A0A087YIQ8_POEFO Loading...

Programmed cell death protein 5

May function in the process of apoptosis.

AlphaFold DB (A0A3B3TKT3), UniProt , Accession A0A087YIQ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 126 aa.

						>A0A087YIQ8_POEFO|A0A087YIQ8
MADEELEAIRRQRMAELQAKQGDASNNQQGEEAKQRETEMRNSILAQVLDQSARARLSNLALVKPEKANAVENYLIQMARFGKLGGKISESGLIEILEKVSQQTEKKTTVTFNRRRVMDSDDEDDY
					

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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	57.1	Low	74.8	Confident	202 Å²	202	133.3 Å²	133.3	100%	0.995	66%	0.656	S	S	*	*				0	-56.3	0	-69.7	-179	-179.6	0	0	111.2	D3 E4	M1-D3 PolarHBondContact O-N 3.36Å; M1-E4 PolarHBondContact O-N 3.45Å
2	A	62.7	Low	75.4	Confident	75 Å²	75	133.6 Å²	133.6	62%	0.62	66%	0.655	S	S	*	*	H	α-helix	trans	-64.8	-34.2	177.7	0	0	0	0	0	115	E4 L6	A2-E4 VanDerWaalsContact C-N 3.34Å; A2-E4 PolarHBondContact O-N 3.49Å; A2-L6 PolarHBondContact O-N 3.49Å
3	D	66.3	Low	75.9	Confident	128 Å²	128	137.9 Å²	137.9	68%	0.684	66%	0.659	S	S	*	*	H	α-helix	trans	-71.1	-27	178	-76	-37.1	0	0	0	113.7	M1 L6 E7	M1-D3 PolarHBondContact O-N 3.36Å; D3-L6 PolarHBondContact O-N 3.36Å; D3-E7 PolarHBondContact O-N 3.08Å; D3-E7 VanDerWaalsContact O-N 3.07Å
4	E	75.9	Confident	76.1	Confident	143 Å²	143	136.9 Å²	136.9	67%	0.668	66%	0.655	S	S	*	*	H	α-helix	trans	-76.9	-35.4	-175.6	-157.9	169.1	-170.4	0	0	111.4	M1 A2 A8	M1-E4 PolarHBondContact O-N 3.45Å; A2-E4 VanDerWaalsContact C-N 3.34Å; A2-E4 PolarHBondContact O-N 3.49Å; E4-A8 WeakPolarHBondContact O-CB 3.29Å; E4-A8 PolarHBondContact O-N 3.07Å
5	E	74.3	Confident	76.4	Confident	145 Å²	145	131.5 Å²	131.5	68%	0.678	64%	0.643	S	S	*	*	H	α-helix	trans	-67.3	-36.9	170.3	-77.1	-166.2	131	0	0	112.3	A8 I9	E5-A8 PolarHBondContact O-N 3.42Å; E5-I9 VanDerWaalsContact O-CG1 3.29Å; E5-I9 WeakPolarHBondContact O-CG1 3.49Å; E5-I9 PolarHBondContact O-N 2.99Å
6	L	73.6	Confident	76.5	Confident	114 Å²	114	131.4 Å²	131.4	60%	0.597	64%	0.64	S	S	*	*	H	α-helix	trans	-65.7	-40.4	176.3	-93	155.7	0	0	0	112.1	A2 D3 R10	A2-L6 PolarHBondContact O-N 3.49Å; D3-L6 PolarHBondContact O-N 3.36Å; L6-R10 WeakPolarHBondContact O-CB 3.32Å; L6-R10 PolarHBondContact O-N 3.02Å; L6-R10 VanDerWaalsContact O-N 3.08Å
7	E	81.1	Confident	76.3	Confident	120 Å²	120	130.5 Å²	130.5	56%	0.561	64%	0.639	S	S	*	*	H	α-helix	trans	-68	-38.4	173.9	-74.7	-164.4	163.6	0	0	112.6	D3 R10 R11	D3-E7 PolarHBondContact O-N 3.08Å; D3-E7 VanDerWaalsContact O-N 3.07Å; E7-R10 PolarHBondContact O-N 3Å; E7-R11 WeakPolarHBondContact O-CG 3.37Å; E7-R11 PolarHBondContact O-N 3.47Å
8	A	84.2	Confident	75.9	Confident	52 Å²	52	130.9 Å²	130.9	43%	0.43	64%	0.639	S	S	.	*	H	α-helix	trans	-61.3	-45.4	175.6	0	0	0	0	0	111.5	E4 E5 R10 R11 Q12	E4-A8 WeakPolarHBondContact O-CB 3.29Å; E4-A8 PolarHBondContact O-N 3.07Å; E5-A8 PolarHBondContact O-N 3.42Å; A8-R10 VanDerWaalsContact C-N 3.32Å; A8-R10 PolarHBondContact O-N 2.91Å; A8-R11 PolarHBondContact O-N 3.32Å; A8-Q12 WeakPolarHBondContact O-CB 3.43Å; A8-Q12 PolarHBondContact O-N 3.42Å
9	I	81.1	Confident	75.5	Confident	106 Å²	106	127.4 Å²	127.4	54%	0.544	63%	0.634	S	S	.	*	H	α-helix	trans	-62.1	-40.1	175.9	-69.1	168.3	0	0	0	111.1	E5 R13	E5-I9 VanDerWaalsContact O-CG1 3.29Å; E5-I9 WeakPolarHBondContact O-CG1 3.49Å; E5-I9 PolarHBondContact O-N 2.99Å; I9-R13 WeakPolarHBondContact O-CB 3.42Å; I9-R13 PolarHBondContact O-N 3.27Å
10	R	82.1	Confident	74.9	Confident	200 Å²	200	129.4 Å²	129.4	76%	0.755	64%	0.638	S	S	*	*	H	α-helix	trans	-66.8	-42.2	178	-166.3	178.6	-174.8	166.4	1.8	112.1	L6 E7 A8 M14	L6-R10 WeakPolarHBondContact O-CB 3.32Å; L6-R10 PolarHBondContact O-N 3.02Å; L6-R10 VanDerWaalsContact O-N 3.08Å; E7-R10 PolarHBondContact O-N 3Å; A8-R10 VanDerWaalsContact C-N 3.32Å; A8-R10 PolarHBondContact O-N 2.91Å; R10-M14 WeakPolarHBondContact O-CB 3.39Å; R10-M14 PolarHBondContact O-N 2.98Å
11	R	84.4	Confident	74.2	Confident	181 Å²	181	129.6 Å²	129.6	68%	0.683	64%	0.637	S	S	*	*	H	α-helix	trans	-64.8	-43.9	175.7	-75.5	-177.3	-173.6	-143.8	4.1	111.7	E7 A8 M14 A15	E7-R11 WeakPolarHBondContact O-CG 3.37Å; E7-R11 PolarHBondContact O-N 3.47Å; A8-R11 PolarHBondContact O-N 3.32Å; R11-M14 PolarHBondContact O-N 3.26Å; R11-A15 WeakPolarHBondContact O-CB 3.45Å; R11-A15 PolarHBondContact O-N 3.32Å
12	Q	82.5	Confident	74.1	Confident	137 Å²	137	122.1 Å²	122.1	64%	0.64	61%	0.613	S	S	*	*	H	α-helix	trans	-64.6	-43.4	-179.7	-163.8	172.3	-7.6	0	0	111.3	A8 M14 A15 E16	A8-Q12 WeakPolarHBondContact O-CB 3.43Å; A8-Q12 PolarHBondContact O-N 3.42Å; Q12-M14 VanDerWaalsContact C-N 3.34Å; Q12-M14 PolarHBondContact O-N 2.89Å; Q12-A15 PolarHBondContact O-N 3.16Å; Q12-E16 WeakPolarHBondContact O-CB 3.4Å; Q12-E16 PolarHBondContact O-N 2.87Å
13	R	81.6	Confident	73.6	Confident	190 Å²	190	124.8 Å²	124.8	72%	0.717	62%	0.616	S	S	*	*	H	α-helix	trans	-68	-32.8	175.7	-163.1	159.7	-167.3	133.1	1.7	113	I9 L17	I9-R13 WeakPolarHBondContact O-CB 3.42Å; I9-R13 PolarHBondContact O-N 3.27Å; R13-L17 WeakPolarHBondContact O-CB 3.41Å; R13-L17 PolarHBondContact O-N 2.95Å; R13-L17 VanDerWaalsContact O-N 3.16Å
14	M	78.9	Confident	72.9	Confident	123 Å²	123	120.6 Å²	120.6	61%	0.606	60%	0.599	S	S	*	*	H	α-helix	trans	-71.8	-41.2	175.8	-152.8	-139.1	-64.1	0	0	111.8	R10 R11 Q12 L17 Q18	R10-M14 WeakPolarHBondContact O-CB 3.39Å; R10-M14 PolarHBondContact O-N 2.98Å; R11-M14 PolarHBondContact O-N 3.26Å; Q12-M14 VanDerWaalsContact C-N 3.34Å; Q12-M14 PolarHBondContact O-N 2.89Å; M14-L17 PolarHBondContact O-N 2.81Å; M14-Q18 WeakPolarHBondContact O-CB 3.37Å; M14-Q18 PolarHBondContact O-N 3.37Å
15	A	79.8	Confident	71.7	Confident	56 Å²	56	116.5 Å²	116.5	46%	0.463	59%	0.586	S	S	.	*	H	α-helix	trans	-64.9	-39	175.8	0	0	0	0	0	111.9	R11 Q12 L17 Q18 A19	R11-A15 WeakPolarHBondContact O-CB 3.45Å; R11-A15 PolarHBondContact O-N 3.32Å; Q12-A15 PolarHBondContact O-N 3.16Å; A15-L17 VanDerWaalsContact C-N 3.35Å; A15-Q18 PolarHBondContact O-N 2.96Å; A15-A19 VanDerWaalsContact O-CB 3.23Å; A15-A19 WeakPolarHBondContact O-CB 3.48Å; A15-A19 PolarHBondContact O-N 3.41Å
16	E	77.7	Confident	70.7	Confident	130 Å²	130	115.7 Å²	115.7	61%	0.607	59%	0.587	S	S	*	*	H	α-helix	trans	-65.1	-39	175.6	-162	-179	105.9	0	0	111.6	Q12 K20	Q12-E16 WeakPolarHBondContact O-CB 3.4Å; Q12-E16 PolarHBondContact O-N 2.87Å; E16-K20 VanDerWaalsContact O-CB 3.25Å; E16-K20 WeakPolarHBondContact O-CB 3.25Å; E16-K20 PolarHBondContact O-N 2.93Å
17	L	73.1	Confident	69.8	Low	117 Å²	117	115.1 Å²	115.1	61%	0.613	59%	0.585	S	S	*	*	H	α-helix	trans	-68.6	-39.6	176.3	-143.1	157.3	0	0	0	111.4	R13 M14 A15 K20 Q21	R13-L17 WeakPolarHBondContact O-CB 3.41Å; R13-L17 PolarHBondContact O-N 2.95Å; R13-L17 VanDerWaalsContact O-N 3.16Å; M14-L17 PolarHBondContact O-N 2.81Å; A15-L17 VanDerWaalsContact C-N 3.35Å; L17-K20 PolarHBondContact O-N 3.42Å; L17-Q21 WeakPolarHBondContact O-CB 3.23Å; L17-Q21 PolarHBondContact O-N 3.45Å
18	Q	69.5	Low	68.6	Low	137 Å²	137	114.4 Å²	114.4	64%	0.64	58%	0.581	S	S	*	*	H	α-helix	trans	-70.4	-37.7	176.7	-161.4	170.9	44.6	0	0	112.2	M14 A15 Q21 G22	M14-Q18 WeakPolarHBondContact O-CB 3.37Å; M14-Q18 PolarHBondContact O-N 3.37Å; A15-Q18 PolarHBondContact O-N 2.96Å; Q18-Q21 PolarHBondContact O-N 3.48Å; Q18-G22 PolarHBondContact O-N 3.03Å
19	A	68.6	Low	67.3	Low	65 Å²	65	118.1 Å²	118.1	54%	0.537	59%	0.59	S	S	.	*	H	α-helix	trans	-66.1	-41.1	173.7	0	0	0	0	0	111.6	A15 Q21 G22 D23	A15-A19 VanDerWaalsContact O-CB 3.23Å; A15-A19 WeakPolarHBondContact O-CB 3.48Å; A15-A19 PolarHBondContact O-N 3.41Å; A19-Q21 VanDerWaalsContact C-N 3.28Å; A19-Q21 PolarHBondContact O-N 2.92Å; A19-G22 PolarHBondContact O-N 3.41Å; A19-D23 PolarHBondContact O-N 3.29Å; A19-D23 VanDerWaalsContact O-N 3.13Å
20	K	64.3	Low	66.3	Low	166 Å²	166	115 Å²	115	72%	0.722	58%	0.584	S	S	*	*	H	α-helix	trans	-68.1	-27.7	176.4	-153.5	170.8	-175.3	-175.8	0	112.7	E16 L17 A24	E16-K20 VanDerWaalsContact O-CB 3.25Å; E16-K20 WeakPolarHBondContact O-CB 3.25Å; E16-K20 PolarHBondContact O-N 2.93Å; L17-K20 PolarHBondContact O-N 3.42Å; K20-A24 WeakPolarHBondContact O-CB 3.41Å; K20-A24 PolarHBondContact O-N 3.35Å
21	Q	58.6	Low	65.5	Low	134 Å²	134	110 Å²	110	63%	0.626	57%	0.569	S	S	*	*	H	α-helix	trans	-79.9	-33	173.4	-164.5	169.2	28.8	0	0	112.6	L17 Q18 A19 S25	L17-Q21 WeakPolarHBondContact O-CB 3.23Å; L17-Q21 PolarHBondContact O-N 3.45Å; Q18-Q21 PolarHBondContact O-N 3.48Å; A19-Q21 VanDerWaalsContact C-N 3.28Å; A19-Q21 PolarHBondContact O-N 2.92Å; Q21-S25 WeakPolarHBondContact O-CB 3.1Å; Q21-S25 PolarHBondContact O-N 3.06Å
22	G	54.9	Low	64.7	Low	46 Å²	46	105.5 Å²	105.5	47%	0.474	56%	0.556	S	S	.	*	H	α-helix	trans	-68.3	-37.4	175.5	0	0	0	0	0	113.9	Q18 A19 N26	Q18-G22 PolarHBondContact O-N 3.03Å; A19-G22 PolarHBondContact O-N 3.41Å; G22-N26 PolarHBondContact O-N 3.13Å
23	D	52.5	Low	64	Low	130 Å²	130	101.8 Å²	101.8	70%	0.695	55%	0.548	S	S	*	.	H	α-helix	trans	-73.9	-38	177.3	-159.1	-103.9	0	0	0	112.1	A19 N27	A19-D23 PolarHBondContact O-N 3.29Å; A19-D23 VanDerWaalsContact O-N 3.13Å; D23-N27 PolarHBondContact O-N 3.24Å
24	A	51.9	Low	63.6	Low	40 Å²	40	100.1 Å²	100.1	33%	0.331	55%	0.546	S	S	.	.	H	α-helix	trans	-63.8	-40	172.3	0	0	0	0	0	112	K20 N26 N27 Q28	K20-A24 WeakPolarHBondContact O-CB 3.41Å; K20-A24 PolarHBondContact O-N 3.35Å; A24-N26 PolarHBondContact O-N 2.81Å; A24-N27 PolarHBondContact O-N 3.41Å; A24-Q28 WeakPolarHBondContact O-CB 3.25Å; A24-Q28 WeakPolarHBondContact O-CG 3.34Å; A24-Q28 PolarHBondContact O-N 3.39Å; A24-Q28 PolarHBondContact O-OE1 3.49Å
25	S	51.9	Low	63.4	Low	57 Å²	57	99.4 Å²	99.4	40%	0.399	54%	0.541	S	S	.	.	H	α-helix	trans	-67.7	-30.8	-177.5	-161.2	0	0	0	0	113.8	Q21 Q29	Q21-S25 WeakPolarHBondContact O-CB 3.1Å; Q21-S25 PolarHBondContact O-N 3.06Å; S25-Q29 WeakPolarHBondContact O-CB 3.14Å; S25-Q29 WeakPolarHBondContact O-CG 3.4Å; S25-Q29 PolarHBondContact O-N 3.48Å
26	N	53	Low	63.2	Low	129 Å²	129	104.4 Å²	104.4	69%	0.69	55%	0.548	S	S	*	.	H	α-helix	trans	-78.5	-33.8	178.8	-164.3	42.4	0	0	0	112.2	G22 A24	G22-N26 PolarHBondContact O-N 3.13Å; A24-N26 PolarHBondContact O-N 2.81Å
27	N	54.2	Low	63	Low	102 Å²	102	103.1 Å²	103.1	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-77.5	-39.4	173.4	-148	40.6	0	0	0	111.5	D23 A24 Q29 G30 E31	D23-N27 PolarHBondContact O-N 3.24Å; A24-N27 PolarHBondContact O-N 3.41Å; N27-Q29 PolarHBondContact O-N 2.71Å; N27-G30 PolarHBondContact O-N 3.43Å; N27-E31 PolarHBondContact ND2-OE2 3.3Å; N27-E31 WeakPolarHBondContact O-CB 3.36Å; N27-E31 VanDerWaalsContact O-CG 3.25Å; N27-E31 WeakPolarHBondContact O-CG 3.17Å; N27-E31 PolarHBondContact O-N 2.88Å
28	Q	55.3	Low	63.3	Low	105 Å²	105	101.2 Å²	101.2	49%	0.491	54%	0.536	S	S	.	.	H	α-helix	trans	-65.7	-36.6	176.3	-73.9	176.8	-70.7	0	0	113	A24 E31 E32	A24-Q28 WeakPolarHBondContact O-CB 3.25Å; A24-Q28 WeakPolarHBondContact O-CG 3.34Å; A24-Q28 PolarHBondContact O-N 3.39Å; A24-Q28 PolarHBondContact O-OE1 3.49Å; Q28-E31 PolarHBondContact O-N 2.79Å; Q28-E32 VanDerWaalsContact O-CB 3.25Å; Q28-E32 WeakPolarHBondContact O-CB 3.26Å; Q28-E32 PolarHBondContact O-N 3.48Å
29	Q	57.9	Low	63.8	Low	130 Å²	130	100.6 Å²	100.6	61%	0.607	53%	0.533	S	S	*	.	H	α-helix	trans	-67.2	-38.5	174.7	-86.1	173.9	-23.1	0	0	112.5	S25 N27 A33	S25-Q29 WeakPolarHBondContact O-CB 3.14Å; S25-Q29 WeakPolarHBondContact O-CG 3.4Å; S25-Q29 PolarHBondContact O-N 3.48Å; N27-Q29 PolarHBondContact O-N 2.71Å; Q29-A33 VanDerWaalsContact O-CB 3.26Å; Q29-A33 WeakPolarHBondContact O-CB 3.41Å; Q29-A33 PolarHBondContact O-N 3.06Å
30	G	60.4	Low	64.2	Low	41 Å²	41	103.3 Å²	103.3	42%	0.423	54%	0.536	S	S	.	.	H	α-helix	trans	-69.1	-39.4	174.9	0	0	0	0	0	112.8	N27 K34	N27-G30 PolarHBondContact O-N 3.43Å; G30-K34 WeakPolarHBondContact O-CB 3.32Å; G30-K34 PolarHBondContact O-N 2.75Å
31	E	64.1	Low	64.8	Low	93 Å²	93	99.5 Å²	99.5	44%	0.435	52%	0.517	S	S	.	.	H	α-helix	trans	-71.7	-41.3	177.4	-72	175.9	122.2	0	0	112.1	N27 Q28 K34 Q35	N27-E31 PolarHBondContact ND2-OE2 3.3Å; N27-E31 WeakPolarHBondContact O-CB 3.36Å; N27-E31 VanDerWaalsContact O-CG 3.25Å; N27-E31 WeakPolarHBondContact O-CG 3.17Å; N27-E31 PolarHBondContact O-N 2.88Å; Q28-E31 PolarHBondContact O-N 2.79Å; E31-K34 PolarHBondContact O-N 2.78Å; E31-Q35 VanDerWaalsContact O-CB 3.26Å; E31-Q35 WeakPolarHBondContact O-CB 3.2Å; E31-Q35 WeakPolarHBondContact O-CG 3.38Å; E31-Q35 PolarHBondContact O-N 3.39Å
32	E	67.2	Low	65.9	Low	88 Å²	88	97.3 Å²	97.3	41%	0.411	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-41.8	173.2	-93.2	-177.1	47.7	0	0	111.9	Q28 K34 Q35 R36	Q28-E32 VanDerWaalsContact O-CB 3.25Å; Q28-E32 WeakPolarHBondContact O-CB 3.26Å; Q28-E32 PolarHBondContact O-N 3.48Å; E32-K34 VanDerWaalsContact C-N 3.35Å; E32-Q35 PolarHBondContact O-N 3.23Å; E32-R36 WeakPolarHBondContact O-CB 3.25Å; E32-R36 WeakPolarHBondContact O-CG 3.46Å; E32-R36 PolarHBondContact O-N 3.03Å; E32-R36 IonicContact OE1-CZ 2.64Å; E32-R36 IonicContact OE1-NE 3.96Å; E32-R36 IonicContact OE1-NH2 2.75Å; E32-R36 PolarHBondContact OE1-NH2 2.86Å
33	A	69.5	Low	67.2	Low	58 Å²	58	97.9 Å²	97.9	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-44.8	176.8	0	0	0	0	0	111	Q29 E37	Q29-A33 VanDerWaalsContact O-CB 3.26Å; Q29-A33 WeakPolarHBondContact O-CB 3.41Å; Q29-A33 PolarHBondContact O-N 3.06Å; A33-E37 WeakPolarHBondContact O-CB 3.26Å; A33-E37 PolarHBondContact O-N 3.13Å
34	K	72.7	Confident	68.4	Low	156 Å²	156	93.1 Å²	93.1	68%	0.678	48%	0.481	S	S	*	.	H	α-helix	trans	-62.7	-44.7	174	-94.6	-178.7	174.6	177.5	0	112.3	G30 E31 E32 E37 T38	G30-K34 WeakPolarHBondContact O-CB 3.32Å; G30-K34 PolarHBondContact O-N 2.75Å; E31-K34 PolarHBondContact O-N 2.78Å; E32-K34 VanDerWaalsContact C-N 3.35Å; K34-E37 PolarHBondContact O-N 3.02Å; K34-T38 WeakPolarHBondContact O-CG2 3.47Å; K34-T38 PolarHBondContact O-N 3.33Å; K34-T38 PolarHBondContact O-OG1 3.3Å
35	Q	74.3	Confident	69.6	Low	107 Å²	107	91.8 Å²	91.8	50%	0.5	47%	0.468	S	S	.	.	H	α-helix	trans	-61.3	-49.6	-179.9	-78.7	171.5	30	0	0	110.5	E31 E32 E37 T38 E39	E31-Q35 VanDerWaalsContact O-CB 3.26Å; E31-Q35 WeakPolarHBondContact O-CB 3.2Å; E31-Q35 WeakPolarHBondContact O-CG 3.38Å; E31-Q35 PolarHBondContact O-N 3.39Å; E32-Q35 PolarHBondContact O-N 3.23Å; Q35-E37 VanDerWaalsContact C-N 3.28Å; Q35-E37 PolarHBondContact O-N 2.82Å; Q35-T38 VanDerWaalsContact CA-OG1 3.28Å; Q35-T38 WeakPolarHBondContact CA-OG1 3.18Å; Q35-T38 CarbonylContact O-C 3.47Å; Q35-T38 PolarHBondContact O-N 3.36Å; Q35-T38 VanDerWaalsContact O-N 3.1Å; Q35-T38 PolarHBondContact O-OG1 3.02Å; Q35-E39 WeakPolarHBondContact O-CB 3.37Å; Q35-E39 WeakPolarHBondContact O-CG 3.24Å; Q35-E39 PolarHBondContact O-N 2.87Å
36	R	75.5	Confident	70.9	Confident	161 Å²	161	90.9 Å²	90.9	61%	0.608	46%	0.464	S	S	*	.	H	α-helix	trans	-58.1	-40.5	175.2	-68.9	176.8	-154.9	-146.4	9.9	112	E32 E39 M40	E32-R36 WeakPolarHBondContact O-CB 3.25Å; E32-R36 WeakPolarHBondContact O-CG 3.46Å; E32-R36 PolarHBondContact O-N 3.03Å; E32-R36 IonicContact OE1-CZ 2.64Å; E32-R36 IonicContact OE1-NE 3.96Å; E32-R36 IonicContact OE1-NH2 2.75Å; E32-R36 PolarHBondContact OE1-NH2 2.86Å; R36-E39 PolarHBondContact O-N 2.77Å; R36-M40 VanDerWaalsContact O-CB 3.24Å; R36-M40 WeakPolarHBondContact O-CB 3.28Å; R36-M40 PolarHBondContact O-N 3.05Å
37	E	74.4	Confident	72.1	Confident	104 Å²	104	91.7 Å²	91.7	49%	0.486	46%	0.463	S	S	.	.	H	α-helix	trans	-68.3	-38.9	177.7	-149.1	-179.2	92.6	0	0	111.8	A33 K34 Q35 R41	A33-E37 WeakPolarHBondContact O-CB 3.26Å; A33-E37 PolarHBondContact O-N 3.13Å; K34-E37 PolarHBondContact O-N 3.02Å; Q35-E37 VanDerWaalsContact C-N 3.28Å; Q35-E37 PolarHBondContact O-N 2.82Å; E37-R41 VanDerWaalsContact CG-NH1 3.35Å; E37-R41 WeakPolarHBondContact O-CB 3.47Å; E37-R41 VanDerWaalsContact O-CG 3.28Å; E37-R41 WeakPolarHBondContact O-CG 3.2Å; E37-R41 PolarHBondContact O-N 2.73Å; E37-R41 IonicContact OE1-CZ 3.69Å; E37-R41 IonicContact OE1-NH1 2.71Å; E37-R41 PolarHBondContact OE1-NH1 2.79Å; E37-R41 IonicContact OE1-NH2 3.39Å; E37-R41 PolarHBondContact OE1-NH2 3.49Å
38	T	78	Confident	73.2	Confident	77 Å²	77	87.4 Å²	87.4	47%	0.472	44%	0.441	S	S	.	.	H	α-helix	trans	-70.9	-37.5	174.3	49.8	0	0	0	0	112.9	K34 Q35 R41 N42	K34-T38 WeakPolarHBondContact O-CG2 3.47Å; K34-T38 PolarHBondContact O-N 3.33Å; K34-T38 PolarHBondContact O-OG1 3.3Å; Q35-T38 VanDerWaalsContact CA-OG1 3.28Å; Q35-T38 WeakPolarHBondContact CA-OG1 3.18Å; Q35-T38 CarbonylContact O-C 3.47Å; Q35-T38 PolarHBondContact O-N 3.36Å; Q35-T38 VanDerWaalsContact O-N 3.1Å; Q35-T38 PolarHBondContact O-OG1 3.02Å; T38-R41 PolarHBondContact O-N 2.77Å; T38-N42 WeakPolarHBondContact O-CB 3.26Å; T38-N42 PolarHBondContact O-N 3.1Å
39	E	80.2	Confident	74.3	Confident	124 Å²	124	83 Å²	83	58%	0.579	42%	0.421	S	S	*	.	H	α-helix	trans	-68.1	-41	176.3	-75.8	-176.8	95.8	0	0	110.7	Q35 R36 N42 S43	Q35-E39 WeakPolarHBondContact O-CB 3.37Å; Q35-E39 WeakPolarHBondContact O-CG 3.24Å; Q35-E39 PolarHBondContact O-N 2.87Å; R36-E39 PolarHBondContact O-N 2.77Å; E39-N42 PolarHBondContact O-N 3.44Å; E39-S43 VanDerWaalsContact O-CB 3.26Å; E39-S43 WeakPolarHBondContact O-CB 3.39Å; E39-S43 PolarHBondContact O-N 3.44Å; E39-S43 PolarHBondContact O-OG 3.38Å
40	M	77.6	Confident	75.6	Confident	122 Å²	122	79.7 Å²	79.7	60%	0.601	41%	0.407	S	S	*	.	H	α-helix	trans	-62.8	-44.5	172.5	-171	-174.9	-170.9	0	0	111.1	R36 S43 I44	R36-M40 VanDerWaalsContact O-CB 3.24Å; R36-M40 WeakPolarHBondContact O-CB 3.28Å; R36-M40 PolarHBondContact O-N 3.05Å; M40-S43 PolarHBondContact O-OG 3.14Å; M40-I44 HydrophobicContact CG-CD1 4.11Å; M40-I44 WeakPolarHBondContact O-CB 3.46Å; M40-I44 WeakPolarHBondContact O-CD1 3.43Å; M40-I44 WeakPolarHBondContact O-CG1 3.41Å; M40-I44 PolarHBondContact O-N 2.96Å; M40-I44 VanDerWaalsContact O-N 3.08Å
41	R	77.5	Confident	76.6	Confident	85 Å²	85	85.8 Å²	85.8	32%	0.321	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-45.5	174.5	-77.9	-176.8	-179.6	103.3	5.4	111.8	E37 T38 I44 L45 I76	E37-R41 VanDerWaalsContact CG-NH1 3.35Å; E37-R41 WeakPolarHBondContact O-CB 3.47Å; E37-R41 VanDerWaalsContact O-CG 3.28Å; E37-R41 WeakPolarHBondContact O-CG 3.2Å; E37-R41 PolarHBondContact O-N 2.73Å; E37-R41 IonicContact OE1-CZ 3.69Å; E37-R41 IonicContact OE1-NH1 2.71Å; E37-R41 PolarHBondContact OE1-NH1 2.79Å; E37-R41 IonicContact OE1-NH2 3.39Å; E37-R41 PolarHBondContact OE1-NH2 3.49Å; T38-R41 PolarHBondContact O-N 2.77Å; R41-I44 PolarHBondContact O-N 3.35Å; R41-L45 WeakPolarHBondContact O-CB 3.19Å; R41-L45 VanDerWaalsContact O-CG 3.24Å; R41-L45 WeakPolarHBondContact O-CG 3.24Å; R41-L45 PolarHBondContact O-N 3.45Å; R41-I76 HydrophobicContact CB-CD1 4.24Å; R41-I76 HydrophobicContact CG-CD1 3.95Å; R41-I76 HydrophobicContact CG-CG1 4.45Å
42	N	80.4	Confident	77.5	Confident	89 Å²	89	83.4 Å²	83.4	48%	0.476	42%	0.418	S	S	.	.	H	α-helix	trans	-70.8	-34.1	-177.2	-164.5	9	0	0	0	111.6	T38 E39 L45 A46 R54	T38-N42 WeakPolarHBondContact O-CB 3.26Å; T38-N42 PolarHBondContact O-N 3.1Å; E39-N42 PolarHBondContact O-N 3.44Å; N42-L45 PolarHBondContact O-N 3.25Å; N42-A46 WeakPolarHBondContact O-CB 3.41Å; N42-A46 PolarHBondContact O-N 2.95Å; N42-R54 PolarHBondContact OD1-NH2 3.36Å; N42-R54 VanDerWaalsContact OD1-NH2 3.13Å
43	S	82	Confident	78.2	Confident	58 Å²	58	79.2 Å²	79.2	41%	0.406	40%	0.399	S	S	.	.	H	α-helix	trans	-67	-42.6	174.6	72.1	0	0	0	0	111.2	E39 M40 A46 Q47	E39-S43 VanDerWaalsContact O-CB 3.26Å; E39-S43 WeakPolarHBondContact O-CB 3.39Å; E39-S43 PolarHBondContact O-N 3.44Å; E39-S43 PolarHBondContact O-OG 3.38Å; M40-S43 PolarHBondContact O-OG 3.14Å; S43-A46 WeakPolarHBondContact O-CB 3.34Å; S43-A46 PolarHBondContact O-N 2.75Å; S43-Q47 WeakPolarHBondContact O-CG 3.43Å; S43-Q47 PolarHBondContact O-N 3.27Å
44	I	79.3	Confident	78.9	Confident	30 Å²	30	81.8 Å²	81.8	15%	0.154	40%	0.396	C	S	.	.	H	α-helix	trans	-59.9	-50.6	172.8	-70.8	166.3	0	0	0	110.3	M40 R41 A46 Q47 V48 A79	M40-I44 HydrophobicContact CG-CD1 4.11Å; M40-I44 WeakPolarHBondContact O-CB 3.46Å; M40-I44 WeakPolarHBondContact O-CD1 3.43Å; M40-I44 WeakPolarHBondContact O-CG1 3.41Å; M40-I44 PolarHBondContact O-N 2.96Å; M40-I44 VanDerWaalsContact O-N 3.08Å; R41-I44 PolarHBondContact O-N 3.35Å; I44-A46 VanDerWaalsContact C-N 3.26Å; I44-A46 PolarHBondContact O-N 3.49Å; I44-Q47 PolarHBondContact O-N 3.38Å; I44-V48 HydrophobicContact CG2-CG2 4.37Å; I44-V48 WeakPolarHBondContact O-CB 3.49Å; I44-V48 WeakPolarHBondContact O-CG2 3.28Å; I44-V48 PolarHBondContact O-N 2.99Å; I44-A79 HydrophobicContact CG2-CB 3.16Å
45	L	76.6	Confident	79.5	Confident	11 Å²	11	77 Å²	77	6%	0.058	39%	0.386	C	S	.	.	H	α-helix	trans	-60.1	-37.9	177.4	-72.4	170.5	0	0	0	111.4	R41 N42 V48 L49 E72 L75 I76	R41-L45 WeakPolarHBondContact O-CB 3.19Å; R41-L45 VanDerWaalsContact O-CG 3.24Å; R41-L45 WeakPolarHBondContact O-CG 3.24Å; R41-L45 PolarHBondContact O-N 3.45Å; N42-L45 PolarHBondContact O-N 3.25Å; L45-V48 PolarHBondContact O-N 2.97Å; L45-L49 HydrophobicContact CB-CD1 4.09Å; L45-L49 HydrophobicContact CD2-CD1 4.12Å; L45-L49 WeakPolarHBondContact O-CB 3.21Å; L45-L49 WeakPolarHBondContact O-CD1 3.37Å; L45-L49 WeakPolarHBondContact O-CG 3.47Å; L45-L49 PolarHBondContact O-N 2.64Å; L45-E72 HydrophobicContact CD1-CG 4.37Å; L45-L75 HydrophobicContact CD2-CB 3.81Å; L45-L75 HydrophobicContact CD2-CD2 3.83Å; L45-L75 HydrophobicContact CD2-CG 4.45Å; L45-I76 HydrophobicContact CD1-CD1 4.38Å; L45-I76 HydrophobicContact CD1-CG1 4.43Å; L45-I76 HydrophobicContact CD2-CG1 4.18Å; L45-I76 HydrophobicContact CG-CG1 4.23Å
46	A	79.1	Confident	79.9	Confident	38 Å²	38	77.8 Å²	77.8	31%	0.314	38%	0.384	S	S	.	.	H	α-helix	trans	-67.8	-33.5	177.3	0	0	0	0	0	113.5	N42 S43 I44	N42-A46 WeakPolarHBondContact O-CB 3.41Å; N42-A46 PolarHBondContact O-N 2.95Å; S43-A46 WeakPolarHBondContact O-CB 3.34Å; S43-A46 PolarHBondContact O-N 2.75Å; I44-A46 VanDerWaalsContact C-N 3.26Å; I44-A46 PolarHBondContact O-N 3.49Å
47	Q	77.9	Confident	80.2	Confident	146 Å²	146	70.8 Å²	70.8	68%	0.682	36%	0.359	S	S	*	.	H	α-helix	trans	-76.4	-33.3	176.6	-74.2	179	-37.8	0	0	111.9	S43 I44	S43-Q47 WeakPolarHBondContact O-CG 3.43Å; S43-Q47 PolarHBondContact O-N 3.27Å; I44-Q47 PolarHBondContact O-N 3.38Å
48	V	76.5	Confident	80.8	Confident	13 Å²	13	69.1 Å²	69.1	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-86.3	-34.7	-176.6	171.7	0	0	0	0	112.4	I44 L45 L75 A79 L84 K87 I88	I44-V48 HydrophobicContact CG2-CG2 4.37Å; I44-V48 WeakPolarHBondContact O-CB 3.49Å; I44-V48 WeakPolarHBondContact O-CG2 3.28Å; I44-V48 PolarHBondContact O-N 2.99Å; L45-V48 PolarHBondContact O-N 2.97Å; V48-L75 HydrophobicContact CB-CD2 4.44Å; V48-L75 HydrophobicContact CG1-CD2 3.66Å; V48-L75 HydrophobicContact CG1-CG 3.94Å; V48-A79 HydrophobicContact CG2-CB 4.16Å; V48-L84 HydrophobicContact CB-CD1 4.32Å; V48-L84 HydrophobicContact CG1-CD1 3.54Å; V48-L84 HydrophobicContact CG1-CD2 4.04Å; V48-L84 HydrophobicContact CG1-CG 4.25Å; V48-L84 HydrophobicContact CG2-CB 4.31Å; V48-L84 HydrophobicContact CG2-CD1 3.77Å; V48-K87 CarbonylContact O-C 3.27Å; V48-K87 VanDerWaalsContact O-CA 3.29Å; V48-K87 WeakPolarHBondContact O-CA 3.16Å; V48-I88 HydrophobicContact CG1-CD1 3.86Å; V48-I88 HydrophobicContact CG1-CG1 4.28Å; V48-I88 PolarHBondContact O-N 2.84Å
49	L	79.8	Confident	81.2	Confident	12 Å²	12	69.7 Å²	69.7	6%	0.063	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-93.2	138	-177	-68.1	159.7	0	0	0	111.3	L45 A53 R54 L57 L75 L93	L45-L49 HydrophobicContact CB-CD1 4.09Å; L45-L49 HydrophobicContact CD2-CD1 4.12Å; L45-L49 WeakPolarHBondContact O-CB 3.21Å; L45-L49 WeakPolarHBondContact O-CD1 3.37Å; L45-L49 WeakPolarHBondContact O-CG 3.47Å; L45-L49 PolarHBondContact O-N 2.64Å; L49-A53 HydrophobicContact CB-CB 4.37Å; L49-A53 HydrophobicContact CD2-CB 3.7Å; L49-R54 HydrophobicContact CB-CG 4.41Å; L49-R54 HydrophobicContact CD1-CG 4.48Å; L49-L57 HydrophobicContact CD1-CD1 4.36Å; L49-L75 HydrophobicContact CD1-CD2 3.93Å; L49-L75 HydrophobicContact CD2-CD2 3.48Å; L49-L75 VanDerWaalsContact CD2-CD2 3.48Å; L49-L75 HydrophobicContact CG-CD2 3.52Å; L49-L93 HydrophobicContact CD2-CD1 3.93Å
50	D	84.5	Confident	81.3	Confident	60 Å²	60	65.5 Å²	65.5	32%	0.321	34%	0.34	S	S	.	.			trans	-75.9	162.8	165.3	-175.2	43.7	0	0	0	112	S52 A53 R54 I88	D50-S52 PolarHBondContact O-N 2.83Å; D50-S52 PolarHBondContact OD2-N 3.41Å; D50-S52 PolarHBondContact OD2-OG 3.34Å; D50-A53 PolarHBondContact O-N 3.13Å; D50-A53 VanDerWaalsContact O-N 3.13Å; D50-R54 PolarHBondContact O-N 2.9Å; D50-I88 PolarHBondContact N-O 3.47Å
51	Q	82.3	Confident	81.7	Confident	170 Å²	170	61.7 Å²	61.7	79%	0.794	33%	0.328	S	S	*	.	H	α-helix	trans	-54.8	-40.5	176.9	-98.1	-162	73.6	0	0	112.2	R54 A55	Q51-R54 PolarHBondContact O-N 3.24Å; Q51-A55 PolarHBondContact O-N 2.98Å; Q51-A55 VanDerWaalsContact O-N 3.14Å
52	S	82.2	Confident	82.1	Confident	43 Å²	43	64.3 Å²	64.3	30%	0.301	35%	0.347	S	S	.	.	H	α-helix	trans	-60.3	-46.8	176.5	56.9	0	0	0	0	112.3	D50 R54 A55 R56	D50-S52 PolarHBondContact O-N 2.83Å; D50-S52 PolarHBondContact OD2-N 3.41Å; D50-S52 PolarHBondContact OD2-OG 3.34Å; S52-R54 PolarHBondContact O-N 3.42Å; S52-A55 PolarHBondContact O-N 3.19Å; S52-R56 PolarHBondContact O-N 3.22Å; S52-R56 VanDerWaalsContact O-N 3.1Å
53	A	82.3	Confident	82.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-37.4	179.2	0	0	0	0	0	112.1	L49 D50 R56 L57 I88 L93	L49-A53 HydrophobicContact CB-CB 4.37Å; L49-A53 HydrophobicContact CD2-CB 3.7Å; D50-A53 PolarHBondContact O-N 3.13Å; D50-A53 VanDerWaalsContact O-N 3.13Å; A53-R56 PolarHBondContact O-N 3.16Å; A53-L57 WeakPolarHBondContact O-CB 3.49Å; A53-L57 PolarHBondContact O-N 3.16Å; A53-I88 WeakPolarHBondContact CB-O 3.4Å; A53-L93 HydrophobicContact CB-CD2 4.36Å
54	R	83.3	Confident	82.5	Confident	112 Å²	112	68.2 Å²	68.2	42%	0.423	36%	0.362	S	S	.	.	H	α-helix	trans	-61.4	-46.5	175	-110.4	-179	167.3	173.6	-4.8	112.4	N42 L49 D50 Q51 S52 R56 L57 S58	N42-R54 PolarHBondContact OD1-NH2 3.36Å; N42-R54 VanDerWaalsContact OD1-NH2 3.13Å; L49-R54 HydrophobicContact CB-CG 4.41Å; L49-R54 HydrophobicContact CD1-CG 4.48Å; D50-R54 PolarHBondContact O-N 2.9Å; Q51-R54 PolarHBondContact O-N 3.24Å; S52-R54 PolarHBondContact O-N 3.42Å; R54-R56 VanDerWaalsContact C-N 3.31Å; R54-R56 PolarHBondContact O-N 3.08Å; R54-L57 PolarHBondContact O-N 2.72Å; R54-S58 WeakPolarHBondContact O-CB 3.49Å; R54-S58 PolarHBondContact O-N 3.02Å
55	A	85	Confident	82.7	Confident	56 Å²	56	70.3 Å²	70.3	46%	0.463	38%	0.377	S	S	.	.	H	α-helix	trans	-61.8	-41.3	176.8	0	0	0	0	0	111.3	Q51 S52 S58 N59	Q51-A55 PolarHBondContact O-N 2.98Å; Q51-A55 VanDerWaalsContact O-N 3.14Å; S52-A55 PolarHBondContact O-N 3.19Å; A55-S58 PolarHBondContact O-N 2.95Å; A55-N59 PolarHBondContact O-N 3.31Å; A55-N59 PolarHBondContact O-ND2 3.5Å
56	R	83.2	Confident	83	Confident	123 Å²	123	77.8 Å²	77.8	46%	0.464	41%	0.412	S	S	.	.	H	α-helix	trans	-66.5	-41.4	177.4	-165.4	63	170.8	175	1.7	112.6	S52 A53 R54 S58 N59 L60 E90	S52-R56 PolarHBondContact O-N 3.22Å; S52-R56 VanDerWaalsContact O-N 3.1Å; A53-R56 PolarHBondContact O-N 3.16Å; R54-R56 VanDerWaalsContact C-N 3.31Å; R54-R56 PolarHBondContact O-N 3.08Å; R56-S58 VanDerWaalsContact C-N 3.35Å; R56-N59 PolarHBondContact O-N 2.94Å; R56-L60 WeakPolarHBondContact O-CB 3.38Å; R56-L60 PolarHBondContact O-N 3.27Å; R56-E90 HydrophobicContact CB-CG 4.08Å; R56-E90 WeakPolarHBondContact CD-OE1 3.38Å; R56-E90 HydrophobicContact CG-CG 3.99Å; R56-E90 IonicContact CZ-OE1 3.86Å; R56-E90 IonicContact NE-OE1 3.12Å; R56-E90 PolarHBondContact NE-OE1 3.41Å
57	L	82.8	Confident	83.1	Confident	14 Å²	14	79.9 Å²	79.9	7%	0.073	41%	0.414	C	S	.	.	H	α-helix	trans	-65.1	-39.6	177.6	-164.5	146.1	0	0	0	111.2	L49 A53 R54 L60 A61 V71 E72 L93	L49-L57 HydrophobicContact CD1-CD1 4.36Å; A53-L57 WeakPolarHBondContact O-CB 3.49Å; A53-L57 PolarHBondContact O-N 3.16Å; R54-L57 PolarHBondContact O-N 2.72Å; L57-L60 PolarHBondContact O-N 2.83Å; L57-A61 WeakPolarHBondContact O-CB 3.21Å; L57-A61 PolarHBondContact O-N 3.31Å; L57-V71 HydrophobicContact CD1-CG1 4.2Å; L57-E72 HydrophobicContact CD1-CG 4.06Å; L57-E72 HydrophobicContact CD2-CG 4.01Å; L57-L93 HydrophobicContact CB-CD2 4.12Å; L57-L93 HydrophobicContact CD1-CD1 4.44Å; L57-L93 HydrophobicContact CD1-CD2 4.32Å
58	S	85.6	Confident	83.3	Confident	69 Å²	69	73.1 Å²	73.1	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-46.9	173.5	-176.6	0	0	0	0	112.1	R54 A55 R56 L60 A61 L62	R54-S58 WeakPolarHBondContact O-CB 3.49Å; R54-S58 PolarHBondContact O-N 3.02Å; A55-S58 PolarHBondContact O-N 2.95Å; R56-S58 VanDerWaalsContact C-N 3.35Å; S58-L60 VanDerWaalsContact C-N 3.34Å; S58-L60 PolarHBondContact O-N 3.45Å; S58-A61 PolarHBondContact O-N 2.82Å; S58-L62 WeakPolarHBondContact O-CG 3.5Å; S58-L62 PolarHBondContact O-N 3.37Å; S58-L62 VanDerWaalsContact O-N 3.16Å
59	N	87.2	Confident	83.7	Confident	88 Å²	88	77.1 Å²	77.1	47%	0.471	40%	0.404	S	S	.	.	H	α-helix	trans	-63.3	-39.4	174.7	-73.5	-22.4	0	0	0	112.2	A55 R56 L62 V63	A55-N59 PolarHBondContact O-N 3.31Å; A55-N59 PolarHBondContact O-ND2 3.5Å; R56-N59 PolarHBondContact O-N 2.94Å; N59-L62 WeakPolarHBondContact O-CB 3.24Å; N59-L62 PolarHBondContact O-N 3.03Å; N59-V63 WeakPolarHBondContact O-CG2 3.43Å; N59-V63 PolarHBondContact O-N 3.32Å; N59-V63 VanDerWaalsContact O-N 3.16Å
60	L	82.9	Confident	83.8	Confident	36 Å²	36	78.5 Å²	78.5	19%	0.188	42%	0.417	C	S	.	.	H	α-helix	trans	-66.2	-38.2	176.6	-177	63.1	0	0	0	111.6	R56 L57 S58 L62 V63 K64 A68 L97	R56-L60 WeakPolarHBondContact O-CB 3.38Å; R56-L60 PolarHBondContact O-N 3.27Å; L57-L60 PolarHBondContact O-N 2.83Å; S58-L60 VanDerWaalsContact C-N 3.34Å; S58-L60 PolarHBondContact O-N 3.45Å; L60-L62 VanDerWaalsContact C-N 3.27Å; L60-L62 PolarHBondContact O-N 3.1Å; L60-V63 PolarHBondContact O-N 2.87Å; L60-K64 HydrophobicContact CD1-CB 4.49Å; L60-K64 CarbonylContact O-C 3.12Å; L60-K64 VanDerWaalsContact O-C 3.27Å; L60-K64 WeakPolarHBondContact O-CA 3.37Å; L60-K64 PolarHBondContact O-N 3.42Å; L60-A68 HydrophobicContact CG-CB 4.41Å; L60-L97 HydrophobicContact CD2-CD1 4.19Å; L60-L97 HydrophobicContact CD2-CD2 3.81Å
61	A	85.1	Confident	83.5	Confident	42 Å²	42	75.7 Å²	75.7	35%	0.347	40%	0.402	S	S	.	.	H	α-helix	trans	-62.6	-35.3	175.9	0	0	0	0	0	112	L57 S58 P65 A68	L57-A61 WeakPolarHBondContact O-CB 3.21Å; L57-A61 PolarHBondContact O-N 3.31Å; S58-A61 PolarHBondContact O-N 2.82Å; A61-P65 WeakPolarHBondContact O-CD 3.35Å; A61-A68 HydrophobicContact CB-CB 3.8Å
62	L	85.5	Confident	83.4	Confident	141 Å²	141	70.9 Å²	70.9	74%	0.738	38%	0.38	S	S	*	.	H	α-helix	trans	-67.7	-39.7	174.2	-67.9	171	0	0	0	112.5	S58 N59 L60	S58-L62 WeakPolarHBondContact O-CG 3.5Å; S58-L62 PolarHBondContact O-N 3.37Å; S58-L62 VanDerWaalsContact O-N 3.16Å; N59-L62 WeakPolarHBondContact O-CB 3.24Å; N59-L62 PolarHBondContact O-N 3.03Å; L60-L62 VanDerWaalsContact C-N 3.27Å; L60-L62 PolarHBondContact O-N 3.1Å
63	V	88.1	Confident	83.4	Confident	112 Å²	112	74 Å²	74	68%	0.679	39%	0.393	S	S	*	.	H	α-helix	trans	-85.6	-41	-175.3	-177.8	0	0	0	0	111.9	N59 L60	N59-V63 WeakPolarHBondContact O-CG2 3.43Å; N59-V63 PolarHBondContact O-N 3.32Å; N59-V63 VanDerWaalsContact O-N 3.16Å; L60-V63 PolarHBondContact O-N 2.87Å
64	K	83.8	Confident	83.3	Confident	117 Å²	117	77.4 Å²	77.4	51%	0.509	41%	0.407	S	S	.	.			trans	-148.9	87.1	-177.9	-71.9	-175.3	-177.7	172.8	0	110.7	L60 E66 K67 A68	L60-K64 HydrophobicContact CD1-CB 4.49Å; L60-K64 CarbonylContact O-C 3.12Å; L60-K64 VanDerWaalsContact O-C 3.27Å; L60-K64 WeakPolarHBondContact O-CA 3.37Å; L60-K64 PolarHBondContact O-N 3.42Å; K64-E66 VanDerWaalsContact C-N 3.28Å; K64-E66 PolarHBondContact O-N 3.22Å; K64-K67 HydrophobicContact CB-CB 4.33Å; K64-K67 HydrophobicContact CB-CG 4.43Å; K64-K67 HydrophobicContact CD-CD 4.38Å; K64-K67 PolarHBondContact O-N 3.41Å; K64-A68 PolarHBondContact O-N 2.74Å
65	P	83.2	Confident	83.1	Confident	73 Å²	73	72.1 Å²	72.1	47%	0.474	39%	0.387	S	S	.	.	H	α-helix	trans	-63.3	-31.1	-177.8	24.6	-34	0	0	0	113	A61 K67 A68 N69	A61-P65 WeakPolarHBondContact O-CD 3.35Å; P65-K67 VanDerWaalsContact C-N 3.34Å; P65-K67 PolarHBondContact O-N 3.27Å; P65-A68 PolarHBondContact O-N 3.34Å; P65-N69 WeakPolarHBondContact O-CB 3.37Å; P65-N69 PolarHBondContact O-N 2.97Å; P65-N69 PolarHBondContact O-ND2 3.17Å
66	E	83.9	Confident	82.8	Confident	168 Å²	168	70.1 Å²	70.1	79%	0.785	37%	0.368	S	S	*	.	H	α-helix	trans	-59.9	-43.5	176.9	-71.4	-155.5	106.2	0	0	112.7	K64 A70	K64-E66 VanDerWaalsContact C-N 3.28Å; K64-E66 PolarHBondContact O-N 3.22Å; E66-A70 PolarHBondContact O-N 2.9Å; E66-A70 VanDerWaalsContact O-N 3.11Å
67	K	79.8	Confident	82.5	Confident	83 Å²	83	68 Å²	68	36%	0.361	36%	0.364	S	S	.	.	H	α-helix	trans	-70.7	-36.5	178.9	-69.1	-157.3	177.6	-155.1	0	111.6	K64 P65 A70 V71 L97 S101	K64-K67 HydrophobicContact CB-CB 4.33Å; K64-K67 HydrophobicContact CB-CG 4.43Å; K64-K67 HydrophobicContact CD-CD 4.38Å; K64-K67 PolarHBondContact O-N 3.41Å; P65-K67 VanDerWaalsContact C-N 3.34Å; P65-K67 PolarHBondContact O-N 3.27Å; K67-A70 PolarHBondContact O-N 2.91Å; K67-V71 WeakPolarHBondContact O-CG2 3.28Å; K67-V71 PolarHBondContact O-N 2.96Å; K67-V71 VanDerWaalsContact O-N 3.13Å; K67-L97 HydrophobicContact CB-CD1 4.01Å; K67-L97 HydrophobicContact CD-CD1 4.36Å; K67-S101 PolarHBondContact NZ-OG 3.28Å
68	A	83.4	Confident	82.1	Confident	4 Å²	4	69.1 Å²	69.1	3%	0.033	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-46.4	175.2	0	0	0	0	0	111.8	L60 A61 K64 P65 A70 V71 E72	L60-A68 HydrophobicContact CG-CB 4.41Å; A61-A68 HydrophobicContact CB-CB 3.8Å; K64-A68 PolarHBondContact O-N 2.74Å; P65-A68 PolarHBondContact O-N 3.34Å; A68-A70 VanDerWaalsContact C-N 3.33Å; A68-A70 PolarHBondContact O-N 2.75Å; A68-V71 PolarHBondContact O-N 3.28Å; A68-E72 PolarHBondContact O-N 3.35Å
69	N	83.5	Confident	81.6	Confident	97 Å²	97	67 Å²	67	52%	0.519	36%	0.355	S	S	.	.	H	α-helix	trans	-59.8	-41.7	176.2	-78.7	-56.5	0	0	0	112.3	P65 V71 E72 N73	P65-N69 WeakPolarHBondContact O-CB 3.37Å; P65-N69 PolarHBondContact O-N 2.97Å; P65-N69 PolarHBondContact O-ND2 3.17Å; N69-V71 VanDerWaalsContact C-N 3.32Å; N69-V71 PolarHBondContact O-N 3.32Å; N69-E72 PolarHBondContact O-N 3.41Å; N69-N73 WeakPolarHBondContact O-CB 3.29Å; N69-N73 PolarHBondContact O-N 3.26Å
70	A	82.4	Confident	81	Confident	41 Å²	41	71.9 Å²	71.9	34%	0.339	37%	0.367	S	S	.	.	H	α-helix	trans	-61.5	-41.4	177	0	0	0	0	0	111.9	E66 K67 A68 Y74 V100	E66-A70 PolarHBondContact O-N 2.9Å; E66-A70 VanDerWaalsContact O-N 3.11Å; K67-A70 PolarHBondContact O-N 2.91Å; A68-A70 VanDerWaalsContact C-N 3.33Å; A68-A70 PolarHBondContact O-N 2.75Å; A70-Y74 WeakPolarHBondContact O-CB 3.47Å; A70-Y74 PolarHBondContact O-N 3.41Å; A70-V100 HydrophobicContact CB-CG1 4.19Å
71	V	78.9	Confident	80.3	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.006	38%	0.384	C	S	.	.	H	α-helix	trans	-69	-44.8	177.5	172.3	0	0	0	0	111.7	L57 K67 A68 N69 N73 Y74 L75 L93 L97	L57-V71 HydrophobicContact CD1-CG1 4.2Å; K67-V71 WeakPolarHBondContact O-CG2 3.28Å; K67-V71 PolarHBondContact O-N 2.96Å; K67-V71 VanDerWaalsContact O-N 3.13Å; A68-V71 PolarHBondContact O-N 3.28Å; N69-V71 VanDerWaalsContact C-N 3.32Å; N69-V71 PolarHBondContact O-N 3.32Å; V71-N73 VanDerWaalsContact C-N 3.34Å; V71-N73 PolarHBondContact O-N 3.44Å; V71-Y74 PolarHBondContact O-N 3.23Å; V71-L75 WeakPolarHBondContact O-CB 3.32Å; V71-L75 PolarHBondContact O-N 2.93Å; V71-L93 HydrophobicContact CG1-CD1 3.39Å; V71-L93 HydrophobicContact CG1-CG 4.12Å; V71-L97 HydrophobicContact CG2-CB 3.97Å; V71-L97 HydrophobicContact CG2-CD1 3.34Å; V71-L97 HydrophobicContact CG2-CG 4.24Å
72	E	80.1	Confident	79.4	Confident	68 Å²	68	77.3 Å²	77.3	32%	0.318	40%	0.4	S	S	.	.	H	α-helix	trans	-58.1	-47.1	175.8	-78	-171.5	154.9	0	0	111.5	L45 L57 A68 N69 Y74 L75 I76	L45-E72 HydrophobicContact CD1-CG 4.37Å; L57-E72 HydrophobicContact CD1-CG 4.06Å; L57-E72 HydrophobicContact CD2-CG 4.01Å; A68-E72 PolarHBondContact O-N 3.35Å; N69-E72 PolarHBondContact O-N 3.41Å; E72-Y74 VanDerWaalsContact C-N 3.32Å; E72-Y74 PolarHBondContact O-N 3.28Å; E72-L75 PolarHBondContact O-N 3.28Å; E72-I76 WeakPolarHBondContact O-CB 3.38Å; E72-I76 WeakPolarHBondContact O-CD1 3.34Å; E72-I76 VanDerWaalsContact O-CG1 3.24Å; E72-I76 WeakPolarHBondContact O-CG1 3.5Å; E72-I76 PolarHBondContact O-N 3.13Å
73	N	82.6	Confident	78.1	Confident	109 Å²	109	79.1 Å²	79.1	58%	0.583	40%	0.402	S	S	*	.	H	α-helix	trans	-64.4	-39.2	-179.2	-159.3	27.7	0	0	0	111.7	N69 V71 Q77	N69-N73 WeakPolarHBondContact O-CB 3.29Å; N69-N73 PolarHBondContact O-N 3.26Å; V71-N73 VanDerWaalsContact C-N 3.34Å; V71-N73 PolarHBondContact O-N 3.44Å; N73-Q77 WeakPolarHBondContact O-CB 3.32Å; N73-Q77 PolarHBondContact O-N 2.9Å
74	Y	79.8	Confident	76.8	Confident	72 Å²	72	75.7 Å²	75.7	28%	0.282	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-40.4	174.9	-172.2	-106.3	0	0	0	112.2	A70 V71 E72 Q77 M78 I96 V100	A70-Y74 WeakPolarHBondContact O-CB 3.47Å; A70-Y74 PolarHBondContact O-N 3.41Å; V71-Y74 PolarHBondContact O-N 3.23Å; E72-Y74 VanDerWaalsContact C-N 3.32Å; E72-Y74 PolarHBondContact O-N 3.28Å; Y74-Q77 PolarHBondContact O-N 3.11Å; Y74-M78 HydrophobicContact CD1-CE 3.35Å; Y74-M78 HydrophobicContact CD1-CG 4.47Å; Y74-M78 HydrophobicContact CD1-SD 4.2Å; Y74-M78 HydrophobicContact CE1-CE 3.16Å; Y74-M78 HydrophobicContact CE1-CG 4.15Å; Y74-M78 HydrophobicContact CE1-SD 3.52Å; Y74-M78 VanDerWaalsContact CE1-SD 3.52Å; Y74-M78 HydrophobicContact CG-CE 4.44Å; Y74-M78 PolarHBondContact O-N 3.4Å; Y74-I96 HydrophobicContact CD1-CG2 3.39Å; Y74-I96 HydrophobicContact CE1-CG2 3.61Å; Y74-V100 HydrophobicContact CD1-CG2 3.88Å; Y74-V100 HydrophobicContact CD2-CG2 4.08Å; Y74-V100 HydrophobicContact CE1-CG2 4.26Å; Y74-V100 HydrophobicContact CE2-CG2 4.46Å; Y74-V100 HydrophobicContact CG-CG2 3.77Å
75	L	78	Confident	75.3	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	40%	0.399	C	S	.	.	H	α-helix	trans	-64.9	-45.5	176.5	-123.8	72.5	0	0	0	112	L45 V48 L49 V71 E72 Q77 M78 A79 I88 L93 I96	L45-L75 HydrophobicContact CD2-CB 3.81Å; L45-L75 HydrophobicContact CD2-CD2 3.83Å; L45-L75 HydrophobicContact CD2-CG 4.45Å; V48-L75 HydrophobicContact CB-CD2 4.44Å; V48-L75 HydrophobicContact CG1-CD2 3.66Å; V48-L75 HydrophobicContact CG1-CG 3.94Å; L49-L75 HydrophobicContact CD1-CD2 3.93Å; L49-L75 HydrophobicContact CD2-CD2 3.48Å; L49-L75 VanDerWaalsContact CD2-CD2 3.48Å; L49-L75 HydrophobicContact CG-CD2 3.52Å; V71-L75 WeakPolarHBondContact O-CB 3.32Å; V71-L75 PolarHBondContact O-N 2.93Å; E72-L75 PolarHBondContact O-N 3.28Å; L75-Q77 VanDerWaalsContact C-N 3.27Å; L75-Q77 PolarHBondContact O-N 2.96Å; L75-M78 HydrophobicContact CD1-CE 3.95Å; L75-M78 PolarHBondContact O-N 3.43Å; L75-A79 WeakPolarHBondContact O-CB 3.47Å; L75-A79 PolarHBondContact O-N 3.45Å; L75-I88 HydrophobicContact CD1-CD1 3.55Å; L75-I88 HydrophobicContact CD2-CD1 4.35Å; L75-I88 HydrophobicContact CG-CD1 4.07Å; L75-L93 HydrophobicContact CD1-CD1 4.41Å; L75-I96 HydrophobicContact CD1-CD1 4.28Å
76	I	79.4	Confident	74.6	Confident	14 Å²	14	73.1 Å²	73.1	7%	0.072	40%	0.399	C	S	.	.	H	α-helix	trans	-58.7	-44.1	175.6	-69.5	161	0	0	0	109.8	R41 L45 E72 A79 R80	R41-I76 HydrophobicContact CB-CD1 4.24Å; R41-I76 HydrophobicContact CG-CD1 3.95Å; R41-I76 HydrophobicContact CG-CG1 4.45Å; L45-I76 HydrophobicContact CD1-CD1 4.38Å; L45-I76 HydrophobicContact CD1-CG1 4.43Å; L45-I76 HydrophobicContact CD2-CG1 4.18Å; L45-I76 HydrophobicContact CG-CG1 4.23Å; E72-I76 WeakPolarHBondContact O-CB 3.38Å; E72-I76 WeakPolarHBondContact O-CD1 3.34Å; E72-I76 VanDerWaalsContact O-CG1 3.24Å; E72-I76 WeakPolarHBondContact O-CG1 3.5Å; E72-I76 PolarHBondContact O-N 3.13Å; I76-A79 PolarHBondContact O-N 3.39Å; I76-R80 HydrophobicContact CG2-CG 4.45Å; I76-R80 VanDerWaalsContact O-CG 3.28Å; I76-R80 WeakPolarHBondContact O-CG 3.36Å; I76-R80 PolarHBondContact O-N 3.18Å
77	Q	77.4	Confident	74.2	Confident	79 Å²	79	72.5 Å²	72.5	37%	0.369	39%	0.394	S	S	.	.	H	α-helix	trans	-61.5	-48.4	177.7	-172	174.8	9.5	0	0	111.3	N73 Y74 L75 A79 R80 F81	N73-Q77 WeakPolarHBondContact O-CB 3.32Å; N73-Q77 PolarHBondContact O-N 2.9Å; Y74-Q77 PolarHBondContact O-N 3.11Å; L75-Q77 VanDerWaalsContact C-N 3.27Å; L75-Q77 PolarHBondContact O-N 2.96Å; Q77-A79 VanDerWaalsContact C-N 3.25Å; Q77-A79 PolarHBondContact O-N 3.45Å; Q77-R80 PolarHBondContact O-N 3.25Å; Q77-F81 HydrophobicContact CG-CD2 3.9Å; Q77-F81 HydrophobicContact CG-CE2 3.53Å; Q77-F81 WeakPolarHBondContact O-CD2 3.42Å; Q77-F81 PolarHBondContact O-N 3.28Å; Q77-F81 VanDerWaalsContact O-N 3.15Å
78	M	74.2	Confident	74	Confident	37 Å²	37	69.3 Å²	69.3	18%	0.182	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-33	177.2	-75.1	-163.1	-70.1	0	0	113	Y74 L75 F81 G82 K83 L84 I96	Y74-M78 HydrophobicContact CD1-CE 3.35Å; Y74-M78 HydrophobicContact CD1-CG 4.47Å; Y74-M78 HydrophobicContact CD1-SD 4.2Å; Y74-M78 HydrophobicContact CE1-CE 3.16Å; Y74-M78 HydrophobicContact CE1-CG 4.15Å; Y74-M78 HydrophobicContact CE1-SD 3.52Å; Y74-M78 VanDerWaalsContact CE1-SD 3.52Å; Y74-M78 HydrophobicContact CG-CE 4.44Å; Y74-M78 PolarHBondContact O-N 3.4Å; L75-M78 HydrophobicContact CD1-CE 3.95Å; L75-M78 PolarHBondContact O-N 3.43Å; M78-F81 PolarHBondContact O-N 3.47Å; M78-G82 PolarHBondContact O-N 3.31Å; M78-K83 PolarHBondContact O-N 3.05Å; M78-L84 HydrophobicContact CB-CD1 3.56Å; M78-L84 HydrophobicContact CB-CD2 4.34Å; M78-L84 HydrophobicContact CB-CG 3.78Å; M78-L84 HydrophobicContact CE-CD2 4.27Å; M78-I96 HydrophobicContact CE-CD1 3.96Å
79	A	75.3	Confident	73.9	Confident	23 Å²	23	71.5 Å²	71.5	19%	0.19	40%	0.396	C	S	.	.	H	α-helix	trans	-73.9	-40.3	-180	0	0	0	0	0	111.8	I44 V48 L75 I76 Q77 F81 G82 L84	I44-A79 HydrophobicContact CG2-CB 3.16Å; V48-A79 HydrophobicContact CG2-CB 4.16Å; L75-A79 WeakPolarHBondContact O-CB 3.47Å; L75-A79 PolarHBondContact O-N 3.45Å; I76-A79 PolarHBondContact O-N 3.39Å; Q77-A79 VanDerWaalsContact C-N 3.25Å; Q77-A79 PolarHBondContact O-N 3.45Å; A79-F81 PolarHBondContact O-N 2.89Å; A79-G82 PolarHBondContact O-N 3.03Å; A79-L84 HydrophobicContact CB-CD1 3.77Å
80	R	73.4	Confident	73.7	Confident	191 Å²	191	70.3 Å²	70.3	72%	0.721	39%	0.387	S	S	*	.	H	α-helix	trans	-61.4	-33.3	173	-70.9	176.5	107.4	161.8	8.1	112.4	I76 Q77 G82	I76-R80 HydrophobicContact CG2-CG 4.45Å; I76-R80 VanDerWaalsContact O-CG 3.28Å; I76-R80 WeakPolarHBondContact O-CG 3.36Å; I76-R80 PolarHBondContact O-N 3.18Å; Q77-R80 PolarHBondContact O-N 3.25Å; R80-G82 PolarHBondContact O-N 3.46Å
81	F	69.1	Low	73.6	Confident	128 Å²	128	71.9 Å²	71.9	56%	0.561	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-2.5	174.4	-74.3	-62.6	0	0	0	114	Q77 M78 A79 K83	Q77-F81 HydrophobicContact CG-CD2 3.9Å; Q77-F81 HydrophobicContact CG-CE2 3.53Å; Q77-F81 WeakPolarHBondContact O-CD2 3.42Å; Q77-F81 PolarHBondContact O-N 3.28Å; Q77-F81 VanDerWaalsContact O-N 3.15Å; M78-F81 PolarHBondContact O-N 3.47Å; A79-F81 PolarHBondContact O-N 2.89Å; F81-K83 HydrophobicContact CB-CG 4.29Å; F81-K83 PolarHBondContact O-N 3Å; F81-K83 VanDerWaalsContact O-N 3.1Å
82	G	64.8	Low	73.5	Confident	65 Å²	65	72.8 Å²	72.8	67%	0.67	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	16.6	-178.1	0	0	0	0	0	113.7	M78 A79 R80 L84	M78-G82 PolarHBondContact O-N 3.31Å; A79-G82 PolarHBondContact O-N 3.03Å; R80-G82 PolarHBondContact O-N 3.46Å; G82-L84 VanDerWaalsContact C-N 3.33Å
83	K	58.5	Low	73.4	Confident	179 Å²	179	69.9 Å²	69.9	78%	0.778	39%	0.392	S	S	*	.			trans	-83.9	-8.8	-179	-77.3	-158.1	176.7	-161	0	113.5	M78 F81 G85	M78-K83 PolarHBondContact O-N 3.05Å; F81-K83 HydrophobicContact CB-CG 4.29Å; F81-K83 PolarHBondContact O-N 3Å; F81-K83 VanDerWaalsContact O-N 3.1Å; K83-G85 PolarHBondContact O-N 3.21Å
84	L	62.2	Low	73.3	Confident	39 Å²	39	68.3 Å²	68.3	20%	0.204	38%	0.383	C	S	.	.			trans	-86.3	84.9	176.5	-73	161.2	0	0	0	109.4	V48 M78 A79 G82 G86 I88	V48-L84 HydrophobicContact CB-CD1 4.32Å; V48-L84 HydrophobicContact CG1-CD1 3.54Å; V48-L84 HydrophobicContact CG1-CD2 4.04Å; V48-L84 HydrophobicContact CG1-CG 4.25Å; V48-L84 HydrophobicContact CG2-CB 4.31Å; V48-L84 HydrophobicContact CG2-CD1 3.77Å; M78-L84 HydrophobicContact CB-CD1 3.56Å; M78-L84 HydrophobicContact CB-CD2 4.34Å; M78-L84 HydrophobicContact CB-CG 3.78Å; M78-L84 HydrophobicContact CE-CD2 4.27Å; A79-L84 HydrophobicContact CB-CD1 3.77Å; G82-L84 VanDerWaalsContact C-N 3.33Å; L84-G86 PolarHBondContact O-N 3.49Å; L84-I88 HydrophobicContact CD2-CD1 3.45Å; L84-I88 VanDerWaalsContact CD2-CD1 3.45Å; L84-I88 HydrophobicContact CD2-CG1 4.08Å
85	G	52	Low	73.3	Confident	89 Å²	89	70 Å²	70	92%	0.918	39%	0.393	S	S	*	.			trans	-76.9	11.9	176	0	0	0	0	0	114.6	K83	K83-G85 PolarHBondContact O-N 3.21Å
86	G	67.2	Low	73.2	Confident	47 Å²	47	71.2 Å²	71.2	49%	0.485	40%	0.399	S	S	.	.	S	Bend	trans	-173.8	169.7	-176.7	0	0	0	0	0	114.3	L84	L84-G86 PolarHBondContact O-N 3.49Å
87	K	75.4	Confident	73.1	Confident	155 Å²	155	72.2 Å²	72.2	67%	0.674	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-72	131.7	176	-61.8	-175	179.4	-172	0	110.4	V48	V48-K87 CarbonylContact O-C 3.27Å; V48-K87 VanDerWaalsContact O-CA 3.29Å; V48-K87 WeakPolarHBondContact O-CA 3.16Å
88	I	76.5	Confident	73.2	Confident	17 Å²	17	73.8 Å²	73.8	9%	0.087	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-83.8	120.6	172.8	-68.4	172.4	0	0	0	108.6	V48 D50 A53 L75 L84 L93 I96	V48-I88 HydrophobicContact CG1-CD1 3.86Å; V48-I88 HydrophobicContact CG1-CG1 4.28Å; V48-I88 PolarHBondContact O-N 2.84Å; D50-I88 PolarHBondContact N-O 3.47Å; A53-I88 WeakPolarHBondContact CB-O 3.4Å; L75-I88 HydrophobicContact CD1-CD1 3.55Å; L75-I88 HydrophobicContact CD2-CD1 4.35Å; L75-I88 HydrophobicContact CG-CD1 4.07Å; L84-I88 HydrophobicContact CD2-CD1 3.45Å; L84-I88 VanDerWaalsContact CD2-CD1 3.45Å; L84-I88 HydrophobicContact CD2-CG1 4.08Å; I88-L93 HydrophobicContact CG2-CB 4.09Å; I88-L93 HydrophobicContact CG2-CD1 4.41Å; I88-I96 HydrophobicContact CD1-CD1 3.66Å; I88-I96 HydrophobicContact CG1-CD1 4.45Å; I88-I96 HydrophobicContact CG2-CD1 4.38Å
89	S	81.4	Confident	73.1	Confident	50 Å²	50	77.5 Å²	77.5	35%	0.35	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-79.5	169.4	169.2	58.4	0	0	0	0	111.5	S91 G92 L93	S89-S91 VanDerWaalsContact C-N 3.28Å; S89-S91 PolarHBondContact O-N 3.44Å; S89-S91 PolarHBondContact OG-OG 2.97Å; S89-G92 PolarHBondContact O-N 3.15Å; S89-G92 VanDerWaalsContact O-N 3.15Å; S89-L93 PolarHBondContact O-N 3.25Å
90	E	80	Confident	72.9	Confident	72 Å²	72	77.1 Å²	77.1	34%	0.336	42%	0.422	S	S	.	.	H	α-helix	trans	-52	-44.2	175	179.6	175.9	-174	0	0	113.1	R56 G92 L93 I94	R56-E90 HydrophobicContact CB-CG 4.08Å; R56-E90 WeakPolarHBondContact CD-OE1 3.38Å; R56-E90 HydrophobicContact CG-CG 3.99Å; R56-E90 IonicContact CZ-OE1 3.86Å; R56-E90 IonicContact NE-OE1 3.12Å; R56-E90 PolarHBondContact NE-OE1 3.41Å; E90-G92 PolarHBondContact O-N 3.46Å; E90-L93 WeakPolarHBondContact O-CB 3.2Å; E90-L93 PolarHBondContact O-N 2.97Å; E90-I94 HydrophobicContact CG-CD1 3.92Å; E90-I94 VanDerWaalsContact O-CG1 3.32Å; E90-I94 WeakPolarHBondContact O-CG1 3.45Å; E90-I94 PolarHBondContact O-N 2.96Å
91	S	79.8	Confident	72.7	Confident	74 Å²	74	70.3 Å²	70.3	52%	0.517	40%	0.404	S	S	.	.	H	α-helix	trans	-60.6	-44.7	178.3	50.4	0	0	0	0	112.3	S89 L93 I94 E95	S89-S91 VanDerWaalsContact C-N 3.28Å; S89-S91 PolarHBondContact O-N 3.44Å; S89-S91 PolarHBondContact OG-OG 2.97Å; S91-L93 VanDerWaalsContact C-N 3.32Å; S91-L93 PolarHBondContact O-N 2.94Å; S91-I94 PolarHBondContact O-N 3.34Å; S91-E95 PolarHBondContact O-N 2.97Å
92	G	76.3	Confident	72.6	Confident	20 Å²	20	69 Å²	69	21%	0.206	40%	0.4	C	S	.	.	H	α-helix	trans	-64.6	-36.9	176.1	0	0	0	0	0	112.4	S89 E90 I94 E95 I96	S89-G92 PolarHBondContact O-N 3.15Å; S89-G92 VanDerWaalsContact O-N 3.15Å; E90-G92 PolarHBondContact O-N 3.46Å; G92-I94 VanDerWaalsContact C-N 3.33Å; G92-I94 PolarHBondContact O-N 3.49Å; G92-E95 PolarHBondContact O-N 3.44Å; G92-I96 WeakPolarHBondContact O-CB 3.4Å; G92-I96 WeakPolarHBondContact O-CD1 3.38Å; G92-I96 WeakPolarHBondContact O-CG1 3.37Å; G92-I96 PolarHBondContact O-N 3.15Å
93	L	77.1	Confident	72.4	Confident	7 Å²	7	71.3 Å²	71.3	4%	0.037	39%	0.393	C	S	.	.	H	α-helix	trans	-63.9	-39.6	175.5	-165.6	73.2	0	0	0	111.7	L49 A53 L57 V71 L75 I88 S89 E90 S91 I96 L97	L49-L93 HydrophobicContact CD2-CD1 3.93Å; A53-L93 HydrophobicContact CB-CD2 4.36Å; L57-L93 HydrophobicContact CB-CD2 4.12Å; L57-L93 HydrophobicContact CD1-CD1 4.44Å; L57-L93 HydrophobicContact CD1-CD2 4.32Å; V71-L93 HydrophobicContact CG1-CD1 3.39Å; V71-L93 HydrophobicContact CG1-CG 4.12Å; L75-L93 HydrophobicContact CD1-CD1 4.41Å; I88-L93 HydrophobicContact CG2-CB 4.09Å; I88-L93 HydrophobicContact CG2-CD1 4.41Å; S89-L93 PolarHBondContact O-N 3.25Å; E90-L93 WeakPolarHBondContact O-CB 3.2Å; E90-L93 PolarHBondContact O-N 2.97Å; S91-L93 VanDerWaalsContact C-N 3.32Å; S91-L93 PolarHBondContact O-N 2.94Å; L93-I96 PolarHBondContact O-N 3.4Å; L93-L97 VanDerWaalsContact O-CB 3.26Å; L93-L97 WeakPolarHBondContact O-CB 3.3Å; L93-L97 PolarHBondContact O-N 3.1Å
94	I	81.2	Confident	72.3	Confident	76 Å²	76	68 Å²	68	39%	0.39	39%	0.388	S	S	.	.	H	α-helix	trans	-67.5	-44.9	177.7	-66.9	164.1	0	0	0	110.8	E90 S91 G92 I96 L97 E98	E90-I94 HydrophobicContact CG-CD1 3.92Å; E90-I94 VanDerWaalsContact O-CG1 3.32Å; E90-I94 WeakPolarHBondContact O-CG1 3.45Å; E90-I94 PolarHBondContact O-N 2.96Å; S91-I94 PolarHBondContact O-N 3.34Å; G92-I94 VanDerWaalsContact C-N 3.33Å; G92-I94 PolarHBondContact O-N 3.49Å; I94-I96 VanDerWaalsContact C-N 3.31Å; I94-I96 PolarHBondContact O-N 2.85Å; I94-L97 WeakPolarHBondContact O-CB 3.29Å; I94-L97 PolarHBondContact O-N 2.87Å; I94-E98 WeakPolarHBondContact O-CB 3.04Å; I94-E98 PolarHBondContact O-N 3.43Å
95	E	80.4	Confident	71.8	Confident	108 Å²	108	74.1 Å²	74.1	51%	0.505	42%	0.415	S	S	.	.	H	α-helix	trans	-61.4	-40.7	175.2	-75	-171.3	-164.7	0	0	112.1	S91 G92 E98 K99	S91-E95 PolarHBondContact O-N 2.97Å; G92-E95 PolarHBondContact O-N 3.44Å; E95-E98 PolarHBondContact O-N 2.9Å; E95-K99 WeakPolarHBondContact O-CB 3.26Å; E95-K99 VanDerWaalsContact O-CG 3.29Å; E95-K99 WeakPolarHBondContact O-CG 3.18Å; E95-K99 PolarHBondContact O-N 3.43Å; E95-K99 IonicContact OE2-NZ 3.82Å
96	I	75.6	Confident	71.6	Confident	25 Å²	25	77.6 Å²	77.6	13%	0.128	41%	0.405	C	S	.	.	H	α-helix	trans	-64.3	-44.2	175.1	-72.4	163.7	0	0	0	109.9	Y74 L75 M78 I88 G92 L93 I94 E98 K99 V100	Y74-I96 HydrophobicContact CD1-CG2 3.39Å; Y74-I96 HydrophobicContact CE1-CG2 3.61Å; L75-I96 HydrophobicContact CD1-CD1 4.28Å; M78-I96 HydrophobicContact CE-CD1 3.96Å; I88-I96 HydrophobicContact CD1-CD1 3.66Å; I88-I96 HydrophobicContact CG1-CD1 4.45Å; I88-I96 HydrophobicContact CG2-CD1 4.38Å; G92-I96 WeakPolarHBondContact O-CB 3.4Å; G92-I96 WeakPolarHBondContact O-CD1 3.38Å; G92-I96 WeakPolarHBondContact O-CG1 3.37Å; G92-I96 PolarHBondContact O-N 3.15Å; L93-I96 PolarHBondContact O-N 3.4Å; I94-I96 VanDerWaalsContact C-N 3.31Å; I94-I96 PolarHBondContact O-N 2.85Å; I96-E98 VanDerWaalsContact C-N 3.31Å; I96-E98 PolarHBondContact O-N 3.34Å; I96-K99 PolarHBondContact O-N 3.44Å; I96-V100 HydrophobicContact CG2-CG2 4.07Å; I96-V100 VanDerWaalsContact O-CB 3.3Å; I96-V100 WeakPolarHBondContact O-CB 3.42Å; I96-V100 WeakPolarHBondContact O-CG2 3.06Å; I96-V100 PolarHBondContact O-N 3.01Å
97	L	76.6	Confident	70.4	Confident	36 Å²	36	84.1 Å²	84.1	19%	0.188	42%	0.42	C	S	.	.	H	α-helix	trans	-61.2	-41.3	177.6	176.6	69.3	0	0	0	111.5	L60 K67 V71 L93 I94 S101	L60-L97 HydrophobicContact CD2-CD1 4.19Å; L60-L97 HydrophobicContact CD2-CD2 3.81Å; K67-L97 HydrophobicContact CB-CD1 4.01Å; K67-L97 HydrophobicContact CD-CD1 4.36Å; V71-L97 HydrophobicContact CG2-CB 3.97Å; V71-L97 HydrophobicContact CG2-CD1 3.34Å; V71-L97 HydrophobicContact CG2-CG 4.24Å; L93-L97 VanDerWaalsContact O-CB 3.26Å; L93-L97 WeakPolarHBondContact O-CB 3.3Å; L93-L97 PolarHBondContact O-N 3.1Å; I94-L97 WeakPolarHBondContact O-CB 3.29Å; I94-L97 PolarHBondContact O-N 2.87Å; L97-S101 VanDerWaalsContact O-CB 3.29Å; L97-S101 WeakPolarHBondContact O-CB 3.29Å; L97-S101 PolarHBondContact O-N 3.2Å
98	E	79.5	Confident	68.9	Low	111 Å²	111	83.3 Å²	83.3	52%	0.519	43%	0.428	S	S	.	.	H	α-helix	trans	-65.9	-47.3	176.8	-171.8	177.4	-171.5	0	0	111.1	I94 E95 I96 S101 Q102	I94-E98 WeakPolarHBondContact O-CB 3.04Å; I94-E98 PolarHBondContact O-N 3.43Å; E95-E98 PolarHBondContact O-N 2.9Å; I96-E98 VanDerWaalsContact C-N 3.31Å; I96-E98 PolarHBondContact O-N 3.34Å; E98-S101 PolarHBondContact O-N 2.93Å; E98-Q102 VanDerWaalsContact O-CG 3.3Å; E98-Q102 WeakPolarHBondContact O-CG 3.37Å; E98-Q102 PolarHBondContact O-N 3.16Å; E98-Q102 PolarHBondContact OE1-NE2 2.94Å
99	K	72.6	Confident	67.5	Low	116 Å²	116	88 Å²	88	50%	0.504	46%	0.458	S	S	.	.	H	α-helix	trans	-60.4	-45.8	174.7	-75.4	170.8	-178.6	161.8	0	111.7	E95 I96 Q102 Q103	E95-K99 WeakPolarHBondContact O-CB 3.26Å; E95-K99 VanDerWaalsContact O-CG 3.29Å; E95-K99 WeakPolarHBondContact O-CG 3.18Å; E95-K99 PolarHBondContact O-N 3.43Å; E95-K99 IonicContact OE2-NZ 3.82Å; I96-K99 PolarHBondContact O-N 3.44Å; K99-Q102 PolarHBondContact O-N 2.77Å; K99-Q103 WeakPolarHBondContact O-CB 3.45Å; K99-Q103 PolarHBondContact O-N 3.31Å
100	V	70.8	Confident	66.1	Low	15 Å²	15	89.5 Å²	89.5	9%	0.091	47%	0.465	C	S	.	.	H	α-helix	trans	-61.5	-47.1	176.9	169.5	0	0	0	0	109.7	A70 Y74 I96 Q102 Q103 T104	A70-V100 HydrophobicContact CB-CG1 4.19Å; Y74-V100 HydrophobicContact CD1-CG2 3.88Å; Y74-V100 HydrophobicContact CD2-CG2 4.08Å; Y74-V100 HydrophobicContact CE1-CG2 4.26Å; Y74-V100 HydrophobicContact CE2-CG2 4.46Å; Y74-V100 HydrophobicContact CG-CG2 3.77Å; I96-V100 HydrophobicContact CG2-CG2 4.07Å; I96-V100 VanDerWaalsContact O-CB 3.3Å; I96-V100 WeakPolarHBondContact O-CB 3.42Å; I96-V100 WeakPolarHBondContact O-CG2 3.06Å; I96-V100 PolarHBondContact O-N 3.01Å; V100-Q102 VanDerWaalsContact C-N 3.31Å; V100-Q102 PolarHBondContact O-N 3.34Å; V100-Q103 PolarHBondContact O-N 2.81Å; V100-Q103 VanDerWaalsContact O-N 3.16Å; V100-T104 WeakPolarHBondContact O-CB 3.3Å; V100-T104 PolarHBondContact O-N 2.86Å; V100-T104 PolarHBondContact O-OG1 2.96Å
101	S	69.3	Low	64.9	Low	48 Å²	48	91.5 Å²	91.5	34%	0.336	48%	0.482	S	S	.	.	H	α-helix	trans	-57.9	-42.9	177.1	-163.4	0	0	0	0	112	K67 L97 E98	K67-S101 PolarHBondContact NZ-OG 3.28Å; L97-S101 VanDerWaalsContact O-CB 3.29Å; L97-S101 WeakPolarHBondContact O-CB 3.29Å; L97-S101 PolarHBondContact O-N 3.2Å; E98-S101 PolarHBondContact O-N 2.93Å
102	Q	68	Low	63.4	Low	101 Å²	101	95.6 Å²	95.6	47%	0.472	49%	0.491	S	S	.	.	H	α-helix	trans	-72.8	-32.2	177.5	-69.1	177.2	19.2	0	0	113.1	E98 K99 V100 K106	E98-Q102 VanDerWaalsContact O-CG 3.3Å; E98-Q102 WeakPolarHBondContact O-CG 3.37Å; E98-Q102 PolarHBondContact O-N 3.16Å; E98-Q102 PolarHBondContact OE1-NE2 2.94Å; K99-Q102 PolarHBondContact O-N 2.77Å; V100-Q102 VanDerWaalsContact C-N 3.31Å; V100-Q102 PolarHBondContact O-N 3.34Å; Q102-K106 PolarHBondContact O-N 3.29Å
103	Q	59.7	Low	62.3	Low	113 Å²	113	101.8 Å²	101.8	53%	0.528	52%	0.519	S	S	.	.	H	α-helix	trans	-84.4	-29.8	-176.4	-160.6	179.8	-16	0	0	111.7	K99 V100 E105 K106	K99-Q103 WeakPolarHBondContact O-CB 3.45Å; K99-Q103 PolarHBondContact O-N 3.31Å; V100-Q103 PolarHBondContact O-N 2.81Å; V100-Q103 VanDerWaalsContact O-N 3.16Å; Q103-E105 PolarHBondContact O-N 2.75Å; Q103-K106 CarbonylContact O-C 3.54Å; Q103-K106 PolarHBondContact O-N 2.78Å; Q103-K106 VanDerWaalsContact O-O 3.09Å
104	T	55.8	Low	61.4	Low	110 Å²	110	112.3 Å²	112.3	68%	0.675	56%	0.559	S	S	*	*	H	α-helix	trans	-63.3	-32.4	168.4	-50.6	0	0	0	0	111.1	V100 K106	V100-T104 WeakPolarHBondContact O-CB 3.3Å; V100-T104 PolarHBondContact O-N 2.86Å; V100-T104 PolarHBondContact O-OG1 2.96Å; T104-K106 VanDerWaalsContact C-N 3.34Å
105	E	52.4	Low	60.3	Low	166 Å²	166	118.9 Å²	118.9	78%	0.776	58%	0.578	S	S	*	*	H	α-helix	trans	-70.6	-27.6	169.8	-71	-172.6	109.8	0	0	113	Q103	Q103-E105 PolarHBondContact O-N 2.75Å
106	K	47.4	Very low	59.1	Low	163 Å²	163	125.3 Å²	125.3	71%	0.709	60%	0.598	S	S	*	*	S	Bend	trans	-111.2	73.4	-178.7	-65.3	-175.3	-177.8	179.3	0	112	Q102 Q103 T104	Q102-K106 PolarHBondContact O-N 3.29Å; Q103-K106 CarbonylContact O-C 3.54Å; Q103-K106 PolarHBondContact O-N 2.78Å; Q103-K106 VanDerWaalsContact O-O 3.09Å; T104-K106 VanDerWaalsContact C-N 3.34Å
107	K	43.1	Very low	57.9	Low	183 Å²	183	128.9 Å²	128.9	80%	0.796	62%	0.621	S	S	*	*			trans	42.7	103.2	155.5	-78.4	-175.6	174.6	-177.9	0	117.2	T109	K107-T109 PolarHBondContact O-N 3.04Å
108	T	43.8	Very low	56.7	Low	138 Å²	138	134.8 Å²	134.8	85%	0.847	65%	0.649	S	S	*	*			trans	-21.1	97.5	142.9	-38.5	0	0	0	0	113.8
109	T	47.2	Very low	55.2	Low	117 Å²	117	137.2 Å²	137.2	72%	0.718	67%	0.666	S	S	*	*			trans	-128.5	90.2	159.1	-51.9	0	0	0	0	107.1	K107	K107-T109 PolarHBondContact O-N 3.04Å
110	V	51.4	Low	54.2	Low	81 Å²	81	135.6 Å²	135.6	49%	0.491	67%	0.669	S	S	.	*			trans	-98.5	94.7	172	-177.4	0	0	0	0	107.2	F112	V110-F112 HydrophobicContact CB-CE2 4.27Å; V110-F112 HydrophobicContact CG1-CD2 3.87Å; V110-F112 HydrophobicContact CG1-CE2 3.62Å; V110-F112 HydrophobicContact CG1-CZ 4.19Å; V110-F112 PolarHBondContact O-N 3.17Å
111	T	55.5	Low	53.2	Low	114 Å²	114	141.6 Å²	141.6	70%	0.699	70%	0.701	S	S	*	*			trans	-72.7	101.4	172.4	-40.2	0	0	0	0	108.4	N113	T111-N113 PolarHBondContact O-N 3.08Å; T111-N113 VanDerWaalsContact O-N 3.08Å
112	F	46.9	Very low	52.3	Low	159 Å²	159	145 Å²	145	70%	0.697	72%	0.715	S	S	*	*			trans	-75.5	90.7	174.4	-84.2	-91.7	0	0	0	110.1	V110 R114	V110-F112 HydrophobicContact CB-CE2 4.27Å; V110-F112 HydrophobicContact CG1-CD2 3.87Å; V110-F112 HydrophobicContact CG1-CE2 3.62Å; V110-F112 HydrophobicContact CG1-CZ 4.19Å; V110-F112 PolarHBondContact O-N 3.17Å; F112-R114 PolarHBondContact O-N 3.44Å
113	N	54.6	Low	51.6	Low	150 Å²	150	147.7 Å²	147.7	80%	0.802	73%	0.728	S	S	*	*			trans	-75.4	84.9	159	-93.6	22.8	0	0	0	108.2	T111 R115	T111-N113 PolarHBondContact O-N 3.08Å; T111-N113 VanDerWaalsContact O-N 3.08Å; N113-R115 PolarHBondContact O-N 3.47Å
114	R	57.1	Low	51.2	Low	229 Å²	229	148.9 Å²	148.9	86%	0.864	74%	0.738	S	S	*	*			trans	-63.3	92.3	161.4	-84.4	-176.2	178	161.7	-0.9	107.5	F112 R116	F112-R114 PolarHBondContact O-N 3.44Å; R114-R116 PolarHBondContact O-N 2.96Å
115	R	58.4	Low	51.1	Low	213 Å²	213	150.3 Å²	150.3	80%	0.804	74%	0.742	S	S	*	*			trans	-52.7	103.3	163.7	178.5	175	152.3	170.5	-7.8	107.1	N113 V117	N113-R115 PolarHBondContact O-N 3.47Å; R115-V117 VanDerWaalsContact C-N 3.26Å; R115-V117 HydrophobicContact CG-CG1 4.03Å; R115-V117 PolarHBondContact O-N 3.35Å
116	R	56	Low	50.8	Low	243 Å²	243	156.9 Å²	156.9	92%	0.917	76%	0.761	S	S	*	*			trans	-61	94.7	162	-76.2	-166.6	-174.2	-177.7	1.9	106.6	R114	R114-R116 PolarHBondContact O-N 2.96Å
117	V	50.4	Low	50.9	Low	101 Å²	101	156.6 Å²	156.6	61%	0.612	76%	0.764	S	S	*	*			trans	-85	98.9	150.8	-69.5	0	0	0	0	103.8	R115	R115-V117 VanDerWaalsContact C-N 3.26Å; R115-V117 HydrophobicContact CG-CG1 4.03Å; R115-V117 PolarHBondContact O-N 3.35Å
118	M	50.4	Low	51.4	Low	159 Å²	159	155.2 Å²	155.2	78%	0.783	76%	0.762	S	S	*	*				49.2	101.3	100	-81.8	-69.5	-159.7	0	0	111.2
119	D	48.4	Very low	51.8	Low	163 Å²	163	156.2 Å²	156.2	87%	0.872	76%	0.758	S	S	*	*			trans	-135.1	101	139.7	-136.5	32.9	0	0	0	105.5
120	S	51.7	Low	52	Low	81 Å²	81	158.5 Å²	158.5	57%	0.566	76%	0.76	S	S	*	*			trans	-76.3	168.2	149.7	-63.2	0	0	0	0	107.7
121	D	50	Low	52.1	Low	141 Å²	141	163.3 Å²	163.3	75%	0.754	78%	0.777	S	S	*	*			trans	93.2	127	-173.2	-69.4	-140.5	0	0	0	112
122	D	50.8	Low	51.9	Low	119 Å²	119	166.6 Å²	166.6	64%	0.636	78%	0.782	S	S	*	*			cis	-164.3	149.3	5.7	-120.4	-146	0	0	0	108.2
123	E	52	Low	52.2	Low	158 Å²	158	167.1 Å²	167.1	74%	0.738	79%	0.788	S	S	*	*			trans	20.2	122.8	138.4	-91.4	148	71.8	0	0	120.3
124	D	51.2	Low	52	Low	138 Å²	138	168.5 Å²	168.5	74%	0.738	79%	0.787	S	S	*	*				159.7	130.4	110.8	-84.4	-35.2	0	0	0	114.4
125	D	53.8	Low	51.6	Low	141 Å²	141	163.4 Å²	163.4	75%	0.754	78%	0.781	S	S	*	*			trans	48.3	115	148.4	-68.7	-34	0	0	0	121.9
126	Y	46.1	Very low	51	Low	304 Å²	304	158.9 Å²	158.9	100%	1.192	78%	0.778	S	S	*	*				-177	0	107.3	-106.1	-78.9	0	0	0	112.7

Retrieved 126 of 126 residues in 79 ms (Link to these results)

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