A0A087YH85_POEFO Loading...

Glucagon b

AlphaFold DB (A0A3B3THL8), UniProt , Accession A0A087YH85, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 123 aa.

						>A0A087YH85_POEFO|A0A087YH85
MKSAQSLAGLMLLVIIQSSWQVPDQDTDRTPLLLSENSILSDPSEFPNMKRHSEGTFSNDYSKYLETRRAQDFVQWLKNSKRNGSLFRRHADGTYTSDVSSYLQDQAAKEFVSWLKTGRGRRD
					

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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	58.8	Low	70.7	Confident	213 Å²	213	110.3 Å²	110.3	100%	1.049	63%	0.627	S	S	*	*				0	-3.7	0	-59	173.9	75.1	0	0	114.7
2	K	57.1	Low	71.4	Confident	190 Å²	190	110.3 Å²	110.3	83%	0.826	62%	0.623	S	S	*	*	H	α-helix	trans	-81.8	-24.7	-179	-61.2	179.4	-180	-179.9	0	114.2	S6	K2-S6 PolarHBondContact O-N 3.42Å
3	S	61.1	Low	71.9	Confident	97 Å²	97	109.8 Å²	109.8	68%	0.678	62%	0.617	S	S	*	*	H	α-helix	trans	-69.6	-36.7	-180	50.2	0	0	0	0	113.3	Q5 S6 L7	S3-Q5 VanDerWaalsContact C-N 3.34Å; S3-Q5 PolarHBondContact O-N 3.41Å; S3-S6 WeakPolarHBondContact O-CB 3.37Å; S3-S6 PolarHBondContact O-N 3.08Å; S3-L7 PolarHBondContact O-N 3.25Å; S3-L7 VanDerWaalsContact O-N 3.07Å
4	A	64.8	Low	72.2	Confident	64 Å²	64	107 Å²	107	53%	0.529	60%	0.604	S	S	.	*	H	α-helix	trans	-65.2	-37.8	177.3	0	0	0	0	0	112.3	S6 L7 A8	A4-S6 VanDerWaalsContact C-N 3.34Å; A4-L7 PolarHBondContact O-N 3.17Å; A4-A8 PolarHBondContact O-N 3.34Å; A4-A8 VanDerWaalsContact O-N 3.11Å
5	Q	66.4	Low	72.1	Confident	148 Å²	148	107.1 Å²	107.1	69%	0.692	60%	0.6	S	S	*	*	H	α-helix	trans	-68.5	-35.2	176.3	-59.4	-67.4	-20.5	0	0	111.5	S3 G9	S3-Q5 VanDerWaalsContact C-N 3.34Å; S3-Q5 PolarHBondContact O-N 3.41Å; Q5-G9 PolarHBondContact O-N 3.29Å; Q5-G9 VanDerWaalsContact O-N 3.12Å
6	S	71.5	Confident	72.2	Confident	87 Å²	87	106.4 Å²	106.4	61%	0.608	59%	0.594	S	S	*	*	H	α-helix	trans	-68.2	-37.8	175.8	-168.4	0	0	0	0	112.7	K2 S3 A4 L10	K2-S6 PolarHBondContact O-N 3.42Å; S3-S6 WeakPolarHBondContact O-CB 3.37Å; S3-S6 PolarHBondContact O-N 3.08Å; A4-S6 VanDerWaalsContact C-N 3.34Å; S6-L10 PolarHBondContact O-N 2.91Å; S6-L10 VanDerWaalsContact O-N 3.17Å
7	L	75.6	Confident	71.8	Confident	114 Å²	114	107.2 Å²	107.2	60%	0.597	59%	0.592	S	S	*	*	H	α-helix	trans	-69.3	-40.9	177.4	-173.3	69.4	0	0	0	111.4	S3 A4 G9 L10 M11	S3-L7 PolarHBondContact O-N 3.25Å; S3-L7 VanDerWaalsContact O-N 3.07Å; A4-L7 PolarHBondContact O-N 3.17Å; L7-G9 VanDerWaalsContact C-N 3.33Å; L7-G9 PolarHBondContact O-N 3.3Å; L7-L10 PolarHBondContact O-N 2.93Å; L7-M11 WeakPolarHBondContact O-CG 3.4Å; L7-M11 PolarHBondContact O-N 3.29Å
8	A	79.7	Confident	71.1	Confident	59 Å²	59	105.2 Å²	105.2	49%	0.488	59%	0.586	S	S	.	*	H	α-helix	trans	-61.6	-41.2	176	0	0	0	0	0	111.8	A4 M11 L12	A4-A8 PolarHBondContact O-N 3.34Å; A4-A8 VanDerWaalsContact O-N 3.11Å; A8-M11 PolarHBondContact O-N 2.8Å; A8-L12 PolarHBondContact O-N 2.89Å; A8-L12 VanDerWaalsContact O-N 3.07Å
9	G	81.4	Confident	70.5	Confident	40 Å²	40	104.8 Å²	104.8	41%	0.412	59%	0.592	S	S	.	*	H	α-helix	trans	-63.6	-40.6	175.1	0	0	0	0	0	113.3	Q5 L7 L12 L13	Q5-G9 PolarHBondContact O-N 3.29Å; Q5-G9 VanDerWaalsContact O-N 3.12Å; L7-G9 VanDerWaalsContact C-N 3.33Å; L7-G9 PolarHBondContact O-N 3.3Å; G9-L12 PolarHBondContact O-N 3.34Å; G9-L13 PolarHBondContact O-N 3.26Å
10	L	81.3	Confident	69.5	Low	104 Å²	104	110.7 Å²	110.7	55%	0.545	60%	0.604	S	S	.	*	H	α-helix	trans	-67.3	-39.9	178.9	-170.5	139.2	0	0	0	112.1	S6 L7 L13 V14	S6-L10 PolarHBondContact O-N 2.91Å; S6-L10 VanDerWaalsContact O-N 3.17Å; L7-L10 PolarHBondContact O-N 2.93Å; L10-L13 PolarHBondContact O-N 3.35Å; L10-V14 HydrophobicContact CD2-CG2 4.41Å; L10-V14 WeakPolarHBondContact O-CG2 3.47Å; L10-V14 PolarHBondContact O-N 3.46Å; L10-V14 VanDerWaalsContact O-N 3.08Å
11	M	80.1	Confident	68.7	Low	97 Å²	97	112.5 Å²	112.5	48%	0.478	61%	0.608	S	S	.	*	H	α-helix	trans	-62.7	-42.6	173.4	-72.9	-72.3	99.3	0	0	112.1	L7 A8 L13 V14 I15	L7-M11 WeakPolarHBondContact O-CG 3.4Å; L7-M11 PolarHBondContact O-N 3.29Å; A8-M11 PolarHBondContact O-N 2.8Å; M11-L13 VanDerWaalsContact C-N 3.29Å; M11-L13 PolarHBondContact O-N 2.72Å; M11-V14 PolarHBondContact O-N 3.29Å; M11-I15 WeakPolarHBondContact O-CD1 3.48Å; M11-I15 VanDerWaalsContact O-CG1 3.23Å; M11-I15 WeakPolarHBondContact O-CG1 3.33Å; M11-I15 PolarHBondContact O-N 3.37Å; M11-I15 VanDerWaalsContact O-N 3.11Å
12	L	79.2	Confident	68.5	Low	110 Å²	110	108.1 Å²	108.1	58%	0.576	59%	0.593	S	S	*	*	H	α-helix	trans	-60.9	-41	176.3	-162.5	96.7	0	0	0	111.3	A8 G9 I15 I16	A8-L12 PolarHBondContact O-N 2.89Å; A8-L12 VanDerWaalsContact O-N 3.07Å; G9-L12 PolarHBondContact O-N 3.34Å; L12-I15 PolarHBondContact O-N 2.89Å; L12-I16 HydrophobicContact CD2-CD1 3.86Å; L12-I16 HydrophobicContact CG-CD1 4.01Å; L12-I16 WeakPolarHBondContact O-CD1 3.35Å; L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.3Å; L12-I16 PolarHBondContact O-N 3.46Å
13	L	78.4	Confident	67.9	Low	104 Å²	104	104.7 Å²	104.7	55%	0.545	59%	0.591	S	S	.	*	H	α-helix	trans	-67.7	-38.8	-178.5	-156.4	130.4	0	0	0	112.2	G9 L10 M11 I16 Q17	G9-L13 PolarHBondContact O-N 3.26Å; L10-L13 PolarHBondContact O-N 3.35Å; M11-L13 VanDerWaalsContact C-N 3.29Å; M11-L13 PolarHBondContact O-N 2.72Å; L13-I16 PolarHBondContact O-N 2.87Å; L13-Q17 WeakPolarHBondContact O-CG 3.44Å; L13-Q17 PolarHBondContact O-N 2.99Å
14	V	75.5	Confident	67.2	Low	71 Å²	71	106 Å²	106	43%	0.43	59%	0.59	S	S	.	*	H	α-helix	trans	-64.5	-39.2	174.1	172.5	0	0	0	0	111.5	L10 M11 Q17 S18	L10-V14 HydrophobicContact CD2-CG2 4.41Å; L10-V14 WeakPolarHBondContact O-CG2 3.47Å; L10-V14 PolarHBondContact O-N 3.46Å; L10-V14 VanDerWaalsContact O-N 3.08Å; M11-V14 PolarHBondContact O-N 3.29Å; V14-Q17 PolarHBondContact O-N 3.48Å; V14-S18 WeakPolarHBondContact O-CB 3.43Å; V14-S18 PolarHBondContact O-N 3.18Å; V14-S18 PolarHBondContact O-OG 3.24Å
15	I	71.4	Confident	66.2	Low	108 Å²	108	111.1 Å²	111.1	55%	0.554	60%	0.603	S	S	*	*	H	α-helix	trans	-68.4	-38	178.3	-65.1	162.7	0	0	0	111.3	M11 L12 S18 S19	M11-I15 WeakPolarHBondContact O-CD1 3.48Å; M11-I15 VanDerWaalsContact O-CG1 3.23Å; M11-I15 WeakPolarHBondContact O-CG1 3.33Å; M11-I15 PolarHBondContact O-N 3.37Å; M11-I15 VanDerWaalsContact O-N 3.11Å; L12-I15 PolarHBondContact O-N 2.89Å; I15-S18 PolarHBondContact O-OG 3.07Å; I15-S18 VanDerWaalsContact O-OG 3.05Å; I15-S19 WeakPolarHBondContact O-CB 3.29Å; I15-S19 PolarHBondContact O-N 3.41Å; I15-S19 VanDerWaalsContact O-N 3.13Å
16	I	72.5	Confident	64.9	Low	96 Å²	96	109.6 Å²	109.6	49%	0.492	60%	0.6	S	S	.	*	H	α-helix	trans	-69.3	-39.2	177	-65.9	162.9	0	0	0	110.6	L12 L13 S19	L12-I16 HydrophobicContact CD2-CD1 3.86Å; L12-I16 HydrophobicContact CG-CD1 4.01Å; L12-I16 WeakPolarHBondContact O-CD1 3.35Å; L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.3Å; L12-I16 PolarHBondContact O-N 3.46Å; L13-I16 PolarHBondContact O-N 2.87Å; I16-S19 PolarHBondContact O-N 2.9Å
17	Q	65.6	Low	63.4	Low	121 Å²	121	111.4 Å²	111.4	57%	0.565	61%	0.607	S	S	*	*	H	α-helix	trans	-66.5	-43	175.8	-75.3	-178.7	-21.8	0	0	112.5	L13 V14 S19 W20 Q21	L13-Q17 WeakPolarHBondContact O-CG 3.44Å; L13-Q17 PolarHBondContact O-N 2.99Å; V14-Q17 PolarHBondContact O-N 3.48Å; Q17-S19 VanDerWaalsContact C-N 3.25Å; Q17-S19 PolarHBondContact O-N 2.98Å; Q17-W20 PolarHBondContact O-N 3.41Å; Q17-Q21 PolarHBondContact O-N 2.88Å
18	S	59.5	Low	61.8	Low	70 Å²	70	112.3 Å²	112.3	49%	0.49	61%	0.613	S	S	.	*	H	α-helix	trans	-67.2	-27.8	177.9	68	0	0	0	0	112.7	V14 I15 W20 Q21	V14-S18 WeakPolarHBondContact O-CB 3.43Å; V14-S18 PolarHBondContact O-N 3.18Å; V14-S18 PolarHBondContact O-OG 3.24Å; I15-S18 PolarHBondContact O-OG 3.07Å; I15-S18 VanDerWaalsContact O-OG 3.05Å; S18-W20 PolarHBondContact O-N 3.3Å; S18-Q21 PolarHBondContact O-N 3.49Å
19	S	59.6	Low	60.2	Low	98 Å²	98	120.9 Å²	120.9	69%	0.685	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-17.8	178	-169.1	0	0	0	0	113.9	I15 I16 Q17	I15-S19 WeakPolarHBondContact O-CB 3.29Å; I15-S19 PolarHBondContact O-N 3.41Å; I15-S19 VanDerWaalsContact O-N 3.13Å; I16-S19 PolarHBondContact O-N 2.9Å; Q17-S19 VanDerWaalsContact C-N 3.25Å; Q17-S19 PolarHBondContact O-N 2.98Å
20	W	51.1	Low	58.9	Low	223 Å²	223	124.7 Å²	124.7	85%	0.845	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-7.8	174.7	-79.7	67.2	0	0	0	113.1	Q17 S18 V22	Q17-W20 PolarHBondContact O-N 3.41Å; S18-W20 PolarHBondContact O-N 3.3Å; W20-V22 PolarHBondContact O-N 3.4Å; W20-V22 VanDerWaalsContact O-N 3.12Å
21	Q	51.6	Low	57.2	Low	148 Å²	148	126 Å²	126	69%	0.692	66%	0.663	S	S	*	*			trans	-89.4	80.4	-178.2	-148.5	159.1	1.1	0	0	109.1	Q17 S18 P23	Q17-Q21 PolarHBondContact O-N 2.88Å; S18-Q21 PolarHBondContact O-N 3.49Å; Q21-P23 WeakPolarHBondContact O-CD 3.49Å
22	V	54.3	Low	55.6	Low	121 Å²	121	128.7 Å²	128.7	73%	0.733	68%	0.678	S	S	*	*			trans	-57.9	123.8	163	174.1	0	0	0	0	107.4	W20 D24	W20-V22 PolarHBondContact O-N 3.4Å; W20-V22 VanDerWaalsContact O-N 3.12Å; V22-D24 VanDerWaalsContact C-N 3.33Å; V22-D24 PolarHBondContact O-N 2.93Å
23	P	46.4	Very low	54.1	Low	119 Å²	119	131.2 Å²	131.2	77%	0.773	69%	0.692	S	S	*	*			trans	-71.1	96.4	166.8	-4.7	21.2	0	0	0	107.1	Q21 Q25	Q21-P23 WeakPolarHBondContact O-CD 3.49Å; P23-Q25 PolarHBondContact O-N 3.12Å; P23-Q25 VanDerWaalsContact O-N 3.08Å
24	D	46.3	Very low	52.6	Low	125 Å²	125	134.3 Å²	134.3	67%	0.668	71%	0.708	S	S	*	*			trans	-74.1	88.4	160.8	-172.7	34.9	0	0	0	106.8	V22 D26	V22-D24 VanDerWaalsContact C-N 3.33Å; V22-D24 PolarHBondContact O-N 2.93Å; D24-D26 VanDerWaalsContact OD1-CG 3.3Å
25	Q	43.9	Very low	50.9	Low	170 Å²	170	135.8 Å²	135.8	79%	0.794	72%	0.721	S	S	*	*			trans	-97.3	51.2	170.7	-153.7	-176.6	9.6	0	0	109.5	P23 T27	P23-Q25 PolarHBondContact O-N 3.12Å; P23-Q25 VanDerWaalsContact O-N 3.08Å; Q25-T27 VanDerWaalsContact C-N 3.33Å; Q25-T27 PolarHBondContact O-N 3.03Å
26	D	37.5	Very low	49.4	Very low	116 Å²	116	139.4 Å²	139.4	62%	0.62	74%	0.736	S	S	*	*			trans	-73.5	89.1	162.7	-79.4	-7.5	0	0	0	108.5	D24 D28	D24-D26 VanDerWaalsContact OD1-CG 3.3Å; D26-D28 PolarHBondContact O-N 2.78Å
27	T	40.4	Very low	48.2	Very low	126 Å²	126	141.6 Å²	141.6	77%	0.773	75%	0.749	S	S	*	*			trans	-85.9	61	154.7	-56.5	0	0	0	0	108.5	Q25	Q25-T27 VanDerWaalsContact C-N 3.33Å; Q25-T27 PolarHBondContact O-N 3.03Å
28	D	41.3	Very low	47	Very low	133 Å²	133	140.8 Å²	140.8	71%	0.711	76%	0.756	S	S	*	*			trans	-99.9	96.5	165.3	-83.2	-15.7	0	0	0	108.3	D26	D26-D28 PolarHBondContact O-N 2.78Å
29	R	47.8	Very low	46.4	Very low	238 Å²	238	145.5 Å²	145.5	90%	0.898	77%	0.774	S	S	*	*			trans	-119.1	114.5	151.3	-72	-165.1	174.9	-175	0.2	108.7
30	T	53.2	Low	46.1	Very low	121 Å²	121	147.9 Å²	147.9	74%	0.742	78%	0.778	S	S	*	*			trans	97.9	98.4	160.5	-18.6	0	0	0	0	115.5
31	P	44.5	Very low	45.8	Very low	131 Å²	131	142.6 Å²	142.6	85%	0.851	78%	0.775	S	S	*	*				-135	65.3	119.4	38.4	-26.4	0	0	0	111.1
32	L	48.4	Very low	45.4	Very low	153 Å²	153	143 Å²	143	80%	0.801	78%	0.782	S	S	*	*			trans	-93.3	82.4	163.3	-174.2	108.1	0	0	0	107.2
33	L	45.7	Very low	45.4	Very low	164 Å²	164	142.8 Å²	142.8	86%	0.859	78%	0.784	S	S	*	*	S	Bend	trans	177.9	7	153.5	-104.6	172.1	0	0	0	119.3
34	L	48.1	Very low	45.6	Very low	169 Å²	169	141.6 Å²	141.6	89%	0.885	78%	0.778	S	S	*	*	S	Bend	trans	-145.1	93.1	178.7	-93.3	166.4	0	0	0	111.3
35	S	39.5	Very low	45.5	Very low	102 Å²	102	144.6 Å²	144.6	71%	0.713	79%	0.788	S	S	*	*				171.1	58.1	129.8	-161	0	0	0	0	110.3	N37	S35-N37 PolarHBondContact O-N 2.72Å; S35-N37 VanDerWaalsContact O-N 3.12Å
36	E	40.3	Very low	45.7	Very low	183 Å²	183	145.1 Å²	145.1	86%	0.855	79%	0.788	S	S	*	*			trans	-77.1	32.1	167.4	-161.6	-177.7	126.7	0	0	111.1
37	N	47.6	Very low	46.2	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	80%	0.795	S	S	*	*			trans	-128.9	21	-163.3	-67.8	5.3	0	0	0	115.5	S35	S35-N37 PolarHBondContact O-N 2.72Å; S35-N37 VanDerWaalsContact O-N 3.12Å
38	S	39.7	Very low	47	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	79%	0.791	S	S	*	*			trans	-141	54.3	175	-154.8	0	0	0	0	113.9	L40	S38-L40 VanDerWaalsContact C-N 3.26Å; S38-L40 PolarHBondContact O-N 2.71Å
39	I	47.2	Very low	47.5	Very low	170 Å²	170	146.9 Å²	146.9	87%	0.872	80%	0.796	S	S	*	*			trans	-77.1	78.3	157.3	-57.1	172.1	0	0	0	107.4
40	L	53.6	Low	48.1	Very low	148 Å²	148	140.8 Å²	140.8	78%	0.775	78%	0.776	S	S	*	*			trans	-168.6	140.7	155.7	-160	54.2	0	0	0	111.1	S38	S38-L40 VanDerWaalsContact C-N 3.26Å; S38-L40 PolarHBondContact O-N 2.71Å
41	S	44	Very low	48.6	Very low	112 Å²	112	146 Å²	146	78%	0.783	78%	0.782	S	S	*	*			trans	71	97.5	170.4	75.9	0	0	0	0	118.4
42	D	43.1	Very low	49.2	Very low	155 Å²	155	145.9 Å²	145.9	83%	0.829	77%	0.769	S	S	*	*				157.2	126.1	99.9	-156	12.4	0	0	0	110.5
43	P	54	Low	49.5	Very low	118 Å²	118	142.5 Å²	142.5	77%	0.766	76%	0.759	S	S	*	*			trans	-99.1	93.6	-176.4	34.8	-23.6	0	0	0	110.6
44	S	50.4	Low	50.1	Low	93 Å²	93	139.4 Å²	139.4	65%	0.65	74%	0.74	S	S	*	*			trans	159.3	74.1	151.8	172.4	0	0	0	0	111.2
45	E	44.9	Very low	50.8	Low	188 Å²	188	134.2 Å²	134.2	88%	0.879	73%	0.727	S	S	*	*			trans	-124.1	103.9	150.1	-70.4	-160.1	163.4	0	0	107.5	P47	E45-P47 VanDerWaalsContact O-N 3.14Å
46	F	48.4	Very low	52	Low	182 Å²	182	132.2 Å²	132.2	80%	0.798	71%	0.711	S	S	*	*			trans	-46	123.4	159.9	-68.9	-87.2	0	0	0	106.5	N48	F46-N48 VanDerWaalsContact C-N 3.34Å; F46-N48 PolarHBondContact O-N 2.69Å
47	P	48.7	Very low	52.8	Low	119 Å²	119	131.9 Å²	131.9	77%	0.773	71%	0.707	S	S	*	*			trans	-59.7	109	175.6	24.2	-30.9	0	0	0	105.4	E45 M49	E45-P47 VanDerWaalsContact O-N 3.14Å; P47-M49 PolarHBondContact O-N 3.26Å
48	N	56.5	Low	53.5	Low	128 Å²	128	129 Å²	129	68%	0.684	70%	0.698	S	S	*	*			trans	-62.1	93.5	175.1	-171.6	-33.5	0	0	0	104.7	F46 K50	F46-N48 VanDerWaalsContact C-N 3.34Å; F46-N48 PolarHBondContact O-N 2.69Å; N48-K50 PolarHBondContact O-N 2.73Å
49	M	51	Low	55	Low	164 Å²	164	125.3 Å²	125.3	81%	0.808	67%	0.67	S	S	*	*			trans	-69.3	73.1	173.7	-167.4	101.3	76.2	0	0	105.9	P47 R51	P47-M49 PolarHBondContact O-N 3.26Å; M49-R51 PolarHBondContact O-N 3.02Å
50	K	61.3	Low	56.2	Low	111 Å²	111	121.6 Å²	121.6	48%	0.483	65%	0.652	S	S	.	*			trans	-72.9	102.9	-170.1	-154.3	166.7	-170.1	-170	0	106.7	N48 H52 E54	N48-K50 PolarHBondContact O-N 2.73Å; K50-H52 PolarHBondContact O-N 3Å; K50-E54 WeakPolarHBondContact CD-OE1 3.36Å; K50-E54 WeakPolarHBondContact CE-OE1 3.35Å; K50-E54 IonicContact NZ-OE1 2.61Å; K50-E54 PolarHBondContact NZ-OE1 3.49Å; K50-E54 IonicContact NZ-OE2 3.72Å
51	R	63	Low	57.4	Low	230 Å²	230	120.8 Å²	120.8	87%	0.868	64%	0.64	S	S	*	*			trans	-72.8	17.5	179.9	-63.2	-176.5	172.7	-130.8	-0.8	113.6	M49	M49-R51 PolarHBondContact O-N 3.02Å
52	H	57.9	Low	59.2	Low	128 Å²	128	118.7 Å²	118.7	59%	0.593	63%	0.625	S	S	*	*	S	Bend	trans	-127.8	122.5	-169.9	-51.3	-113.2	0	0	0	107.3	K50 E54	K50-H52 PolarHBondContact O-N 3Å; H52-E54 PolarHBondContact O-N 3.22Å
53	S	54.8	Low	61.1	Low	82 Å²	82	117.2 Å²	117.2	57%	0.573	61%	0.611	S	S	*	*			trans	-62.3	103.7	175.3	36.2	0	0	0	0	109.6	G55 T56	S53-G55 PolarHBondContact O-N 3.43Å; S53-T56 PolarHBondContact O-OG1 3.46Å
54	E	57.3	Low	62.6	Low	99 Å²	99	117.9 Å²	117.9	46%	0.463	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.4	134.2	170.1	-65.2	-64.8	134.5	0	0	109.4	K50 H52 N59	K50-E54 WeakPolarHBondContact CD-OE1 3.36Å; K50-E54 WeakPolarHBondContact CE-OE1 3.35Å; K50-E54 IonicContact NZ-OE1 2.61Å; K50-E54 PolarHBondContact NZ-OE1 3.49Å; K50-E54 IonicContact NZ-OE2 3.72Å; H52-E54 PolarHBondContact O-N 3.22Å; E54-N59 VanDerWaalsContact CD-ND2 3.26Å; E54-N59 PolarHBondContact OE1-ND2 2.94Å; E54-N59 PolarHBondContact OE2-ND2 2.94Å
55	G	64.1	Low	64.5	Low	60 Å²	60	115.7 Å²	115.7	62%	0.619	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.4	8.6	178.7	0	0	0	0	0	116.3	S53	S53-G55 PolarHBondContact O-N 3.43Å
56	T	64.2	Low	66.4	Low	61 Å²	61	113.3 Å²	113.3	37%	0.374	57%	0.569	S	S	.	*	S	Bend	trans	-88.6	146.9	166.6	60.3	0	0	0	0	110.9	S53 S58 N59 D60	S53-T56 PolarHBondContact O-OG1 3.46Å; T56-S58 PolarHBondContact O-N 3.36Å; T56-N59 WeakPolarHBondContact O-CB 3.46Å; T56-N59 PolarHBondContact O-N 2.94Å; T56-D60 PolarHBondContact O-N 3.47Å
57	F	57.7	Low	68.4	Low	176 Å²	176	107.9 Å²	107.9	77%	0.772	55%	0.551	S	S	*	*	H	α-helix	trans	-47.3	-37.9	179	175.8	-99.7	0	0	0	113.4	Y61	F57-Y61 WeakPolarHBondContact O-CB 3.37Å; F57-Y61 PolarHBondContact O-N 2.91Å; F57-Y61 VanDerWaalsContact O-N 3.15Å
58	S	61.4	Low	70.4	Confident	82 Å²	82	108.5 Å²	108.5	57%	0.573	54%	0.538	S	S	*	.	H	α-helix	trans	-69.2	-33.4	177.3	-63.4	0	0	0	0	113.8	T56 S62	T56-S58 PolarHBondContact O-N 3.36Å; S58-S62 VanDerWaalsContact O-CB 3.32Å; S58-S62 WeakPolarHBondContact O-CB 3.31Å; S58-S62 PolarHBondContact O-N 2.91Å; S58-S62 PolarHBondContact O-OG 3.01Å
59	N	71.3	Confident	72	Confident	25 Å²	25	111 Å²	111	13%	0.134	54%	0.537	C	S	.	.	H	α-helix	trans	-70.6	-44	177.2	-173.8	51.3	0	0	0	111.3	E54 T56 Y61 S62 K63	E54-N59 VanDerWaalsContact CD-ND2 3.26Å; E54-N59 PolarHBondContact OE1-ND2 2.94Å; E54-N59 PolarHBondContact OE2-ND2 2.94Å; T56-N59 WeakPolarHBondContact O-CB 3.46Å; T56-N59 PolarHBondContact O-N 2.94Å; N59-Y61 PolarHBondContact O-N 3.36Å; N59-S62 WeakPolarHBondContact O-CB 3.4Å; N59-S62 PolarHBondContact O-N 3.11Å; N59-K63 WeakPolarHBondContact O-CB 2.95Å; N59-K63 PolarHBondContact O-N 3.29Å
60	D	73.8	Confident	73.9	Confident	93 Å²	93	105.7 Å²	105.7	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-67.5	-38.4	-179.4	-67	-14.7	0	0	0	111.8	T56 K63 Y64	T56-D60 PolarHBondContact O-N 3.47Å; D60-K63 PolarHBondContact O-N 3.49Å; D60-Y64 WeakPolarHBondContact O-CB 2.9Å; D60-Y64 PolarHBondContact O-N 3.4Å
61	Y	78.3	Confident	75.4	Confident	131 Å²	131	106.2 Å²	106.2	51%	0.514	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-41.2	172.9	-174.1	-110.6	0	0	0	112.1	F57 N59 K63 Y64 L65	F57-Y61 WeakPolarHBondContact O-CB 3.37Å; F57-Y61 PolarHBondContact O-N 2.91Å; F57-Y61 VanDerWaalsContact O-N 3.15Å; N59-Y61 PolarHBondContact O-N 3.36Å; Y61-K63 VanDerWaalsContact C-N 3.34Å; Y61-K63 PolarHBondContact O-N 3.39Å; Y61-Y64 PolarHBondContact O-N 3.39Å; Y61-L65 HydrophobicContact CD1-CD1 3.93Å; Y61-L65 HydrophobicContact CD1-CG 4.34Å; Y61-L65 HydrophobicContact CE1-CD1 3.39Å; Y61-L65 HydrophobicContact CE1-CG 3.95Å; Y61-L65 HydrophobicContact CE2-CD2 4.5Å; Y61-L65 HydrophobicContact CE2-CG 4.37Å; Y61-L65 WeakPolarHBondContact O-CG 3.23Å; Y61-L65 PolarHBondContact O-N 3.46Å
62	S	81.6	Confident	76.7	Confident	67 Å²	67	100 Å²	100	47%	0.469	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-43.5	176.4	-61.4	0	0	0	0	111.3	S58 N59 L65 E66	S58-S62 VanDerWaalsContact O-CB 3.32Å; S58-S62 WeakPolarHBondContact O-CB 3.31Å; S58-S62 PolarHBondContact O-N 2.91Å; S58-S62 PolarHBondContact O-OG 3.01Å; N59-S62 WeakPolarHBondContact O-CB 3.4Å; N59-S62 PolarHBondContact O-N 3.11Å; S62-L65 PolarHBondContact O-N 3.01Å; S62-E66 WeakPolarHBondContact O-CB 3.25Å; S62-E66 PolarHBondContact O-N 2.86Å
63	K	81.8	Confident	78.1	Confident	125 Å²	125	99.6 Å²	99.6	54%	0.543	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-40.2	176.3	-171.7	176.6	-177.5	178.3	0	112.6	N59 D60 Y61 E66 T67	N59-K63 WeakPolarHBondContact O-CB 2.95Å; N59-K63 PolarHBondContact O-N 3.29Å; D60-K63 PolarHBondContact O-N 3.49Å; Y61-K63 VanDerWaalsContact C-N 3.34Å; Y61-K63 PolarHBondContact O-N 3.39Å; K63-E66 PolarHBondContact O-N 3.3Å; K63-T67 WeakPolarHBondContact O-CB 3.43Å; K63-T67 PolarHBondContact O-N 3.1Å; K63-T67 PolarHBondContact O-OG1 2.76Å
64	Y	87.4	Confident	79.9	Confident	131 Å²	131	99.5 Å²	99.5	51%	0.514	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-47.3	173.7	170.1	-99.9	0	0	0	111.6	D60 Y61 E66 T67 R68	D60-Y64 WeakPolarHBondContact O-CB 2.9Å; D60-Y64 PolarHBondContact O-N 3.4Å; Y61-Y64 PolarHBondContact O-N 3.39Å; Y64-E66 VanDerWaalsContact C-N 3.35Å; Y64-E66 PolarHBondContact O-N 2.76Å; Y64-T67 PolarHBondContact O-N 2.99Å; Y64-R68 WeakPolarHBondContact O-CB 3.44Å; Y64-R68 PolarHBondContact O-N 3.49Å
65	L	88.5	Confident	81.3	Confident	47 Å²	47	98.6 Å²	98.6	25%	0.246	50%	0.496	C	S	.	.	H	α-helix	trans	-62.7	-41.8	177.4	-74.3	-177.3	0	0	0	112.1	Y61 S62 R68 R69	Y61-L65 HydrophobicContact CD1-CD1 3.93Å; Y61-L65 HydrophobicContact CD1-CG 4.34Å; Y61-L65 HydrophobicContact CE1-CD1 3.39Å; Y61-L65 HydrophobicContact CE1-CG 3.95Å; Y61-L65 HydrophobicContact CE2-CD2 4.5Å; Y61-L65 HydrophobicContact CE2-CG 4.37Å; Y61-L65 WeakPolarHBondContact O-CG 3.23Å; Y61-L65 PolarHBondContact O-N 3.46Å; S62-L65 PolarHBondContact O-N 3.01Å; L65-R68 PolarHBondContact O-N 2.75Å; L65-R69 WeakPolarHBondContact O-CB 3.39Å; L65-R69 VanDerWaalsContact O-CG 3.27Å; L65-R69 WeakPolarHBondContact O-CG 3.44Å; L65-R69 PolarHBondContact O-N 2.9Å
66	E	85.5	Confident	82.3	Confident	139 Å²	139	102.4 Å²	102.4	65%	0.65	49%	0.492	S	S	*	.	H	α-helix	trans	-62.3	-46	176.6	-175.3	171.1	-156.8	0	0	111.2	S62 K63 Y64 R68 R69 A70	S62-E66 WeakPolarHBondContact O-CB 3.25Å; S62-E66 PolarHBondContact O-N 2.86Å; K63-E66 PolarHBondContact O-N 3.3Å; Y64-E66 VanDerWaalsContact C-N 3.35Å; Y64-E66 PolarHBondContact O-N 2.76Å; E66-R68 VanDerWaalsContact C-N 3.32Å; E66-R68 PolarHBondContact O-N 3.27Å; E66-R69 PolarHBondContact O-N 2.81Å; E66-A70 WeakPolarHBondContact O-CB 3.39Å; E66-A70 PolarHBondContact O-N 3.44Å
67	T	89.6	Confident	83.3	Confident	68 Å²	68	103.2 Å²	103.2	42%	0.417	49%	0.494	S	S	.	.	H	α-helix	trans	-60.1	-43.3	175.5	-55.4	0	0	0	0	111.1	K63 Y64 A70 Q71	K63-T67 WeakPolarHBondContact O-CB 3.43Å; K63-T67 PolarHBondContact O-N 3.1Å; K63-T67 PolarHBondContact O-OG1 2.76Å; Y64-T67 PolarHBondContact O-N 2.99Å; T67-A70 PolarHBondContact O-N 3.03Å; T67-Q71 VanDerWaalsContact O-CG 3.3Å; T67-Q71 WeakPolarHBondContact O-CG 3.38Å; T67-Q71 PolarHBondContact O-N 3.26Å
68	R	91.8	Very high	84.6	Confident	132 Å²	132	99.9 Å²	99.9	50%	0.498	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-44.1	177.1	-172	172.8	-179.2	176.8	-0.6	112.1	Y64 L65 E66 A70 Q71 D72	Y64-R68 WeakPolarHBondContact O-CB 3.44Å; Y64-R68 PolarHBondContact O-N 3.49Å; L65-R68 PolarHBondContact O-N 2.75Å; E66-R68 VanDerWaalsContact C-N 3.32Å; E66-R68 PolarHBondContact O-N 3.27Å; R68-A70 PolarHBondContact O-N 2.93Å; R68-Q71 PolarHBondContact O-N 3.31Å; R68-D72 PolarHBondContact O-N 3Å
69	R	89.4	Confident	85.2	Confident	180 Å²	180	100.3 Å²	100.3	68%	0.679	48%	0.475	S	S	*	.	H	α-helix	trans	-63.4	-40.7	175.7	-73	175.5	-172.8	-176.3	4.1	112	L65 E66 Q71 D72 F73	L65-R69 WeakPolarHBondContact O-CB 3.39Å; L65-R69 VanDerWaalsContact O-CG 3.27Å; L65-R69 WeakPolarHBondContact O-CG 3.44Å; L65-R69 PolarHBondContact O-N 2.9Å; E66-R69 PolarHBondContact O-N 2.81Å; R69-Q71 VanDerWaalsContact C-N 3.34Å; R69-D72 PolarHBondContact O-N 3.38Å; R69-F73 WeakPolarHBondContact O-CB 3.46Å; R69-F73 PolarHBondContact O-N 2.87Å
70	A	91.6	Very high	85.1	Confident	52 Å²	52	99.9 Å²	99.9	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-63.9	-41.5	176.9	0	0	0	0	0	111.4	E66 T67 R68 F73 V74	E66-A70 WeakPolarHBondContact O-CB 3.39Å; E66-A70 PolarHBondContact O-N 3.44Å; T67-A70 PolarHBondContact O-N 3.03Å; R68-A70 PolarHBondContact O-N 2.93Å; A70-F73 PolarHBondContact O-N 3.45Å; A70-V74 WeakPolarHBondContact O-CG2 3.17Å; A70-V74 PolarHBondContact O-N 3.03Å
71	Q	93.4	Very high	84.6	Confident	123 Å²	123	104.2 Å²	104.2	58%	0.575	49%	0.488	S	S	*	.	H	α-helix	trans	-62	-46.5	173.7	-73.2	174.6	-4.9	0	0	112	T67 R68 R69 F73 V74 Q75	T67-Q71 VanDerWaalsContact O-CG 3.3Å; T67-Q71 WeakPolarHBondContact O-CG 3.38Å; T67-Q71 PolarHBondContact O-N 3.26Å; R68-Q71 PolarHBondContact O-N 3.31Å; R69-Q71 VanDerWaalsContact C-N 3.34Å; Q71-F73 VanDerWaalsContact C-N 3.28Å; Q71-F73 PolarHBondContact O-N 2.98Å; Q71-V74 PolarHBondContact O-N 3.41Å; Q71-Q75 WeakPolarHBondContact O-CB 3.43Å; Q71-Q75 PolarHBondContact O-N 3.25Å
72	D	89.9	Confident	83.7	Confident	99 Å²	99	108.3 Å²	108.3	53%	0.529	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-38.8	176.8	-72.9	-21.6	0	0	0	111.6	R68 R69 Q75 W76	R68-D72 PolarHBondContact O-N 3Å; R69-D72 PolarHBondContact O-N 3.38Å; D72-Q75 PolarHBondContact O-N 3.29Å; D72-W76 VanDerWaalsContact O-CB 3.3Å; D72-W76 WeakPolarHBondContact O-CB 3.45Å; D72-W76 PolarHBondContact O-N 2.91Å
73	F	87.9	Confident	82.5	Confident	120 Å²	120	110.7 Å²	110.7	53%	0.526	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-44.8	176	178	-111.9	0	0	0	112.6	R69 A70 Q71 Q75 W76 L77	R69-F73 WeakPolarHBondContact O-CB 3.46Å; R69-F73 PolarHBondContact O-N 2.87Å; A70-F73 PolarHBondContact O-N 3.45Å; Q71-F73 VanDerWaalsContact C-N 3.28Å; Q71-F73 PolarHBondContact O-N 2.98Å; F73-Q75 VanDerWaalsContact C-N 3.32Å; F73-Q75 PolarHBondContact O-N 3.12Å; F73-W76 HydrophobicContact CD2-CE3 4.29Å; F73-W76 HydrophobicContact CE2-CE3 4.15Å; F73-W76 HydrophobicContact CE2-CZ3 4.25Å; F73-W76 WeakPolarHBondContact O-CB 2.88Å; F73-W76 PolarHBondContact O-N 3.34Å; F73-L77 HydrophobicContact CD1-CD1 4.03Å; F73-L77 HydrophobicContact CE1-CD1 3.49Å; F73-L77 VanDerWaalsContact CE1-CD1 3.49Å; F73-L77 HydrophobicContact CE1-CG 4.21Å; F73-L77 HydrophobicContact CE2-CD1 4.4Å; F73-L77 HydrophobicContact CE2-CD2 4.5Å; F73-L77 HydrophobicContact CE2-CG 4.27Å; F73-L77 HydrophobicContact CZ-CD1 3.71Å; F73-L77 HydrophobicContact CZ-CD2 4.28Å; F73-L77 HydrophobicContact CZ-CG 4.04Å; F73-L77 WeakPolarHBondContact O-CG 2.98Å; F73-L77 PolarHBondContact O-N 2.61Å
74	V	90.6	Very high	81.3	Confident	80 Å²	80	108.3 Å²	108.3	49%	0.485	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-40.9	176	171.8	0	0	0	0	110.8	A70 Q71 W76 L77 K78	A70-V74 WeakPolarHBondContact O-CG2 3.17Å; A70-V74 PolarHBondContact O-N 3.03Å; Q71-V74 PolarHBondContact O-N 3.41Å; V74-W76 VanDerWaalsContact C-N 3.34Å; V74-L77 PolarHBondContact O-N 3.49Å; V74-K78 HydrophobicContact CG1-CD 4Å; V74-K78 HydrophobicContact CG1-CG 4.49Å; V74-K78 VanDerWaalsContact O-CG 3.3Å; V74-K78 WeakPolarHBondContact O-CG 3.23Å; V74-K78 PolarHBondContact O-N 2.9Å
75	Q	87.4	Confident	79.8	Confident	80 Å²	80	104 Å²	104	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-40.4	176.6	-172	57.4	37.5	0	0	111.4	Q71 D72 F73 K78 N79	Q71-Q75 WeakPolarHBondContact O-CB 3.43Å; Q71-Q75 PolarHBondContact O-N 3.25Å; D72-Q75 PolarHBondContact O-N 3.29Å; F73-Q75 VanDerWaalsContact C-N 3.32Å; F73-Q75 PolarHBondContact O-N 3.12Å; Q75-K78 PolarHBondContact O-N 3.48Å; Q75-N79 PolarHBondContact NE2-ND2 3Å; Q75-N79 PolarHBondContact NE2-OD1 3.5Å; Q75-N79 VanDerWaalsContact NE2-OD1 3.12Å; Q75-N79 WeakPolarHBondContact O-CB 3.43Å; Q75-N79 PolarHBondContact O-N 3.22Å
76	W	86.2	Confident	78.1	Confident	140 Å²	140	106.3 Å²	106.3	53%	0.53	52%	0.522	S	S	.	.	H	α-helix	trans	-59	-49.8	171.1	178.9	84.4	0	0	0	110.8	D72 F73 V74 K78 N79 S80 L86	D72-W76 VanDerWaalsContact O-CB 3.3Å; D72-W76 WeakPolarHBondContact O-CB 3.45Å; D72-W76 PolarHBondContact O-N 2.91Å; F73-W76 HydrophobicContact CD2-CE3 4.29Å; F73-W76 HydrophobicContact CE2-CE3 4.15Å; F73-W76 HydrophobicContact CE2-CZ3 4.25Å; F73-W76 WeakPolarHBondContact O-CB 2.88Å; F73-W76 PolarHBondContact O-N 3.34Å; V74-W76 VanDerWaalsContact C-N 3.34Å; W76-K78 VanDerWaalsContact C-N 3.35Å; W76-K78 PolarHBondContact O-N 3.46Å; W76-N79 PolarHBondContact O-N 2.89Å; W76-S80 WeakPolarHBondContact O-CB 3.03Å; W76-S80 PolarHBondContact O-N 3.27Å; W76-L86 HydrophobicContact CH2-CD2 3.76Å; W76-L86 HydrophobicContact CZ2-CD2 3.8Å
77	L	84.9	Confident	76.3	Confident	78 Å²	78	109.5 Å²	109.5	41%	0.408	53%	0.534	S	S	.	.	H	α-helix	trans	-57.8	-43.9	177.4	-75.7	176.1	0	0	0	112.8	F73 V74 N79 S80 K81	F73-L77 HydrophobicContact CD1-CD1 4.03Å; F73-L77 HydrophobicContact CE1-CD1 3.49Å; F73-L77 VanDerWaalsContact CE1-CD1 3.49Å; F73-L77 HydrophobicContact CE1-CG 4.21Å; F73-L77 HydrophobicContact CE2-CD1 4.4Å; F73-L77 HydrophobicContact CE2-CD2 4.5Å; F73-L77 HydrophobicContact CE2-CG 4.27Å; F73-L77 HydrophobicContact CZ-CD1 3.71Å; F73-L77 HydrophobicContact CZ-CD2 4.28Å; F73-L77 HydrophobicContact CZ-CG 4.04Å; F73-L77 WeakPolarHBondContact O-CG 2.98Å; F73-L77 PolarHBondContact O-N 2.61Å; V74-L77 PolarHBondContact O-N 3.49Å; L77-N79 PolarHBondContact O-N 3.48Å; L77-S80 PolarHBondContact O-N 3.34Å; L77-K81 WeakPolarHBondContact O-CB 3.15Å; L77-K81 PolarHBondContact O-N 2.86Å
78	K	83.9	Confident	74.6	Confident	106 Å²	106	112.4 Å²	112.4	46%	0.461	54%	0.537	S	S	.	.	H	α-helix	trans	-62.5	-42.2	178.4	-74.8	167.2	63.8	-164.4	0	112.2	V74 Q75 W76	V74-K78 HydrophobicContact CG1-CD 4Å; V74-K78 HydrophobicContact CG1-CG 4.49Å; V74-K78 VanDerWaalsContact O-CG 3.3Å; V74-K78 WeakPolarHBondContact O-CG 3.23Å; V74-K78 PolarHBondContact O-N 2.9Å; Q75-K78 PolarHBondContact O-N 3.48Å; W76-K78 VanDerWaalsContact C-N 3.35Å; W76-K78 PolarHBondContact O-N 3.46Å
79	N	74.4	Confident	73	Confident	91 Å²	91	117.4 Å²	117.4	49%	0.487	56%	0.556	S	S	.	*	H	α-helix	trans	-73.8	-37.7	178.8	-72.3	-6.6	0	0	0	111.4	Q75 W76 L77 R82 N83	Q75-N79 PolarHBondContact NE2-ND2 3Å; Q75-N79 PolarHBondContact NE2-OD1 3.5Å; Q75-N79 VanDerWaalsContact NE2-OD1 3.12Å; Q75-N79 WeakPolarHBondContact O-CB 3.43Å; Q75-N79 PolarHBondContact O-N 3.22Å; W76-N79 PolarHBondContact O-N 2.89Å; L77-N79 PolarHBondContact O-N 3.48Å; N79-R82 PolarHBondContact O-N 3.38Å; N79-N83 WeakPolarHBondContact O-CB 3.35Å; N79-N83 PolarHBondContact O-N 2.87Å
80	S	68.4	Low	71.4	Confident	15 Å²	15	113.5 Å²	113.5	11%	0.105	55%	0.545	C	S	.	.	H	α-helix	trans	-67.1	-39.1	179.7	-166	0	0	0	0	112.5	W76 L77 R82 N83 L86	W76-S80 WeakPolarHBondContact O-CB 3.03Å; W76-S80 PolarHBondContact O-N 3.27Å; L77-S80 PolarHBondContact O-N 3.34Å; S80-R82 PolarHBondContact O-N 3.41Å; S80-N83 PolarHBondContact O-N 3.36Å; S80-L86 VanDerWaalsContact OG-CD1 3.31Å; S80-L86 WeakPolarHBondContact OG-CD1 3.3Å; S80-L86 WeakPolarHBondContact OG-CD2 3.43Å; S80-L86 WeakPolarHBondContact OG-CG 3.36Å
81	K	63.6	Low	69.7	Low	185 Å²	185	114.1 Å²	114.1	80%	0.804	55%	0.551	S	S	*	*	H	α-helix	trans	-64	-35.7	173	-171.9	-177.6	179.5	-174.2	0	113	L77	L77-K81 WeakPolarHBondContact O-CB 3.15Å; L77-K81 PolarHBondContact O-N 2.86Å
82	R	60.8	Low	67.8	Low	216 Å²	216	111.9 Å²	111.9	82%	0.815	54%	0.543	S	S	*	.	H	α-helix	trans	-78.9	-28.4	177.6	-83.8	-171.9	167.6	94.2	-2.5	113.3	N79 S80 G84	N79-R82 PolarHBondContact O-N 3.38Å; S80-R82 PolarHBondContact O-N 3.41Å; R82-G84 VanDerWaalsContact C-N 3.31Å; R82-G84 PolarHBondContact O-N 2.91Å
83	N	56	Low	66.4	Low	118 Å²	118	111.1 Å²	111.1	63%	0.631	56%	0.558	S	S	*	*	H	α-helix	trans	-82.2	-6.7	-177.1	-154.3	20.7	0	0	0	113.5	N79 S80 S85	N79-N83 WeakPolarHBondContact O-CB 3.35Å; N79-N83 PolarHBondContact O-N 2.87Å; S80-N83 PolarHBondContact O-N 3.36Å; N83-S85 PolarHBondContact ND2-OG 2.88Å; N83-S85 VanDerWaalsContact O-CB 3.23Å; N83-S85 WeakPolarHBondContact O-CB 3.43Å; N83-S85 PolarHBondContact O-N 2.95Å; N83-S85 PolarHBondContact O-OG 2.8Å; N83-S85 VanDerWaalsContact O-OG 3.1Å
84	G	55.2	Low	65.1	Low	75 Å²	75	108.8 Å²	108.8	77%	0.773	55%	0.554	S	S	*	*			trans	57.7	-1.3	173	0	0	0	0	0	116.1	R82	R82-G84 VanDerWaalsContact C-N 3.31Å; R82-G84 PolarHBondContact O-N 2.91Å
85	S	55.9	Low	63.5	Low	39 Å²	39	114.5 Å²	114.5	27%	0.273	57%	0.568	S	S	.	*			trans	-118.9	31.7	-163.7	67.7	0	0	0	0	110.8	N83 F87 R88	N83-S85 PolarHBondContact ND2-OG 2.88Å; N83-S85 VanDerWaalsContact O-CB 3.23Å; N83-S85 WeakPolarHBondContact O-CB 3.43Å; N83-S85 PolarHBondContact O-N 2.95Å; N83-S85 PolarHBondContact O-OG 2.8Å; N83-S85 VanDerWaalsContact O-OG 3.1Å; S85-F87 PolarHBondContact O-N 2.77Å; S85-R88 WeakPolarHBondContact O-CA 3.36Å; S85-R88 WeakPolarHBondContact O-CB 3.39Å; S85-R88 PolarHBondContact O-N 2.79Å
86	L	52.8	Low	62.5	Low	97 Å²	97	115.3 Å²	115.3	51%	0.508	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.7	-16.4	167.6	-91.5	171.3	0	0	0	113.3	W76 S80	W76-L86 HydrophobicContact CH2-CD2 3.76Å; W76-L86 HydrophobicContact CZ2-CD2 3.8Å; S80-L86 VanDerWaalsContact OG-CD1 3.31Å; S80-L86 WeakPolarHBondContact OG-CD1 3.3Å; S80-L86 WeakPolarHBondContact OG-CD2 3.43Å; S80-L86 WeakPolarHBondContact OG-CG 3.36Å
87	F	49.3	Very low	61.6	Low	206 Å²	206	109.3 Å²	109.3	90%	0.904	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-11.7	168.9	-106	-84.7	0	0	0	114.8	S85 R89	S85-F87 PolarHBondContact O-N 2.77Å; F87-R89 VanDerWaalsContact C-N 3.34Å; F87-R89 PolarHBondContact O-N 2.93Å
88	R	53.6	Low	61.1	Low	129 Å²	129	111.2 Å²	111.2	49%	0.487	57%	0.568	S	S	.	*			trans	-95	66.3	177.3	-140.9	175.2	-153.6	-114.2	1.1	109.6	S85 H90 D92	S85-R88 WeakPolarHBondContact O-CA 3.36Å; S85-R88 WeakPolarHBondContact O-CB 3.39Å; S85-R88 PolarHBondContact O-N 2.79Å; R88-H90 HydrophobicContact CG-CB 4.18Å; R88-H90 VanDerWaalsContact CG-CD2 3.44Å; R88-H90 WeakPolarHBondContact CG-CD2 3.3Å; R88-H90 PolarHBondContact O-N 3.09Å; R88-D92 WeakPolarHBondContact CD-OD2 3.37Å; R88-D92 IonicContact CZ-OD1 3.71Å; R88-D92 IonicContact CZ-OD2 3.64Å; R88-D92 IonicContact NE-OD2 3.85Å; R88-D92 IonicContact NH1-OD1 2.9Å; R88-D92 PolarHBondContact NH1-OD1 3.06Å; R88-D92 IonicContact NH1-OD2 2.75Å; R88-D92 PolarHBondContact NH1-OD2 3.08Å
89	R	58.3	Low	60.8	Low	236 Å²	236	109 Å²	109	89%	0.891	56%	0.563	S	S	*	*			trans	-73.7	39.5	159.8	-62.5	-172.7	-176.2	-144.7	3.1	110.8	F87	F87-R89 VanDerWaalsContact C-N 3.34Å; F87-R89 PolarHBondContact O-N 2.93Å
90	H	54.7	Low	61	Low	98 Å²	98	107.1 Å²	107.1	45%	0.454	56%	0.558	S	S	.	*			trans	-90.3	130.4	172.9	-65	-54.5	0	0	0	107.1	R88 D92	R88-H90 HydrophobicContact CG-CB 4.18Å; R88-H90 VanDerWaalsContact CG-CD2 3.44Å; R88-H90 WeakPolarHBondContact CG-CD2 3.3Å; R88-H90 PolarHBondContact O-N 3.09Å; H90-D92 WeakPolarHBondContact CB-OD1 3.42Å; H90-D92 PolarHBondContact O-N 3.26Å
91	A	56	Low	61.6	Low	66 Å²	66	108.7 Å²	108.7	55%	0.545	57%	0.568	S	S	.	*			trans	-69	72.4	168.1	0	0	0	0	0	107.8	G93 T94	A91-G93 PolarHBondContact O-N 2.75Å; A91-T94 WeakPolarHBondContact CB-OG1 3.3Å; A91-T94 PolarHBondContact O-N 3.4Å; A91-T94 VanDerWaalsContact O-N 3.09Å; A91-T94 PolarHBondContact O-OG1 3.48Å
92	D	54.7	Low	62.6	Low	76 Å²	76	107 Å²	107	41%	0.406	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	15.1	-169.4	-75.5	-30.3	0	0	0	114.2	R88 H90	R88-D92 WeakPolarHBondContact CD-OD2 3.37Å; R88-D92 IonicContact CZ-OD1 3.71Å; R88-D92 IonicContact CZ-OD2 3.64Å; R88-D92 IonicContact NE-OD2 3.85Å; R88-D92 IonicContact NH1-OD1 2.9Å; R88-D92 PolarHBondContact NH1-OD1 3.06Å; R88-D92 IonicContact NH1-OD2 2.75Å; R88-D92 PolarHBondContact NH1-OD2 3.08Å; H90-D92 WeakPolarHBondContact CB-OD1 3.42Å; H90-D92 PolarHBondContact O-N 3.26Å
93	G	60.2	Low	63.9	Low	82 Å²	82	101.6 Å²	101.6	85%	0.845	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	10.2	175.2	0	0	0	0	0	113.5	A91	A91-G93 PolarHBondContact O-N 2.75Å
94	T	60.5	Low	65.2	Low	72 Å²	72	101.9 Å²	101.9	44%	0.442	54%	0.543	S	S	.	.	S	Bend	trans	-105.2	144.7	174.9	7.9	0	0	0	0	108.8	A91 T96 S97	A91-T94 WeakPolarHBondContact CB-OG1 3.3Å; A91-T94 PolarHBondContact O-N 3.4Å; A91-T94 VanDerWaalsContact O-N 3.09Å; A91-T94 PolarHBondContact O-OG1 3.48Å; T94-T96 PolarHBondContact O-N 2.99Å; T94-S97 PolarHBondContact O-N 3.02Å; T94-S97 PolarHBondContact O-OG 3.23Å
95	Y	56.6	Low	66.8	Low	200 Å²	200	103.1 Å²	103.1	78%	0.784	53%	0.531	S	S	*	.	H	α-helix	trans	-43.1	-29	178.2	177.4	-101.1	0	0	0	114.7	S97 V99	Y95-S97 VanDerWaalsContact C-N 3.34Å; Y95-S97 PolarHBondContact O-N 2.83Å; Y95-V99 HydrophobicContact CE1-CG2 4.1Å
96	T	66.3	Low	68.5	Low	96 Å²	96	104.7 Å²	104.7	59%	0.589	53%	0.534	S	S	*	.	H	α-helix	trans	-68.8	-21.5	177.3	59.8	0	0	0	0	115	T94 S100	T94-T96 PolarHBondContact O-N 2.99Å; T96-S100 VanDerWaalsContact O-CB 3.23Å; T96-S100 WeakPolarHBondContact O-CB 3.4Å; T96-S100 PolarHBondContact O-N 3.31Å
97	S	67.7	Low	70.2	Confident	15 Å²	15	102.9 Å²	102.9	11%	0.105	53%	0.533	C	S	.	.	H	α-helix	trans	-72.1	-44.2	-179.3	59.8	0	0	0	0	112.5	T94 Y95 S100 S101	T94-S97 PolarHBondContact O-N 3.02Å; T94-S97 PolarHBondContact O-OG 3.23Å; Y95-S97 VanDerWaalsContact C-N 3.34Å; Y95-S97 PolarHBondContact O-N 2.83Å; S97-S100 PolarHBondContact O-N 3.48Å; S97-S101 PolarHBondContact O-N 3.48Å; S97-S101 PolarHBondContact O-OG 2.94Å
98	D	73.6	Confident	72.2	Confident	117 Å²	117	95.5 Å²	95.5	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-71.1	-34.8	-178.4	-63.2	-19.3	0	0	0	111.3	S101 Y102	D98-S101 PolarHBondContact O-OG 3.22Å; D98-Y102 WeakPolarHBondContact O-CB 3.46Å; D98-Y102 PolarHBondContact O-N 3.33Å; D98-Y102 VanDerWaalsContact O-N 3.11Å
99	V	78.5	Confident	74.1	Confident	59 Å²	59	95.4 Å²	95.4	36%	0.358	51%	0.514	S	S	.	.	H	α-helix	trans	-67.7	-41.9	172	179	0	0	0	0	110.5	Y95 S101 Y102 L103	Y95-V99 HydrophobicContact CE1-CG2 4.1Å; V99-S101 PolarHBondContact O-N 3.15Å; V99-Y102 PolarHBondContact O-N 3.44Å; V99-L103 HydrophobicContact CG1-CD1 3.99Å; V99-L103 HydrophobicContact CG1-CG 4.33Å; V99-L103 WeakPolarHBondContact O-CB 3.49Å; V99-L103 VanDerWaalsContact O-CG 3.25Å; V99-L103 WeakPolarHBondContact O-CG 3.5Å; V99-L103 PolarHBondContact O-N 2.89Å
100	S	79.3	Confident	75.5	Confident	53 Å²	53	89.7 Å²	89.7	37%	0.371	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-40	178.1	-172.5	0	0	0	0	112.4	T96 S97 Q104	T96-S100 VanDerWaalsContact O-CB 3.23Å; T96-S100 WeakPolarHBondContact O-CB 3.4Å; T96-S100 PolarHBondContact O-N 3.31Å; S97-S100 PolarHBondContact O-N 3.48Å; S100-Q104 WeakPolarHBondContact O-CB 3.27Å; S100-Q104 PolarHBondContact O-N 2.89Å
101	S	80.3	Confident	77.1	Confident	47 Å²	47	90.5 Å²	90.5	33%	0.329	50%	0.5	S	S	.	.	H	α-helix	trans	-67.6	-43.2	177.5	64.2	0	0	0	0	111.5	S97 D98 V99 L103 Q104 D105	S97-S101 PolarHBondContact O-N 3.48Å; S97-S101 PolarHBondContact O-OG 2.94Å; D98-S101 PolarHBondContact O-OG 3.22Å; V99-S101 PolarHBondContact O-N 3.15Å; S101-L103 PolarHBondContact O-N 2.95Å; S101-Q104 PolarHBondContact O-N 3.32Å; S101-D105 PolarHBondContact O-N 3.12Å
102	Y	84.4	Confident	78.7	Confident	149 Å²	149	90.6 Å²	90.6	58%	0.584	49%	0.493	S	S	*	.	H	α-helix	trans	-59.9	-44.7	174.6	176.7	-99.9	0	0	0	112.4	D98 V99 Q104 D105 Q106	D98-Y102 WeakPolarHBondContact O-CB 3.46Å; D98-Y102 PolarHBondContact O-N 3.33Å; D98-Y102 VanDerWaalsContact O-N 3.11Å; V99-Y102 PolarHBondContact O-N 3.44Å; Y102-Q104 VanDerWaalsContact C-N 3.31Å; Y102-Q104 PolarHBondContact O-N 3.33Å; Y102-D105 PolarHBondContact O-N 2.69Å; Y102-Q106 WeakPolarHBondContact O-CB 3.45Å; Y102-Q106 PolarHBondContact O-N 3.06Å
103	L	87.4	Confident	80.3	Confident	104 Å²	104	89.8 Å²	89.8	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-36.7	177	-72.4	175.3	0	0	0	112	V99 S101 Q106 A107	V99-L103 HydrophobicContact CG1-CD1 3.99Å; V99-L103 HydrophobicContact CG1-CG 4.33Å; V99-L103 WeakPolarHBondContact O-CB 3.49Å; V99-L103 VanDerWaalsContact O-CG 3.25Å; V99-L103 WeakPolarHBondContact O-CG 3.5Å; V99-L103 PolarHBondContact O-N 2.89Å; S101-L103 PolarHBondContact O-N 2.95Å; L103-Q106 PolarHBondContact O-N 3.44Å; L103-A107 WeakPolarHBondContact O-CB 3.46Å; L103-A107 PolarHBondContact O-N 3.28Å
104	Q	84.9	Confident	81.6	Confident	124 Å²	124	91.1 Å²	91.1	58%	0.579	47%	0.473	S	S	*	.	H	α-helix	trans	-67.7	-42.1	176.8	-169.8	169.7	13.6	0	0	111.8	S100 S101 Y102 Q106 A107 A108	S100-Q104 WeakPolarHBondContact O-CB 3.27Å; S100-Q104 PolarHBondContact O-N 2.89Å; S101-Q104 PolarHBondContact O-N 3.32Å; Y102-Q104 VanDerWaalsContact C-N 3.31Å; Y102-Q104 PolarHBondContact O-N 3.33Å; Q104-Q106 VanDerWaalsContact C-N 3.32Å; Q104-Q106 PolarHBondContact O-N 3.22Å; Q104-A107 PolarHBondContact O-N 3.3Å; Q104-A108 WeakPolarHBondContact O-CB 3.36Å; Q104-A108 PolarHBondContact O-N 3.44Å
105	D	87.8	Confident	82.9	Confident	100 Å²	100	92.1 Å²	92.1	54%	0.535	48%	0.475	S	S	.	.	H	α-helix	trans	-62.5	-40.1	173.4	-93.6	20.2	0	0	0	111.8	S101 Y102 A108 K109	S101-D105 PolarHBondContact O-N 3.12Å; Y102-D105 PolarHBondContact O-N 2.69Å; D105-A108 PolarHBondContact O-N 3.05Å; D105-K109 WeakPolarHBondContact O-CG 3.46Å; D105-K109 PolarHBondContact O-N 3.39Å; D105-K109 VanDerWaalsContact O-N 3.07Å
106	Q	91.1	Very high	84.2	Confident	72 Å²	72	90.9 Å²	90.9	34%	0.336	47%	0.474	S	S	.	.	H	α-helix	trans	-65.2	-44.3	175.4	-167.5	65.3	4.7	0	0	111.2	Y102 L103 Q104 A108 K109 E110	Y102-Q106 WeakPolarHBondContact O-CB 3.45Å; Y102-Q106 PolarHBondContact O-N 3.06Å; L103-Q106 PolarHBondContact O-N 3.44Å; Q104-Q106 VanDerWaalsContact C-N 3.32Å; Q104-Q106 PolarHBondContact O-N 3.22Å; Q106-A108 VanDerWaalsContact C-N 3.32Å; Q106-A108 PolarHBondContact O-N 3.34Å; Q106-K109 PolarHBondContact O-N 3.08Å; Q106-E110 WeakPolarHBondContact O-CG 3.32Å; Q106-E110 PolarHBondContact O-N 3.01Å
107	A	88.8	Confident	85	Confident	59 Å²	59	91 Å²	91	49%	0.488	48%	0.475	S	S	.	.	H	α-helix	trans	-61.7	-38.6	175.9	0	0	0	0	0	112.3	L103 Q104 E110 F111	L103-A107 WeakPolarHBondContact O-CB 3.46Å; L103-A107 PolarHBondContact O-N 3.28Å; Q104-A107 PolarHBondContact O-N 3.3Å; A107-E110 PolarHBondContact O-N 3.36Å; A107-F111 VanDerWaalsContact O-CB 3.3Å; A107-F111 WeakPolarHBondContact O-CB 3.45Å; A107-F111 PolarHBondContact O-N 3.13Å
108	A	91.8	Very high	85.1	Confident	52 Å²	52	91.8 Å²	91.8	43%	0.43	49%	0.485	S	S	.	.	H	α-helix	trans	-64.8	-41.5	175.8	0	0	0	0	0	112.1	Q104 D105 Q106 F111 V112	Q104-A108 WeakPolarHBondContact O-CB 3.36Å; Q104-A108 PolarHBondContact O-N 3.44Å; D105-A108 PolarHBondContact O-N 3.05Å; Q106-A108 VanDerWaalsContact C-N 3.32Å; Q106-A108 PolarHBondContact O-N 3.34Å; A108-F111 PolarHBondContact O-N 2.94Å; A108-V112 WeakPolarHBondContact O-CG2 3.37Å; A108-V112 PolarHBondContact O-N 3.01Å
109	K	92.4	Very high	84.6	Confident	127 Å²	127	95.4 Å²	95.4	55%	0.552	49%	0.49	S	S	*	.	H	α-helix	trans	-63.8	-45.2	175.6	-71.8	169.9	-173.9	168.7	0	111.9	D105 Q106 F111 V112 S113	D105-K109 WeakPolarHBondContact O-CG 3.46Å; D105-K109 PolarHBondContact O-N 3.39Å; D105-K109 VanDerWaalsContact O-N 3.07Å; Q106-K109 PolarHBondContact O-N 3.08Å; K109-F111 VanDerWaalsContact C-N 3.32Å; K109-F111 PolarHBondContact O-N 3.4Å; K109-V112 PolarHBondContact O-N 3.31Å; K109-S113 WeakPolarHBondContact O-CB 3.43Å; K109-S113 PolarHBondContact O-N 3.35Å
110	E	88.3	Confident	83.7	Confident	115 Å²	115	95.1 Å²	95.1	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-41.9	175.5	-71.2	-60.4	150.2	0	0	111.4	Q106 A107 V112 S113 W114	Q106-E110 WeakPolarHBondContact O-CG 3.32Å; Q106-E110 PolarHBondContact O-N 3.01Å; A107-E110 PolarHBondContact O-N 3.36Å; E110-V112 PolarHBondContact O-N 3.11Å; E110-S113 WeakPolarHBondContact O-CB 3.49Å; E110-S113 PolarHBondContact O-N 3.4Å; E110-W114 VanDerWaalsContact O-CB 3.29Å; E110-W114 WeakPolarHBondContact O-CB 3.23Å; E110-W114 PolarHBondContact O-N 3.29Å
111	F	88.4	Confident	82.7	Confident	116 Å²	116	103.6 Å²	103.6	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-61.5	-43.4	175.9	179.8	-109.7	0	0	0	112.3	A107 A108 K109 W114 L115	A107-F111 VanDerWaalsContact O-CB 3.3Å; A107-F111 WeakPolarHBondContact O-CB 3.45Å; A107-F111 PolarHBondContact O-N 3.13Å; A108-F111 PolarHBondContact O-N 2.94Å; K109-F111 VanDerWaalsContact C-N 3.32Å; K109-F111 PolarHBondContact O-N 3.4Å; F111-W114 HydrophobicContact CD2-CE3 4.22Å; F111-W114 HydrophobicContact CE2-CE3 4.1Å; F111-W114 HydrophobicContact CE2-CZ3 4.09Å; F111-W114 WeakPolarHBondContact O-CB 3.46Å; F111-W114 PolarHBondContact O-N 3.43Å; F111-L115 HydrophobicContact CD1-CD1 4.03Å; F111-L115 HydrophobicContact CE1-CD1 3.56Å; F111-L115 HydrophobicContact CE1-CG 4.24Å; F111-L115 HydrophobicContact CZ-CD1 3.91Å; F111-L115 HydrophobicContact CZ-CD2 4.39Å; F111-L115 HydrophobicContact CZ-CG 4.2Å; F111-L115 WeakPolarHBondContact O-CG 3.48Å; F111-L115 PolarHBondContact O-N 3.07Å
112	V	90.3	Very high	81.7	Confident	68 Å²	68	111.1 Å²	111.1	41%	0.412	54%	0.544	S	S	.	.	H	α-helix	trans	-66.9	-39.9	175.7	172.6	0	0	0	0	111.5	A108 K109 E110 W114 L115 K116	A108-V112 WeakPolarHBondContact O-CG2 3.37Å; A108-V112 PolarHBondContact O-N 3.01Å; K109-V112 PolarHBondContact O-N 3.31Å; E110-V112 PolarHBondContact O-N 3.11Å; V112-W114 VanDerWaalsContact C-N 3.32Å; V112-L115 PolarHBondContact O-N 3.48Å; V112-K116 HydrophobicContact CG1-CD 4.24Å; V112-K116 WeakPolarHBondContact O-CB 3.26Å; V112-K116 WeakPolarHBondContact O-CG 3.38Å; V112-K116 PolarHBondContact O-N 3.03Å
113	S	88.8	Confident	80.2	Confident	59 Å²	59	115.7 Å²	115.7	41%	0.413	58%	0.578	S	S	.	*	H	α-helix	trans	-60.3	-44.1	173.9	-175.4	0	0	0	0	111.3	K109 E110 K116 T117	K109-S113 WeakPolarHBondContact O-CB 3.43Å; K109-S113 PolarHBondContact O-N 3.35Å; E110-S113 WeakPolarHBondContact O-CB 3.49Å; E110-S113 PolarHBondContact O-N 3.4Å; S113-K116 PolarHBondContact O-N 3.43Å; S113-T117 WeakPolarHBondContact O-CB 3.5Å; S113-T117 PolarHBondContact O-N 3.28Å; S113-T117 PolarHBondContact O-OG1 3.26Å
114	W	87.3	Confident	79.9	Confident	109 Å²	109	116.3 Å²	116.3	41%	0.413	58%	0.58	S	S	.	*	H	α-helix	trans	-61.5	-44.3	175.6	176.3	88.6	0	0	0	112.2	E110 F111 V112 T117 G118	E110-W114 VanDerWaalsContact O-CB 3.29Å; E110-W114 WeakPolarHBondContact O-CB 3.23Å; E110-W114 PolarHBondContact O-N 3.29Å; F111-W114 HydrophobicContact CD2-CE3 4.22Å; F111-W114 HydrophobicContact CE2-CE3 4.1Å; F111-W114 HydrophobicContact CE2-CZ3 4.09Å; F111-W114 WeakPolarHBondContact O-CB 3.46Å; F111-W114 PolarHBondContact O-N 3.43Å; V112-W114 VanDerWaalsContact C-N 3.32Å; W114-T117 PolarHBondContact O-N 3.17Å; W114-G118 PolarHBondContact O-N 3.28Å
115	L	86.8	Confident	79.6	Confident	93 Å²	93	115.8 Å²	115.8	49%	0.487	58%	0.58	S	S	.	*	H	α-helix	trans	-60.5	-45.8	174	-76	175.9	0	0	0	111.9	F111 V112 T117 G118	F111-L115 HydrophobicContact CD1-CD1 4.03Å; F111-L115 HydrophobicContact CE1-CD1 3.56Å; F111-L115 HydrophobicContact CE1-CG 4.24Å; F111-L115 HydrophobicContact CZ-CD1 3.91Å; F111-L115 HydrophobicContact CZ-CD2 4.39Å; F111-L115 HydrophobicContact CZ-CG 4.2Å; F111-L115 WeakPolarHBondContact O-CG 3.48Å; F111-L115 PolarHBondContact O-N 3.07Å; V112-L115 PolarHBondContact O-N 3.48Å; L115-T117 VanDerWaalsContact C-N 3.29Å; L115-T117 PolarHBondContact O-N 3.04Å; L115-G118 PolarHBondContact O-N 3.47Å; L115-G118 VanDerWaalsContact O-N 3.08Å
116	K	84.8	Confident	79.1	Confident	174 Å²	174	116.7 Å²	116.7	76%	0.757	58%	0.583	S	S	*	*	H	α-helix	trans	-63.9	-34.6	177.8	-75.1	177.2	177.2	-176.9	0	112.6	V112 S113 G118	V112-K116 HydrophobicContact CG1-CD 4.24Å; V112-K116 WeakPolarHBondContact O-CB 3.26Å; V112-K116 WeakPolarHBondContact O-CG 3.38Å; V112-K116 PolarHBondContact O-N 3.03Å; S113-K116 PolarHBondContact O-N 3.43Å; K116-G118 PolarHBondContact O-N 3.07Å
117	T	83.1	Confident	78.4	Confident	98 Å²	98	119.4 Å²	119.4	60%	0.601	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-3.9	177.3	-51.2	0	0	0	0	111.9	S113 W114 L115 R119	S113-T117 WeakPolarHBondContact O-CB 3.5Å; S113-T117 PolarHBondContact O-N 3.28Å; S113-T117 PolarHBondContact O-OG1 3.26Å; W114-T117 PolarHBondContact O-N 3.17Å; L115-T117 VanDerWaalsContact C-N 3.29Å; L115-T117 PolarHBondContact O-N 3.04Å; T117-R119 PolarHBondContact O-N 3.11Å
118	G	69.3	Low	77.8	Confident	32 Å²	32	123.1 Å²	123.1	33%	0.33	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	66.6	19.1	171.2	0	0	0	0	0	114.1	W114 L115 K116 G120 R121	W114-G118 PolarHBondContact O-N 3.28Å; L115-G118 PolarHBondContact O-N 3.47Å; L115-G118 VanDerWaalsContact O-N 3.08Å; K116-G118 PolarHBondContact O-N 3.07Å; G118-G120 PolarHBondContact O-N 3.12Å; G118-R121 PolarHBondContact O-N 3.48Å
119	R	62.6	Low	76.9	Confident	194 Å²	194	127.9 Å²	127.9	73%	0.732	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-10.4	-173.2	-165	167.2	-178.2	159.7	-0	113.6	T117	T117-R119 PolarHBondContact O-N 3.11Å
120	G	60.2	Low	75.8	Confident	52 Å²	52	127.9 Å²	127.9	54%	0.536	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.6	8.1	175.2	0	0	0	0	0	115.9	G118	G118-G120 PolarHBondContact O-N 3.12Å
121	R	59.2	Low	74.8	Confident	231 Å²	231	128.9 Å²	128.9	87%	0.872	63%	0.626	S	S	*	*	S	Bend	trans	-118.6	14.5	179.7	-76.9	-167	177.5	179.4	0.3	114.4	G118	G118-R121 PolarHBondContact O-N 3.48Å
122	R	58.3	Low	73.7	Confident	206 Å²	206	130 Å²	130	78%	0.777	64%	0.636	S	S	*	*			trans	-119.2	83	175.3	-69.7	-174.9	-176.1	130.4	0.2	108.9
123	D	53.4	Low	72.2	Confident	244 Å²	244	135.6 Å²	135.6	100%	1.305	66%	0.657	S	S	*	*			trans	-141.8	0	139	-72.5	-43.9	0	0	0	106.5

Retrieved 123 of 123 residues in 290 ms (Link to these results)

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