A0A087XXK6_POEFO Loading...

DNA-binding protein inhibitor ID-4

AlphaFold DB , UniProt , Accession A0A087XXK6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 139 aa.

						>A0A087XXK6_POEFO|A0A087XXK6
MKAVTPVHPQSGGGSSSQLSLHYLSKQSLNIARCRMEEEDLFCLQYDMNDCYSRLKRLVPTIPQDKKVSKVEILQHVIDYILDLQLALETHPSLQKQPPQRTCPPAASNPNRTPLTVLNIDHHQRTSIVKKPEDSVLCR
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.8	Very low	45.8	Very low	228 Å²	228	148 Å²	148	100%	1.123	83%	0.83	S	S	*	*				0	106.1	0	-68.3	178.3	173.9	0	0	109.7
2	K	42	Very low	45.9	Very low	216 Å²	216	142.2 Å²	142.2	94%	0.939	83%	0.827	S	S	*	*			trans	159	134.9	131.6	45.9	-126.7	153.2	-163.1	0	109.8
3	A	48.8	Very low	45.4	Very low	91 Å²	91	136.9 Å²	136.9	75%	0.752	82%	0.823	S	S	*	*			trans	-91.1	-178.5	-166.7	0	0	0	0	0	112.5
4	V	45.3	Very low	45.5	Very low	135 Å²	135	131.3 Å²	131.3	82%	0.818	81%	0.806	S	S	*	*			trans	123.5	122.5	138.8	-165.7	0	0	0	0	114.7
5	T	44.9	Very low	45.8	Very low	124 Å²	124	129.7 Å²	129.7	76%	0.761	80%	0.803	S	S	*	*			trans	-58.7	159.7	173.6	-21.8	0	0	0	0	113.8
6	P	52.5	Low	46.1	Very low	116 Å²	116	127.3 Å²	127.3	75%	0.753	79%	0.792	S	S	*	*				-142.7	130.5	113	31	-12.9	0	0	0	113.6
7	V	45.3	Very low	46.6	Very low	127 Å²	127	123.7 Å²	123.7	77%	0.77	77%	0.773	S	S	*	*				77.3	107.2	99.7	176.3	0	0	0	0	116.2
8	H	53.7	Low	47	Very low	173 Å²	173	124.8 Å²	124.8	80%	0.801	77%	0.768	S	S	*	*				132.5	134.6	127.7	-148	67.3	0	0	0	115
9	P	46.8	Very low	47.5	Very low	101 Å²	101	125.1 Å²	125.1	66%	0.656	76%	0.763	S	S	*	*			trans	-85.3	141.1	-173.1	34.1	-31.1	0	0	0	111.7
10	Q	37.9	Very low	48	Very low	200 Å²	200	121.8 Å²	121.8	94%	0.935	75%	0.745	S	S	*	*			trans	-98.9	104.5	165.3	-150.3	172.3	90.4	0	0	107.9	G12	Q10-G12 PolarHBondContact O-N 3.41Å; Q10-G12 VanDerWaalsContact O-N 3.11Å
11	S	39.8	Very low	48.4	Very low	117 Å²	117	121.5 Å²	121.5	82%	0.818	74%	0.739	S	S	*	*			trans	-57.4	108.5	177	-168.8	0	0	0	0	109.8
12	G	47.1	Very low	49	Very low	78 Å²	78	116.2 Å²	116.2	80%	0.804	71%	0.711	S	S	*	*			trans	-75.7	122.6	163	0	0	0	0	0	108.7	Q10	Q10-G12 PolarHBondContact O-N 3.41Å; Q10-G12 VanDerWaalsContact O-N 3.11Å
13	G	39.4	Very low	49.5	Very low	74 Å²	74	113.6 Å²	113.6	76%	0.763	70%	0.696	S	S	*	*			trans	169.7	105.3	172.6	0	0	0	0	0	114.9
14	G	46.7	Very low	49.9	Very low	58 Å²	58	114.1 Å²	114.1	60%	0.598	69%	0.686	S	S	*	*			trans	88.5	56.4	138.7	0	0	0	0	0	118.2	S16	G14-S16 VanDerWaalsContact C-N 3.31Å
15	S	49.4	Very low	50.7	Low	108 Å²	108	110.6 Å²	110.6	76%	0.755	67%	0.668	S	S	*	*	S	Bend	trans	-92.3	14.9	160.8	-157.7	0	0	0	0	113.2
16	S	51.1	Low	51.3	Low	90 Å²	90	110.7 Å²	110.7	63%	0.629	66%	0.657	S	S	*	*	S	Bend	trans	-97	-23	-179.5	-168.9	0	0	0	0	112.9	G14 S20	G14-S16 VanDerWaalsContact C-N 3.31Å; S16-S20 PolarHBondContact O-N 3.21Å; S16-S20 PolarHBondContact O-OG 3.14Å
17	S	55.3	Low	51.6	Low	67 Å²	67	109.2 Å²	109.2	47%	0.469	64%	0.641	S	S	.	*	H	α-helix	trans	-81.2	-29.1	-175.1	31.3	0	0	0	0	114	S20 L21	S17-S20 PolarHBondContact O-N 3.28Å; S17-L21 WeakPolarHBondContact O-CB 3.42Å; S17-L21 VanDerWaalsContact O-CG 3.31Å; S17-L21 WeakPolarHBondContact O-CG 3.34Å; S17-L21 PolarHBondContact O-N 3.48Å
18	Q	53.2	Low	52.2	Low	144 Å²	144	106.4 Å²	106.4	67%	0.673	63%	0.627	S	S	*	*	H	α-helix	trans	-67	-46.2	177.5	-88	-86.6	4.4	0	0	112.2	S20 L21 H22	Q18-S20 VanDerWaalsContact C-N 3.31Å; Q18-S20 PolarHBondContact O-N 3.31Å; Q18-L21 PolarHBondContact O-N 2.99Å; Q18-H22 PolarHBondContact O-N 3.21Å
19	L	57.4	Low	52	Low	130 Å²	130	103.5 Å²	103.5	68%	0.681	62%	0.616	S	S	*	*	H	α-helix	trans	-65.8	-37.7	177.1	-65.6	176.6	0	0	0	111.4	H22 Y23	L19-H22 PolarHBondContact O-N 3.37Å; L19-Y23 WeakPolarHBondContact O-CB 3.34Å; L19-Y23 PolarHBondContact O-N 3.16Å
20	S	57	Low	52.3	Low	59 Å²	59	103.2 Å²	103.2	41%	0.413	61%	0.609	S	S	.	*	H	α-helix	trans	-65.9	-40.9	176.3	-60.8	0	0	0	0	112.2	S16 S17 Q18 Y23 L24	S16-S20 PolarHBondContact O-N 3.21Å; S16-S20 PolarHBondContact O-OG 3.14Å; S17-S20 PolarHBondContact O-N 3.28Å; Q18-S20 VanDerWaalsContact C-N 3.31Å; Q18-S20 PolarHBondContact O-N 3.31Å; S20-Y23 PolarHBondContact O-N 3.05Å; S20-L24 VanDerWaalsContact O-CB 3.31Å; S20-L24 WeakPolarHBondContact O-CB 3.46Å; S20-L24 WeakPolarHBondContact O-CD1 3.46Å; S20-L24 WeakPolarHBondContact O-CG 3.24Å; S20-L24 PolarHBondContact O-N 3.38Å
21	L	56.3	Low	53	Low	115 Å²	115	99.9 Å²	99.9	60%	0.602	60%	0.597	S	S	*	*	H	α-helix	trans	-66.7	-39.5	174.1	-75.8	175.5	0	0	0	112.1	S17 Q18 Y23 S25	S17-L21 WeakPolarHBondContact O-CB 3.42Å; S17-L21 VanDerWaalsContact O-CG 3.31Å; S17-L21 WeakPolarHBondContact O-CG 3.34Å; S17-L21 PolarHBondContact O-N 3.48Å; Q18-L21 PolarHBondContact O-N 2.99Å; L21-Y23 VanDerWaalsContact C-N 3.33Å; L21-S25 WeakPolarHBondContact O-CB 3.5Å; L21-S25 PolarHBondContact O-N 3.44Å
22	H	59	Low	53.4	Low	117 Å²	117	98.4 Å²	98.4	54%	0.542	59%	0.591	S	S	.	*	H	α-helix	trans	-66.3	-36.7	174.6	-175.9	-105.3	0	0	0	111.9	Q18 L19 K26	Q18-H22 PolarHBondContact O-N 3.21Å; L19-H22 PolarHBondContact O-N 3.37Å; H22-K26 WeakPolarHBondContact O-CB 3.34Å; H22-K26 PolarHBondContact O-N 2.95Å
23	Y	52	Low	53.3	Low	161 Å²	161	101.4 Å²	101.4	63%	0.631	58%	0.578	S	S	*	*	H	α-helix	trans	-72.1	-40.6	176.5	-164	-92.4	0	0	0	112.5	L19 S20 L21 K26 Q27	L19-Y23 WeakPolarHBondContact O-CB 3.34Å; L19-Y23 PolarHBondContact O-N 3.16Å; S20-Y23 PolarHBondContact O-N 3.05Å; L21-Y23 VanDerWaalsContact C-N 3.33Å; Y23-K26 WeakPolarHBondContact O-CB 3.43Å; Y23-K26 PolarHBondContact O-N 3.21Å; Y23-Q27 VanDerWaalsContact O-CB 3.31Å; Y23-Q27 WeakPolarHBondContact O-CB 3.42Å; Y23-Q27 PolarHBondContact O-N 3.22Å
24	L	58.5	Low	53.3	Low	102 Å²	102	102.6 Å²	102.6	53%	0.534	57%	0.574	S	S	.	*	H	α-helix	trans	-67.5	-36.5	173.1	-79.3	159.5	0	0	0	112	S20 Q27 S28	S20-L24 VanDerWaalsContact O-CB 3.31Å; S20-L24 WeakPolarHBondContact O-CB 3.46Å; S20-L24 WeakPolarHBondContact O-CD1 3.46Å; S20-L24 WeakPolarHBondContact O-CG 3.24Å; S20-L24 PolarHBondContact O-N 3.38Å; L24-Q27 PolarHBondContact O-N 3.42Å; L24-S28 WeakPolarHBondContact O-CB 3.31Å; L24-S28 PolarHBondContact O-N 2.93Å; L24-S28 PolarHBondContact O-OG 3.41Å
25	S	62.2	Low	53.3	Low	62 Å²	62	111.9 Å²	111.9	43%	0.434	59%	0.591	S	S	.	*	H	α-helix	trans	-65.9	-42.7	173.2	-179.3	0	0	0	0	111.3	L21 S28 L29	L21-S25 WeakPolarHBondContact O-CB 3.5Å; L21-S25 PolarHBondContact O-N 3.44Å; S25-S28 PolarHBondContact O-OG 3.01Å; S25-L29 VanDerWaalsContact O-CG 3.27Å; S25-L29 WeakPolarHBondContact O-CG 3.44Å; S25-L29 PolarHBondContact O-N 2.99Å
26	K	56.3	Low	53	Low	126 Å²	126	112.4 Å²	112.4	55%	0.548	58%	0.583	S	S	.	*	H	α-helix	trans	-57.5	-54	167.1	-86.3	-175.9	147.9	-175.1	0	110	H22 Y23 S28 L29 N30	H22-K26 WeakPolarHBondContact O-CB 3.34Å; H22-K26 PolarHBondContact O-N 2.95Å; Y23-K26 WeakPolarHBondContact O-CB 3.43Å; Y23-K26 PolarHBondContact O-N 3.21Å; K26-S28 VanDerWaalsContact C-N 3.31Å; K26-S28 PolarHBondContact O-N 3.48Å; K26-L29 CarbonylContact O-C 3.59Å; K26-L29 WeakPolarHBondContact O-CA 3.32Å; K26-L29 VanDerWaalsContact O-CB 3.29Å; K26-L29 WeakPolarHBondContact O-CB 3.44Å; K26-L29 PolarHBondContact O-N 3.29Å; K26-N30 PolarHBondContact O-N 3.4Å; K26-N30 PolarHBondContact O-OD1 3.4Å
27	Q	59.6	Low	52.9	Low	85 Å²	85	115.1 Å²	115.1	40%	0.397	59%	0.586	S	S	.	*	H	α-helix	trans	-59.6	-36.1	-175	-165.2	170.9	3.8	0	0	113.9	Y23 L24 N30 I31	Y23-Q27 VanDerWaalsContact O-CB 3.31Å; Y23-Q27 WeakPolarHBondContact O-CB 3.42Å; Y23-Q27 PolarHBondContact O-N 3.22Å; L24-Q27 PolarHBondContact O-N 3.42Å; Q27-N30 VanDerWaalsContact CA-CG 3.45Å; Q27-N30 VanDerWaalsContact CA-OD1 3.26Å; Q27-N30 WeakPolarHBondContact CA-OD1 3.39Å; Q27-N30 VanDerWaalsContact O-CB 3.23Å; Q27-N30 WeakPolarHBondContact O-CB 3.22Å; Q27-N30 VanDerWaalsContact O-CG 3.26Å; Q27-N30 PolarHBondContact O-N 3.01Å; Q27-N30 VanDerWaalsContact O-N 3.15Å; Q27-I31 HydrophobicContact CG-CD1 4.37Å; Q27-I31 WeakPolarHBondContact O-CG1 3.18Å; Q27-I31 PolarHBondContact O-N 2.96Å
28	S	56.8	Low	52.9	Low	68 Å²	68	117.3 Å²	117.3	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-70.5	-34.1	175	67.2	0	0	0	0	112.2	L24 S25 K26 N30 I31 A32	L24-S28 WeakPolarHBondContact O-CB 3.31Å; L24-S28 PolarHBondContact O-N 2.93Å; L24-S28 PolarHBondContact O-OG 3.41Å; S25-S28 PolarHBondContact O-OG 3.01Å; K26-S28 VanDerWaalsContact C-N 3.31Å; K26-S28 PolarHBondContact O-N 3.48Å; S28-N30 VanDerWaalsContact C-N 3.26Å; S28-N30 PolarHBondContact O-N 3.32Å; S28-I31 PolarHBondContact O-N 2.92Å; S28-A32 PolarHBondContact O-N 3.37Å
29	L	51.1	Low	52.9	Low	112 Å²	112	116.3 Å²	116.3	59%	0.586	58%	0.584	S	S	*	*	H	α-helix	trans	-64.8	-28.9	167.9	-63.3	168.3	0	0	0	111.6	S25 K26 R33	S25-L29 VanDerWaalsContact O-CG 3.27Å; S25-L29 WeakPolarHBondContact O-CG 3.44Å; S25-L29 PolarHBondContact O-N 2.99Å; K26-L29 CarbonylContact O-C 3.59Å; K26-L29 WeakPolarHBondContact O-CA 3.32Å; K26-L29 VanDerWaalsContact O-CB 3.29Å; K26-L29 WeakPolarHBondContact O-CB 3.44Å; K26-L29 PolarHBondContact O-N 3.29Å; L29-R33 VanDerWaalsContact O-CD 3.27Å; L29-R33 WeakPolarHBondContact O-CD 3.28Å; L29-R33 WeakPolarHBondContact O-CG 3.42Å
30	N	52.8	Low	52.9	Low	95 Å²	95	111.1 Å²	111.1	51%	0.508	56%	0.557	S	S	.	*	H	α-helix	trans	-66.2	-42.8	172.5	-36.7	-3.2	0	0	0	111.8	K26 Q27 S28 A32 R33	K26-N30 PolarHBondContact O-N 3.4Å; K26-N30 PolarHBondContact O-OD1 3.4Å; Q27-N30 VanDerWaalsContact CA-CG 3.45Å; Q27-N30 VanDerWaalsContact CA-OD1 3.26Å; Q27-N30 WeakPolarHBondContact CA-OD1 3.39Å; Q27-N30 VanDerWaalsContact O-CB 3.23Å; Q27-N30 WeakPolarHBondContact O-CB 3.22Å; Q27-N30 VanDerWaalsContact O-CG 3.26Å; Q27-N30 PolarHBondContact O-N 3.01Å; Q27-N30 VanDerWaalsContact O-N 3.15Å; S28-N30 VanDerWaalsContact C-N 3.26Å; S28-N30 PolarHBondContact O-N 3.32Å; N30-A32 VanDerWaalsContact C-N 3.33Å; N30-R33 WeakPolarHBondContact O-CB 3.18Å; N30-R33 PolarHBondContact O-N 3.41Å; N30-R33 VanDerWaalsContact O-N 3.12Å
31	I	51.7	Low	52.8	Low	130 Å²	130	114.5 Å²	114.5	67%	0.667	57%	0.569	S	S	*	*	H	α-helix	trans	-75.5	-29.1	-168.3	-65.2	161.6	0	0	0	110.3	Q27 S28 R33	Q27-I31 HydrophobicContact CG-CD1 4.37Å; Q27-I31 WeakPolarHBondContact O-CG1 3.18Å; Q27-I31 PolarHBondContact O-N 2.96Å; S28-I31 PolarHBondContact O-N 2.92Å; I31-R33 VanDerWaalsContact C-N 3.26Å; I31-R33 PolarHBondContact O-N 2.85Å
32	A	48.8	Very low	52.8	Low	85 Å²	85	114 Å²	114	70%	0.702	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-7.7	170.2	0	0	0	0	0	113.8	S28 N30 C34	S28-A32 PolarHBondContact O-N 3.37Å; N30-A32 VanDerWaalsContact C-N 3.33Å; A32-C34 PolarHBondContact O-N 3.32Å
33	R	44.1	Very low	52.6	Low	141 Å²	141	110 Å²	110	53%	0.532	55%	0.547	S	S	.	.			trans	-84.4	67.7	177	-70.4	169.2	87.1	83.8	4.5	111	L29 N30 I31 R35	L29-R33 VanDerWaalsContact O-CD 3.27Å; L29-R33 WeakPolarHBondContact O-CD 3.28Å; L29-R33 WeakPolarHBondContact O-CG 3.42Å; N30-R33 WeakPolarHBondContact O-CB 3.18Å; N30-R33 PolarHBondContact O-N 3.41Å; N30-R33 VanDerWaalsContact O-N 3.12Å; I31-R33 VanDerWaalsContact C-N 3.26Å; I31-R33 PolarHBondContact O-N 2.85Å; R33-R35 PolarHBondContact O-N 3.2Å
34	C	39.2	Very low	52.7	Low	100 Å²	100	108.7 Å²	108.7	68%	0.676	55%	0.551	S	S	*	*			trans	-51.6	124.9	137.3	-95.6	0	0	0	0	106.2	A32 M36	A32-C34 PolarHBondContact O-N 3.32Å; C34-M36 VanDerWaalsContact C-N 3.32Å; C34-M36 PolarHBondContact O-N 3Å
35	R	48.3	Very low	52.7	Low	253 Å²	253	109.5 Å²	109.5	96%	0.955	55%	0.552	S	S	*	*	S	Bend	trans	-55.1	89	-173	-67.7	-89.5	-174.3	165.1	-0	111.3	R33	R33-R35 PolarHBondContact O-N 3.2Å
36	M	42.9	Very low	52.6	Low	119 Å²	119	116.8 Å²	116.8	59%	0.586	57%	0.571	S	S	*	*			trans	-112.1	117	155.7	-75.6	165.9	67	0	0	105.1	C34 D40	C34-M36 VanDerWaalsContact C-N 3.32Å; C34-M36 PolarHBondContact O-N 3Å; M36-D40 HydrophobicContact CE-CB 4.24Å; M36-D40 WeakPolarHBondContact CE-OD2 3.5Å
37	E	48.6	Very low	53.9	Low	147 Å²	147	113.9 Å²	113.9	69%	0.687	56%	0.562	S	S	*	*			trans	-47.5	139.8	173.6	60.3	-155.3	89	0	0	110.3	E39 D40	E37-E39 VanDerWaalsContact C-OE2 3.26Å; E37-E39 VanDerWaalsContact CB-OE2 3.24Å; E37-E39 WeakPolarHBondContact CB-OE2 3.24Å; E37-E39 HydrophobicContact CG-CB 4.4Å; E37-E39 PolarHBondContact O-N 2.86Å; E37-D40 WeakPolarHBondContact O-CB 3.42Å; E37-D40 PolarHBondContact O-N 3.13Å
38	E	54.3	Low	55.5	Low	113 Å²	113	114.9 Å²	114.9	53%	0.528	57%	0.567	S	S	.	*	H	α-helix	trans	-54.1	-27.7	-169.1	-167.2	178	134	0	0	112.4	D40 L41 F42	E38-D40 PolarHBondContact O-N 3.05Å; E38-L41 WeakPolarHBondContact O-CB 3.25Å; E38-L41 PolarHBondContact O-N 3.44Å; E38-L41 VanDerWaalsContact O-N 3.16Å; E38-F42 HydrophobicContact CG-CD2 4.44Å; E38-F42 HydrophobicContact CG-CE2 3.9Å; E38-F42 WeakPolarHBondContact O-CD2 3.37Å
39	E	54.1	Low	57.1	Low	123 Å²	123	115.3 Å²	115.3	58%	0.575	56%	0.564	S	S	*	*	H	α-helix	trans	-54.5	-29.2	174	-65.3	83.4	173	0	0	113.6	E37 C43	E37-E39 VanDerWaalsContact C-OE2 3.26Å; E37-E39 VanDerWaalsContact CB-OE2 3.24Å; E37-E39 WeakPolarHBondContact CB-OE2 3.24Å; E37-E39 HydrophobicContact CG-CB 4.4Å; E37-E39 PolarHBondContact O-N 2.86Å; E39-C43 PolarHBondContact O-N 2.64Å; E39-C43 PolarHBondContact O-SG 3.29Å
40	D	56.8	Low	59	Low	21 Å²	21	113.9 Å²	113.9	11%	0.112	56%	0.558	C	S	.	*	H	α-helix	trans	-85	-23.1	-177.7	-148	36.6	0	0	0	113.6	M36 E37 E38 F42 R54	M36-D40 HydrophobicContact CE-CB 4.24Å; M36-D40 WeakPolarHBondContact CE-OD2 3.5Å; E37-D40 WeakPolarHBondContact O-CB 3.42Å; E37-D40 PolarHBondContact O-N 3.13Å; E38-D40 PolarHBondContact O-N 3.05Å; D40-F42 VanDerWaalsContact C-N 3.27Å; D40-R54 WeakPolarHBondContact OD1-CD 3.29Å; D40-R54 IonicContact OD1-CZ 2.72Å; D40-R54 IonicContact OD1-NE 2.91Å; D40-R54 PolarHBondContact OD1-NE 3Å; D40-R54 IonicContact OD1-NH1 2.83Å; D40-R54 PolarHBondContact OD1-NH1 3.4Å; D40-R54 IonicContact OD1-NH2 3.2Å; D40-R54 PolarHBondContact OD1-NH2 3.17Å; D40-R54 IonicContact OD2-CZ 2.87Å; D40-R54 IonicContact OD2-NE 3.83Å; D40-R54 IonicContact OD2-NH1 2.71Å; D40-R54 PolarHBondContact OD2-NH1 3.12Å; D40-R54 IonicContact OD2-NH2 2.66Å; D40-R54 PolarHBondContact OD2-NH2 2.93Å
41	L	56.1	Low	61	Low	130 Å²	130	111.2 Å²	111.2	68%	0.681	55%	0.546	S	S	*	.	H	α-helix	trans	-73.5	-25.2	173.2	-156.7	72.4	0	0	0	111.2	E38	E38-L41 WeakPolarHBondContact O-CB 3.25Å; E38-L41 PolarHBondContact O-N 3.44Å; E38-L41 VanDerWaalsContact O-N 3.16Å
42	F	55.4	Low	63	Low	103 Å²	103	107.5 Å²	107.5	45%	0.452	52%	0.524	S	S	.	.	H	α-helix	trans	-83.1	-24.5	175.5	-73.5	-71.7	0	0	0	113.7	E38 D40 L44 Q45	E38-F42 HydrophobicContact CG-CD2 4.44Å; E38-F42 HydrophobicContact CG-CE2 3.9Å; E38-F42 WeakPolarHBondContact O-CD2 3.37Å; D40-F42 VanDerWaalsContact C-N 3.27Å; F42-L44 PolarHBondContact O-N 3.47Å; F42-Q45 WeakPolarHBondContact O-CA 3.36Å; F42-Q45 WeakPolarHBondContact O-CB 3.3Å; F42-Q45 PolarHBondContact O-N 3.01Å
43	C	54.9	Low	65.1	Low	34 Å²	34	106.4 Å²	106.4	23%	0.23	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.2	174.7	-73.2	0	0	0	0	113.1	E39 Q45	E39-C43 PolarHBondContact O-N 2.64Å; E39-C43 PolarHBondContact O-SG 3.29Å; C43-Q45 VanDerWaalsContact C-N 3.35Å
44	L	54.6	Low	67.4	Low	134 Å²	134	103.4 Å²	103.4	70%	0.702	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-14.7	172.6	-165.7	61.8	0	0	0	112.4	F42 Y46	F42-L44 PolarHBondContact O-N 3.47Å; L44-Y46 VanDerWaalsContact C-N 3.28Å; L44-Y46 PolarHBondContact O-N 3.37Å
45	Q	58	Low	70.1	Confident	118 Å²	118	100.9 Å²	100.9	55%	0.551	48%	0.479	S	S	*	.	S	Bend	trans	-84.2	72.5	179.1	-138.5	-178.7	100.6	0	0	109.2	F42 C43	F42-Q45 WeakPolarHBondContact O-CA 3.36Å; F42-Q45 WeakPolarHBondContact O-CB 3.3Å; F42-Q45 PolarHBondContact O-N 3.01Å; C43-Q45 VanDerWaalsContact C-N 3.35Å
46	Y	59.7	Low	72.4	Confident	216 Å²	216	90.8 Å²	90.8	85%	0.847	44%	0.442	S	S	*	.	S	Bend	trans	101.5	-11.7	153.5	-64.1	-81.1	0	0	0	122.7	L44	L44-Y46 VanDerWaalsContact C-N 3.28Å; L44-Y46 PolarHBondContact O-N 3.37Å
47	D	84.2	Confident	74.9	Confident	65 Å²	65	93.4 Å²	93.4	35%	0.348	45%	0.446	S	S	.	.			trans	-118.9	113.4	171.3	-160.2	-13.6	0	0	0	113.6	N49 D50	D47-N49 PolarHBondContact O-N 3Å; D47-N49 VanDerWaalsContact OD1-CB 3.29Å; D47-N49 WeakPolarHBondContact OD1-CB 3.46Å; D47-N49 PolarHBondContact OD1-N 3.09Å; D47-N49 PolarHBondContact OD1-ND2 3Å; D47-D50 HydrophobicContact CB-CB 4.42Å; D47-D50 PolarHBondContact O-N 3.02Å
48	M	92.3	Very high	77.1	Confident	105 Å²	105	90.5 Å²	90.5	52%	0.517	44%	0.435	S	S	.	.	H	α-helix	trans	-60.4	-29.5	172.5	-67.6	-65.3	92.7	0	0	112.5	D50 C51 Y52	M48-D50 VanDerWaalsContact C-N 3.29Å; M48-D50 PolarHBondContact O-N 3.03Å; M48-C51 WeakPolarHBondContact O-CB 3.38Å; M48-C51 PolarHBondContact O-N 3.25Å; M48-Y52 HydrophobicContact CB-CE2 4.48Å; M48-Y52 WeakPolarHBondContact O-CD2 3.27Å; M48-Y52 PolarHBondContact O-N 3.33Å
49	N	91.8	Very high	79.2	Confident	77 Å²	77	85.4 Å²	85.4	41%	0.412	41%	0.411	S	S	.	.	H	α-helix	trans	-68.7	-28.6	178.9	-55.8	-55.5	0	0	0	112.3	D47 Y52 S53 K70	D47-N49 PolarHBondContact O-N 3Å; D47-N49 VanDerWaalsContact OD1-CB 3.29Å; D47-N49 WeakPolarHBondContact OD1-CB 3.46Å; D47-N49 PolarHBondContact OD1-N 3.09Å; D47-N49 PolarHBondContact OD1-ND2 3Å; N49-Y52 PolarHBondContact O-N 3.05Å; N49-S53 PolarHBondContact O-N 2.94Å; N49-S53 PolarHBondContact O-OG 3.43Å; N49-K70 WeakPolarHBondContact OD1-CE 3.27Å; N49-K70 PolarHBondContact OD1-NZ 3.27Å
50	D	91.6	Very high	81.2	Confident	83 Å²	83	84.3 Å²	84.3	44%	0.444	42%	0.415	S	S	.	.	H	α-helix	trans	-69.6	-37.6	174.4	-70.6	-20.7	0	0	0	111.2	D47 M48 Y52 S53 R54	D47-D50 HydrophobicContact CB-CB 4.42Å; D47-D50 PolarHBondContact O-N 3.02Å; M48-D50 VanDerWaalsContact C-N 3.29Å; M48-D50 PolarHBondContact O-N 3.03Å; D50-Y52 PolarHBondContact O-N 3.22Å; D50-S53 PolarHBondContact O-N 2.81Å; D50-R54 WeakPolarHBondContact O-CB 3.49Å; D50-R54 PolarHBondContact O-N 3.31Å
51	C	93	Very high	83.1	Confident	39 Å²	39	87 Å²	87	26%	0.264	43%	0.432	S	S	.	.	H	α-helix	trans	-58.4	-48.1	171.5	-67	0	0	0	0	110.8	M48 S53 R54 L55	M48-C51 WeakPolarHBondContact O-CB 3.38Å; M48-C51 PolarHBondContact O-N 3.25Å; C51-S53 VanDerWaalsContact C-N 3.33Å; C51-S53 PolarHBondContact O-N 2.67Å; C51-R54 PolarHBondContact O-N 2.83Å; C51-L55 VanDerWaalsContact O-CG 3.27Å; C51-L55 WeakPolarHBondContact O-CG 3.18Å; C51-L55 PolarHBondContact O-N 3.04Å
52	Y	94.1	Very high	85	Confident	51 Å²	51	81 Å²	81	20%	0.2	40%	0.4	C	S	.	.	H	α-helix	trans	-61.5	-40.1	176	-70.3	-72	0	0	0	112.6	M48 N49 D50 R54 L55 K56 K70 I73 L74	M48-Y52 HydrophobicContact CB-CE2 4.48Å; M48-Y52 WeakPolarHBondContact O-CD2 3.27Å; M48-Y52 PolarHBondContact O-N 3.33Å; N49-Y52 PolarHBondContact O-N 3.05Å; D50-Y52 PolarHBondContact O-N 3.22Å; Y52-R54 VanDerWaalsContact C-N 3.29Å; Y52-R54 PolarHBondContact O-N 3.22Å; Y52-L55 HydrophobicContact CD1-CD1 4.36Å; Y52-L55 PolarHBondContact O-N 3.03Å; Y52-K56 WeakPolarHBondContact O-CG 3.23Å; Y52-K56 PolarHBondContact O-N 3.34Å; Y52-K70 HydrophobicContact CD1-CB 4.33Å; Y52-K70 HydrophobicContact CD1-CG 4.15Å; Y52-K70 HydrophobicContact CD2-CD 4.06Å; Y52-K70 HydrophobicContact CD2-CG 4.04Å; Y52-K70 HydrophobicContact CE1-CB 3.7Å; Y52-K70 HydrophobicContact CE1-CD 4.42Å; Y52-K70 HydrophobicContact CE1-CG 3.85Å; Y52-K70 HydrophobicContact CE2-CB 4.37Å; Y52-K70 HydrophobicContact CE2-CD 3.53Å; Y52-K70 HydrophobicContact CE2-CG 3.79Å; Y52-K70 HydrophobicContact CG-CG 4.26Å; Y52-I73 HydrophobicContact CD1-CB 4.17Å; Y52-I73 HydrophobicContact CD1-CD1 4.05Å; Y52-I73 HydrophobicContact CD1-CG2 3.83Å; Y52-I73 HydrophobicContact CG-CD1 4.46Å; Y52-L74 HydrophobicContact CE1-CD2 4.25Å; Y52-L74 HydrophobicContact CE1-CG 4.2Å
53	S	92.9	Very high	86.9	Confident	62 Å²	62	78.2 Å²	78.2	43%	0.434	39%	0.393	S	S	.	.	H	α-helix	trans	-65.1	-34.7	177.1	-60.3	0	0	0	0	112.2	N49 D50 C51	N49-S53 PolarHBondContact O-N 2.94Å; N49-S53 PolarHBondContact O-OG 3.43Å; D50-S53 PolarHBondContact O-N 2.81Å; C51-S53 VanDerWaalsContact C-N 3.33Å; C51-S53 PolarHBondContact O-N 2.67Å
54	R	93.6	Very high	88.7	Confident	79 Å²	79	82.4 Å²	82.4	30%	0.298	41%	0.409	S	S	.	.	H	α-helix	trans	-70.6	-42.4	173.2	-177	157.7	-177.5	-111.2	4.1	112.3	D40 D50 C51 Y52 K56 R57 L58	D40-R54 WeakPolarHBondContact OD1-CD 3.29Å; D40-R54 IonicContact OD1-CZ 2.72Å; D40-R54 IonicContact OD1-NE 2.91Å; D40-R54 PolarHBondContact OD1-NE 3Å; D40-R54 IonicContact OD1-NH1 2.83Å; D40-R54 PolarHBondContact OD1-NH1 3.4Å; D40-R54 IonicContact OD1-NH2 3.2Å; D40-R54 PolarHBondContact OD1-NH2 3.17Å; D40-R54 IonicContact OD2-CZ 2.87Å; D40-R54 IonicContact OD2-NE 3.83Å; D40-R54 IonicContact OD2-NH1 2.71Å; D40-R54 PolarHBondContact OD2-NH1 3.12Å; D40-R54 IonicContact OD2-NH2 2.66Å; D40-R54 PolarHBondContact OD2-NH2 2.93Å; D50-R54 WeakPolarHBondContact O-CB 3.49Å; D50-R54 PolarHBondContact O-N 3.31Å; C51-R54 PolarHBondContact O-N 2.83Å; Y52-R54 VanDerWaalsContact C-N 3.29Å; Y52-R54 PolarHBondContact O-N 3.22Å; R54-K56 VanDerWaalsContact C-N 3.27Å; R54-K56 PolarHBondContact O-N 3.46Å; R54-R57 PolarHBondContact O-N 2.99Å; R54-L58 HydrophobicContact CG-CD1 3.94Å; R54-L58 HydrophobicContact CG-CG 4.36Å; R54-L58 PolarHBondContact O-N 3.4Å; R54-L58 VanDerWaalsContact O-N 3.12Å
55	L	95.7	Very high	90.5	Very high	46 Å²	46	84.2 Å²	84.2	24%	0.241	42%	0.419	C	S	.	.	H	α-helix	trans	-57.5	-41.2	174.8	-66.3	169	0	0	0	111.3	C51 Y52 R57 L58 V59 I73 V77	C51-L55 VanDerWaalsContact O-CG 3.27Å; C51-L55 WeakPolarHBondContact O-CG 3.18Å; C51-L55 PolarHBondContact O-N 3.04Å; Y52-L55 HydrophobicContact CD1-CD1 4.36Å; Y52-L55 PolarHBondContact O-N 3.03Å; L55-R57 PolarHBondContact O-N 3.48Å; L55-L58 PolarHBondContact O-N 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.27Å; L55-V59 PolarHBondContact O-N 3.3Å; L55-I73 HydrophobicContact CB-CG2 3.85Å; L55-I73 HydrophobicContact CD1-CG2 4Å; L55-V77 HydrophobicContact CB-CG2 4.01Å; L55-V77 HydrophobicContact CD1-CG2 4.13Å; L55-V77 HydrophobicContact CD2-CG1 4.28Å; L55-V77 HydrophobicContact CD2-CG2 3.76Å; L55-V77 HydrophobicContact CG-CG2 4.15Å
56	K	95.3	Very high	92	Very high	42 Å²	42	84.3 Å²	84.3	18%	0.183	42%	0.418	C	S	.	.	H	α-helix	trans	-58.5	-29.7	174.2	-71.8	-170.6	62.9	174.1	0	114.3	Y52 R54 I62 P63 Q64 K66 I73	Y52-K56 WeakPolarHBondContact O-CG 3.23Å; Y52-K56 PolarHBondContact O-N 3.34Å; R54-K56 VanDerWaalsContact C-N 3.27Å; R54-K56 PolarHBondContact O-N 3.46Å; K56-I62 HydrophobicContact CB-CG2 4.42Å; K56-I62 HydrophobicContact CG-CG2 3.84Å; K56-P63 WeakPolarHBondContact CE-O 3.48Å; K56-P63 PolarHBondContact NZ-O 3.05Å; K56-Q64 PolarHBondContact NZ-O 3.24Å; K56-K66 PolarHBondContact NZ-O 3.11Å; K56-I73 HydrophobicContact CD-CD1 4.31Å; K56-I73 HydrophobicContact CG-CD1 4.1Å; K56-I73 HydrophobicContact CG-CG1 4.47Å
57	R	95.3	Very high	93.7	Very high	173 Å²	173	83.8 Å²	83.8	65%	0.653	42%	0.42	S	S	*	.	H	α-helix	trans	-82.7	-32	178.1	-71.2	-173.2	-74.8	146.6	-6.4	112.5	R54 L55	R54-R57 PolarHBondContact O-N 2.99Å; L55-R57 PolarHBondContact O-N 3.48Å
58	L	96.6	Very high	94.2	Very high	87 Å²	87	81.9 Å²	81.9	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-85.3	-29.8	-175.5	-68.5	174.6	0	0	0	113.5	R54 L55 P60 Y80	R54-L58 HydrophobicContact CG-CD1 3.94Å; R54-L58 HydrophobicContact CG-CG 4.36Å; R54-L58 PolarHBondContact O-N 3.4Å; R54-L58 VanDerWaalsContact O-N 3.12Å; L55-L58 PolarHBondContact O-N 3.3Å; L58-P60 WeakPolarHBondContact O-CD 3.44Å; L58-Y80 WeakPolarHBondContact O-CE1 3.22Å
59	V	96.9	Very high	94.5	Very high	5 Å²	5	79.5 Å²	79.5	3%	0.03	40%	0.404	C	S	.	.			trans	-98.7	112.1	-175	-176.9	0	0	0	0	110.5	L55 T61 I62 H76 V77 Y80	L55-V59 WeakPolarHBondContact O-CG2 3.27Å; L55-V59 PolarHBondContact O-N 3.3Å; V59-T61 WeakPolarHBondContact CG1-OG1 3.01Å; V59-T61 PolarHBondContact O-N 3.1Å; V59-T61 VanDerWaalsContact O-N 3.16Å; V59-I62 HydrophobicContact CB-CD1 3.6Å; V59-I62 HydrophobicContact CB-CG1 3.8Å; V59-I62 HydrophobicContact CG1-CD1 3.9Å; V59-I62 HydrophobicContact CG1-CG1 3.71Å; V59-I62 HydrophobicContact CG2-CD1 4.02Å; V59-I62 PolarHBondContact O-N 3.45Å; V59-H76 HydrophobicContact CG1-CB 4.13Å; V59-V77 HydrophobicContact CG2-CB 4.44Å; V59-V77 HydrophobicContact CG2-CG2 3.67Å; V59-Y80 HydrophobicContact CB-CD1 4.4Å; V59-Y80 HydrophobicContact CG1-CD1 4.31Å; V59-Y80 HydrophobicContact CG1-CG 4.11Å; V59-Y80 HydrophobicContact CG2-CD1 3.95Å
60	P	96.3	Very high	94.7	Very high	101 Å²	101	80.5 Å²	80.5	66%	0.656	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.2	-174	-23.3	34	0	0	0	114.5	L58 I62 Y80	L58-P60 WeakPolarHBondContact O-CD 3.44Å; P60-I62 VanDerWaalsContact C-N 3.33Å; P60-Y80 HydrophobicContact CG-CE2 3.99Å
61	T	96.1	Very high	95.1	Very high	76 Å²	76	81 Å²	81	47%	0.466	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.4	-176.8	57	0	0	0	0	113.2	V59 P63 H76	V59-T61 WeakPolarHBondContact CG1-OG1 3.01Å; V59-T61 PolarHBondContact O-N 3.1Å; V59-T61 VanDerWaalsContact O-N 3.16Å; T61-P63 WeakPolarHBondContact O-CD 3.47Å; T61-H76 PolarHBondContact OG1-ND1 3.07Å
62	I	97.1	Very high	95.3	Very high	5 Å²	5	83.2 Å²	83.2	3%	0.026	42%	0.417	C	S	.	.	S	Bend	trans	-87.9	122.5	-178.7	-56.2	178	0	0	0	110.7	K56 V59 P60 Q64 V68 I73 H76 V77	K56-I62 HydrophobicContact CB-CG2 4.42Å; K56-I62 HydrophobicContact CG-CG2 3.84Å; V59-I62 HydrophobicContact CB-CD1 3.6Å; V59-I62 HydrophobicContact CB-CG1 3.8Å; V59-I62 HydrophobicContact CG1-CD1 3.9Å; V59-I62 HydrophobicContact CG1-CG1 3.71Å; V59-I62 HydrophobicContact CG2-CD1 4.02Å; V59-I62 PolarHBondContact O-N 3.45Å; P60-I62 VanDerWaalsContact C-N 3.33Å; I62-Q64 PolarHBondContact O-N 3.17Å; I62-V68 HydrophobicContact CG2-CG2 4.3Å; I62-I73 HydrophobicContact CD1-CB 4.36Å; I62-I73 HydrophobicContact CD1-CG1 4.45Å; I62-I73 HydrophobicContact CD1-CG2 3.93Å; I62-I73 HydrophobicContact CG2-CG1 4.39Å; I62-H76 HydrophobicContact CD1-CB 3.73Å; I62-H76 HydrophobicContact CG1-CB 3.35Å; I62-V77 HydrophobicContact CD1-CG2 4.4Å
63	P	95.4	Very high	95.5	Very high	45 Å²	45	81.1 Å²	81.1	29%	0.292	41%	0.41	S	S	.	.			trans	-69.3	129.8	179.3	-29.4	44	0	0	0	113	K56 T61 K66	K56-P63 WeakPolarHBondContact CE-O 3.48Å; K56-P63 PolarHBondContact NZ-O 3.05Å; T61-P63 WeakPolarHBondContact O-CD 3.47Å; P63-K66 HydrophobicContact CB-CD 4Å; P63-K66 HydrophobicContact CB-CG 3.59Å; P63-K66 HydrophobicContact CG-CD 4.45Å
64	Q	93	Very high	95.7	Very high	121 Å²	121	81.9 Å²	81.9	57%	0.565	41%	0.408	S	S	*	.	S	Bend	trans	-82.4	-39.6	-174.5	-62.4	-172.6	11.1	0	0	112.6	K56 I62 K66	K56-Q64 PolarHBondContact NZ-O 3.24Å; I62-Q64 PolarHBondContact O-N 3.17Å; Q64-K66 VanDerWaalsContact C-N 3.33Å; Q64-K66 PolarHBondContact O-N 2.91Å
65	D	90.9	Very high	96	Very high	173 Å²	173	83.2 Å²	83.2	93%	0.925	42%	0.418	S	S	*	.	S	Bend	trans	-82.5	-4.8	-172.3	-53.4	-60.1	0	0	0	115
66	K	91.2	Very high	96.1	Very high	120 Å²	120	83.7 Å²	83.7	52%	0.522	42%	0.419	S	S	.	.	S	Bend	trans	-116.1	159.5	176.6	61.6	166.5	177.4	172.2	0	113.1	K56 P63 Q64 V68	K56-K66 PolarHBondContact NZ-O 3.11Å; P63-K66 HydrophobicContact CB-CD 4Å; P63-K66 HydrophobicContact CB-CG 3.59Å; P63-K66 HydrophobicContact CG-CD 4.45Å; Q64-K66 VanDerWaalsContact C-N 3.33Å; Q64-K66 PolarHBondContact O-N 2.91Å; K66-V68 HydrophobicContact CG-CG2 4.11Å
67	K	94.2	Very high	96.2	Very high	205 Å²	205	82.8 Å²	82.8	89%	0.891	42%	0.416	S	S	*	.			trans	-71.9	126.1	166.8	-59.3	-60.8	179.7	-178.7	0	108
68	V	95.6	Very high	96.4	Very high	25 Å²	25	79.2 Å²	79.2	15%	0.152	41%	0.41	C	S	.	.			trans	-123.6	136.6	176.3	-176.1	0	0	0	0	105.6	I62 K66 E72 I73	I62-V68 HydrophobicContact CG2-CG2 4.3Å; K66-V68 HydrophobicContact CG-CG2 4.11Å; V68-E72 HydrophobicContact CG1-CB 3.47Å; V68-E72 VanDerWaalsContact CG1-CB 3.47Å; V68-E72 HydrophobicContact CG1-CG 4.47Å; V68-I73 HydrophobicContact CB-CG1 4.16Å; V68-I73 HydrophobicContact CG1-CG1 3.88Å
69	S	97.6	Very high	96.5	Very high	54 Å²	54	79.1 Å²	79.1	38%	0.378	41%	0.409	S	S	.	.			trans	-67.6	158.6	-179.6	70.4	0	0	0	0	111.2	V71 E72 I73	S69-V71 PolarHBondContact O-N 2.92Å; S69-E72 WeakPolarHBondContact CB-OE2 3.47Å; S69-E72 PolarHBondContact N-OE2 3.45Å; S69-E72 PolarHBondContact O-N 3.26Å; S69-E72 WeakPolarHBondContact OG-CB 3.33Å; S69-E72 VanDerWaalsContact OG-CG 3.25Å; S69-E72 WeakPolarHBondContact OG-CG 3.24Å; S69-E72 PolarHBondContact OG-N 3.43Å; S69-E72 VanDerWaalsContact OG-N 3.17Å; S69-E72 PolarHBondContact OG-OE2 3.36Å; S69-I73 WeakPolarHBondContact O-CG1 2.82Å; S69-I73 PolarHBondContact O-N 3.39Å
70	K	97	Very high	96.5	Very high	99 Å²	99	82.2 Å²	82.2	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-57.6	-38	176	-69.9	-178.4	173.9	-176.8	0	111.5	N49 Y52 I73 L74	N49-K70 WeakPolarHBondContact OD1-CE 3.27Å; N49-K70 PolarHBondContact OD1-NZ 3.27Å; Y52-K70 HydrophobicContact CD1-CB 4.33Å; Y52-K70 HydrophobicContact CD1-CG 4.15Å; Y52-K70 HydrophobicContact CD2-CD 4.06Å; Y52-K70 HydrophobicContact CD2-CG 4.04Å; Y52-K70 HydrophobicContact CE1-CB 3.7Å; Y52-K70 HydrophobicContact CE1-CD 4.42Å; Y52-K70 HydrophobicContact CE1-CG 3.85Å; Y52-K70 HydrophobicContact CE2-CB 4.37Å; Y52-K70 HydrophobicContact CE2-CD 3.53Å; Y52-K70 HydrophobicContact CE2-CG 3.79Å; Y52-K70 HydrophobicContact CG-CG 4.26Å; K70-I73 PolarHBondContact O-N 3.29Å; K70-L74 VanDerWaalsContact O-CG 3.27Å; K70-L74 WeakPolarHBondContact O-CG 3.3Å; K70-L74 PolarHBondContact O-N 3.25Å; K70-L74 VanDerWaalsContact O-N 3.07Å
71	V	98.3	Very high	96.6	Very high	94 Å²	94	81.2 Å²	81.2	57%	0.57	41%	0.409	S	S	*	.	H	α-helix	trans	-68.5	-46.3	179.2	176.9	0	0	0	0	111.4	S69 I73 L74 Q75	S69-V71 PolarHBondContact O-N 2.92Å; V71-I73 VanDerWaalsContact C-N 3.3Å; V71-I73 PolarHBondContact O-N 3.31Å; V71-L74 PolarHBondContact O-N 3.32Å; V71-L74 VanDerWaalsContact O-N 3.1Å; V71-Q75 WeakPolarHBondContact O-CG 3.42Å; V71-Q75 PolarHBondContact O-N 3.2Å
72	E	98	Very high	96.7	Very high	85 Å²	85	82 Å²	82	40%	0.397	41%	0.41	S	S	.	.	H	α-helix	trans	-60.7	-40.2	176.2	-73.9	165.5	117.3	0	0	111.4	V68 S69 L74 Q75 H76	V68-E72 HydrophobicContact CG1-CB 3.47Å; V68-E72 VanDerWaalsContact CG1-CB 3.47Å; V68-E72 HydrophobicContact CG1-CG 4.47Å; S69-E72 WeakPolarHBondContact CB-OE2 3.47Å; S69-E72 PolarHBondContact N-OE2 3.45Å; S69-E72 PolarHBondContact O-N 3.26Å; S69-E72 WeakPolarHBondContact OG-CB 3.33Å; S69-E72 VanDerWaalsContact OG-CG 3.25Å; S69-E72 WeakPolarHBondContact OG-CG 3.24Å; S69-E72 PolarHBondContact OG-N 3.43Å; S69-E72 VanDerWaalsContact OG-N 3.17Å; S69-E72 PolarHBondContact OG-OE2 3.36Å; E72-L74 VanDerWaalsContact C-N 3.33Å; E72-L74 PolarHBondContact O-N 2.84Å; E72-Q75 PolarHBondContact O-N 3.49Å; E72-H76 PolarHBondContact O-CD2 2.66Å; E72-H76 PolarHBondContact O-N 2.91Å
73	I	97.8	Very high	96.6	Very high	7 Å²	7	86.7 Å²	86.7	4%	0.036	44%	0.435	C	S	.	.	H	α-helix	trans	-58.3	-46.7	173.4	-69.2	168.7	0	0	0	110.6	Y52 L55 K56 I62 V68 S69 K70 V71 Q75 H76 V77	Y52-I73 HydrophobicContact CD1-CB 4.17Å; Y52-I73 HydrophobicContact CD1-CD1 4.05Å; Y52-I73 HydrophobicContact CD1-CG2 3.83Å; Y52-I73 HydrophobicContact CG-CD1 4.46Å; L55-I73 HydrophobicContact CB-CG2 3.85Å; L55-I73 HydrophobicContact CD1-CG2 4Å; K56-I73 HydrophobicContact CD-CD1 4.31Å; K56-I73 HydrophobicContact CG-CD1 4.1Å; K56-I73 HydrophobicContact CG-CG1 4.47Å; I62-I73 HydrophobicContact CD1-CB 4.36Å; I62-I73 HydrophobicContact CD1-CG1 4.45Å; I62-I73 HydrophobicContact CD1-CG2 3.93Å; I62-I73 HydrophobicContact CG2-CG1 4.39Å; V68-I73 HydrophobicContact CB-CG1 4.16Å; V68-I73 HydrophobicContact CG1-CG1 3.88Å; S69-I73 WeakPolarHBondContact O-CG1 2.82Å; S69-I73 PolarHBondContact O-N 3.39Å; K70-I73 PolarHBondContact O-N 3.29Å; V71-I73 VanDerWaalsContact C-N 3.3Å; V71-I73 PolarHBondContact O-N 3.31Å; I73-Q75 VanDerWaalsContact C-N 3.33Å; I73-Q75 PolarHBondContact O-N 3.36Å; I73-H76 PolarHBondContact O-N 3.2Å; I73-V77 HydrophobicContact CG2-CG2 4.35Å; I73-V77 WeakPolarHBondContact O-CG2 3.29Å; I73-V77 PolarHBondContact O-N 2.95Å
74	L	98.3	Very high	96.7	Very high	77 Å²	77	88 Å²	88	40%	0.403	44%	0.439	S	S	.	.	H	α-helix	trans	-63.8	-37.9	179.7	-67.9	173	0	0	0	112.4	Y52 K70 V71 E72 V77 I78	Y52-L74 HydrophobicContact CE1-CD2 4.25Å; Y52-L74 HydrophobicContact CE1-CG 4.2Å; K70-L74 VanDerWaalsContact O-CG 3.27Å; K70-L74 WeakPolarHBondContact O-CG 3.3Å; K70-L74 PolarHBondContact O-N 3.25Å; K70-L74 VanDerWaalsContact O-N 3.07Å; V71-L74 PolarHBondContact O-N 3.32Å; V71-L74 VanDerWaalsContact O-N 3.1Å; E72-L74 VanDerWaalsContact C-N 3.33Å; E72-L74 PolarHBondContact O-N 2.84Å; L74-V77 PolarHBondContact O-N 3.28Å; L74-I78 VanDerWaalsContact O-CG1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.39Å; L74-I78 PolarHBondContact O-N 3.2Å
75	Q	98.6	Very high	96.7	Very high	108 Å²	108	87.2 Å²	87.2	51%	0.505	44%	0.436	S	S	.	.	H	α-helix	trans	-61.7	-50.9	175.7	-71.8	171.5	-30.3	0	0	111.3	V71 E72 I73 V77 I78 D79	V71-Q75 WeakPolarHBondContact O-CG 3.42Å; V71-Q75 PolarHBondContact O-N 3.2Å; E72-Q75 PolarHBondContact O-N 3.49Å; I73-Q75 VanDerWaalsContact C-N 3.33Å; I73-Q75 PolarHBondContact O-N 3.36Å; Q75-V77 PolarHBondContact O-N 2.91Å; Q75-I78 WeakPolarHBondContact O-CB 3.21Å; Q75-I78 PolarHBondContact O-N 2.85Å; Q75-I78 VanDerWaalsContact O-N 3.09Å; Q75-D79 PolarHBondContact O-N 3.41Å
76	H	98.4	Very high	96.9	Very high	56 Å²	56	83.9 Å²	83.9	26%	0.259	42%	0.418	S	S	.	.	H	α-helix	trans	-59.2	-34.7	176.6	-77.2	-67.8	0	0	0	113.2	V59 T61 I62 E72 I73 Y80	V59-H76 HydrophobicContact CG1-CB 4.13Å; T61-H76 PolarHBondContact OG1-ND1 3.07Å; I62-H76 HydrophobicContact CD1-CB 3.73Å; I62-H76 HydrophobicContact CG1-CB 3.35Å; E72-H76 PolarHBondContact O-CD2 2.66Å; E72-H76 PolarHBondContact O-N 2.91Å; I73-H76 PolarHBondContact O-N 3.2Å; H76-Y80 VanDerWaalsContact O-CB 3.31Å; H76-Y80 WeakPolarHBondContact O-CB 3.12Å; H76-Y80 PolarHBondContact O-N 3.23Å
77	V	98.3	Very high	97	Very high	22 Å²	22	80.5 Å²	80.5	13%	0.133	41%	0.412	C	S	.	.	H	α-helix	trans	-67.6	-42.1	175.8	171.4	0	0	0	0	111.4	L55 V59 I62 I73 L74 Q75 Y80 I81	L55-V77 HydrophobicContact CB-CG2 4.01Å; L55-V77 HydrophobicContact CD1-CG2 4.13Å; L55-V77 HydrophobicContact CD2-CG1 4.28Å; L55-V77 HydrophobicContact CD2-CG2 3.76Å; L55-V77 HydrophobicContact CG-CG2 4.15Å; V59-V77 HydrophobicContact CG2-CB 4.44Å; V59-V77 HydrophobicContact CG2-CG2 3.67Å; I62-V77 HydrophobicContact CD1-CG2 4.4Å; I73-V77 HydrophobicContact CG2-CG2 4.35Å; I73-V77 WeakPolarHBondContact O-CG2 3.29Å; I73-V77 PolarHBondContact O-N 2.95Å; L74-V77 PolarHBondContact O-N 3.28Å; Q75-V77 PolarHBondContact O-N 2.91Å; V77-Y80 PolarHBondContact O-N 3.34Å; V77-I81 HydrophobicContact CG1-CD1 3.83Å; V77-I81 VanDerWaalsContact O-CG1 3.28Å; V77-I81 WeakPolarHBondContact O-CG1 3.27Å; V77-I81 PolarHBondContact O-N 3.43Å
78	I	98.4	Very high	96.9	Very high	99 Å²	99	75 Å²	75	51%	0.508	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-50.9	176.5	-69.3	162.2	0	0	0	109.5	L74 Q75 Y80 I81 L82	L74-I78 VanDerWaalsContact O-CG1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.39Å; L74-I78 PolarHBondContact O-N 3.2Å; Q75-I78 WeakPolarHBondContact O-CB 3.21Å; Q75-I78 PolarHBondContact O-N 2.85Å; Q75-I78 VanDerWaalsContact O-N 3.09Å; I78-Y80 VanDerWaalsContact C-N 3.32Å; I78-Y80 PolarHBondContact O-N 2.71Å; I78-I81 PolarHBondContact O-N 2.94Å; I78-L82 HydrophobicContact CG2-CD1 3.92Å; I78-L82 HydrophobicContact CG2-CG 4.46Å; I78-L82 VanDerWaalsContact O-CG 3.32Å; I78-L82 WeakPolarHBondContact O-CG 3.23Å; I78-L82 PolarHBondContact O-N 2.92Å
79	D	98.2	Very high	96.6	Very high	85 Å²	85	80.9 Å²	80.9	46%	0.455	42%	0.418	S	S	.	.	H	α-helix	trans	-58.7	-44.9	-179.8	-64.7	-24.5	0	0	0	111.3	Q75 I81 L82 D83	Q75-D79 PolarHBondContact O-N 3.41Å; D79-I81 PolarHBondContact O-N 3.22Å; D79-L82 PolarHBondContact O-N 2.94Å; D79-D83 PolarHBondContact O-N 3.47Å
80	Y	98.4	Very high	96	Very high	69 Å²	69	82.2 Å²	82.2	27%	0.271	42%	0.424	S	S	.	.	H	α-helix	trans	-64.7	-38.2	179.5	-176	-126	0	0	0	113.3	L58 V59 P60 H76 V77 I78 L84	L58-Y80 WeakPolarHBondContact O-CE1 3.22Å; V59-Y80 HydrophobicContact CB-CD1 4.4Å; V59-Y80 HydrophobicContact CG1-CD1 4.31Å; V59-Y80 HydrophobicContact CG1-CG 4.11Å; V59-Y80 HydrophobicContact CG2-CD1 3.95Å; P60-Y80 HydrophobicContact CG-CE2 3.99Å; H76-Y80 VanDerWaalsContact O-CB 3.31Å; H76-Y80 WeakPolarHBondContact O-CB 3.12Å; H76-Y80 PolarHBondContact O-N 3.23Å; V77-Y80 PolarHBondContact O-N 3.34Å; I78-Y80 VanDerWaalsContact C-N 3.32Å; I78-Y80 PolarHBondContact O-N 2.71Å; Y80-L84 HydrophobicContact CD1-CD1 3.92Å; Y80-L84 HydrophobicContact CD2-CD1 4.31Å; Y80-L84 HydrophobicContact CD2-CG 4.19Å; Y80-L84 HydrophobicContact CE1-CD1 3.54Å; Y80-L84 HydrophobicContact CE1-CG 4.38Å; Y80-L84 HydrophobicContact CE2-CD1 3.95Å; Y80-L84 HydrophobicContact CE2-CD2 4.05Å; Y80-L84 HydrophobicContact CE2-CG 3.88Å; Y80-L84 HydrophobicContact CG-CD1 4.3Å; Y80-L84 WeakPolarHBondContact O-CB 3.35Å; Y80-L84 WeakPolarHBondContact O-CG 3.26Å; Y80-L84 PolarHBondContact O-N 3.2Å
81	I	97.9	Very high	95.1	Very high	80 Å²	80	82.5 Å²	82.5	41%	0.41	43%	0.426	S	S	.	.	H	α-helix	trans	-64.6	-43.2	175.3	-70.5	167.1	0	0	0	110.4	V77 I78 D79 L84 Q85	V77-I81 HydrophobicContact CG1-CD1 3.83Å; V77-I81 VanDerWaalsContact O-CG1 3.28Å; V77-I81 WeakPolarHBondContact O-CG1 3.27Å; V77-I81 PolarHBondContact O-N 3.43Å; I78-I81 PolarHBondContact O-N 2.94Å; D79-I81 PolarHBondContact O-N 3.22Å; I81-L84 PolarHBondContact O-N 3Å; I81-Q85 HydrophobicContact CG2-CG 4.37Å; I81-Q85 WeakPolarHBondContact O-CB 3.29Å; I81-Q85 VanDerWaalsContact O-CG 3.24Å; I81-Q85 WeakPolarHBondContact O-CG 3.4Å; I81-Q85 PolarHBondContact O-N 3.3Å
82	L	97.4	Very high	93.5	Very high	93 Å²	93	82.2 Å²	82.2	49%	0.487	43%	0.426	S	S	.	.	H	α-helix	trans	-63.9	-43.5	179.3	-66.1	172.2	0	0	0	111.4	I78 D79 Q85 L86	I78-L82 HydrophobicContact CG2-CD1 3.92Å; I78-L82 HydrophobicContact CG2-CG 4.46Å; I78-L82 VanDerWaalsContact O-CG 3.32Å; I78-L82 WeakPolarHBondContact O-CG 3.23Å; I78-L82 PolarHBondContact O-N 2.92Å; D79-L82 PolarHBondContact O-N 2.94Å; L82-Q85 PolarHBondContact O-N 2.71Å; L82-L86 PolarHBondContact O-N 3.48Å
83	D	96.3	Very high	92	Very high	103 Å²	103	82 Å²	82	55%	0.551	43%	0.434	S	S	*	.	H	α-helix	trans	-62.9	-43.3	176.9	-72.9	-17.7	0	0	0	111.9	D79 L86 A87	D79-D83 PolarHBondContact O-N 3.47Å; D83-L86 PolarHBondContact O-N 2.83Å; D83-A87 WeakPolarHBondContact O-CB 3.27Å; D83-A87 PolarHBondContact O-N 2.92Å
84	L	95.9	Very high	90.2	Very high	73 Å²	73	87.6 Å²	87.6	38%	0.382	46%	0.463	S	S	.	.	H	α-helix	trans	-65.2	-39.7	176.8	-74	176.9	0	0	0	112.1	Y80 I81 A87 L88	Y80-L84 HydrophobicContact CD1-CD1 3.92Å; Y80-L84 HydrophobicContact CD2-CD1 4.31Å; Y80-L84 HydrophobicContact CD2-CG 4.19Å; Y80-L84 HydrophobicContact CE1-CD1 3.54Å; Y80-L84 HydrophobicContact CE1-CG 4.38Å; Y80-L84 HydrophobicContact CE2-CD1 3.95Å; Y80-L84 HydrophobicContact CE2-CD2 4.05Å; Y80-L84 HydrophobicContact CE2-CG 3.88Å; Y80-L84 HydrophobicContact CG-CD1 4.3Å; Y80-L84 WeakPolarHBondContact O-CB 3.35Å; Y80-L84 WeakPolarHBondContact O-CG 3.26Å; Y80-L84 PolarHBondContact O-N 3.2Å; I81-L84 PolarHBondContact O-N 3Å; L84-A87 PolarHBondContact O-N 2.73Å; L84-L88 WeakPolarHBondContact O-CB 3.38Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.21Å; L84-L88 PolarHBondContact O-N 3.46Å
85	Q	94.8	Very high	88.4	Confident	104 Å²	104	90.7 Å²	90.7	49%	0.486	48%	0.476	S	S	.	.	H	α-helix	trans	-60.1	-49.5	175.1	-77	173.6	-17.4	0	0	110.5	I81 L82 A87 L88 E89	I81-Q85 HydrophobicContact CG2-CG 4.37Å; I81-Q85 WeakPolarHBondContact O-CB 3.29Å; I81-Q85 VanDerWaalsContact O-CG 3.24Å; I81-Q85 WeakPolarHBondContact O-CG 3.4Å; I81-Q85 PolarHBondContact O-N 3.3Å; L82-Q85 PolarHBondContact O-N 2.71Å; Q85-A87 PolarHBondContact O-N 3.3Å; Q85-L88 PolarHBondContact O-N 3.17Å; Q85-E89 WeakPolarHBondContact O-CG 3.4Å; Q85-E89 PolarHBondContact O-N 3.01Å
86	L	94.5	Very high	86.4	Confident	104 Å²	104	94.4 Å²	94.4	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-58.4	-46.1	177.9	179.6	63	0	0	0	112	L82 D83 L88 E89 T90	L82-L86 PolarHBondContact O-N 3.48Å; D83-L86 PolarHBondContact O-N 2.83Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.02Å; L86-E89 PolarHBondContact O-N 3.12Å; L86-T90 HydrophobicContact CD1-CG2 4.36Å; L86-T90 WeakPolarHBondContact O-CG2 3.31Å; L86-T90 PolarHBondContact O-N 3.48Å; L86-T90 VanDerWaalsContact O-N 3.14Å; L86-T90 PolarHBondContact O-OG1 3.27Å
87	A	93.3	Very high	84.1	Confident	48 Å²	48	99.1 Å²	99.1	40%	0.397	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-34.4	-179.9	0	0	0	0	0	113.2	D83 L84 Q85 T90 H91	D83-A87 WeakPolarHBondContact O-CB 3.27Å; D83-A87 PolarHBondContact O-N 2.92Å; L84-A87 PolarHBondContact O-N 2.73Å; Q85-A87 PolarHBondContact O-N 3.3Å; A87-T90 PolarHBondContact O-OG1 2.78Å; A87-H91 PolarHBondContact O-CD2 3.22Å
88	L	91.5	Very high	81.5	Confident	89 Å²	89	103.2 Å²	103.2	47%	0.466	54%	0.539	S	S	.	.	H	α-helix	trans	-75.1	-37.6	176.8	-70.8	172.2	0	0	0	112	L84 Q85 L86 T90 H91 L94	L84-L88 WeakPolarHBondContact O-CB 3.38Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.21Å; L84-L88 PolarHBondContact O-N 3.46Å; Q85-L88 PolarHBondContact O-N 3.17Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.02Å; L88-T90 VanDerWaalsContact C-N 3.33Å; L88-T90 PolarHBondContact O-N 2.87Å; L88-H91 CarbonylContact O-C 3.55Å; L88-H91 PolarHBondContact O-N 3.45Å; L88-L94 HydrophobicContact CD2-CB 4.27Å
89	E	89.2	Confident	78.9	Confident	150 Å²	150	104.8 Å²	104.8	70%	0.701	56%	0.556	S	S	*	*	H	α-helix	trans	-64.2	-36.4	176.9	-73.6	178.1	125.2	0	0	112.2	Q85 L86 H91	Q85-E89 WeakPolarHBondContact O-CG 3.4Å; Q85-E89 PolarHBondContact O-N 3.01Å; L86-E89 PolarHBondContact O-N 3.12Å; E89-H91 VanDerWaalsContact C-N 3.34Å
90	T	84.8	Confident	76.3	Confident	82 Å²	82	109.2 Å²	109.2	50%	0.503	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-14.2	-179.9	58.7	0	0	0	0	114	L86 A87 L88	L86-T90 HydrophobicContact CD1-CG2 4.36Å; L86-T90 WeakPolarHBondContact O-CG2 3.31Å; L86-T90 PolarHBondContact O-N 3.48Å; L86-T90 VanDerWaalsContact O-N 3.14Å; L86-T90 PolarHBondContact O-OG1 3.27Å; A87-T90 PolarHBondContact O-OG1 2.78Å; L88-T90 VanDerWaalsContact C-N 3.33Å; L88-T90 PolarHBondContact O-N 2.87Å
91	H	79.1	Confident	73.5	Confident	105 Å²	105	116.1 Å²	116.1	49%	0.486	60%	0.6	S	S	.	*			trans	-131.3	73.5	-176.7	-62.9	-57.8	0	0	0	112.4	A87 L88 E89 S93 L94	A87-H91 PolarHBondContact O-CD2 3.22Å; L88-H91 CarbonylContact O-C 3.55Å; L88-H91 PolarHBondContact O-N 3.45Å; E89-H91 VanDerWaalsContact C-N 3.34Å; H91-S93 PolarHBondContact O-N 3.16Å; H91-L94 HydrophobicContact CB-CD1 4.26Å; H91-L94 HydrophobicContact CB-CG 4.27Å; H91-L94 PolarHBondContact O-N 3.27Å
92	P	64.4	Low	70.8	Confident	87 Å²	87	119 Å²	119	57%	0.565	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-62.9	-12.4	-176.2	25.2	-35.1	0	0	0	114.2	L94 Q95	P92-L94 VanDerWaalsContact C-N 3.29Å; P92-L94 PolarHBondContact O-N 3.15Å; P92-Q95 WeakPolarHBondContact O-CB 3.43Å; P92-Q95 PolarHBondContact O-N 3.06Å
93	S	66.4	Low	68.1	Low	82 Å²	82	120.2 Å²	120.2	57%	0.573	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-66	-26.9	171.7	45.3	0	0	0	0	113.6	H91 Q95	H91-S93 PolarHBondContact O-N 3.16Å; S93-Q95 VanDerWaalsContact C-N 3.27Å
94	L	61.3	Low	65.9	Low	123 Å²	123	120.5 Å²	120.5	64%	0.644	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-75.9	-17.4	175.3	-60.8	-175.3	0	0	0	112.8	L88 H91 P92 K96	L88-L94 HydrophobicContact CD2-CB 4.27Å; H91-L94 HydrophobicContact CB-CD1 4.26Å; H91-L94 HydrophobicContact CB-CG 4.27Å; H91-L94 PolarHBondContact O-N 3.27Å; P92-L94 VanDerWaalsContact C-N 3.29Å; P92-L94 PolarHBondContact O-N 3.15Å; L94-K96 VanDerWaalsContact C-N 3.32Å
95	Q	59.4	Low	63.8	Low	143 Å²	143	123 Å²	123	67%	0.668	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-85.8	-2.7	-178.8	-147.6	172.8	3	0	0	113.1	P92 S93 Q97	P92-Q95 WeakPolarHBondContact O-CB 3.43Å; P92-Q95 PolarHBondContact O-N 3.06Å; S93-Q95 VanDerWaalsContact C-N 3.27Å; Q95-Q97 PolarHBondContact O-N 3.44Å
96	K	55.9	Low	61.6	Low	185 Å²	185	122.9 Å²	122.9	80%	0.804	68%	0.681	S	S	*	*			trans	-76	60.7	178.1	-71.1	-176.5	178.6	179	0	112.3	L94	L94-K96 VanDerWaalsContact C-N 3.32Å
97	Q	51.7	Low	59.4	Low	155 Å²	155	122 Å²	122	72%	0.724	69%	0.689	S	S	*	*	S	Bend	trans	-78.3	141.9	150.1	-165.3	172.9	17.4	0	0	107.2	Q95	Q95-Q97 PolarHBondContact O-N 3.44Å
98	P	42.5	Very low	57.6	Low	108 Å²	108	125 Å²	125	70%	0.701	71%	0.707	S	S	*	*			trans	-53.9	141.3	-174.4	18.5	-31.7	0	0	0	112	Q100	P98-Q100 PolarHBondContact O-N 2.87Å
99	P	44.3	Very low	55.9	Low	132 Å²	132	126.9 Å²	126.9	86%	0.857	72%	0.717	S	S	*	*			trans	-70.3	99.4	-167.4	28.8	-34	0	0	0	110.5	R101	P99-R101 PolarHBondContact O-N 3.2Å
100	Q	42.5	Very low	54.4	Low	178 Å²	178	126.3 Å²	126.3	83%	0.832	73%	0.726	S	S	*	*			trans	-90.9	95.6	159	-71.3	-126.9	-25.6	0	0	108.7	P98	P98-Q100 PolarHBondContact O-N 2.87Å
101	R	41.2	Very low	53	Low	215 Å²	215	129.4 Å²	129.4	81%	0.811	74%	0.74	S	S	*	*			trans	55.4	111.2	156.6	-53.7	-162.3	-168.9	170.3	5.2	116.9	P99 C103	P99-R101 PolarHBondContact O-N 3.2Å; R101-C103 PolarHBondContact O-N 3.26Å
102	T	41	Very low	52.2	Low	140 Å²	140	134.8 Å²	134.8	86%	0.859	76%	0.756	S	S	*	*			trans	-21.2	106.2	145.9	46.9	0	0	0	0	113	P104	T102-P104 WeakPolarHBondContact O-CD 3.46Å
103	C	40.3	Very low	52.1	Low	119 Å²	119	135.8 Å²	135.8	80%	0.804	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-68.4	123.7	159.4	-60	0	0	0	0	107.4	R101	R101-C103 PolarHBondContact O-N 3.26Å
104	P	49.8	Very low	52	Low	109 Å²	109	135.7 Å²	135.7	71%	0.708	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-62.2	152.4	165	25.9	-30.4	0	0	0	109.4	T102 A106	T102-P104 WeakPolarHBondContact O-CD 3.46Å; P104-A106 PolarHBondContact O-N 2.57Å
105	P	51.7	Low	51.6	Low	125 Å²	125	137 Å²	137	81%	0.812	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-53.3	129.7	176	22.7	-32.4	0	0	0	109.1	A107	P105-A107 PolarHBondContact O-N 3.03Å
106	A	49.3	Very low	51.7	Low	101 Å²	101	134.7 Å²	134.7	84%	0.835	76%	0.76	S	S	*	*			trans	-53.4	107.7	178.8	0	0	0	0	0	109.3	P104 S108	P104-A106 PolarHBondContact O-N 2.57Å; A106-S108 PolarHBondContact O-N 3.28Å; A106-S108 VanDerWaalsContact O-N 3.11Å
107	A	48.9	Very low	51.8	Low	86 Å²	86	129.2 Å²	129.2	71%	0.711	74%	0.743	S	S	*	*			trans	-54.2	119.4	159.5	0	0	0	0	0	106.6	P105 N109	P105-A107 PolarHBondContact O-N 3.03Å; A107-N109 PolarHBondContact O-N 2.8Å
108	S	54.1	Low	52.2	Low	111 Å²	111	127.9 Å²	127.9	78%	0.776	74%	0.74	S	S	*	*			trans	-49.5	104.8	173.2	50.6	0	0	0	0	109.5	A106 P110	A106-S108 PolarHBondContact O-N 3.28Å; A106-S108 VanDerWaalsContact O-N 3.11Å; S108-P110 VanDerWaalsContact O-CD 3.3Å; S108-P110 WeakPolarHBondContact O-CD 3.49Å
109	N	56.1	Low	52.9	Low	128 Å²	128	128.5 Å²	128.5	68%	0.684	74%	0.737	S	S	*	*			trans	-66	118.2	165.5	-80.3	-45.6	0	0	0	107.3	A107 N111	A107-N109 PolarHBondContact O-N 2.8Å; N109-N111 PolarHBondContact O-N 2.98Å
110	P	57.6	Low	53.6	Low	138 Å²	138	126 Å²	126	90%	0.896	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	8.9	-179.3	29.6	-35.1	0	0	0	113.5	S108	S108-P110 VanDerWaalsContact O-CD 3.3Å; S108-P110 WeakPolarHBondContact O-CD 3.49Å
111	N	55.2	Low	54	Low	147 Å²	147	121.8 Å²	121.8	79%	0.786	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	12.8	-170.8	-145.1	-4	0	0	0	113.8	N109	N109-N111 PolarHBondContact O-N 2.98Å
112	R	63	Low	54.7	Low	219 Å²	219	118.9 Å²	118.9	83%	0.826	69%	0.694	S	S	*	*			trans	-111.2	95.3	166	-69.6	-158.5	178.2	-159	1.1	108.8	P114	R112-P114 VanDerWaalsContact O-CD 3.29Å; R112-P114 WeakPolarHBondContact O-CD 3.08Å
113	T	62.3	Low	55.2	Low	108 Å²	108	117.5 Å²	117.5	66%	0.663	68%	0.678	S	S	*	*			trans	-61.5	115.8	168	-20.1	0	0	0	0	107.5	V117	T113-V117 HydrophobicContact CG2-CB 3.78Å; T113-V117 HydrophobicContact CG2-CG1 3.79Å; T113-V117 HydrophobicContact CG2-CG2 3.95Å
114	P	63.3	Low	55.6	Low	79 Å²	79	117.2 Å²	117.2	51%	0.513	67%	0.665	S	S	.	*			trans	-64	144.7	178.1	23	-27.6	0	0	0	109.1	R112 T116 V117	R112-P114 VanDerWaalsContact O-CD 3.29Å; R112-P114 WeakPolarHBondContact O-CD 3.08Å; P114-T116 PolarHBondContact O-N 2.82Å; P114-V117 HydrophobicContact CG-CG2 3.99Å; P114-V117 WeakPolarHBondContact O-CB 3.33Å; P114-V117 PolarHBondContact O-N 3.26Å
115	L	53.5	Low	55.5	Low	152 Å²	152	121.8 Å²	121.8	80%	0.796	67%	0.668	S	S	*	*	H	α-helix	trans	-51.3	-25.7	-179.4	-72.7	167	0	0	0	112.9	V117 L118 N119	L115-V117 PolarHBondContact O-N 3.2Å; L115-L118 PolarHBondContact O-N 2.98Å; L115-N119 PolarHBondContact O-N 3.29Å
116	T	60.4	Low	55.4	Low	93 Å²	93	121.7 Å²	121.7	57%	0.571	67%	0.665	S	S	*	*	H	α-helix	trans	-54.1	-35	172	-40.2	0	0	0	0	113.5	P114 N119 I120	P114-T116 PolarHBondContact O-N 2.82Å; T116-N119 PolarHBondContact O-N 2.88Å; T116-I120 HydrophobicContact CG2-CD1 4.46Å; T116-I120 WeakPolarHBondContact O-CG1 3.36Å; T116-I120 PolarHBondContact O-N 3.37Å
117	V	58.6	Low	55.5	Low	71 Å²	71	120.7 Å²	120.7	43%	0.43	65%	0.652	S	S	.	*	H	α-helix	trans	-68.9	-35.1	-178.4	177.7	0	0	0	0	111.9	T113 P114 L115 N119 I120	T113-V117 HydrophobicContact CG2-CB 3.78Å; T113-V117 HydrophobicContact CG2-CG1 3.79Å; T113-V117 HydrophobicContact CG2-CG2 3.95Å; P114-V117 HydrophobicContact CG-CG2 3.99Å; P114-V117 WeakPolarHBondContact O-CB 3.33Å; P114-V117 PolarHBondContact O-N 3.26Å; L115-V117 PolarHBondContact O-N 3.2Å; V117-N119 VanDerWaalsContact C-N 3.33Å; V117-I120 PolarHBondContact O-N 3.41Å
118	L	59.9	Low	55.4	Low	127 Å²	127	122.6 Å²	122.6	67%	0.665	65%	0.649	S	S	*	*	H	α-helix	trans	-73.9	-26.4	176.1	-70.4	173.6	0	0	0	112.5	L115 I120 D121	L115-L118 PolarHBondContact O-N 2.98Å; L118-I120 PolarHBondContact O-N 2.89Å; L118-D121 PolarHBondContact O-N 2.81Å
119	N	56.8	Low	54.9	Low	121 Å²	121	124.1 Å²	124.1	65%	0.647	65%	0.653	S	S	*	*	H	α-helix	trans	-70.6	-24.8	175.2	-164.1	53.5	0	0	0	112.1	L115 T116 V117	L115-N119 PolarHBondContact O-N 3.29Å; T116-N119 PolarHBondContact O-N 2.88Å; V117-N119 VanDerWaalsContact C-N 3.33Å
120	I	59.4	Low	54.3	Low	78 Å²	78	127.4 Å²	127.4	40%	0.4	66%	0.661	S	S	.	*	H	α-helix	trans	-82.3	-24.2	179.6	-64.9	167.1	0	0	0	111.9	T116 V117 L118 H123	T116-I120 HydrophobicContact CG2-CD1 4.46Å; T116-I120 WeakPolarHBondContact O-CG1 3.36Å; T116-I120 PolarHBondContact O-N 3.37Å; V117-I120 PolarHBondContact O-N 3.41Å; L118-I120 PolarHBondContact O-N 2.89Å; I120-H123 VanDerWaalsContact C-CE1 3.41Å; I120-H123 WeakPolarHBondContact CA-CE1 3.46Å; I120-H123 WeakPolarHBondContact CG2-CE1 3.31Å; I120-H123 PolarHBondContact O-CE1 2.92Å; I120-H123 PolarHBondContact O-ND1 3.35Å
121	D	51.5	Low	53.8	Low	90 Å²	90	128.9 Å²	128.9	48%	0.481	65%	0.653	S	S	.	*	H	α-helix	trans	-70	-36.8	177.7	-168.9	-105.2	0	0	0	111.6	L118 H123 Q124 R125	L118-D121 PolarHBondContact O-N 2.81Å; D121-H123 PolarHBondContact O-N 3.39Å; D121-Q124 PolarHBondContact O-N 3.46Å; D121-R125 PolarHBondContact O-N 2.83Å
122	H	55.7	Low	53.2	Low	154 Å²	154	128.1 Å²	128.1	71%	0.713	66%	0.657	S	S	*	*	H	α-helix	trans	-68.1	-33.5	-173.3	-124.1	-76.4	0	0	0	113.8
123	H	52.1	Low	52.3	Low	111 Å²	111	123.8 Å²	123.8	51%	0.514	65%	0.646	S	S	.	*	H	α-helix	trans	-85.4	-12.4	-179.6	63.2	20.1	0	0	0	113.9	I120 D121 T126	I120-H123 VanDerWaalsContact C-CE1 3.41Å; I120-H123 WeakPolarHBondContact CA-CE1 3.46Å; I120-H123 WeakPolarHBondContact CG2-CE1 3.31Å; I120-H123 PolarHBondContact O-CE1 2.92Å; I120-H123 PolarHBondContact O-ND1 3.35Å; D121-H123 PolarHBondContact O-N 3.39Å; H123-T126 PolarHBondContact O-OG1 2.97Å
124	Q	48.4	Very low	51.6	Low	113 Å²	113	126 Å²	126	53%	0.528	65%	0.654	S	S	.	*	H	α-helix	trans	-96.7	-25.9	179.4	-148.6	-178.4	111.8	0	0	112.1	D121 T126 S127 I128	D121-Q124 PolarHBondContact O-N 3.46Å; Q124-T126 PolarHBondContact O-N 3.49Å; Q124-S127 PolarHBondContact O-N 3.45Å; Q124-S127 PolarHBondContact O-OG 2.87Å; Q124-I128 HydrophobicContact CG-CD1 4.36Å
125	R	47	Very low	50.9	Low	206 Å²	206	127.3 Å²	127.3	78%	0.777	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-17.4	176.1	-171.9	175.5	-78.5	-132.6	-0.6	113.6	D121	D121-R125 PolarHBondContact O-N 2.83Å
126	T	50.8	Low	50.8	Low	123 Å²	123	125.9 Å²	125.9	76%	0.755	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	0.5	179.5	51.1	0	0	0	0	114.7	H123 Q124	H123-T126 PolarHBondContact O-OG1 2.97Å; Q124-T126 PolarHBondContact O-N 3.49Å
127	S	50.3	Low	50.3	Low	80 Å²	80	129.6 Å²	129.6	56%	0.559	68%	0.677	S	S	*	*	S	Bend	trans	-129.8	8.8	-166.7	55.2	0	0	0	0	118.1	Q124	Q124-S127 PolarHBondContact O-N 3.45Å; Q124-S127 PolarHBondContact O-OG 2.87Å
128	I	47.2	Very low	49.5	Very low	125 Å²	125	132.2 Å²	132.2	64%	0.641	70%	0.697	S	S	*	*			trans	-132.1	85.9	-177.9	-53.9	174.6	0	0	0	112.5	Q124	Q124-I128 HydrophobicContact CG-CD1 4.36Å
129	V	43.1	Very low	49	Very low	143 Å²	143	141.1 Å²	141.1	87%	0.867	72%	0.722	S	S	*	*				-146.6	76.7	126.7	-176	0	0	0	0	107.9
130	K	44.9	Very low	48.6	Very low	197 Å²	197	142.2 Å²	142.2	86%	0.857	73%	0.726	S	S	*	*			trans	-132.6	111.9	147.4	-78.3	-171.3	178	175.2	0	107.2
131	K	47.4	Very low	48	Very low	169 Å²	169	145.5 Å²	145.5	74%	0.735	74%	0.743	S	S	*	*			trans	-44.7	137.8	173.8	-87.1	175.4	152.6	-156.4	0	111.4	E133	K131-E133 WeakPolarHBondContact CD-OE1 3.31Å; K131-E133 VanDerWaalsContact CE-OE1 3.27Å; K131-E133 WeakPolarHBondContact CE-OE1 3.43Å; K131-E133 IonicContact NZ-OE1 2.71Å; K131-E133 PolarHBondContact NZ-OE1 3.11Å
132	P	41.9	Very low	47.8	Very low	131 Å²	131	148.6 Å²	148.6	85%	0.851	76%	0.758	S	S	*	*			trans	-113.3	102.7	152.7	32.4	-17.4	0	0	0	108.6
133	E	44.6	Very low	47.4	Very low	129 Å²	129	148.3 Å²	148.3	60%	0.603	76%	0.76	S	S	*	*			trans	-108.7	137.5	155.8	55.9	-159.5	90.9	0	0	106.9	K131	K131-E133 WeakPolarHBondContact CD-OE1 3.31Å; K131-E133 VanDerWaalsContact CE-OE1 3.27Å; K131-E133 WeakPolarHBondContact CE-OE1 3.43Å; K131-E133 IonicContact NZ-OE1 2.71Å; K131-E133 PolarHBondContact NZ-OE1 3.11Å
134	D	46.7	Very low	47.1	Very low	155 Å²	155	150.6 Å²	150.6	83%	0.829	78%	0.776	S	S	*	*			trans	73	112.3	-177.9	-73.9	-70.8	0	0	0	118.4
135	S	48.8	Very low	47	Very low	106 Å²	106	153.1 Å²	153.1	74%	0.741	79%	0.792	S	S	*	*				175.5	109.9	106.8	-159.9	0	0	0	0	112.3
136	V	50.8	Low	47	Very low	121 Å²	121	149.4 Å²	149.4	73%	0.733	79%	0.793	S	S	*	*			trans	41.1	117.5	140.3	-53.6	0	0	0	0	122.6
137	L	49.9	Very low	46.7	Very low	172 Å²	172	151.4 Å²	151.4	90%	0.901	80%	0.796	S	S	*	*				19.2	114.4	122.9	-163.7	70.9	0	0	0	116.9
138	C	42	Very low	46.4	Very low	125 Å²	125	157.3 Å²	157.3	85%	0.845	82%	0.816	S	S	*	*			trans	-127.8	137.5	157.3	-148.3	0	0	0	0	110.4
139	R	49.2	Very low	46.3	Very low	315 Å²	315	160.3 Å²	160.3	100%	1.189	83%	0.832	S	S	*	*			trans	-56.4	0	178.2	-82.7	174.5	162.7	-177.5	-5.6	113.4

Retrieved 139 of 139 residues in 46.1 ms (Link to these results)

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