A0A096NH05_PAPAN Loading...

Canopy FGF signaling regulator 2

AlphaFold DB (A0A2K5NQ80), UniProt , Accession A0A096NH05, Species PAPAN (Papio anubis, Olive baboon), Gene CNPY2, Length 182 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.2	Low	63.1	Low	238 Å²	238	130 Å²	130	100%	1.172	66%	0.662	S	S	*	*				0	-4.6	0	-66.3	166.7	70.6	0	0	115
2	K	54.1	Low	63.3	Low	191 Å²	191	123 Å²	123	83%	0.83	65%	0.646	S	S	*	*			trans	-83.6	-20	178.5	-79.5	178	168.2	179.2	0	115.6
3	G	55.9	Low	63.6	Low	46 Å²	46	118.1 Å²	118.1	47%	0.474	63%	0.634	S	S	.	*	H	α-helix	trans	-75.8	-24.9	-175.8	0	0	0	0	0	115.3	W6 L7	G3-W6 PolarHBondContact O-N 3.13Å; G3-L7 PolarHBondContact O-N 2.89Å; G3-L7 VanDerWaalsContact O-N 3.12Å
4	W	58	Low	63.8	Low	222 Å²	222	117.7 Å²	117.7	84%	0.841	63%	0.631	S	S	*	*	H	α-helix	trans	-74	-32	-176.8	-116.7	3.1	0	0	0	113.5	L7 A8	W4-L7 PolarHBondContact O-N 2.74Å; W4-A8 WeakPolarHBondContact O-CB 3.36Å; W4-A8 PolarHBondContact O-N 2.94Å
5	G	62.7	Low	63.7	Low	42 Å²	42	117.8 Å²	117.8	43%	0.433	63%	0.631	S	S	.	*	H	α-helix	trans	-65.8	-37.8	174.7	0	0	0	0	0	112.7	L9	G5-L9 WeakPolarHBondContact O-CB 3.17Å; G5-L9 PolarHBondContact O-N 3.04Å
6	W	66.6	Low	63.4	Low	194 Å²	194	113 Å²	113	74%	0.735	62%	0.618	S	S	*	*	H	α-helix	trans	-72.5	-39.6	176.9	-74.2	70.3	0	0	0	112	G3 L9 L10	G3-W6 PolarHBondContact O-N 3.13Å; W6-L9 PolarHBondContact O-N 2.81Å; W6-L10 WeakPolarHBondContact O-CB 3.25Å; W6-L10 VanDerWaalsContact O-CG 3.23Å; W6-L10 WeakPolarHBondContact O-CG 3.13Å; W6-L10 PolarHBondContact O-N 3.24Å
7	L	68.4	Low	63.6	Low	98 Å²	98	111.6 Å²	111.6	51%	0.513	61%	0.614	S	S	.	*	H	α-helix	trans	-62.4	-42.9	172.6	-101.5	138.6	0	0	0	112	G3 W4 L10 L11	G3-L7 PolarHBondContact O-N 2.89Å; G3-L7 VanDerWaalsContact O-N 3.12Å; W4-L7 PolarHBondContact O-N 2.74Å; L7-L10 PolarHBondContact O-N 2.92Å; L7-L11 HydrophobicContact CD2-CD1 4.34Å; L7-L11 VanDerWaalsContact O-CB 3.28Å; L7-L11 WeakPolarHBondContact O-CB 3.32Å; L7-L11 WeakPolarHBondContact O-CD1 3.09Å; L7-L11 WeakPolarHBondContact O-CG 3.31Å; L7-L11 PolarHBondContact O-N 2.76Å
8	A	71.3	Confident	63.3	Low	64 Å²	64	108.9 Å²	108.9	53%	0.529	61%	0.608	S	S	.	*	H	α-helix	trans	-65.8	-40	177	0	0	0	0	0	112.5	W4 G12	W4-A8 WeakPolarHBondContact O-CB 3.36Å; W4-A8 PolarHBondContact O-N 2.94Å; A8-G12 PolarHBondContact O-N 2.93Å
9	L	68.8	Low	62.8	Low	137 Å²	137	113.9 Å²	113.9	72%	0.717	62%	0.617	S	S	*	*	H	α-helix	trans	-64.8	-43.6	173.8	-97.3	150.1	0	0	0	112.4	G5 W6 G12 A13	G5-L9 WeakPolarHBondContact O-CB 3.17Å; G5-L9 PolarHBondContact O-N 3.04Å; W6-L9 PolarHBondContact O-N 2.81Å; L9-G12 PolarHBondContact O-N 2.76Å; L9-A13 WeakPolarHBondContact O-CB 3.34Å; L9-A13 PolarHBondContact O-N 3.16Å
10	L	68.4	Low	62.9	Low	105 Å²	105	111.4 Å²	111.4	55%	0.55	61%	0.612	S	S	.	*	H	α-helix	trans	-66.3	-42.4	177	-73.3	167.9	0	0	0	111.8	W6 L7 A13 L14	W6-L10 WeakPolarHBondContact O-CB 3.25Å; W6-L10 VanDerWaalsContact O-CG 3.23Å; W6-L10 WeakPolarHBondContact O-CG 3.13Å; W6-L10 PolarHBondContact O-N 3.24Å; L7-L10 PolarHBondContact O-N 2.92Å; L10-A13 PolarHBondContact O-N 2.62Å; L10-L14 WeakPolarHBondContact O-CB 3.27Å; L10-L14 VanDerWaalsContact O-CG 3.26Å; L10-L14 WeakPolarHBondContact O-CG 3.45Å; L10-L14 PolarHBondContact O-N 3.28Å
11	L	67.4	Low	63.1	Low	93 Å²	93	112.8 Å²	112.8	49%	0.487	61%	0.608	S	S	.	*	H	α-helix	trans	-62.5	-44	173.6	-85.5	152.6	0	0	0	111.4	L7 A13 L14 L15	L7-L11 HydrophobicContact CD2-CD1 4.34Å; L7-L11 VanDerWaalsContact O-CB 3.28Å; L7-L11 WeakPolarHBondContact O-CB 3.32Å; L7-L11 WeakPolarHBondContact O-CD1 3.09Å; L7-L11 WeakPolarHBondContact O-CG 3.31Å; L7-L11 PolarHBondContact O-N 2.76Å; L11-A13 PolarHBondContact O-N 2.73Å; L11-L14 PolarHBondContact O-N 2.86Å; L11-L15 HydrophobicContact CD2-CD1 4.4Å; L11-L15 WeakPolarHBondContact O-CD1 3.3Å; L11-L15 PolarHBondContact O-N 3.36Å
12	G	66.1	Low	63.9	Low	46 Å²	46	109.1 Å²	109.1	47%	0.474	58%	0.581	S	S	.	*	H	α-helix	trans	-60.1	-43.9	175.7	0	0	0	0	0	112.8	A8 L9 G16	A8-G12 PolarHBondContact O-N 2.93Å; L9-G12 PolarHBondContact O-N 2.76Å; G12-G16 PolarHBondContact O-N 3.06Å
13	A	67.6	Low	65.2	Low	59 Å²	59	102.4 Å²	102.4	49%	0.488	56%	0.558	S	S	.	*	H	α-helix	trans	-63.6	-45.8	176	0	0	0	0	0	112.1	L9 L10 L11 G16 T17	L9-A13 WeakPolarHBondContact O-CB 3.34Å; L9-A13 PolarHBondContact O-N 3.16Å; L10-A13 PolarHBondContact O-N 2.62Å; L11-A13 PolarHBondContact O-N 2.73Å; A13-G16 PolarHBondContact O-N 2.85Å; A13-T17 WeakPolarHBondContact O-CG2 3.5Å; A13-T17 PolarHBondContact O-N 3.29Å
14	L	66.2	Low	66.7	Low	113 Å²	113	102.9 Å²	102.9	59%	0.592	55%	0.548	S	S	*	.	H	α-helix	trans	-62.4	-44.9	178.7	-72.8	167.3	0	0	0	112.1	L10 L11 G16 T17 A18	L10-L14 WeakPolarHBondContact O-CB 3.27Å; L10-L14 VanDerWaalsContact O-CG 3.26Å; L10-L14 WeakPolarHBondContact O-CG 3.45Å; L10-L14 PolarHBondContact O-N 3.28Å; L11-L14 PolarHBondContact O-N 2.86Å; L14-G16 VanDerWaalsContact C-N 3.33Å; L14-G16 PolarHBondContact O-N 2.77Å; L14-T17 PolarHBondContact O-N 2.81Å; L14-T17 PolarHBondContact O-OG1 3.32Å; L14-A18 PolarHBondContact O-N 3.07Å; L14-A18 VanDerWaalsContact O-N 3.13Å
15	L	61.9	Low	68.3	Low	119 Å²	119	93.1 Å²	93.1	62%	0.623	51%	0.513	S	S	*	.	H	α-helix	trans	-62.8	-39.7	176.4	-92	75.5	0	0	0	111.9	L11 A18 W19	L11-L15 HydrophobicContact CD2-CD1 4.4Å; L11-L15 WeakPolarHBondContact O-CD1 3.3Å; L11-L15 PolarHBondContact O-N 3.36Å; L15-A18 PolarHBondContact O-N 3.34Å; L15-W19 PolarHBondContact O-N 3.05Å; L15-W19 VanDerWaalsContact O-N 3.08Å
16	G	59.7	Low	69.7	Low	41 Å²	41	92.2 Å²	92.2	42%	0.423	50%	0.498	S	S	.	.	H	α-helix	trans	-61.1	-45.8	175.9	0	0	0	0	0	112.6	G12 A13 L14 A18 W19 A20	G12-G16 PolarHBondContact O-N 3.06Å; A13-G16 PolarHBondContact O-N 2.85Å; L14-G16 VanDerWaalsContact C-N 3.33Å; L14-G16 PolarHBondContact O-N 2.77Å; G16-A18 PolarHBondContact O-N 3.5Å; G16-W19 PolarHBondContact O-N 3.11Å; G16-A20 WeakPolarHBondContact O-CB 3.43Å; G16-A20 PolarHBondContact O-N 3.13Å
17	T	65.7	Low	71	Confident	90 Å²	90	85.3 Å²	85.3	55%	0.552	47%	0.473	S	S	*	.	H	α-helix	trans	-64.6	-37.5	178.3	61.2	0	0	0	0	113.1	A13 L14 R21	A13-T17 WeakPolarHBondContact O-CG2 3.5Å; A13-T17 PolarHBondContact O-N 3.29Å; L14-T17 PolarHBondContact O-N 2.81Å; L14-T17 PolarHBondContact O-OG1 3.32Å; T17-R21 WeakPolarHBondContact O-CB 3.2Å; T17-R21 PolarHBondContact O-N 3.31Å
18	A	58.5	Low	72.2	Confident	62 Å²	62	80.9 Å²	80.9	51%	0.512	45%	0.451	S	S	.	.	H	α-helix	trans	-67.7	-40.1	177.6	0	0	0	0	0	112.1	L14 L15 G16 R22	L14-A18 PolarHBondContact O-N 3.07Å; L14-A18 VanDerWaalsContact O-N 3.13Å; L15-A18 PolarHBondContact O-N 3.34Å; G16-A18 PolarHBondContact O-N 3.5Å; A18-R22 WeakPolarHBondContact O-CB 3.14Å; A18-R22 PolarHBondContact O-N 2.96Å
19	W	54.2	Low	73.3	Confident	205 Å²	205	78 Å²	78	78%	0.777	43%	0.428	S	S	*	.	H	α-helix	trans	-66.8	-48.5	176	-162.9	-41.1	0	0	0	111.2	L15 G16 R21 R22 S23	L15-W19 PolarHBondContact O-N 3.05Å; L15-W19 VanDerWaalsContact O-N 3.08Å; G16-W19 PolarHBondContact O-N 3.11Å; W19-R21 PolarHBondContact O-N 3.28Å; W19-R22 PolarHBondContact O-N 3.03Å; W19-R22 VanDerWaalsContact O-N 3.14Å; W19-S23 PolarHBondContact O-N 3.19Å
20	A	64.3	Low	74.6	Confident	63 Å²	63	71.5 Å²	71.5	52%	0.521	39%	0.394	S	S	.	.	H	α-helix	trans	-54.7	-43.8	177.6	0	0	0	0	0	111.3	G16 S23 Q24	G16-A20 WeakPolarHBondContact O-CB 3.43Å; G16-A20 PolarHBondContact O-N 3.13Å; A20-S23 WeakPolarHBondContact O-CB 3.39Å; A20-S23 PolarHBondContact O-N 2.77Å; A20-Q24 PolarHBondContact O-N 2.98Å
21	R	68.2	Low	76	Confident	141 Å²	141	66.6 Å²	66.6	53%	0.532	37%	0.368	S	S	.	.	H	α-helix	trans	-67.3	-40.2	178	-162.6	170.7	-167.8	168.2	2.7	113.4	T17 W19 S23 Q24 D25	T17-R21 WeakPolarHBondContact O-CB 3.2Å; T17-R21 PolarHBondContact O-N 3.31Å; W19-R21 PolarHBondContact O-N 3.28Å; R21-S23 VanDerWaalsContact C-N 3.3Å; R21-S23 PolarHBondContact O-N 3.11Å; R21-Q24 WeakPolarHBondContact O-CB 3.48Å; R21-Q24 PolarHBondContact O-N 2.88Å; R21-D25 PolarHBondContact O-N 3.44Å
22	R	68.1	Low	77.3	Confident	160 Å²	160	63.3 Å²	63.3	60%	0.604	35%	0.349	S	S	*	.	H	α-helix	trans	-63.7	-37	174.4	-177.8	177	175.2	168.4	-1.4	111.9	A18 W19 L26	A18-R22 WeakPolarHBondContact O-CB 3.14Å; A18-R22 PolarHBondContact O-N 2.96Å; W19-R22 PolarHBondContact O-N 3.03Å; W19-R22 VanDerWaalsContact O-N 3.14Å; R22-L26 PolarHBondContact O-N 3.31Å
23	S	81.4	Confident	78.7	Confident	50 Å²	50	61.2 Å²	61.2	35%	0.35	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-44.2	173.6	-168.2	0	0	0	0	110.6	W19 A20 R21 L26 H27	W19-S23 PolarHBondContact O-N 3.19Å; A20-S23 WeakPolarHBondContact O-CB 3.39Å; A20-S23 PolarHBondContact O-N 2.77Å; R21-S23 VanDerWaalsContact C-N 3.3Å; R21-S23 PolarHBondContact O-N 3.11Å; S23-L26 WeakPolarHBondContact O-CB 3.5Å; S23-L26 PolarHBondContact O-N 3.04Å; S23-H27 PolarHBondContact O-N 3.23Å; S23-H27 VanDerWaalsContact O-N 3.11Å; S23-H27 PolarHBondContact O-ND1 2.97Å; S23-H27 PolarHBondContact OG-CE1 3.38Å
24	Q	88.2	Confident	80.1	Confident	56 Å²	56	58.4 Å²	58.4	26%	0.262	30%	0.304	S	S	.	.	H	α-helix	trans	-63.7	-42.8	179.8	-165.2	-176.7	9.1	0	0	112.8	A20 R21 L26 H27 C28 L170 D172	A20-Q24 PolarHBondContact O-N 2.98Å; R21-Q24 WeakPolarHBondContact O-CB 3.48Å; R21-Q24 PolarHBondContact O-N 2.88Å; Q24-L26 VanDerWaalsContact C-N 3.27Å; Q24-L26 PolarHBondContact O-N 2.92Å; Q24-H27 PolarHBondContact O-N 2.66Å; Q24-C28 VanDerWaalsContact O-CB 3.31Å; Q24-C28 WeakPolarHBondContact O-CB 3.18Å; Q24-C28 PolarHBondContact O-N 3.1Å; Q24-L170 VanDerWaalsContact CG-O 3.3Å; Q24-L170 WeakPolarHBondContact CG-O 3.37Å; Q24-D172 PolarHBondContact NE2-OD1 3.4Å
25	D	90.4	Very high	81.5	Confident	17 Å²	17	53 Å²	53	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-56.9	-42.4	176.3	-72.2	-9.3	0	0	0	112.1	R21 G29 R102 K103	R21-D25 PolarHBondContact O-N 3.44Å; D25-G29 PolarHBondContact O-N 2.9Å; D25-R102 IonicContact OD1-CZ 3.8Å; D25-R102 IonicContact OD1-NE 2.99Å; D25-R102 PolarHBondContact OD1-NE 3.24Å; D25-R102 IonicContact OD1-NH2 3.02Å; D25-R102 PolarHBondContact OD1-NH2 3.04Å; D25-R102 IonicContact OD2-NE 2.71Å; D25-K103 HydrophobicContact CB-CB 4.39Å
26	L	92.9	Very high	83	Confident	23 Å²	23	49.3 Å²	49.3	12%	0.12	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-49.2	177.4	174	69.6	0	0	0	111.8	R22 S23 Q24 G29 A30 Y105 T132 L133 A136	R22-L26 PolarHBondContact O-N 3.31Å; S23-L26 WeakPolarHBondContact O-CB 3.5Å; S23-L26 PolarHBondContact O-N 3.04Å; Q24-L26 VanDerWaalsContact C-N 3.27Å; Q24-L26 PolarHBondContact O-N 2.92Å; L26-G29 PolarHBondContact O-N 3.48Å; L26-A30 WeakPolarHBondContact O-CB 3.41Å; L26-A30 PolarHBondContact O-N 2.87Å; L26-Y105 HydrophobicContact CD1-CE1 4.15Å; L26-Y105 HydrophobicContact CD1-CE2 4.25Å; L26-Y105 WeakPolarHBondContact CD1-OH 3.22Å; L26-T132 HydrophobicContact CD1-CG2 3.88Å; L26-T132 HydrophobicContact CD2-CG2 3.37Å; L26-T132 HydrophobicContact CG-CG2 4.27Å; L26-L133 HydrophobicContact CD1-CD1 4.03Å; L26-A136 HydrophobicContact CD1-CB 4.34Å; L26-A136 HydrophobicContact CD2-CB 4.07Å; L26-A136 HydrophobicContact CG-CB 3.87Å
27	H	94.3	Very high	84.8	Confident	49 Å²	49	47.3 Å²	47.3	23%	0.227	24%	0.236	C	C	.	.	H	α-helix	trans	-68.6	-37	-178.4	-68.9	73	0	0	0	111.5	S23 Q24 A30 C31 I140 L170	S23-H27 PolarHBondContact O-N 3.23Å; S23-H27 VanDerWaalsContact O-N 3.11Å; S23-H27 PolarHBondContact O-ND1 2.97Å; S23-H27 PolarHBondContact OG-CE1 3.38Å; Q24-H27 PolarHBondContact O-N 2.66Å; H27-A30 PolarHBondContact O-N 2.94Å; H27-C31 WeakPolarHBondContact O-CB 3.29Å; H27-C31 PolarHBondContact O-N 3.42Å; H27-I140 HydrophobicContact CB-CD1 4.46Å; H27-I140 WeakPolarHBondContact O-CD1 3.45Å; H27-L170 HydrophobicContact CB-CD2 4.11Å
28	C	93.6	Very high	86.2	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.034	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-45.9	172.3	179.4	0	0	0	0	111.4	Q24 C31 R32 L170 C171 L175	Q24-C28 VanDerWaalsContact O-CB 3.31Å; Q24-C28 WeakPolarHBondContact O-CB 3.18Å; Q24-C28 PolarHBondContact O-N 3.1Å; C28-C31 PolarHBondContact O-N 3.26Å; C28-R32 WeakPolarHBondContact O-CB 3.48Å; C28-R32 VanDerWaalsContact O-CG 3.28Å; C28-R32 WeakPolarHBondContact O-CG 3.27Å; C28-R32 PolarHBondContact O-N 3.43Å; C28-L170 WeakPolarHBondContact CB-O 3.48Å; C28-C171 WeakPolarHBondContact CA-SG 3.49Å; C28-C171 HydrophobicContact CB-CB 3.99Å; C28-C171 WeakPolarHBondContact CB-SG 3.22Å; C28-C171 VanDerWaalsContact SG-CA 3.58Å; C28-C171 WeakPolarHBondContact SG-CB 3.19Å; C28-C171 CovalentContact SG-SG 2.04Å; C28-C171 PolarHBondContact SG-SG 3.11Å; C28-L175 VanDerWaalsContact SG-CD1 3.57Å
29	G	93.5	Very high	87.9	Confident	5 Å²	5	43.8 Å²	43.8	5%	0.052	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-46.8	174.9	0	0	0	0	0	112.9	D25 L26 R32 A33	D25-G29 PolarHBondContact O-N 2.9Å; L26-G29 PolarHBondContact O-N 3.48Å; G29-R32 PolarHBondContact O-N 3.45Å; G29-A33 WeakPolarHBondContact O-CB 3.42Å; G29-A33 PolarHBondContact O-N 3.05Å
30	A	96.3	Very high	89.8	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.2	-46.5	177.4	0	0	0	0	0	112	L26 H27 R32 A33 L34 L133 A136 I140	L26-A30 WeakPolarHBondContact O-CB 3.41Å; L26-A30 PolarHBondContact O-N 2.87Å; H27-A30 PolarHBondContact O-N 2.94Å; A30-R32 PolarHBondContact O-N 3.38Å; A30-A33 PolarHBondContact O-N 3.47Å; A30-L34 VanDerWaalsContact O-CB 3.28Å; A30-L34 WeakPolarHBondContact O-CB 3.47Å; A30-L34 PolarHBondContact O-N 2.87Å; A30-L133 HydrophobicContact CB-CD1 3.86Å; A30-A136 HydrophobicContact CB-CB 3.78Å; A30-I140 HydrophobicContact CB-CD1 3.68Å
31	C	96.8	Very high	91.3	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-61.1	-44.7	177	-176.8	0	0	0	0	111.7	H27 C28 A33 L34 V35 I140 C164 L170	H27-C31 WeakPolarHBondContact O-CB 3.29Å; H27-C31 PolarHBondContact O-N 3.42Å; C28-C31 PolarHBondContact O-N 3.26Å; C31-A33 PolarHBondContact O-N 2.87Å; C31-L34 PolarHBondContact O-N 2.89Å; C31-V35 WeakPolarHBondContact O-CG2 3.48Å; C31-V35 PolarHBondContact O-N 3.27Å; C31-I140 HydrophobicContact CB-CD1 4.05Å; C31-C164 HydrophobicContact CB-CB 3.83Å; C31-C164 WeakPolarHBondContact CB-SG 3.34Å; C31-C164 PolarHBondContact O-SG 2.86Å; C31-C164 WeakPolarHBondContact SG-CA 3.33Å; C31-C164 WeakPolarHBondContact SG-CB 3.41Å; C31-C164 CovalentContact SG-SG 2.04Å; C31-C164 PolarHBondContact SG-SG 2.64Å; C31-L170 HydrophobicContact CB-CD1 3.78Å
32	R	94.9	Very high	92.5	Very high	24 Å²	24	30.8 Å²	30.8	9%	0.091	14%	0.143	C	C	.	.	H	α-helix	trans	-63.9	-42.2	179.3	-73.2	-177	103.5	77	5.6	111.6	C28 G29 A30 D36 K160 D161	C28-R32 WeakPolarHBondContact O-CB 3.48Å; C28-R32 VanDerWaalsContact O-CG 3.28Å; C28-R32 WeakPolarHBondContact O-CG 3.27Å; C28-R32 PolarHBondContact O-N 3.43Å; G29-R32 PolarHBondContact O-N 3.45Å; A30-R32 PolarHBondContact O-N 3.38Å; R32-D36 WeakPolarHBondContact O-CB 3.34Å; R32-D36 PolarHBondContact O-N 2.92Å; R32-K160 HydrophobicContact CB-CD 4.05Å; R32-K160 HydrophobicContact CB-CG 4.23Å; R32-K160 HydrophobicContact CG-CD 4.11Å; R32-K160 HydrophobicContact CG-CG 3.82Å; R32-D161 IonicContact CZ-OD1 2.67Å; R32-D161 IonicContact NH1-OD1 3.57Å; R32-D161 PolarHBondContact NH1-OD1 2.88Å; R32-D161 IonicContact NH2-OD1 2.89Å; R32-D161 PolarHBondContact NH2-OD1 3.3Å
33	A	95.5	Very high	93.8	Very high	2 Å²	2	26.8 Å²	26.8	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-64.8	-45.1	175.1	0	0	0	0	0	112	G29 A30 C31 V35 D36 E37 M89 Y92	G29-A33 WeakPolarHBondContact O-CB 3.42Å; G29-A33 PolarHBondContact O-N 3.05Å; A30-A33 PolarHBondContact O-N 3.47Å; C31-A33 PolarHBondContact O-N 2.87Å; A33-V35 VanDerWaalsContact C-N 3.34Å; A33-V35 PolarHBondContact O-N 3Å; A33-D36 PolarHBondContact O-N 2.71Å; A33-E37 WeakPolarHBondContact O-CG 3.46Å; A33-E37 PolarHBondContact O-N 3.34Å; A33-M89 HydrophobicContact CB-CE 3.9Å; A33-M89 HydrophobicContact CB-SD 3.73Å; A33-Y92 HydrophobicContact CB-CD1 3.94Å; A33-Y92 HydrophobicContact CB-CE1 3.48Å; A33-Y92 VanDerWaalsContact CB-CE1 3.48Å; A33-Y92 HydrophobicContact CB-CE2 4.19Å; A33-Y92 HydrophobicContact CB-CG 4.48Å
34	L	96.9	Very high	94.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-54.7	-49.1	174.9	171.6	62.4	0	0	0	111.3	A30 C31 E37 L38 L82 I85 I140 V141 L148	A30-L34 VanDerWaalsContact O-CB 3.28Å; A30-L34 WeakPolarHBondContact O-CB 3.47Å; A30-L34 PolarHBondContact O-N 2.87Å; C31-L34 PolarHBondContact O-N 2.89Å; L34-E37 PolarHBondContact O-N 3.22Å; L34-L38 HydrophobicContact CD1-CD1 3.97Å; L34-L38 HydrophobicContact CD1-CG 4.31Å; L34-L38 HydrophobicContact CG-CD1 4.07Å; L34-L38 WeakPolarHBondContact O-CB 3.34Å; L34-L38 WeakPolarHBondContact O-CG 3.25Å; L34-L38 PolarHBondContact O-N 2.99Å; L34-L82 HydrophobicContact CD1-CD2 4.19Å; L34-I85 HydrophobicContact CD1-CB 4.23Å; L34-I85 HydrophobicContact CD1-CG2 3.57Å; L34-I140 HydrophobicContact CD2-CG2 3.89Å; L34-V141 HydrophobicContact CD1-CG2 4.08Å; L34-V141 HydrophobicContact CD2-CG2 3.86Å; L34-L148 HydrophobicContact CD2-CD1 4.05Å; L34-L148 HydrophobicContact CD2-CD2 4.01Å
35	V	95.9	Very high	94.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-45.8	177.4	169.1	0	0	0	0	111.7	C31 A33 E37 L38 E39 F152 V159 K160 L163	C31-V35 WeakPolarHBondContact O-CG2 3.48Å; C31-V35 PolarHBondContact O-N 3.27Å; A33-V35 VanDerWaalsContact C-N 3.34Å; A33-V35 PolarHBondContact O-N 3Å; V35-E37 VanDerWaalsContact C-N 3.29Å; V35-E37 PolarHBondContact O-N 2.89Å; V35-L38 PolarHBondContact O-N 3.48Å; V35-E39 HydrophobicContact CG1-CG 4.28Å; V35-E39 WeakPolarHBondContact O-CG 3.42Å; V35-E39 PolarHBondContact O-N 3.11Å; V35-F152 HydrophobicContact CB-CZ 4.32Å; V35-F152 HydrophobicContact CG1-CZ 4Å; V35-F152 HydrophobicContact CG2-CE2 4.36Å; V35-F152 HydrophobicContact CG2-CZ 4.16Å; V35-V159 HydrophobicContact CG1-CB 4.32Å; V35-V159 HydrophobicContact CG1-CG1 4.01Å; V35-K160 HydrophobicContact CB-CB 4.46Å; V35-K160 HydrophobicContact CB-CG 4.48Å; V35-K160 HydrophobicContact CG1-CB 3.76Å; V35-K160 HydrophobicContact CG1-CD 4.46Å; V35-K160 HydrophobicContact CG1-CG 4.26Å; V35-L163 HydrophobicContact CG2-CD2 3.72Å
36	D	94.5	Very high	95	Very high	41 Å²	41	32 Å²	32	22%	0.219	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-34.2	-179.6	-69.2	-27.3	0	0	0	112.2	R32 A33 W40 R111 K160	R32-D36 WeakPolarHBondContact O-CB 3.34Å; R32-D36 PolarHBondContact O-N 2.92Å; A33-D36 PolarHBondContact O-N 2.71Å; D36-W40 WeakPolarHBondContact O-CB 3.3Å; D36-W40 PolarHBondContact O-N 2.99Å; D36-R111 PolarHBondContact O-NH2 3.34Å; D36-K160 WeakPolarHBondContact OD1-CD 3.26Å; D36-K160 IonicContact OD1-NZ 3.76Å; D36-K160 PolarHBondContact OD1-NZ 2.67Å; D36-K160 IonicContact OD2-NZ 3.16Å; D36-K160 PolarHBondContact OD2-NZ 2.89Å
37	E	95.7	Very high	95	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-76.6	-39.6	174.9	-63.9	-57.6	136.1	0	0	111.8	A33 L34 V35 W40 E41 I85 R88 Y92 R107 R111	A33-E37 WeakPolarHBondContact O-CG 3.46Å; A33-E37 PolarHBondContact O-N 3.34Å; L34-E37 PolarHBondContact O-N 3.22Å; V35-E37 VanDerWaalsContact C-N 3.29Å; V35-E37 PolarHBondContact O-N 2.89Å; E37-W40 PolarHBondContact O-N 2.89Å; E37-E41 WeakPolarHBondContact O-CG 3.41Å; E37-E41 PolarHBondContact O-N 2.04Å; E37-I85 HydrophobicContact CB-CD1 4.29Å; E37-I85 HydrophobicContact CB-CG1 4.23Å; E37-I85 HydrophobicContact CB-CG2 3.59Å; E37-I85 HydrophobicContact CG-CG2 4.22Å; E37-R88 HydrophobicContact CG-CB 4.41Å; E37-R88 WeakPolarHBondContact OE2-CD 3.35Å; E37-Y92 HydrophobicContact CG-CE2 4.25Å; E37-Y92 WeakPolarHBondContact OE1-CE2 3.41Å; E37-Y92 PolarHBondContact OE1-OH 3.29Å; E37-R107 IonicContact OE1-CZ 3.78Å; E37-R107 IonicContact OE1-NE 2.99Å; E37-R107 PolarHBondContact OE1-NE 2.74Å; E37-R107 IonicContact OE1-NH2 3.05Å; E37-R107 IonicContact OE2-CZ 2.64Å; E37-R107 IonicContact OE2-NE 3.87Å; E37-R107 IonicContact OE2-NH2 2.69Å; E37-R107 PolarHBondContact OE2-NH2 3.05Å; E37-R111 IonicContact OE1-NE 2.68Å
38	L	95.9	Very high	94.9	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-60.4	-49.7	175.2	-83	166.8	0	0	0	111.4	L34 V35 W40 E41 I42 L81 L82 I85 L148 F152	L34-L38 HydrophobicContact CD1-CD1 3.97Å; L34-L38 HydrophobicContact CD1-CG 4.31Å; L34-L38 HydrophobicContact CG-CD1 4.07Å; L34-L38 WeakPolarHBondContact O-CB 3.34Å; L34-L38 WeakPolarHBondContact O-CG 3.25Å; L34-L38 PolarHBondContact O-N 2.99Å; V35-L38 PolarHBondContact O-N 3.48Å; L38-W40 PolarHBondContact O-N 3.46Å; L38-E41 PolarHBondContact O-N 3.45Å; L38-I42 WeakPolarHBondContact O-CB 3.4Å; L38-I42 WeakPolarHBondContact O-CD1 3.05Å; L38-I42 WeakPolarHBondContact O-CG1 3.38Å; L38-I42 PolarHBondContact O-N 2.04Å; L38-L81 HydrophobicContact CD2-CB 3.82Å; L38-L81 HydrophobicContact CD2-CD1 4.16Å; L38-L82 HydrophobicContact CD1-CD2 3.85Å; L38-L82 HydrophobicContact CD2-CD2 4.19Å; L38-I85 HydrophobicContact CB-CD1 4.13Å; L38-I85 HydrophobicContact CD2-CD1 3.35Å; L38-I85 HydrophobicContact CG-CD1 3.44Å; L38-I85 VanDerWaalsContact CG-CD1 3.44Å; L38-L148 HydrophobicContact CD1-CD2 4.12Å; L38-F152 HydrophobicContact CB-CD1 4.47Å; L38-F152 HydrophobicContact CB-CE1 3.85Å; L38-F152 HydrophobicContact CB-CE2 4.25Å; L38-F152 HydrophobicContact CB-CZ 3.71Å; L38-F152 HydrophobicContact CD1-CD2 3.93Å; L38-F152 HydrophobicContact CD1-CE2 3.44Å; L38-F152 VanDerWaalsContact CD1-CE2 3.44Å; L38-F152 HydrophobicContact CD1-CZ 3.77Å; L38-F152 HydrophobicContact CG-CE2 4.45Å; L38-F152 HydrophobicContact CG-CZ 4.38Å
39	E	94.7	Very high	95	Very high	77 Å²	77	47.4 Å²	47.4	36%	0.36	24%	0.244	S	C	.	.	H	α-helix	trans	-58.8	-38.3	177.8	-73	-175.3	149.6	0	0	111.5	V35 A43 F152 V159	V35-E39 HydrophobicContact CG1-CG 4.28Å; V35-E39 WeakPolarHBondContact O-CG 3.42Å; V35-E39 PolarHBondContact O-N 3.11Å; E39-A43 VanDerWaalsContact O-CB 3.26Å; E39-A43 WeakPolarHBondContact O-CB 3.39Å; E39-A43 PolarHBondContact O-N 2.91Å; E39-F152 HydrophobicContact CG-CE1 3.82Å; E39-F152 HydrophobicContact CG-CZ 4.44Å; E39-V159 WeakPolarHBondContact OE1-CB 3.49Å
40	W	93.9	Very high	95.1	Very high	83 Å²	83	50.5 Å²	50.5	31%	0.314	26%	0.262	S	S	.	.	H	α-helix	trans	-66	-51.7	176.9	-177.6	-92.2	0	0	0	112.4	D36 E37 L38 I42 A43 Q44 R111	D36-W40 WeakPolarHBondContact O-CB 3.3Å; D36-W40 PolarHBondContact O-N 2.99Å; E37-W40 PolarHBondContact O-N 2.89Å; L38-W40 PolarHBondContact O-N 3.46Å; W40-I42 VanDerWaalsContact C-N 3.33Å; W40-I42 PolarHBondContact O-N 3.05Å; W40-A43 WeakPolarHBondContact O-CB 3.06Å; W40-A43 PolarHBondContact O-N 3.02Å; W40-A43 VanDerWaalsContact O-N 3.11Å; W40-Q44 VanDerWaalsContact CZ2-NE2 3.28Å; W40-Q44 WeakPolarHBondContact O-CG 3.5Å; W40-Q44 PolarHBondContact O-N 2.81Å; W40-Q44 VanDerWaalsContact O-N 3.15Å; W40-R111 HydrophobicContact CD2-CG 4.35Å; W40-R111 VanDerWaalsContact CE3-CD 3.4Å; W40-R111 HydrophobicContact CH2-CB 4.26Å; W40-R111 HydrophobicContact CZ2-CB 3.61Å; W40-R111 HydrophobicContact CZ2-CG 4.2Å
41	E	95	Very high	94.9	Very high	39 Å²	39	52.8 Å²	52.8	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-41.4	-178.6	-70.3	-61	151.1	0	0	111.5	E37 L38 A43 Q44 L81 R88	E37-E41 WeakPolarHBondContact O-CG 3.41Å; E37-E41 PolarHBondContact O-N 2.04Å; L38-E41 PolarHBondContact O-N 3.45Å; E41-A43 VanDerWaalsContact C-N 3.3Å; E41-A43 PolarHBondContact O-N 2.77Å; E41-Q44 PolarHBondContact O-N 3.11Å; E41-Q44 VanDerWaalsContact O-N 3.16Å; E41-L81 HydrophobicContact CB-CD1 3.88Å; E41-L81 HydrophobicContact CB-CD2 3.68Å; E41-L81 HydrophobicContact CB-CG 4.44Å; E41-L81 HydrophobicContact CG-CD2 4.04Å; E41-R88 IonicContact OE1-CZ 2.84Å; E41-R88 IonicContact OE1-NE 3.43Å; E41-R88 IonicContact OE1-NH1 3.27Å; E41-R88 PolarHBondContact OE1-NH1 3.49Å; E41-R88 IonicContact OE1-NH2 2.88Å; E41-R88 PolarHBondContact OE1-NH2 3.46Å; E41-R88 IonicContact OE2-NH2 3.05Å
42	I	94.9	Very high	94.6	Very high	14 Å²	14	59.1 Å²	59.1	7%	0.072	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-42.2	173.6	-67.1	166.7	0	0	0	110.8	L38 W40 Q44 V45 A72 R73 L78 L81 F152	L38-I42 WeakPolarHBondContact O-CB 3.4Å; L38-I42 WeakPolarHBondContact O-CD1 3.05Å; L38-I42 WeakPolarHBondContact O-CG1 3.38Å; L38-I42 PolarHBondContact O-N 2.04Å; W40-I42 VanDerWaalsContact C-N 3.33Å; W40-I42 PolarHBondContact O-N 3.05Å; I42-Q44 PolarHBondContact O-N 2.85Å; I42-V45 WeakPolarHBondContact O-CB 3.29Å; I42-V45 PolarHBondContact O-N 2.77Å; I42-A72 HydrophobicContact CG2-CB 4.31Å; I42-R73 HydrophobicContact CG2-CG 3.93Å; I42-L78 HydrophobicContact CD1-CD2 3.69Å; I42-L78 HydrophobicContact CG1-CD2 4.16Å; I42-L81 HydrophobicContact CG1-CD1 4.05Å; I42-F152 HydrophobicContact CD1-CB 4.37Å; I42-F152 HydrophobicContact CD1-CD1 3.58Å; I42-F152 HydrophobicContact CD1-CE1 4.23Å; I42-F152 HydrophobicContact CD1-CG 4.29Å
43	A	93.8	Very high	94	Very high	76 Å²	76	61 Å²	61	63%	0.628	31%	0.314	S	S	*	.	H	α-helix	trans	-68.3	-20.6	-180	0	0	0	0	0	113.8	E39 W40 E41 V45	E39-A43 VanDerWaalsContact O-CB 3.26Å; E39-A43 WeakPolarHBondContact O-CB 3.39Å; E39-A43 PolarHBondContact O-N 2.91Å; W40-A43 WeakPolarHBondContact O-CB 3.06Å; W40-A43 PolarHBondContact O-N 3.02Å; W40-A43 VanDerWaalsContact O-N 3.11Å; E41-A43 VanDerWaalsContact C-N 3.3Å; E41-A43 PolarHBondContact O-N 2.77Å; A43-V45 VanDerWaalsContact C-N 3.33Å
44	Q	93.9	Very high	93.1	Very high	114 Å²	114	62.9 Å²	62.9	53%	0.533	33%	0.333	S	S	.	.	H	α-helix	trans	-79.4	-15.4	175.2	-60.8	-50.2	-29.4	0	0	113.5	W40 E41 I42	W40-Q44 VanDerWaalsContact CZ2-NE2 3.28Å; W40-Q44 WeakPolarHBondContact O-CG 3.5Å; W40-Q44 PolarHBondContact O-N 2.81Å; W40-Q44 VanDerWaalsContact O-N 3.15Å; E41-Q44 PolarHBondContact O-N 3.11Å; E41-Q44 VanDerWaalsContact O-N 3.16Å; I42-Q44 PolarHBondContact O-N 2.85Å
45	V	95.9	Very high	92.2	Very high	22 Å²	22	64 Å²	64	13%	0.133	34%	0.341	C	S	.	.	S	Bend	trans	-74.1	135	-179.1	178.9	0	0	0	0	110.8	I42 A43 P47 K49 Y71 A72	I42-V45 WeakPolarHBondContact O-CB 3.29Å; I42-V45 PolarHBondContact O-N 2.77Å; A43-V45 VanDerWaalsContact C-N 3.33Å; V45-P47 VanDerWaalsContact O-CD 3.3Å; V45-P47 WeakPolarHBondContact O-CD 3Å; V45-K49 HydrophobicContact CG1-CB 4.33Å; V45-K49 HydrophobicContact CG1-CD 4.33Å; V45-Y71 HydrophobicContact CG1-CD1 3.83Å; V45-A72 HydrophobicContact CB-CB 3.73Å; V45-A72 HydrophobicContact CG1-CB 3.65Å; V45-A72 HydrophobicContact CG2-CB 4.27Å
46	D	95.2	Very high	91.2	Very high	95 Å²	95	74.2 Å²	74.2	51%	0.508	39%	0.386	S	S	.	.			trans	-57.9	120.8	171.1	-177.5	-12.1	0	0	0	110.2	K48 K49	D46-K48 PolarHBondContact O-N 3.44Å; D46-K48 WeakPolarHBondContact OD1-CB 3.19Å; D46-K48 PolarHBondContact OD1-N 3.25Å; D46-K49 HydrophobicContact CB-CB 4.3Å; D46-K49 VanDerWaalsContact O-CB 3.29Å; D46-K49 WeakPolarHBondContact O-CB 3.45Å; D46-K49 PolarHBondContact O-N 2.95Å
47	P	92.7	Very high	90.4	Very high	122 Å²	122	81.8 Å²	81.8	79%	0.792	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-19.1	178.3	-25.9	34.6	0	0	0	114.6	V45	V45-P47 VanDerWaalsContact O-CD 3.3Å; V45-P47 WeakPolarHBondContact O-CD 3Å
48	K	94	Very high	89.9	Confident	179 Å²	179	87.7 Å²	87.7	78%	0.778	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-11.1	176.9	-62.3	178.5	-178	173.7	0	113.6	D46 T50	D46-K48 PolarHBondContact O-N 3.44Å; D46-K48 WeakPolarHBondContact OD1-CB 3.19Å; D46-K48 PolarHBondContact OD1-N 3.25Å; K48-T50 PolarHBondContact O-N 3.48Å
49	K	95.8	Very high	89.3	Confident	101 Å²	101	90.6 Å²	90.6	44%	0.439	46%	0.457	S	S	.	.			trans	-70.2	121.4	179	-171.5	178.5	174.1	-168.3	0	109.2	V45 D46 Y71	V45-K49 HydrophobicContact CG1-CB 4.33Å; V45-K49 HydrophobicContact CG1-CD 4.33Å; D46-K49 HydrophobicContact CB-CB 4.3Å; D46-K49 VanDerWaalsContact O-CB 3.29Å; D46-K49 WeakPolarHBondContact O-CB 3.45Å; D46-K49 PolarHBondContact O-N 2.95Å; K49-Y71 HydrophobicContact CD-CD1 3.55Å; K49-Y71 HydrophobicContact CD-CE1 4.11Å; K49-Y71 HydrophobicContact CD-CG 4.02Å; K49-Y71 HydrophobicContact CG-CD1 4.17Å; K49-Y71 HydrophobicContact CG-CG 4.17Å; K49-Y71 WeakPolarHBondContact O-CB 3.07Å; K49-Y71 PolarHBondContact O-N 2.97Å
50	T	94	Very high	88.9	Confident	69 Å²	69	94 Å²	94	42%	0.423	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	159.7	177.9	54.6	0	0	0	0	111	K48 E68 V69	K48-T50 PolarHBondContact O-N 3.48Å; T50-E68 WeakPolarHBondContact CB-OE1 3.36Å; T50-E68 PolarHBondContact OG1-OE1 2.68Å; T50-V69 CarbonylContact C-O 3.57Å; T50-V69 VanDerWaalsContact CA-O 3.27Å; T50-V69 WeakPolarHBondContact CA-O 3.31Å; T50-V69 WeakPolarHBondContact CB-O 3.4Å
51	I	92.9	Very high	88.8	Confident	49 Å²	49	96 Å²	96	25%	0.251	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.4	169.4	-172.8	168.5	0	0	0	109.3	M53 E68 V69 Y71 A76	I51-M53 HydrophobicContact CG2-CE 4.07Å; I51-E68 WeakPolarHBondContact O-CA 3.47Å; I51-V69 HydrophobicContact CG2-CG2 3.65Å; I51-V69 PolarHBondContact N-O 3.03Å; I51-V69 PolarHBondContact O-N 2.84Å; I51-Y71 HydrophobicContact CB-CD2 4.17Å; I51-Y71 HydrophobicContact CD1-CD2 4.33Å; I51-Y71 HydrophobicContact CG2-CD2 4.48Å; I51-A76 HydrophobicContact CD1-CB 4.33Å
52	Q	89.6	Confident	88.2	Confident	133 Å²	133	97 Å²	97	62%	0.621	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	118	175.1	-80.6	-168.3	20.2	0	0	109.8	V66 E68	Q52-V66 HydrophobicContact CB-CG1 3.51Å; Q52-V66 HydrophobicContact CG-CG1 3.75Å; Q52-E68 HydrophobicContact CG-CG 3.79Å
53	M	82.9	Confident	87.8	Confident	65 Å²	65	98.7 Å²	98.7	32%	0.32	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.1	173	-66.8	-171.3	178.9	0	0	109.8	I51 S55 V66 V67 V69	I51-M53 HydrophobicContact CG2-CE 4.07Å; M53-S55 PolarHBondContact O-N 3.14Å; M53-V66 WeakPolarHBondContact O-CA 3.29Å; M53-V66 WeakPolarHBondContact O-CG1 3.43Å; M53-V67 PolarHBondContact N-O 3.06Å; M53-V67 PolarHBondContact O-N 2.94Å; M53-V69 HydrophobicContact CE-CG2 3.65Å; M53-V69 HydrophobicContact CG-CG2 4.11Å; M53-V69 HydrophobicContact SD-CG2 3.79Å
54	G	77.2	Confident	87.4	Confident	41 Å²	41	100.3 Å²	100.3	42%	0.423	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	124.5	170.6	0	0	0	0	0	109.8
55	S	76.6	Confident	86.8	Confident	23 Å²	23	96.8 Å²	96.8	16%	0.161	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	140.4	172.4	146	0	0	0	0	109.3	M53 R57 Q64 S65	M53-S55 PolarHBondContact O-N 3.14Å; S55-R57 PolarHBondContact O-N 3.34Å; S55-R57 PolarHBondContact OG-N 2.91Å; S55-R57 VanDerWaalsContact OG-N 3.13Å; S55-Q64 WeakPolarHBondContact O-CG 3.4Å; S55-Q64 PolarHBondContact O-NE2 3.15Å; S55-S65 VanDerWaalsContact CB-O 3.25Å; S55-S65 WeakPolarHBondContact CB-O 3.19Å; S55-S65 WeakPolarHBondContact CB-OG 3.25Å; S55-S65 PolarHBondContact N-O 2.99Å; S55-S65 PolarHBondContact OG-OG 3.27Å
56	F	76.4	Confident	86.3	Confident	214 Å²	214	99.5 Å²	99.5	94%	0.939	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	-8.5	175.9	-63.3	-81.2	0	0	0	114.1
57	R	77.8	Confident	85.9	Confident	201 Å²	201	98.7 Å²	98.7	76%	0.758	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	118.5	-179.5	-61.9	-175.5	176.2	170.6	0.2	111.9	S55 S65	S55-R57 PolarHBondContact O-N 3.34Å; S55-R57 PolarHBondContact OG-N 2.91Å; S55-R57 VanDerWaalsContact OG-N 3.13Å; R57-S65 PolarHBondContact O-OG 3.36Å
58	I	85	Confident	85.8	Confident	124 Å²	124	98.6 Å²	98.6	64%	0.636	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	128.6	166.3	-55.9	179.2	0	0	0	108.1	S63	I58-S63 CarbonylContact C-O 3.6Å
59	N	82.2	Confident	85.6	Confident	62 Å²	62	92.1 Å²	92.1	33%	0.332	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-70.4	158	176.1	-67.1	-41.5	0	0	0	110.6	D61 G62 S63	N59-D61 WeakPolarHBondContact CB-OD1 3.3Å; N59-D61 PolarHBondContact O-N 2.98Å; N59-G62 PolarHBondContact O-N 3.22Å; N59-S63 WeakPolarHBondContact CB-O 3.46Å; N59-S63 PolarHBondContact N-O 3.05Å; N59-S63 PolarHBondContact ND2-OG 2.9Å
60	P	88	Confident	85.6	Confident	147 Å²	147	91.6 Å²	91.6	96%	0.955	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-20.3	177.8	-25.1	34.7	0	0	0	115.1	G62	P60-G62 VanDerWaalsContact C-N 3.3Å
61	D	90.9	Very high	85.6	Confident	127 Å²	127	90.1 Å²	90.1	68%	0.679	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	1.5	176.7	66.5	-2.1	0	0	0	113.6	N59 S63	N59-D61 WeakPolarHBondContact CB-OD1 3.3Å; N59-D61 PolarHBondContact O-N 2.98Å; D61-S63 VanDerWaalsContact C-N 3.31Å; D61-S63 VanDerWaalsContact CG-OG 3.31Å; D61-S63 VanDerWaalsContact OD1-CB 3.32Å; D61-S63 WeakPolarHBondContact OD1-CB 3.42Å; D61-S63 PolarHBondContact OD1-N 3.42Å; D61-S63 PolarHBondContact OD1-OG 3.42Å; D61-S63 PolarHBondContact OD2-OG 3.4Å
62	G	83.3	Confident	85.7	Confident	59 Å²	59	88.6 Å²	88.6	61%	0.608	49%	0.487	S	S	*	.	S	Bend	trans	83.9	-1.4	-178.3	0	0	0	0	0	114.6	N59 P60	N59-G62 PolarHBondContact O-N 3.22Å; P60-G62 VanDerWaalsContact C-N 3.3Å
63	S	86.2	Confident	86	Confident	49 Å²	49	86 Å²	86	34%	0.343	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-78.5	150.7	173.1	69.6	0	0	0	0	111.4	I58 N59 D61	I58-S63 CarbonylContact C-O 3.6Å; N59-S63 WeakPolarHBondContact CB-O 3.46Å; N59-S63 PolarHBondContact N-O 3.05Å; N59-S63 PolarHBondContact ND2-OG 2.9Å; D61-S63 VanDerWaalsContact C-N 3.31Å; D61-S63 VanDerWaalsContact CG-OG 3.31Å; D61-S63 VanDerWaalsContact OD1-CB 3.32Å; D61-S63 WeakPolarHBondContact OD1-CB 3.42Å; D61-S63 PolarHBondContact OD1-N 3.42Å; D61-S63 PolarHBondContact OD1-OG 3.42Å; D61-S63 PolarHBondContact OD2-OG 3.4Å
64	Q	84.4	Confident	86.5	Confident	110 Å²	110	83.1 Å²	83.1	51%	0.514	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.6	171.8	-166.3	175	12.8	0	0	108.7	S55	S55-Q64 WeakPolarHBondContact O-CG 3.4Å; S55-Q64 PolarHBondContact O-NE2 3.15Å
65	S	81.3	Confident	87.3	Confident	40 Å²	40	87.3 Å²	87.3	28%	0.28	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	149.2	171.6	42.6	0	0	0	0	109.6	S55 R57	S55-S65 VanDerWaalsContact CB-O 3.25Å; S55-S65 WeakPolarHBondContact CB-O 3.19Å; S55-S65 WeakPolarHBondContact CB-OG 3.25Å; S55-S65 PolarHBondContact N-O 2.99Å; S55-S65 PolarHBondContact OG-OG 3.27Å; R57-S65 PolarHBondContact O-OG 3.36Å
66	V	85.6	Confident	88.1	Confident	79 Å²	79	88.7 Å²	88.7	48%	0.479	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.6	178.3	-178.1	0	0	0	0	108	Q52 M53	Q52-V66 HydrophobicContact CB-CG1 3.51Å; Q52-V66 HydrophobicContact CG-CG1 3.75Å; M53-V66 WeakPolarHBondContact O-CA 3.29Å; M53-V66 WeakPolarHBondContact O-CG1 3.43Å
67	V	87.3	Confident	89.1	Confident	79 Å²	79	79.1 Å²	79.1	48%	0.479	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.3	177.4	-176.8	0	0	0	0	108.2	M53 V69	M53-V67 PolarHBondContact N-O 3.06Å; M53-V67 PolarHBondContact O-N 2.94Å; V67-V69 HydrophobicContact CG1-CG1 4.24Å
68	E	89.6	Confident	90	Very high	120 Å²	120	69.7 Å²	69.7	56%	0.561	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.2	170	-82.1	-173.8	89.9	0	0	110.5	T50 I51 Q52	T50-E68 WeakPolarHBondContact CB-OE1 3.36Å; T50-E68 PolarHBondContact OG1-OE1 2.68Å; I51-E68 WeakPolarHBondContact O-CA 3.47Å; Q52-E68 HydrophobicContact CG-CG 3.79Å
69	V	91.4	Very high	90.5	Very high	42 Å²	42	65.5 Å²	65.5	26%	0.255	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	156.8	173.9	-59.4	0	0	0	0	110.3	T50 I51 M53 V67 Y71	T50-V69 CarbonylContact C-O 3.57Å; T50-V69 VanDerWaalsContact CA-O 3.27Å; T50-V69 WeakPolarHBondContact CA-O 3.31Å; T50-V69 WeakPolarHBondContact CB-O 3.4Å; I51-V69 HydrophobicContact CG2-CG2 3.65Å; I51-V69 PolarHBondContact N-O 3.03Å; I51-V69 PolarHBondContact O-N 2.84Å; M53-V69 HydrophobicContact CE-CG2 3.65Å; M53-V69 HydrophobicContact CG-CG2 4.11Å; M53-V69 HydrophobicContact SD-CG2 3.79Å; V67-V69 HydrophobicContact CG1-CG1 4.24Å; V69-Y71 PolarHBondContact O-N 3.35Å
70	P	93.9	Very high	91.2	Very high	91 Å²	91	66.9 Å²	66.9	59%	0.591	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	131.2	174.2	-23.5	34.4	0	0	0	111.4
71	Y	95.2	Very high	91.6	Very high	37 Å²	37	60.3 Å²	60.3	15%	0.145	34%	0.344	C	S	.	.	S	Bend	trans	-68.4	-41.4	-178.4	174.2	-103.2	0	0	0	112.1	V45 K49 I51 V69 R73 S74 H77 E80	V45-Y71 HydrophobicContact CG1-CD1 3.83Å; K49-Y71 HydrophobicContact CD-CD1 3.55Å; K49-Y71 HydrophobicContact CD-CE1 4.11Å; K49-Y71 HydrophobicContact CD-CG 4.02Å; K49-Y71 HydrophobicContact CG-CD1 4.17Å; K49-Y71 HydrophobicContact CG-CG 4.17Å; K49-Y71 WeakPolarHBondContact O-CB 3.07Å; K49-Y71 PolarHBondContact O-N 2.97Å; I51-Y71 HydrophobicContact CB-CD2 4.17Å; I51-Y71 HydrophobicContact CD1-CD2 4.33Å; I51-Y71 HydrophobicContact CG2-CD2 4.48Å; V69-Y71 PolarHBondContact O-N 3.35Å; Y71-R73 PolarHBondContact O-N 2.95Å; Y71-S74 WeakPolarHBondContact O-CB 3.25Å; Y71-S74 PolarHBondContact O-N 3.31Å; Y71-S74 PolarHBondContact O-OG 3.32Å; Y71-H77 HydrophobicContact CD2-CB 4.21Å; Y71-H77 HydrophobicContact CE1-CB 4.22Å; Y71-H77 AromaticContact CE1-CD2 3.34Å; Y71-H77 WeakPolarHBondContact CE1-CD2 3.43Å; Y71-H77 AromaticContact CE1-CG 3.66Å; Y71-H77 AromaticContact CE1-NE2 3.62Å; Y71-H77 HydrophobicContact CE2-CB 3.87Å; Y71-H77 AromaticContact CZ-CD2 3.3Å; Y71-H77 AromaticContact CZ-CG 3.68Å; Y71-H77 VanDerWaalsContact O-CB 3.25Å; Y71-H77 WeakPolarHBondContact O-CB 3.36Å; Y71-H77 PolarHBondContact OH-CD2 2.73Å; Y71-E80 PolarHBondContact OH-OE2 3.46Å
72	A	95.4	Very high	91.9	Very high	18 Å²	18	54.6 Å²	54.6	15%	0.149	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-37	-170.4	0	0	0	0	0	114.8	I42 V45 H77	I42-A72 HydrophobicContact CG2-CB 4.31Å; V45-A72 HydrophobicContact CB-CB 3.73Å; V45-A72 HydrophobicContact CG1-CB 3.65Å; V45-A72 HydrophobicContact CG2-CB 4.27Å; A72-H77 PolarHBondContact O-ND1 3.43Å
73	R	94.4	Very high	92.4	Very high	78 Å²	78	59.1 Å²	59.1	29%	0.294	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	19.8	-179.3	-66.9	-178.5	173.1	137.1	-1.3	112.5	I42 Y71 F152 E155	I42-R73 HydrophobicContact CG2-CG 3.93Å; Y71-R73 PolarHBondContact O-N 2.95Å; R73-F152 WeakPolarHBondContact CB-O 3.17Å; R73-F152 VanDerWaalsContact CD-O 3.22Å; R73-F152 WeakPolarHBondContact CD-O 3.3Å; R73-F152 VanDerWaalsContact CG-O 3.29Å; R73-F152 WeakPolarHBondContact CG-O 3.11Å; R73-E155 IonicContact CZ-OE2 2.65Å; R73-E155 IonicContact NH1-OE2 3.19Å; R73-E155 PolarHBondContact NH1-OE2 2.84Å; R73-E155 IonicContact NH2-OE2 3.52Å
74	S	94.8	Very high	92.8	Very high	5 Å²	5	61.8 Å²	61.8	4%	0.035	33%	0.325	C	S	.	.			trans	-69.7	142.2	172.5	66	0	0	0	0	109.8	Y71 A76 H77 L78	Y71-S74 WeakPolarHBondContact O-CB 3.25Å; Y71-S74 PolarHBondContact O-N 3.31Å; Y71-S74 PolarHBondContact O-OG 3.32Å; S74-A76 PolarHBondContact O-N 3.26Å; S74-H77 PolarHBondContact O-N 3.06Å; S74-H77 WeakPolarHBondContact OG-CB 3.44Å; S74-H77 PolarHBondContact OG-N 3.45Å; S74-L78 WeakPolarHBondContact O-CG 3.4Å; S74-L78 PolarHBondContact O-N 2.98Å
75	E	94.1	Very high	93.4	Very high	128 Å²	128	56.6 Å²	56.6	60%	0.598	30%	0.301	S	S	*	.	H	α-helix	trans	-48.7	-46.7	176.5	178.7	177.5	161.7	0	0	111.6	H77 L78 T79 I149	E75-H77 VanDerWaalsContact C-N 3.32Å; E75-H77 PolarHBondContact O-N 3.16Å; E75-L78 PolarHBondContact O-N 3.5Å; E75-L78 VanDerWaalsContact O-N 3.14Å; E75-T79 PolarHBondContact O-N 3.15Å; E75-T79 PolarHBondContact O-OG1 3.39Å; E75-I149 HydrophobicContact CB-CG2 4.28Å; E75-I149 HydrophobicContact CG-CD1 4.44Å; E75-I149 HydrophobicContact CG-CG2 3.97Å
76	A	93.7	Very high	94.2	Very high	53 Å²	53	54.9 Å²	54.9	44%	0.438	29%	0.289	S	S	.	.	H	α-helix	trans	-55.9	-41.2	177.3	0	0	0	0	0	113.9	I51 S74 E80	I51-A76 HydrophobicContact CD1-CB 4.33Å; S74-A76 PolarHBondContact O-N 3.26Å; A76-E80 PolarHBondContact O-N 3.11Å
77	H	96.1	Very high	94.7	Very high	12 Å²	12	55 Å²	55	6%	0.056	29%	0.287	C	S	.	.	H	α-helix	trans	-75	-38.6	177.5	179.7	-126.4	0	0	0	111.9	Y71 A72 S74 E75 E80 L81	Y71-H77 HydrophobicContact CD2-CB 4.21Å; Y71-H77 HydrophobicContact CE1-CB 4.22Å; Y71-H77 AromaticContact CE1-CD2 3.34Å; Y71-H77 WeakPolarHBondContact CE1-CD2 3.43Å; Y71-H77 AromaticContact CE1-CG 3.66Å; Y71-H77 AromaticContact CE1-NE2 3.62Å; Y71-H77 HydrophobicContact CE2-CB 3.87Å; Y71-H77 AromaticContact CZ-CD2 3.3Å; Y71-H77 AromaticContact CZ-CG 3.68Å; Y71-H77 VanDerWaalsContact O-CB 3.25Å; Y71-H77 WeakPolarHBondContact O-CB 3.36Å; Y71-H77 PolarHBondContact OH-CD2 2.73Å; A72-H77 PolarHBondContact O-ND1 3.43Å; S74-H77 PolarHBondContact O-N 3.06Å; S74-H77 WeakPolarHBondContact OG-CB 3.44Å; S74-H77 PolarHBondContact OG-N 3.45Å; E75-H77 VanDerWaalsContact C-N 3.32Å; E75-H77 PolarHBondContact O-N 3.16Å; H77-E80 PolarHBondContact O-N 2.96Å; H77-L81 WeakPolarHBondContact O-CG 3.27Å; H77-L81 PolarHBondContact O-N 2.88Å
78	L	96.9	Very high	95	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-43	179.7	-66.1	175.2	0	0	0	111.1	I42 S74 E75 E80 L81 L82 I149 F152	I42-L78 HydrophobicContact CD1-CD2 3.69Å; I42-L78 HydrophobicContact CG1-CD2 4.16Å; S74-L78 WeakPolarHBondContact O-CG 3.4Å; S74-L78 PolarHBondContact O-N 2.98Å; E75-L78 PolarHBondContact O-N 3.5Å; E75-L78 VanDerWaalsContact O-N 3.14Å; L78-E80 VanDerWaalsContact C-N 3.35Å; L78-E80 PolarHBondContact O-N 2.93Å; L78-L81 PolarHBondContact O-N 3.35Å; L78-L82 VanDerWaalsContact O-CG 3.27Å; L78-L82 WeakPolarHBondContact O-CG 3.4Å; L78-L82 PolarHBondContact O-N 3.01Å; L78-I149 HydrophobicContact CB-CG1 4.4Å; L78-F152 HydrophobicContact CD1-CB 3.81Å; L78-F152 HydrophobicContact CD2-CB 3.85Å; L78-F152 HydrophobicContact CG-CB 4.48Å
79	T	96.2	Very high	95.2	Very high	37 Å²	37	48.6 Å²	48.6	23%	0.227	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-44.1	174.2	-57.8	0	0	0	0	111.5	E75 L81 L82 E83 I149	E75-T79 PolarHBondContact O-N 3.15Å; E75-T79 PolarHBondContact O-OG1 3.39Å; T79-L81 PolarHBondContact O-N 2.96Å; T79-L82 PolarHBondContact O-N 2.97Å; T79-E83 PolarHBondContact O-N 2.91Å; T79-I149 WeakPolarHBondContact OG1-CD1 3.28Å
80	E	96.1	Very high	95.3	Very high	91 Å²	91	53 Å²	53	43%	0.425	27%	0.265	S	S	.	.	H	α-helix	trans	-58.2	-45.4	175.2	-177.8	177.1	-159.3	0	0	111.7	Y71 A76 H77 L78 L82 E83	Y71-E80 PolarHBondContact OH-OE2 3.46Å; A76-E80 PolarHBondContact O-N 3.11Å; H77-E80 PolarHBondContact O-N 2.96Å; L78-E80 VanDerWaalsContact C-N 3.35Å; L78-E80 PolarHBondContact O-N 2.93Å; E80-L82 PolarHBondContact O-N 3.25Å; E80-E83 PolarHBondContact O-N 3.36Å
81	L	97.4	Very high	95.2	Very high	9 Å²	9	50.6 Å²	50.6	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-38.8	177	-70.6	-178.7	0	0	0	112.9	L38 E41 I42 H77 L78 T79 E83 E84 I85	L38-L81 HydrophobicContact CD2-CB 3.82Å; L38-L81 HydrophobicContact CD2-CD1 4.16Å; E41-L81 HydrophobicContact CB-CD1 3.88Å; E41-L81 HydrophobicContact CB-CD2 3.68Å; E41-L81 HydrophobicContact CB-CG 4.44Å; E41-L81 HydrophobicContact CG-CD2 4.04Å; I42-L81 HydrophobicContact CG1-CD1 4.05Å; H77-L81 WeakPolarHBondContact O-CG 3.27Å; H77-L81 PolarHBondContact O-N 2.88Å; L78-L81 PolarHBondContact O-N 3.35Å; T79-L81 PolarHBondContact O-N 2.96Å; L81-E83 VanDerWaalsContact C-N 3.27Å; L81-E83 PolarHBondContact O-N 3.37Å; L81-E84 PolarHBondContact O-N 3.36Å; L81-I85 HydrophobicContact CB-CD1 3.93Å; L81-I85 WeakPolarHBondContact O-CB 3.42Å; L81-I85 WeakPolarHBondContact O-CD1 3.44Å; L81-I85 VanDerWaalsContact O-CG1 3.22Å; L81-I85 WeakPolarHBondContact O-CG1 3.48Å; L81-I85 PolarHBondContact O-N 3.39Å
82	L	96.9	Very high	95.1	Very high	7 Å²	7	49 Å²	49	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-32.6	-180	-72.9	176.3	0	0	0	112.3	L34 L38 L78 T79 E80 V141 E145 L148 I149	L34-L82 HydrophobicContact CD1-CD2 4.19Å; L38-L82 HydrophobicContact CD1-CD2 3.85Å; L38-L82 HydrophobicContact CD2-CD2 4.19Å; L78-L82 VanDerWaalsContact O-CG 3.27Å; L78-L82 WeakPolarHBondContact O-CG 3.4Å; L78-L82 PolarHBondContact O-N 3.01Å; T79-L82 PolarHBondContact O-N 2.97Å; E80-L82 PolarHBondContact O-N 3.25Å; L82-V141 HydrophobicContact CB-CG1 3.88Å; L82-V141 HydrophobicContact CD2-CG1 4.47Å; L82-V141 HydrophobicContact CD2-CG2 4.14Å; L82-E145 HydrophobicContact CD1-CG 4.05Å; L82-L148 HydrophobicContact CD1-CB 4.14Å; L82-L148 HydrophobicContact CD1-CD1 4.48Å; L82-L148 HydrophobicContact CD2-CB 4.32Å; L82-L148 HydrophobicContact CD2-CD1 3.9Å; L82-L148 HydrophobicContact CD2-CD2 4.45Å; L82-L148 HydrophobicContact CD2-CG 4.47Å; L82-I149 HydrophobicContact CD1-CG1 4.08Å
83	E	93.4	Very high	94.9	Very high	154 Å²	154	48.1 Å²	48.1	72%	0.72	23%	0.233	S	C	*	.	H	α-helix	trans	-68.4	-32.7	175	-67.4	179.5	-173.3	0	0	112.6	T79 E80 L81	T79-E83 PolarHBondContact O-N 2.91Å; E80-E83 PolarHBondContact O-N 3.36Å; L81-E83 VanDerWaalsContact C-N 3.27Å; L81-E83 PolarHBondContact O-N 3.37Å
84	E	95.5	Very high	94.8	Very high	104 Å²	104	45 Å²	45	49%	0.486	22%	0.221	S	C	.	.	H	α-helix	trans	-97.7	-31.3	-172	-63.2	-171	164.8	0	0	114.3	L81 C86 D87	L81-E84 PolarHBondContact O-N 3.36Å; E84-C86 VanDerWaalsContact C-N 3.3Å; E84-C86 PolarHBondContact O-N 2.85Å; E84-D87 WeakPolarHBondContact O-CB 3.36Å; E84-D87 PolarHBondContact O-N 3.26Å; E84-D87 VanDerWaalsContact O-N 3.13Å
85	I	96.3	Very high	94.5	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-32.8	-168.3	-80.3	168.8	0	0	0	112.8	L34 E37 L38 L81 D87 R88 M89	L34-I85 HydrophobicContact CD1-CB 4.23Å; L34-I85 HydrophobicContact CD1-CG2 3.57Å; E37-I85 HydrophobicContact CB-CD1 4.29Å; E37-I85 HydrophobicContact CB-CG1 4.23Å; E37-I85 HydrophobicContact CB-CG2 3.59Å; E37-I85 HydrophobicContact CG-CG2 4.22Å; L38-I85 HydrophobicContact CB-CD1 4.13Å; L38-I85 HydrophobicContact CD2-CD1 3.35Å; L38-I85 HydrophobicContact CG-CD1 3.44Å; L38-I85 VanDerWaalsContact CG-CD1 3.44Å; L81-I85 HydrophobicContact CB-CD1 3.93Å; L81-I85 WeakPolarHBondContact O-CB 3.42Å; L81-I85 WeakPolarHBondContact O-CD1 3.44Å; L81-I85 VanDerWaalsContact O-CG1 3.22Å; L81-I85 WeakPolarHBondContact O-CG1 3.48Å; L81-I85 PolarHBondContact O-N 3.39Å; I85-D87 PolarHBondContact O-N 3.43Å; I85-D87 VanDerWaalsContact O-N 3.16Å; I85-R88 VanDerWaalsContact O-CB 3.26Å; I85-R88 WeakPolarHBondContact O-CB 3.26Å; I85-R88 PolarHBondContact O-N 2.93Å; I85-M89 HydrophobicContact CG2-CE 4.22Å
86	C	97.4	Very high	94.2	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.034	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-64.5	-21.1	179.6	-64.8	0	0	0	0	113.2	E84 R88 M89 C137 E138	E84-C86 VanDerWaalsContact C-N 3.3Å; E84-C86 PolarHBondContact O-N 2.85Å; C86-R88 PolarHBondContact O-N 3.22Å; C86-M89 WeakPolarHBondContact O-CB 3.17Å; C86-M89 VanDerWaalsContact O-CG 3.27Å; C86-M89 WeakPolarHBondContact O-CG 3.47Å; C86-M89 PolarHBondContact O-N 3.22Å; C86-C137 WeakPolarHBondContact CA-SG 3.27Å; C86-C137 HydrophobicContact CB-CB 3.74Å; C86-C137 WeakPolarHBondContact CB-SG 3.18Å; C86-C137 WeakPolarHBondContact SG-CB 3.31Å; C86-C137 CovalentContact SG-SG 2.05Å; C86-C137 PolarHBondContact SG-SG 3Å; C86-E138 HydrophobicContact CB-CG 3.88Å; C86-E138 PolarHBondContact SG-N 2.9Å; C86-E138 VanDerWaalsContact SG-N 3.4Å
87	D	95.9	Very high	93.7	Very high	82 Å²	82	45.7 Å²	45.7	44%	0.439	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-68.1	-18.9	171.3	-81.5	-28.4	0	0	0	113.5	E84 I85 M89 K90 K134	E84-D87 WeakPolarHBondContact O-CB 3.36Å; E84-D87 PolarHBondContact O-N 3.26Å; E84-D87 VanDerWaalsContact O-N 3.13Å; I85-D87 PolarHBondContact O-N 3.43Å; I85-D87 VanDerWaalsContact O-N 3.16Å; D87-M89 VanDerWaalsContact C-N 3.28Å; D87-M89 PolarHBondContact O-N 3.01Å; D87-K90 WeakPolarHBondContact O-CD 3.33Å; D87-K90 WeakPolarHBondContact O-CE 3.47Å; D87-K90 WeakPolarHBondContact O-CG 3.35Å; D87-K134 WeakPolarHBondContact OD1-CE 3.32Å; D87-K134 IonicContact OD1-NZ 2.8Å; D87-K134 PolarHBondContact OD1-NZ 2.91Å
88	R	94.3	Very high	93.1	Very high	63 Å²	63	50.1 Å²	50.1	24%	0.238	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-79.6	-9.2	177.3	-57.7	-178.5	-178.3	-119.9	6.3	112.9	E37 E41 I85 C86 K90 E91	E37-R88 HydrophobicContact CG-CB 4.41Å; E37-R88 WeakPolarHBondContact OE2-CD 3.35Å; E41-R88 IonicContact OE1-CZ 2.84Å; E41-R88 IonicContact OE1-NE 3.43Å; E41-R88 IonicContact OE1-NH1 3.27Å; E41-R88 PolarHBondContact OE1-NH1 3.49Å; E41-R88 IonicContact OE1-NH2 2.88Å; E41-R88 PolarHBondContact OE1-NH2 3.46Å; E41-R88 IonicContact OE2-NH2 3.05Å; I85-R88 VanDerWaalsContact O-CB 3.26Å; I85-R88 WeakPolarHBondContact O-CB 3.26Å; I85-R88 PolarHBondContact O-N 2.93Å; C86-R88 PolarHBondContact O-N 3.22Å; R88-K90 PolarHBondContact O-N 2.64Å; R88-E91 VanDerWaalsContact O-CB 3.28Å; R88-E91 WeakPolarHBondContact O-CB 3.48Å; R88-E91 PolarHBondContact O-N 3.33Å
89	M	94.6	Very high	92.5	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-60.8	-18.5	176.5	-63.1	-55.4	130	0	0	113.2	A33 I85 C86 D87 E91 Y92 L133 K134 C137	A33-M89 HydrophobicContact CB-CE 3.9Å; A33-M89 HydrophobicContact CB-SD 3.73Å; I85-M89 HydrophobicContact CG2-CE 4.22Å; C86-M89 WeakPolarHBondContact O-CB 3.17Å; C86-M89 VanDerWaalsContact O-CG 3.27Å; C86-M89 WeakPolarHBondContact O-CG 3.47Å; C86-M89 PolarHBondContact O-N 3.22Å; D87-M89 VanDerWaalsContact C-N 3.28Å; D87-M89 PolarHBondContact O-N 3.01Å; M89-E91 PolarHBondContact O-N 2.85Å; M89-Y92 PolarHBondContact O-N 3.26Å; M89-Y92 HydrophobicContact SD-CD2 4.44Å; M89-L133 HydrophobicContact CB-CB 4.24Å; M89-L133 HydrophobicContact CB-CD2 4.04Å; M89-L133 HydrophobicContact CB-CG 4.03Å; M89-L133 HydrophobicContact CG-CD2 4.39Å; M89-L133 HydrophobicContact CG-CG 4.13Å; M89-L133 HydrophobicContact SD-CD2 3.86Å; M89-L133 HydrophobicContact SD-CG 3.88Å; M89-K134 HydrophobicContact CB-CB 4.07Å; M89-C137 HydrophobicContact CE-CB 4.44Å; M89-C137 HydrophobicContact CG-CB 3.85Å; M89-C137 HydrophobicContact SD-CB 4.33Å
90	K	93.1	Very high	91.9	Very high	136 Å²	136	56.3 Å²	56.3	59%	0.591	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-64.1	-18.3	169.4	72.9	-167.9	173.4	-166.6	0	114.3	D87 R88 Y92	D87-K90 WeakPolarHBondContact O-CD 3.33Å; D87-K90 WeakPolarHBondContact O-CE 3.47Å; D87-K90 WeakPolarHBondContact O-CG 3.35Å; R88-K90 PolarHBondContact O-N 2.64Å; K90-Y92 VanDerWaalsContact C-N 3.29Å
91	E	91.9	Very high	91.3	Very high	39 Å²	39	59.3 Å²	59.3	18%	0.182	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-90.5	4.1	179.8	-59.6	179.2	-155.3	0	0	112.4	R88 M89 R107 V108 V109	R88-E91 VanDerWaalsContact O-CB 3.28Å; R88-E91 WeakPolarHBondContact O-CB 3.48Å; R88-E91 PolarHBondContact O-N 3.33Å; M89-E91 PolarHBondContact O-N 2.85Å; E91-R107 IonicContact OE2-CZ 2.73Å; E91-R107 IonicContact OE2-NH1 3.98Å; E91-R107 PolarHBondContact OE2-NH1 3.05Å; E91-R107 IonicContact OE2-NH2 3.96Å; E91-R107 PolarHBondContact OE2-NH2 3.49Å; E91-V108 VanDerWaalsContact O-CG2 3.22Å; E91-V108 WeakPolarHBondContact O-CG2 3.39Å; E91-V108 PolarHBondContact O-N 2.9Å; E91-V109 HydrophobicContact CB-CB 4.08Å; E91-V109 HydrophobicContact CB-CG2 4.17Å; E91-V109 HydrophobicContact CG-CB 4.25Å; E91-V109 HydrophobicContact CG-CG2 4.28Å; E91-V109 PolarHBondContact O-N 3.35Å
92	Y	92.6	Very high	90.7	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.016	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	147.5	178.8	-73	-106.1	0	0	0	111.4	A33 E37 M89 K90 V106 R107 L133	A33-Y92 HydrophobicContact CB-CD1 3.94Å; A33-Y92 HydrophobicContact CB-CE1 3.48Å; A33-Y92 VanDerWaalsContact CB-CE1 3.48Å; A33-Y92 HydrophobicContact CB-CE2 4.19Å; A33-Y92 HydrophobicContact CB-CG 4.48Å; E37-Y92 HydrophobicContact CG-CE2 4.25Å; E37-Y92 WeakPolarHBondContact OE1-CE2 3.41Å; E37-Y92 PolarHBondContact OE1-OH 3.29Å; M89-Y92 PolarHBondContact O-N 3.26Å; M89-Y92 HydrophobicContact SD-CD2 4.44Å; K90-Y92 VanDerWaalsContact C-N 3.29Å; Y92-V106 CarbonylContact C-O 3.58Å; Y92-V106 VanDerWaalsContact CA-O 3.3Å; Y92-V106 WeakPolarHBondContact CA-O 3.39Å; Y92-R107 HydrophobicContact CD1-CB 4.19Å; Y92-R107 HydrophobicContact CD2-CG 4.35Å; Y92-R107 HydrophobicContact CE1-CB 3.83Å; Y92-R107 HydrophobicContact CE1-CG 4.3Å; Y92-R107 HydrophobicContact CE2-CB 4.36Å; Y92-R107 HydrophobicContact CE2-CG 3.93Å; Y92-L133 HydrophobicContact CG-CD2 4.15Å
93	G	91.4	Very high	90.2	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	157.6	174.3	0	0	0	0	0	112	Y105 V106 R124	G93-Y105 WeakPolarHBondContact O-CA 3.31Å; G93-V106 PolarHBondContact N-O 3.46Å; G93-V106 PolarHBondContact O-N 2.97Å; G93-R124 CarbonylContact C-O 3.56Å; G93-R124 WeakPolarHBondContact CA-O 3.4Å
94	E	91.9	Very high	90	Very high	12 Å²	12	58 Å²	58	6%	0.056	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	127.4	176.6	-177.7	179.6	103.7	0	0	110.3	K103 N104 Y105 R124 I129	E94-K103 HydrophobicContact CG-CB 4.33Å; E94-K103 HydrophobicContact CG-CD 4.49Å; E94-K103 HydrophobicContact CG-CG 4.24Å; E94-K103 WeakPolarHBondContact OE1-CE 3.34Å; E94-K103 IonicContact OE1-NZ 3.03Å; E94-K103 PolarHBondContact OE1-NZ 3.28Å; E94-K103 WeakPolarHBondContact OE2-CD 3.46Å; E94-K103 WeakPolarHBondContact OE2-CE 3.5Å; E94-K103 IonicContact OE2-NZ 3.61Å; E94-K103 PolarHBondContact OE2-NZ 3.31Å; E94-N104 CarbonylContact C-O 3.55Å; E94-N104 WeakPolarHBondContact CA-O 3.32Å; E94-Y105 HydrophobicContact CB-CD1 4.45Å; E94-Y105 HydrophobicContact CB-CE1 4.18Å; E94-Y105 HydrophobicContact CG-CE1 4.35Å; E94-Y105 PolarHBondContact OE2-OH 3.41Å; E94-R124 HydrophobicContact CB-CB 4.4Å; E94-R124 PolarHBondContact N-O 2.94Å; E94-R124 PolarHBondContact O-N 2.84Å; E94-I129 HydrophobicContact CB-CD1 3.78Å; E94-I129 HydrophobicContact CB-CG1 4.29Å; E94-I129 HydrophobicContact CB-CG2 4.06Å
95	Q	89.8	Confident	89.8	Confident	60 Å²	60	54.1 Å²	54.1	28%	0.28	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.2	171.9	-173.6	176.6	69.9	0	0	109.4	N104 V106 I123	Q95-N104 PolarHBondContact N-O 2.88Å; Q95-N104 PolarHBondContact O-N 2.98Å; Q95-V106 HydrophobicContact CB-CG2 4.35Å; Q95-I123 HydrophobicContact CB-CG1 4.32Å; Q95-I123 HydrophobicContact CG-CG1 4.4Å
96	I	87.8	Confident	89.5	Confident	97 Å²	97	55.6 Å²	55.6	50%	0.497	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.6	170.6	-60.1	176.2	0	0	0	107.8
97	D	83.2	Confident	89.1	Confident	43 Å²	43	56.6 Å²	56.6	23%	0.23	29%	0.291	C	S	.	.			trans	-65.2	122.1	173	175.3	-16.6	0	0	0	109.2	S99 T100 H101 R102	D97-S99 PolarHBondContact O-N 3.21Å; D97-S99 WeakPolarHBondContact OD1-CA 3.42Å; D97-S99 VanDerWaalsContact OD1-CB 3.31Å; D97-S99 WeakPolarHBondContact OD1-CB 3.46Å; D97-S99 PolarHBondContact OD1-N 3.45Å; D97-T100 VanDerWaalsContact CB-OG1 3.27Å; D97-T100 WeakPolarHBondContact CB-OG1 3.42Å; D97-T100 PolarHBondContact OD1-N 2.94Å; D97-T100 WeakPolarHBondContact OD2-CG2 3.47Å; D97-T100 PolarHBondContact OD2-OG1 3.39Å; D97-H101 WeakPolarHBondContact O-CA 3.28Å; D97-H101 PolarHBondContact O-N 3.36Å; D97-R102 PolarHBondContact N-O 3.11Å
98	P	83.6	Confident	88.8	Confident	106 Å²	106	53.2 Å²	53.2	69%	0.688	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.6	-177.7	27.1	-34.9	0	0	0	113.5
99	S	83.3	Confident	88.3	Confident	106 Å²	106	52.8 Å²	52.8	74%	0.741	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-46.4	-177.7	-48.3	0	0	0	0	111.5	D97	D97-S99 PolarHBondContact O-N 3.21Å; D97-S99 WeakPolarHBondContact OD1-CA 3.42Å; D97-S99 VanDerWaalsContact OD1-CB 3.31Å; D97-S99 WeakPolarHBondContact OD1-CB 3.46Å; D97-S99 PolarHBondContact OD1-N 3.45Å
100	T	83.2	Confident	87.8	Confident	64 Å²	64	53 Å²	53	39%	0.393	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-15	-175.2	65.7	0	0	0	0	113.3	D97 R102	D97-T100 VanDerWaalsContact CB-OG1 3.27Å; D97-T100 WeakPolarHBondContact CB-OG1 3.42Å; D97-T100 PolarHBondContact OD1-N 2.94Å; D97-T100 WeakPolarHBondContact OD2-CG2 3.47Å; D97-T100 PolarHBondContact OD2-OG1 3.39Å; T100-R102 PolarHBondContact O-N 3.18Å; T100-R102 VanDerWaalsContact O-N 3.12Å; T100-R102 PolarHBondContact OG1-N 3.43Å
101	H	83.8	Confident	87.2	Confident	153 Å²	153	51 Å²	51	71%	0.708	27%	0.269	S	S	*	.			trans	53.5	21.1	-169.2	-63.7	-60.3	0	0	0	113.7	D97	D97-H101 WeakPolarHBondContact O-CA 3.28Å; D97-H101 PolarHBondContact O-N 3.36Å
102	R	84.6	Confident	86.5	Confident	21 Å²	21	55.6 Å²	55.6	8%	0.079	30%	0.295	C	S	.	.			trans	-91.9	157.3	175	-63.7	-179.7	79.5	158.8	7	110.3	D25 D97 T100 D172	D25-R102 IonicContact OD1-CZ 3.8Å; D25-R102 IonicContact OD1-NE 2.99Å; D25-R102 PolarHBondContact OD1-NE 3.24Å; D25-R102 IonicContact OD1-NH2 3.02Å; D25-R102 PolarHBondContact OD1-NH2 3.04Å; D25-R102 IonicContact OD2-NE 2.71Å; D97-R102 PolarHBondContact N-O 3.11Å; T100-R102 PolarHBondContact O-N 3.18Å; T100-R102 VanDerWaalsContact O-N 3.12Å; T100-R102 PolarHBondContact OG1-N 3.43Å; R102-D172 IonicContact CZ-OD2 2.81Å; R102-D172 IonicContact NH1-OD2 3.33Å; R102-D172 PolarHBondContact NH1-OD2 2.83Å; R102-D172 IonicContact NH2-OD2 2.64Å; R102-D172 PolarHBondContact NH2-OD2 2.77Å
103	K	87.7	Confident	85.2	Confident	52 Å²	52	58.4 Å²	58.4	23%	0.226	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.1	173	-68.2	171.8	169.4	-128.7	0	109.2	D25 E94 Y105	D25-K103 HydrophobicContact CB-CB 4.39Å; E94-K103 HydrophobicContact CG-CB 4.33Å; E94-K103 HydrophobicContact CG-CD 4.49Å; E94-K103 HydrophobicContact CG-CG 4.24Å; E94-K103 WeakPolarHBondContact OE1-CE 3.34Å; E94-K103 IonicContact OE1-NZ 3.03Å; E94-K103 PolarHBondContact OE1-NZ 3.28Å; E94-K103 WeakPolarHBondContact OE2-CD 3.46Å; E94-K103 WeakPolarHBondContact OE2-CE 3.5Å; E94-K103 IonicContact OE2-NZ 3.61Å; E94-K103 PolarHBondContact OE2-NZ 3.31Å; K103-Y105 HydrophobicContact CB-CE2 4.34Å
104	N	87.5	Confident	84	Confident	70 Å²	70	65.1 Å²	65.1	37%	0.374	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	150	171.5	-168.8	14.3	0	0	0	108.9	E94 Q95	E94-N104 CarbonylContact C-O 3.55Å; E94-N104 WeakPolarHBondContact CA-O 3.32Å; Q95-N104 PolarHBondContact N-O 2.88Å; Q95-N104 PolarHBondContact O-N 2.98Å
105	Y	91.5	Very high	82.5	Confident	22 Å²	22	69.3 Å²	69.3	9%	0.086	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	117.6	-177.8	-63.9	-92.5	0	0	0	108.5	L26 G93 E94 K103 I129 L133	L26-Y105 HydrophobicContact CD1-CE1 4.15Å; L26-Y105 HydrophobicContact CD1-CE2 4.25Å; L26-Y105 WeakPolarHBondContact CD1-OH 3.22Å; G93-Y105 WeakPolarHBondContact O-CA 3.31Å; E94-Y105 HydrophobicContact CB-CD1 4.45Å; E94-Y105 HydrophobicContact CB-CE1 4.18Å; E94-Y105 HydrophobicContact CG-CE1 4.35Å; E94-Y105 PolarHBondContact OE2-OH 3.41Å; K103-Y105 HydrophobicContact CB-CE2 4.34Å; Y105-I129 HydrophobicContact CE1-CG2 4.2Å; Y105-L133 HydrophobicContact CD1-CD1 3.77Å; Y105-L133 HydrophobicContact CD1-CD2 3.97Å; Y105-L133 HydrophobicContact CD1-CG 4.37Å; Y105-L133 HydrophobicContact CD2-CD1 4.36Å; Y105-L133 HydrophobicContact CE1-CD1 4.12Å; Y105-L133 HydrophobicContact CG-CD1 3.89Å; Y105-L133 HydrophobicContact CG-CD2 4.39Å
106	V	89.8	Confident	81	Confident	32 Å²	32	69.7 Å²	69.7	19%	0.194	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.9	-172.3	-63.5	0	0	0	0	110.2	Y92 G93 Q95 V108 I123	Y92-V106 CarbonylContact C-O 3.58Å; Y92-V106 VanDerWaalsContact CA-O 3.3Å; Y92-V106 WeakPolarHBondContact CA-O 3.39Å; G93-V106 PolarHBondContact N-O 3.46Å; G93-V106 PolarHBondContact O-N 2.97Å; Q95-V106 HydrophobicContact CB-CG2 4.35Å; V106-V108 PolarHBondContact O-N 3.24Å; V106-I123 HydrophobicContact CG2-CD1 3.91Å; V106-I123 HydrophobicContact CG2-CG1 4.25Å; V106-I123 HydrophobicContact CG2-CG2 4.29Å
107	R	90.2	Very high	79.3	Confident	26 Å²	26	74.7 Å²	74.7	10%	0.098	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	120.2	177.9	-156.6	-168.7	-154.6	-76.5	-3.6	109.8	E37 E91 Y92 V109 G110 L118	E37-R107 IonicContact OE1-CZ 3.78Å; E37-R107 IonicContact OE1-NE 2.99Å; E37-R107 PolarHBondContact OE1-NE 2.74Å; E37-R107 IonicContact OE1-NH2 3.05Å; E37-R107 IonicContact OE2-CZ 2.64Å; E37-R107 IonicContact OE2-NE 3.87Å; E37-R107 IonicContact OE2-NH2 2.69Å; E37-R107 PolarHBondContact OE2-NH2 3.05Å; E91-R107 IonicContact OE2-CZ 2.73Å; E91-R107 IonicContact OE2-NH1 3.98Å; E91-R107 PolarHBondContact OE2-NH1 3.05Å; E91-R107 IonicContact OE2-NH2 3.96Å; E91-R107 PolarHBondContact OE2-NH2 3.49Å; Y92-R107 HydrophobicContact CD1-CB 4.19Å; Y92-R107 HydrophobicContact CD2-CG 4.35Å; Y92-R107 HydrophobicContact CE1-CB 3.83Å; Y92-R107 HydrophobicContact CE1-CG 4.3Å; Y92-R107 HydrophobicContact CE2-CB 4.36Å; Y92-R107 HydrophobicContact CE2-CG 3.93Å; R107-V109 WeakPolarHBondContact CD-O 3.49Å; R107-V109 WeakPolarHBondContact CG-O 3.28Å; R107-V109 PolarHBondContact NH1-O 3.24Å; R107-G110 VanDerWaalsContact NH1-C 3.29Å; R107-G110 PolarHBondContact NH1-O 3.36Å; R107-L118 WeakPolarHBondContact O-CD1 3.38Å
108	V	88.6	Confident	78.1	Confident	12 Å²	12	76.3 Å²	76.3	7%	0.073	42%	0.42	C	S	.	.			trans	-100.7	-27.5	-175.7	-65.5	0	0	0	0	113.1	E91 V106 I123 I125	E91-V108 VanDerWaalsContact O-CG2 3.22Å; E91-V108 WeakPolarHBondContact O-CG2 3.39Å; E91-V108 PolarHBondContact O-N 2.9Å; V106-V108 PolarHBondContact O-N 3.24Å; V108-I123 HydrophobicContact CG1-CD1 4.39Å; V108-I123 HydrophobicContact CG1-CG2 3.63Å; V108-I125 HydrophobicContact CB-CD1 3.93Å; V108-I125 HydrophobicContact CG1-CD1 3.93Å; V108-I125 HydrophobicContact CG1-CG1 4.14Å; V108-I125 HydrophobicContact CG2-CD1 3.71Å; V108-I125 HydrophobicContact CG2-CG1 4.1Å
109	V	84.9	Confident	76.9	Confident	54 Å²	54	76.3 Å²	76.3	33%	0.327	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-91	142.1	170.1	-169.9	0	0	0	0	107.6	E91 R107	E91-V109 HydrophobicContact CB-CB 4.08Å; E91-V109 HydrophobicContact CB-CG2 4.17Å; E91-V109 HydrophobicContact CG-CB 4.25Å; E91-V109 HydrophobicContact CG-CG2 4.28Å; E91-V109 PolarHBondContact O-N 3.35Å; R107-V109 WeakPolarHBondContact CD-O 3.49Å; R107-V109 WeakPolarHBondContact CG-O 3.28Å; R107-V109 PolarHBondContact NH1-O 3.24Å
110	G	82.6	Confident	76.1	Confident	5 Å²	5	75.9 Å²	75.9	5%	0.052	40%	0.404	C	S	.	.			trans	-77.9	155.1	170.7	0	0	0	0	0	111.2	R107 N112 G113 E114	R107-G110 VanDerWaalsContact NH1-C 3.29Å; R107-G110 PolarHBondContact NH1-O 3.36Å; G110-N112 PolarHBondContact O-N 3.41Å; G110-N112 VanDerWaalsContact O-N 3.16Å; G110-G113 PolarHBondContact O-N 2.96Å; G110-E114 WeakPolarHBondContact CA-O 3.22Å; G110-E114 PolarHBondContact N-O 2.9Å
111	R	82.3	Confident	75.3	Confident	94 Å²	94	80 Å²	80	36%	0.355	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.7	-175.4	-65.1	-172.4	176.1	120.1	-12.4	114.1	D36 E37 W40	D36-R111 PolarHBondContact O-NH2 3.34Å; E37-R111 IonicContact OE1-NE 2.68Å; W40-R111 HydrophobicContact CD2-CG 4.35Å; W40-R111 VanDerWaalsContact CE3-CD 3.4Å; W40-R111 HydrophobicContact CH2-CB 4.26Å; W40-R111 HydrophobicContact CZ2-CB 3.61Å; W40-R111 HydrophobicContact CZ2-CG 4.2Å
112	N	76.1	Confident	74.9	Confident	135 Å²	135	75.8 Å²	75.8	72%	0.722	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	9	174.1	-62	-16.6	0	0	0	113	G110 E114	G110-N112 PolarHBondContact O-N 3.41Å; G110-N112 VanDerWaalsContact O-N 3.16Å; N112-E114 PolarHBondContact O-N 3.42Å
113	G	66.3	Low	74.9	Confident	62 Å²	62	75.8 Å²	75.8	64%	0.639	42%	0.418	S	S	*	.	S	Bend	trans	78.9	-0.9	-174.6	0	0	0	0	0	114.7	G110	G110-G113 PolarHBondContact O-N 2.96Å
114	E	65	Low	74.9	Confident	141 Å²	141	80.1 Å²	80.1	66%	0.659	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-72.1	134	168.9	-67.2	-177	134.7	0	0	109.5	G110 N112 N116	G110-E114 WeakPolarHBondContact CA-O 3.22Å; G110-E114 PolarHBondContact N-O 2.9Å; N112-E114 PolarHBondContact O-N 3.42Å; E114-N116 PolarHBondContact O-N 3.35Å
115	S	60.4	Low	74.9	Confident	100 Å²	100	81.3 Å²	81.3	70%	0.699	44%	0.438	S	S	*	.	B	Isolated β-bridge	trans	-63.5	118.4	167.5	50.6	0	0	0	0	107.8	E117	S115-E117 PolarHBondContact O-N 3.29Å
116	N	57.9	Low	74.7	Confident	68 Å²	68	82.6 Å²	82.6	36%	0.364	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-59.4	128.4	169.3	-67.4	-38.7	0	0	0	106.3	E114 L118	E114-N116 PolarHBondContact O-N 3.35Å; N116-L118 HydrophobicContact CB-CD1 3.94Å; N116-L118 HydrophobicContact CB-CG 3.83Å; N116-L118 PolarHBondContact O-N 3.48Å
117	E	53.8	Low	74.6	Confident	202 Å²	202	85.6 Å²	85.6	94%	0.944	47%	0.468	S	S	*	.			trans	-67	43.1	167.1	-77	-161.9	119.7	0	0	110.7	S115 D119	S115-E117 PolarHBondContact O-N 3.29Å; E117-D119 PolarHBondContact O-N 3.04Å
118	L	56.3	Low	74.7	Confident	77 Å²	77	90.1 Å²	90.1	40%	0.403	50%	0.495	S	S	.	.			trans	-61.9	130.7	161	-68.7	167.2	0	0	0	105.6	R107 N116 L120 I123	R107-L118 WeakPolarHBondContact O-CD1 3.38Å; N116-L118 HydrophobicContact CB-CD1 3.94Å; N116-L118 HydrophobicContact CB-CG 3.83Å; N116-L118 PolarHBondContact O-N 3.48Å; L118-L120 PolarHBondContact O-N 2.88Å; L118-I123 HydrophobicContact CB-CD1 4.45Å
119	D	59.2	Low	74.8	Confident	106 Å²	106	90.2 Å²	90.2	57%	0.567	49%	0.494	S	S	*	.			trans	-57.4	94.8	168.4	-171.2	21.1	0	0	0	106.9	E117 Q121	E117-D119 PolarHBondContact O-N 3.04Å; D119-Q121 PolarHBondContact O-N 2.94Å; D119-Q121 VanDerWaalsContact OD1-CD 3.31Å; D119-Q121 VanDerWaalsContact OD1-CG 3.22Å; D119-Q121 WeakPolarHBondContact OD1-CG 3.42Å; D119-Q121 PolarHBondContact OD1-NE2 3.48Å; D119-Q121 PolarHBondContact OD2-NE2 2.95Å
120	L	66	Low	75.1	Confident	98 Å²	98	88.6 Å²	88.6	51%	0.513	49%	0.486	S	S	.	.			trans	-61.8	-3.2	-176.8	-67.4	174.2	0	0	0	111.7	L118 G122 I123	L118-L120 PolarHBondContact O-N 2.88Å; L120-G122 PolarHBondContact O-N 3.43Å; L120-G122 VanDerWaalsContact O-N 3.11Å; L120-I123 HydrophobicContact CD2-CD1 4.49Å; L120-I123 PolarHBondContact O-N 3.03Å; L120-I123 VanDerWaalsContact O-N 3.13Å
121	Q	67.3	Low	75.8	Confident	150 Å²	150	90.3 Å²	90.3	70%	0.701	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	114.5	170.6	-71.3	-178	65.4	0	0	110.7	D119	D119-Q121 PolarHBondContact O-N 2.94Å; D119-Q121 VanDerWaalsContact OD1-CD 3.31Å; D119-Q121 VanDerWaalsContact OD1-CG 3.22Å; D119-Q121 WeakPolarHBondContact OD1-CG 3.42Å; D119-Q121 PolarHBondContact OD1-NE2 3.48Å; D119-Q121 PolarHBondContact OD2-NE2 2.95Å
122	G	75.6	Confident	76.4	Confident	64 Å²	64	89.2 Å²	89.2	66%	0.66	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	2.2	177.1	0	0	0	0	0	115.1	L120	L120-G122 PolarHBondContact O-N 3.43Å; L120-G122 VanDerWaalsContact O-N 3.11Å
123	I	84.3	Confident	77.3	Confident	22 Å²	22	82.8 Å²	82.8	11%	0.113	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	125.1	170.3	-56.6	171.9	0	0	0	109.3	Q95 V106 V108 L118 L120 I125	Q95-I123 HydrophobicContact CB-CG1 4.32Å; Q95-I123 HydrophobicContact CG-CG1 4.4Å; V106-I123 HydrophobicContact CG2-CD1 3.91Å; V106-I123 HydrophobicContact CG2-CG1 4.25Å; V106-I123 HydrophobicContact CG2-CG2 4.29Å; V108-I123 HydrophobicContact CG1-CD1 4.39Å; V108-I123 HydrophobicContact CG1-CG2 3.63Å; L118-I123 HydrophobicContact CB-CD1 4.45Å; L120-I123 HydrophobicContact CD2-CD1 4.49Å; L120-I123 PolarHBondContact O-N 3.03Å; L120-I123 VanDerWaalsContact O-N 3.13Å; I123-I125 HydrophobicContact CG2-CG1 4.15Å
124	R	87.4	Confident	78.8	Confident	143 Å²	143	83 Å²	83	54%	0.54	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.9	175.7	-66.2	-178.8	55.4	154	-1.2	109.9	G93 E94 D126 I129	G93-R124 CarbonylContact C-O 3.56Å; G93-R124 WeakPolarHBondContact CA-O 3.4Å; E94-R124 HydrophobicContact CB-CB 4.4Å; E94-R124 PolarHBondContact N-O 2.94Å; E94-R124 PolarHBondContact O-N 2.84Å; R124-D126 IonicContact NH2-OD2 2.82Å; R124-D126 PolarHBondContact NH2-OD2 2.81Å; R124-I129 HydrophobicContact CB-CD1 3.68Å; R124-I129 WeakPolarHBondContact O-CD1 3.42Å
125	I	86.4	Confident	80.3	Confident	94 Å²	94	82.7 Å²	82.7	48%	0.482	45%	0.453	S	S	.	.			trans	-122.4	107.1	174.6	-52.5	162.4	0	0	0	106	V108 I123	V108-I125 HydrophobicContact CB-CD1 3.93Å; V108-I125 HydrophobicContact CG1-CD1 3.93Å; V108-I125 HydrophobicContact CG1-CG1 4.14Å; V108-I125 HydrophobicContact CG2-CD1 3.71Å; V108-I125 HydrophobicContact CG2-CG1 4.1Å; I123-I125 HydrophobicContact CG2-CG1 4.15Å
126	D	87.4	Confident	82.1	Confident	49 Å²	49	78 Å²	78	26%	0.262	42%	0.42	S	S	.	.			trans	-139.1	158.4	174	67.3	49	0	0	0	109.8	R124 D128 I129 S130	R124-D126 IonicContact NH2-OD2 2.82Å; R124-D126 PolarHBondContact NH2-OD2 2.81Å; D126-D128 PolarHBondContact O-N 3.36Å; D126-D128 WeakPolarHBondContact OD1-CB 3.49Å; D126-D128 PolarHBondContact OD1-N 3.25Å; D126-I129 HydrophobicContact CB-CD1 4.47Å; D126-I129 VanDerWaalsContact CG-CD1 3.43Å; D126-I129 PolarHBondContact O-N 2.75Å; D126-I129 WeakPolarHBondContact OD1-CB 3.36Å; D126-I129 WeakPolarHBondContact OD1-CG1 3.22Å; D126-I129 PolarHBondContact OD1-N 3.28Å; D126-I129 WeakPolarHBondContact OD2-CD1 3.48Å; D126-S130 PolarHBondContact O-N 2.69Å; D126-S130 VanDerWaalsContact O-N 3.11Å; D126-S130 PolarHBondContact O-OG 3.05Å
127	S	89.2	Confident	84	Confident	95 Å²	95	74.7 Å²	74.7	66%	0.664	40%	0.403	S	S	*	.	H	α-helix	trans	-62.5	-28.7	-176.4	53.2	0	0	0	0	112.9	G131	S127-G131 PolarHBondContact O-N 3.42Å
128	D	91.7	Very high	86.1	Confident	121 Å²	121	68.5 Å²	68.5	65%	0.647	37%	0.373	S	S	*	.	H	α-helix	trans	-73.1	-40.4	-179	-62.6	-11	0	0	0	110.1	D126 T132	D126-D128 PolarHBondContact O-N 3.36Å; D126-D128 WeakPolarHBondContact OD1-CB 3.49Å; D126-D128 PolarHBondContact OD1-N 3.25Å; D128-T132 WeakPolarHBondContact O-CB 3.35Å; D128-T132 PolarHBondContact O-N 3.32Å; D128-T132 PolarHBondContact O-OG1 2.86Å
129	I	90.8	Very high	88	Confident	14 Å²	14	66.2 Å²	66.2	7%	0.072	36%	0.364	C	S	.	.	H	α-helix	trans	-60	-52.7	171.9	-70.7	163.3	0	0	0	109.6	E94 Y105 R124 D126 G131 T132 L133	E94-I129 HydrophobicContact CB-CD1 3.78Å; E94-I129 HydrophobicContact CB-CG1 4.29Å; E94-I129 HydrophobicContact CB-CG2 4.06Å; Y105-I129 HydrophobicContact CE1-CG2 4.2Å; R124-I129 HydrophobicContact CB-CD1 3.68Å; R124-I129 WeakPolarHBondContact O-CD1 3.42Å; D126-I129 HydrophobicContact CB-CD1 4.47Å; D126-I129 VanDerWaalsContact CG-CD1 3.43Å; D126-I129 PolarHBondContact O-N 2.75Å; D126-I129 WeakPolarHBondContact OD1-CB 3.36Å; D126-I129 WeakPolarHBondContact OD1-CG1 3.22Å; D126-I129 PolarHBondContact OD1-N 3.28Å; D126-I129 WeakPolarHBondContact OD2-CD1 3.48Å; I129-G131 VanDerWaalsContact C-N 3.34Å; I129-G131 PolarHBondContact O-N 3.12Å; I129-T132 PolarHBondContact O-N 2.77Å; I129-L133 WeakPolarHBondContact O-CB 3.45Å; I129-L133 PolarHBondContact O-N 2.64Å
130	S	92	Very high	89.8	Confident	20 Å²	20	61.4 Å²	61.4	14%	0.14	34%	0.338	C	S	.	.	H	α-helix	trans	-59.8	-44	179.9	-62.5	0	0	0	0	112.1	D126 K134	D126-S130 PolarHBondContact O-N 2.69Å; D126-S130 VanDerWaalsContact O-N 3.11Å; D126-S130 PolarHBondContact O-OG 3.05Å; S130-K134 VanDerWaalsContact O-CB 3.27Å; S130-K134 WeakPolarHBondContact O-CB 3.47Å; S130-K134 PolarHBondContact O-N 2.05Å
131	G	95.3	Very high	91.3	Very high	41 Å²	41	57.5 Å²	57.5	42%	0.423	32%	0.319	S	S	.	.	H	α-helix	trans	-66	-41.6	177.8	0	0	0	0	0	112.9	S127 I129 K134 F135	S127-G131 PolarHBondContact O-N 3.42Å; I129-G131 VanDerWaalsContact C-N 3.34Å; I129-G131 PolarHBondContact O-N 3.12Å; G131-K134 PolarHBondContact O-N 3.26Å; G131-F135 WeakPolarHBondContact O-CB 3.23Å; G131-F135 PolarHBondContact O-N 3.16Å
132	T	95.3	Very high	92.7	Very high	71 Å²	71	58 Å²	58	44%	0.436	32%	0.321	S	S	.	.	H	α-helix	trans	-67.6	-39.6	178.7	-58.6	0	0	0	0	111.6	L26 D128 I129 A136	L26-T132 HydrophobicContact CD1-CG2 3.88Å; L26-T132 HydrophobicContact CD2-CG2 3.37Å; L26-T132 HydrophobicContact CG-CG2 4.27Å; D128-T132 WeakPolarHBondContact O-CB 3.35Å; D128-T132 PolarHBondContact O-N 3.32Å; D128-T132 PolarHBondContact O-OG1 2.86Å; I129-T132 PolarHBondContact O-N 2.77Å; T132-A136 WeakPolarHBondContact O-CB 3.43Å; T132-A136 PolarHBondContact O-N 3.13Å
133	L	95.8	Very high	93.7	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-69.4	-41.6	176.7	-170.5	68.8	0	0	0	111.5	L26 A30 M89 Y92 Y105 I129 A136 C137	L26-L133 HydrophobicContact CD1-CD1 4.03Å; A30-L133 HydrophobicContact CB-CD1 3.86Å; M89-L133 HydrophobicContact CB-CB 4.24Å; M89-L133 HydrophobicContact CB-CD2 4.04Å; M89-L133 HydrophobicContact CB-CG 4.03Å; M89-L133 HydrophobicContact CG-CD2 4.39Å; M89-L133 HydrophobicContact CG-CG 4.13Å; M89-L133 HydrophobicContact SD-CD2 3.86Å; M89-L133 HydrophobicContact SD-CG 3.88Å; Y92-L133 HydrophobicContact CG-CD2 4.15Å; Y105-L133 HydrophobicContact CD1-CD1 3.77Å; Y105-L133 HydrophobicContact CD1-CD2 3.97Å; Y105-L133 HydrophobicContact CD1-CG 4.37Å; Y105-L133 HydrophobicContact CD2-CD1 4.36Å; Y105-L133 HydrophobicContact CE1-CD1 4.12Å; Y105-L133 HydrophobicContact CG-CD1 3.89Å; Y105-L133 HydrophobicContact CG-CD2 4.39Å; I129-L133 WeakPolarHBondContact O-CB 3.45Å; I129-L133 PolarHBondContact O-N 2.64Å; L133-A136 PolarHBondContact O-N 3.13Å; L133-C137 WeakPolarHBondContact O-CB 3.44Å; L133-C137 PolarHBondContact O-N 3.46Å
134	K	97.2	Very high	94.2	Very high	66 Å²	66	62 Å²	62	29%	0.287	32%	0.32	S	S	.	.	H	α-helix	trans	-57.1	-51	172.5	175.2	170.5	170.7	173	0	111.2	D87 M89 S130 G131 A136 C137 E138	D87-K134 WeakPolarHBondContact OD1-CE 3.32Å; D87-K134 IonicContact OD1-NZ 2.8Å; D87-K134 PolarHBondContact OD1-NZ 2.91Å; M89-K134 HydrophobicContact CB-CB 4.07Å; S130-K134 VanDerWaalsContact O-CB 3.27Å; S130-K134 WeakPolarHBondContact O-CB 3.47Å; S130-K134 PolarHBondContact O-N 2.05Å; G131-K134 PolarHBondContact O-N 3.26Å; K134-A136 VanDerWaalsContact C-N 3.31Å; K134-A136 PolarHBondContact O-N 3.41Å; K134-C137 WeakPolarHBondContact O-CB 3.43Å; K134-C137 PolarHBondContact O-N 3.35Å; K134-C137 VanDerWaalsContact O-N 3.1Å; K134-E138 WeakPolarHBondContact CE-OE1 3.45Å; K134-E138 HydrophobicContact CG-CG 4.42Å; K134-E138 IonicContact NZ-OE1 3.96Å; K134-E138 WeakPolarHBondContact O-CG 3.35Å; K134-E138 PolarHBondContact O-N 3.08Å
135	F	96.9	Very high	94.6	Very high	135 Å²	135	58.9 Å²	58.9	59%	0.592	31%	0.312	S	S	*	.	H	α-helix	trans	-60.2	-40.8	179.1	179	-97.2	0	0	0	112.6	G131 C137 E138 S139	G131-F135 WeakPolarHBondContact O-CB 3.23Å; G131-F135 PolarHBondContact O-N 3.16Å; F135-C137 VanDerWaalsContact C-N 3.35Å; F135-E138 PolarHBondContact O-N 3.36Å; F135-S139 WeakPolarHBondContact O-CB 3.38Å; F135-S139 PolarHBondContact O-N 2.91Å; F135-S139 PolarHBondContact O-OG 3.1Å
136	A	97.2	Very high	95	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.008	32%	0.321	C	S	.	.	H	α-helix	trans	-64.9	-39.1	175.3	0	0	0	0	0	112	L26 A30 T132 L133 K134 S139 I140	L26-A136 HydrophobicContact CD1-CB 4.34Å; L26-A136 HydrophobicContact CD2-CB 4.07Å; L26-A136 HydrophobicContact CG-CB 3.87Å; A30-A136 HydrophobicContact CB-CB 3.78Å; T132-A136 WeakPolarHBondContact O-CB 3.43Å; T132-A136 PolarHBondContact O-N 3.13Å; L133-A136 PolarHBondContact O-N 3.13Å; K134-A136 VanDerWaalsContact C-N 3.31Å; K134-A136 PolarHBondContact O-N 3.41Å; A136-S139 PolarHBondContact O-N 3.45Å; A136-I140 WeakPolarHBondContact O-CD1 3.41Å; A136-I140 VanDerWaalsContact O-CG1 3.22Å; A136-I140 WeakPolarHBondContact O-CG1 3.45Å; A136-I140 PolarHBondContact O-N 3.34Å
137	C	98.3	Very high	95.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-50.6	173.5	179	0	0	0	0	111.3	C86 M89 L133 K134 F135 S139 I140 V141	C86-C137 WeakPolarHBondContact CA-SG 3.27Å; C86-C137 HydrophobicContact CB-CB 3.74Å; C86-C137 WeakPolarHBondContact CB-SG 3.18Å; C86-C137 WeakPolarHBondContact SG-CB 3.31Å; C86-C137 CovalentContact SG-SG 2.05Å; C86-C137 PolarHBondContact SG-SG 3Å; M89-C137 HydrophobicContact CE-CB 4.44Å; M89-C137 HydrophobicContact CG-CB 3.85Å; M89-C137 HydrophobicContact SD-CB 4.33Å; L133-C137 WeakPolarHBondContact O-CB 3.44Å; L133-C137 PolarHBondContact O-N 3.46Å; K134-C137 WeakPolarHBondContact O-CB 3.43Å; K134-C137 PolarHBondContact O-N 3.35Å; K134-C137 VanDerWaalsContact O-N 3.1Å; F135-C137 VanDerWaalsContact C-N 3.35Å; C137-S139 VanDerWaalsContact C-N 3.28Å; C137-S139 PolarHBondContact O-N 3.14Å; C137-I140 WeakPolarHBondContact O-CB 3.46Å; C137-I140 PolarHBondContact O-N 3.03Å; C137-V141 WeakPolarHBondContact O-CG2 3.37Å; C137-V141 PolarHBondContact O-N 3.4Å
138	E	98.1	Very high	95.5	Very high	71 Å²	71	56.1 Å²	56.1	33%	0.332	29%	0.289	S	S	.	.	H	α-helix	trans	-57	-44.4	178.4	-70.3	170.6	156.3	0	0	110.7	C86 K134 F135 I140 V141 E142	C86-E138 HydrophobicContact CB-CG 3.88Å; C86-E138 PolarHBondContact SG-N 2.9Å; C86-E138 VanDerWaalsContact SG-N 3.4Å; K134-E138 WeakPolarHBondContact CE-OE1 3.45Å; K134-E138 HydrophobicContact CG-CG 4.42Å; K134-E138 IonicContact NZ-OE1 3.96Å; K134-E138 WeakPolarHBondContact O-CG 3.35Å; K134-E138 PolarHBondContact O-N 3.08Å; F135-E138 PolarHBondContact O-N 3.36Å; E138-I140 VanDerWaalsContact C-N 3.32Å; E138-I140 PolarHBondContact O-N 3.36Å; E138-V141 PolarHBondContact O-N 3.43Å; E138-E142 WeakPolarHBondContact O-CB 3.09Å; E138-E142 VanDerWaalsContact O-CG 3.32Å; E138-E142 WeakPolarHBondContact O-CG 3.27Å; E138-E142 PolarHBondContact O-N 2.94Å
139	S	97.2	Very high	95.7	Very high	30 Å²	30	51.4 Å²	51.4	21%	0.21	26%	0.264	C	S	.	.	H	α-helix	trans	-60.5	-39.4	176.5	-56.3	0	0	0	0	112.5	F135 A136 C137 E143	F135-S139 WeakPolarHBondContact O-CB 3.38Å; F135-S139 PolarHBondContact O-N 2.91Å; F135-S139 PolarHBondContact O-OG 3.1Å; A136-S139 PolarHBondContact O-N 3.45Å; C137-S139 VanDerWaalsContact C-N 3.28Å; C137-S139 PolarHBondContact O-N 3.14Å; S139-E143 WeakPolarHBondContact O-CB 3.43Å; S139-E143 PolarHBondContact O-N 3.04Å
140	I	96.6	Very high	95.7	Very high	4 Å²	4	56 Å²	56	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-68.5	-43.3	177.3	-69.9	161.4	0	0	0	110.9	H27 A30 C31 L34 A136 C137 E138 E143 Y144 L170	H27-I140 HydrophobicContact CB-CD1 4.46Å; H27-I140 WeakPolarHBondContact O-CD1 3.45Å; A30-I140 HydrophobicContact CB-CD1 3.68Å; C31-I140 HydrophobicContact CB-CD1 4.05Å; L34-I140 HydrophobicContact CD2-CG2 3.89Å; A136-I140 WeakPolarHBondContact O-CD1 3.41Å; A136-I140 VanDerWaalsContact O-CG1 3.22Å; A136-I140 WeakPolarHBondContact O-CG1 3.45Å; A136-I140 PolarHBondContact O-N 3.34Å; C137-I140 WeakPolarHBondContact O-CB 3.46Å; C137-I140 PolarHBondContact O-N 3.03Å; E138-I140 VanDerWaalsContact C-N 3.32Å; E138-I140 PolarHBondContact O-N 3.36Å; I140-E143 PolarHBondContact O-N 2.89Å; I140-Y144 HydrophobicContact CG2-CD2 4.17Å; I140-Y144 WeakPolarHBondContact O-CB 3.26Å; I140-Y144 WeakPolarHBondContact O-CD2 3.45Å; I140-Y144 PolarHBondContact O-N 3.4Å; I140-L170 HydrophobicContact CD1-CD1 3.89Å; I140-L170 HydrophobicContact CG1-CD1 3.84Å; I140-L170 HydrophobicContact CG2-CD1 4.16Å
141	V	97.4	Very high	95.7	Very high	17 Å²	17	57.3 Å²	57.3	10%	0.103	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-46.6	177.6	171.6	0	0	0	0	110.2	L34 L82 C137 E138 E143 E145 L148	L34-V141 HydrophobicContact CD1-CG2 4.08Å; L34-V141 HydrophobicContact CD2-CG2 3.86Å; L82-V141 HydrophobicContact CB-CG1 3.88Å; L82-V141 HydrophobicContact CD2-CG1 4.47Å; L82-V141 HydrophobicContact CD2-CG2 4.14Å; C137-V141 WeakPolarHBondContact O-CG2 3.37Å; C137-V141 PolarHBondContact O-N 3.4Å; E138-V141 PolarHBondContact O-N 3.43Å; V141-E143 VanDerWaalsContact C-N 3.34Å; V141-E143 PolarHBondContact O-N 2.86Å; V141-E145 WeakPolarHBondContact O-CA 3.45Å; V141-E145 WeakPolarHBondContact O-CB 3.41Å; V141-E145 PolarHBondContact O-N 2.88Å; V141-L148 HydrophobicContact CG2-CD1 4.49Å
142	E	96.7	Very high	95.7	Very high	160 Å²	160	55.8 Å²	55.8	75%	0.748	27%	0.27	S	S	*	.	H	α-helix	trans	-61.5	-38.9	178	-73.4	177.5	-173.6	0	0	112.9	E138	E138-E142 WeakPolarHBondContact O-CB 3.09Å; E138-E142 VanDerWaalsContact O-CG 3.32Å; E138-E142 WeakPolarHBondContact O-CG 3.27Å; E138-E142 PolarHBondContact O-N 2.94Å
143	E	96	Very high	95.5	Very high	128 Å²	128	54.9 Å²	54.9	60%	0.598	27%	0.267	S	S	*	.	H	α-helix	trans	-82.4	-34	-176.6	-172.2	176.9	165.5	0	0	113.3	S139 I140 V141	S139-E143 WeakPolarHBondContact O-CB 3.43Å; S139-E143 PolarHBondContact O-N 3.04Å; I140-E143 PolarHBondContact O-N 2.89Å; V141-E143 VanDerWaalsContact C-N 3.34Å; V141-E143 PolarHBondContact O-N 2.86Å
144	Y	95.9	Very high	95.2	Very high	41 Å²	41	64 Å²	64	16%	0.161	30%	0.301	C	S	.	.	H	α-helix	trans	-122.4	23.2	-168.6	-59.6	-76	0	0	0	113.7	I140 D146 E147 L148 T168 L170	I140-Y144 HydrophobicContact CG2-CD2 4.17Å; I140-Y144 WeakPolarHBondContact O-CB 3.26Å; I140-Y144 WeakPolarHBondContact O-CD2 3.45Å; I140-Y144 PolarHBondContact O-N 3.4Å; Y144-D146 VanDerWaalsContact C-N 3.34Å; Y144-D146 PolarHBondContact O-N 2.81Å; Y144-E147 PolarHBondContact O-N 3.48Å; Y144-L148 WeakPolarHBondContact O-CB 3.44Å; Y144-L148 WeakPolarHBondContact O-CD1 3.34Å; Y144-L148 VanDerWaalsContact O-CG 3.25Å; Y144-L148 WeakPolarHBondContact O-CG 3.45Å; Y144-L148 PolarHBondContact O-N 3.16Å; Y144-T168 HydrophobicContact CD1-CG2 3.59Å; Y144-T168 HydrophobicContact CD2-CG2 4.25Å; Y144-T168 HydrophobicContact CE1-CG2 3.87Å; Y144-T168 HydrophobicContact CG-CG2 3.8Å; Y144-L170 HydrophobicContact CE2-CD1 4.45Å; Y144-L170 HydrophobicContact CE2-CD2 4.38Å
145	E	95.7	Very high	94.5	Very high	79 Å²	79	68.2 Å²	68.2	37%	0.369	32%	0.322	S	S	.	.	H	α-helix	trans	-52.4	-50	-179.6	-172.6	-179	165.1	0	0	111.9	L82 V141 E147 L148 I149	L82-E145 HydrophobicContact CD1-CG 4.05Å; V141-E145 WeakPolarHBondContact O-CA 3.45Å; V141-E145 WeakPolarHBondContact O-CB 3.41Å; V141-E145 PolarHBondContact O-N 2.88Å; E145-E147 PolarHBondContact O-N 3.12Å; E145-L148 WeakPolarHBondContact O-CB 3.48Å; E145-L148 PolarHBondContact O-N 2.94Å; E145-I149 HydrophobicContact CG-CD1 3.83Å; E145-I149 HydrophobicContact CG-CG1 4.48Å; E145-I149 WeakPolarHBondContact O-CG1 3.46Å; E145-I149 PolarHBondContact O-N 3.35Å
146	D	94.1	Very high	93.9	Very high	126 Å²	126	63.5 Å²	63.5	67%	0.674	31%	0.308	S	S	*	.	H	α-helix	trans	-61.2	-45.8	-178.9	-72.9	-24.6	0	0	0	111.3	Y144 I149 E150	Y144-D146 VanDerWaalsContact C-N 3.34Å; Y144-D146 PolarHBondContact O-N 2.81Å; D146-I149 PolarHBondContact O-N 2.82Å; D146-E150 VanDerWaalsContact O-CB 3.3Å; D146-E150 WeakPolarHBondContact O-CB 3.39Å; D146-E150 PolarHBondContact O-N 2.83Å
147	E	92.6	Very high	93.3	Very high	51 Å²	51	69.4 Å²	69.4	24%	0.238	34%	0.339	C	S	.	.	H	α-helix	trans	-63.9	-40.3	176.4	-73.4	79	-173.7	0	0	112.4	Y144 E145 F151 R167	Y144-E147 PolarHBondContact O-N 3.48Å; E145-E147 PolarHBondContact O-N 3.12Å; E147-F151 WeakPolarHBondContact O-CB 3.16Å; E147-F151 PolarHBondContact O-N 2.93Å; E147-R167 HydrophobicContact CB-CG 4.2Å; E147-R167 HydrophobicContact CG-CG 3.99Å; E147-R167 VanDerWaalsContact CG-NE 3.3Å
148	L	94.9	Very high	92.6	Very high	3 Å²	3	73.6 Å²	73.6	2%	0.016	36%	0.361	C	S	.	.	H	α-helix	trans	-61	-52.8	176.5	-77.9	158.2	0	0	0	110	L34 L38 L82 V141 Y144 E145 E150 F151 F152 L163	L34-L148 HydrophobicContact CD2-CD1 4.05Å; L34-L148 HydrophobicContact CD2-CD2 4.01Å; L38-L148 HydrophobicContact CD1-CD2 4.12Å; L82-L148 HydrophobicContact CD1-CB 4.14Å; L82-L148 HydrophobicContact CD1-CD1 4.48Å; L82-L148 HydrophobicContact CD2-CB 4.32Å; L82-L148 HydrophobicContact CD2-CD1 3.9Å; L82-L148 HydrophobicContact CD2-CD2 4.45Å; L82-L148 HydrophobicContact CD2-CG 4.47Å; V141-L148 HydrophobicContact CG2-CD1 4.49Å; Y144-L148 WeakPolarHBondContact O-CB 3.44Å; Y144-L148 WeakPolarHBondContact O-CD1 3.34Å; Y144-L148 VanDerWaalsContact O-CG 3.25Å; Y144-L148 WeakPolarHBondContact O-CG 3.45Å; Y144-L148 PolarHBondContact O-N 3.16Å; E145-L148 WeakPolarHBondContact O-CB 3.48Å; E145-L148 PolarHBondContact O-N 2.94Å; L148-E150 VanDerWaalsContact C-N 3.35Å; L148-E150 PolarHBondContact O-N 2.65Å; L148-F151 PolarHBondContact O-N 3.39Å; L148-F152 HydrophobicContact CD2-CD2 4.47Å; L148-F152 HydrophobicContact CD2-CE2 4.12Å; L148-F152 WeakPolarHBondContact O-CB 3.35Å; L148-F152 VanDerWaalsContact O-CD2 3.29Å; L148-F152 WeakPolarHBondContact O-CD2 3.49Å; L148-F152 PolarHBondContact O-N 2.97Å; L148-L163 HydrophobicContact CD2-CD2 3.52Å; L148-L163 HydrophobicContact CG-CD2 4.43Å
149	I	95.1	Very high	92.2	Very high	22 Å²	22	70.4 Å²	70.4	11%	0.113	35%	0.347	C	S	.	.	H	α-helix	trans	-60	-46.1	178.8	-68.2	171.6	0	0	0	110.4	E75 L78 T79 L82 E145 D146 F151 F152 S153	E75-I149 HydrophobicContact CB-CG2 4.28Å; E75-I149 HydrophobicContact CG-CD1 4.44Å; E75-I149 HydrophobicContact CG-CG2 3.97Å; L78-I149 HydrophobicContact CB-CG1 4.4Å; T79-I149 WeakPolarHBondContact OG1-CD1 3.28Å; L82-I149 HydrophobicContact CD1-CG1 4.08Å; E145-I149 HydrophobicContact CG-CD1 3.83Å; E145-I149 HydrophobicContact CG-CG1 4.48Å; E145-I149 WeakPolarHBondContact O-CG1 3.46Å; E145-I149 PolarHBondContact O-N 3.35Å; D146-I149 PolarHBondContact O-N 2.82Å; I149-F151 VanDerWaalsContact C-N 3.35Å; I149-F151 PolarHBondContact O-N 2.82Å; I149-F152 PolarHBondContact O-N 2.65Å; I149-S153 VanDerWaalsContact O-CB 3.25Å; I149-S153 WeakPolarHBondContact O-CB 3.1Å; I149-S153 PolarHBondContact O-N 3.19Å
150	E	92.5	Very high	91.8	Very high	110 Å²	110	71.1 Å²	71.1	51%	0.514	35%	0.346	S	S	.	.	H	α-helix	trans	-57.4	-48.6	177.9	-174.8	-173.8	-176.9	0	0	111	D146 L148 S153 R167	D146-E150 VanDerWaalsContact O-CB 3.3Å; D146-E150 WeakPolarHBondContact O-CB 3.39Å; D146-E150 PolarHBondContact O-N 2.83Å; L148-E150 VanDerWaalsContact C-N 3.35Å; L148-E150 PolarHBondContact O-N 2.65Å; E150-S153 PolarHBondContact O-OG 2.79Å; E150-R167 IonicContact OE2-NH2 3.82Å; E150-R167 PolarHBondContact OE2-NH2 2.8Å; E150-R167 VanDerWaalsContact OE2-NH2 3.16Å
151	F	91.5	Very high	91.4	Very high	48 Å²	48	73.2 Å²	73.2	21%	0.211	36%	0.358	C	S	.	.	H	α-helix	trans	-66.1	-42.1	-177	-127.6	-91.7	0	0	0	112.6	E147 L148 I149 V159 K162 L163	E147-F151 WeakPolarHBondContact O-CB 3.16Å; E147-F151 PolarHBondContact O-N 2.93Å; L148-F151 PolarHBondContact O-N 3.39Å; I149-F151 VanDerWaalsContact C-N 3.35Å; I149-F151 PolarHBondContact O-N 2.82Å; F151-V159 HydrophobicContact CD1-CG1 3.85Å; F151-V159 HydrophobicContact CE1-CG1 4.37Å; F151-K162 HydrophobicContact CE1-CB 3.78Å; F151-K162 HydrophobicContact CE1-CD 4.17Å; F151-K162 HydrophobicContact CZ-CB 3.48Å; F151-K162 VanDerWaalsContact CZ-CB 3.48Å; F151-K162 HydrophobicContact CZ-CD 4.08Å; F151-K162 HydrophobicContact CZ-CG 4.43Å; F151-L163 HydrophobicContact CB-CD1 4.14Å; F151-L163 HydrophobicContact CD2-CD1 4.01Å; F151-L163 HydrophobicContact CG-CD1 4.04Å
152	F	94.1	Very high	91	Very high	8 Å²	8	76 Å²	76	4%	0.035	37%	0.369	C	S	.	.	H	α-helix	trans	-85.2	-13.1	-176.9	-78.8	-79	0	0	0	114.1	V35 L38 E39 I42 R73 L78 L148 I149 R154 V159 L163	V35-F152 HydrophobicContact CB-CZ 4.32Å; V35-F152 HydrophobicContact CG1-CZ 4Å; V35-F152 HydrophobicContact CG2-CE2 4.36Å; V35-F152 HydrophobicContact CG2-CZ 4.16Å; L38-F152 HydrophobicContact CB-CD1 4.47Å; L38-F152 HydrophobicContact CB-CE1 3.85Å; L38-F152 HydrophobicContact CB-CE2 4.25Å; L38-F152 HydrophobicContact CB-CZ 3.71Å; L38-F152 HydrophobicContact CD1-CD2 3.93Å; L38-F152 HydrophobicContact CD1-CE2 3.44Å; L38-F152 VanDerWaalsContact CD1-CE2 3.44Å; L38-F152 HydrophobicContact CD1-CZ 3.77Å; L38-F152 HydrophobicContact CG-CE2 4.45Å; L38-F152 HydrophobicContact CG-CZ 4.38Å; E39-F152 HydrophobicContact CG-CE1 3.82Å; E39-F152 HydrophobicContact CG-CZ 4.44Å; I42-F152 HydrophobicContact CD1-CB 4.37Å; I42-F152 HydrophobicContact CD1-CD1 3.58Å; I42-F152 HydrophobicContact CD1-CE1 4.23Å; I42-F152 HydrophobicContact CD1-CG 4.29Å; R73-F152 WeakPolarHBondContact CB-O 3.17Å; R73-F152 VanDerWaalsContact CD-O 3.22Å; R73-F152 WeakPolarHBondContact CD-O 3.3Å; R73-F152 VanDerWaalsContact CG-O 3.29Å; R73-F152 WeakPolarHBondContact CG-O 3.11Å; L78-F152 HydrophobicContact CD1-CB 3.81Å; L78-F152 HydrophobicContact CD2-CB 3.85Å; L78-F152 HydrophobicContact CG-CB 4.48Å; L148-F152 HydrophobicContact CD2-CD2 4.47Å; L148-F152 HydrophobicContact CD2-CE2 4.12Å; L148-F152 WeakPolarHBondContact O-CB 3.35Å; L148-F152 VanDerWaalsContact O-CD2 3.29Å; L148-F152 WeakPolarHBondContact O-CD2 3.49Å; L148-F152 PolarHBondContact O-N 2.97Å; I149-F152 PolarHBondContact O-N 2.65Å; F152-R154 PolarHBondContact O-N 2.93Å; F152-R154 VanDerWaalsContact O-N 3.11Å; F152-V159 HydrophobicContact CE1-CG1 3.96Å; F152-V159 HydrophobicContact CE2-CG1 4.04Å; F152-V159 HydrophobicContact CZ-CG1 3.63Å; F152-L163 HydrophobicContact CE2-CD2 4.12Å
153	S	92.3	Very high	90.7	Very high	53 Å²	53	68.5 Å²	68.5	37%	0.371	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.3	173.4	71.5	0	0	0	0	113.4	I149 E150	I149-S153 VanDerWaalsContact O-CB 3.25Å; I149-S153 WeakPolarHBondContact O-CB 3.1Å; I149-S153 PolarHBondContact O-N 3.19Å; E150-S153 PolarHBondContact O-OG 2.79Å
154	R	88.7	Confident	90.6	Very high	190 Å²	190	62.4 Å²	62.4	72%	0.717	31%	0.305	S	S	*	.	S	Bend	trans	-129.2	155	-179.3	-60	179.3	-170.5	173.6	6	110.8	F152	F152-R154 PolarHBondContact O-N 2.93Å; F152-R154 VanDerWaalsContact O-N 3.11Å
155	E	82.8	Confident	90.3	Very high	155 Å²	155	60.7 Å²	60.7	72%	0.724	30%	0.299	S	S	*	.			trans	-72.3	130.3	169.2	-157.4	146.6	168.5	0	0	110	R73	R73-E155 IonicContact CZ-OE2 2.65Å; R73-E155 IonicContact NH1-OE2 3.19Å; R73-E155 PolarHBondContact NH1-OE2 2.84Å; R73-E155 IonicContact NH2-OE2 3.52Å
156	A	83.4	Confident	89.8	Confident	36 Å²	36	63.8 Å²	63.8	30%	0.298	31%	0.311	S	S	.	.			trans	-148.3	141.5	176.6	0	0	0	0	0	110.2	V159	A156-V159 HydrophobicContact CB-CG2 4.14Å; A156-V159 WeakPolarHBondContact O-CG2 3.28Å
157	D	84.7	Confident	89.5	Confident	126 Å²	126	63.2 Å²	63.2	67%	0.674	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	151.7	170.7	-53.3	-56.6	0	0	0	110.8	V159 K162	D157-V159 VanDerWaalsContact C-N 3.28Å; D157-V159 PolarHBondContact O-N 3.04Å; D157-K162 VanDerWaalsContact O-CE 3.31Å; D157-K162 WeakPolarHBondContact O-CE 3.47Å; D157-K162 PolarHBondContact O-NZ 3.31Å
158	N	85.1	Confident	89.3	Confident	87 Å²	87	61.3 Å²	61.3	47%	0.465	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	40.6	176.2	-51.8	-59.4	0	0	0	112.5	K160 D161 K162	N158-K160 PolarHBondContact O-N 3.25Å; N158-D161 PolarHBondContact O-N 2.85Å; N158-K162 WeakPolarHBondContact O-CG 3.38Å; N158-K162 PolarHBondContact O-N 3.28Å
159	V	88.1	Confident	89	Confident	5 Å²	5	67 Å²	67	3%	0.03	32%	0.322	C	S	.	.	H	α-helix	trans	-52.5	-47	178.9	175.8	0	0	0	0	110.2	V35 E39 F151 F152 A156 D157 D161 K162 L163	V35-V159 HydrophobicContact CG1-CB 4.32Å; V35-V159 HydrophobicContact CG1-CG1 4.01Å; E39-V159 WeakPolarHBondContact OE1-CB 3.49Å; F151-V159 HydrophobicContact CD1-CG1 3.85Å; F151-V159 HydrophobicContact CE1-CG1 4.37Å; F152-V159 HydrophobicContact CE1-CG1 3.96Å; F152-V159 HydrophobicContact CE2-CG1 4.04Å; F152-V159 HydrophobicContact CZ-CG1 3.63Å; A156-V159 HydrophobicContact CB-CG2 4.14Å; A156-V159 WeakPolarHBondContact O-CG2 3.28Å; D157-V159 VanDerWaalsContact C-N 3.28Å; D157-V159 PolarHBondContact O-N 3.04Å; V159-D161 PolarHBondContact O-N 3.35Å; V159-K162 PolarHBondContact O-N 3.27Å; V159-L163 HydrophobicContact CG1-CB 4.46Å; V159-L163 WeakPolarHBondContact O-CB 3.33Å; V159-L163 PolarHBondContact O-N 2.69Å
160	K	88.8	Confident	88.7	Confident	44 Å²	44	66.9 Å²	66.9	19%	0.191	32%	0.321	C	S	.	.	H	α-helix	trans	-54.8	-46.8	-178.3	-170.4	157	137.8	173.7	0	113.9	R32 V35 D36 N158 C164	R32-K160 HydrophobicContact CB-CD 4.05Å; R32-K160 HydrophobicContact CB-CG 4.23Å; R32-K160 HydrophobicContact CG-CD 4.11Å; R32-K160 HydrophobicContact CG-CG 3.82Å; V35-K160 HydrophobicContact CB-CB 4.46Å; V35-K160 HydrophobicContact CB-CG 4.48Å; V35-K160 HydrophobicContact CG1-CB 3.76Å; V35-K160 HydrophobicContact CG1-CD 4.46Å; V35-K160 HydrophobicContact CG1-CG 4.26Å; D36-K160 WeakPolarHBondContact OD1-CD 3.26Å; D36-K160 IonicContact OD1-NZ 3.76Å; D36-K160 PolarHBondContact OD1-NZ 2.67Å; D36-K160 IonicContact OD2-NZ 3.16Å; D36-K160 PolarHBondContact OD2-NZ 2.89Å; N158-K160 PolarHBondContact O-N 3.25Å; K160-C164 WeakPolarHBondContact O-CB 3.42Å; K160-C164 PolarHBondContact O-N 3.46Å; K160-C164 PolarHBondContact O-SG 3.31Å
161	D	88.1	Confident	88.6	Confident	49 Å²	49	61.8 Å²	61.8	26%	0.262	30%	0.298	S	S	.	.	H	α-helix	trans	-76.2	-40	179.7	-69.3	-32.8	0	0	0	112.5	R32 N158 V159 S165 K166	R32-D161 IonicContact CZ-OD1 2.67Å; R32-D161 IonicContact NH1-OD1 3.57Å; R32-D161 PolarHBondContact NH1-OD1 2.88Å; R32-D161 IonicContact NH2-OD1 2.89Å; R32-D161 PolarHBondContact NH2-OD1 3.3Å; N158-D161 PolarHBondContact O-N 2.85Å; V159-D161 PolarHBondContact O-N 3.35Å; D161-S165 WeakPolarHBondContact O-CA 3.37Å; D161-S165 WeakPolarHBondContact O-CB 3.19Å; D161-S165 PolarHBondContact O-N 3.38Å; D161-S165 VanDerWaalsContact O-N 3.11Å; D161-S165 PolarHBondContact O-OG 3.42Å; D161-S165 VanDerWaalsContact O-OG 3.13Å; D161-K166 PolarHBondContact O-N 2.73Å
162	K	90	Very high	88.1	Confident	76 Å²	76	62 Å²	62	33%	0.33	30%	0.301	S	S	.	.	I	π-helix	trans	-66.8	-44.2	179.3	-67.2	173.1	179.4	163.2	0	111.4	F151 D157 N158 V159 K166 R167	F151-K162 HydrophobicContact CE1-CB 3.78Å; F151-K162 HydrophobicContact CE1-CD 4.17Å; F151-K162 HydrophobicContact CZ-CB 3.48Å; F151-K162 VanDerWaalsContact CZ-CB 3.48Å; F151-K162 HydrophobicContact CZ-CD 4.08Å; F151-K162 HydrophobicContact CZ-CG 4.43Å; D157-K162 VanDerWaalsContact O-CE 3.31Å; D157-K162 WeakPolarHBondContact O-CE 3.47Å; D157-K162 PolarHBondContact O-NZ 3.31Å; N158-K162 WeakPolarHBondContact O-CG 3.38Å; N158-K162 PolarHBondContact O-N 3.28Å; V159-K162 PolarHBondContact O-N 3.27Å; K162-K166 CarbonylContact O-C 3.6Å; K162-K166 WeakPolarHBondContact O-CA 3.47Å; K162-K166 VanDerWaalsContact O-CB 3.27Å; K162-K166 WeakPolarHBondContact O-CB 3.41Å; K162-K166 PolarHBondContact O-N 2.87Å; K162-R167 PolarHBondContact O-N 3.5Å
163	L	91.2	Very high	86.6	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	32%	0.324	C	S	.	.	I	π-helix	trans	-72.5	-62.6	-178.7	-173.2	69.6	0	0	0	110.3	V35 L148 F151 F152 V159 S165 R167 T168	V35-L163 HydrophobicContact CG2-CD2 3.72Å; L148-L163 HydrophobicContact CD2-CD2 3.52Å; L148-L163 HydrophobicContact CG-CD2 4.43Å; F151-L163 HydrophobicContact CB-CD1 4.14Å; F151-L163 HydrophobicContact CD2-CD1 4.01Å; F151-L163 HydrophobicContact CG-CD1 4.04Å; F152-L163 HydrophobicContact CE2-CD2 4.12Å; V159-L163 HydrophobicContact CG1-CB 4.46Å; V159-L163 WeakPolarHBondContact O-CB 3.33Å; V159-L163 PolarHBondContact O-N 2.69Å; L163-S165 PolarHBondContact O-N 3.22Å; L163-R167 HydrophobicContact CD1-CB 4.18Å; L163-R167 HydrophobicContact CD1-CG 4.13Å; L163-R167 WeakPolarHBondContact O-CB 2.79Å; L163-R167 PolarHBondContact O-N 2.73Å; L163-T168 HydrophobicContact CD1-CG2 4.44Å; L163-T168 PolarHBondContact O-N 3.18Å; L163-T168 VanDerWaalsContact O-N 3.1Å; L163-T168 PolarHBondContact O-OG1 2.94Å
164	C	92.8	Very high	84.3	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.334	C	S	.	.	I	π-helix	trans	-69.2	-19.8	-171.8	-57.9	0	0	0	0	114.1	C31 K160 T168 L170 C171	C31-C164 HydrophobicContact CB-CB 3.83Å; C31-C164 WeakPolarHBondContact CB-SG 3.34Å; C31-C164 PolarHBondContact O-SG 2.86Å; C31-C164 WeakPolarHBondContact SG-CA 3.33Å; C31-C164 WeakPolarHBondContact SG-CB 3.41Å; C31-C164 CovalentContact SG-SG 2.04Å; C31-C164 PolarHBondContact SG-SG 2.64Å; K160-C164 WeakPolarHBondContact O-CB 3.42Å; K160-C164 PolarHBondContact O-N 3.46Å; K160-C164 PolarHBondContact O-SG 3.31Å; C164-T168 WeakPolarHBondContact CA-OG1 3.39Å; C164-T168 PolarHBondContact O-OG1 2.92Å; C164-L170 PolarHBondContact O-N 2.74Å; C164-L170 VanDerWaalsContact O-N 3.11Å; C164-C171 HydrophobicContact CB-CB 4.41Å; C164-C171 WeakPolarHBondContact O-CB 3.44Å; C164-C171 PolarHBondContact O-N 3.13Å
165	S	89.4	Confident	82.3	Confident	6 Å²	6	61.1 Å²	61.1	4%	0.042	31%	0.313	C	S	.	.	I	π-helix	trans	-111.2	-49.5	179.9	-36	0	0	0	0	113.3	D161 L163	D161-S165 WeakPolarHBondContact O-CA 3.37Å; D161-S165 WeakPolarHBondContact O-CB 3.19Å; D161-S165 PolarHBondContact O-N 3.38Å; D161-S165 VanDerWaalsContact O-N 3.11Å; D161-S165 PolarHBondContact O-OG 3.42Å; D161-S165 VanDerWaalsContact O-OG 3.13Å; L163-S165 PolarHBondContact O-N 3.22Å
166	K	86.6	Confident	80.4	Confident	144 Å²	144	61.9 Å²	61.9	63%	0.626	32%	0.316	S	S	*	.	I	π-helix	trans	-87.5	-29.9	-173	-63.2	179.1	177.7	178.2	0	113.8	D161 K162 H173	D161-K166 PolarHBondContact O-N 2.73Å; K162-K166 CarbonylContact O-C 3.6Å; K162-K166 WeakPolarHBondContact O-CA 3.47Å; K162-K166 VanDerWaalsContact O-CB 3.27Å; K162-K166 WeakPolarHBondContact O-CB 3.41Å; K162-K166 PolarHBondContact O-N 2.87Å; K166-H173 VanDerWaalsContact CG-NE2 3.34Å; K166-H173 WeakPolarHBondContact CG-NE2 3.27Å
167	R	87.7	Confident	78.5	Confident	114 Å²	114	64.6 Å²	64.6	43%	0.43	33%	0.325	S	S	.	.	I	π-helix	trans	-93.5	-41.3	-175.5	-174.7	56.7	162.2	164.6	-3.6	111.8	E147 E150 K162 L163	E147-R167 HydrophobicContact CB-CG 4.2Å; E147-R167 HydrophobicContact CG-CG 3.99Å; E147-R167 VanDerWaalsContact CG-NE 3.3Å; E150-R167 IonicContact OE2-NH2 3.82Å; E150-R167 PolarHBondContact OE2-NH2 2.8Å; E150-R167 VanDerWaalsContact OE2-NH2 3.16Å; K162-R167 PolarHBondContact O-N 3.5Å; L163-R167 HydrophobicContact CD1-CB 4.18Å; L163-R167 HydrophobicContact CD1-CG 4.13Å; L163-R167 WeakPolarHBondContact O-CB 2.79Å; L163-R167 PolarHBondContact O-N 2.73Å
168	T	87.3	Confident	76.3	Confident	10 Å²	10	63 Å²	63	6%	0.061	32%	0.323	C	S	.	.	S	Bend	trans	-112.4	-5.8	-172.6	64	0	0	0	0	114.5	Y144 L163 C164 L170	Y144-T168 HydrophobicContact CD1-CG2 3.59Å; Y144-T168 HydrophobicContact CD2-CG2 4.25Å; Y144-T168 HydrophobicContact CE1-CG2 3.87Å; Y144-T168 HydrophobicContact CG-CG2 3.8Å; L163-T168 HydrophobicContact CD1-CG2 4.44Å; L163-T168 PolarHBondContact O-N 3.18Å; L163-T168 VanDerWaalsContact O-N 3.1Å; L163-T168 PolarHBondContact O-OG1 2.94Å; C164-T168 WeakPolarHBondContact CA-OG1 3.39Å; C164-T168 PolarHBondContact O-OG1 2.92Å; T168-L170 PolarHBondContact O-N 3.38Å; T168-L170 WeakPolarHBondContact OG1-CD1 3.18Å; T168-L170 VanDerWaalsContact OG1-CG 3.31Å; T168-L170 WeakPolarHBondContact OG1-CG 3.22Å
169	D	88.2	Confident	74.2	Confident	123 Å²	123	65.5 Å²	65.5	66%	0.658	33%	0.332	S	S	*	.			trans	53	17.9	-177.7	-66.4	-38.5	0	0	0	115
170	L	90.3	Very high	71.7	Confident	20 Å²	20	72 Å²	72	11%	0.105	37%	0.366	C	S	.	.			trans	-71.1	-33.9	-178.6	-62.7	175.2	0	0	0	111.9	Q24 H27 C28 C31 I140 Y144 C164 T168	Q24-L170 VanDerWaalsContact CG-O 3.3Å; Q24-L170 WeakPolarHBondContact CG-O 3.37Å; H27-L170 HydrophobicContact CB-CD2 4.11Å; C28-L170 WeakPolarHBondContact CB-O 3.48Å; C31-L170 HydrophobicContact CB-CD1 3.78Å; I140-L170 HydrophobicContact CD1-CD1 3.89Å; I140-L170 HydrophobicContact CG1-CD1 3.84Å; I140-L170 HydrophobicContact CG2-CD1 4.16Å; Y144-L170 HydrophobicContact CE2-CD1 4.45Å; Y144-L170 HydrophobicContact CE2-CD2 4.38Å; C164-L170 PolarHBondContact O-N 2.74Å; C164-L170 VanDerWaalsContact O-N 3.11Å; T168-L170 PolarHBondContact O-N 3.38Å; T168-L170 WeakPolarHBondContact OG1-CD1 3.18Å; T168-L170 VanDerWaalsContact OG1-CG 3.31Å; T168-L170 WeakPolarHBondContact OG1-CG 3.22Å
171	C	88.7	Confident	69.1	Low	3 Å²	3	78.4 Å²	78.4	2%	0.02	40%	0.397	C	S	.	.	S	Bend	trans	-106.8	132.9	177.1	-66.4	0	0	0	0	111.3	C28 C164 H173	C28-C171 WeakPolarHBondContact CA-SG 3.49Å; C28-C171 HydrophobicContact CB-CB 3.99Å; C28-C171 WeakPolarHBondContact CB-SG 3.22Å; C28-C171 VanDerWaalsContact SG-CA 3.58Å; C28-C171 WeakPolarHBondContact SG-CB 3.19Å; C28-C171 CovalentContact SG-SG 2.04Å; C28-C171 PolarHBondContact SG-SG 3.11Å; C164-C171 HydrophobicContact CB-CB 4.41Å; C164-C171 WeakPolarHBondContact O-CB 3.44Å; C164-C171 PolarHBondContact O-N 3.13Å; C171-H173 PolarHBondContact O-N 2.77Å
172	D	82.2	Confident	66.5	Low	51 Å²	51	88 Å²	88	27%	0.273	45%	0.447	S	S	.	.			trans	-64	135.2	164	-60.6	-45.1	0	0	0	109.2	Q24 R102 A174 L175	Q24-D172 PolarHBondContact NE2-OD1 3.4Å; R102-D172 IonicContact CZ-OD2 2.81Å; R102-D172 IonicContact NH1-OD2 3.33Å; R102-D172 PolarHBondContact NH1-OD2 2.83Å; R102-D172 IonicContact NH2-OD2 2.64Å; R102-D172 PolarHBondContact NH2-OD2 2.77Å; D172-A174 HydrophobicContact CB-CB 4.08Å; D172-A174 PolarHBondContact O-N 3.28Å; D172-L175 PolarHBondContact O-N 3.39Å; D172-L175 VanDerWaalsContact O-N 3.11Å
173	H	61.4	Low	65.3	Low	111 Å²	111	88.6 Å²	88.6	51%	0.514	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-10.6	168.4	-73.7	71.1	0	0	0	113.2	K166 C171 L175	K166-H173 VanDerWaalsContact CG-NE2 3.34Å; K166-H173 WeakPolarHBondContact CG-NE2 3.27Å; C171-H173 PolarHBondContact O-N 2.77Å; H173-L175 VanDerWaalsContact C-N 3.29Å; H173-L175 PolarHBondContact O-N 3.11Å
174	A	45.6	Very low	64	Low	72 Å²	72	93.2 Å²	93.2	60%	0.595	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-8.5	177.6	0	0	0	0	0	114.2	D172 H176	D172-A174 HydrophobicContact CB-CB 4.08Å; D172-A174 PolarHBondContact O-N 3.28Å; A174-H176 PolarHBondContact O-N 3.18Å
175	L	46.7	Very low	62.4	Low	50 Å²	50	98.3 Å²	98.3	26%	0.262	50%	0.503	S	S	.	.			trans	-80	65.5	165.3	-66.1	175.1	0	0	0	109	C28 D172 H173 I177	C28-L175 VanDerWaalsContact SG-CD1 3.57Å; D172-L175 PolarHBondContact O-N 3.39Å; D172-L175 VanDerWaalsContact O-N 3.11Å; H173-L175 VanDerWaalsContact C-N 3.29Å; H173-L175 PolarHBondContact O-N 3.11Å; L175-I177 VanDerWaalsContact C-N 3.32Å; L175-I177 PolarHBondContact O-N 3.27Å
176	H	42.8	Very low	60.8	Low	171 Å²	171	103.8 Å²	103.8	79%	0.792	53%	0.53	S	S	*	.			trans	-58.4	98	166.8	-83.2	-74.1	0	0	0	108.5	A174 S178	A174-H176 PolarHBondContact O-N 3.18Å; H176-S178 PolarHBondContact O-N 2.89Å
177	I	42.7	Very low	59.2	Low	94 Å²	94	101.3 Å²	101.3	48%	0.482	52%	0.524	S	S	.	.			trans	-64.2	127.7	152	-61.8	-176.4	0	0	0	105.4	L175 H179	L175-I177 VanDerWaalsContact C-N 3.32Å; L175-I177 PolarHBondContact O-N 3.27Å; I177-H179 PolarHBondContact O-N 2.77Å
178	S	37.9	Very low	57.3	Low	92 Å²	92	100.4 Å²	100.4	64%	0.643	53%	0.53	S	S	*	.			trans	-55.4	102.2	170.5	49.1	0	0	0	0	109.3	H176 D180	H176-S178 PolarHBondContact O-N 2.89Å; S178-D180 PolarHBondContact O-N 3.27Å
179	H	40.9	Very low	55.1	Low	139 Å²	139	106.9 Å²	106.9	64%	0.644	56%	0.563	S	S	*	*			trans	-72.7	81	158.9	-94.5	-85.9	0	0	0	108	I177	I177-H179 PolarHBondContact O-N 2.77Å
180	D	37.3	Very low	52.6	Low	142 Å²	142	105.6 Å²	105.6	76%	0.759	56%	0.556	S	S	*	*			trans	-83	119.3	146.7	-71.9	-19.2	0	0	0	104.6	S178	S178-D180 PolarHBondContact O-N 3.27Å
181	E	33.3	Very low	49.5	Very low	178 Å²	178	112.8 Å²	112.8	83%	0.832	59%	0.594	S	S	*	*			cis	-151.5	168.1	3.7	-80.1	179	116.4	0	0	107.3
182	L	34.2	Very low	45.9	Very low	250 Å²	250	122.7 Å²	122.7	100%	1.309	65%	0.646	S	S	*	*			trans	-41.2	0	178.1	-122.5	82.7	0	0	0	117.3

Retrieved 182 of 182 residues in 427.6 ms (Link to these results)

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