95 PolarHBondContact N-O 3.39Å; F88-V95 PolarHBondContact O-N 3.18Å; V95-F109 HydrophobicContact CB-CD1 4.47Å; V95-F109 HydrophobicContact CB-CD2 4.04Å; V95-F109 HydrophobicContact CB-CE1 4.31Å; V95-F109 HydrophobicContact CB-CE2 3.87Å; V95-F109 HydrophobicContact CB-CG 4.35Å; V95-F109 HydrophobicContact CB-CZ 4.01Å; V95-F109 HydrophobicContact CG1-CB 4.25Å; V95-F109 HydrophobicContact CG1-CD1 3.64Å; V95-F109 HydrophobicContact CG1-CD2 3.86Å; V95-F109 HydrophobicContact CG1-CE1 3.84Å; V95-F109 HydrophobicContact CG1-CE2 4.06Å; V95-F109 HydrophobicContact CG1-CG 3.65Å; V95-F109 HydrophobicContact CG1-CZ 4.04Å; V95-F109 HydrophobicContact CG2-CD2 3.78Å; V95-F109 HydrophobicContact CG2-CE2 3.85Å; V95-F109 HydrophobicContact CG2-CG 4.38Å; V95-F109 HydrophobicContact CG2-CZ 4.49Å; V95-V111 HydrophobicContact CG2-CG2 3.98Å; V95-T345 HydrophobicContact CG1-CG2 4.01Å; V95-V346 WeakPolarHBondContact CA-O 3.37Å; V95-M347 HydrophobicContact CG1-CB 4.27Å; V95-M347 HydrophobicContact CG2-CB 3.95Å; V95-M347 HydrophobicContact CG2-CE 3.79Å; V95-M347 HydrophobicContact CG2-CG 3.81Å; V95-M347 HydrophobicContact CG2-SD 4.39Å
96	Y	98.3	Very high	94.9	Very high	9 Å²	9	50.9 Å²	50.9	4%	0.035	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	129.2	170.9	-162	-96.8	0	0	0	108.8	T85 E87 I98 K329 V332 V346	T85-Y96 HydrophobicContact CG2-CE1 4.13Å; T85-Y96 HydrophobicContact CG2-CE2 3.75Å; T85-Y96 VanDerWaalsContact CG2-CZ 3.48Å; T85-Y96 WeakPolarHBondContact CG2-OH 3.42Å; E87-Y96 HydrophobicContact CB-CD2 4.45Å; E87-Y96 HydrophobicContact CG-CD2 3.73Å; E87-Y96 HydrophobicContact CG-CE2 3.58Å; E87-Y96 VanDerWaalsContact OE1-CE2 3.25Å; E87-Y96 WeakPolarHBondContact OE1-CE2 3.21Å; Y96-I98 HydrophobicContact CD1-CG2 4.16Å; Y96-I98 HydrophobicContact CE1-CG2 3.54Å; Y96-K329 HydrophobicContact CD1-CB 4.17Å; Y96-K329 HydrophobicContact CD1-CG 4.04Å; Y96-K329 HydrophobicContact CD2-CB 3.78Å; Y96-K329 HydrophobicContact CD2-CD 3.94Å; Y96-K329 HydrophobicContact CD2-CG 3.83Å; Y96-K329 HydrophobicContact CE1-CB 4.49Å; Y96-K329 HydrophobicContact CE1-CD 4.45Å; Y96-K329 HydrophobicContact CE1-CG 3.86Å; Y96-K329 HydrophobicContact CE2-CB 4.14Å; Y96-K329 HydrophobicContact CE2-CD 3.45Å; Y96-K329 VanDerWaalsContact CE2-CD 3.45Å; Y96-K329 HydrophobicContact CE2-CG 3.65Å; Y96-K329 HydrophobicContact CG-CB 3.8Å; Y96-K329 HydrophobicContact CG-CG 4.02Å; Y96-K329 VanDerWaalsContact OH-CE 3.28Å; Y96-K329 WeakPolarHBondContact OH-CE 3.39Å; Y96-K329 PolarHBondContact OH-NZ 3.32Å; Y96-V332 HydrophobicContact CD1-CB 3.81Å; Y96-V332 HydrophobicContact CD1-CG1 3.71Å; Y96-V332 HydrophobicContact CD1-CG2 4.09Å; Y96-V332 HydrophobicContact CE1-CG1 4.14Å; Y96-V332 WeakPolarHBondContact O-CG2 3.49Å; Y96-V346 PolarHBondContact N-O 3.01Å; Y96-V346 PolarHBondContact O-N 2.82Å
97	S	98	Very high	95	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.1	-175.1	-29.3	0	0	0	0	109.7	T85 W86 M105 F109 I344 T345	T85-S97 CarbonylContact C-O 3.41Å; T85-S97 VanDerWaalsContact CA-O 3.31Å; T85-S97 WeakPolarHBondContact CA-O 3.47Å; W86-S97 PolarHBondContact N-O 3Å; W86-S97 PolarHBondContact O-N 2.9Å; W86-S97 PolarHBondContact O-OG 3.32Å; S97-M105 VanDerWaalsContact CB-CE 3.47Å; S97-F109 WeakPolarHBondContact OG-CD1 3.47Å; S97-F109 VanDerWaalsContact OG-CE1 3.3Å; S97-F109 WeakPolarHBondContact OG-CE1 3.33Å; S97-I344 CarbonylContact C-O 3.39Å; S97-I344 VanDerWaalsContact CA-O 3.23Å; S97-I344 WeakPolarHBondContact CA-O 3.25Å; S97-T345 WeakPolarHBondContact CB-OG1 3.36Å; S97-T345 WeakPolarHBondContact OG-CG2 3.39Å
98	I	96.6	Very high	95.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.9	173.2	64	174.2	0	0	0	110.1	F82 T85 Y96 G100 V332 F336 I344	F82-I98 HydrophobicContact CD1-CG2 4.13Å; F82-I98 HydrophobicContact CE1-CD1 4.17Å; F82-I98 HydrophobicContact CE1-CG2 4.36Å; T85-I98 HydrophobicContact CG2-CG2 4.22Å; Y96-I98 HydrophobicContact CD1-CG2 4.16Å; Y96-I98 HydrophobicContact CE1-CG2 3.54Å; I98-G100 PolarHBondContact O-N 3.27Å; I98-V332 HydrophobicContact CB-CG1 4.45Å; I98-V332 HydrophobicContact CD1-CG1 3.69Å; I98-V332 HydrophobicContact CG1-CG1 3.64Å; I98-V332 HydrophobicContact CG2-CG1 4.1Å; I98-F336 HydrophobicContact CD1-CB 3.88Å; I98-F336 HydrophobicContact CD1-CD2 3.86Å; I98-F336 HydrophobicContact CD1-CG 4.02Å; I98-I344 HydrophobicContact CD1-CD1 4.19Å; I98-I344 HydrophobicContact CG1-CB 4.03Å; I98-I344 HydrophobicContact CG1-CD1 4.47Å; I98-I344 HydrophobicContact CG1-CG1 4.35Å; I98-I344 PolarHBondContact N-O 3.5Å; I98-I344 PolarHBondContact O-N 3.49Å
99	Q	95.7	Very high	95.3	Very high	21 Å²	21	40.5 Å²	40.5	10%	0.098	19%	0.192	C	C	.	.			trans	-61.4	-31.6	170.4	-172.5	175	-67.1	0	0	111.9	K84 R101 R102 D103 H104 M105 N343	K84-Q99 HydrophobicContact CB-CB 4.1Å; K84-Q99 VanDerWaalsContact CD-OE1 3.27Å; K84-Q99 PolarHBondContact O-N 2.99Å; K84-Q99 VanDerWaalsContact O-N 3.11Å; Q99-R101 PolarHBondContact O-N 3.27Å; Q99-R102 WeakPolarHBondContact CG-O 3.39Å; Q99-R102 PolarHBondContact NE2-O 3.26Å; Q99-D103 VanDerWaalsContact NE2-C 3.34Å; Q99-D103 PolarHBondContact NE2-O 3.47Å; Q99-H104 WeakPolarHBondContact CG-O 3.36Å; Q99-M105 VanDerWaalsContact CA-SD 3.52Å; Q99-M105 HydrophobicContact CB-CB 4.11Å; Q99-M105 HydrophobicContact CB-SD 4.21Å; Q99-M105 HydrophobicContact CG-CB 4.08Å; Q99-N343 PolarHBondContact O-ND2 3.49Å
100	G	91.8	Very high	95.5	Very high	7 Å²	7	37.6 Å²	37.6	7%	0.072	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	-127.6	179.6	0	0	0	0	0	111	I98	I98-G100 PolarHBondContact O-N 3.27Å
101	R	92.1	Very high	95.7	Very high	90 Å²	90	36.4 Å²	36.4	34%	0.34	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	6.4	-173.2	-58.4	-175.8	179.6	178.3	8.4	114.1	K62 Q99 F336	K62-R101 VanDerWaalsContact NZ-CZ 3.25Å; K62-R101 VanDerWaalsContact NZ-NH1 3.18Å; Q99-R101 PolarHBondContact O-N 3.27Å; R101-F336 HydrophobicContact CG-CE2 3.74Å; R101-F336 HydrophobicContact CG-CZ 4.36Å
102	R	92.4	Very high	96.1	Very high	91 Å²	91	31.3 Å²	31.3	34%	0.343	15%	0.147	S	C	.	.	S	Bend	trans	-82.2	158.6	174.4	-62.3	-62.1	-161.4	84.7	-0.7	110.4	Q99 H104 E106 P341 D342 N343	Q99-R102 WeakPolarHBondContact CG-O 3.39Å; Q99-R102 PolarHBondContact NE2-O 3.26Å; R102-H104 VanDerWaalsContact C-N 3.33Å; R102-H104 WeakPolarHBondContact CB-O 3.33Å; R102-E106 IonicContact NH1-OE2 3.47Å; R102-P341 WeakPolarHBondContact CD-O 3.48Å; R102-D342 VanDerWaalsContact CZ-CG 3.48Å; R102-D342 IonicContact CZ-OD1 3.9Å; R102-D342 IonicContact CZ-OD2 3.01Å; R102-D342 IonicContact NE-OD1 3.06Å; R102-D342 PolarHBondContact NE-OD1 3.11Å; R102-D342 VanDerWaalsContact NE-OD1 3.08Å; R102-D342 IonicContact NE-OD2 2.76Å; R102-D342 IonicContact NH1-OD1 2.67Å; R102-D342 PolarHBondContact NH1-OD1 3.05Å; R102-D342 IonicContact NH2-OD1 3.54Å; R102-D342 PolarHBondContact NH2-OD1 2.92Å; R102-D342 IonicContact NH2-OD2 3.82Å; R102-D342 PolarHBondContact NH2-OD2 2.92Å; R102-N343 WeakPolarHBondContact CB-ND2 3.41Å
103	D	91.6	Very high	96	Very high	142 Å²	142	32 Å²	32	76%	0.759	15%	0.152	S	C	*	.	S	Bend	trans	-73.7	-28.8	174.6	-63.8	-36	0	0	0	112.1	Q99	Q99-D103 VanDerWaalsContact NE2-C 3.34Å; Q99-D103 PolarHBondContact NE2-O 3.47Å
104	H	94.2	Very high	95.2	Very high	103 Å²	103	33 Å²	33	48%	0.477	16%	0.158	S	C	.	.	S	Bend	trans	-124.1	152.3	-177.2	-65.2	-86.9	0	0	0	111.2	Q99 R102 E106 E133 N343	Q99-H104 WeakPolarHBondContact CG-O 3.36Å; R102-H104 VanDerWaalsContact C-N 3.33Å; R102-H104 WeakPolarHBondContact CB-O 3.33Å; H104-E106 HydrophobicContact CB-CG 3.96Å; H104-E133 IonicContact ND1-OE1 3.54Å; H104-N343 PolarHBondContact O-ND2 2.85Å; H104-N343 PolarHBondContact O-OD1 3.21Å
105	M	96.3	Very high	94	Very high	2 Å²	2	37 Å²	37	1%	0.01	18%	0.178	C	C	.	.			trans	-100.5	94.1	170.3	-178.6	62.9	-179.3	0	0	106.9	K84 W86 S97 Q99 D107 R108 N343	K84-M105 HydrophobicContact CD-CB 4.37Å; W86-M105 HydrophobicContact CE3-CE 4.01Å; W86-M105 HydrophobicContact CE3-CG 4.29Å; W86-M105 HydrophobicContact CH2-CB 4.46Å; W86-M105 HydrophobicContact CH2-CG 3.71Å; W86-M105 HydrophobicContact CZ2-CG 4.09Å; W86-M105 HydrophobicContact CZ3-CE 4.12Å; W86-M105 HydrophobicContact CZ3-CG 3.83Å; S97-M105 VanDerWaalsContact CB-CE 3.47Å; Q99-M105 VanDerWaalsContact CA-SD 3.52Å; Q99-M105 HydrophobicContact CB-CB 4.11Å; Q99-M105 HydrophobicContact CB-SD 4.21Å; Q99-M105 HydrophobicContact CG-CB 4.08Å; M105-D107 HydrophobicContact CE-CB 3.46Å; M105-D107 VanDerWaalsContact CE-CB 3.46Å; M105-D107 HydrophobicContact SD-CB 4.13Å; M105-R108 PolarHBondContact O-NH1 2.81Å; M105-N343 WeakPolarHBondContact CA-OD1 3.21Å; M105-N343 HydrophobicContact SD-CB 3.95Å
106	E	97.8	Very high	92.7	Very high	22 Å²	22	43 Å²	43	10%	0.103	21%	0.214	C	C	.	.			trans	-94.5	-19.8	-176.5	-57.8	-175.9	116.5	0	0	112	R102 H104 G129 G132 E133 A136 N343	R102-E106 IonicContact NH1-OE2 3.47Å; H104-E106 HydrophobicContact CB-CG 3.96Å; E106-G129 VanDerWaalsContact CB-O 3.28Å; E106-G129 WeakPolarHBondContact CB-O 3.37Å; E106-G129 WeakPolarHBondContact O-CA 3.24Å; E106-G129 PolarHBondContact O-N 3.46Å; E106-G132 VanDerWaalsContact OE1-CA 3.25Å; E106-G132 WeakPolarHBondContact OE1-CA 3.31Å; E106-G132 PolarHBondContact OE1-N 3.36Å; E106-E133 HydrophobicContact CG-CG 4.05Å; E106-A136 VanDerWaalsContact O-CB 3.23Å; E106-A136 WeakPolarHBondContact O-CB 3.49Å; E106-N343 PolarHBondContact N-OD1 3.33Å
107	D	98.5	Very high	91.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.			trans	-56.7	147.9	169.2	-93.2	0.5	0	0	0	111.9	W86 M105 F127 D128 S301 N343 T345	W86-D107 WeakPolarHBondContact CZ3-O 3.26Å; M105-D107 HydrophobicContact CE-CB 3.46Å; M105-D107 VanDerWaalsContact CE-CB 3.46Å; M105-D107 HydrophobicContact SD-CB 4.13Å; D107-F127 CarbonylContact C-O 3.48Å; D107-F127 WeakPolarHBondContact CA-O 3.45Å; D107-D128 VanDerWaalsContact OD1-CA 3.27Å; D107-D128 WeakPolarHBondContact OD1-CA 3.42Å; D107-D128 VanDerWaalsContact OD1-CG 3.31Å; D107-S301 PolarHBondContact OD2-OG 3.36Å; D107-N343 HydrophobicContact CB-CB 4.09Å; D107-N343 PolarHBondContact N-OD1 3Å; D107-T345 VanDerWaalsContact CB-OG1 3.25Å; D107-T345 WeakPolarHBondContact CB-OG1 3.28Å; D107-T345 VanDerWaalsContact CG-OG1 3.26Å; D107-T345 WeakPolarHBondContact OD2-CB 3.4Å; D107-T345 PolarHBondContact OD2-N 2.95Å; D107-T345 PolarHBondContact OD2-OG1 3Å
108	R	98.6	Very high	90.8	Very high	12 Å²	12	54 Å²	54	5%	0.045	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	156.8	170.3	-64.3	-63.3	-178	-82.7	1	110	M105 F127 E133 A136 D137 K140	M105-R108 PolarHBondContact O-NH1 2.81Å; R108-F127 HydrophobicContact CB-CB 4.2Å; R108-F127 HydrophobicContact CB-CD2 4.22Å; R108-F127 PolarHBondContact N-O 3.27Å; R108-F127 PolarHBondContact O-N 3.31Å; R108-E133 IonicContact CZ-OE2 2.79Å; R108-E133 IonicContact NH1-OE2 3.39Å; R108-E133 IonicContact NH2-OE2 3.89Å; R108-E133 PolarHBondContact NH2-OE2 3.38Å; R108-A136 HydrophobicContact CB-CB 4.33Å; R108-A136 HydrophobicContact CG-CB 3.73Å; R108-D137 IonicContact CZ-OD1 3.46Å; R108-D137 VanDerWaalsContact CZ-OD1 3.24Å; R108-D137 IonicContact CZ-OD2 3.82Å; R108-D137 IonicContact NE-OD1 2.75Å; R108-D137 PolarHBondContact NE-OD1 3.22Å; R108-D137 VanDerWaalsContact NH2-CG 3.32Å; R108-D137 IonicContact NH2-OD1 3.04Å; R108-D137 PolarHBondContact NH2-OD1 3.44Å; R108-D137 IonicContact NH2-OD2 3.43Å; R108-D137 PolarHBondContact NH2-OD2 3.34Å; R108-K140 HydrophobicContact CB-CB 4.14Å; R108-K140 HydrophobicContact CB-CD 4.09Å; R108-K140 HydrophobicContact CB-CG 4.49Å; R108-K140 HydrophobicContact CG-CB 4.49Å; R108-K140 HydrophobicContact CG-CD 4.35Å
109	F	98.6	Very high	90.1	Very high	23 Å²	23	55.8 Å²	55.8	10%	0.101	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	160.3	171.8	68.5	-95	0	0	0	111.1	W86 F88 V95 S97 V111 G125 I126 K140 T345 M347	W86-F109 HydrophobicContact CB-CE1 3.98Å; W86-F109 HydrophobicContact CE3-CE1 4.48Å; F88-F109 HydrophobicContact CB-CE2 3.64Å; F88-F109 HydrophobicContact CB-CZ 3.85Å; F88-F109 HydrophobicContact CG-CE2 4.3Å; V95-F109 HydrophobicContact CB-CD1 4.47Å; V95-F109 HydrophobicContact CB-CD2 4.04Å; V95-F109 HydrophobicContact CB-CE1 4.31Å; V95-F109 HydrophobicContact CB-CE2 3.87Å; V95-F109 HydrophobicContact CB-CG 4.35Å; V95-F109 HydrophobicContact CB-CZ 4.01Å; V95-F109 HydrophobicContact CG1-CB 4.25Å; V95-F109 HydrophobicContact CG1-CD1 3.64Å; V95-F109 HydrophobicContact CG1-CD2 3.86Å; V95-F109 HydrophobicContact CG1-CE1 3.84Å; V95-F109 HydrophobicContact CG1-CE2 4.06Å; V95-F109 HydrophobicContact CG1-CG 3.65Å; V95-F109 HydrophobicContact CG1-CZ 4.04Å; V95-F109 HydrophobicContact CG2-CD2 3.78Å; V95-F109 HydrophobicContact CG2-CE2 3.85Å; V95-F109 HydrophobicContact CG2-CG 4.38Å; V95-F109 HydrophobicContact CG2-CZ 4.49Å; S97-F109 WeakPolarHBondContact OG-CD1 3.47Å; S97-F109 VanDerWaalsContact OG-CE1 3.3Å; S97-F109 WeakPolarHBondContact OG-CE1 3.33Å; F109-V111 HydrophobicContact CD2-CG2 4.49Å; F109-G125 CarbonylContact C-O 3.53Å; F109-G125 WeakPolarHBondContact CA-O 3.35Å; F109-G125 WeakPolarHBondContact CB-O 3.46Å; F109-I126 HydrophobicContact CB-CD1 3.8Å; F109-K140 VanDerWaalsContact O-CE 3.31Å; F109-K140 WeakPolarHBondContact O-CE 3.41Å; F109-T345 HydrophobicContact CB-CG2 4.26Å; F109-T345 HydrophobicContact CD1-CG2 4.15Å; F109-M347 HydrophobicContact CB-CE 4.39Å
110	E	98.1	Very high	89.8	Confident	51 Å²	51	55.5 Å²	55.5	24%	0.238	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	144.5	172.6	-164.7	53.7	-111	0	0	111.9	L112 G125 F127 K140 P144	E110-L112 HydrophobicContact CG-CD2 4.3Å; E110-L112 HydrophobicContact CG-CG 4.11Å; E110-G125 PolarHBondContact N-O 3.42Å; E110-G125 PolarHBondContact O-N 3.5Å; E110-F127 HydrophobicContact CB-CE2 4.5Å; E110-K140 HydrophobicContact CB-CG 4.39Å; E110-K140 WeakPolarHBondContact OE2-CE 3.43Å; E110-P144 HydrophobicContact CB-CB 4.33Å; E110-P144 HydrophobicContact CB-CG 3.78Å; E110-P144 HydrophobicContact CG-CB 3.8Å; E110-P144 HydrophobicContact CG-CG 3.72Å
111	V	97.4	Very high	89.8	Confident	12 Å²	12	55.4 Å²	55.4	7%	0.073	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	104.6	179	179.8	0	0	0	0	109.4	F88 V93 V95 F109 T113 F124 M347	F88-V111 HydrophobicContact CD1-CB 4.34Å; F88-V111 HydrophobicContact CD1-CG2 4.06Å; F88-V111 HydrophobicContact CE1-CB 3.86Å; F88-V111 HydrophobicContact CE1-CG1 3.68Å; F88-V111 HydrophobicContact CE1-CG2 4.01Å; F88-V111 HydrophobicContact CZ-CB 4.01Å; F88-V111 HydrophobicContact CZ-CG1 3.92Å; V93-V111 HydrophobicContact CG1-CG1 4.1Å; V93-V111 HydrophobicContact CG1-CG2 4.07Å; V93-V111 HydrophobicContact CG2-CG1 4.5Å; V95-V111 HydrophobicContact CG2-CG2 3.98Å; F109-V111 HydrophobicContact CD2-CG2 4.49Å; V111-T113 HydrophobicContact CG1-CG2 3.98Å; V111-F124 HydrophobicContact CG1-CD1 3.97Å; V111-F124 HydrophobicContact CG1-CE1 3.83Å; V111-F124 HydrophobicContact CG2-CD1 4.31Å; V111-M347 HydrophobicContact CG2-CE 3.57Å; V111-M347 HydrophobicContact CG2-SD 4.08Å
112	L	95.4	Very high	90	Very high	40 Å²	40	52.3 Å²	52.3	21%	0.209	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	107.8	175.9	-55.6	-179.7	0	0	0	110.4	E110 S122 I123 P144	E110-L112 HydrophobicContact CG-CD2 4.3Å; E110-L112 HydrophobicContact CG-CG 4.11Å; L112-S122 WeakPolarHBondContact O-CA 3.37Å; L112-I123 HydrophobicContact CB-CB 4.2Å; L112-I123 PolarHBondContact N-O 3.04Å; L112-I123 PolarHBondContact O-N 3.37Å; L112-P144 HydrophobicContact CD1-CB 3.55Å; L112-P144 HydrophobicContact CG-CB 4.27Å
113	T	90.5	Very high	90.3	Very high	47 Å²	47	48.1 Å²	48.1	29%	0.288	25%	0.254	S	S	.	.			trans	-121	127.7	179.1	63.4	0	0	0	0	110.6	V111 F124	V111-T113 HydrophobicContact CG1-CG2 3.98Å; T113-F124 HydrophobicContact CG2-CE1 4.06Å; T113-F124 HydrophobicContact CG2-CZ 4.25Å
114	D	81.1	Confident	90.6	Very high	22 Å²	22	41.4 Å²	41.4	12%	0.118	22%	0.218	C	C	.	.			trans	-108.1	70.9	168.8	-179	13.7	0	0	0	109.9	T116 N117 K118 S119	D114-T116 PolarHBondContact O-N 3.38Å; D114-T116 PolarHBondContact OD1-OG1 2.87Å; D114-N117 WeakPolarHBondContact OD1-CB 3.3Å; D114-N117 PolarHBondContact OD1-N 2.71Å; D114-N117 PolarHBondContact OD1-ND2 3.24Å; D114-N117 WeakPolarHBondContact OD2-CB 3.41Å; D114-K118 WeakPolarHBondContact O-CA 3.36Å; D114-K118 PolarHBondContact O-N 2.88Å; D114-K118 PolarHBondContact OD2-N 2.92Å; D114-S119 WeakPolarHBondContact OD2-CB 3.48Å; D114-S119 PolarHBondContact OD2-N 3.31Å; D114-S119 PolarHBondContact OD2-OG 3.1Å
115	I	72.7	Confident	90.8	Very high	83 Å²	83	36.5 Å²	36.5	43%	0.426	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.6	-176	-55.1	176	0	0	0	111
116	T	71.5	Confident	90.9	Very high	125 Å²	125	36.4 Å²	36.4	77%	0.767	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-53.1	-175.4	34.7	0	0	0	0	113.1	D114	D114-T116 PolarHBondContact O-N 3.38Å; D114-T116 PolarHBondContact OD1-OG1 2.87Å
117	N	75.3	Confident	91	Very high	130 Å²	130	35.4 Å²	35.4	70%	0.695	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-15.1	-174.8	-49.4	-58.8	0	0	0	112.2	D114 S119	D114-N117 WeakPolarHBondContact OD1-CB 3.3Å; D114-N117 PolarHBondContact OD1-N 2.71Å; D114-N117 PolarHBondContact OD1-ND2 3.24Å; D114-N117 WeakPolarHBondContact OD2-CB 3.41Å; N117-S119 PolarHBondContact O-N 3.39Å; N117-S119 VanDerWaalsContact O-N 3.12Å
118	K	80.6	Confident	91	Very high	112 Å²	112	35.8 Å²	35.8	49%	0.487	19%	0.193	S	C	.	.			trans	46.8	38.2	-174.1	-62.6	-170	175.6	-161.7	0	112.3	D114 H120 D202	D114-K118 WeakPolarHBondContact O-CA 3.36Å; D114-K118 PolarHBondContact O-N 2.88Å; D114-K118 PolarHBondContact OD2-N 2.92Å; K118-H120 PolarHBondContact O-N 3.2Å; K118-D202 VanDerWaalsContact NZ-CG 3.25Å; K118-D202 IonicContact NZ-OD1 2.67Å; K118-D202 PolarHBondContact NZ-OD1 2.95Å; K118-D202 IonicContact NZ-OD2 2.93Å; K118-D202 PolarHBondContact NZ-OD2 2.94Å
119	S	82.8	Confident	91	Very high	37 Å²	37	35.2 Å²	35.2	26%	0.259	19%	0.191	S	C	.	.			trans	-72	-13.3	-175.5	65.9	0	0	0	0	113.5	D114 N117 Q152	D114-S119 WeakPolarHBondContact OD2-CB 3.48Å; D114-S119 PolarHBondContact OD2-N 3.31Å; D114-S119 PolarHBondContact OD2-OG 3.1Å; N117-S119 PolarHBondContact O-N 3.39Å; N117-S119 VanDerWaalsContact O-N 3.12Å; S119-Q152 PolarHBondContact OG-NE2 3.12Å; S119-Q152 VanDerWaalsContact OG-NE2 3.08Å
120	H	88.7	Confident	91	Very high	15 Å²	15	35.6 Å²	35.6	7%	0.069	19%	0.193	C	C	.	.	S	Bend	trans	-156.1	163.1	174.3	61.1	87.6	0	0	0	110.1	K118 R148 L151 Q152	K118-H120 PolarHBondContact O-N 3.2Å; H120-R148 WeakPolarHBondContact NE2-CG 3.26Å; H120-L151 HydrophobicContact CB-CB 3.85Å; H120-Q152 HydrophobicContact CB-CG 4.05Å
121	P	92.3	Very high	90.9	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.032	21%	0.213	C	C	.	.			trans	-55.5	146.9	168.1	-24.8	35.1	0	0	0	111.9	I123 L151 Y165 L199 L200	P121-I123 WeakPolarHBondContact O-CG1 3.29Å; P121-I123 PolarHBondContact O-N 3.48Å; P121-L151 HydrophobicContact CG-CD2 4.47Å; P121-Y165 HydrophobicContact CG-CD1 4.29Å; P121-Y165 HydrophobicContact CG-CE1 3.58Å; P121-Y165 HydrophobicContact CG-CE2 3.91Å; P121-Y165 WeakPolarHBondContact CG-OH 3.41Å; P121-L199 HydrophobicContact CB-CB 4.25Å; P121-L200 CarbonylContact C-O 3.57Å; P121-L200 WeakPolarHBondContact CA-O 3.48Å
122	S	96.1	Very high	90.9	Very high	25 Å²	25	36.7 Å²	36.7	18%	0.175	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	137.1	169.8	-64.3	0	0	0	0	110	L112 L199 L200	L112-S122 WeakPolarHBondContact O-CA 3.37Å; S122-L199 CarbonylContact O-C 3.41Å; S122-L199 WeakPolarHBondContact O-CA 3.18Å; S122-L200 PolarHBondContact N-O 2.98Å; S122-L200 PolarHBondContact O-N 2.79Å
123	I	97.9	Very high	91	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.4	-174.6	-47.4	178.8	0	0	0	108.4	L112 P121 P144 L147 R148 L151 M197 L199	L112-I123 HydrophobicContact CB-CB 4.2Å; L112-I123 PolarHBondContact N-O 3.04Å; L112-I123 PolarHBondContact O-N 3.37Å; P121-I123 WeakPolarHBondContact O-CG1 3.29Å; P121-I123 PolarHBondContact O-N 3.48Å; I123-P144 HydrophobicContact CG2-CB 4.49Å; I123-L147 HydrophobicContact CD1-CB 4.09Å; I123-R148 HydrophobicContact CD1-CB 4.01Å; I123-L151 HydrophobicContact CD1-CD1 3.93Å; I123-L151 HydrophobicContact CG1-CD1 4.27Å; I123-M197 HydrophobicContact CG2-CE 3.46Å; I123-M197 VanDerWaalsContact CG2-CE 3.46Å; I123-L199 HydrophobicContact CB-CD2 4.17Å; I123-L199 HydrophobicContact CD1-CD2 4.48Å; I123-L199 HydrophobicContact CG1-CD2 3.76Å; I123-L199 HydrophobicContact CG2-CD2 3.98Å
124	F	98.6	Very high	91.4	Very high	1 Å²	1	37 Å²	37	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.1	176.2	-52.4	-72.5	0	0	0	109.2	V93 V111 T113 M197 A198 L200 M297 L299 M347 V349	V93-F124 HydrophobicContact CG1-CE1 4.27Å; V93-F124 HydrophobicContact CG2-CE1 3.63Å; V93-F124 HydrophobicContact CG2-CZ 4.11Å; V111-F124 HydrophobicContact CG1-CD1 3.97Å; V111-F124 HydrophobicContact CG1-CE1 3.83Å; V111-F124 HydrophobicContact CG2-CD1 4.31Å; T113-F124 HydrophobicContact CG2-CE1 4.06Å; T113-F124 HydrophobicContact CG2-CZ 4.25Å; F124-M197 CarbonylContact O-C 3.54Å; F124-M197 WeakPolarHBondContact O-CA 3.3Å; F124-A198 HydrophobicContact CB-CB 4.29Å; F124-A198 HydrophobicContact CD2-CB 4.32Å; F124-A198 PolarHBondContact N-O 2.81Å; F124-A198 PolarHBondContact O-N 3.31Å; F124-L200 HydrophobicContact CD2-CB 4.48Å; F124-L200 HydrophobicContact CE2-CB 3.77Å; F124-L200 HydrophobicContact CE2-CD2 3.98Å; F124-L200 HydrophobicContact CZ-CD2 4.42Å; F124-M297 HydrophobicContact CD2-CE 3.52Å; F124-M297 HydrophobicContact CE2-CE 3.76Å; F124-M297 HydrophobicContact CG-CE 4.23Å; F124-L299 HydrophobicContact CB-CD1 3.68Å; F124-M347 HydrophobicContact CB-CE 4.3Å; F124-M347 HydrophobicContact CB-SD 3.68Å; F124-M347 HydrophobicContact CD1-SD 3.65Å; F124-M347 HydrophobicContact CG-SD 3.95Å; F124-V349 HydrophobicContact CD1-CG2 4.04Å; F124-V349 HydrophobicContact CD2-CG2 4.49Å; F124-V349 HydrophobicContact CE1-CG1 4.49Å; F124-V349 HydrophobicContact CE1-CG2 3.97Å; F124-V349 HydrophobicContact CE2-CG1 4.27Å; F124-V349 HydrophobicContact CE2-CG2 4.38Å; F124-V349 HydrophobicContact CG-CG2 4.31Å; F124-V349 HydrophobicContact CZ-CG1 3.95Å; F124-V349 HydrophobicContact CZ-CG2 4.13Å
125	G	98.5	Very high	92.2	Very high	1 Å²	1	36 Å²	36	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.7	-179.9	0	0	0	0	0	112.4	F109 E110 L196 M197	F109-G125 CarbonylContact C-O 3.53Å; F109-G125 WeakPolarHBondContact CA-O 3.35Å; F109-G125 WeakPolarHBondContact CB-O 3.46Å; E110-G125 PolarHBondContact N-O 3.42Å; E110-G125 PolarHBondContact O-N 3.5Å; G125-L196 CarbonylContact C-O 3.59Å; G125-L196 WeakPolarHBondContact CA-O 3.39Å; G125-M197 VanDerWaalsContact CA-SD 3.57Å
126	I	98.9	Very high	93.4	Very high	0 Å²	0	32 Å²	32	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.7	164.5	-60.9	-68.6	0	0	0	107.7	F109 L196 L299 T345 M347	F109-I126 HydrophobicContact CB-CD1 3.8Å; I126-L196 HydrophobicContact CB-CB 4.35Å; I126-L196 PolarHBondContact N-O 2.81Å; I126-L196 PolarHBondContact O-N 2.82Å; I126-L299 HydrophobicContact CG1-CB 3.93Å; I126-T345 HydrophobicContact CD1-CG2 3.66Å; I126-M347 HydrophobicContact CD1-CB 4.21Å; I126-M347 HydrophobicContact CD1-CE 4.13Å
127	F	98.9	Very high	94.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	106.5	179.7	-47.2	-83.8	0	0	0	108	D107 R108 E110 A136 A139 K140 L143 P144 T193 T194 C195 M197	D107-F127 CarbonylContact C-O 3.48Å; D107-F127 WeakPolarHBondContact CA-O 3.45Å; R108-F127 HydrophobicContact CB-CB 4.2Å; R108-F127 HydrophobicContact CB-CD2 4.22Å; R108-F127 PolarHBondContact N-O 3.27Å; R108-F127 PolarHBondContact O-N 3.31Å; E110-F127 HydrophobicContact CB-CE2 4.5Å; F127-A136 HydrophobicContact CB-CB 4.37Å; F127-A139 HydrophobicContact CD1-CB 3.58Å; F127-A139 HydrophobicContact CE1-CB 3.77Å; F127-A139 HydrophobicContact CG-CB 4.13Å; F127-A139 HydrophobicContact CZ-CB 4.47Å; F127-K140 HydrophobicContact CD2-CB 4.2Å; F127-K140 HydrophobicContact CE2-CB 4.22Å; F127-L143 HydrophobicContact CE1-CD2 4.04Å; F127-L143 HydrophobicContact CZ-CD2 4.44Å; F127-P144 HydrophobicContact CZ-CG 4.28Å; F127-T193 WeakPolarHBondContact CB-OG1 3.17Å; F127-T194 WeakPolarHBondContact CA-O 3.37Å; F127-C195 HydrophobicContact CD1-CB 4.35Å; F127-C195 HydrophobicContact CE1-CB 4.47Å; F127-M197 HydrophobicContact CE1-SD 3.9Å; F127-M197 HydrophobicContact CZ-SD 3.58Å; F127-M197 VanDerWaalsContact CZ-SD 3.58Å
128	D	98.8	Very high	95.8	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.043	15%	0.15	C	C	.	.			trans	-90.1	110.4	177.1	-173.3	-22.8	0	0	0	108	D107 T193 T194 S301	D107-D128 VanDerWaalsContact OD1-CA 3.27Å; D107-D128 WeakPolarHBondContact OD1-CA 3.42Å; D107-D128 VanDerWaalsContact OD1-CG 3.31Å; D128-T193 VanDerWaalsContact C-OG1 3.25Å; D128-T193 PolarHBondContact N-OG1 3.44Å; D128-T193 CarbonylContact O-C 3.53Å; D128-T193 WeakPolarHBondContact O-CA 3.2Å; D128-T193 WeakPolarHBondContact O-CB 3.44Å; D128-T193 PolarHBondContact O-OG1 2.89Å; D128-T194 HydrophobicContact CB-CG2 3.89Å; D128-T194 WeakPolarHBondContact CB-OG1 3.31Å; D128-T194 PolarHBondContact N-OG1 3.47Å; D128-T194 PolarHBondContact O-N 3Å; D128-S301 VanDerWaalsContact OD2-CB 3.32Å; D128-S301 WeakPolarHBondContact OD2-CB 3.31Å
129	G	98.6	Very high	96.7	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	148.4	-173.5	0	0	0	0	0	112.3	E106	E106-G129 VanDerWaalsContact CB-O 3.28Å; E106-G129 WeakPolarHBondContact CB-O 3.37Å; E106-G129 WeakPolarHBondContact O-CA 3.24Å; E106-G129 PolarHBondContact O-N 3.46Å
130	H	98.3	Very high	97.4	Very high	31 Å²	31	20.6 Å²	20.6	14%	0.144	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	149.2	174.1	60.6	-102.1	0	0	0	111.7	G132 A191 G192 L261 D269	H130-G132 PolarHBondContact O-N 3.42Å; H130-A191 WeakPolarHBondContact O-CA 3.12Å; H130-G192 VanDerWaalsContact CE1-C 3.46Å; H130-G192 PolarHBondContact N-O 3.42Å; H130-G192 WeakPolarHBondContact NE2-CA 3.49Å; H130-G192 PolarHBondContact O-N 3.47Å; H130-L261 WeakPolarHBondContact NE2-CD1 3.09Å; H130-D269 IonicContact CD2-OD1 3.45Å; H130-D269 IonicContact CE1-OD2 3.65Å; H130-D269 PolarHBondContact CE1-OD2 3.22Å; H130-D269 VanDerWaalsContact CE1-OD2 3.26Å; H130-D269 IonicContact NE2-OD1 2.71Å; H130-D269 PolarHBondContact NE2-OD1 2.82Å; H130-D269 IonicContact NE2-OD2 3.31Å; H130-D269 PolarHBondContact NE2-OD2 3.22Å
131	G	96.8	Very high	97.9	Very high	64 Å²	64	22.9 Å²	22.9	66%	0.66	15%	0.151	S	C	*	.	S	Bend	trans	70.2	19.8	179	0	0	0	0	0	113.4
132	G	96.9	Very high	98.2	Very high	22 Å²	22	25.9 Å²	25.9	23%	0.227	17%	0.165	C	C	.	.	S	Bend	trans	130.3	156.2	-174.6	0	0	0	0	0	112.5	E106 H130 A134	E106-G132 VanDerWaalsContact OE1-CA 3.25Å; E106-G132 WeakPolarHBondContact OE1-CA 3.31Å; E106-G132 PolarHBondContact OE1-N 3.36Å; H130-G132 PolarHBondContact O-N 3.42Å; G132-A134 VanDerWaalsContact C-N 3.33Å
133	E	97.3	Very high	98.2	Very high	58 Å²	58	24.7 Å²	24.7	27%	0.271	16%	0.156	S	C	.	.	S	Bend	trans	-79.3	-16.9	-178.8	-59.5	-176.5	-146.8	0	0	112.9	H104 E106 R108 A135 A136 D137	H104-E133 IonicContact ND1-OE1 3.54Å; E106-E133 HydrophobicContact CG-CG 4.05Å; R108-E133 IonicContact CZ-OE2 2.79Å; R108-E133 IonicContact NH1-OE2 3.39Å; R108-E133 IonicContact NH2-OE2 3.89Å; R108-E133 PolarHBondContact NH2-OE2 3.38Å; E133-A135 PolarHBondContact O-N 3.27Å; E133-A136 PolarHBondContact O-N 3.36Å; E133-D137 WeakPolarHBondContact O-CB 3.34Å; E133-D137 PolarHBondContact O-N 2.75Å
134	A	98.3	Very high	98.2	Very high	35 Å²	35	24.7 Å²	24.7	29%	0.289	16%	0.156	S	C	.	.	H	α-helix	trans	-61.1	-41.5	-166.7	0	0	0	0	0	114.1	G132 Y138 L184 D189 A191	G132-A134 VanDerWaalsContact C-N 3.33Å; A134-Y138 VanDerWaalsContact O-CB 3.3Å; A134-Y138 WeakPolarHBondContact O-CB 3.35Å; A134-Y138 PolarHBondContact O-N 3.1Å; A134-L184 HydrophobicContact CB-CD2 4.08Å; A134-D189 WeakPolarHBondContact CB-OD2 3.5Å; A134-A191 HydrophobicContact CB-CB 4.41Å
135	A	98.6	Very high	98	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-68.7	-44.5	-179.6	0	0	0	0	0	112	E133 Y138 A139 M180 L184 A191 G192 T193	E133-A135 PolarHBondContact O-N 3.27Å; A135-Y138 PolarHBondContact O-N 2.71Å; A135-A139 WeakPolarHBondContact O-CB 3.3Å; A135-A139 PolarHBondContact O-N 3.06Å; A135-M180 HydrophobicContact CB-SD 3.89Å; A135-L184 HydrophobicContact CB-CD1 4.29Å; A135-A191 HydrophobicContact CB-CB 3.92Å; A135-G192 VanDerWaalsContact CB-C 3.49Å; A135-T193 HydrophobicContact CB-CG2 4.16Å
136	A	98.7	Very high	97.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.8	-41.9	176.9	0	0	0	0	0	111.7	E106 R108 F127 E133 Y138 A139 K140	E106-A136 VanDerWaalsContact O-CB 3.23Å; E106-A136 WeakPolarHBondContact O-CB 3.49Å; R108-A136 HydrophobicContact CB-CB 4.33Å; R108-A136 HydrophobicContact CG-CB 3.73Å; F127-A136 HydrophobicContact CB-CB 4.37Å; E133-A136 PolarHBondContact O-N 3.36Å; A136-Y138 VanDerWaalsContact C-N 3.33Å; A136-Y138 PolarHBondContact O-N 3.01Å; A136-A139 PolarHBondContact O-N 3.28Å; A136-K140 WeakPolarHBondContact O-CB 3.5Å; A136-K140 PolarHBondContact O-N 3.05Å
137	D	98.6	Very high	97.7	Very high	67 Å²	67	28.9 Å²	28.9	36%	0.358	18%	0.178	S	C	.	.	H	α-helix	trans	-59.3	-44	173.3	-85.2	-35.3	0	0	0	111.8	R108 E133 A141	R108-D137 IonicContact CZ-OD1 3.46Å; R108-D137 VanDerWaalsContact CZ-OD1 3.24Å; R108-D137 IonicContact CZ-OD2 3.82Å; R108-D137 IonicContact NE-OD1 2.75Å; R108-D137 PolarHBondContact NE-OD1 3.22Å; R108-D137 VanDerWaalsContact NH2-CG 3.32Å; R108-D137 IonicContact NH2-OD1 3.04Å; R108-D137 PolarHBondContact NH2-OD1 3.44Å; R108-D137 IonicContact NH2-OD2 3.43Å; R108-D137 PolarHBondContact NH2-OD2 3.34Å; E133-D137 WeakPolarHBondContact O-CB 3.34Å; E133-D137 PolarHBondContact O-N 2.75Å; D137-A141 VanDerWaalsContact O-CB 3.29Å; D137-A141 WeakPolarHBondContact O-CB 3.35Å; D137-A141 PolarHBondContact O-N 3.49Å
138	Y	98.6	Very high	97.6	Very high	25 Å²	25	32.1 Å²	32.1	10%	0.098	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-49	178.1	-165.5	-89.2	0	0	0	112.1	A134 A135 A136 A141 H142 V176 M180 K183	A134-Y138 VanDerWaalsContact O-CB 3.3Å; A134-Y138 WeakPolarHBondContact O-CB 3.35Å; A134-Y138 PolarHBondContact O-N 3.1Å; A135-Y138 PolarHBondContact O-N 2.71Å; A136-Y138 VanDerWaalsContact C-N 3.33Å; A136-Y138 PolarHBondContact O-N 3.01Å; Y138-A141 PolarHBondContact O-N 2.76Å; Y138-H142 AromaticContact CD1-ND1 3.87Å; Y138-H142 AromaticContact CD2-CE1 3.54Å; Y138-H142 AromaticContact CD2-ND1 3.69Å; Y138-H142 HydrophobicContact CE1-CB 4.3Å; Y138-H142 AromaticContact CE1-CG 3.99Å; Y138-H142 AromaticContact CE1-ND1 3.88Å; Y138-H142 AromaticContact CE2-CE1 3.29Å; Y138-H142 WeakPolarHBondContact CE2-CE1 3.46Å; Y138-H142 AromaticContact CE2-ND1 3.62Å; Y138-H142 AromaticContact CE2-NE2 3.69Å; Y138-H142 AromaticContact CG-ND1 3.81Å; Y138-H142 AromaticContact CZ-CE1 3.76Å; Y138-H142 AromaticContact CZ-CG 3.92Å; Y138-H142 AromaticContact CZ-ND1 3.75Å; Y138-H142 AromaticContact CZ-NE2 3.9Å; Y138-H142 PolarHBondContact O-N 3.1Å; Y138-H142 VanDerWaalsContact O-N 3.08Å; Y138-H142 PolarHBondContact O-ND1 3.39Å; Y138-V176 HydrophobicContact CD1-CG1 4.18Å; Y138-V176 HydrophobicContact CE1-CG1 4.03Å; Y138-M180 HydrophobicContact CD1-CB 3.56Å; Y138-M180 HydrophobicContact CD1-CE 3.71Å; Y138-M180 HydrophobicContact CD1-CG 3.62Å; Y138-M180 HydrophobicContact CD1-SD 4.45Å; Y138-M180 HydrophobicContact CE1-CB 3.7Å; Y138-M180 HydrophobicContact CE1-CG 4.24Å; Y138-M180 HydrophobicContact CG-CB 4.27Å; Y138-M180 HydrophobicContact CG-CE 4.34Å; Y138-M180 HydrophobicContact CG-CG 3.89Å; Y138-K183 HydrophobicContact CD2-CD 4.2Å; Y138-K183 HydrophobicContact CE2-CD 3.33Å; Y138-K183 PolarHBondContact OH-NZ 3.08Å
139	A	98.6	Very high	97.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.1	-49	179.9	0	0	0	0	0	110.9	F127 A135 A136 A141 H142 L143 P144 M180 T193 L267	F127-A139 HydrophobicContact CD1-CB 3.58Å; F127-A139 HydrophobicContact CE1-CB 3.77Å; F127-A139 HydrophobicContact CG-CB 4.13Å; F127-A139 HydrophobicContact CZ-CB 4.47Å; A135-A139 WeakPolarHBondContact O-CB 3.3Å; A135-A139 PolarHBondContact O-N 3.06Å; A136-A139 PolarHBondContact O-N 3.28Å; A139-A141 VanDerWaalsContact C-N 3.35Å; A139-A141 PolarHBondContact O-N 2.86Å; A139-H142 PolarHBondContact O-N 3.45Å; A139-L143 VanDerWaalsContact O-CB 3.28Å; A139-L143 WeakPolarHBondContact O-CB 3.25Å; A139-L143 PolarHBondContact O-N 2.79Å; A139-P144 WeakPolarHBondContact O-CD 3.33Å; A139-M180 HydrophobicContact CB-CE 3.9Å; A139-T193 HydrophobicContact CB-CG2 3.99Å; A139-L267 HydrophobicContact CB-CD1 4.36Å
140	K	98.3	Very high	97.1	Very high	72 Å²	72	40 Å²	40	31%	0.313	23%	0.227	S	C	.	.	H	α-helix	trans	-56.7	-45.7	175.6	-178	-168.6	173.6	-178.7	0	112.2	R108 F109 E110 F127 A136 P144	R108-K140 HydrophobicContact CB-CB 4.14Å; R108-K140 HydrophobicContact CB-CD 4.09Å; R108-K140 HydrophobicContact CB-CG 4.49Å; R108-K140 HydrophobicContact CG-CB 4.49Å; R108-K140 HydrophobicContact CG-CD 4.35Å; F109-K140 VanDerWaalsContact O-CE 3.31Å; F109-K140 WeakPolarHBondContact O-CE 3.41Å; E110-K140 HydrophobicContact CB-CG 4.39Å; E110-K140 WeakPolarHBondContact OE2-CE 3.43Å; F127-K140 HydrophobicContact CD2-CB 4.2Å; F127-K140 HydrophobicContact CE2-CB 4.22Å; A136-K140 WeakPolarHBondContact O-CB 3.5Å; A136-K140 PolarHBondContact O-N 3.05Å; K140-P144 VanDerWaalsContact O-CD 3.22Å; K140-P144 WeakPolarHBondContact O-CD 3.46Å
141	A	97.9	Very high	96.9	Very high	64 Å²	64	38.5 Å²	38.5	53%	0.529	22%	0.22	S	C	.	.	H	α-helix	trans	-72.7	-30.4	-173.9	0	0	0	0	0	114	D137 Y138 A139	D137-A141 VanDerWaalsContact O-CB 3.29Å; D137-A141 WeakPolarHBondContact O-CB 3.35Å; D137-A141 PolarHBondContact O-N 3.49Å; Y138-A141 PolarHBondContact O-N 2.76Å; A139-A141 VanDerWaalsContact C-N 3.35Å; A139-A141 PolarHBondContact O-N 2.86Å
142	H	98.1	Very high	96.7	Very high	68 Å²	68	37.6 Å²	37.6	32%	0.315	20%	0.199	S	C	.	.	H	α-helix	trans	-111.9	-38.7	-169.2	-59.7	79.8	0	0	0	113.7	Y138 A139 S146 V176	Y138-H142 AromaticContact CD1-ND1 3.87Å; Y138-H142 AromaticContact CD2-CE1 3.54Å; Y138-H142 AromaticContact CD2-ND1 3.69Å; Y138-H142 HydrophobicContact CE1-CB 4.3Å; Y138-H142 AromaticContact CE1-CG 3.99Å; Y138-H142 AromaticContact CE1-ND1 3.88Å; Y138-H142 AromaticContact CE2-CE1 3.29Å; Y138-H142 WeakPolarHBondContact CE2-CE1 3.46Å; Y138-H142 AromaticContact CE2-ND1 3.62Å; Y138-H142 AromaticContact CE2-NE2 3.69Å; Y138-H142 AromaticContact CG-ND1 3.81Å; Y138-H142 AromaticContact CZ-CE1 3.76Å; Y138-H142 AromaticContact CZ-CG 3.92Å; Y138-H142 AromaticContact CZ-ND1 3.75Å; Y138-H142 AromaticContact CZ-NE2 3.9Å; Y138-H142 PolarHBondContact O-N 3.1Å; Y138-H142 VanDerWaalsContact O-N 3.08Å; Y138-H142 PolarHBondContact O-ND1 3.39Å; A139-H142 PolarHBondContact O-N 3.45Å; H142-S146 WeakPolarHBondContact O-CB 3.3Å; H142-S146 PolarHBondContact O-N 3.39Å; H142-V176 HydrophobicContact CB-CG1 4.34Å
143	L	97.9	Very high	96.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.4	-51.5	-171.3	-179.2	65.1	0	0	0	113.2	F127 A139 E145 S146 L147 R172 I173 V176 C195 M197	F127-L143 HydrophobicContact CE1-CD2 4.04Å; F127-L143 HydrophobicContact CZ-CD2 4.44Å; A139-L143 VanDerWaalsContact O-CB 3.28Å; A139-L143 WeakPolarHBondContact O-CB 3.25Å; A139-L143 PolarHBondContact O-N 2.79Å; L143-E145 VanDerWaalsContact C-N 3.31Å; L143-E145 PolarHBondContact O-N 2.91Å; L143-S146 PolarHBondContact O-N 2.86Å; L143-L147 HydrophobicContact CD1-CD1 3.95Å; L143-L147 HydrophobicContact CD1-CG 4.22Å; L143-L147 HydrophobicContact CG-CD1 3.92Å; L143-L147 WeakPolarHBondContact O-CB 3.39Å; L143-L147 WeakPolarHBondContact O-CG 3.5Å; L143-L147 PolarHBondContact O-N 3.35Å; L143-R172 HydrophobicContact CD1-CB 3.93Å; L143-I173 HydrophobicContact CD1-CG1 4.19Å; L143-I173 HydrophobicContact CD2-CG1 4.01Å; L143-V176 HydrophobicContact CB-CG1 4.23Å; L143-V176 HydrophobicContact CB-CG2 4.25Å; L143-V176 HydrophobicContact CD1-CB 4.24Å; L143-V176 HydrophobicContact CD1-CG2 3.85Å; L143-C195 VanDerWaalsContact CD2-SG 3.52Å; L143-M197 HydrophobicContact CD2-CG 3.91Å; L143-M197 HydrophobicContact CD2-SD 3.97Å
144	P	97.3	Very high	96	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.013	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-40.6	-179.4	-25.3	37.8	0	0	0	112.5	E110 L112 I123 F127 A139 K140 R148 M197	E110-P144 HydrophobicContact CB-CB 4.33Å; E110-P144 HydrophobicContact CB-CG 3.78Å; E110-P144 HydrophobicContact CG-CB 3.8Å; E110-P144 HydrophobicContact CG-CG 3.72Å; L112-P144 HydrophobicContact CD1-CB 3.55Å; L112-P144 HydrophobicContact CG-CB 4.27Å; I123-P144 HydrophobicContact CG2-CB 4.49Å; F127-P144 HydrophobicContact CZ-CG 4.28Å; A139-P144 WeakPolarHBondContact O-CD 3.33Å; K140-P144 VanDerWaalsContact O-CD 3.22Å; K140-P144 WeakPolarHBondContact O-CD 3.46Å; P144-R148 WeakPolarHBondContact O-CB 3.48Å; P144-R148 PolarHBondContact O-N 2.89Å; P144-M197 HydrophobicContact CG-CE 4.44Å
145	E	94.7	Very high	95.6	Very high	64 Å²	64	38.2 Å²	38.2	30%	0.299	20%	0.197	S	C	.	.	H	α-helix	trans	-71.6	-42.3	180	179.4	53.1	-150.9	0	0	112.2	L143 L147 R148 Q149	L143-E145 VanDerWaalsContact C-N 3.31Å; L143-E145 PolarHBondContact O-N 2.91Å; E145-L147 VanDerWaalsContact C-N 3.31Å; E145-L147 PolarHBondContact O-N 2.86Å; E145-R148 WeakPolarHBondContact O-CB 3.46Å; E145-R148 PolarHBondContact O-N 2.91Å; E145-R148 IonicContact OE1-CZ 3.41Å; E145-R148 IonicContact OE1-NE 3.29Å; E145-R148 PolarHBondContact OE1-NE 2.86Å; E145-R148 IonicContact OE1-NH2 3.15Å; E145-R148 PolarHBondContact OE1-NH2 3.18Å; E145-R148 IonicContact OE2-CZ 3.85Å; E145-R148 IonicContact OE2-NE 3.41Å; E145-R148 PolarHBondContact OE2-NE 2.73Å; E145-R148 IonicContact OE2-NH2 3.93Å; E145-R148 PolarHBondContact OE2-NH2 2.99Å; E145-Q149 WeakPolarHBondContact O-CG 3.28Å; E145-Q149 PolarHBondContact O-N 2.89Å; E145-Q149 VanDerWaalsContact O-N 3.11Å; E145-Q149 PolarHBondContact OE1-NE2 3.07Å
146	S	95.4	Very high	95	Very high	25 Å²	25	48.5 Å²	48.5	18%	0.175	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-40.4	174.4	-170	0	0	0	0	111.6	H142 L143 Q150 R172	H142-S146 WeakPolarHBondContact O-CB 3.3Å; H142-S146 PolarHBondContact O-N 3.39Å; L143-S146 PolarHBondContact O-N 2.86Å; S146-Q150 PolarHBondContact O-N 3.29Å; S146-R172 VanDerWaalsContact OG-CD 3.24Å; S146-R172 WeakPolarHBondContact OG-CD 3.42Å; S146-R172 PolarHBondContact OG-NH1 3.27Å
147	L	96.1	Very high	94.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-46.9	172.8	-81.4	165.4	0	0	0	111.7	I123 L143 E145 Q149 Q150 L151 I168 L169 R172 M197	I123-L147 HydrophobicContact CD1-CB 4.09Å; L143-L147 HydrophobicContact CD1-CD1 3.95Å; L143-L147 HydrophobicContact CD1-CG 4.22Å; L143-L147 HydrophobicContact CG-CD1 3.92Å; L143-L147 WeakPolarHBondContact O-CB 3.39Å; L143-L147 WeakPolarHBondContact O-CG 3.5Å; L143-L147 PolarHBondContact O-N 3.35Å; E145-L147 VanDerWaalsContact C-N 3.31Å; E145-L147 PolarHBondContact O-N 2.86Å; L147-Q149 VanDerWaalsContact C-N 3.3Å; L147-Q149 PolarHBondContact O-N 2.84Å; L147-Q150 PolarHBondContact O-N 3.4Å; L147-L151 HydrophobicContact CB-CD1 4.34Å; L147-L151 VanDerWaalsContact O-CB 3.31Å; L147-L151 WeakPolarHBondContact O-CB 3.43Å; L147-L151 WeakPolarHBondContact O-CG 3.39Å; L147-L151 PolarHBondContact O-N 2.94Å; L147-I168 HydrophobicContact CD2-CG2 4.08Å; L147-L169 HydrophobicContact CD1-CD2 3.86Å; L147-L169 HydrophobicContact CD2-CD2 3.89Å; L147-L169 HydrophobicContact CD2-CG 4.44Å; L147-R172 HydrophobicContact CD2-CB 3.69Å; L147-R172 HydrophobicContact CD2-CG 3.73Å; L147-R172 HydrophobicContact CG-CB 3.95Å; L147-R172 HydrophobicContact CG-CG 4.13Å; L147-M197 HydrophobicContact CD1-CE 3.73Å
148	R	95.5	Very high	93.2	Very high	68 Å²	68	56.1 Å²	56.1	26%	0.257	27%	0.268	S	S	.	.	H	α-helix	trans	-53.3	-48.7	179	-172.7	-178.5	70.7	78.6	-2	111.5	H120 I123 P144 E145 L151 Q152	H120-R148 WeakPolarHBondContact NE2-CG 3.26Å; I123-R148 HydrophobicContact CD1-CB 4.01Å; P144-R148 WeakPolarHBondContact O-CB 3.48Å; P144-R148 PolarHBondContact O-N 2.89Å; E145-R148 WeakPolarHBondContact O-CB 3.46Å; E145-R148 PolarHBondContact O-N 2.91Å; E145-R148 IonicContact OE1-CZ 3.41Å; E145-R148 IonicContact OE1-NE 3.29Å; E145-R148 PolarHBondContact OE1-NE 2.86Å; E145-R148 IonicContact OE1-NH2 3.15Å; E145-R148 PolarHBondContact OE1-NH2 3.18Å; E145-R148 IonicContact OE2-CZ 3.85Å; E145-R148 IonicContact OE2-NE 3.41Å; E145-R148 PolarHBondContact OE2-NE 2.73Å; E145-R148 IonicContact OE2-NH2 3.93Å; E145-R148 PolarHBondContact OE2-NH2 2.99Å; R148-L151 PolarHBondContact O-N 3.14Å; R148-Q152 WeakPolarHBondContact O-CB 3.27Å; R148-Q152 VanDerWaalsContact O-CG 3.26Å; R148-Q152 WeakPolarHBondContact O-CG 3.49Å; R148-Q152 PolarHBondContact O-N 3.04Å
149	Q	93.3	Very high	91.8	Very high	107 Å²	107	67 Å²	67	50%	0.5	31%	0.31	S	S	.	.	H	α-helix	trans	-62.6	-46	-179.4	-67.2	174	9.9	0	0	112.2	E145 L147 Q152 A153	E145-Q149 WeakPolarHBondContact O-CG 3.28Å; E145-Q149 PolarHBondContact O-N 2.89Å; E145-Q149 VanDerWaalsContact O-N 3.11Å; E145-Q149 PolarHBondContact OE1-NE2 3.07Å; L147-Q149 VanDerWaalsContact C-N 3.3Å; L147-Q149 PolarHBondContact O-N 2.84Å; Q149-Q152 PolarHBondContact O-N 3.39Å; Q149-A153 PolarHBondContact O-N 3.16Å; Q149-A153 VanDerWaalsContact O-N 3.13Å
150	Q	93.2	Very high	90.1	Very high	68 Å²	68	76.3 Å²	76.3	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-67.6	-40.1	178.6	-72.3	-165.4	-18.2	0	0	112.7	S146 L147 A153 F154 I168	S146-Q150 PolarHBondContact O-N 3.29Å; L147-Q150 PolarHBondContact O-N 3.4Å; Q150-A153 PolarHBondContact O-N 3.13Å; Q150-F154 WeakPolarHBondContact O-CB 3.42Å; Q150-F154 PolarHBondContact O-N 3.13Å; Q150-I168 HydrophobicContact CB-CG2 4.18Å
151	L	94.1	Very high	88.9	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-38.1	177.4	-70	167.8	0	0	0	111.5	H120 P121 I123 L147 R148 F154 E155 Y165 I168 L199	H120-L151 HydrophobicContact CB-CB 3.85Å; P121-L151 HydrophobicContact CG-CD2 4.47Å; I123-L151 HydrophobicContact CD1-CD1 3.93Å; I123-L151 HydrophobicContact CG1-CD1 4.27Å; L147-L151 HydrophobicContact CB-CD1 4.34Å; L147-L151 VanDerWaalsContact O-CB 3.31Å; L147-L151 WeakPolarHBondContact O-CB 3.43Å; L147-L151 WeakPolarHBondContact O-CG 3.39Å; L147-L151 PolarHBondContact O-N 2.94Å; R148-L151 PolarHBondContact O-N 3.14Å; L151-F154 PolarHBondContact O-N 3.46Å; L151-E155 WeakPolarHBondContact O-CG 3.3Å; L151-E155 PolarHBondContact O-N 2.79Å; L151-Y165 HydrophobicContact CD2-CD1 3.54Å; L151-Y165 HydrophobicContact CD2-CE1 3.87Å; L151-I168 HydrophobicContact CD2-CD1 4.15Å; L151-I168 HydrophobicContact CD2-CG2 4.17Å; L151-I168 HydrophobicContact CG-CG2 4.42Å; L151-L199 HydrophobicContact CD1-CD1 3.94Å; L151-L199 HydrophobicContact CD1-CD2 3.78Å; L151-L199 HydrophobicContact CD2-CD1 4.08Å
152	Q	92.5	Very high	88	Confident	45 Å²	45	77.4 Å²	77.4	21%	0.21	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-40.2	174	-77.6	-178.7	-28.2	0	0	112.5	S119 H120 R148 Q149 R156	S119-Q152 PolarHBondContact OG-NE2 3.12Å; S119-Q152 VanDerWaalsContact OG-NE2 3.08Å; H120-Q152 HydrophobicContact CB-CG 4.05Å; R148-Q152 WeakPolarHBondContact O-CB 3.27Å; R148-Q152 VanDerWaalsContact O-CG 3.26Å; R148-Q152 WeakPolarHBondContact O-CG 3.49Å; R148-Q152 PolarHBondContact O-N 3.04Å; Q149-Q152 PolarHBondContact O-N 3.39Å; Q152-R156 WeakPolarHBondContact O-CG 3.31Å; Q152-R156 PolarHBondContact O-N 3.16Å
153	A	90.5	Very high	87.4	Confident	49 Å²	49	77.1 Å²	77.1	41%	0.405	38%	0.376	S	S	.	.	H	α-helix	trans	-65.2	-46.4	173.7	0	0	0	0	0	110.8	Q149 Q150 E155 R156 E157	Q149-A153 PolarHBondContact O-N 3.16Å; Q149-A153 VanDerWaalsContact O-N 3.13Å; Q150-A153 PolarHBondContact O-N 3.13Å; A153-E155 PolarHBondContact O-N 3.47Å; A153-R156 WeakPolarHBondContact O-CB 3.34Å; A153-R156 PolarHBondContact O-N 3.18Å; A153-E157 PolarHBondContact O-N 2.85Å
154	F	90.8	Very high	87.1	Confident	24 Å²	24	79.9 Å²	79.9	11%	0.105	40%	0.395	C	S	.	.	H	α-helix	trans	-59.7	-45.6	178.5	175.4	-104.5	0	0	0	113	Q150 L151 R156 E157 K158 V163 Y165 I168	Q150-F154 WeakPolarHBondContact O-CB 3.42Å; Q150-F154 PolarHBondContact O-N 3.13Å; L151-F154 PolarHBondContact O-N 3.46Å; F154-R156 PolarHBondContact O-N 2.81Å; F154-E157 CarbonylContact O-C 3.54Å; F154-E157 PolarHBondContact O-N 2.88Å; F154-E157 VanDerWaalsContact O-N 3.09Å; F154-K158 HydrophobicContact CE1-CD 4.08Å; F154-K158 HydrophobicContact CE1-CG 3.98Å; F154-K158 HydrophobicContact CZ-CG 3.97Å; F154-K158 WeakPolarHBondContact O-CA 3.42Å; F154-K158 WeakPolarHBondContact O-CB 3.42Å; F154-K158 PolarHBondContact O-N 2.93Å; F154-V163 HydrophobicContact CD2-CB 4.32Å; F154-V163 HydrophobicContact CD2-CG1 4.48Å; F154-V163 HydrophobicContact CE2-CB 3.97Å; F154-V163 HydrophobicContact CE2-CG1 4.39Å; F154-V163 WeakPolarHBondContact CE2-O 3.39Å; F154-V163 WeakPolarHBondContact CZ-O 3.48Å; F154-Y165 HydrophobicContact CD1-CD1 4.13Å; F154-Y165 AromaticContact CD1-CE1 3.71Å; F154-Y165 HydrophobicContact CD1-CE1 3.71Å; F154-Y165 AromaticContact CE1-CD1 3.9Å; F154-Y165 HydrophobicContact CE1-CD1 3.9Å; F154-Y165 AromaticContact CE1-CE1 3.53Å; F154-Y165 HydrophobicContact CE1-CE1 3.53Å; F154-I168 HydrophobicContact CB-CD1 3.84Å; F154-I168 HydrophobicContact CD1-CD1 4.02Å; F154-I168 HydrophobicContact CD2-CD1 3.91Å; F154-I168 HydrophobicContact CG-CD1 3.64Å
155	E	88.3	Confident	87	Confident	54 Å²	54	80.3 Å²	80.3	25%	0.252	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-27.3	179.5	-75.4	-55.7	135.7	0	0	113.2	L151 A153 K158 Y165	L151-E155 WeakPolarHBondContact O-CG 3.3Å; L151-E155 PolarHBondContact O-N 2.79Å; A153-E155 PolarHBondContact O-N 3.47Å; E155-K158 IonicContact OE1-NZ 3.85Å; E155-K158 PolarHBondContact OE1-NZ 2.88Å; E155-K158 VanDerWaalsContact OE2-CD 3.31Å; E155-K158 WeakPolarHBondContact OE2-CD 3.38Å; E155-K158 IonicContact OE2-NZ 3.69Å; E155-K158 PolarHBondContact OE2-NZ 3.49Å; E155-K158 VanDerWaalsContact OE2-NZ 3.13Å; E155-Y165 VanDerWaalsContact OE1-CE1 3.3Å; E155-Y165 WeakPolarHBondContact OE1-CE1 3.43Å; E155-Y165 VanDerWaalsContact OE1-CZ 3.26Å; E155-Y165 PolarHBondContact OE1-OH 3.29Å
156	R	86.8	Confident	87.1	Confident	216 Å²	216	78.4 Å²	78.4	82%	0.815	39%	0.391	S	S	*	.	H	α-helix	trans	-71.5	-30.9	175.5	-68.7	171.9	-176.7	-160.5	1.1	112.6	Q152 A153 F154	Q152-R156 WeakPolarHBondContact O-CG 3.31Å; Q152-R156 PolarHBondContact O-N 3.16Å; A153-R156 WeakPolarHBondContact O-CB 3.34Å; A153-R156 PolarHBondContact O-N 3.18Å; F154-R156 PolarHBondContact O-N 2.81Å
157	E	84.2	Confident	87.1	Confident	142 Å²	142	78.5 Å²	78.5	66%	0.664	39%	0.392	S	S	*	.	H	α-helix	trans	-111.6	1.4	-171.9	-63.6	174.7	-167.8	0	0	113	A153 F154 R159 E160	A153-E157 PolarHBondContact O-N 2.85Å; F154-E157 CarbonylContact O-C 3.54Å; F154-E157 PolarHBondContact O-N 2.88Å; F154-E157 VanDerWaalsContact O-N 3.09Å; E157-R159 PolarHBondContact O-N 3.47Å; E157-E160 PolarHBondContact O-N 2.99Å; E157-E160 VanDerWaalsContact O-N 3.12Å
158	K	76.3	Confident	87.2	Confident	85 Å²	85	78.9 Å²	78.9	37%	0.37	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-50.6	-32.1	-167.2	-172	171.3	-172.9	168	0	116.1	F154 E155 E160 Y165	F154-K158 HydrophobicContact CE1-CD 4.08Å; F154-K158 HydrophobicContact CE1-CG 3.98Å; F154-K158 HydrophobicContact CZ-CG 3.97Å; F154-K158 WeakPolarHBondContact O-CA 3.42Å; F154-K158 WeakPolarHBondContact O-CB 3.42Å; F154-K158 PolarHBondContact O-N 2.93Å; E155-K158 IonicContact OE1-NZ 3.85Å; E155-K158 PolarHBondContact OE1-NZ 2.88Å; E155-K158 VanDerWaalsContact OE2-CD 3.31Å; E155-K158 WeakPolarHBondContact OE2-CD 3.38Å; E155-K158 IonicContact OE2-NZ 3.69Å; E155-K158 PolarHBondContact OE2-NZ 3.49Å; E155-K158 VanDerWaalsContact OE2-NZ 3.13Å; K158-E160 PolarHBondContact O-N 3.46Å; K158-Y165 PolarHBondContact NZ-OH 2.82Å
159	R	67.4	Low	87.2	Confident	255 Å²	255	75.7 Å²	75.7	96%	0.962	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-67.2	-18.9	-176	-68.2	-174	-171.8	173.4	3.7	113.6	E157	E157-R159 PolarHBondContact O-N 3.47Å
160	E	64.9	Low	87.5	Confident	194 Å²	194	74.5 Å²	74.5	91%	0.907	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-116	-1.2	-174.8	-63.1	179.8	-178	0	0	112.8	E157 K158	E157-E160 PolarHBondContact O-N 2.99Å; E157-E160 VanDerWaalsContact O-N 3.12Å; K158-E160 PolarHBondContact O-N 3.46Å
161	S	72.8	Confident	87.7	Confident	47 Å²	47	76.5 Å²	76.5	33%	0.329	39%	0.386	S	S	.	.			trans	-98.2	132.9	-171.3	-169.9	0	0	0	0	112.9	V163	S161-V163 WeakPolarHBondContact OG-CB 3.37Å; S161-V163 WeakPolarHBondContact OG-CG2 3.24Å; S161-V163 PolarHBondContact OG-N 3.33Å
162	A	77.3	Confident	87.9	Confident	112 Å²	112	78.4 Å²	78.4	93%	0.926	39%	0.393	S	S	*	.			trans	-80.7	-3.5	169.1	0	0	0	0	0	113
163	V	86.2	Confident	88.2	Confident	63 Å²	63	76.2 Å²	76.2	38%	0.382	38%	0.383	S	S	.	.			trans	-76.4	140.1	-177.6	-178.4	0	0	0	0	109.8	F154 S161 S167 I168	F154-V163 HydrophobicContact CD2-CB 4.32Å; F154-V163 HydrophobicContact CD2-CG1 4.48Å; F154-V163 HydrophobicContact CE2-CB 3.97Å; F154-V163 HydrophobicContact CE2-CG1 4.39Å; F154-V163 WeakPolarHBondContact CE2-O 3.39Å; F154-V163 WeakPolarHBondContact CZ-O 3.48Å; S161-V163 WeakPolarHBondContact OG-CB 3.37Å; S161-V163 WeakPolarHBondContact OG-CG2 3.24Å; S161-V163 PolarHBondContact OG-N 3.33Å; V163-S167 WeakPolarHBondContact CG1-OG 3.25Å; V163-I168 HydrophobicContact CG1-CD1 3.91Å; V163-I168 HydrophobicContact CG1-CG1 3.59Å
164	S	92.1	Very high	88.6	Confident	57 Å²	57	76.1 Å²	76.1	40%	0.399	38%	0.375	S	S	.	.			trans	-110.1	161.4	175.8	66.2	0	0	0	0	111.5	A166 S167 I168	S164-A166 PolarHBondContact O-N 2.93Å; S164-S167 PolarHBondContact N-OG 3.36Å; S164-S167 PolarHBondContact O-N 3.23Å; S164-S167 VanDerWaalsContact O-N 3.15Å; S164-S167 PolarHBondContact O-OG 2.96Å; S164-S167 PolarHBondContact OG-N 2.94Å; S164-S167 PolarHBondContact OG-OG 3.38Å; S164-I168 WeakPolarHBondContact O-CG1 3.18Å; S164-I168 PolarHBondContact O-N 3.11Å; S164-I168 VanDerWaalsContact O-N 3.09Å
165	Y	95.1	Very high	88.9	Confident	12 Å²	12	75.1 Å²	75.1	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-56.9	-36.1	171	-64.6	-36	0	0	0	112.5	P121 L151 F154 E155 K158 S167 I168 L169 L199 E204	P121-Y165 HydrophobicContact CG-CD1 4.29Å; P121-Y165 HydrophobicContact CG-CE1 3.58Å; P121-Y165 HydrophobicContact CG-CE2 3.91Å; P121-Y165 WeakPolarHBondContact CG-OH 3.41Å; L151-Y165 HydrophobicContact CD2-CD1 3.54Å; L151-Y165 HydrophobicContact CD2-CE1 3.87Å; F154-Y165 HydrophobicContact CD1-CD1 4.13Å; F154-Y165 AromaticContact CD1-CE1 3.71Å; F154-Y165 HydrophobicContact CD1-CE1 3.71Å; F154-Y165 AromaticContact CE1-CD1 3.9Å; F154-Y165 HydrophobicContact CE1-CD1 3.9Å; F154-Y165 AromaticContact CE1-CE1 3.53Å; F154-Y165 HydrophobicContact CE1-CE1 3.53Å; E155-Y165 VanDerWaalsContact OE1-CE1 3.3Å; E155-Y165 WeakPolarHBondContact OE1-CE1 3.43Å; E155-Y165 VanDerWaalsContact OE1-CZ 3.26Å; E155-Y165 PolarHBondContact OE1-OH 3.29Å; K158-Y165 PolarHBondContact NZ-OH 2.82Å; Y165-S167 PolarHBondContact O-N 2.89Å; Y165-I168 PolarHBondContact O-N 2.75Å; Y165-L169 WeakPolarHBondContact O-CB 3.43Å; Y165-L169 PolarHBondContact O-N 3.43Å; Y165-L199 HydrophobicContact CG-CD1 4.46Å; Y165-E204 WeakPolarHBondContact CD2-OE1 3.24Å
166	A	96.7	Very high	89.4	Confident	23 Å²	23	72.6 Å²	72.6	19%	0.19	36%	0.359	C	S	.	.	H	α-helix	trans	-58.5	-48	175.9	0	0	0	0	0	111.5	S164 I168 L169 E170 T206 I284	S164-A166 PolarHBondContact O-N 2.93Å; A166-I168 VanDerWaalsContact C-N 3.35Å; A166-I168 PolarHBondContact O-N 3.47Å; A166-L169 PolarHBondContact O-N 3.29Å; A166-E170 PolarHBondContact O-N 2.97Å; A166-T206 HydrophobicContact CB-CG2 4.24Å; A166-I284 HydrophobicContact CB-CG2 3.77Å; A166-I284 VanDerWaalsContact O-CD1 3.25Å; A166-I284 WeakPolarHBondContact O-CD1 3.35Å
167	S	96.1	Very high	90	Very high	28 Å²	28	62.4 Å²	62.4	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-34.9	177.5	53.2	0	0	0	0	113.4	V163 S164 Y165 Q171	V163-S167 WeakPolarHBondContact CG1-OG 3.25Å; S164-S167 PolarHBondContact N-OG 3.36Å; S164-S167 PolarHBondContact O-N 3.23Å; S164-S167 VanDerWaalsContact O-N 3.15Å; S164-S167 PolarHBondContact O-OG 2.96Å; S164-S167 PolarHBondContact OG-N 2.94Å; S164-S167 PolarHBondContact OG-OG 3.38Å; Y165-S167 PolarHBondContact O-N 2.89Å; S167-Q171 WeakPolarHBondContact O-CB 3.5Å; S167-Q171 WeakPolarHBondContact O-CG 3.15Å; S167-Q171 PolarHBondContact O-N 3.44Å; S167-Q171 VanDerWaalsContact O-N 3.09Å
168	I	96.7	Very high	90.7	Very high	8 Å²	8	63.6 Å²	63.6	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-45.1	176.4	-66.1	168.7	0	0	0	110.2	L147 Q150 L151 F154 V163 S164 Y165 A166 Q171 R172	L147-I168 HydrophobicContact CD2-CG2 4.08Å; Q150-I168 HydrophobicContact CB-CG2 4.18Å; L151-I168 HydrophobicContact CD2-CD1 4.15Å; L151-I168 HydrophobicContact CD2-CG2 4.17Å; L151-I168 HydrophobicContact CG-CG2 4.42Å; F154-I168 HydrophobicContact CB-CD1 3.84Å; F154-I168 HydrophobicContact CD1-CD1 4.02Å; F154-I168 HydrophobicContact CD2-CD1 3.91Å; F154-I168 HydrophobicContact CG-CD1 3.64Å; V163-I168 HydrophobicContact CG1-CD1 3.91Å; V163-I168 HydrophobicContact CG1-CG1 3.59Å; S164-I168 WeakPolarHBondContact O-CG1 3.18Å; S164-I168 PolarHBondContact O-N 3.11Å; S164-I168 VanDerWaalsContact O-N 3.09Å; Y165-I168 PolarHBondContact O-N 2.75Å; A166-I168 VanDerWaalsContact C-N 3.35Å; A166-I168 PolarHBondContact O-N 3.47Å; I168-Q171 PolarHBondContact O-N 2.95Å; I168-R172 HydrophobicContact CG2-CG 4.49Å; I168-R172 WeakPolarHBondContact O-CB 3.21Å; I168-R172 WeakPolarHBondContact O-CG 3.29Å; I168-R172 PolarHBondContact O-N 2.87Å
169	L	97.2	Very high	91.7	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-57.7	-51.9	176	-83.4	167.6	0	0	0	111.9	L147 Y165 A166 Q171 R172 I173 M197 L199 T206 A208 I284	L147-L169 HydrophobicContact CD1-CD2 3.86Å; L147-L169 HydrophobicContact CD2-CD2 3.89Å; L147-L169 HydrophobicContact CD2-CG 4.44Å; Y165-L169 WeakPolarHBondContact O-CB 3.43Å; Y165-L169 PolarHBondContact O-N 3.43Å; A166-L169 PolarHBondContact O-N 3.29Å; L169-Q171 PolarHBondContact O-N 2.82Å; L169-R172 PolarHBondContact O-N 2.64Å; L169-I173 WeakPolarHBondContact O-CB 3.29Å; L169-I173 VanDerWaalsContact O-CG1 3.3Å; L169-I173 WeakPolarHBondContact O-CG1 3.12Å; L169-I173 PolarHBondContact O-N 2.86Å; L169-M197 HydrophobicContact CD2-CB 4.04Å; L169-L199 HydrophobicContact CD1-CD1 3.61Å; L169-L199 HydrophobicContact CD1-CG 3.83Å; L169-L199 HydrophobicContact CD2-CD1 3.83Å; L169-L199 HydrophobicContact CD2-CD2 4.35Å; L169-L199 HydrophobicContact CD2-CG 3.92Å; L169-L199 HydrophobicContact CG-CD1 3.49Å; L169-L199 VanDerWaalsContact CG-CD1 3.49Å; L169-L199 HydrophobicContact CG-CG 4.01Å; L169-T206 HydrophobicContact CD1-CG2 3.61Å; L169-A208 HydrophobicContact CB-CB 4.34Å; L169-A208 HydrophobicContact CD1-CB 4.16Å; L169-I284 HydrophobicContact CB-CD1 4.17Å
170	E	98.3	Very high	93.1	Very high	82 Å²	82	51.4 Å²	51.4	38%	0.383	28%	0.275	S	S	.	.	H	α-helix	trans	-55.7	-52.6	179.5	-173.9	177.6	-152.5	0	0	111.2	A166 R172 I173 L174 P282 I284	A166-E170 PolarHBondContact O-N 2.97Å; E170-R172 VanDerWaalsContact C-N 3.26Å; E170-R172 PolarHBondContact O-N 3.46Å; E170-I173 PolarHBondContact O-N 3.05Å; E170-L174 HydrophobicContact CG-CD1 3.99Å; E170-L174 WeakPolarHBondContact O-CB 3.38Å; E170-L174 VanDerWaalsContact O-CG 3.28Å; E170-L174 WeakPolarHBondContact O-CG 3.25Å; E170-L174 PolarHBondContact O-N 3.37Å; E170-P282 HydrophobicContact CB-CG 4.36Å; E170-P282 HydrophobicContact CG-CG 4.19Å; E170-I284 HydrophobicContact CB-CD1 3.75Å
171	Q	97.9	Very high	94.7	Very high	111 Å²	111	43.7 Å²	43.7	52%	0.519	24%	0.24	S	C	.	.	H	α-helix	trans	-62.3	-33.2	-178.5	-71.6	174.4	18.7	0	0	113	S167 I168 L169 A175	S167-Q171 WeakPolarHBondContact O-CB 3.5Å; S167-Q171 WeakPolarHBondContact O-CG 3.15Å; S167-Q171 PolarHBondContact O-N 3.44Å; S167-Q171 VanDerWaalsContact O-N 3.09Å; I168-Q171 PolarHBondContact O-N 2.95Å; L169-Q171 PolarHBondContact O-N 2.82Å; Q171-A175 VanDerWaalsContact O-CB 3.23Å; Q171-A175 WeakPolarHBondContact O-CB 3.41Å; Q171-A175 PolarHBondContact O-N 2.79Å
172	R	98	Very high	95.7	Very high	39 Å²	39	47 Å²	47	15%	0.147	25%	0.254	C	S	.	.	H	α-helix	trans	-77.2	-44.2	178.2	-74.1	-64.7	81.8	-157.8	-8.2	113.6	L143 S146 L147 I168 L169 E170 L174 A175 V176	L143-R172 HydrophobicContact CD1-CB 3.93Å; S146-R172 VanDerWaalsContact OG-CD 3.24Å; S146-R172 WeakPolarHBondContact OG-CD 3.42Å; S146-R172 PolarHBondContact OG-NH1 3.27Å; L147-R172 HydrophobicContact CD2-CB 3.69Å; L147-R172 HydrophobicContact CD2-CG 3.73Å; L147-R172 HydrophobicContact CG-CB 3.95Å; L147-R172 HydrophobicContact CG-CG 4.13Å; I168-R172 HydrophobicContact CG2-CG 4.49Å; I168-R172 WeakPolarHBondContact O-CB 3.21Å; I168-R172 WeakPolarHBondContact O-CG 3.29Å; I168-R172 PolarHBondContact O-N 2.87Å; L169-R172 PolarHBondContact O-N 2.64Å; E170-R172 VanDerWaalsContact C-N 3.26Å; E170-R172 PolarHBondContact O-N 3.46Å; R172-L174 VanDerWaalsContact C-N 3.34Å; R172-L174 PolarHBondContact O-N 2.92Å; R172-A175 PolarHBondContact O-N 2.99Å; R172-V176 WeakPolarHBondContact O-CB 3.45Å; R172-V176 WeakPolarHBondContact O-CG2 3.25Å; R172-V176 PolarHBondContact O-N 3.33Å
173	I	98.7	Very high	96.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-51	175.1	-70.6	168.6	0	0	0	109.7	L143 L169 E170 A175 V176 D177 A208 V210 L267 P282	L143-I173 HydrophobicContact CD1-CG1 4.19Å; L143-I173 HydrophobicContact CD2-CG1 4.01Å; L169-I173 WeakPolarHBondContact O-CB 3.29Å; L169-I173 VanDerWaalsContact O-CG1 3.3Å; L169-I173 WeakPolarHBondContact O-CG1 3.12Å; L169-I173 PolarHBondContact O-N 2.86Å; E170-I173 PolarHBondContact O-N 3.05Å; I173-A175 VanDerWaalsContact C-N 3.31Å; I173-A175 PolarHBondContact O-N 3.43Å; I173-V176 PolarHBondContact O-N 2.79Å; I173-D177 WeakPolarHBondContact O-CB 3.49Å; I173-D177 PolarHBondContact O-N 3.49Å; I173-A208 HydrophobicContact CD1-CB 3.65Å; I173-V210 HydrophobicContact CG2-CG2 3.98Å; I173-L267 HydrophobicContact CG2-CD2 3.8Å; I173-P282 HydrophobicContact CD1-CB 4.06Å; I173-P282 HydrophobicContact CD1-CG 4.14Å; I173-P282 HydrophobicContact CG2-CG 4.46Å
174	L	98.7	Very high	97.1	Very high	46 Å²	46	44 Å²	44	24%	0.241	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-32.1	-179	-67	178.5	0	0	0	113.7	E170 R172 R178 P280	E170-L174 HydrophobicContact CG-CD1 3.99Å; E170-L174 WeakPolarHBondContact O-CB 3.38Å; E170-L174 VanDerWaalsContact O-CG 3.28Å; E170-L174 WeakPolarHBondContact O-CG 3.25Å; E170-L174 PolarHBondContact O-N 3.37Å; R172-L174 VanDerWaalsContact C-N 3.34Å; R172-L174 PolarHBondContact O-N 2.92Å; L174-R178 WeakPolarHBondContact O-CG 3.5Å; L174-R178 PolarHBondContact O-N 2.79Å; L174-R178 PolarHBondContact O-NE 2.88Å; L174-P280 HydrophobicContact CD2-CB 4.21Å; L174-P280 HydrophobicContact CD2-CG 3.73Å
175	A	98.4	Very high	97.2	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-78.5	-44.2	178.7	0	0	0	0	0	112.9	Q171 R172 I173 D177 R178 E179	Q171-A175 VanDerWaalsContact O-CB 3.23Å; Q171-A175 WeakPolarHBondContact O-CB 3.41Å; Q171-A175 PolarHBondContact O-N 2.79Å; R172-A175 PolarHBondContact O-N 2.99Å; I173-A175 VanDerWaalsContact C-N 3.31Å; I173-A175 PolarHBondContact O-N 3.43Å; A175-D177 PolarHBondContact O-N 3.37Å; A175-R178 PolarHBondContact O-N 3.35Å; A175-R178 VanDerWaalsContact O-N 3.17Å; A175-E179 WeakPolarHBondContact O-CG 3.42Å; A175-E179 PolarHBondContact O-N 3.09Å
176	V	98.3	Very high	97.2	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-37.4	175.8	171.1	0	0	0	0	110.2	Y138 H142 L143 R172 I173 E179 M180	Y138-V176 HydrophobicContact CD1-CG1 4.18Å; Y138-V176 HydrophobicContact CE1-CG1 4.03Å; H142-V176 HydrophobicContact CB-CG1 4.34Å; L143-V176 HydrophobicContact CB-CG1 4.23Å; L143-V176 HydrophobicContact CB-CG2 4.25Å; L143-V176 HydrophobicContact CD1-CB 4.24Å; L143-V176 HydrophobicContact CD1-CG2 3.85Å; R172-V176 WeakPolarHBondContact O-CB 3.45Å; R172-V176 WeakPolarHBondContact O-CG2 3.25Å; R172-V176 PolarHBondContact O-N 3.33Å; I173-V176 PolarHBondContact O-N 2.79Å; V176-E179 PolarHBondContact O-N 2.67Å; V176-M180 HydrophobicContact CG1-CE 4.49Å; V176-M180 VanDerWaalsContact O-CB 3.24Å; V176-M180 WeakPolarHBondContact O-CB 3.31Å; V176-M180 PolarHBondContact O-N 3.34Å
177	D	98.6	Very high	97.2	Very high	3 Å²	3	51 Å²	51	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-48.1	173.6	-169.1	59.1	0	0	0	112.5	I173 A175 E179 M180 L181 L267 G268 K273 P280	I173-D177 WeakPolarHBondContact O-CB 3.49Å; I173-D177 PolarHBondContact O-N 3.49Å; A175-D177 PolarHBondContact O-N 3.37Å; D177-E179 VanDerWaalsContact C-N 3.34Å; D177-E179 PolarHBondContact O-N 2.93Å; D177-M180 WeakPolarHBondContact O-CB 3.11Å; D177-M180 PolarHBondContact O-N 3.09Å; D177-M180 VanDerWaalsContact O-N 3.13Å; D177-L181 VanDerWaalsContact O-CG 3.27Å; D177-L181 WeakPolarHBondContact O-CG 3.22Å; D177-L181 PolarHBondContact O-N 3.49Å; D177-L267 HydrophobicContact CB-CD2 4.06Å; D177-L267 WeakPolarHBondContact OD1-CA 3.39Å; D177-L267 WeakPolarHBondContact OD1-CB 3.4Å; D177-G268 PolarHBondContact OD1-N 2.98Å; D177-K273 IonicContact OD1-NZ 3.01Å; D177-K273 PolarHBondContact OD1-NZ 3.26Å; D177-K273 IonicContact OD2-NZ 2.78Å; D177-K273 PolarHBondContact OD2-NZ 3.46Å; D177-P280 HydrophobicContact CB-CB 3.96Å; D177-P280 HydrophobicContact CB-CG 4.45Å; D177-P280 WeakPolarHBondContact OD2-CB 3.31Å; D177-P280 VanDerWaalsContact OD2-CG 3.31Å; D177-P280 WeakPolarHBondContact OD2-CG 3.41Å
178	R	98.3	Very high	97.2	Very high	166 Å²	166	56.9 Å²	56.9	63%	0.626	28%	0.283	S	S	*	.	H	α-helix	trans	-58.1	-46.4	177	-74.9	-176.4	-65.4	167.8	2.1	112	L174 A175 M180 L181 D182	L174-R178 WeakPolarHBondContact O-CG 3.5Å; L174-R178 PolarHBondContact O-N 2.79Å; L174-R178 PolarHBondContact O-NE 2.88Å; A175-R178 PolarHBondContact O-N 3.35Å; A175-R178 VanDerWaalsContact O-N 3.17Å; R178-M180 VanDerWaalsContact C-N 3.29Å; R178-M180 PolarHBondContact O-N 2.91Å; R178-L181 PolarHBondContact O-N 2.99Å; R178-D182 PolarHBondContact O-N 3.17Å
179	E	97.6	Very high	97.2	Very high	85 Å²	85	58.8 Å²	58.8	40%	0.397	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-35	177	-67.1	167.6	-157.7	0	0	112.4	A175 V176 D177	A175-E179 WeakPolarHBondContact O-CG 3.42Å; A175-E179 PolarHBondContact O-N 3.09Å; V176-E179 PolarHBondContact O-N 2.67Å; D177-E179 VanDerWaalsContact C-N 3.34Å; D177-E179 PolarHBondContact O-N 2.93Å
180	M	97.7	Very high	97.2	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-68.2	-44.7	176	-172.2	-166.9	-59.3	0	0	111.1	A135 Y138 A139 V176 D177 R178 D182 K183 L184 L267	A135-M180 HydrophobicContact CB-SD 3.89Å; Y138-M180 HydrophobicContact CD1-CB 3.56Å; Y138-M180 HydrophobicContact CD1-CE 3.71Å; Y138-M180 HydrophobicContact CD1-CG 3.62Å; Y138-M180 HydrophobicContact CD1-SD 4.45Å; Y138-M180 HydrophobicContact CE1-CB 3.7Å; Y138-M180 HydrophobicContact CE1-CG 4.24Å; Y138-M180 HydrophobicContact CG-CB 4.27Å; Y138-M180 HydrophobicContact CG-CE 4.34Å; Y138-M180 HydrophobicContact CG-CG 3.89Å; A139-M180 HydrophobicContact CB-CE 3.9Å; V176-M180 HydrophobicContact CG1-CE 4.49Å; V176-M180 VanDerWaalsContact O-CB 3.24Å; V176-M180 WeakPolarHBondContact O-CB 3.31Å; V176-M180 PolarHBondContact O-N 3.34Å; D177-M180 WeakPolarHBondContact O-CB 3.11Å; D177-M180 PolarHBondContact O-N 3.09Å; D177-M180 VanDerWaalsContact O-N 3.13Å; R178-M180 VanDerWaalsContact C-N 3.29Å; R178-M180 PolarHBondContact O-N 2.91Å; M180-D182 VanDerWaalsContact C-N 3.32Å; M180-D182 PolarHBondContact O-N 3.39Å; M180-K183 PolarHBondContact O-N 3.03Å; M180-K183 VanDerWaalsContact O-N 3.11Å; M180-L184 HydrophobicContact CG-CD1 3.69Å; M180-L184 HydrophobicContact CG-CG 4.06Å; M180-L184 WeakPolarHBondContact O-CB 3.49Å; M180-L184 WeakPolarHBondContact O-CG 3.39Å; M180-L184 PolarHBondContact O-N 3.4Å; M180-L184 HydrophobicContact SD-CD1 3.98Å; M180-L267 HydrophobicContact CE-CB 4.04Å; M180-L267 HydrophobicContact CE-CD1 4.35Å; M180-L267 HydrophobicContact SD-CB 4.32Å
181	L	97.1	Very high	97.2	Very high	32 Å²	32	60.6 Å²	60.6	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-60.4	-40	179.7	-69.9	173.6	0	0	0	112.5	D177 R178 K183 L184 S185 G268 K273	D177-L181 VanDerWaalsContact O-CG 3.27Å; D177-L181 WeakPolarHBondContact O-CG 3.22Å; D177-L181 PolarHBondContact O-N 3.49Å; R178-L181 PolarHBondContact O-N 2.99Å; L181-K183 VanDerWaalsContact C-N 3.26Å; L181-K183 PolarHBondContact O-N 2.99Å; L181-L184 PolarHBondContact O-N 2.92Å; L181-S185 VanDerWaalsContact O-CB 3.22Å; L181-S185 WeakPolarHBondContact O-CB 3.48Å; L181-S185 PolarHBondContact O-N 3.2Å; L181-S185 PolarHBondContact O-OG 3.14Å; L181-G268 WeakPolarHBondContact CD2-O 3.11Å; L181-K273 HydrophobicContact CD1-CD 3.78Å; L181-K273 HydrophobicContact CD2-CD 3.98Å; L181-K273 HydrophobicContact CG-CD 4.45Å
182	D	95.5	Very high	97.3	Very high	116 Å²	116	55.3 Å²	55.3	62%	0.62	28%	0.277	S	S	*	.	H	α-helix	trans	-59.8	-39.4	176.1	-70.1	-20.8	0	0	0	111.3	R178 M180 S185 A186	R178-D182 PolarHBondContact O-N 3.17Å; M180-D182 VanDerWaalsContact C-N 3.32Å; M180-D182 PolarHBondContact O-N 3.39Å; D182-S185 PolarHBondContact O-OG 3.1Å; D182-A186 WeakPolarHBondContact O-CB 3.29Å; D182-A186 PolarHBondContact O-N 2.92Å
183	K	95.6	Very high	97.3	Very high	103 Å²	103	53.4 Å²	53.4	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-76	-45.4	179.2	-70.1	175.6	179.3	171.2	0	112.7	Y138 M180 L181 A186 N187	Y138-K183 HydrophobicContact CD2-CD 4.2Å; Y138-K183 HydrophobicContact CE2-CD 3.33Å; Y138-K183 PolarHBondContact OH-NZ 3.08Å; M180-K183 PolarHBondContact O-N 3.03Å; M180-K183 VanDerWaalsContact O-N 3.11Å; L181-K183 VanDerWaalsContact C-N 3.26Å; L181-K183 PolarHBondContact O-N 2.99Å; K183-A186 PolarHBondContact O-N 3.04Å; K183-N187 PolarHBondContact O-N 3.16Å; K183-N187 PolarHBondContact O-ND2 2.76Å
184	L	96.1	Very high	97.3	Very high	10 Å²	10	53.4 Å²	53.4	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-46	179.8	-72.8	179.3	0	0	0	111.1	A134 A135 M180 L181 A186 N187 H188 D189 A191 Y270	A134-L184 HydrophobicContact CB-CD2 4.08Å; A135-L184 HydrophobicContact CB-CD1 4.29Å; M180-L184 HydrophobicContact CG-CD1 3.69Å; M180-L184 HydrophobicContact CG-CG 4.06Å; M180-L184 WeakPolarHBondContact O-CB 3.49Å; M180-L184 WeakPolarHBondContact O-CG 3.39Å; M180-L184 PolarHBondContact O-N 3.4Å; M180-L184 HydrophobicContact SD-CD1 3.98Å; L181-L184 PolarHBondContact O-N 2.92Å; L184-A186 PolarHBondContact O-N 3.04Å; L184-N187 CarbonylContact O-C 3.53Å; L184-N187 PolarHBondContact O-N 3.37Å; L184-N187 VanDerWaalsContact O-N 3.16Å; L184-H188 PolarHBondContact O-N 2.79Å; L184-D189 WeakPolarHBondContact CB-O 3.4Å; L184-D189 HydrophobicContact CD2-CB 3.81Å; L184-D189 PolarHBondContact O-N 2.8Å; L184-A191 WeakPolarHBondContact CD1-O 3.21Å; L184-Y270 HydrophobicContact CB-CD1 4.39Å
185	S	94.8	Very high	97.3	Very high	46 Å²	46	51.2 Å²	51.2	32%	0.322	26%	0.258	S	S	.	.	H	α-helix	trans	-63.9	-39.1	178.3	62.4	0	0	0	0	112.9	L181 D182 N187 H188	L181-S185 VanDerWaalsContact O-CB 3.22Å; L181-S185 WeakPolarHBondContact O-CB 3.48Å; L181-S185 PolarHBondContact O-N 3.2Å; L181-S185 PolarHBondContact O-OG 3.14Å; D182-S185 PolarHBondContact O-OG 3.1Å; S185-N187 PolarHBondContact O-N 3.07Å; S185-H188 PolarHBondContact O-N 2.95Å
186	A	95.8	Very high	97.4	Very high	69 Å²	69	51.1 Å²	51.1	57%	0.57	26%	0.257	S	S	*	.	H	α-helix	trans	-62.2	-33.5	175.6	0	0	0	0	0	112.6	D182 K183 L184	D182-A186 WeakPolarHBondContact O-CB 3.29Å; D182-A186 PolarHBondContact O-N 2.92Å; K183-A186 PolarHBondContact O-N 3.04Å; L184-A186 PolarHBondContact O-N 3.04Å
187	N	95.6	Very high	97.4	Very high	123 Å²	123	51 Å²	51	66%	0.658	26%	0.257	S	S	*	.	H	α-helix	trans	-92.8	-0.2	179.5	-66.5	-27.9	0	0	0	113.8	K183 L184 S185 D189	K183-N187 PolarHBondContact O-N 3.16Å; K183-N187 PolarHBondContact O-ND2 2.76Å; L184-N187 CarbonylContact O-C 3.53Å; L184-N187 PolarHBondContact O-N 3.37Å; L184-N187 VanDerWaalsContact O-N 3.16Å; S185-N187 PolarHBondContact O-N 3.07Å; N187-D189 HydrophobicContact CB-CB 4.4Å; N187-D189 PolarHBondContact O-N 2.9Å
188	H	96.2	Very high	97.4	Very high	151 Å²	151	50.9 Å²	50.9	70%	0.699	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	35.2	-172.3	-54.5	72.9	0	0	0	112.6	L184 S185	L184-H188 PolarHBondContact O-N 2.79Å; S185-H188 PolarHBondContact O-N 2.95Å
189	D	96.9	Very high	97.4	Very high	48 Å²	48	43 Å²	43	26%	0.257	23%	0.226	S	C	.	.			trans	-95.6	116.6	178.2	-169.7	-30	0	0	0	108.6	A134 L184 N187 A191 Y270	A134-D189 WeakPolarHBondContact CB-OD2 3.5Å; L184-D189 WeakPolarHBondContact CB-O 3.4Å; L184-D189 HydrophobicContact CD2-CB 3.81Å; L184-D189 PolarHBondContact O-N 2.8Å; N187-D189 HydrophobicContact CB-CB 4.4Å; N187-D189 PolarHBondContact O-N 2.9Å; D189-A191 VanDerWaalsContact C-N 3.3Å; D189-A191 WeakPolarHBondContact OD1-CB 3.46Å; D189-A191 PolarHBondContact OD1-N 2.8Å; D189-Y270 VanDerWaalsContact O-CD1 3.3Å; D189-Y270 WeakPolarHBondContact O-CD1 3.37Å; D189-Y270 VanDerWaalsContact O-CE1 3.25Å; D189-Y270 WeakPolarHBondContact O-CE1 3.25Å
190	E	97.7	Very high	97.3	Very high	120 Å²	120	40.1 Å²	40.1	56%	0.561	21%	0.213	S	C	*	.			trans	-90.8	7.6	-176	-56.7	-171.2	159.5	0	0	112.8	Y270 P271	E190-Y270 HydrophobicContact CG-CE1 4.03Å; E190-P271 HydrophobicContact CB-CG 4.15Å; E190-P271 HydrophobicContact CG-CG 3.67Å
191	A	98.4	Very high	97	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.			trans	-56.1	148.8	-178.6	0	0	0	0	0	112.6	H130 A134 A135 L184 D189 D269	H130-A191 WeakPolarHBondContact O-CA 3.12Å; A134-A191 HydrophobicContact CB-CB 4.41Å; A135-A191 HydrophobicContact CB-CB 3.92Å; L184-A191 WeakPolarHBondContact CD1-O 3.21Å; D189-A191 VanDerWaalsContact C-N 3.3Å; D189-A191 WeakPolarHBondContact OD1-CB 3.46Å; D189-A191 PolarHBondContact OD1-N 2.8Å; A191-D269 PolarHBondContact O-N 3.44Å
192	G	98.8	Very high	96.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	172.2	172.2	0	0	0	0	0	111.4	H130 A135 L267	H130-G192 VanDerWaalsContact CE1-C 3.46Å; H130-G192 PolarHBondContact N-O 3.42Å; H130-G192 WeakPolarHBondContact NE2-CA 3.49Å; H130-G192 PolarHBondContact O-N 3.47Å; A135-G192 VanDerWaalsContact CB-C 3.49Å; G192-L267 CarbonylContact C-O 3.56Å; G192-L267 WeakPolarHBondContact CA-O 3.47Å
193	T	98.9	Very high	96.3	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	149.8	174	-170.3	0	0	0	0	111.9	F127 D128 A135 A139 L267	F127-T193 WeakPolarHBondContact CB-OG1 3.17Å; D128-T193 VanDerWaalsContact C-OG1 3.25Å; D128-T193 PolarHBondContact N-OG1 3.44Å; D128-T193 CarbonylContact O-C 3.53Å; D128-T193 WeakPolarHBondContact O-CA 3.2Å; D128-T193 WeakPolarHBondContact O-CB 3.44Å; D128-T193 PolarHBondContact O-OG1 2.89Å; A135-T193 HydrophobicContact CB-CG2 4.16Å; A139-T193 HydrophobicContact CB-CG2 3.99Å; T193-L267 HydrophobicContact CG2-CB 3.97Å; T193-L267 PolarHBondContact N-O 2.93Å; T193-L267 PolarHBondContact O-N 2.98Å
194	T	98.9	Very high	96.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.			trans	-68.3	165.6	162.9	71.4	0	0	0	0	110.5	F127 D128 V210 D212 S213 M263	F127-T194 WeakPolarHBondContact CA-O 3.37Å; D128-T194 HydrophobicContact CB-CG2 3.89Å; D128-T194 WeakPolarHBondContact CB-OG1 3.31Å; D128-T194 PolarHBondContact N-OG1 3.47Å; D128-T194 PolarHBondContact O-N 3Å; T194-V210 CarbonylContact C-O 3.53Å; T194-V210 WeakPolarHBondContact CA-O 3.26Å; T194-V210 WeakPolarHBondContact CB-O 3.43Å; T194-D212 WeakPolarHBondContact CG2-OD1 3.42Å; T194-S213 PolarHBondContact OG1-OG 3.37Å; T194-M263 HydrophobicContact CG2-CE 3.72Å; T194-M263 HydrophobicContact CG2-SD 3.6Å
195	C	98.8	Very high	96.3	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	105.5	174.4	-178.9	0	0	0	0	109.6	F127 L143 M197 N209 V210 L267	F127-C195 HydrophobicContact CD1-CB 4.35Å; F127-C195 HydrophobicContact CE1-CB 4.47Å; L143-C195 VanDerWaalsContact CD2-SG 3.52Å; C195-M197 VanDerWaalsContact SG-CG 3.54Å; C195-N209 CarbonylContact O-C 3.44Å; C195-N209 WeakPolarHBondContact O-CA 3.34Å; C195-V210 HydrophobicContact CB-CB 4.1Å; C195-V210 HydrophobicContact CB-CG2 4.33Å; C195-V210 PolarHBondContact N-O 2.69Å; C195-V210 PolarHBondContact O-N 2.76Å; C195-L267 HydrophobicContact CB-CD1 3.62Å; C195-L267 HydrophobicContact CB-CD2 4.48Å; C195-L267 HydrophobicContact CB-CG 3.88Å
196	L	98.9	Very high	96.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111	170.8	178.4	70.1	0	0	0	108.6	G125 I126 V207 A208 N209 R214 L299	G125-L196 CarbonylContact C-O 3.59Å; G125-L196 WeakPolarHBondContact CA-O 3.39Å; I126-L196 HydrophobicContact CB-CB 4.35Å; I126-L196 PolarHBondContact N-O 2.81Å; I126-L196 PolarHBondContact O-N 2.82Å; L196-V207 HydrophobicContact CD1-CG1 3.82Å; L196-A208 WeakPolarHBondContact CA-O 3.14Å; L196-N209 HydrophobicContact CD1-CB 4.1Å; L196-R214 WeakPolarHBondContact CD2-O 3.18Å; L196-L299 HydrophobicContact CD2-CB 3.89Å; L196-L299 HydrophobicContact CD2-CD2 4.02Å; L196-L299 HydrophobicContact CD2-CG 4.48Å; L196-L299 HydrophobicContact CG-CD2 4.48Å
197	M	98.8	Very high	96.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.3	-178.3	-64.5	-61.5	-59.9	0	0	110.6	I123 F124 G125 F127 L143 P144 L147 L169 C195 V207 A208	I123-M197 HydrophobicContact CG2-CE 3.46Å; I123-M197 VanDerWaalsContact CG2-CE 3.46Å; F124-M197 CarbonylContact O-C 3.54Å; F124-M197 WeakPolarHBondContact O-CA 3.3Å; G125-M197 VanDerWaalsContact CA-SD 3.57Å; F127-M197 HydrophobicContact CE1-SD 3.9Å; F127-M197 HydrophobicContact CZ-SD 3.58Å; F127-M197 VanDerWaalsContact CZ-SD 3.58Å; L143-M197 HydrophobicContact CD2-CG 3.91Å; L143-M197 HydrophobicContact CD2-SD 3.97Å; P144-M197 HydrophobicContact CG-CE 4.44Å; L147-M197 HydrophobicContact CD1-CE 3.73Å; L169-M197 HydrophobicContact CD2-CB 4.04Å; C195-M197 VanDerWaalsContact SG-CG 3.54Å; M197-V207 CarbonylContact O-C 3.57Å; M197-V207 VanDerWaalsContact O-CA 3.27Å; M197-V207 WeakPolarHBondContact O-CA 3.34Å; M197-A208 PolarHBondContact N-O 2.82Å; M197-A208 PolarHBondContact O-N 2.89Å
198	A	98.6	Very high	96.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.1	173.2	0	0	0	0	0	111	F124 L205 T206 V207 M297 L299	F124-A198 HydrophobicContact CB-CB 4.29Å; F124-A198 HydrophobicContact CD2-CB 4.32Å; F124-A198 PolarHBondContact N-O 2.81Å; F124-A198 PolarHBondContact O-N 3.31Å; A198-L205 HydrophobicContact CB-CD1 4.11Å; A198-T206 WeakPolarHBondContact CA-O 3.39Å; A198-V207 HydrophobicContact CB-CG2 4Å; A198-M297 HydrophobicContact CB-CE 4.23Å; A198-L299 HydrophobicContact CB-CD1 3.87Å; A198-L299 HydrophobicContact CB-CD2 4.48Å
199	L	98.1	Very high	97	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.3	171.9	-61.6	-174.4	0	0	0	109.4	P121 S122 I123 L151 Y165 L169 L205 T206	P121-L199 HydrophobicContact CB-CB 4.25Å; S122-L199 CarbonylContact O-C 3.41Å; S122-L199 WeakPolarHBondContact O-CA 3.18Å; I123-L199 HydrophobicContact CB-CD2 4.17Å; I123-L199 HydrophobicContact CD1-CD2 4.48Å; I123-L199 HydrophobicContact CG1-CD2 3.76Å; I123-L199 HydrophobicContact CG2-CD2 3.98Å; L151-L199 HydrophobicContact CD1-CD1 3.94Å; L151-L199 HydrophobicContact CD1-CD2 3.78Å; L151-L199 HydrophobicContact CD2-CD1 4.08Å; Y165-L199 HydrophobicContact CG-CD1 4.46Å; L169-L199 HydrophobicContact CD1-CD1 3.61Å; L169-L199 HydrophobicContact CD1-CG 3.83Å; L169-L199 HydrophobicContact CD2-CD1 3.83Å; L169-L199 HydrophobicContact CD2-CD2 4.35Å; L169-L199 HydrophobicContact CD2-CG 3.92Å; L169-L199 HydrophobicContact CG-CD1 3.49Å; L169-L199 VanDerWaalsContact CG-CD1 3.49Å; L169-L199 HydrophobicContact CG-CG 4.01Å; L199-L205 WeakPolarHBondContact O-CA 3.2Å; L199-T206 PolarHBondContact N-O 3.34Å; L199-T206 PolarHBondContact O-N 2.86Å
200	L	96.2	Very high	97	Very high	24 Å²	24	25.3 Å²	25.3	13%	0.126	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	109.3	-179.5	177.6	60.1	0	0	0	110.5	P121 S122 F124 L205 L289 V349 F351	P121-L200 CarbonylContact C-O 3.57Å; P121-L200 WeakPolarHBondContact CA-O 3.48Å; S122-L200 PolarHBondContact N-O 2.98Å; S122-L200 PolarHBondContact O-N 2.79Å; F124-L200 HydrophobicContact CD2-CB 4.48Å; F124-L200 HydrophobicContact CE2-CB 3.77Å; F124-L200 HydrophobicContact CE2-CD2 3.98Å; F124-L200 HydrophobicContact CZ-CD2 4.42Å; L200-L205 HydrophobicContact CB-CD1 4.42Å; L200-L205 HydrophobicContact CD1-CB 4.5Å; L200-L205 HydrophobicContact CD1-CD1 4.47Å; L200-L289 HydrophobicContact CD1-CD1 3.52Å; L200-V349 HydrophobicContact CD2-CG1 4.36Å; L200-F351 HydrophobicContact CD1-CD1 4.21Å; L200-F351 HydrophobicContact CD1-CE1 3.54Å; L200-F351 HydrophobicContact CD1-CZ 4.43Å; L200-F351 HydrophobicContact CD2-CE1 4.19Å
201	S	91.9	Very high	97.1	Very high	25 Å²	25	19.6 Å²	19.6	18%	0.175	9%	0.092	C	C	.	.			trans	-100.3	-178.6	168.2	75	0	0	0	0	110.6	R203 E204	S201-R203 VanDerWaalsContact C-N 3.29Å; S201-R203 PolarHBondContact O-N 3.42Å; S201-E204 PolarHBondContact N-O 3.12Å; S201-E204 WeakPolarHBondContact OG-CB 3.15Å; S201-E204 PolarHBondContact OG-N 2.87Å; S201-E204 VanDerWaalsContact OG-N 3.15Å; S201-E204 PolarHBondContact OG-O 3.26Å
202	D	87.1	Confident	97.1	Very high	120 Å²	120	19.6 Å²	19.6	64%	0.642	9%	0.092	S	C	*	.	S	Bend	trans	-61.6	-32.3	-176.2	-79	-15.9	0	0	0	113.8	K118	K118-D202 VanDerWaalsContact NZ-CG 3.25Å; K118-D202 IonicContact NZ-OD1 2.67Å; K118-D202 PolarHBondContact NZ-OD1 2.95Å; K118-D202 IonicContact NZ-OD2 2.93Å; K118-D202 PolarHBondContact NZ-OD2 2.94Å
203	R	90.7	Very high	97.1	Very high	170 Å²	170	19.6 Å²	19.6	64%	0.642	9%	0.092	S	C	*	.	S	Bend	trans	-129	-7.6	-175.3	-64.8	-177.7	-179.5	-163.6	3.3	114.6	S201 L289 D290	S201-R203 VanDerWaalsContact C-N 3.29Å; S201-R203 PolarHBondContact O-N 3.42Å; R203-L289 WeakPolarHBondContact O-CB 3.4Å; R203-L289 PolarHBondContact O-N 2.94Å; R203-D290 VanDerWaalsContact CD-OD2 3.27Å; R203-D290 WeakPolarHBondContact CD-OD2 3.46Å; R203-D290 IonicContact CZ-OD2 3.77Å; R203-D290 IonicContact NE-OD2 3.58Å; R203-D290 IonicContact NH1-OD2 2.64Å
204	E	94.4	Very high	97.1	Very high	70 Å²	70	21.8 Å²	21.8	33%	0.327	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135	-173.5	-171.4	-174.4	91.5	0	0	110.1	Y165 S201 T206 T286 F287	Y165-E204 WeakPolarHBondContact CD2-OE1 3.24Å; S201-E204 PolarHBondContact N-O 3.12Å; S201-E204 WeakPolarHBondContact OG-CB 3.15Å; S201-E204 PolarHBondContact OG-N 2.87Å; S201-E204 VanDerWaalsContact OG-N 3.15Å; S201-E204 PolarHBondContact OG-O 3.26Å; E204-T206 PolarHBondContact OE1-OG1 3.21Å; E204-T286 HydrophobicContact CG-CG2 3.36Å; E204-T286 WeakPolarHBondContact OE2-CG2 3.22Å; E204-F287 WeakPolarHBondContact CA-O 3.06Å
205	L	97.9	Very high	97.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.2	168.8	170.4	67.3	0	0	0	108.4	A198 L199 L200 V207 L217 L227 T286 F287 L289 M297 F351	A198-L205 HydrophobicContact CB-CD1 4.11Å; L199-L205 WeakPolarHBondContact O-CA 3.2Å; L200-L205 HydrophobicContact CB-CD1 4.42Å; L200-L205 HydrophobicContact CD1-CB 4.5Å; L200-L205 HydrophobicContact CD1-CD1 4.47Å; L205-V207 HydrophobicContact CD1-CG2 3.98Å; L205-V207 HydrophobicContact CD2-CG2 4.27Å; L205-V207 HydrophobicContact CG-CG2 3.89Å; L205-L217 HydrophobicContact CD2-CD1 3.95Å; L205-L227 HydrophobicContact CD2-CD1 4.03Å; L205-L227 HydrophobicContact CD2-CD2 3.71Å; L205-T286 CarbonylContact O-C 3.6Å; L205-T286 WeakPolarHBondContact O-CA 3.14Å; L205-F287 HydrophobicContact CB-CB 4.34Å; L205-F287 HydrophobicContact CD2-CD2 4.49Å; L205-F287 HydrophobicContact CG-CD2 4.47Å; L205-F287 PolarHBondContact N-O 2.84Å; L205-F287 PolarHBondContact O-N 3.36Å; L205-L289 HydrophobicContact CB-CD1 4.45Å; L205-L289 HydrophobicContact CB-CD2 3.84Å; L205-L289 HydrophobicContact CB-CG 4.31Å; L205-M297 HydrophobicContact CD1-CE 4.47Å; L205-M297 HydrophobicContact CD1-SD 4.02Å; L205-M297 HydrophobicContact CD2-SD 4Å; L205-F351 HydrophobicContact CD2-CZ 4.33Å
206	T	98.6	Very high	97.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.4	173.4	-66.1	0	0	0	0	109.5	A166 L169 A198 L199 E204 I284 M285 T286	A166-T206 HydrophobicContact CB-CG2 4.24Å; L169-T206 HydrophobicContact CD1-CG2 3.61Å; A198-T206 WeakPolarHBondContact CA-O 3.39Å; L199-T206 PolarHBondContact N-O 3.34Å; L199-T206 PolarHBondContact O-N 2.86Å; E204-T206 PolarHBondContact OE1-OG1 3.21Å; T206-I284 HydrophobicContact CG2-CG2 3.65Å; T206-M285 CarbonylContact C-O 3.57Å; T206-M285 WeakPolarHBondContact CA-O 3.29Å; T206-T286 WeakPolarHBondContact OG1-CG2 3.29Å; T206-T286 PolarHBondContact OG1-OG1 2.81Å
207	V	98.9	Very high	97.1	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.006	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.9	-176.5	-177.1	0	0	0	0	110	L196 M197 A198 L205 L227 I284 M285 F287	L196-V207 HydrophobicContact CD1-CG1 3.82Å; M197-V207 CarbonylContact O-C 3.57Å; M197-V207 VanDerWaalsContact O-CA 3.27Å; M197-V207 WeakPolarHBondContact O-CA 3.34Å; A198-V207 HydrophobicContact CB-CG2 4Å; L205-V207 HydrophobicContact CD1-CG2 3.98Å; L205-V207 HydrophobicContact CD2-CG2 4.27Å; L205-V207 HydrophobicContact CG-CG2 3.89Å; V207-L227 HydrophobicContact CB-CB 4.36Å; V207-L227 HydrophobicContact CG1-CB 4.26Å; V207-L227 HydrophobicContact CG2-CB 4.06Å; V207-L227 HydrophobicContact CG2-CD1 4.3Å; V207-I284 CarbonylContact O-C 3.54Å; V207-I284 VanDerWaalsContact O-CA 3.3Å; V207-I284 WeakPolarHBondContact O-CA 3.3Å; V207-M285 PolarHBondContact N-O 3.01Å; V207-M285 PolarHBondContact O-N 2.79Å; V207-F287 HydrophobicContact CG2-CE2 4.49Å
208	A	98.9	Very high	97.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.2	173.6	0	0	0	0	0	109.5	L169 I173 L196 M197 P282 D283 I284	L169-A208 HydrophobicContact CB-CB 4.34Å; L169-A208 HydrophobicContact CD1-CB 4.16Å; I173-A208 HydrophobicContact CD1-CB 3.65Å; L196-A208 WeakPolarHBondContact CA-O 3.14Å; M197-A208 PolarHBondContact N-O 2.82Å; M197-A208 PolarHBondContact O-N 2.89Å; A208-P282 HydrophobicContact CB-CB 4.13Å; A208-D283 WeakPolarHBondContact CA-O 3.42Å; A208-I284 HydrophobicContact CB-CD1 4.21Å; A208-I284 HydrophobicContact CB-CG1 3.82Å
209	N	98.9	Very high	97	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	137.2	177.4	-175	45.5	0	0	0	112	C195 L196 G211 S213 H229 H231 P282 D283	C195-N209 CarbonylContact O-C 3.44Å; C195-N209 WeakPolarHBondContact O-CA 3.34Å; L196-N209 HydrophobicContact CD1-CB 4.1Å; N209-G211 PolarHBondContact ND2-O 2.97Å; N209-S213 PolarHBondContact OD1-O 2.89Å; N209-S213 VanDerWaalsContact OD1-O 3.1Å; N209-H229 PolarHBondContact ND2-O 3.35Å; N209-H231 PolarHBondContact ND2-ND1 2.94Å; N209-H231 PolarHBondContact O-CE1 3.14Å; N209-P282 VanDerWaalsContact O-CA 3.26Å; N209-P282 WeakPolarHBondContact O-CA 3.25Å; N209-D283 PolarHBondContact N-O 3.22Å; N209-D283 PolarHBondContact O-N 2.88Å
210	V	98.9	Very high	96.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	120.1	167.8	-171.8	0	0	0	0	106.8	I173 T194 C195 R265 L267 P280 P282	I173-V210 HydrophobicContact CG2-CG2 3.98Å; T194-V210 CarbonylContact C-O 3.53Å; T194-V210 WeakPolarHBondContact CA-O 3.26Å; T194-V210 WeakPolarHBondContact CB-O 3.43Å; C195-V210 HydrophobicContact CB-CB 4.1Å; C195-V210 HydrophobicContact CB-CG2 4.33Å; C195-V210 PolarHBondContact N-O 2.69Å; C195-V210 PolarHBondContact O-N 2.76Å; V210-R265 HydrophobicContact CG1-CB 3.81Å; V210-L267 HydrophobicContact CG1-CD2 4.33Å; V210-L267 HydrophobicContact CG2-CD2 4.46Å; V210-P280 VanDerWaalsContact CG2-O 3.3Å; V210-P280 WeakPolarHBondContact CG2-O 3.49Å; V210-P282 HydrophobicContact CG2-CB 3.76Å
211	G	98.8	Very high	96.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	93.4	-152.4	-174.2	0	0	0	0	0	113.4	N209 H231 R265	N209-G211 PolarHBondContact ND2-O 2.97Å; G211-H231 PolarHBondContact N-ND1 2.87Å; G211-H231 VanDerWaalsContact N-ND1 3.16Å; G211-H231 WeakPolarHBondContact O-CB 3.38Å; G211-H231 PolarHBondContact O-N 2.62Å; G211-H231 PolarHBondContact O-ND1 2.75Å; G211-R265 WeakPolarHBondContact CA-O 3.34Å; G211-R265 PolarHBondContact N-O 3.17Å
212	D	98.4	Very high	97.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.148	C	C	.	.	S	Bend	trans	-122.9	10.3	-168.5	52.3	1.1	0	0	0	115.2	T194 D230 K232 M263	T194-D212 WeakPolarHBondContact CG2-OD1 3.42Å; D212-D230 HydrophobicContact CB-CB 3.91Å; D212-K232 HydrophobicContact CB-CD 4.06Å; D212-K232 VanDerWaalsContact CB-CE 3.49Å; D212-K232 WeakPolarHBondContact OD2-CE 3.38Å; D212-K232 IonicContact OD2-NZ 3.91Å; D212-K232 PolarHBondContact OD2-NZ 3.17Å; D212-M263 WeakPolarHBondContact OD1-CE 3.35Å
213	S	98.8	Very high	97.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.			trans	-57	149	149.9	-74.9	0	0	0	0	109.9	T194 N209 A300	T194-S213 PolarHBondContact OG1-OG 3.37Å; N209-S213 PolarHBondContact OD1-O 2.89Å; N209-S213 VanDerWaalsContact OD1-O 3.1Å; S213-A300 WeakPolarHBondContact CA-O 3.47Å
214	R	98.9	Very high	98	Very high	46 Å²	46	22.4 Å²	22.4	17%	0.174	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	142.3	-176.2	-168.2	-167.3	-59.9	161.3	9.1	113	L196 V216 S228 D230 A300 W305 N310	L196-R214 WeakPolarHBondContact CD2-O 3.18Å; R214-V216 HydrophobicContact CG-CG2 4.39Å; R214-S228 WeakPolarHBondContact CA-OG 3.22Å; R214-S228 WeakPolarHBondContact CG-OG 3.15Å; R214-D230 IonicContact CZ-OD1 3.26Å; R214-D230 VanDerWaalsContact CZ-OD1 3.31Å; R214-D230 IonicContact CZ-OD2 3.4Å; R214-D230 IonicContact NE-OD1 2.65Å; R214-D230 PolarHBondContact NE-OD1 3.45Å; R214-D230 IonicContact NE-OD2 2.66Å; R214-D230 IonicContact NH2-OD1 2.91Å; R214-D230 PolarHBondContact NH2-OD1 3.29Å; R214-D230 VanDerWaalsContact NH2-OD1 3.1Å; R214-D230 IonicContact NH2-OD2 3.24Å; R214-D230 PolarHBondContact NH2-OD2 3.16Å; R214-A300 PolarHBondContact N-O 3.41Å; R214-A300 PolarHBondContact O-N 2.88Å; R214-W305 HydrophobicContact CB-CD2 4.09Å; R214-W305 HydrophobicContact CB-CG 3.98Å; R214-W305 HydrophobicContact CB-CZ2 4.4Å; R214-W305 VanDerWaalsContact O-CZ2 3.22Å; R214-W305 WeakPolarHBondContact O-CZ2 3.25Å; R214-W305 PolarHBondContact O-NE1 2.99Å; R214-N310 WeakPolarHBondContact CD-OD1 3.12Å; R214-N310 PolarHBondContact NH1-OD1 2.93Å
215	G	98.9	Very high	98.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.4	168.7	0	0	0	0	0	112.6	L227 S228 I298	G215-L227 WeakPolarHBondContact O-CB 3.35Å; G215-L227 PolarHBondContact O-N 3.28Å; G215-S228 PolarHBondContact N-OG 3.34Å; G215-I298 CarbonylContact C-O 3.56Å; G215-I298 VanDerWaalsContact CA-O 3.28Å; G215-I298 WeakPolarHBondContact CA-O 3.5Å
216	V	98.9	Very high	98.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135	176.5	-176.9	0	0	0	0	109.7	R214 A224 V225 M297 I298 W305 N310 V314	R214-V216 HydrophobicContact CG-CG2 4.39Å; V216-A224 HydrophobicContact CG1-CB 3.93Å; V216-V225 WeakPolarHBondContact CA-O 3.28Å; V216-M297 CarbonylContact O-C 3.56Å; V216-M297 WeakPolarHBondContact O-CA 3Å; V216-I298 PolarHBondContact N-O 3.49Å; V216-I298 PolarHBondContact O-N 3.46Å; V216-W305 HydrophobicContact CB-CH2 3.93Å; V216-W305 HydrophobicContact CG2-CH2 3.44Å; V216-W305 VanDerWaalsContact CG2-CH2 3.44Å; V216-W305 HydrophobicContact CG2-CZ2 4.06Å; V216-W305 HydrophobicContact CG2-CZ3 3.78Å; V216-N310 HydrophobicContact CG1-CB 4Å; V216-N310 HydrophobicContact CG2-CB 4.09Å; V216-N310 WeakPolarHBondContact CG2-OD1 3.23Å; V216-V314 HydrophobicContact CG1-CG2 3.72Å
217	L	98.6	Very high	98.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143.6	178.6	170.1	150.8	0	0	0	110.8	L205 D219 A224 V225 L227 L292 P294 M297 F351	L205-L217 HydrophobicContact CD2-CD1 3.95Å; L217-D219 HydrophobicContact CD2-CB 4.26Å; L217-A224 WeakPolarHBondContact O-CA 3.18Å; L217-V225 HydrophobicContact CB-CB 4.38Å; L217-V225 HydrophobicContact CD2-CB 3.9Å; L217-V225 HydrophobicContact CD2-CG2 3.99Å; L217-V225 PolarHBondContact N-O 3Å; L217-V225 PolarHBondContact O-N 3.41Å; L217-L227 HydrophobicContact CB-CD1 3.97Å; L217-L227 HydrophobicContact CB-CD2 3.72Å; L217-L227 HydrophobicContact CB-CG 3.88Å; L217-L227 HydrophobicContact CD1-CD2 4.18Å; L217-L292 HydrophobicContact CD1-CD1 4.39Å; L217-L292 HydrophobicContact CD2-CD1 4.27Å; L217-P294 HydrophobicContact CD1-CB 3.6Å; L217-P294 HydrophobicContact CD1-CG 3.93Å; L217-P294 HydrophobicContact CD2-CB 3.87Å; L217-P294 HydrophobicContact CG-CB 3.67Å; L217-M297 HydrophobicContact CB-CB 4.29Å; L217-F351 HydrophobicContact CD1-CE2 4.24Å; L217-F351 HydrophobicContact CD1-CZ 4.08Å
218	C	98.6	Very high	98.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	114.4	167.9	-178.7	0	0	0	0	108.9	N223 P294 E295 F296 V314 R318	C218-N223 WeakPolarHBondContact CA-O 3.21Å; C218-P294 CarbonylContact O-C 3.6Å; C218-P294 WeakPolarHBondContact O-CA 2.99Å; C218-P294 WeakPolarHBondContact O-CB 3.45Å; C218-E295 PolarHBondContact O-N 3.3Å; C218-F296 HydrophobicContact CB-CD1 3.77Å; C218-F296 HydrophobicContact CB-CD2 4.22Å; C218-F296 HydrophobicContact CB-CE1 3.41Å; C218-F296 VanDerWaalsContact CB-CE1 3.41Å; C218-F296 HydrophobicContact CB-CE2 3.88Å; C218-F296 HydrophobicContact CB-CG 4.17Å; C218-F296 HydrophobicContact CB-CZ 3.47Å; C218-F296 VanDerWaalsContact CB-CZ 3.47Å; C218-F296 PolarHBondContact N-O 3.44Å; C218-V314 HydrophobicContact CB-CG1 3.77Å; C218-V314 HydrophobicContact CB-CG2 4.42Å; C218-R318 PolarHBondContact SG-NH1 3.06Å
219	D	97.3	Very high	98.1	Very high	19 Å²	19	27.3 Å²	27.3	10%	0.102	15%	0.149	C	C	.	.			trans	-74.1	176.1	174.5	74.7	12.5	0	0	0	112	L217 D221 G222 N223 V225	L217-D219 HydrophobicContact CD2-CB 4.26Å; D219-D221 PolarHBondContact O-N 3.41Å; D219-D221 VanDerWaalsContact O-N 3.17Å; D219-D221 WeakPolarHBondContact OD1-CA 3.13Å; D219-D221 PolarHBondContact OD1-N 2.98Å; D219-G222 PolarHBondContact O-N 3.17Å; D219-G222 PolarHBondContact OD1-N 3.24Å; D219-N223 PolarHBondContact N-O 2.87Å; D219-N223 VanDerWaalsContact N-O 3.08Å; D219-N223 PolarHBondContact OD1-N 3.31Å; D219-N223 PolarHBondContact OD1-ND2 3.13Å; D219-N223 WeakPolarHBondContact OD2-CB 3.48Å; D219-N223 PolarHBondContact OD2-ND2 3.4Å; D219-V225 HydrophobicContact CB-CG2 4.23Å
220	K	95.4	Very high	98.1	Very high	93 Å²	93	28 Å²	28	40%	0.404	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.1	178.5	64.1	176.6	-177.2	68	0	115	L292 Q293	K220-L292 PolarHBondContact N-O 3.43Å; K220-Q293 HydrophobicContact CB-CB 3.98Å; K220-Q293 WeakPolarHBondContact CB-O 3.49Å; K220-Q293 HydrophobicContact CD-CB 4.15Å; K220-Q293 HydrophobicContact CG-CB 4.43Å; K220-Q293 PolarHBondContact N-O 2.97Å
221	D	95.6	Very high	98.1	Very high	103 Å²	103	28.1 Å²	28.1	55%	0.551	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-3	-177	-59.7	-44.5	0	0	0	110.9	D219 N223	D219-D221 PolarHBondContact O-N 3.41Å; D219-D221 VanDerWaalsContact O-N 3.17Å; D219-D221 WeakPolarHBondContact OD1-CA 3.13Å; D219-D221 PolarHBondContact OD1-N 2.98Å; D221-N223 WeakPolarHBondContact CB-ND2 3.22Å
222	G	96.2	Very high	98.1	Very high	24 Å²	24	29.2 Å²	29.2	25%	0.247	16%	0.158	C	C	.	.	S	Bend	trans	83.8	15.4	-179.7	0	0	0	0	0	115.5	D219	D219-G222 PolarHBondContact O-N 3.17Å; D219-G222 PolarHBondContact OD1-N 3.24Å
223	N	97.9	Very high	98	Very high	88 Å²	88	29.2 Å²	29.2	47%	0.471	16%	0.158	S	C	.	.			trans	-81.6	147.6	175	-48.6	-61.8	0	0	0	110.7	C218 D219 D221	C218-N223 WeakPolarHBondContact CA-O 3.21Å; D219-N223 PolarHBondContact N-O 2.87Å; D219-N223 VanDerWaalsContact N-O 3.08Å; D219-N223 PolarHBondContact OD1-N 3.31Å; D219-N223 PolarHBondContact OD1-ND2 3.13Å; D219-N223 WeakPolarHBondContact OD2-CB 3.48Å; D219-N223 PolarHBondContact OD2-ND2 3.4Å; D221-N223 WeakPolarHBondContact CB-ND2 3.22Å
224	A	98.6	Very high	97.8	Very high	24 Å²	24	35.4 Å²	35.4	20%	0.198	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.1	171.2	0	0	0	0	0	110.2	V216 L217 N310 E311 V314	V216-A224 HydrophobicContact CG1-CB 3.93Å; L217-A224 WeakPolarHBondContact O-CA 3.18Å; A224-N310 HydrophobicContact CB-CB 3.98Å; A224-E311 HydrophobicContact CB-CG 4.26Å; A224-V314 HydrophobicContact CB-CB 4.21Å; A224-V314 HydrophobicContact CB-CG2 3.78Å
225	V	98.6	Very high	97.7	Very high	33 Å²	33	36.1 Å²	36.1	20%	0.2	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	116.3	174.7	-178.6	0	0	0	0	108	V216 L217 D219 L227 F287	V216-V225 WeakPolarHBondContact CA-O 3.28Å; L217-V225 HydrophobicContact CB-CB 4.38Å; L217-V225 HydrophobicContact CD2-CB 3.9Å; L217-V225 HydrophobicContact CD2-CG2 3.99Å; L217-V225 PolarHBondContact N-O 3Å; L217-V225 PolarHBondContact O-N 3.41Å; D219-V225 HydrophobicContact CB-CG2 4.23Å; V225-L227 PolarHBondContact O-N 2.86Å; V225-F287 HydrophobicContact CG1-CE1 4.26Å
226	A	98.5	Very high	97.7	Very high	29 Å²	29	41.7 Å²	41.7	24%	0.24	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	123	176.3	0	0	0	0	0	110.2
227	L	98.8	Very high	97.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-88.9	-15.4	176.6	-61.9	174.9	0	0	0	112.7	L205 V207 G215 L217 V225 F287 M297 L299	L205-L227 HydrophobicContact CD2-CD1 4.03Å; L205-L227 HydrophobicContact CD2-CD2 3.71Å; V207-L227 HydrophobicContact CB-CB 4.36Å; V207-L227 HydrophobicContact CG1-CB 4.26Å; V207-L227 HydrophobicContact CG2-CB 4.06Å; V207-L227 HydrophobicContact CG2-CD1 4.3Å; G215-L227 WeakPolarHBondContact O-CB 3.35Å; G215-L227 PolarHBondContact O-N 3.28Å; L217-L227 HydrophobicContact CB-CD1 3.97Å; L217-L227 HydrophobicContact CB-CD2 3.72Å; L217-L227 HydrophobicContact CB-CG 3.88Å; L217-L227 HydrophobicContact CD1-CD2 4.18Å; V225-L227 PolarHBondContact O-N 2.86Å; L227-F287 HydrophobicContact CB-CE2 4.19Å; L227-F287 HydrophobicContact CB-CZ 4.4Å; L227-F287 HydrophobicContact CD2-CD1 4.35Å; L227-F287 HydrophobicContact CD2-CD2 3.69Å; L227-F287 HydrophobicContact CD2-CE1 4.2Å; L227-F287 HydrophobicContact CD2-CE2 3.52Å; L227-F287 HydrophobicContact CD2-CG 4.12Å; L227-F287 HydrophobicContact CD2-CZ 3.81Å; L227-M297 HydrophobicContact CD1-CB 4.03Å; L227-M297 HydrophobicContact CD1-SD 4.21Å; L227-L299 HydrophobicContact CD1-CD2 4.36Å
228	S	98.6	Very high	97.6	Very high	5 Å²	5	47.8 Å²	47.8	4%	0.035	24%	0.243	C	C	.	.			trans	-157.3	162.9	-174.6	57.5	0	0	0	0	110	R214 G215	R214-S228 WeakPolarHBondContact CA-OG 3.22Å; R214-S228 WeakPolarHBondContact CG-OG 3.15Å; G215-S228 PolarHBondContact N-OG 3.34Å
229	H	97.8	Very high	97.5	Very high	108 Å²	108	55.1 Å²	55.1	50%	0.5	27%	0.271	S	S	.	.			trans	-124.3	136.4	172.5	-58.7	87.8	0	0	0	109.7	N209	N209-H229 PolarHBondContact ND2-O 3.35Å
230	D	98.4	Very high	97.6	Very high	15 Å²	15	59.5 Å²	59.5	8%	0.08	29%	0.289	C	S	.	.			trans	-62.3	144.8	178.3	-54.1	13.1	0	0	0	111	D212 R214 K232 Q235	D212-D230 HydrophobicContact CB-CB 3.91Å; R214-D230 IonicContact CZ-OD1 3.26Å; R214-D230 VanDerWaalsContact CZ-OD1 3.31Å; R214-D230 IonicContact CZ-OD2 3.4Å; R214-D230 IonicContact NE-OD1 2.65Å; R214-D230 PolarHBondContact NE-OD1 3.45Å; R214-D230 IonicContact NE-OD2 2.66Å; R214-D230 IonicContact NH2-OD1 2.91Å; R214-D230 PolarHBondContact NH2-OD1 3.29Å; R214-D230 VanDerWaalsContact NH2-OD1 3.1Å; R214-D230 IonicContact NH2-OD2 3.24Å; R214-D230 PolarHBondContact NH2-OD2 3.16Å; D230-K232 HydrophobicContact CB-CD 4.49Å; D230-K232 HydrophobicContact CB-CG 3.96Å; D230-K232 PolarHBondContact O-N 2.77Å; D230-Q235 PolarHBondContact O-NE2 3.08Å; D230-Q235 PolarHBondContact O-OE1 2.58Å
231	H	98.7	Very high	97.7	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.009	28%	0.278	C	S	.	.			trans	-95.6	73.7	175.8	-65.3	107.1	0	0	0	111.3	N209 G211 S264 R265 D283	N209-H231 PolarHBondContact ND2-ND1 2.94Å; N209-H231 PolarHBondContact O-CE1 3.14Å; G211-H231 PolarHBondContact N-ND1 2.87Å; G211-H231 VanDerWaalsContact N-ND1 3.16Å; G211-H231 WeakPolarHBondContact O-CB 3.38Å; G211-H231 PolarHBondContact O-N 2.62Å; G211-H231 PolarHBondContact O-ND1 2.75Å; H231-S264 WeakPolarHBondContact CB-OG 3.24Å; H231-S264 PolarHBondContact O-N 2.74Å; H231-S264 PolarHBondContact O-OG 2.98Å; H231-R265 HydrophobicContact CB-CB 3.95Å; H231-R265 HydrophobicContact CB-CG 3.93Å; H231-R265 PolarHBondContact CD2-NE 3.29Å; H231-R265 PolarHBondContact CD2-NH2 3.01Å; H231-R265 VanDerWaalsContact NE2-CZ 3.3Å; H231-R265 PolarHBondContact NE2-NH1 3.04Å; H231-R265 PolarHBondContact NE2-NH2 3.38Å; H231-D283 IonicContact NE2-OD1 2.8Å; H231-D283 IonicContact NE2-OD2 3.28Å; H231-D283 PolarHBondContact NE2-OD2 3.47Å
232	K	97.9	Very high	97.8	Very high	24 Å²	24	52.5 Å²	52.5	10%	0.104	25%	0.252	C	S	.	.			trans	-90.7	142	-178	-59.9	-69.3	-172.1	178.5	0	112.1	D212 D230 Y234 Q235	D212-K232 HydrophobicContact CB-CD 4.06Å; D212-K232 VanDerWaalsContact CB-CE 3.49Å; D212-K232 WeakPolarHBondContact OD2-CE 3.38Å; D212-K232 IonicContact OD2-NZ 3.91Å; D212-K232 PolarHBondContact OD2-NZ 3.17Å; D230-K232 HydrophobicContact CB-CD 4.49Å; D230-K232 HydrophobicContact CB-CG 3.96Å; D230-K232 PolarHBondContact O-N 2.77Å; K232-Y234 HydrophobicContact CB-CD1 3.77Å; K232-Y234 HydrophobicContact CB-CE1 3.31Å; K232-Y234 HydrophobicContact CB-CE2 4.4Å; K232-Y234 HydrophobicContact CB-CG 4.5Å; K232-Y234 HydrophobicContact CG-CE1 3.83Å; K232-Y234 PolarHBondContact O-N 3.42Å; K232-Y234 VanDerWaalsContact O-N 3.09Å; K232-Q235 HydrophobicContact CB-CG 4.4Å; K232-Q235 VanDerWaalsContact N-OE1 3.11Å; K232-Q235 WeakPolarHBondContact O-CB 3.23Å; K232-Q235 WeakPolarHBondContact O-CG 3.48Å; K232-Q235 PolarHBondContact O-N 3.32Å; K232-Q235 PolarHBondContact O-OE1 2.97Å
233	P	97.9	Very high	97.9	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.006	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-30	-173.9	-27.9	37.7	0	0	0	114.8	Q235 I242 I249 W255 V257 A262	P233-Q235 VanDerWaalsContact C-N 3.25Å; P233-Q235 PolarHBondContact O-N 2.83Å; P233-I242 HydrophobicContact CB-CD1 4.45Å; P233-I249 HydrophobicContact CB-CD1 4.06Å; P233-I249 HydrophobicContact CB-CG1 4.08Å; P233-I249 HydrophobicContact CB-CG2 4.06Å; P233-I249 WeakPolarHBondContact O-CD1 3.1Å; P233-W255 HydrophobicContact CB-CB 4.45Å; P233-V257 HydrophobicContact CB-CG2 3.93Å; P233-V257 HydrophobicContact CG-CG2 3.67Å; P233-A262 WeakPolarHBondContact CD-O 3.42Å
234	Y	94.3	Very high	98	Very high	130 Å²	130	65.1 Å²	65.1	51%	0.51	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-13.9	-178.8	61.8	-99.4	0	0	0	113.9	K232 W255	K232-Y234 HydrophobicContact CB-CD1 3.77Å; K232-Y234 HydrophobicContact CB-CE1 3.31Å; K232-Y234 HydrophobicContact CB-CE2 4.4Å; K232-Y234 HydrophobicContact CB-CG 4.5Å; K232-Y234 HydrophobicContact CG-CE1 3.83Å; K232-Y234 PolarHBondContact O-N 3.42Å; K232-Y234 VanDerWaalsContact O-N 3.09Å; Y234-W255 HydrophobicContact CD1-CB 4.12Å; Y234-W255 AromaticContact CD1-CD1 3.51Å; Y234-W255 HydrophobicContact CD1-CG 4.02Å; Y234-W255 AromaticContact CG-CD1 3.95Å; Y234-W255 HydrophobicContact CG-CG 4.41Å
235	Q	97.3	Very high	97.9	Very high	61 Å²	61	65.9 Å²	65.9	29%	0.285	30%	0.297	S	S	.	.	S	Bend	trans	-65.7	141.9	178.9	-68.9	174.3	-34	0	0	111.1	D230 K232 P233 K237 E238 R239	D230-Q235 PolarHBondContact O-NE2 3.08Å; D230-Q235 PolarHBondContact O-OE1 2.58Å; K232-Q235 HydrophobicContact CB-CG 4.4Å; K232-Q235 VanDerWaalsContact N-OE1 3.11Å; K232-Q235 WeakPolarHBondContact O-CB 3.23Å; K232-Q235 WeakPolarHBondContact O-CG 3.48Å; K232-Q235 PolarHBondContact O-N 3.32Å; K232-Q235 PolarHBondContact O-OE1 2.97Å; P233-Q235 VanDerWaalsContact C-N 3.25Å; P233-Q235 PolarHBondContact O-N 2.83Å; Q235-K237 VanDerWaalsContact C-N 3.33Å; Q235-K237 PolarHBondContact O-N 2.86Å; Q235-E238 HydrophobicContact CB-CG 4.31Å; Q235-E238 PolarHBondContact O-N 2.75Å; Q235-R239 VanDerWaalsContact O-CB 3.24Å; Q235-R239 WeakPolarHBondContact O-CB 3.38Å; Q235-R239 PolarHBondContact O-N 3Å
236	L	97	Very high	97.9	Very high	117 Å²	117	67.6 Å²	67.6	61%	0.613	32%	0.321	S	S	*	.	H	α-helix	trans	-61.2	-38.9	-170	-172.7	64.5	0	0	0	113.4	K240	L236-K240 HydrophobicContact CD1-CD 4.4Å; L236-K240 HydrophobicContact CG-CD 4.29Å; L236-K240 WeakPolarHBondContact O-CB 3.27Å; L236-K240 VanDerWaalsContact O-CG 3.26Å; L236-K240 WeakPolarHBondContact O-CG 3.42Å; L236-K240 PolarHBondContact O-N 2.81Å; L236-K240 VanDerWaalsContact O-N 3.16Å
237	K	97	Very high	97.9	Very high	124 Å²	124	66.7 Å²	66.7	54%	0.539	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-52.2	177.2	-174.6	-172.4	177	-168.2	0	110.1	Q235 K240 R241 D283	Q235-K237 VanDerWaalsContact C-N 3.33Å; Q235-K237 PolarHBondContact O-N 2.86Å; K237-K240 PolarHBondContact O-N 3.04Å; K237-R241 PolarHBondContact O-N 2.96Å; K237-R241 VanDerWaalsContact O-N 3.13Å; K237-D283 IonicContact NZ-OD1 3.46Å; K237-D283 PolarHBondContact NZ-OD1 2.86Å; K237-D283 IonicContact NZ-OD2 2.69Å; K237-D283 PolarHBondContact NZ-OD2 3.4Å
238	E	98.4	Very high	97.8	Very high	3 Å²	3	71.9 Å²	71.9	1%	0.014	34%	0.337	C	S	.	.	H	α-helix	trans	-69.4	-46	-176.4	-54.3	-51	119.3	0	0	111.9	Q235 K240 R241 I242 S264 R265	Q235-E238 HydrophobicContact CB-CG 4.31Å; Q235-E238 PolarHBondContact O-N 2.75Å; E238-K240 VanDerWaalsContact C-N 3.29Å; E238-K240 PolarHBondContact O-N 3.22Å; E238-R241 WeakPolarHBondContact O-CB 3.22Å; E238-R241 PolarHBondContact O-N 2.67Å; E238-R241 VanDerWaalsContact O-N 3.08Å; E238-R241 IonicContact OE2-NE 3.27Å; E238-R241 PolarHBondContact OE2-NE 3.11Å; E238-R241 IonicContact OE2-NH2 3.08Å; E238-I242 WeakPolarHBondContact O-CD1 3.25Å; E238-I242 WeakPolarHBondContact O-CG1 3.08Å; E238-I242 PolarHBondContact O-N 2.66Å; E238-S264 VanDerWaalsContact CG-OG 3.25Å; E238-S264 WeakPolarHBondContact CG-OG 3.21Å; E238-S264 PolarHBondContact OE2-OG 2.79Å; E238-R265 IonicContact OE1-CZ 2.92Å; E238-R265 IonicContact OE1-NE 3.79Å; E238-R265 PolarHBondContact OE1-NE 2.85Å; E238-R265 IonicContact OE1-NH2 3.44Å; E238-R265 PolarHBondContact OE1-NH2 3.32Å; E238-R265 IonicContact OE2-CZ 2.88Å; E238-R265 IonicContact OE2-NE 3.48Å; E238-R265 PolarHBondContact OE2-NE 2.91Å; E238-R265 IonicContact OE2-NH2 2.7Å
239	R	97.8	Very high	97.8	Very high	154 Å²	154	73.5 Å²	73.5	58%	0.581	35%	0.345	S	S	*	.	H	α-helix	trans	-56.3	-41.6	175.8	177.9	169.7	172.8	-174	-1.4	112.7	Q235 K243 I249	Q235-R239 VanDerWaalsContact O-CB 3.24Å; Q235-R239 WeakPolarHBondContact O-CB 3.38Å; Q235-R239 PolarHBondContact O-N 3Å; R239-K243 WeakPolarHBondContact O-CB 3.34Å; R239-K243 PolarHBondContact O-N 3.1Å; R239-K243 VanDerWaalsContact O-N 3.1Å; R239-I249 HydrophobicContact CB-CD1 3.93Å; R239-I249 HydrophobicContact CG-CD1 3.88Å
240	K	98.3	Very high	97.7	Very high	111 Å²	111	70.2 Å²	70.2	48%	0.483	34%	0.335	S	S	.	.	H	α-helix	trans	-66.4	-43.1	176.2	-77.8	175.6	179	175.7	0	111.3	L236 K237 E238 R244	L236-K240 HydrophobicContact CD1-CD 4.4Å; L236-K240 HydrophobicContact CG-CD 4.29Å; L236-K240 WeakPolarHBondContact O-CB 3.27Å; L236-K240 VanDerWaalsContact O-CG 3.26Å; L236-K240 WeakPolarHBondContact O-CG 3.42Å; L236-K240 PolarHBondContact O-N 2.81Å; L236-K240 VanDerWaalsContact O-N 3.16Å; K237-K240 PolarHBondContact O-N 3.04Å; E238-K240 VanDerWaalsContact C-N 3.29Å; E238-K240 PolarHBondContact O-N 3.22Å; K240-R244 VanDerWaalsContact O-CG 3.3Å; K240-R244 WeakPolarHBondContact O-CG 3.25Å; K240-R244 PolarHBondContact O-N 2.98Å
241	R	98.4	Very high	97.6	Very high	48 Å²	48	75.7 Å²	75.7	18%	0.181	36%	0.358	C	S	.	.	H	α-helix	trans	-60.6	-52.1	177.2	-176.3	-168.6	60.6	70.8	1	111.3	K237 E238 K243 R244 A245 S264 N276 V277 I279	K237-R241 PolarHBondContact O-N 2.96Å; K237-R241 VanDerWaalsContact O-N 3.13Å; E238-R241 WeakPolarHBondContact O-CB 3.22Å; E238-R241 PolarHBondContact O-N 2.67Å; E238-R241 VanDerWaalsContact O-N 3.08Å; E238-R241 IonicContact OE2-NE 3.27Å; E238-R241 PolarHBondContact OE2-NE 3.11Å; E238-R241 IonicContact OE2-NH2 3.08Å; R241-K243 VanDerWaalsContact C-N 3.35Å; R241-K243 PolarHBondContact O-N 3.47Å; R241-R244 WeakPolarHBondContact O-CB 3.42Å; R241-R244 PolarHBondContact O-N 3.43Å; R241-R244 VanDerWaalsContact O-N 3.13Å; R241-A245 PolarHBondContact O-N 3.44Å; R241-S264 PolarHBondContact NH2-O 2.87Å; R241-N276 PolarHBondContact NH1-O 3.2Å; R241-N276 VanDerWaalsContact NH1-O 3.14Å; R241-V277 VanDerWaalsContact NH1-C 3.3Å; R241-V277 PolarHBondContact NH1-O 3.36Å; R241-V277 PolarHBondContact NH2-O 2.74Å; R241-I279 VanDerWaalsContact CD-CD1 3.49Å
242	I	98.7	Very high	97.2	Very high	1 Å²	1	81.4 Å²	81.4	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-57.7	-46.9	179.9	-67.1	157.4	0	0	0	110.9	P233 E238 R244 A245 G246 G247 I249 V257 V277	P233-I242 HydrophobicContact CB-CD1 4.45Å; E238-I242 WeakPolarHBondContact O-CD1 3.25Å; E238-I242 WeakPolarHBondContact O-CG1 3.08Å; E238-I242 PolarHBondContact O-N 2.66Å; I242-R244 VanDerWaalsContact C-N 3.33Å; I242-R244 PolarHBondContact O-N 3.48Å; I242-A245 PolarHBondContact O-N 3.27Å; I242-G246 PolarHBondContact O-N 2.89Å; I242-G247 PolarHBondContact O-N 3.4Å; I242-I249 HydrophobicContact CD1-CD1 3.89Å; I242-I249 HydrophobicContact CD1-CG1 4.12Å; I242-I249 HydrophobicContact CG2-CG1 4.18Å; I242-V257 HydrophobicContact CD1-CG1 4.42Å; I242-V257 HydrophobicContact CD1-CG2 3.64Å; I242-V257 HydrophobicContact CG1-CG1 4.46Å; I242-V257 HydrophobicContact CG1-CG2 4.47Å; I242-V257 HydrophobicContact CG2-CG1 4.25Å; I242-V277 WeakPolarHBondContact CG1-O 3.4Å; I242-V277 HydrophobicContact CG2-CB 4.44Å
243	K	98	Very high	96.8	Very high	163 Å²	163	83.5 Å²	83.5	71%	0.709	42%	0.417	S	S	*	.	H	α-helix	trans	-62.8	-37.8	178.3	-174.4	176.3	179.9	-180	0	112.6	R239 R241 A245 G246	R239-K243 WeakPolarHBondContact O-CB 3.34Å; R239-K243 PolarHBondContact O-N 3.1Å; R239-K243 VanDerWaalsContact O-N 3.1Å; R241-K243 VanDerWaalsContact C-N 3.35Å; R241-K243 PolarHBondContact O-N 3.47Å; K243-A245 VanDerWaalsContact C-N 3.3Å; K243-G246 PolarHBondContact O-N 2.97Å; K243-G246 VanDerWaalsContact O-N 3.13Å
244	R	98.3	Very high	96.5	Very high	215 Å²	215	85.3 Å²	85.3	81%	0.811	43%	0.43	S	S	*	.	H	α-helix	trans	-67.1	-31.7	176.6	-75.8	175.1	-175.5	175.4	0.3	112.5	K240 R241 I242 G246	K240-R244 VanDerWaalsContact O-CG 3.3Å; K240-R244 WeakPolarHBondContact O-CG 3.25Å; K240-R244 PolarHBondContact O-N 2.98Å; R241-R244 WeakPolarHBondContact O-CB 3.42Å; R241-R244 PolarHBondContact O-N 3.43Å; R241-R244 VanDerWaalsContact O-N 3.13Å; I242-R244 VanDerWaalsContact C-N 3.33Å; I242-R244 PolarHBondContact O-N 3.48Å; R244-G246 PolarHBondContact O-N 3.23Å
245	A	98	Very high	96.7	Very high	39 Å²	39	84.7 Å²	84.7	32%	0.322	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	1.5	172.9	0	0	0	0	0	113.4	R241 I242 K243 G247 N276 V277	R241-A245 PolarHBondContact O-N 3.44Å; I242-A245 PolarHBondContact O-N 3.27Å; K243-A245 VanDerWaalsContact C-N 3.3Å; A245-G247 VanDerWaalsContact C-N 3.26Å; A245-G247 PolarHBondContact O-N 2.8Å; A245-N276 HydrophobicContact CB-CB 4.16Å; A245-N276 WeakPolarHBondContact CB-O 3.48Å; A245-V277 HydrophobicContact CB-CG1 4.18Å
246	G	98	Very high	96.7	Very high	69 Å²	69	85.5 Å²	85.5	71%	0.711	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	4.9	-176.3	0	0	0	0	0	114	I242 K243 R244	I242-G246 PolarHBondContact O-N 2.89Å; K243-G246 PolarHBondContact O-N 2.97Å; K243-G246 VanDerWaalsContact O-N 3.13Å; R244-G246 PolarHBondContact O-N 3.23Å
247	G	97.9	Very high	96.8	Very high	10 Å²	10	79.9 Å²	79.9	10%	0.103	40%	0.398	C	S	.	.			trans	-79.6	169	175.9	0	0	0	0	0	113.5	I242 A245	I242-G247 PolarHBondContact O-N 3.4Å; A245-G247 VanDerWaalsContact C-N 3.26Å; A245-G247 PolarHBondContact O-N 2.8Å
248	F	97.2	Very high	96.8	Very high	109 Å²	109	76.1 Å²	76.1	48%	0.478	38%	0.382	S	S	.	.			trans	-127.5	164.2	173.7	69.4	-87.2	0	0	0	111.5	Q258	F248-Q258 HydrophobicContact CE1-CB 4.37Å; F248-Q258 VanDerWaalsContact CZ-C 3.4Å; F248-Q258 HydrophobicContact CZ-CB 4.4Å; F248-Q258 WeakPolarHBondContact CZ-O 3.49Å; F248-Q258 PolarHBondContact O-N 3.46Å
249	I	97.9	Very high	96.7	Very high	39 Å²	39	77.3 Å²	77.3	20%	0.2	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.8	173	-64.8	158.9	0	0	0	107.1	P233 R239 I242 W255 R256	P233-I249 HydrophobicContact CB-CD1 4.06Å; P233-I249 HydrophobicContact CB-CG1 4.08Å; P233-I249 HydrophobicContact CB-CG2 4.06Å; P233-I249 WeakPolarHBondContact O-CD1 3.1Å; R239-I249 HydrophobicContact CB-CD1 3.93Å; R239-I249 HydrophobicContact CG-CD1 3.88Å; I242-I249 HydrophobicContact CD1-CD1 3.89Å; I242-I249 HydrophobicContact CD1-CG1 4.12Å; I242-I249 HydrophobicContact CG2-CG1 4.18Å; I249-W255 HydrophobicContact CG2-CB 4.28Å; I249-W255 HydrophobicContact CG2-CD2 4.46Å; I249-W255 HydrophobicContact CG2-CE3 3.65Å; I249-W255 HydrophobicContact CG2-CZ3 4.36Å; I249-R256 VanDerWaalsContact CA-O 3.3Å; I249-R256 WeakPolarHBondContact CA-O 3.24Å
250	S	96.8	Very high	96.6	Very high	40 Å²	40	75.1 Å²	75.1	28%	0.28	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	159.9	174.7	63.9	0	0	0	0	110.7	W255 R256 G259	S250-W255 WeakPolarHBondContact O-CA 3.42Å; S250-R256 PolarHBondContact N-O 3.35Å; S250-R256 PolarHBondContact O-N 3.17Å; S250-G259 WeakPolarHBondContact OG-CA 3.47Å
251	F	95.3	Very high	96.6	Very high	130 Å²	130	70.4 Å²	70.4	57%	0.57	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	121.2	177.3	-176.5	-95.9	0	0	0	109.7	G253 W255	F251-G253 WeakPolarHBondContact CZ-O 3.45Å; F251-W255 HydrophobicContact CB-CD2 4.39Å; F251-W255 HydrophobicContact CB-CE3 3.99Å; F251-W255 HydrophobicContact CB-CH2 4.49Å; F251-W255 HydrophobicContact CB-CZ3 4.06Å; F251-W255 AromaticContact CD2-CD2 3.98Å; F251-W255 HydrophobicContact CD2-CD2 3.98Å; F251-W255 HydrophobicContact CD2-CE3 4.42Å; F251-W255 HydrophobicContact CD2-CG 4.14Å
252	N	89.9	Confident	96.6	Very high	121 Å²	121	69.4 Å²	69.4	65%	0.647	38%	0.376	S	S	*	.	S	Bend	trans	-142.6	80.7	173.4	-176.3	21.5	0	0	0	109	S254	N252-S254 PolarHBondContact N-O 3.22Å; N252-S254 PolarHBondContact O-N 3.06Å
253	G	89.8	Confident	96.5	Very high	69 Å²	69	69.9 Å²	69.9	71%	0.711	38%	0.378	S	S	*	.	S	Bend	trans	73.9	-39.4	-168.2	0	0	0	0	0	113.3	F251	F251-G253 WeakPolarHBondContact CZ-O 3.45Å
254	S	93.1	Very high	96.5	Very high	39 Å²	39	62.1 Å²	62.1	27%	0.273	34%	0.344	S	S	.	.	S	Bend	trans	-136.1	162.3	170.9	60	0	0	0	0	110.8	N252 R256	N252-S254 PolarHBondContact N-O 3.22Å; N252-S254 PolarHBondContact O-N 3.06Å; S254-R256 PolarHBondContact OG-NE 2.95Å; S254-R256 PolarHBondContact OG-NH2 2.96Å
255	W	96.6	Very high	96.6	Very high	117 Å²	117	52.1 Å²	52.1	44%	0.443	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126.1	174	-69.5	104.2	0	0	0	110.2	P233 Y234 I249 S250 F251	P233-W255 HydrophobicContact CB-CB 4.45Å; Y234-W255 HydrophobicContact CD1-CB 4.12Å; Y234-W255 AromaticContact CD1-CD1 3.51Å; Y234-W255 HydrophobicContact CD1-CG 4.02Å; Y234-W255 AromaticContact CG-CD1 3.95Å; Y234-W255 HydrophobicContact CG-CG 4.41Å; I249-W255 HydrophobicContact CG2-CB 4.28Å; I249-W255 HydrophobicContact CG2-CD2 4.46Å; I249-W255 HydrophobicContact CG2-CE3 3.65Å; I249-W255 HydrophobicContact CG2-CZ3 4.36Å; S250-W255 WeakPolarHBondContact O-CA 3.42Å; F251-W255 HydrophobicContact CB-CD2 4.39Å; F251-W255 HydrophobicContact CB-CE3 3.99Å; F251-W255 HydrophobicContact CB-CH2 4.49Å; F251-W255 HydrophobicContact CB-CZ3 4.06Å; F251-W255 AromaticContact CD2-CD2 3.98Å; F251-W255 HydrophobicContact CD2-CD2 3.98Å; F251-W255 HydrophobicContact CD2-CE3 4.42Å; F251-W255 HydrophobicContact CD2-CG 4.14Å
256	R	98.3	Very high	96.6	Very high	77 Å²	77	50.3 Å²	50.3	29%	0.291	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.5	-172.2	-66.7	175	-179.5	-84.7	-5.1	113.1	I249 S250 S254 G259 I260 L261 A262	I249-R256 VanDerWaalsContact CA-O 3.3Å; I249-R256 WeakPolarHBondContact CA-O 3.24Å; S250-R256 PolarHBondContact N-O 3.35Å; S250-R256 PolarHBondContact O-N 3.17Å; S254-R256 PolarHBondContact OG-NE 2.95Å; S254-R256 PolarHBondContact OG-NH2 2.96Å; R256-G259 PolarHBondContact O-N 2.86Å; R256-I260 WeakPolarHBondContact CD-O 3.3Å; R256-I260 PolarHBondContact NH1-O 2.82Å; R256-L261 CarbonylContact C-O 3.56Å; R256-L261 WeakPolarHBondContact CA-O 3.13Å; R256-A262 HydrophobicContact CG-CB 4.32Å
257	V	98.3	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	127.7	171.8	-176	0	0	0	0	109.2	P233 I242 G259 I260 L261 M263 V277 V278	P233-V257 HydrophobicContact CB-CG2 3.93Å; P233-V257 HydrophobicContact CG-CG2 3.67Å; I242-V257 HydrophobicContact CD1-CG1 4.42Å; I242-V257 HydrophobicContact CD1-CG2 3.64Å; I242-V257 HydrophobicContact CG1-CG1 4.46Å; I242-V257 HydrophobicContact CG1-CG2 4.47Å; I242-V257 HydrophobicContact CG2-CG1 4.25Å; V257-G259 PolarHBondContact O-N 2.8Å; V257-I260 PolarHBondContact O-N 2.91Å; V257-L261 PolarHBondContact N-O 2.84Å; V257-L261 PolarHBondContact O-N 3.26Å; V257-M263 WeakPolarHBondContact CG2-O 3.34Å; V257-V277 HydrophobicContact CG1-CB 3.74Å; V257-V277 HydrophobicContact CG1-CG2 3.7Å; V257-V278 HydrophobicContact CG1-CG2 4.24Å
258	Q	97.7	Very high	96.7	Very high	44 Å²	44	46.5 Å²	46.5	21%	0.206	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	17.8	-173.2	-58.8	-67.4	90.3	0	0	113.9	F248 I260 L272 V277	F248-Q258 HydrophobicContact CE1-CB 4.37Å; F248-Q258 VanDerWaalsContact CZ-C 3.4Å; F248-Q258 HydrophobicContact CZ-CB 4.4Å; F248-Q258 WeakPolarHBondContact CZ-O 3.49Å; F248-Q258 PolarHBondContact O-N 3.46Å; Q258-I260 HydrophobicContact CB-CD1 4.27Å; Q258-I260 PolarHBondContact O-N 3.27Å; Q258-L272 HydrophobicContact CB-CD2 4.19Å; Q258-L272 HydrophobicContact CG-CD2 4.04Å; Q258-V277 HydrophobicContact CG-CG2 3.83Å
259	G	96.6	Very high	96.7	Very high	28 Å²	28	41.8 Å²	41.8	29%	0.289	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	7.1	-171	0	0	0	0	0	115.6	S250 R256 V257	S250-G259 WeakPolarHBondContact OG-CA 3.47Å; R256-G259 PolarHBondContact O-N 2.86Å; V257-G259 PolarHBondContact O-N 2.8Å
260	I	96.4	Very high	96.7	Very high	108 Å²	108	41.7 Å²	41.7	55%	0.554	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-68.5	-174.3	-61.8	165.7	0	0	0	110	R256 V257 Q258 L272	R256-I260 WeakPolarHBondContact CD-O 3.3Å; R256-I260 PolarHBondContact NH1-O 2.82Å; V257-I260 PolarHBondContact O-N 2.91Å; Q258-I260 HydrophobicContact CB-CD1 4.27Å; Q258-I260 PolarHBondContact O-N 3.27Å; I260-L272 HydrophobicContact CD1-CD2 4.25Å
261	L	97.5	Very high	96.7	Very high	13 Å²	13	41.5 Å²	41.5	7%	0.068	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-96.1	128.9	-165.9	-171.3	64.4	0	0	0	112.6	H130 R256 V257 M263 L272 V278	H130-L261 WeakPolarHBondContact NE2-CD1 3.09Å; R256-L261 CarbonylContact C-O 3.56Å; R256-L261 WeakPolarHBondContact CA-O 3.13Å; V257-L261 PolarHBondContact N-O 2.84Å; V257-L261 PolarHBondContact O-N 3.26Å; L261-M263 HydrophobicContact CD1-CG 4.03Å; L261-M263 HydrophobicContact CD2-CG 3.78Å; L261-M263 HydrophobicContact CG-CG 3.71Å; L261-M263 PolarHBondContact O-N 3.42Å; L261-L272 HydrophobicContact CB-CD1 3.74Å; L261-L272 HydrophobicContact CD2-CD1 4.04Å; L261-V278 HydrophobicContact CD2-CG1 4.32Å; L261-V278 HydrophobicContact CD2-CG2 3.86Å
262	A	97.3	Very high	96.9	Very high	26 Å²	26	35.8 Å²	35.8	22%	0.215	20%	0.203	C	C	.	.	S	Bend	trans	-78.6	-4.2	-176.2	0	0	0	0	0	114.7	P233 R256	P233-A262 WeakPolarHBondContact CD-O 3.42Å; R256-A262 HydrophobicContact CG-CB 4.32Å
263	M	97.9	Very high	97.2	Very high	12 Å²	12	31 Å²	31	6%	0.059	18%	0.176	C	C	.	.	S	Bend	trans	-120.2	162.3	173.6	62.1	-171.2	78.5	0	0	110.3	T194 D212 V257 L261	T194-M263 HydrophobicContact CG2-CE 3.72Å; T194-M263 HydrophobicContact CG2-SD 3.6Å; D212-M263 WeakPolarHBondContact OD1-CE 3.35Å; V257-M263 WeakPolarHBondContact CG2-O 3.34Å; L261-M263 HydrophobicContact CD1-CG 4.03Å; L261-M263 HydrophobicContact CD2-CG 3.78Å; L261-M263 HydrophobicContact CG-CG 3.71Å; L261-M263 PolarHBondContact O-N 3.42Å
264	S	98.5	Very high	97.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-104.7	-12.2	-175.4	61.8	0	0	0	0	114.2	H231 E238 R241	H231-S264 WeakPolarHBondContact CB-OG 3.24Å; H231-S264 PolarHBondContact O-N 2.74Å; H231-S264 PolarHBondContact O-OG 2.98Å; E238-S264 VanDerWaalsContact CG-OG 3.25Å; E238-S264 WeakPolarHBondContact CG-OG 3.21Å; E238-S264 PolarHBondContact OE2-OG 2.79Å; R241-S264 PolarHBondContact NH2-O 2.87Å
265	R	98.8	Very high	97.7	Very high	5 Å²	5	36 Å²	36	2%	0.019	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-138.2	143.9	178.2	-57.4	-163.3	-163	163.9	24	108.9	V210 G211 H231 E238 I279 D281 D283	V210-R265 HydrophobicContact CG1-CB 3.81Å; G211-R265 WeakPolarHBondContact CA-O 3.34Å; G211-R265 PolarHBondContact N-O 3.17Å; H231-R265 HydrophobicContact CB-CB 3.95Å; H231-R265 HydrophobicContact CB-CG 3.93Å; H231-R265 PolarHBondContact CD2-NE 3.29Å; H231-R265 PolarHBondContact CD2-NH2 3.01Å; H231-R265 VanDerWaalsContact NE2-CZ 3.3Å; H231-R265 PolarHBondContact NE2-NH1 3.04Å; H231-R265 PolarHBondContact NE2-NH2 3.38Å; E238-R265 IonicContact OE1-CZ 2.92Å; E238-R265 IonicContact OE1-NE 3.79Å; E238-R265 PolarHBondContact OE1-NE 2.85Å; E238-R265 IonicContact OE1-NH2 3.44Å; E238-R265 PolarHBondContact OE1-NH2 3.32Å; E238-R265 IonicContact OE2-CZ 2.88Å; E238-R265 IonicContact OE2-NE 3.48Å; E238-R265 PolarHBondContact OE2-NE 2.91Å; E238-R265 IonicContact OE2-NH2 2.7Å; R265-I279 WeakPolarHBondContact CA-O 3.35Å; R265-I279 VanDerWaalsContact CB-O 3.24Å; R265-I279 WeakPolarHBondContact CB-O 3.32Å; R265-I279 HydrophobicContact CG-CD1 4.42Å; R265-I279 HydrophobicContact CG-CG1 3.76Å; R265-D281 VanDerWaalsContact CD-O 3.27Å; R265-D281 WeakPolarHBondContact CD-O 3.35Å; R265-D281 PolarHBondContact NH1-O 3.32Å; R265-D283 IonicContact CZ-OD1 3.27Å; R265-D283 IonicContact NH1-OD1 2.66Å; R265-D283 PolarHBondContact NH1-OD1 2.87Å; R265-D283 IonicContact NH2-OD1 3.71Å; R265-D283 PolarHBondContact NH2-OD1 3.22Å; R265-D283 VanDerWaalsContact NH2-OD1 3.15Å; R265-D283 IonicContact NH2-OD2 2.76Å; R265-D283 PolarHBondContact NH2-OD2 3.45Å
266	S	98.8	Very high	97.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.19	C	C	.	.			trans	-166.9	162.5	178.7	56	0	0	0	0	110.3	D269 K273 V278 I279	S266-D269 WeakPolarHBondContact CB-OD2 3.27Å; S266-D269 PolarHBondContact OG-OD2 2.94Å; S266-K273 WeakPolarHBondContact O-CE 3.48Å; S266-K273 PolarHBondContact O-NZ 2.5Å; S266-V278 WeakPolarHBondContact OG-CG1 3.17Å; S266-I279 PolarHBondContact N-O 2.87Å
267	L	98.9	Very high	97.7	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	154.8	160.7	-49	-172.3	0	0	0	109.5	A139 I173 D177 M180 G192 T193 C195 V210 P280	A139-L267 HydrophobicContact CB-CD1 4.36Å; I173-L267 HydrophobicContact CG2-CD2 3.8Å; D177-L267 HydrophobicContact CB-CD2 4.06Å; D177-L267 WeakPolarHBondContact OD1-CA 3.39Å; D177-L267 WeakPolarHBondContact OD1-CB 3.4Å; M180-L267 HydrophobicContact CE-CB 4.04Å; M180-L267 HydrophobicContact CE-CD1 4.35Å; M180-L267 HydrophobicContact SD-CB 4.32Å; G192-L267 CarbonylContact C-O 3.56Å; G192-L267 WeakPolarHBondContact CA-O 3.47Å; T193-L267 HydrophobicContact CG2-CB 3.97Å; T193-L267 PolarHBondContact N-O 2.93Å; T193-L267 PolarHBondContact O-N 2.98Å; C195-L267 HydrophobicContact CB-CD1 3.62Å; C195-L267 HydrophobicContact CB-CD2 4.48Å; C195-L267 HydrophobicContact CB-CG 3.88Å; V210-L267 HydrophobicContact CG1-CD2 4.33Å; V210-L267 HydrophobicContact CG2-CD2 4.46Å; L267-P280 HydrophobicContact CD2-CB 3.91Å
268	G	98.5	Very high	97.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.3	-138.9	-173.7	0	0	0	0	0	112.7	D177 L181 Y270 K273	D177-G268 PolarHBondContact OD1-N 2.98Å; L181-G268 WeakPolarHBondContact CD2-O 3.11Å; G268-Y270 VanDerWaalsContact C-N 3.33Å; G268-Y270 PolarHBondContact O-N 3.33Å; G268-K273 WeakPolarHBondContact O-CD 3.43Å; G268-K273 WeakPolarHBondContact O-CE 3.3Å; G268-K273 PolarHBondContact O-NZ 3.33Å
269	D	98.3	Very high	97.8	Very high	10 Å²	10	31.6 Å²	31.6	5%	0.053	18%	0.175	C	C	.	.			trans	53.2	44.6	-179.3	-66.2	-68.7	0	0	0	113.7	H130 A191 S266 P271 L272 K273	H130-D269 IonicContact CD2-OD1 3.45Å; H130-D269 IonicContact CE1-OD2 3.65Å; H130-D269 PolarHBondContact CE1-OD2 3.22Å; H130-D269 VanDerWaalsContact CE1-OD2 3.26Å; H130-D269 IonicContact NE2-OD1 2.71Å; H130-D269 PolarHBondContact NE2-OD1 2.82Å; H130-D269 IonicContact NE2-OD2 3.31Å; H130-D269 PolarHBondContact NE2-OD2 3.22Å; A191-D269 PolarHBondContact O-N 3.44Å; S266-D269 WeakPolarHBondContact CB-OD2 3.27Å; S266-D269 PolarHBondContact OG-OD2 2.94Å; D269-P271 VanDerWaalsContact C-N 3.29Å; D269-P271 VanDerWaalsContact O-N 3.13Å; D269-L272 HydrophobicContact CB-CB 4.45Å; D269-L272 PolarHBondContact O-N 3.41Å; D269-K273 PolarHBondContact O-N 2.86Å
270	Y	97.3	Very high	97.9	Very high	37 Å²	37	31.2 Å²	31.2	15%	0.145	17%	0.167	C	C	.	.	H	α-helix	trans	-52.3	-36.8	-174.3	85.8	-95.9	0	0	0	114.5	L184 D189 E190 G268 L272 K273 N274	L184-Y270 HydrophobicContact CB-CD1 4.39Å; D189-Y270 VanDerWaalsContact O-CD1 3.3Å; D189-Y270 WeakPolarHBondContact O-CD1 3.37Å; D189-Y270 VanDerWaalsContact O-CE1 3.25Å; D189-Y270 WeakPolarHBondContact O-CE1 3.25Å; E190-Y270 HydrophobicContact CG-CE1 4.03Å; G268-Y270 VanDerWaalsContact C-N 3.33Å; G268-Y270 PolarHBondContact O-N 3.33Å; Y270-L272 VanDerWaalsContact C-N 3.32Å; Y270-L272 PolarHBondContact O-N 2.92Å; Y270-K273 PolarHBondContact O-N 3.08Å; Y270-N274 WeakPolarHBondContact O-CB 3.42Å; Y270-N274 PolarHBondContact O-N 2.95Å; Y270-N274 PolarHBondContact O-ND2 2.96Å
271	P	97.4	Very high	98	Very high	36 Å²	36	29.2 Å²	29.2	23%	0.234	16%	0.158	C	C	.	.	H	α-helix	trans	-63.4	-38.2	178.8	-21	34.2	0	0	0	112.3	E190 D269	E190-P271 HydrophobicContact CB-CG 4.15Å; E190-P271 HydrophobicContact CG-CG 3.67Å; D269-P271 VanDerWaalsContact C-N 3.29Å; D269-P271 VanDerWaalsContact O-N 3.13Å
272	L	98	Very high	98	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.052	16%	0.158	C	C	.	.	H	α-helix	trans	-78.1	-31	179.4	-63.3	179.1	0	0	0	112.1	Q258 I260 L261 D269 Y270 L275 N276 V277 V278	Q258-L272 HydrophobicContact CB-CD2 4.19Å; Q258-L272 HydrophobicContact CG-CD2 4.04Å; I260-L272 HydrophobicContact CD1-CD2 4.25Å; L261-L272 HydrophobicContact CB-CD1 3.74Å; L261-L272 HydrophobicContact CD2-CD1 4.04Å; D269-L272 HydrophobicContact CB-CB 4.45Å; D269-L272 PolarHBondContact O-N 3.41Å; Y270-L272 VanDerWaalsContact C-N 3.32Å; Y270-L272 PolarHBondContact O-N 2.92Å; L272-L275 PolarHBondContact O-N 3.02Å; L272-N276 PolarHBondContact O-N 3.11Å; L272-V277 HydrophobicContact CB-CG2 4.06Å; L272-V277 HydrophobicContact CD2-CG2 4.06Å; L272-V277 WeakPolarHBondContact O-CG2 3.2Å; L272-V277 PolarHBondContact O-N 2.91Å; L272-V278 HydrophobicContact CB-CB 3.95Å; L272-V278 HydrophobicContact CB-CG2 3.72Å; L272-V278 HydrophobicContact CD1-CG2 3.83Å; L272-V278 HydrophobicContact CG-CG2 4.39Å
273	K	97.1	Very high	98.1	Very high	19 Å²	19	30.5 Å²	30.5	8%	0.083	16%	0.162	C	C	.	.	H	α-helix	trans	-70.9	-34.1	173.4	-73.1	-175.1	-177.6	158.6	0	112.9	D177 L181 S266 G268 D269 Y270 L275 N276	D177-K273 IonicContact OD1-NZ 3.01Å; D177-K273 PolarHBondContact OD1-NZ 3.26Å; D177-K273 IonicContact OD2-NZ 2.78Å; D177-K273 PolarHBondContact OD2-NZ 3.46Å; L181-K273 HydrophobicContact CD1-CD 3.78Å; L181-K273 HydrophobicContact CD2-CD 3.98Å; L181-K273 HydrophobicContact CG-CD 4.45Å; S266-K273 WeakPolarHBondContact O-CE 3.48Å; S266-K273 PolarHBondContact O-NZ 2.5Å; G268-K273 WeakPolarHBondContact O-CD 3.43Å; G268-K273 WeakPolarHBondContact O-CE 3.3Å; G268-K273 PolarHBondContact O-NZ 3.33Å; D269-K273 PolarHBondContact O-N 2.86Å; Y270-K273 PolarHBondContact O-N 3.08Å; K273-L275 PolarHBondContact O-N 3.37Å; K273-N276 WeakPolarHBondContact O-CA 3.46Å; K273-N276 PolarHBondContact O-N 3.39Å
274	N	96.3	Very high	98.1	Very high	122 Å²	122	32.1 Å²	32.1	65%	0.652	17%	0.17	S	C	*	.	H	α-helix	trans	-59.6	-26.8	171.6	-72.9	-15.1	0	0	0	112.6	Y270	Y270-N274 WeakPolarHBondContact O-CB 3.42Å; Y270-N274 PolarHBondContact O-N 2.95Å; Y270-N274 PolarHBondContact O-ND2 2.96Å
275	L	96.9	Very high	98.1	Very high	91 Å²	91	35.1 Å²	35.1	48%	0.476	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.9	174	-59	178.5	0	0	0	113.4	L272 K273 V277	L272-L275 PolarHBondContact O-N 3.02Å; K273-L275 PolarHBondContact O-N 3.37Å; L275-V277 HydrophobicContact CB-CG1 4.1Å; L275-V277 HydrophobicContact CB-CG2 4.05Å; L275-V277 PolarHBondContact O-N 3.48Å; L275-V277 VanDerWaalsContact O-N 3.12Å
276	N	97	Very high	98.1	Very high	110 Å²	110	38.2 Å²	38.2	59%	0.588	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	18.5	-173.5	-58.8	-65.4	0	0	0	114.7	R241 A245 L272 K273	R241-N276 PolarHBondContact NH1-O 3.2Å; R241-N276 VanDerWaalsContact NH1-O 3.14Å; A245-N276 HydrophobicContact CB-CB 4.16Å; A245-N276 WeakPolarHBondContact CB-O 3.48Å; L272-N276 PolarHBondContact O-N 3.11Å; K273-N276 WeakPolarHBondContact O-CA 3.46Å; K273-N276 PolarHBondContact O-N 3.39Å
277	V	98.3	Very high	98	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.21	C	C	.	.	S	Bend	trans	-87.5	-20.8	-179.8	-61	0	0	0	0	112.1	R241 I242 A245 V257 Q258 L272 L275	R241-V277 VanDerWaalsContact NH1-C 3.3Å; R241-V277 PolarHBondContact NH1-O 3.36Å; R241-V277 PolarHBondContact NH2-O 2.74Å; I242-V277 WeakPolarHBondContact CG1-O 3.4Å; I242-V277 HydrophobicContact CG2-CB 4.44Å; A245-V277 HydrophobicContact CB-CG1 4.18Å; V257-V277 HydrophobicContact CG1-CB 3.74Å; V257-V277 HydrophobicContact CG1-CG2 3.7Å; Q258-V277 HydrophobicContact CG-CG2 3.83Å; L272-V277 HydrophobicContact CB-CG2 4.06Å; L272-V277 HydrophobicContact CD2-CG2 4.06Å; L272-V277 WeakPolarHBondContact O-CG2 3.2Å; L272-V277 PolarHBondContact O-N 2.91Å; L275-V277 HydrophobicContact CB-CG1 4.1Å; L275-V277 HydrophobicContact CB-CG2 4.05Å; L275-V277 PolarHBondContact O-N 3.48Å; L275-V277 VanDerWaalsContact O-N 3.12Å
278	V	98.6	Very high	97.9	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	23%	0.226	C	C	.	.	S	Bend	trans	-119.1	145.1	168.9	174.3	0	0	0	0	108.2	V257 L261 S266 L272	V257-V278 HydrophobicContact CG1-CG2 4.24Å; L261-V278 HydrophobicContact CD2-CG1 4.32Å; L261-V278 HydrophobicContact CD2-CG2 3.86Å; S266-V278 WeakPolarHBondContact OG-CG1 3.17Å; L272-V278 HydrophobicContact CB-CB 3.95Å; L272-V278 HydrophobicContact CB-CG2 3.72Å; L272-V278 HydrophobicContact CD1-CG2 3.83Å; L272-V278 HydrophobicContact CG-CG2 4.39Å
279	I	98.7	Very high	97.8	Very high	33 Å²	33	43 Å²	43	17%	0.169	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-135.1	151.9	-179.2	61.5	168.9	0	0	0	111	R241 R265 S266 D281	R241-I279 VanDerWaalsContact CD-CD1 3.49Å; R265-I279 WeakPolarHBondContact CA-O 3.35Å; R265-I279 VanDerWaalsContact CB-O 3.24Å; R265-I279 WeakPolarHBondContact CB-O 3.32Å; R265-I279 HydrophobicContact CG-CD1 4.42Å; R265-I279 HydrophobicContact CG-CG1 3.76Å; S266-I279 PolarHBondContact N-O 2.87Å; I279-D281 WeakPolarHBondContact CB-OD2 3.47Å; I279-D281 HydrophobicContact CD1-CB 3.91Å; I279-D281 HydrophobicContact CG1-CB 4.48Å
280	P	98.6	Very high	97.6	Very high	20 Å²	20	46.7 Å²	46.7	13%	0.13	25%	0.249	C	C	.	.			trans	-89.6	-1.7	176.7	36.6	-35.7	0	0	0	113.8	L174 D177 V210 L267 P282	L174-P280 HydrophobicContact CD2-CB 4.21Å; L174-P280 HydrophobicContact CD2-CG 3.73Å; D177-P280 HydrophobicContact CB-CB 3.96Å; D177-P280 HydrophobicContact CB-CG 4.45Å; D177-P280 WeakPolarHBondContact OD2-CB 3.31Å; D177-P280 VanDerWaalsContact OD2-CG 3.31Å; D177-P280 WeakPolarHBondContact OD2-CG 3.41Å; V210-P280 VanDerWaalsContact CG2-O 3.3Å; V210-P280 WeakPolarHBondContact CG2-O 3.49Å; L267-P280 HydrophobicContact CD2-CB 3.91Å; P280-P282 WeakPolarHBondContact O-CD 3.27Å
281	D	98.6	Very high	97.5	Very high	66 Å²	66	52.3 Å²	52.3	35%	0.353	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-60.5	120.9	-174	-56.9	-123.9	0	0	0	111.5	R265 I279	R265-D281 VanDerWaalsContact CD-O 3.27Å; R265-D281 WeakPolarHBondContact CD-O 3.35Å; R265-D281 PolarHBondContact NH1-O 3.32Å; I279-D281 WeakPolarHBondContact CB-OD2 3.47Å; I279-D281 HydrophobicContact CD1-CB 3.91Å; I279-D281 HydrophobicContact CG1-CB 4.48Å
282	P	98.6	Very high	97.4	Very high	11 Å²	11	52.4 Å²	52.4	7%	0.071	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-77.9	144.6	178.9	30.8	-33.5	0	0	0	112	E170 I173 A208 N209 V210 P280 I284	E170-P282 HydrophobicContact CB-CG 4.36Å; E170-P282 HydrophobicContact CG-CG 4.19Å; I173-P282 HydrophobicContact CD1-CB 4.06Å; I173-P282 HydrophobicContact CD1-CG 4.14Å; I173-P282 HydrophobicContact CG2-CG 4.46Å; A208-P282 HydrophobicContact CB-CB 4.13Å; N209-P282 VanDerWaalsContact O-CA 3.26Å; N209-P282 WeakPolarHBondContact O-CA 3.25Å; V210-P282 HydrophobicContact CG2-CB 3.76Å; P280-P282 WeakPolarHBondContact O-CD 3.27Å; P282-I284 HydrophobicContact CB-CD1 4.44Å; P282-I284 HydrophobicContact CB-CG1 4.02Å; P282-I284 HydrophobicContact CG-CD1 3.99Å; P282-I284 HydrophobicContact CG-CG1 4.07Å
283	D	98.5	Very high	97.3	Very high	55 Å²	55	57.4 Å²	57.4	29%	0.294	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128	156.3	-76.8	-0.9	0	0	0	107.5	A208 N209 H231 K237 R265	A208-D283 WeakPolarHBondContact CA-O 3.42Å; N209-D283 PolarHBondContact N-O 3.22Å; N209-D283 PolarHBondContact O-N 2.88Å; H231-D283 IonicContact NE2-OD1 2.8Å; H231-D283 IonicContact NE2-OD2 3.28Å; H231-D283 PolarHBondContact NE2-OD2 3.47Å; K237-D283 IonicContact NZ-OD1 3.46Å; K237-D283 PolarHBondContact NZ-OD1 2.86Å; K237-D283 IonicContact NZ-OD2 2.69Å; K237-D283 PolarHBondContact NZ-OD2 3.4Å; R265-D283 IonicContact CZ-OD1 3.27Å; R265-D283 IonicContact NH1-OD1 2.66Å; R265-D283 PolarHBondContact NH1-OD1 2.87Å; R265-D283 IonicContact NH2-OD1 3.71Å; R265-D283 PolarHBondContact NH2-OD1 3.22Å; R265-D283 VanDerWaalsContact NH2-OD1 3.15Å; R265-D283 IonicContact NH2-OD2 2.76Å; R265-D283 PolarHBondContact NH2-OD2 3.45Å
284	I	98.7	Very high	97.3	Very high	47 Å²	47	57.2 Å²	57.2	24%	0.241	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.3	-174.3	-52	-175.2	0	0	0	110.7	A166 L169 E170 T206 V207 A208 P282	A166-I284 HydrophobicContact CB-CG2 3.77Å; A166-I284 VanDerWaalsContact O-CD1 3.25Å; A166-I284 WeakPolarHBondContact O-CD1 3.35Å; L169-I284 HydrophobicContact CB-CD1 4.17Å; E170-I284 HydrophobicContact CB-CD1 3.75Å; T206-I284 HydrophobicContact CG2-CG2 3.65Å; V207-I284 CarbonylContact O-C 3.54Å; V207-I284 VanDerWaalsContact O-CA 3.3Å; V207-I284 WeakPolarHBondContact O-CA 3.3Å; A208-I284 HydrophobicContact CB-CD1 4.21Å; A208-I284 HydrophobicContact CB-CG1 3.82Å; P282-I284 HydrophobicContact CB-CD1 4.44Å; P282-I284 HydrophobicContact CB-CG1 4.02Å; P282-I284 HydrophobicContact CG-CD1 3.99Å; P282-I284 HydrophobicContact CG-CG1 4.07Å
285	M	98.5	Very high	97.3	Very high	63 Å²	63	54.2 Å²	54.2	31%	0.31	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.5	178.4	-60	-177.6	73	0	0	110.5	T206 V207 F287	T206-M285 CarbonylContact C-O 3.57Å; T206-M285 WeakPolarHBondContact CA-O 3.29Å; V207-M285 PolarHBondContact N-O 3.01Å; V207-M285 PolarHBondContact O-N 2.79Å; M285-F287 HydrophobicContact CB-CD2 4.49Å; M285-F287 HydrophobicContact CB-CE2 3.5Å; M285-F287 HydrophobicContact CB-CZ 3.61Å; M285-F287 HydrophobicContact CE-CE1 4.29Å; M285-F287 HydrophobicContact CE-CZ 3.85Å; M285-F287 HydrophobicContact CG-CZ 4.49Å; M285-F287 HydrophobicContact SD-CZ 4.21Å
286	T	98.1	Very high	97.4	Very high	70 Å²	70	49.9 Å²	49.9	43%	0.429	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.2	178.9	-61.9	0	0	0	0	110.1	E204 L205 T206	E204-T286 HydrophobicContact CG-CG2 3.36Å; E204-T286 WeakPolarHBondContact OE2-CG2 3.22Å; L205-T286 CarbonylContact O-C 3.6Å; L205-T286 WeakPolarHBondContact O-CA 3.14Å; T206-T286 WeakPolarHBondContact OG1-CG2 3.29Å; T206-T286 PolarHBondContact OG1-OG1 2.81Å
287	F	97.8	Very high	97.5	Very high	26 Å²	26	44.6 Å²	44.6	11%	0.114	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.4	-171.7	-58.2	-87.7	0	0	0	111.1	E204 L205 V207 V225 L227 M285 L292	E204-F287 WeakPolarHBondContact CA-O 3.06Å; L205-F287 HydrophobicContact CB-CB 4.34Å; L205-F287 HydrophobicContact CD2-CD2 4.49Å; L205-F287 HydrophobicContact CG-CD2 4.47Å; L205-F287 PolarHBondContact N-O 2.84Å; L205-F287 PolarHBondContact O-N 3.36Å; V207-F287 HydrophobicContact CG2-CE2 4.49Å; V225-F287 HydrophobicContact CG1-CE1 4.26Å; L227-F287 HydrophobicContact CB-CE2 4.19Å; L227-F287 HydrophobicContact CB-CZ 4.4Å; L227-F287 HydrophobicContact CD2-CD1 4.35Å; L227-F287 HydrophobicContact CD2-CD2 3.69Å; L227-F287 HydrophobicContact CD2-CE1 4.2Å; L227-F287 HydrophobicContact CD2-CE2 3.52Å; L227-F287 HydrophobicContact CD2-CG 4.12Å; L227-F287 HydrophobicContact CD2-CZ 3.81Å; M285-F287 HydrophobicContact CB-CD2 4.49Å; M285-F287 HydrophobicContact CB-CE2 3.5Å; M285-F287 HydrophobicContact CB-CZ 3.61Å; M285-F287 HydrophobicContact CE-CE1 4.29Å; M285-F287 HydrophobicContact CE-CZ 3.85Å; M285-F287 HydrophobicContact CG-CZ 4.49Å; M285-F287 HydrophobicContact SD-CZ 4.21Å; F287-L292 HydrophobicContact CB-CD1 3.85Å; F287-L292 HydrophobicContact CD1-CD1 4.16Å; F287-L292 HydrophobicContact CG-CD1 4.4Å
288	D	96.5	Very high	97.5	Very high	60 Å²	60	44.6 Å²	44.6	32%	0.321	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	110.7	176.9	-178.3	-24.1	0	0	0	109.9	D290 K291 L292	D288-D290 WeakPolarHBondContact OD1-CB 3.15Å; D288-D290 PolarHBondContact OD1-N 3.24Å; D288-K291 HydrophobicContact CB-CB 4.28Å; D288-K291 HydrophobicContact CB-CD 4.18Å; D288-K291 HydrophobicContact CB-CG 4.28Å; D288-K291 PolarHBondContact O-N 3.49Å; D288-K291 PolarHBondContact OD1-N 3.26Å; D288-K291 WeakPolarHBondContact OD2-CD 3.31Å; D288-K291 WeakPolarHBondContact OD2-CE 3.46Å; D288-K291 WeakPolarHBondContact OD2-CG 3.28Å; D288-K291 IonicContact OD2-NZ 2.73Å; D288-K291 PolarHBondContact OD2-NZ 2.91Å; D288-L292 WeakPolarHBondContact O-CG 3.21Å; D288-L292 PolarHBondContact O-N 3.2Å; D288-L292 VanDerWaalsContact O-N 3.1Å
289	L	95.9	Very high	97.5	Very high	15 Å²	15	44.5 Å²	44.5	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-74.9	-26.1	-175.5	-59.5	177.5	0	0	0	112.6	L200 R203 L205 K291 Q293 P294 F351	L200-L289 HydrophobicContact CD1-CD1 3.52Å; R203-L289 WeakPolarHBondContact O-CB 3.4Å; R203-L289 PolarHBondContact O-N 2.94Å; L205-L289 HydrophobicContact CB-CD1 4.45Å; L205-L289 HydrophobicContact CB-CD2 3.84Å; L205-L289 HydrophobicContact CB-CG 4.31Å; L289-K291 VanDerWaalsContact C-N 3.26Å; L289-K291 PolarHBondContact O-N 3.35Å; L289-Q293 WeakPolarHBondContact O-CA 3.29Å; L289-Q293 PolarHBondContact O-N 2.95Å; L289-P294 HydrophobicContact CD2-CG 3.81Å; L289-F351 HydrophobicContact CD1-CD1 4.5Å; L289-F351 HydrophobicContact CD1-CE1 4.12Å; L289-F351 HydrophobicContact CD2-CD1 4.43Å; L289-F351 HydrophobicContact CD2-CE1 3.74Å; L289-F351 HydrophobicContact CD2-CZ 4.36Å
290	D	94.7	Very high	97.6	Very high	87 Å²	87	42.9 Å²	42.9	47%	0.465	22%	0.218	S	C	.	.	H	α-helix	trans	-68	-33.2	175.9	-70.4	-23.4	0	0	0	110.1	R203 D288 Q293	R203-D290 VanDerWaalsContact CD-OD2 3.27Å; R203-D290 WeakPolarHBondContact CD-OD2 3.46Å; R203-D290 IonicContact CZ-OD2 3.77Å; R203-D290 IonicContact NE-OD2 3.58Å; R203-D290 IonicContact NH1-OD2 2.64Å; D288-D290 WeakPolarHBondContact OD1-CB 3.15Å; D288-D290 PolarHBondContact OD1-N 3.24Å; D290-Q293 WeakPolarHBondContact O-CG 3.39Å
291	K	94.9	Very high	97.6	Very high	155 Å²	155	42 Å²	42	67%	0.674	21%	0.212	S	C	*	.	H	α-helix	trans	-76.1	-47.1	174.3	-70	-176.9	-175.8	115	0	112.8	D288 L289	D288-K291 HydrophobicContact CB-CB 4.28Å; D288-K291 HydrophobicContact CB-CD 4.18Å; D288-K291 HydrophobicContact CB-CG 4.28Å; D288-K291 PolarHBondContact O-N 3.49Å; D288-K291 PolarHBondContact OD1-N 3.26Å; D288-K291 WeakPolarHBondContact OD2-CD 3.31Å; D288-K291 WeakPolarHBondContact OD2-CE 3.46Å; D288-K291 WeakPolarHBondContact OD2-CG 3.28Å; D288-K291 IonicContact OD2-NZ 2.73Å; D288-K291 PolarHBondContact OD2-NZ 2.91Å; L289-K291 VanDerWaalsContact C-N 3.26Å; L289-K291 PolarHBondContact O-N 3.35Å
292	L	95.3	Very high	97.5	Very high	38 Å²	38	39.6 Å²	39.6	20%	0.199	20%	0.2	C	C	.	.	H	α-helix	trans	-76.5	-32.6	-173.8	-69.9	174	0	0	0	113.2	L217 K220 F287 D288 P294	L217-L292 HydrophobicContact CD1-CD1 4.39Å; L217-L292 HydrophobicContact CD2-CD1 4.27Å; K220-L292 PolarHBondContact N-O 3.43Å; F287-L292 HydrophobicContact CB-CD1 3.85Å; F287-L292 HydrophobicContact CD1-CD1 4.16Å; F287-L292 HydrophobicContact CG-CD1 4.4Å; D288-L292 WeakPolarHBondContact O-CG 3.21Å; D288-L292 PolarHBondContact O-N 3.2Å; D288-L292 VanDerWaalsContact O-N 3.1Å; L292-P294 VanDerWaalsContact C-N 3.33Å
293	Q	96.3	Very high	97.5	Very high	115 Å²	115	39.1 Å²	39.1	54%	0.537	20%	0.196	S	C	.	.			trans	43.3	55.1	-173.8	-65.4	172.9	68	0	0	112.3	K220 L289 D290	K220-Q293 HydrophobicContact CB-CB 3.98Å; K220-Q293 WeakPolarHBondContact CB-O 3.49Å; K220-Q293 HydrophobicContact CD-CB 4.15Å; K220-Q293 HydrophobicContact CG-CB 4.43Å; K220-Q293 PolarHBondContact N-O 2.97Å; L289-Q293 WeakPolarHBondContact O-CA 3.29Å; L289-Q293 PolarHBondContact O-N 2.95Å; D290-Q293 WeakPolarHBondContact O-CG 3.39Å
294	P	97.1	Very high	97.5	Very high	14 Å²	14	36.5 Å²	36.5	9%	0.091	18%	0.182	C	C	.	.			trans	-66.3	154.7	-171.1	28.7	-36.6	0	0	0	113.3	L217 C218 L289 L292 F351	L217-P294 HydrophobicContact CD1-CB 3.6Å; L217-P294 HydrophobicContact CD1-CG 3.93Å; L217-P294 HydrophobicContact CD2-CB 3.87Å; L217-P294 HydrophobicContact CG-CB 3.67Å; C218-P294 CarbonylContact O-C 3.6Å; C218-P294 WeakPolarHBondContact O-CA 2.99Å; C218-P294 WeakPolarHBondContact O-CB 3.45Å; L289-P294 HydrophobicContact CD2-CG 3.81Å; L292-P294 VanDerWaalsContact C-N 3.33Å; P294-F351 HydrophobicContact CB-CD2 3.7Å; P294-F351 HydrophobicContact CB-CE2 3.81Å; P294-F351 HydrophobicContact CB-CG 4.11Å; P294-F351 HydrophobicContact CB-CZ 4.29Å; P294-F351 HydrophobicContact CG-CB 4.27Å; P294-F351 HydrophobicContact CG-CD1 3.6Å; P294-F351 HydrophobicContact CG-CD2 3.63Å; P294-F351 HydrophobicContact CG-CE1 3.71Å; P294-F351 HydrophobicContact CG-CE2 3.79Å; P294-F351 HydrophobicContact CG-CG 3.57Å; P294-F351 HydrophobicContact CG-CZ 3.83Å; P294-F351 VanDerWaalsContact O-CB 3.31Å; P294-F351 WeakPolarHBondContact O-CB 3.46Å
295	E	96.8	Very high	97.5	Very high	59 Å²	59	34.8 Å²	34.8	28%	0.276	17%	0.173	S	C	.	.	S	Bend	trans	-90.2	-47.1	172.9	-69.4	177.2	-137.3	0	0	111.1	C218 R318 F351	C218-E295 PolarHBondContact O-N 3.3Å; E295-R318 IonicContact OE1-CZ 3.63Å; E295-R318 IonicContact OE1-NH1 2.75Å; E295-R318 PolarHBondContact OE1-NH1 2.73Å; E295-R318 IonicContact OE1-NH2 3.13Å; E295-R318 PolarHBondContact OE1-NH2 3.33Å; E295-R318 IonicContact OE2-CZ 2.94Å; E295-R318 VanDerWaalsContact OE2-CZ 3.29Å; E295-R318 IonicContact OE2-NE 3.29Å; E295-R318 IonicContact OE2-NH1 3.01Å; E295-R318 PolarHBondContact OE2-NH1 2.67Å; E295-R318 IonicContact OE2-NH2 2.91Å; E295-R318 PolarHBondContact OE2-NH2 2.92Å; E295-F351 PolarHBondContact O-N 3.06Å
296	F	98.4	Very high	97.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	166.9	178.3	63.6	-85.8	0	0	0	111.2	C218 I298 V314 V317 R318 L321 V348 V349	C218-F296 HydrophobicContact CB-CD1 3.77Å; C218-F296 HydrophobicContact CB-CD2 4.22Å; C218-F296 HydrophobicContact CB-CE1 3.41Å; C218-F296 VanDerWaalsContact CB-CE1 3.41Å; C218-F296 HydrophobicContact CB-CE2 3.88Å; C218-F296 HydrophobicContact CB-CG 4.17Å; C218-F296 HydrophobicContact CB-CZ 3.47Å; C218-F296 VanDerWaalsContact CB-CZ 3.47Å; C218-F296 PolarHBondContact N-O 3.44Å; F296-I298 HydrophobicContact CD2-CG1 4.03Å; F296-I298 HydrophobicContact CE2-CD1 3.96Å; F296-I298 HydrophobicContact CE2-CG1 3.84Å; F296-V314 HydrophobicContact CZ-CG1 4.13Å; F296-V314 WeakPolarHBondContact CZ-O 3.43Å; F296-V317 HydrophobicContact CD2-CG1 3.79Å; F296-V317 HydrophobicContact CE1-CG1 4.49Å; F296-V317 HydrophobicContact CE2-CB 3.81Å; F296-V317 HydrophobicContact CE2-CG1 3.45Å; F296-V317 VanDerWaalsContact CE2-CG1 3.45Å; F296-V317 HydrophobicContact CG-CG1 4.45Å; F296-V317 HydrophobicContact CZ-CB 4.02Å; F296-V317 HydrophobicContact CZ-CG1 3.83Å; F296-R318 HydrophobicContact CE1-CB 3.77Å; F296-R318 HydrophobicContact CE1-CG 4.18Å; F296-R318 HydrophobicContact CZ-CB 3.96Å; F296-L321 HydrophobicContact CB-CD2 4.27Å; F296-L321 HydrophobicContact CD1-CD1 3.74Å; F296-L321 HydrophobicContact CD1-CD2 3.76Å; F296-L321 HydrophobicContact CD1-CG 4.25Å; F296-L321 HydrophobicContact CE1-CD1 4.04Å; F296-L321 HydrophobicContact CE1-CD2 4.25Å; F296-L321 HydrophobicContact CE1-CG 4.46Å; F296-L321 HydrophobicContact CG-CD2 3.97Å; F296-V348 HydrophobicContact CB-CG1 4.36Å; F296-V348 HydrophobicContact CD2-CG1 4.33Å; F296-V349 CarbonylContact C-O 3.49Å; F296-V349 WeakPolarHBondContact CA-O 3.09Å; F296-V349 WeakPolarHBondContact CB-O 3.32Å
297	M	98.7	Very high	97.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	151.8	165.4	63	178.3	-172.6	0	0	110.8	F124 A198 L205 V216 L217 L227 L299 V348 V349 F351	F124-M297 HydrophobicContact CD2-CE 3.52Å; F124-M297 HydrophobicContact CE2-CE 3.76Å; F124-M297 HydrophobicContact CG-CE 4.23Å; A198-M297 HydrophobicContact CB-CE 4.23Å; L205-M297 HydrophobicContact CD1-CE 4.47Å; L205-M297 HydrophobicContact CD1-SD 4.02Å; L205-M297 HydrophobicContact CD2-SD 4Å; V216-M297 CarbonylContact O-C 3.56Å; V216-M297 WeakPolarHBondContact O-CA 3Å; L217-M297 HydrophobicContact CB-CB 4.29Å; L227-M297 HydrophobicContact CD1-CB 4.03Å; L227-M297 HydrophobicContact CD1-SD 4.21Å; M297-L299 HydrophobicContact CE-CD1 4.26Å; M297-V348 WeakPolarHBondContact O-CA 3.28Å; M297-V349 HydrophobicContact CE-CB 3.69Å; M297-V349 HydrophobicContact CE-CG1 3.97Å; M297-V349 HydrophobicContact CE-CG2 3.61Å; M297-V349 HydrophobicContact CG-CB 3.81Å; M297-V349 HydrophobicContact CG-CG2 4.37Å; M297-V349 PolarHBondContact N-O 3.44Å; M297-V349 PolarHBondContact O-N 2.88Å; M297-F351 HydrophobicContact CB-CE2 3.96Å; M297-F351 HydrophobicContact CB-CZ 4.38Å; M297-F351 HydrophobicContact CG-CE2 3.92Å; M297-F351 HydrophobicContact CG-CZ 4.12Å; M297-F351 HydrophobicContact SD-CE2 4.46Å; M297-F351 HydrophobicContact SD-CZ 4.06Å
298	I	98.9	Very high	97.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.6	175.2	-53.3	173.6	0	0	0	107.1	G215 V216 F296 L304 W305 A313 V317 V346 M347 V348	G215-I298 CarbonylContact C-O 3.56Å; G215-I298 VanDerWaalsContact CA-O 3.28Å; G215-I298 WeakPolarHBondContact CA-O 3.5Å; V216-I298 PolarHBondContact N-O 3.49Å; V216-I298 PolarHBondContact O-N 3.46Å; F296-I298 HydrophobicContact CD2-CG1 4.03Å; F296-I298 HydrophobicContact CE2-CD1 3.96Å; F296-I298 HydrophobicContact CE2-CG1 3.84Å; I298-L304 HydrophobicContact CG2-CD2 4.02Å; I298-W305 HydrophobicContact CB-CH2 4.23Å; I298-W305 HydrophobicContact CG2-CH2 3.92Å; I298-W305 HydrophobicContact CG2-CZ2 3.98Å; I298-A313 HydrophobicContact CD1-CB 3.97Å; I298-V317 HydrophobicContact CD1-CB 4.11Å; I298-V317 HydrophobicContact CD1-CG2 3.73Å; I298-V317 HydrophobicContact CG1-CG2 4.37Å; I298-V346 HydrophobicContact CG2-CG1 3.79Å; I298-M347 CarbonylContact C-O 3.42Å; I298-M347 VanDerWaalsContact CA-O 3.3Å; I298-M347 WeakPolarHBondContact CA-O 3.37Å; I298-V348 HydrophobicContact CG1-CG2 4.47Å
299	L	98.9	Very high	97.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	127.6	168.1	-51.9	177.3	0	0	0	107.3	F124 I126 L196 A198 L227 M297 M347	F124-L299 HydrophobicContact CB-CD1 3.68Å; I126-L299 HydrophobicContact CG1-CB 3.93Å; L196-L299 HydrophobicContact CD2-CB 3.89Å; L196-L299 HydrophobicContact CD2-CD2 4.02Å; L196-L299 HydrophobicContact CD2-CG 4.48Å; L196-L299 HydrophobicContact CG-CD2 4.48Å; A198-L299 HydrophobicContact CB-CD1 3.87Å; A198-L299 HydrophobicContact CB-CD2 4.48Å; L227-L299 HydrophobicContact CD1-CD2 4.36Å; M297-L299 HydrophobicContact CE-CD1 4.26Å; L299-M347 HydrophobicContact CB-CB 4.31Å; L299-M347 HydrophobicContact CD1-SD 4.12Å; L299-M347 PolarHBondContact N-O 3.15Å; L299-M347 PolarHBondContact O-N 3.24Å
300	A	98.9	Very high	97.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	157.2	-176.2	0	0	0	0	0	113.5	S213 R214 L304 W305 T345 V346	S213-A300 WeakPolarHBondContact CA-O 3.47Å; R214-A300 PolarHBondContact N-O 3.41Å; R214-A300 PolarHBondContact O-N 2.88Å; A300-L304 HydrophobicContact CB-CB 3.83Å; A300-L304 HydrophobicContact CB-CD2 3.62Å; A300-L304 HydrophobicContact CB-CG 4.34Å; A300-W305 HydrophobicContact CB-CZ2 3.96Å; A300-W305 PolarHBondContact O-NE1 3.38Å; A300-T345 WeakPolarHBondContact CA-O 3.23Å; A300-T345 WeakPolarHBondContact CB-O 3.18Å; A300-V346 HydrophobicContact CB-CB 4.31Å; A300-V346 HydrophobicContact CB-CG1 4.38Å; A300-V346 HydrophobicContact CB-CG2 3.85Å
301	S	98.8	Very high	97.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.			trans	-68.8	167.9	167.2	48.3	0	0	0	0	111.6	D107 D128 G303 L304 T345	D107-S301 PolarHBondContact OD2-OG 3.36Å; D128-S301 VanDerWaalsContact OD2-CB 3.32Å; D128-S301 WeakPolarHBondContact OD2-CB 3.31Å; S301-G303 PolarHBondContact O-N 3.35Å; S301-L304 PolarHBondContact O-N 3.34Å; S301-L304 VanDerWaalsContact O-N 3.11Å; S301-T345 PolarHBondContact N-O 3.47Å; S301-T345 VanDerWaalsContact N-O 3.17Å; S301-T345 PolarHBondContact OG-N 3.5Å
302	D	98	Very high	97.8	Very high	17 Å²	17	31.6 Å²	31.6	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-65.3	-20.5	-178.9	75.3	-6.6	0	0	0	112.6	L304 W305 D306	D302-L304 CarbonylContact O-C 3.53Å; D302-L304 PolarHBondContact O-N 3.31Å; D302-W305 PolarHBondContact O-N 3.43Å; D302-D306 WeakPolarHBondContact O-CB 3.28Å; D302-D306 PolarHBondContact O-N 3.24Å
303	G	97.9	Very high	97.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-54.2	-20	169.7	0	0	0	0	0	114.5	S301 S335 C340 N343	S301-G303 PolarHBondContact O-N 3.35Å; G303-S335 PolarHBondContact O-OG 3.34Å; G303-C340 PolarHBondContact O-SG 2.89Å; G303-N343 WeakPolarHBondContact CA-O 3.36Å
304	L	98.6	Very high	98.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-88.9	-52.5	163.7	177.6	66.7	0	0	0	112.1	I298 A300 S301 D302 D306 A307 F308 I331 V346	I298-L304 HydrophobicContact CG2-CD2 4.02Å; A300-L304 HydrophobicContact CB-CB 3.83Å; A300-L304 HydrophobicContact CB-CD2 3.62Å; A300-L304 HydrophobicContact CB-CG 4.34Å; S301-L304 PolarHBondContact O-N 3.34Å; S301-L304 VanDerWaalsContact O-N 3.11Å; D302-L304 CarbonylContact O-C 3.53Å; D302-L304 PolarHBondContact O-N 3.31Å; L304-D306 VanDerWaalsContact C-N 3.28Å; L304-D306 PolarHBondContact O-N 2.82Å; L304-A307 PolarHBondContact O-N 2.87Å; L304-F308 HydrophobicContact CD1-CB 4.32Å; L304-F308 HydrophobicContact CD1-CD2 3.53Å; L304-F308 HydrophobicContact CD1-CE2 4.01Å; L304-F308 HydrophobicContact CD1-CG 4.05Å; L304-F308 HydrophobicContact CG-CD2 4.49Å; L304-F308 PolarHBondContact O-N 2.65Å; L304-F308 VanDerWaalsContact O-N 3.08Å; L304-I331 HydrophobicContact CD1-CD1 3.74Å; L304-I331 HydrophobicContact CD1-CG1 3.66Å; L304-I331 HydrophobicContact CD2-CD1 4.31Å; L304-V346 HydrophobicContact CB-CG2 3.97Å; L304-V346 HydrophobicContact CD1-CG2 4.27Å; L304-V346 HydrophobicContact CD2-CG1 4.3Å; L304-V346 HydrophobicContact CD2-CG2 3.82Å; L304-V346 HydrophobicContact CG-CG2 4.22Å
305	W	98.3	Very high	98.1	Very high	12 Å²	12	31 Å²	31	5%	0.045	15%	0.153	C	C	.	.	H	α-helix	trans	-71.6	-19.4	-165.7	-55.9	116.5	0	0	0	114.4	R214 V216 I298 A300 D302 A307 F308 A313	R214-W305 HydrophobicContact CB-CD2 4.09Å; R214-W305 HydrophobicContact CB-CG 3.98Å; R214-W305 HydrophobicContact CB-CZ2 4.4Å; R214-W305 VanDerWaalsContact O-CZ2 3.22Å; R214-W305 WeakPolarHBondContact O-CZ2 3.25Å; R214-W305 PolarHBondContact O-NE1 2.99Å; V216-W305 HydrophobicContact CB-CH2 3.93Å; V216-W305 HydrophobicContact CG2-CH2 3.44Å; V216-W305 VanDerWaalsContact CG2-CH2 3.44Å; V216-W305 HydrophobicContact CG2-CZ2 4.06Å; V216-W305 HydrophobicContact CG2-CZ3 3.78Å; I298-W305 HydrophobicContact CB-CH2 4.23Å; I298-W305 HydrophobicContact CG2-CH2 3.92Å; I298-W305 HydrophobicContact CG2-CZ2 3.98Å; A300-W305 HydrophobicContact CB-CZ2 3.96Å; A300-W305 PolarHBondContact O-NE1 3.38Å; D302-W305 PolarHBondContact O-N 3.43Å; W305-A307 PolarHBondContact O-N 3.02Å; W305-F308 VanDerWaalsContact O-O 3.13Å; W305-A313 HydrophobicContact CH2-CB 4.33Å; W305-A313 HydrophobicContact CZ3-CB 3.81Å
306	D	94.6	Very high	98.2	Very high	115 Å²	115	29.7 Å²	29.7	62%	0.615	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.8	170.2	-85.3	4.5	0	0	0	112.3	D302 L304	D302-D306 WeakPolarHBondContact O-CB 3.28Å; D302-D306 PolarHBondContact O-N 3.24Å; L304-D306 VanDerWaalsContact C-N 3.28Å; L304-D306 PolarHBondContact O-N 2.82Å
307	A	95	Very high	98.2	Very high	27 Å²	27	29.7 Å²	29.7	22%	0.223	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-15.8	-179.2	0	0	0	0	0	114	L304 W305 S335 R338	L304-A307 PolarHBondContact O-N 2.87Å; W305-A307 PolarHBondContact O-N 3.02Å; A307-S335 WeakPolarHBondContact CB-OG 3.46Å; A307-R338 HydrophobicContact CB-CB 4.35Å; A307-R338 PolarHBondContact O-NH1 2.78Å
308	F	98.1	Very high	98.2	Very high	7 Å²	7	34 Å²	34	3%	0.031	16%	0.163	C	C	.	.			trans	-133.6	136.1	-174.7	-74.9	-99	0	0	0	112.6	L304 W305 E312 A313 F316 I331 Q334	L304-F308 HydrophobicContact CD1-CB 4.32Å; L304-F308 HydrophobicContact CD1-CD2 3.53Å; L304-F308 HydrophobicContact CD1-CE2 4.01Å; L304-F308 HydrophobicContact CD1-CG 4.05Å; L304-F308 HydrophobicContact CG-CD2 4.49Å; L304-F308 PolarHBondContact O-N 2.65Å; L304-F308 VanDerWaalsContact O-N 3.08Å; W305-F308 VanDerWaalsContact O-O 3.13Å; F308-E312 HydrophobicContact CD1-CB 4.04Å; F308-A313 HydrophobicContact CB-CB 4.24Å; F308-F316 HydrophobicContact CE1-CD2 4.47Å; F308-I331 HydrophobicContact CD1-CD1 4.24Å; F308-I331 HydrophobicContact CD1-CG1 4.49Å; F308-I331 HydrophobicContact CE1-CD1 4.21Å; F308-I331 HydrophobicContact CE1-CG1 4.05Å; F308-I331 HydrophobicContact CE2-CG1 4.13Å; F308-I331 HydrophobicContact CZ-CD1 4.46Å; F308-I331 HydrophobicContact CZ-CG1 3.84Å; F308-Q334 HydrophobicContact CE2-CG 4.41Å; F308-Q334 HydrophobicContact CZ-CB 3.97Å; F308-Q334 HydrophobicContact CZ-CG 3.62Å
309	S	98.6	Very high	98.1	Very high	46 Å²	46	40.5 Å²	40.5	32%	0.322	19%	0.193	S	C	.	.			trans	-73.6	163	161.9	66.5	0	0	0	0	111.1	E311 E312 A313	S309-E311 VanDerWaalsContact C-N 3.29Å; S309-E311 PolarHBondContact O-N 3Å; S309-E312 PolarHBondContact O-N 3.36Å; S309-E312 WeakPolarHBondContact OG-CB 3.49Å; S309-E312 VanDerWaalsContact OG-CG 3.29Å; S309-E312 WeakPolarHBondContact OG-CG 3.47Å; S309-E312 PolarHBondContact OG-N 2.89Å; S309-A313 WeakPolarHBondContact O-CB 3.19Å; S309-A313 PolarHBondContact O-N 2.92Å
310	N	98.8	Very high	98	Very high	27 Å²	27	43.5 Å²	43.5	14%	0.144	20%	0.204	C	C	.	.	H	α-helix	trans	-56.7	-45.2	177.2	-64.8	-4.9	0	0	0	111	R214 V216 A224 A313 V314	R214-N310 WeakPolarHBondContact CD-OD1 3.12Å; R214-N310 PolarHBondContact NH1-OD1 2.93Å; V216-N310 HydrophobicContact CG1-CB 4Å; V216-N310 HydrophobicContact CG2-CB 4.09Å; V216-N310 WeakPolarHBondContact CG2-OD1 3.23Å; A224-N310 HydrophobicContact CB-CB 3.98Å; N310-A313 PolarHBondContact O-N 3.08Å; N310-V314 WeakPolarHBondContact O-CG2 3.39Å; N310-V314 PolarHBondContact O-N 3.48Å
311	E	98.8	Very high	97.9	Very high	105 Å²	105	44.8 Å²	44.8	49%	0.491	21%	0.211	S	C	.	.	H	α-helix	trans	-69.4	-37.9	-178.3	-62.8	72.2	-158.5	0	0	112.4	A224 S309 R315	A224-E311 HydrophobicContact CB-CG 4.26Å; S309-E311 VanDerWaalsContact C-N 3.29Å; S309-E311 PolarHBondContact O-N 3Å; E311-R315 WeakPolarHBondContact O-CB 3.48Å; E311-R315 PolarHBondContact O-N 2.6Å; E311-R315 VanDerWaalsContact O-N 3.1Å
312	E	98.6	Very high	97.7	Very high	82 Å²	82	52.8 Å²	52.8	38%	0.383	25%	0.254	S	S	.	.	H	α-helix	trans	-66.2	-45.5	175.2	-78.4	-176.4	-169.7	0	0	111.4	F308 S309 R315 F316 R338	F308-E312 HydrophobicContact CD1-CB 4.04Å; S309-E312 PolarHBondContact O-N 3.36Å; S309-E312 WeakPolarHBondContact OG-CB 3.49Å; S309-E312 VanDerWaalsContact OG-CG 3.29Å; S309-E312 WeakPolarHBondContact OG-CG 3.47Å; S309-E312 PolarHBondContact OG-N 2.89Å; E312-R315 PolarHBondContact O-N 2.76Å; E312-F316 VanDerWaalsContact O-CB 3.25Å; E312-F316 WeakPolarHBondContact O-CB 3.39Å; E312-F316 PolarHBondContact O-N 3.49Å; E312-R338 IonicContact OE2-CZ 3.85Å; E312-R338 IonicContact OE2-NH1 3.76Å; E312-R338 PolarHBondContact OE2-NH1 2.85Å; E312-R338 IonicContact OE2-NH2 3.6Å
313	A	98.8	Very high	97.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-46.9	-179.9	0	0	0	0	0	111.6	I298 W305 F308 S309 N310 R315 F316 V317 I331	I298-A313 HydrophobicContact CD1-CB 3.97Å; W305-A313 HydrophobicContact CH2-CB 4.33Å; W305-A313 HydrophobicContact CZ3-CB 3.81Å; F308-A313 HydrophobicContact CB-CB 4.24Å; S309-A313 WeakPolarHBondContact O-CB 3.19Å; S309-A313 PolarHBondContact O-N 2.92Å; N310-A313 PolarHBondContact O-N 3.08Å; A313-R315 PolarHBondContact O-N 3.34Å; A313-F316 PolarHBondContact O-N 2.94Å; A313-V317 WeakPolarHBondContact O-CB 3.25Å; A313-V317 WeakPolarHBondContact O-CG2 3.3Å; A313-V317 PolarHBondContact O-N 3.44Å; A313-I331 HydrophobicContact CB-CD1 3.83Å
314	V	98.8	Very high	97.1	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-48.9	176.7	164.1	0	0	0	0	110.9	V216 C218 A224 F296 N310 F316 V317 R318	V216-V314 HydrophobicContact CG1-CG2 3.72Å; C218-V314 HydrophobicContact CB-CG1 3.77Å; C218-V314 HydrophobicContact CB-CG2 4.42Å; A224-V314 HydrophobicContact CB-CB 4.21Å; A224-V314 HydrophobicContact CB-CG2 3.78Å; F296-V314 HydrophobicContact CZ-CG1 4.13Å; F296-V314 WeakPolarHBondContact CZ-O 3.43Å; N310-V314 WeakPolarHBondContact O-CG2 3.39Å; N310-V314 PolarHBondContact O-N 3.48Å; V314-F316 VanDerWaalsContact C-N 3.35Å; V314-F316 PolarHBondContact O-N 2.91Å; V314-V317 PolarHBondContact O-N 3.4Å; V314-R318 WeakPolarHBondContact O-CB 3.42Å; V314-R318 PolarHBondContact O-N 3.31Å
315	R	98.6	Very high	96.9	Very high	151 Å²	151	60.5 Å²	60.5	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-60.5	-45.8	178.8	-169.1	-174.3	-46.4	158.4	11.8	111.9	E311 E312 A313 V317 R318 E319	E311-R315 WeakPolarHBondContact O-CB 3.48Å; E311-R315 PolarHBondContact O-N 2.6Å; E311-R315 VanDerWaalsContact O-N 3.1Å; E312-R315 PolarHBondContact O-N 2.76Å; A313-R315 PolarHBondContact O-N 3.34Å; R315-V317 PolarHBondContact O-N 3.36Å; R315-R318 PolarHBondContact O-N 2.76Å; R315-E319 WeakPolarHBondContact O-CG 3.39Å; R315-E319 PolarHBondContact O-N 3.22Å
316	F	98.4	Very high	96.9	Very high	33 Å²	33	60.6 Å²	60.6	15%	0.145	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-45.8	-178.7	-174.8	-80.6	0	0	0	112.1	F308 E312 A313 V314 R320 I331 Q334	F308-F316 HydrophobicContact CE1-CD2 4.47Å; E312-F316 VanDerWaalsContact O-CB 3.25Å; E312-F316 WeakPolarHBondContact O-CB 3.39Å; E312-F316 PolarHBondContact O-N 3.49Å; A313-F316 PolarHBondContact O-N 2.94Å; V314-F316 VanDerWaalsContact C-N 3.35Å; V314-F316 PolarHBondContact O-N 2.91Å; F316-R320 PolarHBondContact O-NH1 3.34Å; F316-R320 VanDerWaalsContact O-NH1 3.09Å; F316-I331 HydrophobicContact CB-CD1 4.43Å; F316-I331 HydrophobicContact CD1-CB 3.65Å; F316-I331 HydrophobicContact CD1-CD1 4.1Å; F316-I331 HydrophobicContact CD1-CG1 3.79Å; F316-I331 HydrophobicContact CE1-CB 3.65Å; F316-I331 HydrophobicContact CE1-CG1 4.12Å; F316-I331 HydrophobicContact CG-CD1 4.47Å; F316-I331 HydrophobicContact CG-CG1 4.37Å; F316-Q334 HydrophobicContact CE2-CB 4.23Å; F316-Q334 HydrophobicContact CE2-CG 4.03Å; F316-Q334 HydrophobicContact CZ-CB 4.02Å; F316-Q334 HydrophobicContact CZ-CG 4.33Å
317	V	98.5	Very high	97	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-72.2	-41.1	-179.8	170.4	0	0	0	0	111.6	F296 I298 A313 V314 R315 E319 R320 L321 F326 I331 V348	F296-V317 HydrophobicContact CD2-CG1 3.79Å; F296-V317 HydrophobicContact CE1-CG1 4.49Å; F296-V317 HydrophobicContact CE2-CB 3.81Å; F296-V317 HydrophobicContact CE2-CG1 3.45Å; F296-V317 VanDerWaalsContact CE2-CG1 3.45Å; F296-V317 HydrophobicContact CG-CG1 4.45Å; F296-V317 HydrophobicContact CZ-CB 4.02Å; F296-V317 HydrophobicContact CZ-CG1 3.83Å; I298-V317 HydrophobicContact CD1-CB 4.11Å; I298-V317 HydrophobicContact CD1-CG2 3.73Å; I298-V317 HydrophobicContact CG1-CG2 4.37Å; A313-V317 WeakPolarHBondContact O-CB 3.25Å; A313-V317 WeakPolarHBondContact O-CG2 3.3Å; A313-V317 PolarHBondContact O-N 3.44Å; V314-V317 PolarHBondContact O-N 3.4Å; R315-V317 PolarHBondContact O-N 3.36Å; V317-E319 VanDerWaalsContact C-N 3.27Å; V317-E319 PolarHBondContact O-N 3.21Å; V317-R320 CarbonylContact O-C 3.44Å; V317-R320 WeakPolarHBondContact O-CA 3.16Å; V317-R320 PolarHBondContact O-N 2.91Å; V317-L321 HydrophobicContact CG1-CD2 3.98Å; V317-L321 PolarHBondContact O-N 3.38Å; V317-F326 WeakPolarHBondContact CG1-O 3.39Å; V317-I331 HydrophobicContact CG2-CB 4.41Å; V317-I331 HydrophobicContact CG2-CD1 3.97Å; V317-I331 HydrophobicContact CG2-CG2 4.26Å; V317-V348 HydrophobicContact CG1-CG1 4.02Å; V317-V348 HydrophobicContact CG1-CG2 4.05Å; V317-V348 HydrophobicContact CG2-CG2 4.44Å
318	R	97.8	Very high	97.1	Very high	91 Å²	91	53.8 Å²	53.8	34%	0.343	26%	0.258	S	S	.	.	H	α-helix	trans	-56.3	-40.6	-179.7	-173.5	-175.1	178.9	104.3	4.9	112.2	C218 E295 F296 V314 R315 R320	C218-R318 PolarHBondContact SG-NH1 3.06Å; E295-R318 IonicContact OE1-CZ 3.63Å; E295-R318 IonicContact OE1-NH1 2.75Å; E295-R318 PolarHBondContact OE1-NH1 2.73Å; E295-R318 IonicContact OE1-NH2 3.13Å; E295-R318 PolarHBondContact OE1-NH2 3.33Å; E295-R318 IonicContact OE2-CZ 2.94Å; E295-R318 VanDerWaalsContact OE2-CZ 3.29Å; E295-R318 IonicContact OE2-NE 3.29Å; E295-R318 IonicContact OE2-NH1 3.01Å; E295-R318 PolarHBondContact OE2-NH1 2.67Å; E295-R318 IonicContact OE2-NH2 2.91Å; E295-R318 PolarHBondContact OE2-NH2 2.92Å; F296-R318 HydrophobicContact CE1-CB 3.77Å; F296-R318 HydrophobicContact CE1-CG 4.18Å; F296-R318 HydrophobicContact CZ-CB 3.96Å; V314-R318 WeakPolarHBondContact O-CB 3.42Å; V314-R318 PolarHBondContact O-N 3.31Å; R315-R318 PolarHBondContact O-N 2.76Å; R318-R320 PolarHBondContact O-N 3.01Å
319	E	97.3	Very high	97.1	Very high	136 Å²	136	56.7 Å²	56.7	64%	0.636	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.7	176.6	-69.1	171.9	-178	0	0	114	R315 V317	R315-E319 WeakPolarHBondContact O-CG 3.39Å; R315-E319 PolarHBondContact O-N 3.22Å; V317-E319 VanDerWaalsContact C-N 3.27Å; V317-E319 PolarHBondContact O-N 3.21Å
320	R	97.6	Very high	97	Very high	63 Å²	63	56 Å²	56	24%	0.238	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	15.8	-167.5	-65.9	178.4	175.4	64.6	8.3	113.2	F316 V317 R318 D322 E323 F326 G327	F316-R320 PolarHBondContact O-NH1 3.34Å; F316-R320 VanDerWaalsContact O-NH1 3.09Å; V317-R320 CarbonylContact O-C 3.44Å; V317-R320 WeakPolarHBondContact O-CA 3.16Å; V317-R320 PolarHBondContact O-N 2.91Å; R318-R320 PolarHBondContact O-N 3.01Å; R320-D322 PolarHBondContact O-N 3.44Å; R320-D322 VanDerWaalsContact O-N 3.16Å; R320-E323 HydrophobicContact CB-CB 4.45Å; R320-E323 HydrophobicContact CB-CG 3.94Å; R320-E323 WeakPolarHBondContact CD-OE1 3.44Å; R320-E323 HydrophobicContact CG-CG 4.29Å; R320-E323 VanDerWaalsContact CG-OE1 3.31Å; R320-E323 WeakPolarHBondContact CG-OE1 3.43Å; R320-E323 IonicContact NE-OE1 3.43Å; R320-E323 VanDerWaalsContact O-CB 3.29Å; R320-E323 WeakPolarHBondContact O-CB 3.39Å; R320-E323 PolarHBondContact O-N 3.45Å; R320-F326 CarbonylContact O-C 3.55Å; R320-G327 PolarHBondContact O-N 2.88Å
321	L	95.9	Very high	97	Very high	27 Å²	27	54.8 Å²	54.8	14%	0.141	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.8	179.3	-70.4	175.3	0	0	0	113.5	F296 V317 F326 V348 K350	F296-L321 HydrophobicContact CB-CD2 4.27Å; F296-L321 HydrophobicContact CD1-CD1 3.74Å; F296-L321 HydrophobicContact CD1-CD2 3.76Å; F296-L321 HydrophobicContact CD1-CG 4.25Å; F296-L321 HydrophobicContact CE1-CD1 4.04Å; F296-L321 HydrophobicContact CE1-CD2 4.25Å; F296-L321 HydrophobicContact CE1-CG 4.46Å; F296-L321 HydrophobicContact CG-CD2 3.97Å; V317-L321 HydrophobicContact CG1-CD2 3.98Å; V317-L321 PolarHBondContact O-N 3.38Å; L321-F326 HydrophobicContact CD2-CB 4.42Å; L321-F326 WeakPolarHBondContact O-CD1 3.27Å; L321-V348 HydrophobicContact CD2-CG1 4.5Å; L321-K350 HydrophobicContact CD2-CD 4.3Å; L321-K350 HydrophobicContact CD2-CG 4.37Å
322	D	94.4	Very high	96.9	Very high	168 Å²	168	49.8 Å²	49.8	90%	0.898	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-10	176.7	-63.1	-36.9	0	0	0	113.2	R320	R320-D322 PolarHBondContact O-N 3.44Å; R320-D322 VanDerWaalsContact O-N 3.16Å
323	E	93.8	Very high	96.8	Very high	68 Å²	68	47.6 Å²	47.6	32%	0.318	23%	0.226	S	C	.	.	S	Bend	trans	-70.3	160.4	174.6	-64.9	-175.3	173.7	0	0	111.5	R320 H325 F326 S330	R320-E323 HydrophobicContact CB-CB 4.45Å; R320-E323 HydrophobicContact CB-CG 3.94Å; R320-E323 WeakPolarHBondContact CD-OE1 3.44Å; R320-E323 HydrophobicContact CG-CG 4.29Å; R320-E323 VanDerWaalsContact CG-OE1 3.31Å; R320-E323 WeakPolarHBondContact CG-OE1 3.43Å; R320-E323 IonicContact NE-OE1 3.43Å; R320-E323 VanDerWaalsContact O-CB 3.29Å; R320-E323 WeakPolarHBondContact O-CB 3.39Å; R320-E323 PolarHBondContact O-N 3.45Å; E323-H325 PolarHBondContact O-N 3.32Å; E323-F326 PolarHBondContact O-N 2.99Å; E323-S330 WeakPolarHBondContact OE2-CB 3.43Å; E323-S330 PolarHBondContact OE2-OG 2.89Å
324	P	89.6	Confident	96.7	Very high	89 Å²	89	51.1 Å²	51.1	58%	0.578	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-50.6	138.5	163.8	-24.7	34.7	0	0	0	110.9	F326	P324-F326 PolarHBondContact O-N 3.16Å
325	H	95.3	Very high	96.6	Very high	21 Å²	21	51 Å²	51	10%	0.097	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	62	19.3	-176	-53.1	92.1	0	0	0	115.5	E87 A94 E323 G327 A328 K329	E87-H325 IonicContact OE2-CE1 3.1Å; E87-H325 PolarHBondContact OE2-CE1 3.24Å; E87-H325 VanDerWaalsContact OE2-CE1 3.27Å; E87-H325 IonicContact OE2-NE2 3.87Å; E87-H325 PolarHBondContact OE2-NE2 3.35Å; A94-H325 VanDerWaalsContact CB-C 3.49Å; A94-H325 HydrophobicContact CB-CB 3.75Å; A94-H325 VanDerWaalsContact CB-O 3.3Å; A94-H325 WeakPolarHBondContact CB-O 3.29Å; E323-H325 PolarHBondContact O-N 3.32Å; H325-G327 PolarHBondContact O-N 3.42Å; H325-G327 VanDerWaalsContact O-N 3.14Å; H325-A328 HydrophobicContact CB-CB 4.21Å; H325-A328 WeakPolarHBondContact O-CB 3.31Å; H325-A328 PolarHBondContact O-N 2.79Å; H325-K329 HydrophobicContact CB-CB 4.17Å
326	F	97.1	Very high	96.4	Very high	14 Å²	14	44 Å²	44	6%	0.061	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	54.6	35.8	175.1	-44.2	-46.8	0	0	0	112.7	N91 A94 V317 R320 L321 E323 P324 A328 V348 K350	N91-F326 WeakPolarHBondContact O-CZ 3.38Å; A94-F326 HydrophobicContact CB-CD2 3.66Å; A94-F326 HydrophobicContact CB-CE2 4.07Å; A94-F326 HydrophobicContact CB-CG 4.43Å; V317-F326 WeakPolarHBondContact CG1-O 3.39Å; R320-F326 CarbonylContact O-C 3.55Å; L321-F326 HydrophobicContact CD2-CB 4.42Å; L321-F326 WeakPolarHBondContact O-CD1 3.27Å; E323-F326 PolarHBondContact O-N 2.99Å; P324-F326 PolarHBondContact O-N 3.16Å; F326-A328 VanDerWaalsContact C-N 3.31Å; F326-A328 PolarHBondContact O-N 3.42Å; F326-V348 HydrophobicContact CB-CB 4.32Å; F326-V348 HydrophobicContact CB-CG1 3.86Å; F326-K350 HydrophobicContact CB-CD 4.31Å; F326-K350 HydrophobicContact CB-CG 4.39Å; F326-K350 HydrophobicContact CD1-CD 3.77Å; F326-K350 VanDerWaalsContact CD1-CE 3.48Å; F326-K350 HydrophobicContact CD1-CG 4.48Å; F326-K350 HydrophobicContact CD2-CD 4.29Å; F326-K350 HydrophobicContact CD2-CG 4.14Å; F326-K350 HydrophobicContact CE1-CD 4.14Å; F326-K350 HydrophobicContact CG-CD 3.85Å; F326-K350 HydrophobicContact CG-CG 4.07Å
327	G	96.6	Very high	96.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	82.4	-7.7	-177.4	0	0	0	0	0	115.7	R320 H325 K329 S330 I331	R320-G327 PolarHBondContact O-N 2.88Å; H325-G327 PolarHBondContact O-N 3.42Å; H325-G327 VanDerWaalsContact O-N 3.14Å; G327-K329 PolarHBondContact O-N 3.33Å; G327-S330 PolarHBondContact O-N 3.22Å; G327-I331 PolarHBondContact O-N 3.23Å
328	A	98.3	Very high	96	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-46.1	-179.9	0	0	0	0	0	112.3	H325 F326 S330 I331 V332 V346 V348	H325-A328 HydrophobicContact CB-CB 4.21Å; H325-A328 WeakPolarHBondContact O-CB 3.31Å; H325-A328 PolarHBondContact O-N 2.79Å; F326-A328 VanDerWaalsContact C-N 3.31Å; F326-A328 PolarHBondContact O-N 3.42Å; A328-S330 PolarHBondContact O-N 2.86Å; A328-I331 WeakPolarHBondContact O-CG2 3.37Å; A328-I331 PolarHBondContact O-N 3.35Å; A328-V332 VanDerWaalsContact O-CG2 3.24Å; A328-V332 WeakPolarHBondContact O-CG2 3.48Å; A328-V332 PolarHBondContact O-N 2.86Å; A328-V332 VanDerWaalsContact O-N 3.1Å; A328-V346 HydrophobicContact CB-CG1 4.44Å; A328-V348 HydrophobicContact CB-CB 4.27Å; A328-V348 HydrophobicContact CB-CG2 3.76Å
329	K	97.1	Very high	95.6	Very high	67 Å²	67	51.1 Å²	51.1	29%	0.291	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-47.3	175.8	179.7	166.3	-171.9	157.9	0	111.5	E87 Y96 H325 G327 I331 V332 L333	E87-K329 IonicContact OE1-NZ 3.85Å; Y96-K329 HydrophobicContact CD1-CB 4.17Å; Y96-K329 HydrophobicContact CD1-CG 4.04Å; Y96-K329 HydrophobicContact CD2-CB 3.78Å; Y96-K329 HydrophobicContact CD2-CD 3.94Å; Y96-K329 HydrophobicContact CD2-CG 3.83Å; Y96-K329 HydrophobicContact CE1-CB 4.49Å; Y96-K329 HydrophobicContact CE1-CD 4.45Å; Y96-K329 HydrophobicContact CE1-CG 3.86Å; Y96-K329 HydrophobicContact CE2-CB 4.14Å; Y96-K329 HydrophobicContact CE2-CD 3.45Å; Y96-K329 VanDerWaalsContact CE2-CD 3.45Å; Y96-K329 HydrophobicContact CE2-CG 3.65Å; Y96-K329 HydrophobicContact CG-CB 3.8Å; Y96-K329 HydrophobicContact CG-CG 4.02Å; Y96-K329 VanDerWaalsContact OH-CE 3.28Å; Y96-K329 WeakPolarHBondContact OH-CE 3.39Å; Y96-K329 PolarHBondContact OH-NZ 3.32Å; H325-K329 HydrophobicContact CB-CB 4.17Å; G327-K329 PolarHBondContact O-N 3.33Å; K329-I331 PolarHBondContact O-N 2.78Å; K329-V332 PolarHBondContact O-N 3.11Å; K329-L333 HydrophobicContact CG-CD1 4.13Å; K329-L333 HydrophobicContact CG-CG 4.49Å; K329-L333 WeakPolarHBondContact O-CG 3.25Å; K329-L333 PolarHBondContact O-N 2.95Å
330	S	97.1	Very high	95.4	Very high	33 Å²	33	45.1 Å²	45.1	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-40.6	-177.3	-59.5	0	0	0	0	112.1	E323 G327 A328 Q334	E323-S330 WeakPolarHBondContact OE2-CB 3.43Å; E323-S330 PolarHBondContact OE2-OG 2.89Å; G327-S330 PolarHBondContact O-N 3.22Å; A328-S330 PolarHBondContact O-N 2.86Å; S330-Q334 WeakPolarHBondContact O-CB 3.37Å; S330-Q334 PolarHBondContact O-N 2.82Å
331	I	98.3	Very high	95.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-74.6	-34.3	180	-161.3	174.1	0	0	0	112.3	L304 F308 A313 F316 V317 G327 A328 K329 Q334 S335 V346	L304-I331 HydrophobicContact CD1-CD1 3.74Å; L304-I331 HydrophobicContact CD1-CG1 3.66Å; L304-I331 HydrophobicContact CD2-CD1 4.31Å; F308-I331 HydrophobicContact CD1-CD1 4.24Å; F308-I331 HydrophobicContact CD1-CG1 4.49Å; F308-I331 HydrophobicContact CE1-CD1 4.21Å; F308-I331 HydrophobicContact CE1-CG1 4.05Å; F308-I331 HydrophobicContact CE2-CG1 4.13Å; F308-I331 HydrophobicContact CZ-CD1 4.46Å; F308-I331 HydrophobicContact CZ-CG1 3.84Å; A313-I331 HydrophobicContact CB-CD1 3.83Å; F316-I331 HydrophobicContact CB-CD1 4.43Å; F316-I331 HydrophobicContact CD1-CB 3.65Å; F316-I331 HydrophobicContact CD1-CD1 4.1Å; F316-I331 HydrophobicContact CD1-CG1 3.79Å; F316-I331 HydrophobicContact CE1-CB 3.65Å; F316-I331 HydrophobicContact CE1-CG1 4.12Å; F316-I331 HydrophobicContact CG-CD1 4.47Å; F316-I331 HydrophobicContact CG-CG1 4.37Å; V317-I331 HydrophobicContact CG2-CB 4.41Å; V317-I331 HydrophobicContact CG2-CD1 3.97Å; V317-I331 HydrophobicContact CG2-CG2 4.26Å; G327-I331 PolarHBondContact O-N 3.23Å; A328-I331 WeakPolarHBondContact O-CG2 3.37Å; A328-I331 PolarHBondContact O-N 3.35Å; K329-I331 PolarHBondContact O-N 2.78Å; I331-Q334 PolarHBondContact O-N 2.8Å; I331-S335 PolarHBondContact O-N 2.93Å; I331-V346 HydrophobicContact CG2-CB 4.34Å; I331-V346 HydrophobicContact CG2-CG1 3.85Å; I331-V346 HydrophobicContact CG2-CG2 4.26Å
332	V	98.2	Very high	95.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.1	-51	171.9	168	0	0	0	0	110.8	Y96 I98 A328 K329 Q334 S335 F336 I344 V346	Y96-V332 HydrophobicContact CD1-CB 3.81Å; Y96-V332 HydrophobicContact CD1-CG1 3.71Å; Y96-V332 HydrophobicContact CD1-CG2 4.09Å; Y96-V332 HydrophobicContact CE1-CG1 4.14Å; Y96-V332 WeakPolarHBondContact O-CG2 3.49Å; I98-V332 HydrophobicContact CB-CG1 4.45Å; I98-V332 HydrophobicContact CD1-CG1 3.69Å; I98-V332 HydrophobicContact CG1-CG1 3.64Å; I98-V332 HydrophobicContact CG2-CG1 4.1Å; A328-V332 VanDerWaalsContact O-CG2 3.24Å; A328-V332 WeakPolarHBondContact O-CG2 3.48Å; A328-V332 PolarHBondContact O-N 2.86Å; A328-V332 VanDerWaalsContact O-N 3.1Å; K329-V332 PolarHBondContact O-N 3.11Å; V332-Q334 VanDerWaalsContact C-N 3.27Å; V332-Q334 PolarHBondContact O-N 3.3Å; V332-S335 PolarHBondContact O-N 2.8Å; V332-S335 VanDerWaalsContact O-N 3.15Å; V332-F336 PolarHBondContact O-N 2.98Å; V332-I344 HydrophobicContact CB-CG2 4.31Å; V332-I344 HydrophobicContact CG1-CB 4.09Å; V332-I344 HydrophobicContact CG1-CG2 3.97Å; V332-I344 HydrophobicContact CG2-CG2 4.09Å; V332-V346 HydrophobicContact CG2-CB 3.63Å; V332-V346 HydrophobicContact CG2-CG2 3.44Å; V332-V346 VanDerWaalsContact CG2-CG2 3.44Å
333	L	95.7	Very high	95.3	Very high	37 Å²	37	37.6 Å²	37.6	19%	0.194	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-39.8	177.8	-66.5	179.1	0	0	0	111.1	F82 K329 S335 F336 Y337	F82-L333 HydrophobicContact CD1-CD2 4.45Å; F82-L333 HydrophobicContact CE1-CD2 3.41Å; F82-L333 VanDerWaalsContact CE1-CD2 3.41Å; F82-L333 HydrophobicContact CZ-CD2 3.69Å; K329-L333 HydrophobicContact CG-CD1 4.13Å; K329-L333 HydrophobicContact CG-CG 4.49Å; K329-L333 WeakPolarHBondContact O-CG 3.25Å; K329-L333 PolarHBondContact O-N 2.95Å; L333-S335 PolarHBondContact O-N 3.42Å; L333-F336 WeakPolarHBondContact O-CB 3.45Å; L333-F336 PolarHBondContact O-N 3.36Å; L333-Y337 HydrophobicContact CB-CD2 4.36Å; L333-Y337 HydrophobicContact CB-CE2 4.04Å; L333-Y337 WeakPolarHBondContact O-CD2 3.4Å; L333-Y337 PolarHBondContact O-N 2.85Å
334	Q	96.9	Very high	95.5	Very high	73 Å²	73	34.3 Å²	34.3	34%	0.341	18%	0.179	S	C	.	.	H	α-helix	trans	-65.4	-37.9	176.9	-171.2	64.3	2.8	0	0	112.5	F308 F316 S330 I331 V332 Y337 R338	F308-Q334 HydrophobicContact CE2-CG 4.41Å; F308-Q334 HydrophobicContact CZ-CB 3.97Å; F308-Q334 HydrophobicContact CZ-CG 3.62Å; F316-Q334 HydrophobicContact CE2-CB 4.23Å; F316-Q334 HydrophobicContact CE2-CG 4.03Å; F316-Q334 HydrophobicContact CZ-CB 4.02Å; F316-Q334 HydrophobicContact CZ-CG 4.33Å; S330-Q334 WeakPolarHBondContact O-CB 3.37Å; S330-Q334 PolarHBondContact O-N 2.82Å; I331-Q334 PolarHBondContact O-N 2.8Å; V332-Q334 VanDerWaalsContact C-N 3.27Å; V332-Q334 PolarHBondContact O-N 3.3Å; Q334-Y337 PolarHBondContact O-N 2.84Å; Q334-R338 WeakPolarHBondContact O-CB 3.42Å; Q334-R338 VanDerWaalsContact O-CG 3.31Å; Q334-R338 WeakPolarHBondContact O-CG 3.4Å; Q334-R338 PolarHBondContact O-N 3.35Å
335	S	96.4	Very high	96	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-44.3	173.3	-169.8	0	0	0	0	111.6	G303 A307 I331 V332 L333 Y337 R338 G339 C340	G303-S335 PolarHBondContact O-OG 3.34Å; A307-S335 WeakPolarHBondContact CB-OG 3.46Å; I331-S335 PolarHBondContact O-N 2.93Å; V332-S335 PolarHBondContact O-N 2.8Å; V332-S335 VanDerWaalsContact O-N 3.15Å; L333-S335 PolarHBondContact O-N 3.42Å; S335-Y337 PolarHBondContact O-N 3.43Å; S335-R338 WeakPolarHBondContact O-CB 3.26Å; S335-R338 PolarHBondContact O-N 2.97Å; S335-G339 PolarHBondContact O-N 2.75Å; S335-C340 WeakPolarHBondContact O-CB 3.34Å; S335-C340 PolarHBondContact O-N 3.12Å
336	F	94.6	Very high	96.1	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-58.9	-46.4	174.8	-177.5	-98.1	0	0	0	112.6	E81 F82 I98 R101 V332 L333 R338 G339 I344	E81-F336 HydrophobicContact CB-CZ 4.23Å; E81-F336 HydrophobicContact CG-CZ 4.34Å; E81-F336 WeakPolarHBondContact OE2-CZ 3.21Å; F82-F336 HydrophobicContact CZ-CD1 4.33Å; F82-F336 HydrophobicContact CZ-CE1 4.32Å; I98-F336 HydrophobicContact CD1-CB 3.88Å; I98-F336 HydrophobicContact CD1-CD2 3.86Å; I98-F336 HydrophobicContact CD1-CG 4.02Å; R101-F336 HydrophobicContact CG-CE2 3.74Å; R101-F336 HydrophobicContact CG-CZ 4.36Å; V332-F336 PolarHBondContact O-N 2.98Å; L333-F336 WeakPolarHBondContact O-CB 3.45Å; L333-F336 PolarHBondContact O-N 3.36Å; F336-R338 VanDerWaalsContact C-N 3.31Å; F336-R338 PolarHBondContact O-N 3.25Å; F336-G339 WeakPolarHBondContact O-CA 3.39Å; F336-G339 PolarHBondContact O-N 3.26Å; F336-I344 HydrophobicContact CB-CD1 3.96Å
337	Y	92.9	Very high	96.2	Very high	127 Å²	127	28.4 Å²	28.4	50%	0.498	14%	0.144	S	C	.	.	H	α-helix	trans	-68.4	-27.9	177.9	-68.1	-49.8	0	0	0	113.3	L333 Q334 S335 G339	L333-Y337 HydrophobicContact CB-CD2 4.36Å; L333-Y337 HydrophobicContact CB-CE2 4.04Å; L333-Y337 WeakPolarHBondContact O-CD2 3.4Å; L333-Y337 PolarHBondContact O-N 2.85Å; Q334-Y337 PolarHBondContact O-N 2.84Å; S335-Y337 PolarHBondContact O-N 3.43Å; Y337-G339 PolarHBondContact O-N 2.8Å
338	R	94.6	Very high	96.3	Very high	115 Å²	115	28.4 Å²	28.4	43%	0.434	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-7.7	168	-75.3	-179.9	-178.2	-160	1.3	112.8	A307 E312 Q334 S335 F336	A307-R338 HydrophobicContact CB-CB 4.35Å; A307-R338 PolarHBondContact O-NH1 2.78Å; E312-R338 IonicContact OE2-CZ 3.85Å; E312-R338 IonicContact OE2-NH1 3.76Å; E312-R338 PolarHBondContact OE2-NH1 2.85Å; E312-R338 IonicContact OE2-NH2 3.6Å; Q334-R338 WeakPolarHBondContact O-CB 3.42Å; Q334-R338 VanDerWaalsContact O-CG 3.31Å; Q334-R338 WeakPolarHBondContact O-CG 3.4Å; Q334-R338 PolarHBondContact O-N 3.35Å; S335-R338 WeakPolarHBondContact O-CB 3.26Å; S335-R338 PolarHBondContact O-N 2.97Å; F336-R338 VanDerWaalsContact C-N 3.31Å; F336-R338 PolarHBondContact O-N 3.25Å
339	G	90.6	Very high	96.3	Very high	32 Å²	32	28.4 Å²	28.4	33%	0.33	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.1	20	172	0	0	0	0	0	114.3	S335 F336 Y337	S335-G339 PolarHBondContact O-N 2.75Å; F336-G339 WeakPolarHBondContact O-CA 3.39Å; F336-G339 PolarHBondContact O-N 3.26Å; Y337-G339 PolarHBondContact O-N 2.8Å
340	C	92.9	Very high	96.3	Very high	9 Å²	9	28 Å²	28	6%	0.061	14%	0.142	C	C	.	.			trans	-51.4	125.5	174.6	-178.2	0	0	0	0	110.6	G303 S335 D342 I344	G303-C340 PolarHBondContact O-SG 2.89Å; S335-C340 WeakPolarHBondContact O-CB 3.34Å; S335-C340 PolarHBondContact O-N 3.12Å; C340-D342 VanDerWaalsContact C-N 3.29Å; C340-D342 PolarHBondContact SG-N 3.39Å; C340-D342 VanDerWaalsContact SG-N 3.43Å; C340-I344 HydrophobicContact CB-CD1 3.71Å; C340-I344 HydrophobicContact CB-CG1 4.42Å
341	P	92.3	Very high	96.1	Very high	83 Å²	83	27.7 Å²	27.7	54%	0.539	14%	0.137	S	C	.	.			trans	-85.2	-2.7	179.5	35.7	-35.7	0	0	0	113	R102	R102-P341 WeakPolarHBondContact CD-O 3.48Å
342	D	95.6	Very high	95.3	Very high	16 Å²	16	35.7 Å²	35.7	9%	0.086	17%	0.172	C	C	.	.	S	Bend	trans	-102.4	174.6	-167.5	-136.8	-31.8	0	0	0	114.5	R102 C340	R102-D342 VanDerWaalsContact CZ-CG 3.48Å; R102-D342 IonicContact CZ-OD1 3.9Å; R102-D342 IonicContact CZ-OD2 3.01Å; R102-D342 IonicContact NE-OD1 3.06Å; R102-D342 PolarHBondContact NE-OD1 3.11Å; R102-D342 VanDerWaalsContact NE-OD1 3.08Å; R102-D342 IonicContact NE-OD2 2.76Å; R102-D342 IonicContact NH1-OD1 2.67Å; R102-D342 PolarHBondContact NH1-OD1 3.05Å; R102-D342 IonicContact NH2-OD1 3.54Å; R102-D342 PolarHBondContact NH2-OD1 2.92Å; R102-D342 IonicContact NH2-OD2 3.82Å; R102-D342 PolarHBondContact NH2-OD2 2.92Å; C340-D342 VanDerWaalsContact C-N 3.29Å; C340-D342 PolarHBondContact SG-N 3.39Å; C340-D342 VanDerWaalsContact SG-N 3.43Å
343	N	97.6	Very high	93.4	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.211	C	C	.	.			trans	-60.2	148.6	154.9	-62.4	162.7	0	0	0	109.2	Q99 R102 H104 M105 E106 D107 G303	Q99-N343 PolarHBondContact O-ND2 3.49Å; R102-N343 WeakPolarHBondContact CB-ND2 3.41Å; H104-N343 PolarHBondContact O-ND2 2.85Å; H104-N343 PolarHBondContact O-OD1 3.21Å; M105-N343 WeakPolarHBondContact CA-OD1 3.21Å; M105-N343 HydrophobicContact SD-CB 3.95Å; E106-N343 PolarHBondContact N-OD1 3.33Å; D107-N343 HydrophobicContact CB-CB 4.09Å; D107-N343 PolarHBondContact N-OD1 3Å; G303-N343 WeakPolarHBondContact CA-O 3.36Å
344	I	98.3	Very high	91.1	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	113.1	-178.6	-45.6	178.8	0	0	0	108.2	S97 I98 V332 F336 C340 V346	S97-I344 CarbonylContact C-O 3.39Å; S97-I344 VanDerWaalsContact CA-O 3.23Å; S97-I344 WeakPolarHBondContact CA-O 3.25Å; I98-I344 HydrophobicContact CD1-CD1 4.19Å; I98-I344 HydrophobicContact CG1-CB 4.03Å; I98-I344 HydrophobicContact CG1-CD1 4.47Å; I98-I344 HydrophobicContact CG1-CG1 4.35Å; I98-I344 PolarHBondContact N-O 3.5Å; I98-I344 PolarHBondContact O-N 3.49Å; V332-I344 HydrophobicContact CB-CG2 4.31Å; V332-I344 HydrophobicContact CG1-CB 4.09Å; V332-I344 HydrophobicContact CG1-CG2 3.97Å; V332-I344 HydrophobicContact CG2-CG2 4.09Å; F336-I344 HydrophobicContact CB-CD1 3.96Å; C340-I344 HydrophobicContact CB-CD1 3.71Å; C340-I344 HydrophobicContact CB-CG1 4.42Å; I344-V346 HydrophobicContact CG2-CG2 4.39Å
345	T	98.7	Very high	88.1	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.5	175.7	-60.8	0	0	0	0	109.8	V95 S97 D107 F109 I126 A300 S301	V95-T345 HydrophobicContact CG1-CG2 4.01Å; S97-T345 WeakPolarHBondContact CB-OG1 3.36Å; S97-T345 WeakPolarHBondContact OG-CG2 3.39Å; D107-T345 VanDerWaalsContact CB-OG1 3.25Å; D107-T345 WeakPolarHBondContact CB-OG1 3.28Å; D107-T345 VanDerWaalsContact CG-OG1 3.26Å; D107-T345 WeakPolarHBondContact OD2-CB 3.4Å; D107-T345 PolarHBondContact OD2-N 2.95Å; D107-T345 PolarHBondContact OD2-OG1 3Å; F109-T345 HydrophobicContact CB-CG2 4.26Å; F109-T345 HydrophobicContact CD1-CG2 4.15Å; I126-T345 HydrophobicContact CD1-CG2 3.66Å; A300-T345 WeakPolarHBondContact CA-O 3.23Å; A300-T345 WeakPolarHBondContact CB-O 3.18Å; S301-T345 PolarHBondContact N-O 3.47Å; S301-T345 VanDerWaalsContact N-O 3.17Å; S301-T345 PolarHBondContact OG-N 3.5Å
346	V	98.9	Very high	85.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.8	177.4	-177.9	0	0	0	0	110.1	V95 Y96 I298 A300 L304 A328 I331 V332 I344 V348	V95-V346 WeakPolarHBondContact CA-O 3.37Å; Y96-V346 PolarHBondContact N-O 3.01Å; Y96-V346 PolarHBondContact O-N 2.82Å; I298-V346 HydrophobicContact CG2-CG1 3.79Å; A300-V346 HydrophobicContact CB-CB 4.31Å; A300-V346 HydrophobicContact CB-CG1 4.38Å; A300-V346 HydrophobicContact CB-CG2 3.85Å; L304-V346 HydrophobicContact CB-CG2 3.97Å; L304-V346 HydrophobicContact CD1-CG2 4.27Å; L304-V346 HydrophobicContact CD2-CG1 4.3Å; L304-V346 HydrophobicContact CD2-CG2 3.82Å; L304-V346 HydrophobicContact CG-CG2 4.22Å; A328-V346 HydrophobicContact CB-CG1 4.44Å; I331-V346 HydrophobicContact CG2-CB 4.34Å; I331-V346 HydrophobicContact CG2-CG1 3.85Å; I331-V346 HydrophobicContact CG2-CG2 4.26Å; V332-V346 HydrophobicContact CG2-CB 3.63Å; V332-V346 HydrophobicContact CG2-CG2 3.44Å; V332-V346 VanDerWaalsContact CG2-CG2 3.44Å; I344-V346 HydrophobicContact CG2-CG2 4.39Å; V346-V348 HydrophobicContact CG1-CG2 4.36Å
347	M	98.9	Very high	82.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.5	170.6	177.6	-178.6	-46.3	0	0	110	V93 A94 V95 F109 V111 F124 I126 I298 L299 V349	V93-M347 HydrophobicContact CG1-CG 4.07Å; V93-M347 HydrophobicContact CG1-SD 4.22Å; A94-M347 CarbonylContact O-C 3.57Å; A94-M347 VanDerWaalsContact O-CA 3.31Å; A94-M347 WeakPolarHBondContact O-CA 3.33Å; V95-M347 HydrophobicContact CG1-CB 4.27Å; V95-M347 HydrophobicContact CG2-CB 3.95Å; V95-M347 HydrophobicContact CG2-CE 3.79Å; V95-M347 HydrophobicContact CG2-CG 3.81Å; V95-M347 HydrophobicContact CG2-SD 4.39Å; F109-M347 HydrophobicContact CB-CE 4.39Å; V111-M347 HydrophobicContact CG2-CE 3.57Å; V111-M347 HydrophobicContact CG2-SD 4.08Å; F124-M347 HydrophobicContact CB-CE 4.3Å; F124-M347 HydrophobicContact CB-SD 3.68Å; F124-M347 HydrophobicContact CD1-SD 3.65Å; F124-M347 HydrophobicContact CG-SD 3.95Å; I126-M347 HydrophobicContact CD1-CB 4.21Å; I126-M347 HydrophobicContact CD1-CE 4.13Å; I298-M347 CarbonylContact C-O 3.42Å; I298-M347 VanDerWaalsContact CA-O 3.3Å; I298-M347 WeakPolarHBondContact CA-O 3.37Å; L299-M347 HydrophobicContact CB-CB 4.31Å; L299-M347 HydrophobicContact CD1-SD 4.12Å; L299-M347 PolarHBondContact N-O 3.15Å; L299-M347 PolarHBondContact O-N 3.24Å; M347-V349 HydrophobicContact CG-CG2 3.96Å; M347-V349 HydrophobicContact SD-CG2 3.95Å
348	V	98.8	Very high	79.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.6	170.5	177.6	0	0	0	0	109.1	V93 A94 F296 M297 I298 V317 L321 F326 A328 V346	V93-V348 CarbonylContact C-O 3.53Å; V93-V348 WeakPolarHBondContact CA-O 3.36Å; A94-V348 PolarHBondContact N-O 3.46Å; A94-V348 PolarHBondContact O-N 3.16Å; F296-V348 HydrophobicContact CB-CG1 4.36Å; F296-V348 HydrophobicContact CD2-CG1 4.33Å; M297-V348 WeakPolarHBondContact O-CA 3.28Å; I298-V348 HydrophobicContact CG1-CG2 4.47Å; V317-V348 HydrophobicContact CG1-CG1 4.02Å; V317-V348 HydrophobicContact CG1-CG2 4.05Å; V317-V348 HydrophobicContact CG2-CG2 4.44Å; L321-V348 HydrophobicContact CD2-CG1 4.5Å; F326-V348 HydrophobicContact CB-CB 4.32Å; F326-V348 HydrophobicContact CB-CG1 3.86Å; A328-V348 HydrophobicContact CB-CB 4.27Å; A328-V348 HydrophobicContact CB-CG2 3.76Å; V346-V348 HydrophobicContact CG1-CG2 4.36Å
349	V	98.1	Very high	76.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	115	176.1	-178.3	0	0	0	0	109.2	N92 V93 F124 L200 F296 M297 M347	N92-V349 CarbonylContact O-C 3.43Å; N92-V349 WeakPolarHBondContact O-CA 3.4Å; V93-V349 HydrophobicContact CG1-CG2 3.97Å; V93-V349 HydrophobicContact CG2-CB 4.47Å; V93-V349 HydrophobicContact CG2-CG1 4.03Å; V93-V349 HydrophobicContact CG2-CG2 4.1Å; F124-V349 HydrophobicContact CD1-CG2 4.04Å; F124-V349 HydrophobicContact CD2-CG2 4.49Å; F124-V349 HydrophobicContact CE1-CG1 4.49Å; F124-V349 HydrophobicContact CE1-CG2 3.97Å; F124-V349 HydrophobicContact CE2-CG1 4.27Å; F124-V349 HydrophobicContact CE2-CG2 4.38Å; F124-V349 HydrophobicContact CG-CG2 4.31Å; F124-V349 HydrophobicContact CZ-CG1 3.95Å; F124-V349 HydrophobicContact CZ-CG2 4.13Å; L200-V349 HydrophobicContact CD2-CG1 4.36Å; F296-V349 CarbonylContact C-O 3.49Å; F296-V349 WeakPolarHBondContact CA-O 3.09Å; F296-V349 WeakPolarHBondContact CB-O 3.32Å; M297-V349 HydrophobicContact CE-CB 3.69Å; M297-V349 HydrophobicContact CE-CG1 3.97Å; M297-V349 HydrophobicContact CE-CG2 3.61Å; M297-V349 HydrophobicContact CG-CB 3.81Å; M297-V349 HydrophobicContact CG-CG2 4.37Å; M297-V349 PolarHBondContact N-O 3.44Å; M297-V349 PolarHBondContact O-N 2.88Å; M347-V349 HydrophobicContact CG-CG2 3.96Å; M347-V349 HydrophobicContact SD-CG2 3.95Å
350	K	96.4	Very high	74.2	Confident	57 Å²	57	58.3 Å²	58.3	25%	0.248	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.9	172.2	-59.4	-164.8	-60.5	-176.1	0	110.4	N92 L321 F326	N92-K350 HydrophobicContact CB-CB 4.31Å; N92-K350 PolarHBondContact ND2-O 2.91Å; N92-K350 VanDerWaalsContact ND2-O 3.15Å; N92-K350 PolarHBondContact O-N 3.3Å; L321-K350 HydrophobicContact CD2-CD 4.3Å; L321-K350 HydrophobicContact CD2-CG 4.37Å; F326-K350 HydrophobicContact CB-CD 4.31Å; F326-K350 HydrophobicContact CB-CG 4.39Å; F326-K350 HydrophobicContact CD1-CD 3.77Å; F326-K350 VanDerWaalsContact CD1-CE 3.48Å; F326-K350 HydrophobicContact CD1-CG 4.48Å; F326-K350 HydrophobicContact CD2-CD 4.29Å; F326-K350 HydrophobicContact CD2-CG 4.14Å; F326-K350 HydrophobicContact CE1-CD 4.14Å; F326-K350 HydrophobicContact CG-CD 3.85Å; F326-K350 HydrophobicContact CG-CG 4.07Å
351	F	93.5	Very high	71.7	Confident	28 Å²	28	62.5 Å²	62.5	12%	0.123	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-83.1	151.9	168.7	-66.3	-97.3	0	0	0	109.2	L200 L205 L217 L289 P294 E295 M297 S353	L200-F351 HydrophobicContact CD1-CD1 4.21Å; L200-F351 HydrophobicContact CD1-CE1 3.54Å; L200-F351 HydrophobicContact CD1-CZ 4.43Å; L200-F351 HydrophobicContact CD2-CE1 4.19Å; L205-F351 HydrophobicContact CD2-CZ 4.33Å; L217-F351 HydrophobicContact CD1-CE2 4.24Å; L217-F351 HydrophobicContact CD1-CZ 4.08Å; L289-F351 HydrophobicContact CD1-CD1 4.5Å; L289-F351 HydrophobicContact CD1-CE1 4.12Å; L289-F351 HydrophobicContact CD2-CD1 4.43Å; L289-F351 HydrophobicContact CD2-CE1 3.74Å; L289-F351 HydrophobicContact CD2-CZ 4.36Å; P294-F351 HydrophobicContact CB-CD2 3.7Å; P294-F351 HydrophobicContact CB-CE2 3.81Å; P294-F351 HydrophobicContact CB-CG 4.11Å; P294-F351 HydrophobicContact CB-CZ 4.29Å; P294-F351 HydrophobicContact CG-CB 4.27Å; P294-F351 HydrophobicContact CG-CD1 3.6Å; P294-F351 HydrophobicContact CG-CD2 3.63Å; P294-F351 HydrophobicContact CG-CE1 3.71Å; P294-F351 HydrophobicContact CG-CE2 3.79Å; P294-F351 HydrophobicContact CG-CG 3.57Å; P294-F351 HydrophobicContact CG-CZ 3.83Å; P294-F351 VanDerWaalsContact O-CB 3.31Å; P294-F351 WeakPolarHBondContact O-CB 3.46Å; E295-F351 PolarHBondContact O-N 3.06Å; M297-F351 HydrophobicContact CB-CE2 3.96Å; M297-F351 HydrophobicContact CB-CZ 4.38Å; M297-F351 HydrophobicContact CG-CE2 3.92Å; M297-F351 HydrophobicContact CG-CZ 4.12Å; M297-F351 HydrophobicContact SD-CE2 4.46Å; M297-F351 HydrophobicContact SD-CZ 4.06Å; F351-S353 PolarHBondContact O-N 2.96Å
352	K	80.7	Confident	69.2	Low	167 Å²	167	62.2 Å²	62.2	73%	0.726	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-70	122.5	173.7	-68.6	-177.6	179.4	178.9	0	107.7	G354	K352-G354 PolarHBondContact O-N 3.18Å; K352-G354 VanDerWaalsContact O-N 3.08Å
353	S	59.8	Low	66.5	Low	118 Å²	118	71.7 Å²	71.7	83%	0.825	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-55.6	119.1	165.1	-51.6	0	0	0	0	107.3	F351 A355	F351-S353 PolarHBondContact O-N 2.96Å; S353-A355 PolarHBondContact O-N 3.37Å
354	G	47.2	Very low	64.9	Low	72 Å²	72	75.3 Å²	75.3	74%	0.742	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-51.6	120	175	0	0	0	0	0	108.2	K352 G356	K352-G354 PolarHBondContact O-N 3.18Å; K352-G354 VanDerWaalsContact O-N 3.08Å; G354-G356 VanDerWaalsContact C-N 3.29Å; G354-G356 PolarHBondContact O-N 3.05Å
355	A	34.3	Very low	63.2	Low	103 Å²	103	79.2 Å²	79.2	85%	0.851	55%	0.545	S	S	*	.			trans	-59.5	101.2	169.8	0	0	0	0	0	106.5	S353 G357	S353-A355 PolarHBondContact O-N 3.37Å; A355-G357 PolarHBondContact O-N 3.02Å; A355-G357 VanDerWaalsContact O-N 3.15Å
356	G	34.2	Very low	61.2	Low	63 Å²	63	83.6 Å²	83.6	65%	0.649	58%	0.576	S	S	*	*			trans	-51	123.4	170.2	0	0	0	0	0	107.9	G354 S358	G354-G356 VanDerWaalsContact C-N 3.29Å; G354-G356 PolarHBondContact O-N 3.05Å; G356-S358 PolarHBondContact O-N 2.93Å
357	G	37.8	Very low	59	Low	83 Å²	83	88.5 Å²	88.5	86%	0.856	61%	0.61	S	S	*	*			trans	-50.2	112.1	179.6	0	0	0	0	0	110.8	A355	A355-G357 PolarHBondContact O-N 3.02Å; A355-G357 VanDerWaalsContact O-N 3.15Å
358	S	33.1	Very low	56.5	Low	106 Å²	106	94.1 Å²	94.1	74%	0.741	65%	0.648	S	S	*	*			trans	-138.2	64	158.6	57.7	0	0	0	0	109	G356 K360	G356-S358 PolarHBondContact O-N 2.93Å; S358-K360 PolarHBondContact O-N 2.89Å
359	S	35.9	Very low	53.7	Low	120 Å²	120	100.3 Å²	100.3	84%	0.839	69%	0.691	S	S	*	*			trans	-66.7	81.8	148.1	57.2	0	0	0	0	107.7	A361	S359-A361 VanDerWaalsContact C-N 3.3Å; S359-A361 PolarHBondContact O-N 3.2Å
360	K	35.5	Very low	50.5	Low	198 Å²	198	107.5 Å²	107.5	86%	0.861	74%	0.74	S	S	*	*			trans	-77.9	96.2	151.6	-82.6	-168.6	176.8	-178.1	0	106.2	S358 G362	S358-K360 PolarHBondContact O-N 2.89Å; K360-G362 PolarHBondContact O-N 2.99Å; K360-G362 VanDerWaalsContact O-N 3.15Å
361	A	40.9	Very low	47	Very low	98 Å²	98	111.4 Å²	111.4	81%	0.81	78%	0.778	S	S	*	*			trans	-53.9	113	154.4	0	0	0	0	0	107.5	S359	S359-A361 VanDerWaalsContact C-N 3.3Å; S359-A361 PolarHBondContact O-N 3.2Å
362	G	39.1	Very low	43.1	Very low	76 Å²	76	118.3 Å²	118.3	78%	0.784	83%	0.833	S	S	*	*			trans	-94.4	114	162.4	0	0	0	0	0	107.3	K360	K360-G362 PolarHBondContact O-N 2.99Å; K360-G362 VanDerWaalsContact O-N 3.15Å
363	V	38.4	Very low	39.7	Very low	216 Å²	216	113.9 Å²	113.9	100%	1.309	84%	0.843	S	S	*	*			trans	-60.1	0	164.7	173.6	0	0	0	0	110

Retrieved 363 of 363 residues in 596.7 ms (Link to these results)

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