A0A096NJN1_PAPAN Loading...

GSK3B interacting protein

AlphaFold DB (A0A096NJN2), UniProt , Accession A0A096NJN1, Species PAPAN (Papio anubis, Olive baboon), Gene GSKIP, Length 139 aa.

						>A0A096NJN1_PAPAN|A0A096NJN1|GSKIP
METDCNPVELSSMSGFEEGSELNGFEGTDMKDMRLEAEAVVNDVLFAVNNMFVSKSLRCADDVAYINVETKERNRYCLELTEAGLKVVGYAFDQVDDHLQTPYHETVYSLLDTLSPAYREAFGNALLQRLEALKRDGQS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.6	Very low	48.5	Very low	240 Å²	240	148.5 Å²	148.5	100%	1.182	82%	0.824	S	S	*	*				0	110.5	0	-80.5	171.5	171.1	0	0	105.9
2	E	49.8	Very low	48.6	Very low	189 Å²	189	145.7 Å²	145.7	88%	0.883	82%	0.822	S	S	*	*			trans	-67.5	142.9	173	-61.4	150.7	92.2	0	0	109
3	T	49.3	Very low	48.7	Very low	137 Å²	137	149.2 Å²	149.2	84%	0.84	83%	0.831	S	S	*	*			trans	-153.2	96.9	154.5	19.6	0	0	0	0	109
4	D	45.9	Very low	48.3	Very low	137 Å²	137	147.5 Å²	147.5	73%	0.733	84%	0.835	S	S	*	*			trans	-56.9	135.2	149.4	-174.9	-83.7	0	0	0	109.2
5	C	48.5	Very low	47.8	Very low	116 Å²	116	143.2 Å²	143.2	78%	0.784	84%	0.836	S	S	*	*			trans	-165.1	97	160	-93.6	0	0	0	0	109.4
6	N	49.3	Very low	47.6	Very low	143 Å²	143	144.7 Å²	144.7	77%	0.765	83%	0.83	S	S	*	*			trans	-92.1	140.6	152.7	-55.8	-76.9	0	0	0	108.4
7	P	52.3	Low	47.7	Very low	114 Å²	114	147.6 Å²	147.6	74%	0.74	83%	0.834	S	S	*	*			trans	-134.9	114.5	144.5	29.6	-12.7	0	0	0	113.9
8	V	48.9	Very low	47.9	Very low	129 Å²	129	148.5 Å²	148.5	78%	0.782	83%	0.831	S	S	*	*			trans	7	117.2	139	57.4	0	0	0	0	120.3
9	E	56.3	Low	47.6	Very low	160 Å²	160	144.3 Å²	144.3	75%	0.748	82%	0.824	S	S	*	*			trans	57.8	143.2	131.1	-56	-79.7	81	0	0	124.5
10	L	48.5	Very low	48	Very low	152 Å²	152	142.9 Å²	142.9	80%	0.796	82%	0.824	S	S	*	*			trans	81.4	115.7	152.7	-73.1	137.4	0	0	0	119.2
11	S	44.1	Very low	48	Very low	116 Å²	116	145 Å²	145	81%	0.811	83%	0.826	S	S	*	*				176.7	119.1	120.3	-75.6	0	0	0	0	114.3
12	S	49.3	Very low	48.5	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	81%	0.814	S	S	*	*			trans	26.7	116.4	137	-50.5	0	0	0	0	122.6
13	M	50.2	Low	48.6	Very low	191 Å²	191	140 Å²	140	94%	0.941	81%	0.809	S	S	*	*			trans	22.3	117.8	137.6	-156.7	178.8	-158.4	0	0	119.5
14	S	43.2	Very low	48.3	Very low	126 Å²	126	137.2 Å²	137.2	88%	0.881	81%	0.807	S	S	*	*			trans	-165.5	128.2	151.9	-71.7	0	0	0	0	111.9
15	G	40.8	Very low	48.6	Very low	83 Å²	83	139.6 Å²	139.6	86%	0.856	81%	0.812	S	S	*	*			trans	109.4	98.2	151.3	0	0	0	0	0	117.9
16	F	44.3	Very low	48.6	Very low	167 Å²	167	141.8 Å²	141.8	73%	0.732	81%	0.81	S	S	*	*			trans	-76.9	123.8	165.7	167.9	-91.1	0	0	0	110.4	E18	F16-E18 HydrophobicContact CE1-CB 4.19Å; F16-E18 HydrophobicContact CE2-CB 3.86Å; F16-E18 HydrophobicContact CZ-CB 3.57Å
17	E	48.9	Very low	48.4	Very low	194 Å²	194	138.3 Å²	138.3	91%	0.907	81%	0.808	S	S	*	*			trans	-135.8	105.2	155.8	-70.7	-103.1	79.9	0	0	106.7	G19	E17-G19 PolarHBondContact O-N 3.12Å
18	E	52.2	Low	48.3	Very low	164 Å²	164	136.5 Å²	136.5	77%	0.766	80%	0.795	S	S	*	*			trans	-80.8	104.2	173.7	-179.2	173	74.9	0	0	108.8	F16	F16-E18 HydrophobicContact CE1-CB 4.19Å; F16-E18 HydrophobicContact CE2-CB 3.86Å; F16-E18 HydrophobicContact CZ-CB 3.57Å
19	G	42.3	Very low	48.6	Very low	68 Å²	68	137.7 Å²	137.7	70%	0.701	80%	0.797	S	S	*	*			trans	-133.9	112.8	173.5	0	0	0	0	0	109.5	E17 E21	E17-G19 PolarHBondContact O-N 3.12Å; G19-E21 PolarHBondContact O-N 3.18Å
20	S	55.5	Low	48.6	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	79%	0.789	S	S	*	*			trans	-72.1	107.3	-170.1	-48.2	0	0	0	0	113.5
21	E	47.6	Very low	49.3	Very low	187 Å²	187	133.7 Å²	133.7	87%	0.874	77%	0.774	S	S	*	*			trans	-156.1	59.5	147.5	47.9	-174.8	80.6	0	0	110.3	G19 N23	G19-E21 PolarHBondContact O-N 3.18Å; E21-N23 PolarHBondContact O-N 3.4Å
22	L	50.8	Low	51.2	Low	180 Å²	180	132.2 Å²	132.2	94%	0.942	76%	0.757	S	S	*	*			trans	-75.7	75.8	169.5	-88.6	155.8	0	0	0	109.9
23	N	51.9	Low	53.1	Low	145 Å²	145	127 Å²	127	78%	0.775	72%	0.719	S	S	*	*			trans	-148	60.7	154.2	-155.4	75.7	0	0	0	110.5	E21	E21-N23 PolarHBondContact O-N 3.4Å
24	G	43.2	Very low	54.9	Low	77 Å²	77	124.6 Å²	124.6	79%	0.794	70%	0.7	S	S	*	*			trans	-106.6	86.3	162.2	0	0	0	0	0	108.8	E26	G24-E26 PolarHBondContact O-N 3.32Å
25	F	52.5	Low	57.2	Low	188 Å²	188	123.8 Å²	123.8	83%	0.825	69%	0.685	S	S	*	*			trans	-72.3	103.9	178.8	-159	-90.7	0	0	0	108.9
26	E	49.2	Very low	59.6	Low	162 Å²	162	123.3 Å²	123.3	76%	0.757	66%	0.661	S	S	*	*			trans	176.9	66.5	149.2	-99.9	-179.9	98.4	0	0	107.1	G24 T28	G24-E26 PolarHBondContact O-N 3.32Å; E26-T28 PolarHBondContact O-N 3.32Å
27	G	45.2	Very low	61.9	Low	69 Å²	69	115.3 Å²	115.3	71%	0.711	63%	0.626	S	S	*	*			trans	-66.8	84.6	144.5	0	0	0	0	0	105	D29	G27-D29 PolarHBondContact O-N 2.95Å
28	T	50.2	Low	64	Low	77 Å²	77	110.7 Å²	110.7	47%	0.472	60%	0.604	S	S	.	*			trans	-66.2	87.9	160.9	-32.5	0	0	0	0	103.5	E26 M30	E26-T28 PolarHBondContact O-N 3.32Å; T28-M30 HydrophobicContact CG2-CB 4.36Å; T28-M30 HydrophobicContact CG2-CE 4.01Å; T28-M30 HydrophobicContact CG2-CG 3.34Å; T28-M30 PolarHBondContact O-N 2.87Å
29	D	53.7	Low	65.9	Low	153 Å²	153	105.5 Å²	105.5	82%	0.818	59%	0.589	S	S	*	*			trans	-55.9	74.7	147.3	-74.6	-97.2	0	0	0	104.7	G27 K31	G27-D29 PolarHBondContact O-N 2.95Å; D29-K31 PolarHBondContact O-N 3.24Å
30	M	56.9	Low	68.3	Low	118 Å²	118	103.6 Å²	103.6	58%	0.581	56%	0.564	S	S	*	*			trans	-61.3	98.8	170.5	-77.3	-173.6	-166	0	0	103.1	T28 D32	T28-M30 HydrophobicContact CG2-CB 4.36Å; T28-M30 HydrophobicContact CG2-CE 4.01Å; T28-M30 HydrophobicContact CG2-CG 3.34Å; T28-M30 PolarHBondContact O-N 2.87Å; M30-D32 PolarHBondContact O-N 2.58Å
31	K	63.3	Low	70.1	Confident	111 Å²	111	98.8 Å²	98.8	48%	0.483	53%	0.53	S	S	.	.			trans	-70	89.5	-179.6	-173.5	176.5	-178.3	179.5	0	105.5	D29 M33 E36	D29-K31 PolarHBondContact O-N 3.24Å; K31-M33 VanDerWaalsContact C-N 3.32Å; K31-M33 PolarHBondContact O-N 3.09Å; K31-E36 HydrophobicContact CD-CG 4.37Å; K31-E36 WeakPolarHBondContact CE-OE2 3.37Å; K31-E36 HydrophobicContact CG-CG 3.87Å; K31-E36 IonicContact NZ-OE2 3.28Å; K31-E36 PolarHBondContact NZ-OE2 3.41Å
32	D	83.4	Confident	72.3	Confident	85 Å²	85	96.1 Å²	96.1	46%	0.455	52%	0.522	S	S	.	.			trans	-52	97.5	176	-87.3	-93.2	0	0	0	108.6	M30 R34 L35 E36	M30-D32 PolarHBondContact O-N 2.58Å; D32-R34 PolarHBondContact O-N 3.39Å; D32-L35 HydrophobicContact CB-CB 3.83Å; D32-L35 WeakPolarHBondContact O-CA 3.28Å; D32-L35 WeakPolarHBondContact O-CB 3.08Å; D32-L35 PolarHBondContact O-N 3.3Å; D32-E36 PolarHBondContact O-N 3.12Å; D32-E36 VanDerWaalsContact O-N 3.13Å
33	M	89.6	Confident	74.2	Confident	4 Å²	4	91.1 Å²	91.1	2%	0.02	50%	0.496	C	S	.	.	H	α-helix	trans	-60.7	-26.5	-175.7	-160.9	60.5	66	0	0	111.3	K31 E36 A37 D61 A64 L80 T81 E82	K31-M33 VanDerWaalsContact C-N 3.32Å; K31-M33 PolarHBondContact O-N 3.09Å; M33-E36 HydrophobicContact SD-CB 4.44Å; M33-A37 VanDerWaalsContact O-CB 3.25Å; M33-A37 WeakPolarHBondContact O-CB 3.48Å; M33-A37 PolarHBondContact O-N 3.37Å; M33-D61 WeakPolarHBondContact CB-O 3.48Å; M33-D61 PolarHBondContact N-O 3.12Å; M33-A64 HydrophobicContact CB-CB 4.02Å; M33-A64 HydrophobicContact CG-CB 3.78Å; M33-A64 WeakPolarHBondContact O-CB 3.49Å; M33-L80 HydrophobicContact CG-CB 4.34Å; M33-L80 HydrophobicContact CG-CD2 3.95Å; M33-L80 HydrophobicContact CG-CG 3.91Å; M33-L80 VanDerWaalsContact CG-O 3.29Å; M33-L80 WeakPolarHBondContact CG-O 3.36Å; M33-L80 HydrophobicContact SD-CB 4.49Å; M33-L80 HydrophobicContact SD-CD1 4.4Å; M33-L80 HydrophobicContact SD-CD2 3.65Å; M33-L80 HydrophobicContact SD-CG 3.51Å; M33-L80 VanDerWaalsContact SD-CG 3.51Å; M33-T81 VanDerWaalsContact CE-C 3.49Å; M33-E82 HydrophobicContact CE-CG 4.08Å
34	R	89.1	Confident	76	Confident	142 Å²	142	84.2 Å²	84.2	54%	0.536	46%	0.459	S	S	.	.	H	α-helix	trans	-61.7	-46.8	170.5	179.2	177.8	170	178.1	-1.3	112.5	D32 E36 A37 E38	D32-R34 PolarHBondContact O-N 3.39Å; R34-E36 VanDerWaalsContact C-N 3.31Å; R34-A37 WeakPolarHBondContact O-CB 3.25Å; R34-A37 PolarHBondContact O-N 3.45Å; R34-E38 IonicContact NE-OE2 3.47Å; R34-E38 PolarHBondContact NE-OE2 2.96Å; R34-E38 WeakPolarHBondContact O-CG 3.42Å; R34-E38 PolarHBondContact O-N 3.49Å
35	L	89.8	Confident	78.3	Confident	109 Å²	109	84 Å²	84	57%	0.571	44%	0.439	S	S	*	.	H	α-helix	trans	-64.6	-41.8	179.7	-178	63.6	0	0	0	110.5	D32 A37 E38 A39	D32-L35 HydrophobicContact CB-CB 3.83Å; D32-L35 WeakPolarHBondContact O-CA 3.28Å; D32-L35 WeakPolarHBondContact O-CB 3.08Å; D32-L35 PolarHBondContact O-N 3.3Å; L35-A37 VanDerWaalsContact C-N 3.32Å; L35-A37 PolarHBondContact O-N 3.08Å; L35-E38 PolarHBondContact O-N 2.83Å; L35-A39 PolarHBondContact O-N 3.24Å
36	E	91.4	Very high	80.1	Confident	72 Å²	72	80.2 Å²	80.2	34%	0.336	42%	0.422	S	S	.	.	H	α-helix	trans	-60.5	-43.5	174.3	-65.5	-71.5	99.4	0	0	111.3	K31 D32 M33 R34 E38 A39 V40 L80	K31-E36 HydrophobicContact CD-CG 4.37Å; K31-E36 WeakPolarHBondContact CE-OE2 3.37Å; K31-E36 HydrophobicContact CG-CG 3.87Å; K31-E36 IonicContact NZ-OE2 3.28Å; K31-E36 PolarHBondContact NZ-OE2 3.41Å; D32-E36 PolarHBondContact O-N 3.12Å; D32-E36 VanDerWaalsContact O-N 3.13Å; M33-E36 HydrophobicContact SD-CB 4.44Å; R34-E36 VanDerWaalsContact C-N 3.31Å; E36-E38 VanDerWaalsContact C-N 3.34Å; E36-E38 PolarHBondContact O-N 3.15Å; E36-A39 PolarHBondContact O-N 3.24Å; E36-V40 WeakPolarHBondContact O-CB 3.26Å; E36-V40 VanDerWaalsContact O-CG2 3.27Å; E36-V40 WeakPolarHBondContact O-CG2 3.28Å; E36-V40 PolarHBondContact O-N 3.39Å; E36-L80 HydrophobicContact CB-CD2 3.97Å
37	A	92.7	Very high	82	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-60.6	-42.2	175	0	0	0	0	0	112.1	M33 R34 L35 V40 V41 V53 A64 I66 L80	M33-A37 VanDerWaalsContact O-CB 3.25Å; M33-A37 WeakPolarHBondContact O-CB 3.48Å; M33-A37 PolarHBondContact O-N 3.37Å; R34-A37 WeakPolarHBondContact O-CB 3.25Å; R34-A37 PolarHBondContact O-N 3.45Å; L35-A37 VanDerWaalsContact C-N 3.32Å; L35-A37 PolarHBondContact O-N 3.08Å; A37-V40 PolarHBondContact O-N 2.88Å; A37-V41 WeakPolarHBondContact O-CB 3.27Å; A37-V41 WeakPolarHBondContact O-CG2 3.35Å; A37-V41 PolarHBondContact O-N 3.36Å; A37-V53 HydrophobicContact CB-CG1 4.45Å; A37-V53 HydrophobicContact CB-CG2 3.78Å; A37-A64 HydrophobicContact CB-CB 3.77Å; A37-I66 HydrophobicContact CB-CD1 3.68Å; A37-I66 HydrophobicContact CB-CG1 3.71Å; A37-L80 HydrophobicContact CB-CD2 3.87Å
38	E	92.6	Very high	84.3	Confident	96 Å²	96	69.6 Å²	69.6	45%	0.449	36%	0.355	S	S	.	.	H	α-helix	trans	-65.5	-40.2	176.2	-69.8	-171.1	81.6	0	0	112.1	R34 L35 E36 V41 N42 V53	R34-E38 IonicContact NE-OE2 3.47Å; R34-E38 PolarHBondContact NE-OE2 2.96Å; R34-E38 WeakPolarHBondContact O-CG 3.42Å; R34-E38 PolarHBondContact O-N 3.49Å; L35-E38 PolarHBondContact O-N 2.83Å; E36-E38 VanDerWaalsContact C-N 3.34Å; E36-E38 PolarHBondContact O-N 3.15Å; E38-V41 PolarHBondContact O-N 3.43Å; E38-N42 WeakPolarHBondContact O-CB 3.38Å; E38-N42 PolarHBondContact O-N 2.94Å; E38-V53 HydrophobicContact CG-CG2 3.67Å
39	A	92.7	Very high	86.4	Confident	55 Å²	55	70.4 Å²	70.4	46%	0.455	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-45.4	174.8	0	0	0	0	0	111.6	L35 E36 V41 N42 D43	L35-A39 PolarHBondContact O-N 3.24Å; E36-A39 PolarHBondContact O-N 3.24Å; A39-V41 PolarHBondContact O-N 2.99Å; A39-N42 PolarHBondContact O-N 3.09Å; A39-D43 PolarHBondContact O-N 3.41Å
40	V	92.9	Very high	88.3	Confident	29 Å²	29	66.2 Å²	66.2	18%	0.176	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-47.5	175.1	164.1	0	0	0	0	110.9	E36 A37 N42 D43 V44 M51 I66 L85 V107	E36-V40 WeakPolarHBondContact O-CB 3.26Å; E36-V40 VanDerWaalsContact O-CG2 3.27Å; E36-V40 WeakPolarHBondContact O-CG2 3.28Å; E36-V40 PolarHBondContact O-N 3.39Å; A37-V40 PolarHBondContact O-N 2.88Å; V40-N42 VanDerWaalsContact C-N 3.34Å; V40-N42 PolarHBondContact O-N 3.35Å; V40-D43 PolarHBondContact O-N 3.33Å; V40-V44 WeakPolarHBondContact O-CG2 3.3Å; V40-V44 PolarHBondContact O-N 2.95Å; V40-M51 HydrophobicContact CG1-CE 4.4Å; V40-I66 HydrophobicContact CG1-CD1 4.21Å; V40-L85 HydrophobicContact CG1-CD2 4.4Å; V40-V107 HydrophobicContact CG1-CB 3.68Å; V40-V107 HydrophobicContact CG1-CG1 3.9Å; V40-V107 HydrophobicContact CG1-CG2 3.67Å
41	V	93.8	Very high	90.1	Very high	16 Å²	16	60.9 Å²	60.9	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-56.2	-51	176.3	169.2	0	0	0	0	109.6	A37 E38 A39 D43 V44 L45 M51 V53 I66	A37-V41 WeakPolarHBondContact O-CB 3.27Å; A37-V41 WeakPolarHBondContact O-CG2 3.35Å; A37-V41 PolarHBondContact O-N 3.36Å; E38-V41 PolarHBondContact O-N 3.43Å; A39-V41 PolarHBondContact O-N 2.99Å; V41-D43 VanDerWaalsContact C-N 3.31Å; V41-D43 PolarHBondContact O-N 3.24Å; V41-V44 PolarHBondContact O-N 3.44Å; V41-L45 WeakPolarHBondContact O-CA 3.28Å; V41-L45 WeakPolarHBondContact O-CB 3.38Å; V41-L45 PolarHBondContact O-N 3.29Å; V41-M51 HydrophobicContact CB-CG 4.46Å; V41-M51 HydrophobicContact CG1-CB 4.11Å; V41-M51 HydrophobicContact CG1-CG 4.23Å; V41-M51 VanDerWaalsContact CG1-O 3.29Å; V41-M51 WeakPolarHBondContact CG1-O 3.48Å; V41-M51 HydrophobicContact CG2-CG 4.03Å; V41-V53 HydrophobicContact CG2-CG2 4.12Å; V41-I66 HydrophobicContact CG2-CG2 3.66Å
42	N	93.2	Very high	91.6	Very high	131 Å²	131	58.7 Å²	58.7	70%	0.701	30%	0.298	S	S	*	.	H	α-helix	trans	-61.8	-38.8	-176.4	-167	-97.5	0	0	0	112.8	E38 A39 V40	E38-N42 WeakPolarHBondContact O-CB 3.38Å; E38-N42 PolarHBondContact O-N 2.94Å; A39-N42 PolarHBondContact O-N 3.09Å; V40-N42 VanDerWaalsContact C-N 3.34Å; V40-N42 PolarHBondContact O-N 3.35Å
43	D	90.9	Very high	92.2	Very high	75 Å²	75	55.7 Å²	55.7	40%	0.401	28%	0.283	S	S	.	.	H	α-helix	trans	-65	-44.1	-177.5	-172.8	-91.1	0	0	0	112.6	A39 V40 V41 F46 Y108	A39-D43 PolarHBondContact O-N 3.41Å; V40-D43 PolarHBondContact O-N 3.33Å; V41-D43 VanDerWaalsContact C-N 3.31Å; V41-D43 PolarHBondContact O-N 3.24Å; D43-F46 VanDerWaalsContact O-CD1 3.23Å; D43-F46 WeakPolarHBondContact O-CD1 3.39Å; D43-F46 VanDerWaalsContact O-CE1 3.23Å; D43-F46 WeakPolarHBondContact O-CE1 3.35Å; D43-Y108 VanDerWaalsContact OD1-CE1 3.28Å; D43-Y108 WeakPolarHBondContact OD1-CE1 3.29Å; D43-Y108 VanDerWaalsContact OD1-CZ 3.23Å; D43-Y108 PolarHBondContact OD1-OH 2.89Å; D43-Y108 PolarHBondContact OD2-OH 2.97Å
44	V	90.4	Very high	92.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-106.1	1.2	-173.5	-56.5	0	0	0	0	114.8	V40 V41 F46 A47 M51 V107 Y108 L111 Y118	V40-V44 WeakPolarHBondContact O-CG2 3.3Å; V40-V44 PolarHBondContact O-N 2.95Å; V41-V44 PolarHBondContact O-N 3.44Å; V44-F46 PolarHBondContact O-N 2.95Å; V44-F46 VanDerWaalsContact O-N 3.12Å; V44-A47 PolarHBondContact O-N 2.98Å; V44-M51 HydrophobicContact CG2-CE 4.02Å; V44-M51 HydrophobicContact CG2-SD 3.51Å; V44-M51 VanDerWaalsContact CG2-SD 3.51Å; V44-V107 HydrophobicContact CG1-CG1 3.76Å; V44-V107 HydrophobicContact CG2-CG1 4.42Å; V44-V107 HydrophobicContact CG2-CG2 3.96Å; V44-Y108 HydrophobicContact CG1-CD1 4.2Å; V44-Y108 HydrophobicContact CG1-CE1 3.76Å; V44-L111 HydrophobicContact CB-CD1 3.96Å; V44-L111 HydrophobicContact CG1-CD1 4.4Å; V44-L111 HydrophobicContact CG2-CD1 3.6Å; V44-Y118 HydrophobicContact CB-CE2 4.05Å; V44-Y118 HydrophobicContact CG1-CE2 4.24Å
45	L	91.7	Very high	92.3	Very high	71 Å²	71	58.5 Å²	58.5	37%	0.372	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-52.7	-37.4	-179.9	-174.5	62.7	0	0	0	112.6	V41 A47 V48 M51	V41-L45 WeakPolarHBondContact O-CA 3.28Å; V41-L45 WeakPolarHBondContact O-CB 3.38Å; V41-L45 PolarHBondContact O-N 3.29Å; L45-A47 PolarHBondContact O-N 3.27Å; L45-V48 PolarHBondContact O-N 3.49Å; L45-M51 HydrophobicContact CD1-CB 3.8Å
46	F	89.8	Confident	92.3	Very high	110 Å²	110	57.9 Å²	57.9	48%	0.482	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-63.8	-24.9	-177.9	78.2	-87.6	0	0	0	113.7	D43 V44 F122 A125	D43-F46 VanDerWaalsContact O-CD1 3.23Å; D43-F46 WeakPolarHBondContact O-CD1 3.39Å; D43-F46 VanDerWaalsContact O-CE1 3.23Å; D43-F46 WeakPolarHBondContact O-CE1 3.35Å; V44-F46 PolarHBondContact O-N 2.95Å; V44-F46 VanDerWaalsContact O-N 3.12Å; F46-F122 HydrophobicContact CZ-CD2 4.31Å; F46-A125 HydrophobicContact CE2-CB 3.97Å; F46-A125 HydrophobicContact CZ-CB 4.46Å
47	A	89.8	Confident	92.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-96	-11.8	-173.2	0	0	0	0	0	112.9	V44 L45 K71 Y118 A121	V44-A47 PolarHBondContact O-N 2.98Å; L45-A47 PolarHBondContact O-N 3.27Å; A47-K71 WeakPolarHBondContact O-CE 3.31Å; A47-Y118 HydrophobicContact CB-CD2 3.25Å; A47-Y118 HydrophobicContact CB-CE2 3.41Å; A47-Y118 VanDerWaalsContact CB-CE2 3.41Å; A47-Y118 HydrophobicContact CB-CG 4.33Å; A47-A121 HydrophobicContact CB-CB 4.06Å
48	V	93	Very high	91.6	Very high	8 Å²	8	67.1 Å²	67.1	5%	0.048	34%	0.338	C	S	.	.	S	Bend	trans	-110.9	177.6	178.5	-61.1	0	0	0	0	111	L45 M51 V68 L111 Y118	L45-V48 PolarHBondContact O-N 3.49Å; V48-M51 HydrophobicContact CG2-CB 3.85Å; V48-M51 HydrophobicContact CG2-SD 4.3Å; V48-V68 HydrophobicContact CB-CG2 4.16Å; V48-V68 HydrophobicContact CG1-CG2 3.97Å; V48-V68 HydrophobicContact CG2-CG2 4.24Å; V48-L111 HydrophobicContact CG1-CD1 4.12Å; V48-L111 HydrophobicContact CG1-CD2 4.23Å; V48-Y118 HydrophobicContact CG1-CD2 4.3Å
49	N	94.2	Very high	91	Very high	93 Å²	93	64.7 Å²	64.7	50%	0.497	33%	0.331	S	S	.	.	S	Bend	trans	-83	-44.4	176.9	-168.8	69.2	0	0	0	111.5	E69 T70	N49-E69 WeakPolarHBondContact CA-O 3.47Å; N49-E69 HydrophobicContact CB-CB 4.41Å; N49-E69 HydrophobicContact CB-CG 4.31Å; N49-E69 VanDerWaalsContact CB-O 3.32Å; N49-E69 WeakPolarHBondContact CB-O 3.34Å; N49-E69 PolarHBondContact N-O 3.47Å; N49-E69 PolarHBondContact ND2-OE1 3.36Å; N49-T70 WeakPolarHBondContact CB-O 3.39Å
50	N	94.1	Very high	90.3	Very high	66 Å²	66	64.4 Å²	64.4	35%	0.353	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	145.8	176.6	-169.8	22.9	0	0	0	109.7	E69	N50-E69 HydrophobicContact CB-CB 4.08Å; N50-E69 PolarHBondContact N-O 3.06Å; N50-E69 VanDerWaalsContact N-O 3.08Å; N50-E69 PolarHBondContact O-N 3.36Å
51	M	94.6	Very high	89.8	Confident	6 Å²	6	67.3 Å²	67.3	3%	0.03	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	136	177	-160.2	173.5	-172.3	0	0	110.1	V40 V41 V44 L45 V48 I66 N67 V68 L78 V107	V40-M51 HydrophobicContact CG1-CE 4.4Å; V41-M51 HydrophobicContact CB-CG 4.46Å; V41-M51 HydrophobicContact CG1-CB 4.11Å; V41-M51 HydrophobicContact CG1-CG 4.23Å; V41-M51 VanDerWaalsContact CG1-O 3.29Å; V41-M51 WeakPolarHBondContact CG1-O 3.48Å; V41-M51 HydrophobicContact CG2-CG 4.03Å; V44-M51 HydrophobicContact CG2-CE 4.02Å; V44-M51 HydrophobicContact CG2-SD 3.51Å; V44-M51 VanDerWaalsContact CG2-SD 3.51Å; L45-M51 HydrophobicContact CD1-CB 3.8Å; V48-M51 HydrophobicContact CG2-CB 3.85Å; V48-M51 HydrophobicContact CG2-SD 4.3Å; M51-I66 HydrophobicContact CE-CG2 3.72Å; M51-I66 HydrophobicContact CG-CG2 4.01Å; M51-N67 CarbonylContact C-O 3.53Å; M51-N67 VanDerWaalsContact CA-O 3.32Å; M51-N67 WeakPolarHBondContact CA-O 3.42Å; M51-V68 HydrophobicContact CB-CG2 4.35Å; M51-V68 HydrophobicContact CE-CB 4.18Å; M51-V68 HydrophobicContact CE-CG2 4.27Å; M51-V68 HydrophobicContact CG-CB 3.92Å; M51-V68 HydrophobicContact CG-CG2 3.94Å; M51-V68 HydrophobicContact SD-CB 4.38Å; M51-V68 HydrophobicContact SD-CG2 4.03Å; M51-L78 HydrophobicContact CE-CD1 4.39Å; M51-V107 HydrophobicContact CE-CG2 4.04Å
52	F	94.9	Very high	89.4	Confident	65 Å²	65	71.1 Å²	71.1	29%	0.285	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	150.6	-177.5	55.8	-83.7	0	0	0	111.1	N67 F92	F52-N67 HydrophobicContact CD1-CB 4.4Å; F52-N67 HydrophobicContact CD2-CB 4.07Å; F52-N67 HydrophobicContact CE1-CB 4Å; F52-N67 HydrophobicContact CE2-CB 3.66Å; F52-N67 WeakPolarHBondContact CE2-ND2 3.36Å; F52-N67 HydrophobicContact CG-CB 4.43Å; F52-N67 HydrophobicContact CZ-CB 3.61Å; F52-N67 PolarHBondContact N-O 3.13Å; F52-N67 PolarHBondContact O-N 3.43Å; F52-F92 HydrophobicContact CE1-CE1 4.27Å; F52-F92 HydrophobicContact CE1-CE2 4.41Å; F52-F92 HydrophobicContact CE1-CZ 4.1Å; F52-F92 HydrophobicContact CZ-CD1 4.37Å; F52-F92 HydrophobicContact CZ-CD2 4.3Å; F52-F92 HydrophobicContact CZ-CE1 4.39Å; F52-F92 HydrophobicContact CZ-CE2 4.34Å; F52-F92 HydrophobicContact CZ-CG 4.29Å; F52-F92 HydrophobicContact CZ-CZ 4.35Å
53	V	94.3	Very high	89.3	Confident	21 Å²	21	66.1 Å²	66.1	13%	0.127	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	134.3	171.1	-173.8	0	0	0	0	109.2	A37 E38 V41 K55 Y65	A37-V53 HydrophobicContact CB-CG1 4.45Å; A37-V53 HydrophobicContact CB-CG2 3.78Å; E38-V53 HydrophobicContact CG-CG2 3.67Å; V41-V53 HydrophobicContact CG2-CG2 4.12Å; V53-K55 PolarHBondContact O-N 3.4Å; V53-Y65 WeakPolarHBondContact CA-O 3.32Å; V53-Y65 WeakPolarHBondContact CG1-O 3.41Å
54	S	93.2	Very high	89.5	Confident	4 Å²	4	62.5 Å²	62.5	3%	0.028	32%	0.319	C	S	.	.			trans	-60.5	131.2	176.6	174.9	0	0	0	0	110.3	S56 L57 C59 Y65 D93	S54-S56 PolarHBondContact OG-N 3.29Å; S54-L57 WeakPolarHBondContact OG-CB 3.44Å; S54-L57 WeakPolarHBondContact OG-CG 3.46Å; S54-L57 PolarHBondContact OG-N 3.17Å; S54-C59 PolarHBondContact O-SG 2.89Å; S54-C59 VanDerWaalsContact O-SG 3.39Å; S54-Y65 WeakPolarHBondContact CB-O 3.35Å; S54-Y65 PolarHBondContact N-O 3.09Å; S54-D93 VanDerWaalsContact CB-OD1 3.26Å; S54-D93 WeakPolarHBondContact CB-OD1 3.27Å; S54-D93 PolarHBondContact OG-OD1 3.22Å
55	K	89.1	Confident	89.7	Confident	202 Å²	202	64.3 Å²	64.3	88%	0.878	33%	0.325	S	S	*	.	S	Bend	trans	-96.7	-16	172.4	-62.4	-177.7	-178.7	-179.9	0	112.3	V53	V53-K55 PolarHBondContact O-N 3.4Å
56	S	89	Confident	89.9	Confident	95 Å²	95	60.9 Å²	60.9	66%	0.664	31%	0.308	S	S	*	.	S	Bend	trans	-87.2	-33.4	-177.3	-57.1	0	0	0	0	111.3	S54	S54-S56 PolarHBondContact OG-N 3.29Å
57	L	87.8	Confident	90.1	Very high	39 Å²	39	55.7 Å²	55.7	20%	0.204	29%	0.285	C	S	.	.	S	Bend	trans	-89.2	148.1	179.2	-59.8	171.5	0	0	0	110.9	S54 C59 Y65 C77 D93 V95	S54-L57 WeakPolarHBondContact OG-CB 3.44Å; S54-L57 WeakPolarHBondContact OG-CG 3.46Å; S54-L57 PolarHBondContact OG-N 3.17Å; L57-C59 PolarHBondContact O-N 2.93Å; L57-C59 VanDerWaalsContact O-N 3.13Å; L57-Y65 HydrophobicContact CB-CD2 3.59Å; L57-Y65 HydrophobicContact CB-CE2 4.24Å; L57-Y65 HydrophobicContact CB-CG 3.78Å; L57-Y65 HydrophobicContact CD1-CD1 3.71Å; L57-Y65 HydrophobicContact CD1-CD2 4.25Å; L57-Y65 HydrophobicContact CD1-CE1 4.42Å; L57-Y65 HydrophobicContact CD1-CG 3.59Å; L57-Y65 HydrophobicContact CG-CG 4.32Å; L57-C77 VanDerWaalsContact CD1-SG 3.6Å; L57-D93 HydrophobicContact CG-CB 4.43Å; L57-V95 HydrophobicContact CD1-CG2 3.59Å; L57-V95 HydrophobicContact CD2-CG2 3.8Å; L57-V95 HydrophobicContact CG-CG2 4.35Å
58	R	80.7	Confident	90.4	Very high	227 Å²	227	55.7 Å²	55.7	86%	0.857	29%	0.285	S	S	*	.			trans	-69.9	111.4	-179.8	-68.2	-168.1	-178.3	-161	1.6	109.5	Y65	R58-Y65 WeakPolarHBondContact O-CD2 3.31Å; R58-Y65 WeakPolarHBondContact O-CE2 3.44Å
59	C	79.8	Confident	90.5	Very high	45 Å²	45	56.3 Å²	56.3	30%	0.304	29%	0.287	S	S	.	.			trans	-92.8	115.2	167.8	-51.9	0	0	0	0	107.2	S54 L57 V63	S54-C59 PolarHBondContact O-SG 2.89Å; S54-C59 VanDerWaalsContact O-SG 3.39Å; L57-C59 PolarHBondContact O-N 2.93Å; L57-C59 VanDerWaalsContact O-N 3.13Å; C59-V63 CarbonylContact C-O 3.53Å; C59-V63 WeakPolarHBondContact CA-O 3.41Å
60	A	78.9	Confident	90.5	Very high	50 Å²	50	51.9 Å²	51.9	41%	0.413	26%	0.264	S	S	.	.			trans	-111.6	177.5	174.2	0	0	0	0	0	109.4	D62 V63	A60-D62 PolarHBondContact O-N 3.34Å; A60-V63 HydrophobicContact CB-CG1 4.33Å; A60-V63 PolarHBondContact N-O 3.36Å; A60-V63 PolarHBondContact O-N 3.02Å
61	D	82	Confident	90.4	Very high	89 Å²	89	53.5 Å²	53.5	48%	0.476	27%	0.268	S	S	.	.	S	Bend	trans	-59.3	-31.1	177.9	-60	-97.8	0	0	0	112.9	M33	M33-D61 WeakPolarHBondContact CB-O 3.48Å; M33-D61 PolarHBondContact N-O 3.12Å
62	D	86.9	Confident	90.3	Very high	96 Å²	96	56.8 Å²	56.8	51%	0.513	28%	0.283	S	S	.	.	S	Bend	trans	-92	-21.4	-177.1	-171.7	-110.6	0	0	0	113.8	A60	A60-D62 PolarHBondContact O-N 3.34Å
63	V	91.1	Very high	90.1	Very high	26 Å²	26	63.3 Å²	63.3	16%	0.158	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	133.9	-172.7	63.8	0	0	0	0	112.4	C59 A60 Y65 E79 L80 T81	C59-V63 CarbonylContact C-O 3.53Å; C59-V63 WeakPolarHBondContact CA-O 3.41Å; A60-V63 HydrophobicContact CB-CG1 4.33Å; A60-V63 PolarHBondContact N-O 3.36Å; A60-V63 PolarHBondContact O-N 3.02Å; V63-Y65 HydrophobicContact CG2-CE2 4.01Å; V63-E79 HydrophobicContact CG2-CG 3.52Å; V63-L80 WeakPolarHBondContact CA-O 3.25Å; V63-T81 HydrophobicContact CB-CG2 4.09Å; V63-T81 HydrophobicContact CG2-CG2 3.79Å
64	A	93.3	Very high	90	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151.3	172	0	0	0	0	0	110.9	M33 A37 L80	M33-A64 HydrophobicContact CB-CB 4.02Å; M33-A64 HydrophobicContact CG-CB 3.78Å; M33-A64 WeakPolarHBondContact O-CB 3.49Å; A37-A64 HydrophobicContact CB-CB 3.77Å; A64-L80 PolarHBondContact N-O 2.91Å; A64-L80 PolarHBondContact O-N 3.46Å
65	Y	94.9	Very high	90.1	Very high	37 Å²	37	71.1 Å²	71.1	15%	0.145	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133.2	178.8	-65.6	-88.3	0	0	0	110.5	V53 S54 L57 R58 V63 L78 E79 V88 V95	V53-Y65 WeakPolarHBondContact CA-O 3.32Å; V53-Y65 WeakPolarHBondContact CG1-O 3.41Å; S54-Y65 WeakPolarHBondContact CB-O 3.35Å; S54-Y65 PolarHBondContact N-O 3.09Å; L57-Y65 HydrophobicContact CB-CD2 3.59Å; L57-Y65 HydrophobicContact CB-CE2 4.24Å; L57-Y65 HydrophobicContact CB-CG 3.78Å; L57-Y65 HydrophobicContact CD1-CD1 3.71Å; L57-Y65 HydrophobicContact CD1-CD2 4.25Å; L57-Y65 HydrophobicContact CD1-CE1 4.42Å; L57-Y65 HydrophobicContact CD1-CG 3.59Å; L57-Y65 HydrophobicContact CG-CG 4.32Å; R58-Y65 WeakPolarHBondContact O-CD2 3.31Å; R58-Y65 WeakPolarHBondContact O-CE2 3.44Å; V63-Y65 HydrophobicContact CG2-CE2 4.01Å; Y65-L78 CarbonylContact C-O 3.59Å; Y65-L78 VanDerWaalsContact CA-O 3.26Å; Y65-L78 WeakPolarHBondContact CA-O 3.38Å; Y65-E79 HydrophobicContact CD1-CB 4.18Å; Y65-E79 HydrophobicContact CD1-CG 4.37Å; Y65-E79 HydrophobicContact CE1-CB 4Å; Y65-E79 HydrophobicContact CE1-CG 3.9Å; Y65-V88 HydrophobicContact CD1-CG2 4.2Å; Y65-V88 HydrophobicContact CE1-CG2 4.27Å; Y65-V95 HydrophobicContact CD1-CG2 4.07Å; Y65-V95 HydrophobicContact CE1-CG1 4.48Å; Y65-V95 HydrophobicContact CE1-CG2 3.73Å
66	I	95.6	Very high	90.4	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.8	-176.7	-52.3	168.4	0	0	0	108.9	A37 V40 V41 M51 L78 L80	A37-I66 HydrophobicContact CB-CD1 3.68Å; A37-I66 HydrophobicContact CB-CG1 3.71Å; V40-I66 HydrophobicContact CG1-CD1 4.21Å; V41-I66 HydrophobicContact CG2-CG2 3.66Å; M51-I66 HydrophobicContact CE-CG2 3.72Å; M51-I66 HydrophobicContact CG-CG2 4.01Å; I66-L78 HydrophobicContact CB-CB 4.29Å; I66-L78 PolarHBondContact N-O 3.1Å; I66-L78 WeakPolarHBondContact O-CB 3.15Å; I66-L78 PolarHBondContact O-N 2.9Å; I66-L80 HydrophobicContact CD1-CB 4.2Å; I66-L80 HydrophobicContact CD1-CD2 4.33Å
67	N	95.8	Very high	90.7	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	130.9	172.7	-72.4	-39.9	0	0	0	109.3	M51 F52 C77 F92 D93	M51-N67 CarbonylContact C-O 3.53Å; M51-N67 VanDerWaalsContact CA-O 3.32Å; M51-N67 WeakPolarHBondContact CA-O 3.42Å; F52-N67 HydrophobicContact CD1-CB 4.4Å; F52-N67 HydrophobicContact CD2-CB 4.07Å; F52-N67 HydrophobicContact CE1-CB 4Å; F52-N67 HydrophobicContact CE2-CB 3.66Å; F52-N67 WeakPolarHBondContact CE2-ND2 3.36Å; F52-N67 HydrophobicContact CG-CB 4.43Å; F52-N67 HydrophobicContact CZ-CB 3.61Å; F52-N67 PolarHBondContact N-O 3.13Å; F52-N67 PolarHBondContact O-N 3.43Å; N67-C77 PolarHBondContact OD1-SG 3.01Å; N67-C77 VanDerWaalsContact OD1-SG 3.33Å; N67-F92 HydrophobicContact CB-CD1 3.58Å; N67-F92 HydrophobicContact CB-CE1 4.03Å; N67-F92 HydrophobicContact CB-CG 4.3Å; N67-F92 WeakPolarHBondContact OD1-CA 3.47Å; N67-D93 PolarHBondContact ND2-OD1 3.12Å; N67-D93 PolarHBondContact OD1-N 2.82Å
68	V	95.1	Very high	91	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135.4	177.7	63	0	0	0	0	111	V48 M51 R75 Y76 L78 L111	V48-V68 HydrophobicContact CB-CG2 4.16Å; V48-V68 HydrophobicContact CG1-CG2 3.97Å; V48-V68 HydrophobicContact CG2-CG2 4.24Å; M51-V68 HydrophobicContact CB-CG2 4.35Å; M51-V68 HydrophobicContact CE-CB 4.18Å; M51-V68 HydrophobicContact CE-CG2 4.27Å; M51-V68 HydrophobicContact CG-CB 3.92Å; M51-V68 HydrophobicContact CG-CG2 3.94Å; M51-V68 HydrophobicContact SD-CB 4.38Å; M51-V68 HydrophobicContact SD-CG2 4.03Å; V68-R75 CarbonylContact O-C 3.6Å; V68-R75 WeakPolarHBondContact O-CA 3.37Å; V68-Y76 HydrophobicContact CG1-CD2 4.23Å; V68-Y76 PolarHBondContact N-O 2.65Å; V68-Y76 PolarHBondContact O-N 3.11Å; V68-L78 HydrophobicContact CG1-CD1 3.93Å; V68-L78 HydrophobicContact CG1-CG 4.11Å; V68-L111 HydrophobicContact CG2-CD2 4.3Å
69	E	95.6	Very high	91.7	Very high	21 Å²	21	46.7 Å²	46.7	10%	0.098	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	114.8	168.2	-165.6	172.9	66.1	0	0	108.3	N49 N50 N74 R75 F92	N49-E69 WeakPolarHBondContact CA-O 3.47Å; N49-E69 HydrophobicContact CB-CB 4.41Å; N49-E69 HydrophobicContact CB-CG 4.31Å; N49-E69 VanDerWaalsContact CB-O 3.32Å; N49-E69 WeakPolarHBondContact CB-O 3.34Å; N49-E69 PolarHBondContact N-O 3.47Å; N49-E69 PolarHBondContact ND2-OE1 3.36Å; N50-E69 HydrophobicContact CB-CB 4.08Å; N50-E69 PolarHBondContact N-O 3.06Å; N50-E69 VanDerWaalsContact N-O 3.08Å; N50-E69 PolarHBondContact O-N 3.36Å; E69-N74 WeakPolarHBondContact CA-O 3.48Å; E69-R75 HydrophobicContact CB-CG 4.44Å; E69-R75 HydrophobicContact CG-CG 4.01Å; E69-R75 IonicContact OE2-CZ 3.42Å; E69-R75 IonicContact OE2-NE 2.82Å; E69-R75 PolarHBondContact OE2-NE 3.15Å; E69-R75 IonicContact OE2-NH2 3.09Å; E69-R75 PolarHBondContact OE2-NH2 3.15Å; E69-R75 VanDerWaalsContact OE2-NH2 3.09Å; E69-F92 HydrophobicContact CB-CE1 4.28Å; E69-F92 HydrophobicContact CB-CZ 3.91Å; E69-F92 HydrophobicContact CG-CZ 4.5Å
70	T	93.9	Very high	92.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.212	C	C	.	.			trans	-69.9	163.1	175.6	59.7	0	0	0	0	110.9	N49 E72 R73 N74 Y76	N49-T70 WeakPolarHBondContact CB-O 3.39Å; T70-E72 PolarHBondContact O-N 3.39Å; T70-E72 VanDerWaalsContact O-N 3.14Å; T70-R73 WeakPolarHBondContact O-CA 3.08Å; T70-R73 PolarHBondContact O-N 3.23Å; T70-N74 PolarHBondContact N-O 3.04Å; T70-N74 WeakPolarHBondContact OG1-CB 3.28Å; T70-N74 PolarHBondContact OG1-N 3.39Å; T70-N74 VanDerWaalsContact OG1-N 3.1Å; T70-N74 PolarHBondContact OG1-O 3.17Å; T70-Y76 HydrophobicContact CG2-CD2 4.13Å; T70-Y76 HydrophobicContact CG2-CE2 3.74Å
71	K	91.1	Very high	93	Very high	101 Å²	101	43.8 Å²	43.8	44%	0.439	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.3	174	-70.3	-174.1	175.6	173.7	0	113.3	A47 R73 A117	A47-K71 WeakPolarHBondContact O-CE 3.31Å; K71-R73 PolarHBondContact O-N 3.21Å; K71-A117 HydrophobicContact CB-CB 3.91Å
72	E	92.5	Very high	93.3	Very high	75 Å²	75	46.9 Å²	46.9	35%	0.35	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	2.8	174.1	-63.6	153.1	81.9	0	0	112.7	T70 N74 S115 P116 A117	T70-E72 PolarHBondContact O-N 3.39Å; T70-E72 VanDerWaalsContact O-N 3.14Å; E72-N74 PolarHBondContact O-N 3.09Å; E72-S115 VanDerWaalsContact OE2-CA 3.26Å; E72-S115 WeakPolarHBondContact OE2-CA 3.1Å; E72-S115 WeakPolarHBondContact OE2-CB 3.46Å; E72-S115 PolarHBondContact OE2-OG 2.8Å; E72-P116 VanDerWaalsContact OE1-CD 3.27Å; E72-P116 WeakPolarHBondContact OE1-CD 3.43Å; E72-P116 VanDerWaalsContact OE1-CG 3.25Å; E72-P116 WeakPolarHBondContact OE1-CG 3.33Å; E72-P116 VanDerWaalsContact OE2-CD 3.28Å; E72-P116 WeakPolarHBondContact OE2-CD 3.25Å; E72-A117 HydrophobicContact CG-CB 4.25Å
73	R	91.5	Very high	93.5	Very high	202 Å²	202	45.5 Å²	45.5	76%	0.762	21%	0.212	S	C	*	.			trans	63.1	17.6	-174.1	-57	-164.5	177.1	-153.4	0.6	114.9	T70 K71	T70-R73 WeakPolarHBondContact O-CA 3.08Å; T70-R73 PolarHBondContact O-N 3.23Å; K71-R73 PolarHBondContact O-N 3.21Å
74	N	93.3	Very high	93.5	Very high	66 Å²	66	44.7 Å²	44.7	35%	0.353	21%	0.209	S	C	.	.			trans	-80.2	133.4	169.3	-56.7	-42.8	0	0	0	109.3	E69 T70 E72 Y76	E69-N74 WeakPolarHBondContact CA-O 3.48Å; T70-N74 PolarHBondContact N-O 3.04Å; T70-N74 WeakPolarHBondContact OG1-CB 3.28Å; T70-N74 PolarHBondContact OG1-N 3.39Å; T70-N74 VanDerWaalsContact OG1-N 3.1Å; T70-N74 PolarHBondContact OG1-O 3.17Å; E72-N74 PolarHBondContact O-N 3.09Å; N74-Y76 HydrophobicContact CB-CE2 3.58Å; N74-Y76 WeakPolarHBondContact CB-OH 3.5Å
75	R	95.3	Very high	93.6	Very high	123 Å²	123	44.9 Å²	44.9	46%	0.464	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.2	-178.6	-64.6	175.2	-179.4	169.5	-0.3	109.8	V68 E69 Y90 F92	V68-R75 CarbonylContact O-C 3.6Å; V68-R75 WeakPolarHBondContact O-CA 3.37Å; E69-R75 HydrophobicContact CB-CG 4.44Å; E69-R75 HydrophobicContact CG-CG 4.01Å; E69-R75 IonicContact OE2-CZ 3.42Å; E69-R75 IonicContact OE2-NE 2.82Å; E69-R75 PolarHBondContact OE2-NE 3.15Å; E69-R75 IonicContact OE2-NH2 3.09Å; E69-R75 PolarHBondContact OE2-NH2 3.15Å; E69-R75 VanDerWaalsContact OE2-NH2 3.09Å; R75-Y90 CarbonylContact O-C 3.51Å; R75-Y90 WeakPolarHBondContact O-CA 3.49Å; R75-F92 HydrophobicContact CB-CD1 4.18Å; R75-F92 HydrophobicContact CB-CE1 4Å; R75-F92 HydrophobicContact CB-CZ 4.4Å; R75-F92 HydrophobicContact CG-CD1 4.41Å; R75-F92 HydrophobicContact CG-CE1 3.9Å; R75-F92 HydrophobicContact CG-CE2 4.19Å; R75-F92 HydrophobicContact CG-CZ 3.8Å
76	Y	94.9	Very high	93.5	Very high	28 Å²	28	44.9 Å²	44.9	11%	0.11	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.8	177.7	-53	-83.4	0	0	0	109.9	V68 T70 N74 V87 G89 Y90 L114	V68-Y76 HydrophobicContact CG1-CD2 4.23Å; V68-Y76 PolarHBondContact N-O 2.65Å; V68-Y76 PolarHBondContact O-N 3.11Å; T70-Y76 HydrophobicContact CG2-CD2 4.13Å; T70-Y76 HydrophobicContact CG2-CE2 3.74Å; N74-Y76 HydrophobicContact CB-CE2 3.58Å; N74-Y76 WeakPolarHBondContact CB-OH 3.5Å; Y76-V87 HydrophobicContact CD1-CG1 4.18Å; Y76-G89 WeakPolarHBondContact CA-O 3.32Å; Y76-Y90 AromaticContact CD1-CD1 3.64Å; Y76-Y90 HydrophobicContact CD1-CD1 3.64Å; Y76-Y90 HydrophobicContact CD1-CE1 4.09Å; Y76-Y90 AromaticContact CE1-CD1 3.59Å; Y76-Y90 HydrophobicContact CE1-CD1 3.59Å; Y76-Y90 AromaticContact CE1-CE1 3.89Å; Y76-Y90 HydrophobicContact CE1-CE1 3.89Å; Y76-L114 HydrophobicContact CD1-CD2 4.49Å; Y76-L114 HydrophobicContact CD2-CD1 4.36Å; Y76-L114 HydrophobicContact CE1-CD2 4.18Å; Y76-L114 HydrophobicContact CE2-CB 4.38Å; Y76-L114 HydrophobicContact CG-CD1 4.36Å
77	C	95.1	Very high	93.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.6	164.8	-163	0	0	0	0	108	L57 N67 V88 G89 A91 Q94	L57-C77 VanDerWaalsContact CD1-SG 3.6Å; N67-C77 PolarHBondContact OD1-SG 3.01Å; N67-C77 VanDerWaalsContact OD1-SG 3.33Å; C77-V88 HydrophobicContact CB-CG2 4.09Å; C77-V88 WeakPolarHBondContact O-CG2 3.41Å; C77-V88 PolarHBondContact O-N 3.26Å; C77-G89 PolarHBondContact N-O 3.47Å; C77-G89 PolarHBondContact O-N 2.78Å; C77-A91 WeakPolarHBondContact CB-O 3.45Å; C77-Q94 WeakPolarHBondContact CB-O 3.23Å
78	L	94.7	Very high	93.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.5	-177.8	-50	-178.4	0	0	0	109	M51 Y65 I66 V68 K86 V87 L110 L114	M51-L78 HydrophobicContact CE-CD1 4.39Å; Y65-L78 CarbonylContact C-O 3.59Å; Y65-L78 VanDerWaalsContact CA-O 3.26Å; Y65-L78 WeakPolarHBondContact CA-O 3.38Å; I66-L78 HydrophobicContact CB-CB 4.29Å; I66-L78 PolarHBondContact N-O 3.1Å; I66-L78 WeakPolarHBondContact O-CB 3.15Å; I66-L78 PolarHBondContact O-N 2.9Å; V68-L78 HydrophobicContact CG1-CD1 3.93Å; V68-L78 HydrophobicContact CG1-CG 4.11Å; L78-K86 CarbonylContact C-O 3.11Å; L78-K86 WeakPolarHBondContact CA-O 3.33Å; L78-V87 HydrophobicContact CD2-CB 4.3Å; L78-V87 HydrophobicContact CD2-CG2 3.76Å; L78-L110 HydrophobicContact CD1-CD2 3.58Å; L78-L110 HydrophobicContact CD2-CD2 3.73Å; L78-L110 HydrophobicContact CG-CD2 4.2Å; L78-L114 HydrophobicContact CD2-CD1 4.36Å
79	E	94.2	Very high	93.4	Very high	22 Å²	22	45.5 Å²	45.5	10%	0.103	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.2	167.8	-175.3	-166.4	99.9	0	0	107.8	V63 Y65 T81 L85 K86 V88 Y103	V63-E79 HydrophobicContact CG2-CG 3.52Å; Y65-E79 HydrophobicContact CD1-CB 4.18Å; Y65-E79 HydrophobicContact CD1-CG 4.37Å; Y65-E79 HydrophobicContact CE1-CB 4Å; Y65-E79 HydrophobicContact CE1-CG 3.9Å; E79-T81 HydrophobicContact CG-CG2 3.98Å; E79-T81 WeakPolarHBondContact OE1-CG2 3.35Å; E79-L85 VanDerWaalsContact O-CA 3.32Å; E79-L85 WeakPolarHBondContact O-CA 2.85Å; E79-K86 HydrophobicContact CB-CG 4Å; E79-K86 PolarHBondContact N-O 3.39Å; E79-K86 PolarHBondContact O-N 3.39Å; E79-K86 WeakPolarHBondContact OE1-CE 3.19Å; E79-K86 IonicContact OE1-NZ 2.9Å; E79-K86 PolarHBondContact OE1-NZ 3.23Å; E79-K86 WeakPolarHBondContact OE2-CE 3.49Å; E79-K86 IonicContact OE2-NZ 2.92Å; E79-K86 PolarHBondContact OE2-NZ 3.02Å; E79-V88 HydrophobicContact CB-CG1 3.58Å; E79-V88 HydrophobicContact CB-CG2 4.27Å; E79-Y103 PolarHBondContact OE1-OH 2.76Å
80	L	93.1	Very high	93.3	Very high	13 Å²	13	51 Å²	51	7%	0.068	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.4	172.7	178.8	72.1	0	0	0	108.1	M33 E36 A37 V63 A64 I66 G84 L85	M33-L80 HydrophobicContact CG-CB 4.34Å; M33-L80 HydrophobicContact CG-CD2 3.95Å; M33-L80 HydrophobicContact CG-CG 3.91Å; M33-L80 VanDerWaalsContact CG-O 3.29Å; M33-L80 WeakPolarHBondContact CG-O 3.36Å; M33-L80 HydrophobicContact SD-CB 4.49Å; M33-L80 HydrophobicContact SD-CD1 4.4Å; M33-L80 HydrophobicContact SD-CD2 3.65Å; M33-L80 HydrophobicContact SD-CG 3.51Å; M33-L80 VanDerWaalsContact SD-CG 3.51Å; E36-L80 HydrophobicContact CB-CD2 3.97Å; A37-L80 HydrophobicContact CB-CD2 3.87Å; V63-L80 WeakPolarHBondContact CA-O 3.25Å; A64-L80 PolarHBondContact N-O 2.91Å; A64-L80 PolarHBondContact O-N 3.46Å; I66-L80 HydrophobicContact CD1-CB 4.2Å; I66-L80 HydrophobicContact CD1-CD2 4.33Å; L80-G84 WeakPolarHBondContact CA-O 3.06Å; L80-L85 HydrophobicContact CD1-CD1 3.53Å; L80-L85 HydrophobicContact CD1-CD2 4.22Å; L80-L85 HydrophobicContact CD1-CG 3.5Å; L80-L85 VanDerWaalsContact CD1-CG 3.5Å
81	T	92.5	Very high	93.3	Very high	20 Å²	20	52.6 Å²	52.6	12%	0.123	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	178.8	176.7	56.8	0	0	0	0	109.2	M33 V63 E79 A83 G84	M33-T81 VanDerWaalsContact CE-C 3.49Å; V63-T81 HydrophobicContact CB-CG2 4.09Å; V63-T81 HydrophobicContact CG2-CG2 3.79Å; E79-T81 HydrophobicContact CG-CG2 3.98Å; E79-T81 WeakPolarHBondContact OE1-CG2 3.35Å; T81-A83 PolarHBondContact O-N 3.14Å; T81-A83 VanDerWaalsContact O-N 3.16Å; T81-A83 PolarHBondContact OG1-N 3.34Å; T81-G84 PolarHBondContact N-O 2.77Å; T81-G84 PolarHBondContact O-N 3.27Å
82	E	89.1	Confident	93.5	Very high	154 Å²	154	50.4 Å²	50.4	72%	0.72	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.4	171.7	-62.9	-165	92.6	0	0	113.5	M33 G84	M33-E82 HydrophobicContact CE-CG 4.08Å; E82-G84 PolarHBondContact O-N 3.18Å
83	A	90.3	Very high	93.5	Very high	68 Å²	68	49.4 Å²	49.4	56%	0.562	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-11.3	176.1	0	0	0	0	0	113.6	T81 Y103	T81-A83 PolarHBondContact O-N 3.14Å; T81-A83 VanDerWaalsContact O-N 3.16Å; T81-A83 PolarHBondContact OG1-N 3.34Å; A83-Y103 HydrophobicContact CB-CD1 4Å; A83-Y103 HydrophobicContact CB-CE1 4.16Å; A83-Y103 HydrophobicContact CB-CG 4.4Å
84	G	92.8	Very high	93.5	Very high	8 Å²	8	43.6 Å²	43.6	8%	0.082	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	115.1	-147.6	-177.1	0	0	0	0	0	112.6	L80 T81 E82 H104	L80-G84 WeakPolarHBondContact CA-O 3.06Å; T81-G84 PolarHBondContact N-O 2.77Å; T81-G84 PolarHBondContact O-N 3.27Å; E82-G84 PolarHBondContact O-N 3.18Å; G84-H104 WeakPolarHBondContact CA-O 3.48Å
85	L	93.6	Very high	93.4	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134	-175.7	-64.3	87.6	0	0	0	111.5	V40 E79 L80 H104 V107 L110	V40-L85 HydrophobicContact CG1-CD2 4.4Å; E79-L85 VanDerWaalsContact O-CA 3.32Å; E79-L85 WeakPolarHBondContact O-CA 2.85Å; L80-L85 HydrophobicContact CD1-CD1 3.53Å; L80-L85 HydrophobicContact CD1-CD2 4.22Å; L80-L85 HydrophobicContact CD1-CG 3.5Å; L80-L85 VanDerWaalsContact CD1-CG 3.5Å; L85-H104 PolarHBondContact N-O 2.85Å; L85-H104 PolarHBondContact O-N 3.08Å; L85-V107 HydrophobicContact CD2-CB 3.89Å; L85-V107 HydrophobicContact CD2-CG2 4.07Å; L85-L110 HydrophobicContact CB-CD2 3.94Å; L85-L110 HydrophobicContact CD2-CD2 4.4Å
86	K	94.4	Very high	93.2	Very high	36 Å²	36	40.4 Å²	40.4	16%	0.157	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	161.3	169.7	65.7	164.6	174.7	-166.7	0	111.6	L78 E79 V88 Y103	L78-K86 CarbonylContact C-O 3.11Å; L78-K86 WeakPolarHBondContact CA-O 3.33Å; E79-K86 HydrophobicContact CB-CG 4Å; E79-K86 PolarHBondContact N-O 3.39Å; E79-K86 PolarHBondContact O-N 3.39Å; E79-K86 WeakPolarHBondContact OE1-CE 3.19Å; E79-K86 IonicContact OE1-NZ 2.9Å; E79-K86 PolarHBondContact OE1-NZ 3.23Å; E79-K86 WeakPolarHBondContact OE2-CE 3.49Å; E79-K86 IonicContact OE2-NZ 2.92Å; E79-K86 PolarHBondContact OE2-NZ 3.02Å; K86-V88 HydrophobicContact CD-CG1 3.93Å; K86-V88 HydrophobicContact CG-CG1 4.03Å; K86-Y103 HydrophobicContact CB-CD1 3.88Å; K86-Y103 HydrophobicContact CB-CE1 4.04Å; K86-Y103 HydrophobicContact CB-CG 4.19Å; K86-Y103 HydrophobicContact CD-CD1 4.35Å; K86-Y103 HydrophobicContact CD-CE1 3.69Å; K86-Y103 HydrophobicContact CD-CE2 3.93Å; K86-Y103 VanDerWaalsContact CD-CZ 3.46Å; K86-Y103 VanDerWaalsContact CE-OH 3.25Å; K86-Y103 WeakPolarHBondContact CE-OH 3.33Å; K86-Y103 HydrophobicContact CG-CD1 4.04Å; K86-Y103 HydrophobicContact CG-CE1 3.67Å; K86-Y103 PolarHBondContact NZ-OH 2.75Å
87	V	94.9	Very high	92.8	Very high	7 Å²	7	46.3 Å²	46.3	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120	172.2	-175.1	0	0	0	0	109.1	Y76 L78 G89 Y90 L99 T101 L110 L114	Y76-V87 HydrophobicContact CD1-CG1 4.18Å; L78-V87 HydrophobicContact CD2-CB 4.3Å; L78-V87 HydrophobicContact CD2-CG2 3.76Å; V87-G89 WeakPolarHBondContact CG1-O 3.32Å; V87-Y90 HydrophobicContact CG1-CE1 4.35Å; V87-L99 HydrophobicContact CG1-CD2 4.26Å; V87-T101 HydrophobicContact CB-CG2 3.97Å; V87-T101 PolarHBondContact N-OG1 2.9Å; V87-T101 PolarHBondContact O-OG1 3.35Å; V87-L110 HydrophobicContact CG2-CD1 3.93Å; V87-L114 HydrophobicContact CG2-CD1 3.87Å; V87-L114 HydrophobicContact CG2-CD2 4.07Å
88	V	94.4	Very high	92.4	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.036	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-9.8	176.3	-66.3	0	0	0	0	113.1	Y65 C77 E79 K86 V95 D96	Y65-V88 HydrophobicContact CD1-CG2 4.2Å; Y65-V88 HydrophobicContact CE1-CG2 4.27Å; C77-V88 HydrophobicContact CB-CG2 4.09Å; C77-V88 WeakPolarHBondContact O-CG2 3.41Å; C77-V88 PolarHBondContact O-N 3.26Å; E79-V88 HydrophobicContact CB-CG1 3.58Å; E79-V88 HydrophobicContact CB-CG2 4.27Å; K86-V88 HydrophobicContact CD-CG1 3.93Å; K86-V88 HydrophobicContact CG-CG1 4.03Å; V88-V95 HydrophobicContact CB-CG1 4.11Å; V88-V95 HydrophobicContact CG2-CG1 4.38Å; V88-V95 HydrophobicContact CG2-CG2 4.08Å; V88-D96 PolarHBondContact O-N 2.89Å
89	G	94.6	Very high	92.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	161	177	0	0	0	0	0	113.6	Y76 C77 V87 Q94	Y76-G89 WeakPolarHBondContact CA-O 3.32Å; C77-G89 PolarHBondContact N-O 3.47Å; C77-G89 PolarHBondContact O-N 2.78Å; V87-G89 WeakPolarHBondContact CG1-O 3.32Å; G89-Q94 WeakPolarHBondContact CA-O 3.42Å
90	Y	93.8	Very high	91.6	Very high	138 Å²	138	64.7 Å²	64.7	54%	0.541	33%	0.331	S	S	.	.	S	Bend	trans	-104.7	18.3	177.6	-60.3	-72.4	0	0	0	112.4	R75 Y76 V87 L99	R75-Y90 CarbonylContact O-C 3.51Å; R75-Y90 WeakPolarHBondContact O-CA 3.49Å; Y76-Y90 AromaticContact CD1-CD1 3.64Å; Y76-Y90 HydrophobicContact CD1-CD1 3.64Å; Y76-Y90 HydrophobicContact CD1-CE1 4.09Å; Y76-Y90 AromaticContact CE1-CD1 3.59Å; Y76-Y90 HydrophobicContact CE1-CD1 3.59Å; Y76-Y90 AromaticContact CE1-CE1 3.89Å; Y76-Y90 HydrophobicContact CE1-CE1 3.89Å; V87-Y90 HydrophobicContact CG1-CE1 4.35Å; Y90-L99 HydrophobicContact CD2-CD2 4.31Å; Y90-L99 HydrophobicContact CE2-CD1 3.76Å; Y90-L99 HydrophobicContact CE2-CD2 3.69Å; Y90-L99 HydrophobicContact CE2-CG 4.41Å
91	A	93.8	Very high	91.4	Very high	33 Å²	33	65.5 Å²	65.5	27%	0.273	34%	0.337	S	S	.	.	S	Bend	trans	-143.5	160.3	174.1	0	0	0	0	0	109	C77 Q94	C77-A91 WeakPolarHBondContact CB-O 3.45Å; A91-Q94 HydrophobicContact CB-CB 3.98Å; A91-Q94 WeakPolarHBondContact O-CB 3.23Å; A91-Q94 PolarHBondContact O-N 3.09Å
92	F	94.2	Very high	91.4	Very high	54 Å²	54	68.8 Å²	68.8	24%	0.237	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	141.4	175.7	-62.3	-36.5	0	0	0	111.5	F52 N67 E69 R75 Q94	F52-F92 HydrophobicContact CE1-CE1 4.27Å; F52-F92 HydrophobicContact CE1-CE2 4.41Å; F52-F92 HydrophobicContact CE1-CZ 4.1Å; F52-F92 HydrophobicContact CZ-CD1 4.37Å; F52-F92 HydrophobicContact CZ-CD2 4.3Å; F52-F92 HydrophobicContact CZ-CE1 4.39Å; F52-F92 HydrophobicContact CZ-CE2 4.34Å; F52-F92 HydrophobicContact CZ-CG 4.29Å; F52-F92 HydrophobicContact CZ-CZ 4.35Å; N67-F92 HydrophobicContact CB-CD1 3.58Å; N67-F92 HydrophobicContact CB-CE1 4.03Å; N67-F92 HydrophobicContact CB-CG 4.3Å; N67-F92 WeakPolarHBondContact OD1-CA 3.47Å; E69-F92 HydrophobicContact CB-CE1 4.28Å; E69-F92 HydrophobicContact CB-CZ 3.91Å; E69-F92 HydrophobicContact CG-CZ 4.5Å; R75-F92 HydrophobicContact CB-CD1 4.18Å; R75-F92 HydrophobicContact CB-CE1 4Å; R75-F92 HydrophobicContact CB-CZ 4.4Å; R75-F92 HydrophobicContact CG-CD1 4.41Å; R75-F92 HydrophobicContact CG-CE1 3.9Å; R75-F92 HydrophobicContact CG-CE2 4.19Å; R75-F92 HydrophobicContact CG-CZ 3.8Å; F92-Q94 PolarHBondContact O-N 2.85Å
93	D	92.2	Very high	91.6	Very high	55 Å²	55	66.6 Å²	66.6	29%	0.294	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	22.6	177.4	-52.5	-61.7	0	0	0	113.3	S54 L57 N67	S54-D93 VanDerWaalsContact CB-OD1 3.26Å; S54-D93 WeakPolarHBondContact CB-OD1 3.27Å; S54-D93 PolarHBondContact OG-OD1 3.22Å; L57-D93 HydrophobicContact CG-CB 4.43Å; N67-D93 PolarHBondContact ND2-OD1 3.12Å; N67-D93 PolarHBondContact OD1-N 2.82Å
94	Q	92.3	Very high	91.8	Very high	80 Å²	80	65.2 Å²	65.2	37%	0.374	33%	0.326	S	S	.	.			trans	-102.6	126.6	176.4	-178.8	-175.9	90	0	0	109.1	C77 G89 A91 F92	C77-Q94 WeakPolarHBondContact CB-O 3.23Å; G89-Q94 WeakPolarHBondContact CA-O 3.42Å; A91-Q94 HydrophobicContact CB-CB 3.98Å; A91-Q94 WeakPolarHBondContact O-CB 3.23Å; A91-Q94 PolarHBondContact O-N 3.09Å; F92-Q94 PolarHBondContact O-N 2.85Å
95	V	91.4	Very high	91.7	Very high	50 Å²	50	73 Å²	73	30%	0.303	36%	0.361	S	S	.	.			trans	-121.9	119.3	172.7	-177.2	0	0	0	0	107	L57 Y65 V88	L57-V95 HydrophobicContact CD1-CG2 3.59Å; L57-V95 HydrophobicContact CD2-CG2 3.8Å; L57-V95 HydrophobicContact CG-CG2 4.35Å; Y65-V95 HydrophobicContact CD1-CG2 4.07Å; Y65-V95 HydrophobicContact CE1-CG1 4.48Å; Y65-V95 HydrophobicContact CE1-CG2 3.73Å; V88-V95 HydrophobicContact CB-CG1 4.11Å; V88-V95 HydrophobicContact CG2-CG1 4.38Å; V88-V95 HydrophobicContact CG2-CG2 4.08Å
96	D	91.8	Very high	91.6	Very high	71 Å²	71	74.9 Å²	74.9	38%	0.38	37%	0.372	S	S	.	.			trans	-115.8	103.1	178.3	-164.4	-74.3	0	0	0	108.8	V88 H98 L99	V88-D96 PolarHBondContact O-N 2.89Å; D96-H98 PolarHBondContact O-N 2.95Å; D96-H98 VanDerWaalsContact O-N 3.15Å; D96-H98 VanDerWaalsContact OD1-CB 3.32Å; D96-H98 WeakPolarHBondContact OD1-CB 3.38Å; D96-H98 PolarHBondContact OD1-N 2.88Å; D96-H98 VanDerWaalsContact OD1-N 3.15Å; D96-L99 HydrophobicContact CB-CB 4.25Å; D96-L99 VanDerWaalsContact O-CB 3.31Å; D96-L99 WeakPolarHBondContact O-CB 3.26Å; D96-L99 PolarHBondContact O-N 2.9Å; D96-L99 PolarHBondContact OD1-N 3.28Å
97	D	85.2	Confident	91.4	Very high	152 Å²	152	73.4 Å²	73.4	81%	0.813	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-16.7	-179.9	-78.2	-90.8	0	0	0	113.6	L99	D97-L99 VanDerWaalsContact C-N 3.29Å
98	H	87.7	Confident	91.3	Very high	170 Å²	170	77.4 Å²	77.4	79%	0.787	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-11.8	176.8	-60.8	-94.4	0	0	0	112.2	D96 Q100	D96-H98 PolarHBondContact O-N 2.95Å; D96-H98 VanDerWaalsContact O-N 3.15Å; D96-H98 VanDerWaalsContact OD1-CB 3.32Å; D96-H98 WeakPolarHBondContact OD1-CB 3.38Å; D96-H98 PolarHBondContact OD1-N 2.88Å; D96-H98 VanDerWaalsContact OD1-N 3.15Å; H98-Q100 PolarHBondContact O-N 2.71Å; H98-Q100 VanDerWaalsContact O-N 3.17Å
99	L	88.3	Confident	91.2	Very high	46 Å²	46	79.9 Å²	79.9	24%	0.241	40%	0.399	C	S	.	.			trans	-80.1	98.8	-179.6	-168.4	64.2	0	0	0	110.9	V87 Y90 D96 D97 T101	V87-L99 HydrophobicContact CG1-CD2 4.26Å; Y90-L99 HydrophobicContact CD2-CD2 4.31Å; Y90-L99 HydrophobicContact CE2-CD1 3.76Å; Y90-L99 HydrophobicContact CE2-CD2 3.69Å; Y90-L99 HydrophobicContact CE2-CG 4.41Å; D96-L99 HydrophobicContact CB-CB 4.25Å; D96-L99 VanDerWaalsContact O-CB 3.31Å; D96-L99 WeakPolarHBondContact O-CB 3.26Å; D96-L99 PolarHBondContact O-N 2.9Å; D96-L99 PolarHBondContact OD1-N 3.28Å; D97-L99 VanDerWaalsContact C-N 3.29Å; L99-T101 VanDerWaalsContact C-N 3.34Å; L99-T101 HydrophobicContact CD1-CG2 4.14Å; L99-T101 HydrophobicContact CD2-CG2 3.91Å; L99-T101 HydrophobicContact CG-CG2 3.68Å; L99-T101 PolarHBondContact O-N 2.92Å; L99-T101 VanDerWaalsContact O-N 3.11Å
100	Q	82.9	Confident	91.1	Very high	192 Å²	192	80 Å²	80	90%	0.897	40%	0.399	S	S	*	.			trans	-86	74.8	175.5	-63.6	-171	-35.4	0	0	110.7	H98	H98-Q100 PolarHBondContact O-N 2.71Å; H98-Q100 VanDerWaalsContact O-N 3.17Å
101	T	89.7	Confident	91	Very high	30 Å²	30	73.4 Å²	73.4	18%	0.184	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-88.9	148.4	168.8	65.6	0	0	0	0	110.9	V87 L99	V87-T101 HydrophobicContact CB-CG2 3.97Å; V87-T101 PolarHBondContact N-OG1 2.9Å; V87-T101 PolarHBondContact O-OG1 3.35Å; L99-T101 VanDerWaalsContact C-N 3.34Å; L99-T101 HydrophobicContact CD1-CG2 4.14Å; L99-T101 HydrophobicContact CD2-CG2 3.91Å; L99-T101 HydrophobicContact CG-CG2 3.68Å; L99-T101 PolarHBondContact O-N 2.92Å; L99-T101 VanDerWaalsContact O-N 3.11Å
102	P	91.6	Very high	90.9	Very high	89 Å²	89	75.3 Å²	75.3	58%	0.578	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-68	149.6	175.2	28.6	-34.3	0	0	0	111.2	H104	P102-H104 PolarHBondContact O-CD2 2.9Å; P102-H104 VanDerWaalsContact O-CD2 3.27Å
103	Y	93.3	Very high	90.6	Very high	108 Å²	108	77.5 Å²	77.5	42%	0.424	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-74.5	138.6	165.7	-74	-92.1	0	0	0	109.7	E79 A83 K86	E79-Y103 PolarHBondContact OE1-OH 2.76Å; A83-Y103 HydrophobicContact CB-CD1 4Å; A83-Y103 HydrophobicContact CB-CE1 4.16Å; A83-Y103 HydrophobicContact CB-CG 4.4Å; K86-Y103 HydrophobicContact CB-CD1 3.88Å; K86-Y103 HydrophobicContact CB-CE1 4.04Å; K86-Y103 HydrophobicContact CB-CG 4.19Å; K86-Y103 HydrophobicContact CD-CD1 4.35Å; K86-Y103 HydrophobicContact CD-CE1 3.69Å; K86-Y103 HydrophobicContact CD-CE2 3.93Å; K86-Y103 VanDerWaalsContact CD-CZ 3.46Å; K86-Y103 VanDerWaalsContact CE-OH 3.25Å; K86-Y103 WeakPolarHBondContact CE-OH 3.33Å; K86-Y103 HydrophobicContact CG-CD1 4.04Å; K86-Y103 HydrophobicContact CG-CE1 3.67Å; K86-Y103 PolarHBondContact NZ-OH 2.75Å
104	H	94.3	Very high	90.5	Very high	40 Å²	40	76.3 Å²	76.3	19%	0.185	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-111	137.9	173.8	-67	-102.2	0	0	0	108.9	G84 L85 P102 T106 L110	G84-H104 WeakPolarHBondContact CA-O 3.48Å; L85-H104 PolarHBondContact N-O 2.85Å; L85-H104 PolarHBondContact O-N 3.08Å; P102-H104 PolarHBondContact O-CD2 2.9Å; P102-H104 VanDerWaalsContact O-CD2 3.27Å; H104-T106 VanDerWaalsContact C-N 3.28Å; H104-T106 PolarHBondContact O-N 2.8Å; H104-L110 HydrophobicContact CB-CB 3.97Å; H104-L110 HydrophobicContact CB-CD1 4.36Å; H104-L110 WeakPolarHBondContact CD2-CD1 3.35Å
105	E	90.9	Very high	90.4	Very high	172 Å²	172	72.5 Å²	72.5	80%	0.804	37%	0.373	S	S	*	.	S	Bend	trans	-62.3	-36.7	-178.6	-170.9	177.8	102.9	0	0	112.3
106	T	91.4	Very high	90.4	Very high	43 Å²	43	73.1 Å²	73.1	26%	0.264	38%	0.378	S	S	.	.	S	Bend	trans	-136.8	157.3	-177.1	70.8	0	0	0	0	112.6	H104 Y108 S109 L110	H104-T106 VanDerWaalsContact C-N 3.28Å; H104-T106 PolarHBondContact O-N 2.8Å; T106-Y108 PolarHBondContact O-N 3.4Å; T106-S109 PolarHBondContact O-N 2.83Å; T106-S109 PolarHBondContact OG1-N 2.95Å; T106-S109 PolarHBondContact OG1-OG 3.12Å; T106-L110 PolarHBondContact O-N 2.94Å
107	V	91.1	Very high	90.3	Very high	6 Å²	6	70.6 Å²	70.6	4%	0.036	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-30.4	173.8	70.3	0	0	0	0	112	V40 V44 M51 L85 L110 L111	V40-V107 HydrophobicContact CG1-CB 3.68Å; V40-V107 HydrophobicContact CG1-CG1 3.9Å; V40-V107 HydrophobicContact CG1-CG2 3.67Å; V44-V107 HydrophobicContact CG1-CG1 3.76Å; V44-V107 HydrophobicContact CG2-CG1 4.42Å; V44-V107 HydrophobicContact CG2-CG2 3.96Å; M51-V107 HydrophobicContact CE-CG2 4.04Å; L85-V107 HydrophobicContact CD2-CB 3.89Å; L85-V107 HydrophobicContact CD2-CG2 4.07Å; V107-L110 PolarHBondContact O-N 3.38Å; V107-L111 HydrophobicContact CG2-CD1 3.79Å; V107-L111 HydrophobicContact CG2-CG 4.04Å; V107-L111 WeakPolarHBondContact O-CB 3.5Å; V107-L111 VanDerWaalsContact O-CG 3.31Å; V107-L111 WeakPolarHBondContact O-CG 3.32Å; V107-L111 PolarHBondContact O-N 2.53Å
108	Y	91.9	Very high	90.6	Very high	91 Å²	91	63.7 Å²	63.7	36%	0.357	33%	0.329	S	S	.	.	H	α-helix	trans	-65.7	-49.3	179.7	-50.8	-83.7	0	0	0	111	D43 V44 T106 L110 L111 D112 Y118 F122	D43-Y108 VanDerWaalsContact OD1-CE1 3.28Å; D43-Y108 WeakPolarHBondContact OD1-CE1 3.29Å; D43-Y108 VanDerWaalsContact OD1-CZ 3.23Å; D43-Y108 PolarHBondContact OD1-OH 2.89Å; D43-Y108 PolarHBondContact OD2-OH 2.97Å; V44-Y108 HydrophobicContact CG1-CD1 4.2Å; V44-Y108 HydrophobicContact CG1-CE1 3.76Å; T106-Y108 PolarHBondContact O-N 3.4Å; Y108-L110 VanDerWaalsContact C-N 3.27Å; Y108-L110 PolarHBondContact O-N 2.95Å; Y108-L111 PolarHBondContact O-N 3.36Å; Y108-D112 VanDerWaalsContact O-CB 3.28Å; Y108-D112 WeakPolarHBondContact O-CB 3.29Å; Y108-D112 PolarHBondContact O-N 3.45Å; Y108-Y118 WeakPolarHBondContact CD1-OH 3.48Å; Y108-F122 HydrophobicContact CD1-CE2 4.44Å
109	S	92	Very high	90.7	Very high	58 Å²	58	62.6 Å²	62.6	41%	0.406	32%	0.318	S	S	.	.	H	α-helix	trans	-63.6	-35.5	178.7	-55.3	0	0	0	0	112.1	T106 T113	T106-S109 PolarHBondContact O-N 2.83Å; T106-S109 PolarHBondContact OG1-N 2.95Å; T106-S109 PolarHBondContact OG1-OG 3.12Å; S109-T113 PolarHBondContact O-OG1 3.04Å; S109-T113 VanDerWaalsContact O-OG1 3.12Å
110	L	92.8	Very high	90.9	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-68.4	-53	175.7	-177.6	71.5	0	0	0	111.1	L78 L85 V87 H104 T106 V107 Y108 D112 T113 L114	L78-L110 HydrophobicContact CD1-CD2 3.58Å; L78-L110 HydrophobicContact CD2-CD2 3.73Å; L78-L110 HydrophobicContact CG-CD2 4.2Å; L85-L110 HydrophobicContact CB-CD2 3.94Å; L85-L110 HydrophobicContact CD2-CD2 4.4Å; V87-L110 HydrophobicContact CG2-CD1 3.93Å; H104-L110 HydrophobicContact CB-CB 3.97Å; H104-L110 HydrophobicContact CB-CD1 4.36Å; H104-L110 WeakPolarHBondContact CD2-CD1 3.35Å; T106-L110 PolarHBondContact O-N 2.94Å; V107-L110 PolarHBondContact O-N 3.38Å; Y108-L110 VanDerWaalsContact C-N 3.27Å; Y108-L110 PolarHBondContact O-N 2.95Å; L110-D112 VanDerWaalsContact C-N 3.31Å; L110-D112 PolarHBondContact O-N 3.16Å; L110-T113 PolarHBondContact O-N 3.32Å; L110-T113 VanDerWaalsContact O-N 3.09Å; L110-L114 HydrophobicContact CD1-CD1 3.95Å; L110-L114 HydrophobicContact CD1-CG 4.29Å; L110-L114 HydrophobicContact CD2-CD1 4.21Å; L110-L114 HydrophobicContact CG-CD1 3.71Å; L110-L114 HydrophobicContact CG-CG 4.29Å; L110-L114 WeakPolarHBondContact O-CG 3.38Å; L110-L114 PolarHBondContact O-N 2.96Å
111	L	91.8	Very high	91.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66	-31.4	-178.7	-72	178.2	0	0	0	113	V44 V48 V68 V107 Y108 T113 L114 S115 Y118	V44-L111 HydrophobicContact CB-CD1 3.96Å; V44-L111 HydrophobicContact CG1-CD1 4.4Å; V44-L111 HydrophobicContact CG2-CD1 3.6Å; V48-L111 HydrophobicContact CG1-CD1 4.12Å; V48-L111 HydrophobicContact CG1-CD2 4.23Å; V68-L111 HydrophobicContact CG2-CD2 4.3Å; V107-L111 HydrophobicContact CG2-CD1 3.79Å; V107-L111 HydrophobicContact CG2-CG 4.04Å; V107-L111 WeakPolarHBondContact O-CB 3.5Å; V107-L111 VanDerWaalsContact O-CG 3.31Å; V107-L111 WeakPolarHBondContact O-CG 3.32Å; V107-L111 PolarHBondContact O-N 2.53Å; Y108-L111 PolarHBondContact O-N 3.36Å; L111-T113 PolarHBondContact O-N 3.48Å; L111-L114 PolarHBondContact O-N 3.33Å; L111-S115 PolarHBondContact O-N 2.87Å; L111-Y118 HydrophobicContact CB-CD1 3.57Å; L111-Y118 HydrophobicContact CB-CD2 3.92Å; L111-Y118 HydrophobicContact CB-CE1 3.73Å; L111-Y118 HydrophobicContact CB-CE2 4.09Å; L111-Y118 HydrophobicContact CB-CG 3.68Å; L111-Y118 HydrophobicContact CD1-CD2 3.71Å; L111-Y118 HydrophobicContact CD1-CE2 3.53Å; L111-Y118 HydrophobicContact CD1-CG 4.34Å; L111-Y118 HydrophobicContact CG-CD2 4.4Å; L111-Y118 HydrophobicContact CG-CE2 4.47Å
112	D	91.5	Very high	91.1	Very high	73 Å²	73	61.2 Å²	61.2	39%	0.39	31%	0.31	S	S	.	.	H	α-helix	trans	-58	-37.9	171.6	-178.2	-102.8	0	0	0	111.9	Y108 L110 R119	Y108-D112 VanDerWaalsContact O-CB 3.28Å; Y108-D112 WeakPolarHBondContact O-CB 3.29Å; Y108-D112 PolarHBondContact O-N 3.45Å; L110-D112 VanDerWaalsContact C-N 3.31Å; L110-D112 PolarHBondContact O-N 3.16Å; D112-R119 WeakPolarHBondContact OD2-CD 3.34Å; D112-R119 WeakPolarHBondContact OD2-CG 3.38Å
113	T	89.1	Confident	91	Very high	100 Å²	100	58.3 Å²	58.3	61%	0.613	30%	0.296	S	S	*	.	H	α-helix	trans	-80.5	-37.3	178	-51.9	0	0	0	0	111.9	S109 L110 L111	S109-T113 PolarHBondContact O-OG1 3.04Å; S109-T113 VanDerWaalsContact O-OG1 3.12Å; L110-T113 PolarHBondContact O-N 3.32Å; L110-T113 VanDerWaalsContact O-N 3.09Å; L111-T113 PolarHBondContact O-N 3.48Å
114	L	89	Confident	90.8	Very high	31 Å²	31	57.6 Å²	57.6	16%	0.162	30%	0.3	C	S	.	.	H	α-helix	trans	-82.8	-28	-174.3	-67.3	-179.8	0	0	0	114.7	Y76 L78 V87 L110 L111	Y76-L114 HydrophobicContact CD1-CD2 4.49Å; Y76-L114 HydrophobicContact CD2-CD1 4.36Å; Y76-L114 HydrophobicContact CE1-CD2 4.18Å; Y76-L114 HydrophobicContact CE2-CB 4.38Å; Y76-L114 HydrophobicContact CG-CD1 4.36Å; L78-L114 HydrophobicContact CD2-CD1 4.36Å; V87-L114 HydrophobicContact CG2-CD1 3.87Å; V87-L114 HydrophobicContact CG2-CD2 4.07Å; L110-L114 HydrophobicContact CD1-CD1 3.95Å; L110-L114 HydrophobicContact CD1-CG 4.29Å; L110-L114 HydrophobicContact CD2-CD1 4.21Å; L110-L114 HydrophobicContact CG-CD1 3.71Å; L110-L114 HydrophobicContact CG-CG 4.29Å; L110-L114 WeakPolarHBondContact O-CG 3.38Å; L110-L114 PolarHBondContact O-N 2.96Å; L111-L114 PolarHBondContact O-N 3.33Å
115	S	90.9	Very high	90.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.302	C	S	.	.			trans	-140.4	104	-173.3	-171.1	0	0	0	0	112	E72 L111 A117 Y118 R119	E72-S115 VanDerWaalsContact OE2-CA 3.26Å; E72-S115 WeakPolarHBondContact OE2-CA 3.1Å; E72-S115 WeakPolarHBondContact OE2-CB 3.46Å; E72-S115 PolarHBondContact OE2-OG 2.8Å; L111-S115 PolarHBondContact O-N 2.87Å; S115-A117 PolarHBondContact O-N 2.9Å; S115-Y118 VanDerWaalsContact O-CB 3.3Å; S115-Y118 WeakPolarHBondContact O-CB 3.41Å; S115-Y118 PolarHBondContact O-N 2.82Å; S115-Y118 VanDerWaalsContact O-N 3.08Å; S115-Y118 PolarHBondContact OG-N 2.8Å; S115-R119 PolarHBondContact O-N 2.78Å
116	P	90.8	Very high	90.3	Very high	62 Å²	62	54.1 Å²	54.1	40%	0.403	29%	0.291	S	S	.	.	H	α-helix	trans	-55.7	-34.3	168.5	20.8	-33.7	0	0	0	112.5	E72 Y118 R119 E120	E72-P116 VanDerWaalsContact OE1-CD 3.27Å; E72-P116 WeakPolarHBondContact OE1-CD 3.43Å; E72-P116 VanDerWaalsContact OE1-CG 3.25Å; E72-P116 WeakPolarHBondContact OE1-CG 3.33Å; E72-P116 VanDerWaalsContact OE2-CD 3.28Å; E72-P116 WeakPolarHBondContact OE2-CD 3.25Å; P116-Y118 VanDerWaalsContact C-N 3.29Å; P116-Y118 PolarHBondContact O-N 2.93Å; P116-R119 WeakPolarHBondContact O-CB 2.83Å; P116-R119 PolarHBondContact O-N 2.92Å; P116-E120 PolarHBondContact O-N 3.44Å; P116-E120 VanDerWaalsContact O-N 3.12Å
117	A	90.6	Very high	90.2	Very high	19 Å²	19	56.6 Å²	56.6	16%	0.157	30%	0.303	C	S	.	.	H	α-helix	trans	-66.2	-31.4	178.1	0	0	0	0	0	112.8	K71 E72 S115 E120 A121	K71-A117 HydrophobicContact CB-CB 3.91Å; E72-A117 HydrophobicContact CG-CB 4.25Å; S115-A117 PolarHBondContact O-N 2.9Å; A117-E120 PolarHBondContact O-N 3.37Å; A117-A121 WeakPolarHBondContact O-CB 3.2Å; A117-A121 PolarHBondContact O-N 3.48Å
118	Y	91.1	Very high	90	Very high	6 Å²	6	62.7 Å²	62.7	2%	0.024	33%	0.33	C	S	.	.	H	α-helix	trans	-62	-47.2	172	172.1	-95	0	0	0	110.8	V44 A47 V48 Y108 L111 S115 P116 E120 A121 F122	V44-Y118 HydrophobicContact CB-CE2 4.05Å; V44-Y118 HydrophobicContact CG1-CE2 4.24Å; A47-Y118 HydrophobicContact CB-CD2 3.25Å; A47-Y118 HydrophobicContact CB-CE2 3.41Å; A47-Y118 VanDerWaalsContact CB-CE2 3.41Å; A47-Y118 HydrophobicContact CB-CG 4.33Å; V48-Y118 HydrophobicContact CG1-CD2 4.3Å; Y108-Y118 WeakPolarHBondContact CD1-OH 3.48Å; L111-Y118 HydrophobicContact CB-CD1 3.57Å; L111-Y118 HydrophobicContact CB-CD2 3.92Å; L111-Y118 HydrophobicContact CB-CE1 3.73Å; L111-Y118 HydrophobicContact CB-CE2 4.09Å; L111-Y118 HydrophobicContact CB-CG 3.68Å; L111-Y118 HydrophobicContact CD1-CD2 3.71Å; L111-Y118 HydrophobicContact CD1-CE2 3.53Å; L111-Y118 HydrophobicContact CD1-CG 4.34Å; L111-Y118 HydrophobicContact CG-CD2 4.4Å; L111-Y118 HydrophobicContact CG-CE2 4.47Å; S115-Y118 VanDerWaalsContact O-CB 3.3Å; S115-Y118 WeakPolarHBondContact O-CB 3.41Å; S115-Y118 PolarHBondContact O-N 2.82Å; S115-Y118 VanDerWaalsContact O-N 3.08Å; S115-Y118 PolarHBondContact OG-N 2.8Å; P116-Y118 VanDerWaalsContact C-N 3.29Å; P116-Y118 PolarHBondContact O-N 2.93Å; Y118-E120 VanDerWaalsContact C-N 3.29Å; Y118-E120 PolarHBondContact O-N 3.46Å; Y118-A121 PolarHBondContact O-N 3.4Å; Y118-A121 VanDerWaalsContact O-N 3.15Å; Y118-F122 HydrophobicContact CE1-CB 4.48Å; Y118-F122 WeakPolarHBondContact O-CB 3.4Å; Y118-F122 PolarHBondContact O-N 3.46Å
119	R	90.8	Very high	89.7	Confident	148 Å²	148	67.5 Å²	67.5	56%	0.558	35%	0.348	S	S	*	.	H	α-helix	trans	-59.6	-40.7	178.9	-168.2	172.6	68.8	-169.4	-2.1	112	D112 S115 P116 G123	D112-R119 WeakPolarHBondContact OD2-CD 3.34Å; D112-R119 WeakPolarHBondContact OD2-CG 3.38Å; S115-R119 PolarHBondContact O-N 2.78Å; P116-R119 WeakPolarHBondContact O-CB 2.83Å; P116-R119 PolarHBondContact O-N 2.92Å; R119-G123 PolarHBondContact O-N 3.23Å
120	E	90.8	Very high	89.4	Confident	130 Å²	130	70.1 Å²	70.1	61%	0.607	36%	0.357	S	S	*	.	H	α-helix	trans	-65.6	-45.3	174.2	-67.6	-177.1	92.3	0	0	112.2	P116 A117 Y118 G123 N124	P116-E120 PolarHBondContact O-N 3.44Å; P116-E120 VanDerWaalsContact O-N 3.12Å; A117-E120 PolarHBondContact O-N 3.37Å; Y118-E120 VanDerWaalsContact C-N 3.29Å; Y118-E120 PolarHBondContact O-N 3.46Å; E120-G123 PolarHBondContact O-N 2.96Å; E120-N124 WeakPolarHBondContact O-CB 3.5Å; E120-N124 VanDerWaalsContact O-CG 3.25Å; E120-N124 PolarHBondContact O-N 2.92Å; E120-N124 PolarHBondContact O-ND2 3Å; E120-N124 VanDerWaalsContact O-ND2 3.09Å
121	A	89.2	Confident	89.2	Confident	16 Å²	16	76 Å²	76	13%	0.132	39%	0.385	C	S	.	.	H	α-helix	trans	-63.5	-43.8	179.1	0	0	0	0	0	112.1	A47 A117 Y118 N124 A125	A47-A121 HydrophobicContact CB-CB 4.06Å; A117-A121 WeakPolarHBondContact O-CB 3.2Å; A117-A121 PolarHBondContact O-N 3.48Å; Y118-A121 PolarHBondContact O-N 3.4Å; Y118-A121 VanDerWaalsContact O-N 3.15Å; A121-N124 PolarHBondContact O-N 3.28Å; A121-A125 WeakPolarHBondContact O-CB 3.26Å; A121-A125 PolarHBondContact O-N 2.47Å
122	F	88.5	Confident	88.9	Confident	92 Å²	92	79 Å²	79	40%	0.404	41%	0.409	S	S	.	.	H	α-helix	trans	-65	-45.1	177.1	-172.5	-95.8	0	0	0	111.4	F46 Y108 Y118 N124 A125 L126	F46-F122 HydrophobicContact CZ-CD2 4.31Å; Y108-F122 HydrophobicContact CD1-CE2 4.44Å; Y118-F122 HydrophobicContact CE1-CB 4.48Å; Y118-F122 WeakPolarHBondContact O-CB 3.4Å; Y118-F122 PolarHBondContact O-N 3.46Å; F122-N124 VanDerWaalsContact C-N 3.34Å; F122-N124 PolarHBondContact O-N 2.85Å; F122-A125 PolarHBondContact O-N 3.27Å; F122-L126 PolarHBondContact O-N 2.97Å
123	G	89.8	Confident	88.5	Confident	28 Å²	28	81.4 Å²	81.4	29%	0.289	42%	0.421	S	S	.	.	H	α-helix	trans	-59.1	-43.9	174.6	0	0	0	0	0	112.6	R119 E120 L126 L127	R119-G123 PolarHBondContact O-N 3.23Å; E120-G123 PolarHBondContact O-N 2.96Å; G123-L126 PolarHBondContact O-N 3.43Å; G123-L127 WeakPolarHBondContact O-CG 3.43Å; G123-L127 PolarHBondContact O-N 3.04Å
124	N	89.5	Confident	88	Confident	93 Å²	93	83.6 Å²	83.6	50%	0.497	42%	0.422	S	S	.	.	H	α-helix	trans	-63.1	-42.5	175.5	-75.7	-34.9	0	0	0	112.1	E120 A121 F122 L126 L127 Q128	E120-N124 WeakPolarHBondContact O-CB 3.5Å; E120-N124 VanDerWaalsContact O-CG 3.25Å; E120-N124 PolarHBondContact O-N 2.92Å; E120-N124 PolarHBondContact O-ND2 3Å; E120-N124 VanDerWaalsContact O-ND2 3.09Å; A121-N124 PolarHBondContact O-N 3.28Å; F122-N124 VanDerWaalsContact C-N 3.34Å; F122-N124 PolarHBondContact O-N 2.85Å; N124-L126 VanDerWaalsContact C-N 3.3Å; N124-L126 PolarHBondContact O-N 3.39Å; N124-L127 PolarHBondContact O-N 2.88Å; N124-Q128 WeakPolarHBondContact O-CG 3.38Å; N124-Q128 PolarHBondContact O-N 3.13Å
125	A	86.8	Confident	87.3	Confident	27 Å²	27	91.6 Å²	91.6	22%	0.223	45%	0.45	C	S	.	.	H	α-helix	trans	-61.6	-38.7	176.3	0	0	0	0	0	112.1	F46 A121 F122 R129	F46-A125 HydrophobicContact CE2-CB 3.97Å; F46-A125 HydrophobicContact CZ-CB 4.46Å; A121-A125 WeakPolarHBondContact O-CB 3.26Å; A121-A125 PolarHBondContact O-N 2.47Å; F122-A125 PolarHBondContact O-N 3.27Å; A125-R129 PolarHBondContact O-N 3.34Å; A125-R129 VanDerWaalsContact O-N 3.17Å
126	L	87.3	Confident	86.4	Confident	112 Å²	112	97.9 Å²	97.9	59%	0.586	48%	0.484	S	S	*	.	H	α-helix	trans	-67.2	-44.2	175.8	-174.1	63.6	0	0	0	111.9	F122 G123 N124 Q128 R129 L130	F122-L126 PolarHBondContact O-N 2.97Å; G123-L126 PolarHBondContact O-N 3.43Å; N124-L126 VanDerWaalsContact C-N 3.3Å; N124-L126 PolarHBondContact O-N 3.39Å; L126-Q128 PolarHBondContact O-N 3.35Å; L126-R129 PolarHBondContact O-N 3.25Å; L126-L130 PolarHBondContact O-N 2.84Å
127	L	89.3	Confident	84.9	Confident	96 Å²	96	98.3 Å²	98.3	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-59.3	-45.8	175.7	-74.5	168.7	0	0	0	111.5	G123 N124 R129 L130 E131	G123-L127 WeakPolarHBondContact O-CG 3.43Å; G123-L127 PolarHBondContact O-N 3.04Å; N124-L127 PolarHBondContact O-N 2.88Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 2.95Å; L127-L130 WeakPolarHBondContact O-CB 3.34Å; L127-L130 PolarHBondContact O-N 3.19Å; L127-L130 VanDerWaalsContact O-N 3.12Å; L127-E131 WeakPolarHBondContact O-CG 3.37Å; L127-E131 PolarHBondContact O-N 3.45Å
128	Q	86.9	Confident	83.3	Confident	133 Å²	133	104.9 Å²	104.9	62%	0.621	53%	0.527	S	S	*	.	H	α-helix	trans	-60	-40.4	177.7	-73.7	-173.6	-68.7	0	0	112.3	N124 L126 E131 A132	N124-Q128 WeakPolarHBondContact O-CG 3.38Å; N124-Q128 PolarHBondContact O-N 3.13Å; L126-Q128 PolarHBondContact O-N 3.35Å; Q128-E131 PolarHBondContact O-N 3.13Å; Q128-A132 WeakPolarHBondContact O-CB 3.42Å; Q128-A132 PolarHBondContact O-N 2.8Å
129	R	86.6	Confident	81.3	Confident	192 Å²	192	112.7 Å²	112.7	73%	0.725	58%	0.582	S	S	*	*	H	α-helix	trans	-65.6	-41	174.7	-75.4	-173.2	176.6	168.4	1.4	112	A125 L126 L127 A132 L133	A125-R129 PolarHBondContact O-N 3.34Å; A125-R129 VanDerWaalsContact O-N 3.17Å; L126-R129 PolarHBondContact O-N 3.25Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 2.95Å; R129-A132 PolarHBondContact O-N 3.47Å; R129-L133 WeakPolarHBondContact O-CG 3.5Å; R129-L133 PolarHBondContact O-N 3.26Å; R129-L133 VanDerWaalsContact O-N 3.13Å
130	L	85.3	Confident	80.9	Confident	114 Å²	114	111 Å²	111	60%	0.597	58%	0.584	S	S	*	*	H	α-helix	trans	-63.4	-41.3	176.9	-172.8	67.3	0	0	0	111.8	L126 L127 L133 K134	L126-L130 PolarHBondContact O-N 2.84Å; L127-L130 WeakPolarHBondContact O-CB 3.34Å; L127-L130 PolarHBondContact O-N 3.19Å; L127-L130 VanDerWaalsContact O-N 3.12Å; L130-L133 PolarHBondContact O-N 3.34Å; L130-K134 PolarHBondContact O-N 2.75Å; L130-K134 VanDerWaalsContact O-N 3.09Å
131	E	88.1	Confident	80.4	Confident	125 Å²	125	109.9 Å²	109.9	58%	0.584	58%	0.582	S	S	*	*	H	α-helix	trans	-66	-38.3	176.1	-71.8	-172.7	98.4	0	0	112.6	L127 Q128 K134 R135	L127-E131 WeakPolarHBondContact O-CG 3.37Å; L127-E131 PolarHBondContact O-N 3.45Å; Q128-E131 PolarHBondContact O-N 3.13Å; E131-K134 PolarHBondContact O-N 2.84Å; E131-R135 PolarHBondContact O-N 2.82Å; E131-R135 VanDerWaalsContact O-N 3.12Å
132	A	85.2	Confident	79.9	Confident	61 Å²	61	115.2 Å²	115.2	50%	0.504	61%	0.607	S	S	.	*	H	α-helix	trans	-61.2	-45.2	175.4	0	0	0	0	0	111.6	Q128 R129 K134 R135 D136	Q128-A132 WeakPolarHBondContact O-CB 3.42Å; Q128-A132 PolarHBondContact O-N 2.8Å; R129-A132 PolarHBondContact O-N 3.47Å; A132-K134 PolarHBondContact O-N 3.24Å; A132-R135 PolarHBondContact O-N 2.7Å; A132-D136 PolarHBondContact O-N 2.96Å; A132-D136 VanDerWaalsContact O-N 3.09Å
133	L	83.1	Confident	79.4	Confident	124 Å²	124	116.5 Å²	116.5	65%	0.649	62%	0.619	S	S	*	*	H	α-helix	trans	-62.7	-40.8	176.8	-69.9	167.4	0	0	0	112.4	R129 L130 R135 D136 G137	R129-L133 WeakPolarHBondContact O-CG 3.5Å; R129-L133 PolarHBondContact O-N 3.26Å; R129-L133 VanDerWaalsContact O-N 3.13Å; L130-L133 PolarHBondContact O-N 3.34Å; L133-R135 VanDerWaalsContact C-N 3.27Å; L133-R135 PolarHBondContact O-N 2.82Å; L133-D136 PolarHBondContact O-N 3.29Å; L133-G137 PolarHBondContact O-N 2.95Å
134	K	79.1	Confident	78.7	Confident	147 Å²	147	122.1 Å²	122.1	64%	0.639	64%	0.64	S	S	*	*	H	α-helix	trans	-62.4	-35.9	177	-176.5	178.9	174.9	-178.2	0	112.1	L130 E131 A132	L130-K134 PolarHBondContact O-N 2.75Å; L130-K134 VanDerWaalsContact O-N 3.09Å; E131-K134 PolarHBondContact O-N 2.84Å; A132-K134 PolarHBondContact O-N 3.24Å
135	R	74.7	Confident	78	Confident	198 Å²	198	124 Å²	124	75%	0.747	65%	0.65	S	S	*	*	H	α-helix	trans	-72.8	-37.9	179.3	-134.9	-178.1	-159.4	117.5	0.2	112.1	E131 A132 L133	E131-R135 PolarHBondContact O-N 2.82Å; E131-R135 VanDerWaalsContact O-N 3.12Å; A132-R135 PolarHBondContact O-N 2.7Å; L133-R135 VanDerWaalsContact C-N 3.27Å; L133-R135 PolarHBondContact O-N 2.82Å
136	D	70.9	Confident	77.3	Confident	133 Å²	133	130.9 Å²	130.9	71%	0.711	68%	0.68	S	S	*	*	H	α-helix	trans	-71.9	-38.5	-179.2	-159.5	-109.4	0	0	0	112.1	A132 L133 Q138	A132-D136 PolarHBondContact O-N 2.96Å; A132-D136 VanDerWaalsContact O-N 3.09Å; L133-D136 PolarHBondContact O-N 3.29Å; D136-Q138 PolarHBondContact O-N 3.42Å
137	G	60.7	Low	76.6	Confident	71 Å²	71	132.4 Å²	132.4	73%	0.732	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	0.5	176.9	0	0	0	0	0	116.1	L133	L133-G137 PolarHBondContact O-N 2.95Å
138	Q	56.6	Low	75.5	Confident	157 Å²	157	135.4 Å²	135.4	73%	0.734	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	6.9	178.6	-73.6	-168.8	-40.3	0	0	113.8	D136	D136-Q138 PolarHBondContact O-N 3.42Å
139	S	49.4	Very low	74.5	Confident	170 Å²	170	135.6 Å²	135.6	100%	1.189	71%	0.71	S	S	*	*			trans	-102.6	0	175.1	-62.9	0	0	0	0	112.7

Retrieved 139 of 139 residues in 355.1 ms (Link to these results)

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