A0A087WZQ9_HUMAN Loading...

Myosin XIX

AlphaFold DB , UniProt , Accession A0A087WZQ9, Species HUMAN (Homo sapiens, Human), Gene MYO19, Length 162 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.1	Very low	42.6	Very low	249 Å²	249	152.5 Å²	152.5	100%	1.227	85%	0.845	S	S	*	*				0	89	0	-142.7	176.6	-155.3	0	0	106.6
2	L	36.5	Very low	43.5	Very low	178 Å²	178	146.3 Å²	146.3	93%	0.932	82%	0.821	S	S	*	*			trans	-118.8	108.6	179.3	-85.1	160.2	0	0	0	106.2
3	Q	39.8	Very low	44.5	Very low	191 Å²	191	143.1 Å²	143.1	89%	0.893	80%	0.8	S	S	*	*			trans	-98.5	109.9	174	-155.1	166.9	19	0	0	107.3
4	Q	41.8	Very low	45.4	Very low	184 Å²	184	135.8 Å²	135.8	86%	0.86	77%	0.773	S	S	*	*			trans	-68.6	131	169.8	-72.9	-169.2	-17.6	0	0	109.2
5	V	43.9	Very low	46.3	Very low	138 Å²	138	134.8 Å²	134.8	84%	0.836	76%	0.759	S	S	*	*			trans	-105.4	103.9	166.5	-172.5	0	0	0	0	106.3
6	N	46	Very low	47.3	Very low	164 Å²	164	129.6 Å²	129.6	88%	0.877	74%	0.738	S	S	*	*			trans	-144.3	113.8	165.5	-109.3	-7.2	0	0	0	108.8
7	G	38.6	Very low	48.2	Very low	74 Å²	74	132.2 Å²	132.2	76%	0.763	73%	0.734	S	S	*	*			trans	-157.3	57	178	0	0	0	0	0	110.2
8	H	45.9	Very low	49.3	Very low	196 Å²	196	132.1 Å²	132.1	91%	0.907	73%	0.726	S	S	*	*			trans	-78.3	115.6	158.5	-120.5	70.9	0	0	0	106.5	P10	H8-P10 VanDerWaalsContact O-CD 3.3Å; H8-P10 WeakPolarHBondContact O-CD 3.41Å
9	N	45.8	Very low	50.1	Low	135 Å²	135	132.3 Å²	132.3	72%	0.722	72%	0.716	S	S	*	*			trans	-97.7	104.8	-177	-156	6.5	0	0	0	108.5	G11	N9-G11 PolarHBondContact O-N 3.19Å
10	P	44.1	Very low	51	Low	119 Å²	119	129.8 Å²	129.8	77%	0.773	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	4	-176	32.9	-33.6	0	0	0	113.3	H8	H8-P10 VanDerWaalsContact O-CD 3.3Å; H8-P10 WeakPolarHBondContact O-CD 3.41Å
11	G	47.5	Very low	52	Low	49 Å²	49	132.5 Å²	132.5	51%	0.505	70%	0.702	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.2	-17.2	-171.5	0	0	0	0	0	116.6	N9	N9-G11 PolarHBondContact O-N 3.19Å
12	S	52.7	Low	53.5	Low	79 Å²	79	126.1 Å²	126.1	55%	0.552	67%	0.669	S	S	*	*	H	α-helix	trans	-81.2	-27.2	-177.2	61.4	0	0	0	0	113.8	A16	S12-A16 PolarHBondContact O-N 2.69Å
13	D	56.4	Low	55	Low	104 Å²	104	121.3 Å²	121.3	56%	0.556	65%	0.645	S	S	*	*	H	α-helix	trans	-74.8	-29.5	-176.5	-92.5	10.9	0	0	0	113.1	R17	D13-R17 WeakPolarHBondContact O-CB 3.33Å; D13-R17 WeakPolarHBondContact O-CD 3.28Å; D13-R17 WeakPolarHBondContact O-CG 3.41Å; D13-R17 PolarHBondContact O-N 3.3Å
14	G	57.8	Low	56.4	Low	41 Å²	41	113.4 Å²	113.4	42%	0.423	61%	0.608	S	S	.	*	H	α-helix	trans	-70.8	-46.1	-180	0	0	0	0	0	112.4	R17 E18	G14-R17 PolarHBondContact O-N 2.83Å; G14-E18 PolarHBondContact O-N 3.31Å
15	Q	58.7	Low	57.8	Low	121 Å²	121	111.8 Å²	111.8	57%	0.565	60%	0.601	S	S	*	*	H	α-helix	trans	-69.3	-43.2	-176.6	-134.3	172.7	0.4	0	0	111.8	R17 E18 Y19	Q15-R17 VanDerWaalsContact C-N 3.27Å; Q15-R17 PolarHBondContact O-N 3.39Å; Q15-E18 PolarHBondContact O-N 2.78Å; Q15-Y19 HydrophobicContact CG-CE2 3.99Å; Q15-Y19 WeakPolarHBondContact O-CD2 3.42Å; Q15-Y19 PolarHBondContact O-N 3.12Å; Q15-Y19 VanDerWaalsContact O-N 3.14Å
16	A	61.8	Low	59.2	Low	51 Å²	51	112.3 Å²	112.3	42%	0.421	59%	0.594	S	S	.	*	H	α-helix	trans	-61.8	-33.8	176.1	0	0	0	0	0	112.8	S12 L20	S12-A16 PolarHBondContact O-N 2.69Å; A16-L20 WeakPolarHBondContact O-CB 3.43Å; A16-L20 WeakPolarHBondContact O-CD1 3.32Å; A16-L20 VanDerWaalsContact O-CG 3.25Å; A16-L20 WeakPolarHBondContact O-CG 2.91Å; A16-L20 PolarHBondContact O-N 3.15Å; A16-L20 VanDerWaalsContact O-N 3.1Å
17	R	62.5	Low	60.4	Low	175 Å²	175	106 Å²	106	66%	0.66	56%	0.559	S	S	*	*	H	α-helix	trans	-72.4	-32.2	177	-77.7	177.3	177.8	-175.1	2.3	113.4	D13 G14 Q15 R21	D13-R17 WeakPolarHBondContact O-CB 3.33Å; D13-R17 WeakPolarHBondContact O-CD 3.28Å; D13-R17 WeakPolarHBondContact O-CG 3.41Å; D13-R17 PolarHBondContact O-N 3.3Å; G14-R17 PolarHBondContact O-N 2.83Å; Q15-R17 VanDerWaalsContact C-N 3.27Å; Q15-R17 PolarHBondContact O-N 3.39Å; R17-R21 PolarHBondContact O-N 2.73Å
18	E	68.5	Low	61.8	Low	129 Å²	129	105.2 Å²	105.2	60%	0.603	54%	0.537	S	S	*	.	H	α-helix	trans	-70.6	-47.1	174.2	-76.6	-171.7	155.4	0	0	111.3	G14 Q15 L20 R21 E22	G14-E18 PolarHBondContact O-N 3.31Å; Q15-E18 PolarHBondContact O-N 2.78Å; E18-L20 PolarHBondContact O-N 3.28Å; E18-R21 WeakPolarHBondContact O-CA 3.17Å; E18-R21 WeakPolarHBondContact O-CB 3.45Å; E18-R21 PolarHBondContact O-N 3.16Å; E18-E22 PolarHBondContact O-N 2.62Å
19	Y	65.4	Low	62.6	Low	137 Å²	137	98.8 Å²	98.8	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-57.6	-45.4	175	-74.8	-66.7	0	0	0	112.7	Q15 R21 E22 D23	Q15-Y19 HydrophobicContact CG-CE2 3.99Å; Q15-Y19 WeakPolarHBondContact O-CD2 3.42Å; Q15-Y19 PolarHBondContact O-N 3.12Å; Q15-Y19 VanDerWaalsContact O-N 3.14Å; Y19-R21 VanDerWaalsContact C-N 3.26Å; Y19-R21 PolarHBondContact O-N 3.06Å; Y19-E22 PolarHBondContact O-N 2.9Å; Y19-D23 PolarHBondContact O-N 3.44Å
20	L	67.4	Low	63.5	Low	82 Å²	82	94 Å²	94	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-60.6	-35.9	175.4	-75.5	168	0	0	0	112.3	A16 E18 L24	A16-L20 WeakPolarHBondContact O-CB 3.43Å; A16-L20 WeakPolarHBondContact O-CD1 3.32Å; A16-L20 VanDerWaalsContact O-CG 3.25Å; A16-L20 WeakPolarHBondContact O-CG 2.91Å; A16-L20 PolarHBondContact O-N 3.15Å; A16-L20 VanDerWaalsContact O-N 3.1Å; E18-L20 PolarHBondContact O-N 3.28Å; L20-L24 VanDerWaalsContact O-CB 3.27Å; L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 VanDerWaalsContact O-CD1 3.3Å; L20-L24 WeakPolarHBondContact O-CD1 3.24Å; L20-L24 WeakPolarHBondContact O-CG 3.12Å; L20-L24 PolarHBondContact O-N 2.94Å
21	R	72.1	Confident	64.1	Low	187 Å²	187	97.3 Å²	97.3	71%	0.706	51%	0.511	S	S	*	.	H	α-helix	trans	-68.7	-38.7	177	-97.3	-175.6	169.1	-147.9	-1.9	112.5	R17 E18 Y19 Q25	R17-R21 PolarHBondContact O-N 2.73Å; E18-R21 WeakPolarHBondContact O-CA 3.17Å; E18-R21 WeakPolarHBondContact O-CB 3.45Å; E18-R21 PolarHBondContact O-N 3.16Å; Y19-R21 VanDerWaalsContact C-N 3.26Å; Y19-R21 PolarHBondContact O-N 3.06Å; R21-Q25 PolarHBondContact O-N 2.97Å
22	E	70.6	Confident	64.5	Low	114 Å²	114	99.3 Å²	99.3	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-67.1	-48.5	176.8	-69.5	176.4	177.7	0	0	110.8	E18 Y19 L24 Q25 E26	E18-E22 PolarHBondContact O-N 2.62Å; Y19-E22 PolarHBondContact O-N 2.9Å; E22-L24 VanDerWaalsContact C-N 3.26Å; E22-L24 PolarHBondContact O-N 2.89Å; E22-Q25 PolarHBondContact O-N 3.3Å; E22-Q25 VanDerWaalsContact O-N 3.1Å; E22-E26 PolarHBondContact O-N 3.01Å
23	D	68.3	Low	65.6	Low	78 Å²	78	99.3 Å²	99.3	42%	0.417	51%	0.507	S	S	.	.	H	α-helix	trans	-58.4	-38.4	175	-71	-15.1	0	0	0	111.9	Y19 F27 P45	Y19-D23 PolarHBondContact O-N 3.44Å; D23-F27 VanDerWaalsContact O-CB 3.28Å; D23-F27 WeakPolarHBondContact O-CB 3.27Å; D23-F27 PolarHBondContact O-N 2.99Å; D23-P45 HydrophobicContact CB-CG 4.37Å
24	L	69.7	Low	66.9	Low	24 Å²	24	95.6 Å²	95.6	13%	0.126	49%	0.487	C	S	.	.	H	α-helix	trans	-65.8	-45.5	174.8	-76.5	168.5	0	0	0	111.8	L20 E22 E26 F27 L28 P45 T47 T50	L20-L24 VanDerWaalsContact O-CB 3.27Å; L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 VanDerWaalsContact O-CD1 3.3Å; L20-L24 WeakPolarHBondContact O-CD1 3.24Å; L20-L24 WeakPolarHBondContact O-CG 3.12Å; L20-L24 PolarHBondContact O-N 2.94Å; E22-L24 VanDerWaalsContact C-N 3.26Å; E22-L24 PolarHBondContact O-N 2.89Å; L24-E26 VanDerWaalsContact C-N 3.34Å; L24-F27 PolarHBondContact O-N 3.1Å; L24-L28 VanDerWaalsContact O-CB 3.24Å; L24-L28 WeakPolarHBondContact O-CB 3.23Å; L24-L28 WeakPolarHBondContact O-CG 3.38Å; L24-L28 PolarHBondContact O-N 3.14Å; L24-P45 HydrophobicContact CD2-CG 3.82Å; L24-P45 HydrophobicContact CG-CG 4.11Å; L24-T47 HydrophobicContact CD2-CG2 4.26Å; L24-T50 HydrophobicContact CD2-CG2 3.26Å
25	Q	70.4	Confident	68.2	Low	150 Å²	150	98.1 Å²	98.1	70%	0.701	48%	0.484	S	S	*	.	H	α-helix	trans	-66	-36.7	178.2	-88.2	-179.2	-22	0	0	112.2	R21 E22 G29	R21-Q25 PolarHBondContact O-N 2.97Å; E22-Q25 PolarHBondContact O-N 3.3Å; E22-Q25 VanDerWaalsContact O-N 3.1Å; Q25-G29 WeakPolarHBondContact O-CA 3.49Å; Q25-G29 PolarHBondContact O-N 3.38Å
26	E	73.5	Confident	69.7	Low	150 Å²	150	97.6 Å²	97.6	70%	0.701	48%	0.48	S	S	*	.	H	α-helix	trans	-67.7	-46.9	174.6	-172.2	177.8	177.8	0	0	111.2	E22 L24 L28 G29 G30	E22-E26 PolarHBondContact O-N 3.01Å; L24-E26 VanDerWaalsContact C-N 3.34Å; E26-L28 VanDerWaalsContact C-N 3.32Å; E26-L28 PolarHBondContact O-N 2.95Å; E26-G29 PolarHBondContact O-N 3.22Å; E26-G30 PolarHBondContact O-N 3Å
27	F	70.4	Confident	71.1	Confident	31 Å²	31	96.7 Å²	96.7	14%	0.136	47%	0.468	C	S	.	.	H	α-helix	trans	-62.9	-37.5	177.8	-179.2	-100.3	0	0	0	112.9	D23 L24 L34 L37 V43 N44 T50	D23-F27 VanDerWaalsContact O-CB 3.28Å; D23-F27 WeakPolarHBondContact O-CB 3.27Å; D23-F27 PolarHBondContact O-N 2.99Å; L24-F27 PolarHBondContact O-N 3.1Å; F27-L34 HydrophobicContact CE1-CD2 3.68Å; F27-L34 HydrophobicContact CE2-CD2 4.15Å; F27-L34 HydrophobicContact CZ-CD2 3.39Å; F27-L37 HydrophobicContact CZ-CD1 4.3Å; F27-V43 HydrophobicContact CE1-CG1 3.82Å; F27-V43 HydrophobicContact CE2-CG1 4.48Å; F27-V43 HydrophobicContact CZ-CB 4.38Å; F27-V43 HydrophobicContact CZ-CG1 3.67Å; F27-N44 WeakPolarHBondContact CB-O 3.37Å; F27-N44 WeakPolarHBondContact CD2-O 3.07Å; F27-N44 WeakPolarHBondContact CG-O 3.49Å; F27-T50 HydrophobicContact CD1-CG2 3.59Å; F27-T50 HydrophobicContact CE1-CG2 3.94Å; F27-T50 HydrophobicContact CG-CG2 4.47Å
28	L	68	Low	72.7	Confident	57 Å²	57	90.4 Å²	90.4	30%	0.298	45%	0.447	S	S	.	.	H	α-helix	trans	-82.8	-25.3	178.6	-64.7	174.3	0	0	0	113	L24 E26 E49 R53	L24-L28 VanDerWaalsContact O-CB 3.24Å; L24-L28 WeakPolarHBondContact O-CB 3.23Å; L24-L28 WeakPolarHBondContact O-CG 3.38Å; L24-L28 PolarHBondContact O-N 3.14Å; E26-L28 VanDerWaalsContact C-N 3.32Å; E26-L28 PolarHBondContact O-N 2.95Å; L28-E49 HydrophobicContact CD1-CG 4.43Å; L28-R53 HydrophobicContact CD2-CB 3.88Å; L28-R53 HydrophobicContact CD2-CG 3.75Å
29	G	64	Low	74	Confident	61 Å²	61	86 Å²	86	63%	0.629	43%	0.428	S	S	*	.	H	α-helix	trans	-88.6	-27.8	-179.1	0	0	0	0	0	113.4	Q25 E26 E31	Q25-G29 WeakPolarHBondContact O-CA 3.49Å; Q25-G29 PolarHBondContact O-N 3.38Å; E26-G29 PolarHBondContact O-N 3.22Å; G29-E31 PolarHBondContact O-N 2.64Å
30	G	63.3	Low	75.5	Confident	34 Å²	34	80 Å²	80	35%	0.351	41%	0.406	S	S	.	.	S	Bend	trans	-73.6	108.2	163.1	0	0	0	0	0	108.8	E26 V32	E26-G30 PolarHBondContact O-N 3Å; G30-V32 PolarHBondContact O-N 3.18Å
31	E	56.2	Low	76.7	Confident	189 Å²	189	80 Å²	80	88%	0.883	41%	0.409	S	S	*	.			trans	-65.7	51.8	164.8	-69.5	-169.9	156.2	0	0	111.3	G29 L33	G29-E31 PolarHBondContact O-N 2.64Å; E31-L33 PolarHBondContact O-N 3.39Å
32	V	57.1	Low	77.6	Confident	91 Å²	91	80.1 Å²	80.1	55%	0.552	41%	0.409	S	S	*	.			trans	-52.5	126.3	148.6	177.4	0	0	0	0	104.5	G30 L34	G30-V32 PolarHBondContact O-N 3.18Å; V32-L34 WeakPolarHBondContact O-CG 3.45Å; V32-L34 PolarHBondContact O-N 2.89Å
33	L	76.1	Confident	78.5	Confident	80 Å²	80	74.8 Å²	74.8	42%	0.419	39%	0.385	S	S	.	.			trans	-61.2	79.9	-177.5	-62.8	141.5	0	0	0	108.4	E31 Y35 K36	E31-L33 PolarHBondContact O-N 3.39Å; L33-Y35 HydrophobicContact CB-CD1 4.21Å; L33-Y35 HydrophobicContact CB-CE1 3.87Å; L33-Y35 HydrophobicContact CD2-CD1 4.38Å; L33-Y35 HydrophobicContact CD2-CE1 3.36Å; L33-Y35 WeakPolarHBondContact CD2-OH 3.24Å; L33-Y35 HydrophobicContact CG-CE1 4.24Å; L33-Y35 PolarHBondContact O-N 3.11Å; L33-K36 HydrophobicContact CB-CB 4.17Å; L33-K36 HydrophobicContact CB-CD 3.67Å; L33-K36 HydrophobicContact CB-CG 3.72Å; L33-K36 HydrophobicContact CD1-CD 3.78Å; L33-K36 VanDerWaalsContact CD1-CE 3.45Å; L33-K36 HydrophobicContact CG-CD 4.21Å; L33-K36 WeakPolarHBondContact O-CA 3.49Å; L33-K36 VanDerWaalsContact O-CB 3.28Å; L33-K36 WeakPolarHBondContact O-CB 3.39Å; L33-K36 PolarHBondContact O-N 3.35Å
34	L	83.3	Confident	79.2	Confident	26 Å²	26	76.9 Å²	76.9	14%	0.136	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-56.4	-32.1	-171.9	-67.6	179.7	0	0	0	110.1	F27 V32 K36 L37 A57	F27-L34 HydrophobicContact CE1-CD2 3.68Å; F27-L34 HydrophobicContact CE2-CD2 4.15Å; F27-L34 HydrophobicContact CZ-CD2 3.39Å; V32-L34 WeakPolarHBondContact O-CG 3.45Å; V32-L34 PolarHBondContact O-N 2.89Å; L34-K36 PolarHBondContact O-N 3.28Å; L34-K36 VanDerWaalsContact O-N 3.16Å; L34-L37 HydrophobicContact CD2-CD1 3.97Å; L34-L37 WeakPolarHBondContact O-CB 3.37Å; L34-L37 PolarHBondContact O-N 2.9Å; L34-L37 VanDerWaalsContact O-N 3.07Å; L34-A57 HydrophobicContact CB-CB 3.89Å
35	Y	85.1	Confident	80.1	Confident	93 Å²	93	76.4 Å²	76.4	37%	0.365	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-62.2	-18.9	174.1	75.8	-98.2	0	0	0	114.3	L33 R58 A61	L33-Y35 HydrophobicContact CB-CD1 4.21Å; L33-Y35 HydrophobicContact CB-CE1 3.87Å; L33-Y35 HydrophobicContact CD2-CD1 4.38Å; L33-Y35 HydrophobicContact CD2-CE1 3.36Å; L33-Y35 WeakPolarHBondContact CD2-OH 3.24Å; L33-Y35 HydrophobicContact CG-CE1 4.24Å; L33-Y35 PolarHBondContact O-N 3.11Å; Y35-R58 WeakPolarHBondContact O-CG 3.37Å; Y35-R58 PolarHBondContact O-NH1 3.21Å; Y35-A61 HydrophobicContact CD2-CB 3.94Å; Y35-A61 HydrophobicContact CG-CB 3.9Å
36	K	89.6	Confident	81	Confident	110 Å²	110	73.8 Å²	73.8	48%	0.478	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-88.6	-8.3	176	-61.5	-172.6	-170.9	178	0	113.6	L33 L34 D38	L33-K36 HydrophobicContact CB-CB 4.17Å; L33-K36 HydrophobicContact CB-CD 3.67Å; L33-K36 HydrophobicContact CB-CG 3.72Å; L33-K36 HydrophobicContact CD1-CD 3.78Å; L33-K36 VanDerWaalsContact CD1-CE 3.45Å; L33-K36 HydrophobicContact CG-CD 4.21Å; L33-K36 WeakPolarHBondContact O-CA 3.49Å; L33-K36 VanDerWaalsContact O-CB 3.28Å; L33-K36 WeakPolarHBondContact O-CB 3.39Å; L33-K36 PolarHBondContact O-N 3.35Å; L34-K36 PolarHBondContact O-N 3.28Å; L34-K36 VanDerWaalsContact O-N 3.16Å; K36-D38 PolarHBondContact O-N 3.48Å; K36-D38 VanDerWaalsContact O-N 3.13Å
37	L	92.6	Very high	81.8	Confident	32 Å²	32	68.6 Å²	68.6	17%	0.168	37%	0.367	C	S	.	.			trans	-74.4	103.5	176.9	-70.2	173.4	0	0	0	110.1	F27 L34 D39 V43 R58	F27-L37 HydrophobicContact CZ-CD1 4.3Å; L34-L37 HydrophobicContact CD2-CD1 3.97Å; L34-L37 WeakPolarHBondContact O-CB 3.37Å; L34-L37 PolarHBondContact O-N 2.9Å; L34-L37 VanDerWaalsContact O-N 3.07Å; L37-D39 VanDerWaalsContact C-N 3.31Å; L37-V43 HydrophobicContact CD1-CG2 4.13Å; L37-R58 WeakPolarHBondContact O-CD 3.27Å; L37-R58 VanDerWaalsContact O-CZ 3.26Å; L37-R58 PolarHBondContact O-NH1 3.23Å
38	D	95.6	Very high	82.8	Confident	43 Å²	43	74.3 Å²	74.3	23%	0.23	40%	0.398	C	S	.	.			trans	-80.4	-12.1	-178.1	-71.8	-30.8	0	0	0	113.7	K36 R58 N67 K103 P104	K36-D38 PolarHBondContact O-N 3.48Å; K36-D38 VanDerWaalsContact O-N 3.13Å; D38-R58 IonicContact OD1-CZ 3.48Å; D38-R58 IonicContact OD1-NH1 2.96Å; D38-R58 PolarHBondContact OD1-NH1 3.35Å; D38-R58 IonicContact OD1-NH2 2.83Å; D38-R58 PolarHBondContact OD1-NH2 3.4Å; D38-N67 WeakPolarHBondContact O-CB 3.36Å; D38-N67 PolarHBondContact O-N 3.22Å; D38-K103 IonicContact OD1-NZ 3.3Å; D38-K103 PolarHBondContact OD1-NZ 3.48Å; D38-K103 VanDerWaalsContact OD2-CD 3.24Å; D38-K103 WeakPolarHBondContact OD2-CD 3.33Å; D38-K103 IonicContact OD2-NZ 2.66Å; D38-K103 PolarHBondContact OD2-NZ 3.05Å; D38-P104 HydrophobicContact CB-CG 3.57Å; D38-P104 WeakPolarHBondContact O-CG 3.27Å
39	D	95.9	Very high	83.9	Confident	36 Å²	36	75.9 Å²	75.9	19%	0.193	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-134.6	119.6	179.2	-167	-27	0	0	0	111.1	L37 T41 R42 N67 G69	L37-D39 VanDerWaalsContact C-N 3.31Å; D39-T41 PolarHBondContact O-N 2.95Å; D39-T41 WeakPolarHBondContact OD1-CB 3.31Å; D39-T41 WeakPolarHBondContact OD1-CG2 3.42Å; D39-T41 PolarHBondContact OD1-N 2.96Å; D39-T41 PolarHBondContact OD1-OG1 3.42Å; D39-T41 PolarHBondContact OD2-OG1 2.96Å; D39-R42 HydrophobicContact CB-CG 4.18Å; D39-R42 WeakPolarHBondContact O-CB 3.33Å; D39-R42 PolarHBondContact O-N 2.82Å; D39-R42 VanDerWaalsContact O-N 3.13Å; D39-N67 WeakPolarHBondContact CA-O 3.44Å; D39-N67 HydrophobicContact CB-CB 4.15Å; D39-G69 PolarHBondContact OD1-N 2.81Å
40	L	95.6	Very high	85.1	Confident	13 Å²	13	73 Å²	73	7%	0.068	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-66	-20.4	-179.5	-66.6	175.6	0	0	0	113.2	R42 V43 V51 C54 L55 T66 N67 A68 V73	L40-R42 PolarHBondContact O-N 3.46Å; L40-V43 HydrophobicContact CD2-CG2 4.3Å; L40-V43 WeakPolarHBondContact O-CB 3.19Å; L40-V43 WeakPolarHBondContact O-CG2 3.43Å; L40-V43 PolarHBondContact O-N 3.43Å; L40-V51 HydrophobicContact CD1-CG1 3.94Å; L40-V51 HydrophobicContact CD2-CG1 4.22Å; L40-C54 HydrophobicContact CD2-CB 4.1Å; L40-L55 HydrophobicContact CD1-CD1 4.36Å; L40-L55 HydrophobicContact CD1-CD2 4.14Å; L40-L55 HydrophobicContact CD1-CG 4.32Å; L40-L55 HydrophobicContact CD2-CD2 4.32Å; L40-L55 HydrophobicContact CD2-CG 4.26Å; L40-T66 HydrophobicContact CD2-CG2 4.08Å; L40-T66 HydrophobicContact CG-CG2 3.85Å; L40-N67 PolarHBondContact N-O 3.28Å; L40-A68 HydrophobicContact CB-CB 4.49Å; L40-A68 HydrophobicContact CD1-CB 4.34Å; L40-V73 HydrophobicContact CD1-CG2 4.12Å
41	T	93.1	Very high	86.6	Confident	82 Å²	82	73 Å²	73	50%	0.503	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-69	-13.7	174.6	63.9	0	0	0	0	112.8	D39	D39-T41 PolarHBondContact O-N 2.95Å; D39-T41 WeakPolarHBondContact OD1-CB 3.31Å; D39-T41 WeakPolarHBondContact OD1-CG2 3.42Å; D39-T41 PolarHBondContact OD1-N 2.96Å; D39-T41 PolarHBondContact OD1-OG1 3.42Å; D39-T41 PolarHBondContact OD2-OG1 2.96Å
42	R	91	Very high	88.4	Confident	189 Å²	189	69.1 Å²	69.1	71%	0.713	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-94.8	-0.5	177.9	-57	-176.7	65.4	-179.5	-0	113.4	D39 L40	D39-R42 HydrophobicContact CB-CG 4.18Å; D39-R42 WeakPolarHBondContact O-CB 3.33Å; D39-R42 PolarHBondContact O-N 2.82Å; D39-R42 VanDerWaalsContact O-N 3.13Å; L40-R42 PolarHBondContact O-N 3.46Å
43	V	89.2	Confident	90.1	Very high	2 Å²	2	70.8 Å²	70.8	1%	0.012	35%	0.348	C	S	.	.	S	Bend	trans	-70.7	134.3	171.6	174.4	0	0	0	0	108.1	F27 L37 L40 V46 T50 C54	F27-V43 HydrophobicContact CE1-CG1 3.82Å; F27-V43 HydrophobicContact CE2-CG1 4.48Å; F27-V43 HydrophobicContact CZ-CB 4.38Å; F27-V43 HydrophobicContact CZ-CG1 3.67Å; L37-V43 HydrophobicContact CD1-CG2 4.13Å; L40-V43 HydrophobicContact CD2-CG2 4.3Å; L40-V43 WeakPolarHBondContact O-CB 3.19Å; L40-V43 WeakPolarHBondContact O-CG2 3.43Å; L40-V43 PolarHBondContact O-N 3.43Å; V43-V46 WeakPolarHBondContact O-CG2 3.43Å; V43-V46 PolarHBondContact O-N 2.93Å; V43-T50 HydrophobicContact CG1-CG2 4.39Å; V43-T50 WeakPolarHBondContact CG1-OG1 3.43Å; V43-C54 HydrophobicContact CG2-CB 4.23Å
44	N	84.5	Confident	90.9	Very high	122 Å²	122	67 Å²	67	65%	0.652	33%	0.328	S	S	*	.	S	Bend	trans	-137.2	118.6	-177.6	-174.6	44.9	0	0	0	111	F27	F27-N44 WeakPolarHBondContact CB-O 3.37Å; F27-N44 WeakPolarHBondContact CD2-O 3.07Å; F27-N44 WeakPolarHBondContact CG-O 3.49Å
45	P	87.4	Confident	91.5	Very high	14 Å²	14	66.9 Å²	66.9	9%	0.091	33%	0.328	C	S	.	.	S	Bend	cis	-71.3	148	-2.2	29.5	-35	0	0	0	112.1	D23 L24 T47 T50	D23-P45 HydrophobicContact CB-CG 4.37Å; L24-P45 HydrophobicContact CD2-CG 3.82Å; L24-P45 HydrophobicContact CG-CG 4.11Å; P45-T47 HydrophobicContact CB-CG2 3.93Å; P45-T47 HydrophobicContact CG-CG2 3.97Å; P45-T47 PolarHBondContact O-N 3.27Å; P45-T47 VanDerWaalsContact O-N 3.08Å; P45-T50 HydrophobicContact CG-CG2 4.42Å; P45-T50 WeakPolarHBondContact O-CB 3.19Å; P45-T50 WeakPolarHBondContact O-CG2 3.34Å; P45-T50 PolarHBondContact O-OG1 3.3Å
46	V	89.5	Confident	92	Very high	95 Å²	95	67.2 Å²	67.2	58%	0.576	33%	0.332	S	S	*	.			trans	-74.8	98.2	172.1	-175.4	0	0	0	0	108.5	V43 V51	V43-V46 WeakPolarHBondContact O-CG2 3.43Å; V43-V46 PolarHBondContact O-N 2.93Å; V46-V51 HydrophobicContact CG1-CG2 4.32Å
47	T	90.5	Very high	92.2	Very high	41 Å²	41	63.2 Å²	63.2	25%	0.252	32%	0.32	S	S	.	.			trans	-132.5	166.1	177.5	75.6	0	0	0	0	110.2	L24 P45 E49 T50 V51	L24-T47 HydrophobicContact CD2-CG2 4.26Å; P45-T47 HydrophobicContact CB-CG2 3.93Å; P45-T47 HydrophobicContact CG-CG2 3.97Å; P45-T47 PolarHBondContact O-N 3.27Å; P45-T47 VanDerWaalsContact O-N 3.08Å; T47-E49 PolarHBondContact O-N 2.92Å; T47-E49 PolarHBondContact OG1-N 3.41Å; T47-T50 PolarHBondContact N-OG1 3.13Å; T47-T50 PolarHBondContact O-N 3.38Å; T47-T50 PolarHBondContact O-OG1 3.07Å; T47-T50 PolarHBondContact OG1-N 2.66Å; T47-T50 PolarHBondContact OG1-OG1 2.94Å; T47-V51 WeakPolarHBondContact O-CB 3.42Å; T47-V51 VanDerWaalsContact O-CG2 3.25Å; T47-V51 WeakPolarHBondContact O-CG2 3.42Å; T47-V51 PolarHBondContact O-N 2.94Å
48	L	91.8	Very high	92.4	Very high	150 Å²	150	61.8 Å²	61.8	79%	0.785	31%	0.312	S	S	*	.	H	α-helix	trans	-55.3	-42.4	173.9	177.3	62.2	0	0	0	111.5	L52	L48-L52 WeakPolarHBondContact O-CB 2.98Å; L48-L52 PolarHBondContact O-N 3.29Å
49	E	89.9	Confident	92.4	Very high	91 Å²	91	63.7 Å²	63.7	43%	0.425	32%	0.317	S	S	.	.	H	α-helix	trans	-66.3	-49.4	-177.9	-177.1	172.2	-173.5	0	0	111.9	L28 T47 V51 L52 R53	L28-E49 HydrophobicContact CD1-CG 4.43Å; T47-E49 PolarHBondContact O-N 2.92Å; T47-E49 PolarHBondContact OG1-N 3.41Å; E49-V51 PolarHBondContact O-N 3.4Å; E49-L52 PolarHBondContact O-N 2.86Å; E49-R53 HydrophobicContact CG-CG 4.48Å; E49-R53 WeakPolarHBondContact O-CB 3.3Å; E49-R53 WeakPolarHBondContact O-CG 3.02Å; E49-R53 PolarHBondContact O-N 3.47Å
50	T	90.6	Very high	92.3	Very high	0 Å²	0	69 Å²	69	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-67.7	-38.3	-177.9	55.7	0	0	0	0	112.1	L24 F27 V43 P45 T47 C54	L24-T50 HydrophobicContact CD2-CG2 3.26Å; F27-T50 HydrophobicContact CD1-CG2 3.59Å; F27-T50 HydrophobicContact CE1-CG2 3.94Å; F27-T50 HydrophobicContact CG-CG2 4.47Å; V43-T50 HydrophobicContact CG1-CG2 4.39Å; V43-T50 WeakPolarHBondContact CG1-OG1 3.43Å; P45-T50 HydrophobicContact CG-CG2 4.42Å; P45-T50 WeakPolarHBondContact O-CB 3.19Å; P45-T50 WeakPolarHBondContact O-CG2 3.34Å; P45-T50 PolarHBondContact O-OG1 3.3Å; T47-T50 PolarHBondContact N-OG1 3.13Å; T47-T50 PolarHBondContact O-N 3.38Å; T47-T50 PolarHBondContact O-OG1 3.07Å; T47-T50 PolarHBondContact OG1-N 2.66Å; T47-T50 PolarHBondContact OG1-OG1 2.94Å; T50-C54 WeakPolarHBondContact O-CB 3.25Å; T50-C54 PolarHBondContact O-N 3.49Å
51	V	94	Very high	92.3	Very high	33 Å²	33	70.5 Å²	70.5	20%	0.2	36%	0.356	C	S	.	.	H	α-helix	trans	-63.8	-46.7	174.2	168.8	0	0	0	0	111	L40 V46 T47 E49 R53 C54 L55	L40-V51 HydrophobicContact CD1-CG1 3.94Å; L40-V51 HydrophobicContact CD2-CG1 4.22Å; V46-V51 HydrophobicContact CG1-CG2 4.32Å; T47-V51 WeakPolarHBondContact O-CB 3.42Å; T47-V51 VanDerWaalsContact O-CG2 3.25Å; T47-V51 WeakPolarHBondContact O-CG2 3.42Å; T47-V51 PolarHBondContact O-N 2.94Å; E49-V51 PolarHBondContact O-N 3.4Å; V51-R53 VanDerWaalsContact C-N 3.35Å; V51-R53 PolarHBondContact O-N 3.34Å; V51-C54 PolarHBondContact O-N 3.25Å; V51-L55 HydrophobicContact CG1-CD1 4.02Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 3.22Å
52	L	94.7	Very high	92.3	Very high	109 Å²	109	70.6 Å²	70.6	57%	0.571	35%	0.354	S	S	*	.	H	α-helix	trans	-62.6	-43	179.2	-177.4	62.9	0	0	0	111.4	L48 E49 L55 Q56	L48-L52 WeakPolarHBondContact O-CB 2.98Å; L48-L52 PolarHBondContact O-N 3.29Å; E49-L52 PolarHBondContact O-N 2.86Å; L52-L55 PolarHBondContact O-N 2.94Å; L52-Q56 VanDerWaalsContact O-CB 3.31Å; L52-Q56 WeakPolarHBondContact O-CB 3.46Å; L52-Q56 PolarHBondContact O-N 3.17Å
53	R	91.5	Very high	92.6	Very high	125 Å²	125	63.7 Å²	63.7	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-63.1	-41.3	176.3	-70.1	-71.4	-169	160.8	5.8	112.2	L28 E49 V51 Q56 A57	L28-R53 HydrophobicContact CD2-CB 3.88Å; L28-R53 HydrophobicContact CD2-CG 3.75Å; E49-R53 HydrophobicContact CG-CG 4.48Å; E49-R53 WeakPolarHBondContact O-CB 3.3Å; E49-R53 WeakPolarHBondContact O-CG 3.02Å; E49-R53 PolarHBondContact O-N 3.47Å; V51-R53 VanDerWaalsContact C-N 3.35Å; V51-R53 PolarHBondContact O-N 3.34Å; R53-Q56 PolarHBondContact O-N 3.02Å; R53-A57 WeakPolarHBondContact O-CB 3.2Å; R53-A57 PolarHBondContact O-N 3.23Å
54	C	93.7	Very high	92.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-60.9	-50.3	174.6	-177.9	0	0	0	0	111.5	L40 V43 T50 V51 Q56 A57 R58	L40-C54 HydrophobicContact CD2-CB 4.1Å; V43-C54 HydrophobicContact CG2-CB 4.23Å; T50-C54 WeakPolarHBondContact O-CB 3.25Å; T50-C54 PolarHBondContact O-N 3.49Å; V51-C54 PolarHBondContact O-N 3.25Å; C54-Q56 VanDerWaalsContact C-N 3.33Å; C54-Q56 PolarHBondContact O-N 2.62Å; C54-A57 PolarHBondContact O-N 3.45Å; C54-R58 WeakPolarHBondContact O-CG 3.49Å; C54-R58 PolarHBondContact O-N 3.42Å
55	L	96.4	Very high	93.6	Very high	25 Å²	25	58.3 Å²	58.3	13%	0.131	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-40.3	177.2	-72.7	174.2	0	0	0	112.2	L40 V51 L52 R58 Y59 V73 L75	L40-L55 HydrophobicContact CD1-CD1 4.36Å; L40-L55 HydrophobicContact CD1-CD2 4.14Å; L40-L55 HydrophobicContact CD1-CG 4.32Å; L40-L55 HydrophobicContact CD2-CD2 4.32Å; L40-L55 HydrophobicContact CD2-CG 4.26Å; V51-L55 HydrophobicContact CG1-CD1 4.02Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 3.22Å; L52-L55 PolarHBondContact O-N 2.94Å; L55-R58 PolarHBondContact O-N 3.32Å; L55-Y59 WeakPolarHBondContact O-CB 3.26Å; L55-Y59 PolarHBondContact O-N 3.33Å; L55-V73 HydrophobicContact CD2-CG1 4.12Å; L55-L75 HydrophobicContact CB-CD1 4.22Å; L55-L75 HydrophobicContact CD2-CD1 4.18Å
56	Q	95.4	Very high	94.1	Very high	99 Å²	99	57.7 Å²	57.7	46%	0.463	30%	0.299	S	S	.	.	H	α-helix	trans	-62.4	-47.6	175.7	-174.4	179.5	19	0	0	111.5	L52 R53 C54 R58 Y59 M60	L52-Q56 VanDerWaalsContact O-CB 3.31Å; L52-Q56 WeakPolarHBondContact O-CB 3.46Å; L52-Q56 PolarHBondContact O-N 3.17Å; R53-Q56 PolarHBondContact O-N 3.02Å; C54-Q56 VanDerWaalsContact C-N 3.33Å; C54-Q56 PolarHBondContact O-N 2.62Å; Q56-R58 VanDerWaalsContact C-N 3.34Å; Q56-R58 PolarHBondContact O-N 3.02Å; Q56-Y59 PolarHBondContact O-N 3.47Å; Q56-M60 HydrophobicContact CG-SD 4.29Å; Q56-M60 WeakPolarHBondContact O-CG 3.31Å; Q56-M60 PolarHBondContact O-N 2.83Å
57	A	93.7	Very high	94.5	Very high	26 Å²	26	55.3 Å²	55.3	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-42.1	177.6	0	0	0	0	0	111.8	L34 R53 C54 M60 A61	L34-A57 HydrophobicContact CB-CB 3.89Å; R53-A57 WeakPolarHBondContact O-CB 3.2Å; R53-A57 PolarHBondContact O-N 3.23Å; C54-A57 PolarHBondContact O-N 3.45Å; A57-M60 PolarHBondContact O-N 3.39Å; A57-A61 PolarHBondContact O-N 3.27Å; A57-A61 VanDerWaalsContact O-N 3.15Å
58	R	96.1	Very high	94.8	Very high	2 Å²	2	55 Å²	55	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-44.9	174.8	-72.7	-177.9	70.5	85.9	-16.4	112	Y35 L37 D38 C54 L55 Q56 M60 A61 D62 T63 Y65 T66	Y35-R58 WeakPolarHBondContact O-CG 3.37Å; Y35-R58 PolarHBondContact O-NH1 3.21Å; L37-R58 WeakPolarHBondContact O-CD 3.27Å; L37-R58 VanDerWaalsContact O-CZ 3.26Å; L37-R58 PolarHBondContact O-NH1 3.23Å; D38-R58 IonicContact OD1-CZ 3.48Å; D38-R58 IonicContact OD1-NH1 2.96Å; D38-R58 PolarHBondContact OD1-NH1 3.35Å; D38-R58 IonicContact OD1-NH2 2.83Å; D38-R58 PolarHBondContact OD1-NH2 3.4Å; C54-R58 WeakPolarHBondContact O-CG 3.49Å; C54-R58 PolarHBondContact O-N 3.42Å; L55-R58 PolarHBondContact O-N 3.32Å; Q56-R58 VanDerWaalsContact C-N 3.34Å; Q56-R58 PolarHBondContact O-N 3.02Å; R58-M60 PolarHBondContact O-N 3.18Å; R58-A61 CarbonylContact O-C 3.35Å; R58-A61 PolarHBondContact O-N 3.44Å; R58-A61 VanDerWaalsContact O-N 3.12Å; R58-D62 PolarHBondContact O-N 3.19Å; R58-T63 CarbonylContact C-O 3.59Å; R58-T63 VanDerWaalsContact NH2-CG2 3.25Å; R58-T63 WeakPolarHBondContact O-CA 3.28Å; R58-T63 WeakPolarHBondContact O-CB 3.45Å; R58-T63 PolarHBondContact O-N 3.29Å; R58-Y65 PolarHBondContact NH2-O 3.24Å; R58-T66 WeakPolarHBondContact CD-OG1 3.49Å; R58-T66 PolarHBondContact NE-OG1 3.1Å
59	Y	96.2	Very high	94.9	Very high	83 Å²	83	49.8 Å²	49.8	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-61.1	-44	177.3	-170.1	-87.8	0	0	0	112	L55 Q56 A61 D62 F64 L75 N76 P77	L55-Y59 WeakPolarHBondContact O-CB 3.26Å; L55-Y59 PolarHBondContact O-N 3.33Å; Q56-Y59 PolarHBondContact O-N 3.47Å; Y59-A61 PolarHBondContact O-N 2.92Å; Y59-D62 PolarHBondContact O-N 3.25Å; Y59-D62 VanDerWaalsContact O-N 3.11Å; Y59-F64 AromaticContact CD2-CD1 3.88Å; Y59-F64 HydrophobicContact CD2-CD1 3.88Å; Y59-F64 AromaticContact CD2-CE1 3.89Å; Y59-F64 HydrophobicContact CD2-CE1 3.89Å; Y59-F64 HydrophobicContact CE2-CD1 4Å; Y59-F64 AromaticContact CE2-CE1 3.85Å; Y59-F64 HydrophobicContact CE2-CE1 3.85Å; Y59-F64 HydrophobicContact CG-CE1 4.44Å; Y59-L75 HydrophobicContact CD2-CB 3.99Å; Y59-L75 HydrophobicContact CD2-CD1 3.98Å; Y59-L75 HydrophobicContact CE2-CB 4.43Å; Y59-N76 WeakPolarHBondContact CE2-O 3.47Å; Y59-P77 PolarHBondContact OH-O 3.47Å; Y59-P77 VanDerWaalsContact OH-O 3.06Å
60	M	94.4	Very high	95	Very high	149 Å²	149	52 Å²	52	73%	0.734	29%	0.291	S	S	*	.	H	α-helix	trans	-64.1	-24.5	176.4	-70.3	178.2	68.4	0	0	113.1	Q56 A57 R58	Q56-M60 HydrophobicContact CG-SD 4.29Å; Q56-M60 WeakPolarHBondContact O-CG 3.31Å; Q56-M60 PolarHBondContact O-N 2.83Å; A57-M60 PolarHBondContact O-N 3.39Å; R58-M60 PolarHBondContact O-N 3.18Å
61	A	93.6	Very high	95.2	Very high	43 Å²	43	56.1 Å²	56.1	36%	0.355	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	19	175.8	0	0	0	0	0	113.3	Y35 A57 R58 Y59 T63	Y35-A61 HydrophobicContact CD2-CB 3.94Å; Y35-A61 HydrophobicContact CG-CB 3.9Å; A57-A61 PolarHBondContact O-N 3.27Å; A57-A61 VanDerWaalsContact O-N 3.15Å; R58-A61 CarbonylContact O-C 3.35Å; R58-A61 PolarHBondContact O-N 3.44Å; R58-A61 VanDerWaalsContact O-N 3.12Å; Y59-A61 PolarHBondContact O-N 2.92Å; A61-T63 PolarHBondContact O-N 3.27Å; A61-T63 PolarHBondContact O-OG1 3.24Å
62	D	94.6	Very high	95.4	Very high	84 Å²	84	56.5 Å²	56.5	45%	0.449	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	33	-179.1	-74.5	-21.4	0	0	0	114.7	R58 Y59 F64 K79	R58-D62 PolarHBondContact O-N 3.19Å; Y59-D62 PolarHBondContact O-N 3.25Å; Y59-D62 VanDerWaalsContact O-N 3.11Å; D62-F64 HydrophobicContact CB-CE2 4.05Å; D62-F64 HydrophobicContact CB-CZ 3.97Å; D62-F64 VanDerWaalsContact O-CE2 3.28Å; D62-F64 WeakPolarHBondContact O-CE2 3.45Å; D62-F64 WeakPolarHBondContact OD1-CZ 3.34Å; D62-K79 VanDerWaalsContact OD1-CE 3.23Å; D62-K79 WeakPolarHBondContact OD1-CE 3.34Å; D62-K79 IonicContact OD1-NZ 2.64Å; D62-K79 PolarHBondContact OD1-NZ 3.07Å; D62-K79 IonicContact OD2-NZ 3Å; D62-K79 PolarHBondContact OD2-NZ 3.38Å
63	T	95.8	Very high	95.6	Very high	44 Å²	44	53.2 Å²	53.2	27%	0.27	30%	0.302	S	S	.	.			trans	-110.6	106.2	175.7	-56.7	0	0	0	0	110	R58 A61	R58-T63 CarbonylContact C-O 3.59Å; R58-T63 VanDerWaalsContact NH2-CG2 3.25Å; R58-T63 WeakPolarHBondContact O-CA 3.28Å; R58-T63 WeakPolarHBondContact O-CB 3.45Å; R58-T63 PolarHBondContact O-N 3.29Å; A61-T63 PolarHBondContact O-N 3.27Å; A61-T63 PolarHBondContact O-OG1 3.24Å
64	F	97.3	Very high	95.9	Very high	3 Å²	3	49.3 Å²	49.3	1%	0.013	30%	0.296	C	S	.	.			trans	-103.3	-7.3	-165.9	-56.4	-65.9	0	0	0	115.2	Y59 D62 A74 L75 P77 V81 L84	Y59-F64 AromaticContact CD2-CD1 3.88Å; Y59-F64 HydrophobicContact CD2-CD1 3.88Å; Y59-F64 AromaticContact CD2-CE1 3.89Å; Y59-F64 HydrophobicContact CD2-CE1 3.89Å; Y59-F64 HydrophobicContact CE2-CD1 4Å; Y59-F64 AromaticContact CE2-CE1 3.85Å; Y59-F64 HydrophobicContact CE2-CE1 3.85Å; Y59-F64 HydrophobicContact CG-CE1 4.44Å; D62-F64 HydrophobicContact CB-CE2 4.05Å; D62-F64 HydrophobicContact CB-CZ 3.97Å; D62-F64 VanDerWaalsContact O-CE2 3.28Å; D62-F64 WeakPolarHBondContact O-CE2 3.45Å; D62-F64 WeakPolarHBondContact OD1-CZ 3.34Å; F64-A74 CarbonylContact O-C 3.42Å; F64-A74 WeakPolarHBondContact O-CA 3.45Å; F64-L75 WeakPolarHBondContact CB-O 3.22Å; F64-L75 PolarHBondContact O-N 3.07Å; F64-P77 HydrophobicContact CD1-CB 3.76Å; F64-P77 HydrophobicContact CD2-CB 4.13Å; F64-P77 HydrophobicContact CE1-CB 3.51Å; F64-P77 HydrophobicContact CE2-CB 3.89Å; F64-P77 HydrophobicContact CG-CB 4.07Å; F64-P77 HydrophobicContact CZ-CB 3.56Å; F64-V81 HydrophobicContact CD2-CG2 4.48Å; F64-V81 HydrophobicContact CE2-CG1 4.36Å; F64-V81 HydrophobicContact CE2-CG2 3.81Å; F64-V81 HydrophobicContact CZ-CG2 4.4Å; F64-L84 HydrophobicContact CD2-CD2 3.96Å
65	Y	98	Very high	96.1	Very high	9 Å²	9	51.6 Å²	51.6	4%	0.035	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.5	-179.8	-70.5	-71.1	0	0	0	109.8	R58 L72 V73 A74 L84 Y85 P104 H105 V106	R58-Y65 PolarHBondContact NH2-O 3.24Å; Y65-L72 HydrophobicContact CD1-CD1 4.47Å; Y65-L72 HydrophobicContact CD1-CD2 3.76Å; Y65-L72 HydrophobicContact CD1-CG 4.15Å; Y65-L72 HydrophobicContact CE1-CD2 4.24Å; Y65-V73 CarbonylContact C-O 3.59Å; Y65-V73 WeakPolarHBondContact CA-O 3.46Å; Y65-A74 HydrophobicContact CD1-CB 3.75Å; Y65-A74 HydrophobicContact CE1-CB 3.52Å; Y65-L84 HydrophobicContact CD2-CD1 4.12Å; Y65-L84 HydrophobicContact CE2-CD1 4.02Å; Y65-L84 HydrophobicContact CE2-CD2 3.95Å; Y65-L84 HydrophobicContact CE2-CG 4.07Å; Y65-Y85 HydrophobicContact CE2-CE1 4.14Å; Y65-Y85 VanDerWaalsContact OH-CE1 3.31Å; Y65-Y85 WeakPolarHBondContact OH-CE1 3.2Å; Y65-Y85 PolarHBondContact OH-OH 3.39Å; Y65-P104 WeakPolarHBondContact CB-O 3.42Å; Y65-H105 AromaticContact CD2-CD2 3.46Å; Y65-H105 VanDerWaalsContact CD2-CD2 3.46Å; Y65-H105 WeakPolarHBondContact CD2-CD2 3.31Å; Y65-H105 AromaticContact CD2-NE2 3.79Å; Y65-H105 AromaticContact CE2-CD2 3.65Å; Y65-H105 AromaticContact CE2-NE2 3.47Å; Y65-H105 WeakPolarHBondContact CE2-NE2 3.08Å; Y65-V106 HydrophobicContact CE1-CB 4.1Å
66	T	98.1	Very high	96.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	136.9	180	-41	0	0	0	0	109.5	L40 R58 V73	L40-T66 HydrophobicContact CD2-CG2 4.08Å; L40-T66 HydrophobicContact CG-CG2 3.85Å; R58-T66 WeakPolarHBondContact CD-OG1 3.49Å; R58-T66 PolarHBondContact NE-OG1 3.1Å; T66-V73 PolarHBondContact N-O 3.08Å; T66-V73 WeakPolarHBondContact O-CB 3.49Å; T66-V73 PolarHBondContact O-N 3.21Å
67	N	98	Very high	96.1	Very high	45 Å²	45	48.8 Å²	48.8	24%	0.241	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	149.9	173.7	-65.3	-23.9	0	0	0	110.4	D38 D39 L40 L72	D38-N67 WeakPolarHBondContact O-CB 3.36Å; D38-N67 PolarHBondContact O-N 3.22Å; D39-N67 WeakPolarHBondContact CA-O 3.44Å; D39-N67 HydrophobicContact CB-CB 4.15Å; L40-N67 PolarHBondContact N-O 3.28Å; N67-L72 WeakPolarHBondContact OD1-CD1 3.45Å
68	A	96.2	Very high	96.2	Very high	34 Å²	34	55.2 Å²	55.2	28%	0.281	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	77.7	166.3	0	0	0	0	0	106.6	L40 C70 T71 V73	L40-A68 HydrophobicContact CB-CB 4.49Å; L40-A68 HydrophobicContact CD1-CB 4.34Å; A68-C70 PolarHBondContact O-N 3.02Å; A68-T71 PolarHBondContact N-O 2.95Å; A68-T71 PolarHBondContact O-N 3.06Å; A68-T71 VanDerWaalsContact O-N 3.12Å; A68-V73 HydrophobicContact CB-CG2 3.96Å
69	G	93.8	Very high	96.1	Very high	42 Å²	42	59.8 Å²	59.8	43%	0.433	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	-118.9	-168.8	0	0	0	0	0	111.1	D39 T71	D39-G69 PolarHBondContact OD1-N 2.81Å; G69-T71 VanDerWaalsContact C-N 3.32Å
70	C	92.1	Very high	95.8	Very high	137 Å²	137	61.5 Å²	61.5	93%	0.926	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-8.4	179.6	62.2	0	0	0	0	114.5	A68	A68-C70 PolarHBondContact O-N 3.02Å
71	T	95.9	Very high	95.7	Very high	86 Å²	86	55.3 Å²	55.3	53%	0.528	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	147.9	-179	-57.4	0	0	0	0	110.6	A68 G69	A68-T71 PolarHBondContact N-O 2.95Å; A68-T71 PolarHBondContact O-N 3.06Å; A68-T71 VanDerWaalsContact O-N 3.12Å; G69-T71 VanDerWaalsContact C-N 3.32Å
72	L	98.1	Very high	95.4	Very high	41 Å²	41	58 Å²	58	22%	0.215	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.6	172.8	-174.6	71.3	0	0	0	110.2	Y65 N67 P104 H105 V106 V109	Y65-L72 HydrophobicContact CD1-CD1 4.47Å; Y65-L72 HydrophobicContact CD1-CD2 3.76Å; Y65-L72 HydrophobicContact CD1-CG 4.15Å; Y65-L72 HydrophobicContact CE1-CD2 4.24Å; N67-L72 WeakPolarHBondContact OD1-CD1 3.45Å; L72-P104 HydrophobicContact CD1-CB 3.91Å; L72-H105 VanDerWaalsContact CD2-C 3.5Å; L72-V106 HydrophobicContact CD2-CB 4.33Å; L72-V109 HydrophobicContact CB-CG2 4.16Å; L72-V109 HydrophobicContact CD2-CG2 3.98Å
73	V	98.1	Very high	95.3	Very high	41 Å²	41	60.3 Å²	60.3	25%	0.248	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.4	170.1	-178.8	0	0	0	0	108.6	L40 L55 Y65 T66 A68	L40-V73 HydrophobicContact CD1-CG2 4.12Å; L55-V73 HydrophobicContact CD2-CG1 4.12Å; Y65-V73 CarbonylContact C-O 3.59Å; Y65-V73 WeakPolarHBondContact CA-O 3.46Å; T66-V73 PolarHBondContact N-O 3.08Å; T66-V73 WeakPolarHBondContact O-CB 3.49Å; T66-V73 PolarHBondContact O-N 3.21Å; A68-V73 HydrophobicContact CB-CG2 3.96Å
74	A	97.8	Very high	95.2	Very high	42 Å²	42	59.5 Å²	59.5	35%	0.347	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.6	175.6	0	0	0	0	0	109.8	F64 Y65	F64-A74 CarbonylContact O-C 3.42Å; F64-A74 WeakPolarHBondContact O-CA 3.45Å; Y65-A74 HydrophobicContact CD1-CB 3.75Å; Y65-A74 HydrophobicContact CE1-CB 3.52Å
75	L	97.6	Very high	95	Very high	49 Å²	49	61.5 Å²	61.5	26%	0.257	36%	0.356	S	S	.	.			trans	-98.7	127.7	172.6	-61	-179.9	0	0	0	109	L55 Y59 F64 P77	L55-L75 HydrophobicContact CB-CD1 4.22Å; L55-L75 HydrophobicContact CD2-CD1 4.18Å; Y59-L75 HydrophobicContact CD2-CB 3.99Å; Y59-L75 HydrophobicContact CD2-CD1 3.98Å; Y59-L75 HydrophobicContact CE2-CB 4.43Å; F64-L75 WeakPolarHBondContact CB-O 3.22Å; F64-L75 PolarHBondContact O-N 3.07Å; L75-P77 VanDerWaalsContact O-CD 3.31Å; L75-P77 WeakPolarHBondContact O-CD 3.39Å
76	N	96.9	Very high	94.9	Very high	48 Å²	48	62.3 Å²	62.3	26%	0.257	36%	0.363	S	S	.	.			trans	-69.8	118.7	176	-177.6	-4.3	0	0	0	109.7	Y59 F78 G135	Y59-N76 WeakPolarHBondContact CE2-O 3.47Å; N76-F78 HydrophobicContact CB-CD2 4.33Å; N76-F78 HydrophobicContact CB-CE2 4Å; N76-F78 HydrophobicContact CB-CZ 4.17Å; N76-F78 VanDerWaalsContact ND2-CE1 3.33Å; N76-F78 WeakPolarHBondContact ND2-CE1 3.16Å; N76-F78 WeakPolarHBondContact O-CD2 3.17Å; N76-F78 PolarHBondContact O-N 3.05Å; N76-F78 PolarHBondContact OD1-N 3.39Å; N76-G135 PolarHBondContact ND2-O 3.21Å
77	P	95.9	Very high	94.7	Very high	17 Å²	17	65.2 Å²	65.2	11%	0.11	38%	0.382	C	S	.	.			trans	-69.5	-17	-178.5	29	-37.2	0	0	0	113.8	Y59 F64 L75 K79 V81	Y59-P77 PolarHBondContact OH-O 3.47Å; Y59-P77 VanDerWaalsContact OH-O 3.06Å; F64-P77 HydrophobicContact CD1-CB 3.76Å; F64-P77 HydrophobicContact CD2-CB 4.13Å; F64-P77 HydrophobicContact CE1-CB 3.51Å; F64-P77 HydrophobicContact CE2-CB 3.89Å; F64-P77 HydrophobicContact CG-CB 4.07Å; F64-P77 HydrophobicContact CZ-CB 3.56Å; L75-P77 VanDerWaalsContact O-CD 3.31Å; L75-P77 WeakPolarHBondContact O-CD 3.39Å; P77-K79 HydrophobicContact CB-CG 4.08Å; P77-K79 PolarHBondContact O-N 2.81Å; P77-V81 HydrophobicContact CB-CG2 4.02Å; P77-V81 HydrophobicContact CG-CG2 4.12Å
78	F	95.1	Very high	94.5	Very high	161 Å²	161	68.3 Å²	68.3	71%	0.706	40%	0.395	S	S	*	.	S	Bend	trans	51.6	17.8	-171.4	-65	-77.1	0	0	0	115	N76	N76-F78 HydrophobicContact CB-CD2 4.33Å; N76-F78 HydrophobicContact CB-CE2 4Å; N76-F78 HydrophobicContact CB-CZ 4.17Å; N76-F78 VanDerWaalsContact ND2-CE1 3.33Å; N76-F78 WeakPolarHBondContact ND2-CE1 3.16Å; N76-F78 WeakPolarHBondContact O-CD2 3.17Å; N76-F78 PolarHBondContact O-N 3.05Å; N76-F78 PolarHBondContact OD1-N 3.39Å
79	K	93.9	Very high	94.5	Very high	97 Å²	97	68.3 Å²	68.3	42%	0.422	39%	0.39	S	S	.	.	S	Bend	trans	-141.6	154.2	175.5	64.3	-179.5	175	175.9	0	110.4	D62 P77 V81	D62-K79 VanDerWaalsContact OD1-CE 3.23Å; D62-K79 WeakPolarHBondContact OD1-CE 3.34Å; D62-K79 IonicContact OD1-NZ 2.64Å; D62-K79 PolarHBondContact OD1-NZ 3.07Å; D62-K79 IonicContact OD2-NZ 3Å; D62-K79 PolarHBondContact OD2-NZ 3.38Å; P77-K79 HydrophobicContact CB-CG 4.08Å; P77-K79 PolarHBondContact O-N 2.81Å; K79-V81 HydrophobicContact CG-CG2 4.14Å; K79-V81 PolarHBondContact O-N 3.39Å
80	P	90.9	Very high	94.7	Very high	120 Å²	120	66.5 Å²	66.5	78%	0.779	37%	0.371	S	S	*	.			trans	-62.3	132.3	170.3	-19.3	32.1	0	0	0	110.7
81	V	92.5	Very high	94.8	Very high	19 Å²	19	65.7 Å²	65.7	12%	0.115	35%	0.348	C	S	.	.			trans	-130.8	77.7	173.2	-166.2	0	0	0	0	108.1	F64 P77 K79 Q83 L84	F64-V81 HydrophobicContact CD2-CG2 4.48Å; F64-V81 HydrophobicContact CE2-CG1 4.36Å; F64-V81 HydrophobicContact CE2-CG2 3.81Å; F64-V81 HydrophobicContact CZ-CG2 4.4Å; P77-V81 HydrophobicContact CB-CG2 4.02Å; P77-V81 HydrophobicContact CG-CG2 4.12Å; K79-V81 HydrophobicContact CG-CG2 4.14Å; K79-V81 PolarHBondContact O-N 3.39Å; V81-Q83 VanDerWaalsContact C-N 3.29Å; V81-Q83 HydrophobicContact CG1-CG 4.37Å; V81-Q83 PolarHBondContact O-N 2.9Å; V81-L84 HydrophobicContact CB-CB 4.03Å; V81-L84 HydrophobicContact CB-CD2 4.3Å; V81-L84 HydrophobicContact CG1-CB 3.84Å; V81-L84 HydrophobicContact CG1-CD2 4.45Å; V81-L84 VanDerWaalsContact O-CB 3.26Å; V81-L84 WeakPolarHBondContact O-CB 3.39Å; V81-L84 PolarHBondContact O-N 2.73Å; V81-L84 VanDerWaalsContact O-N 3.08Å
82	P	87.3	Confident	94.8	Very high	100 Å²	100	66.6 Å²	66.6	65%	0.649	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-56.4	-39.6	-167.8	-26.6	35.2	0	0	0	114	L84 Y85	P82-L84 PolarHBondContact O-N 2.6Å; P82-Y85 PolarHBondContact O-N 3.22Å
83	Q	91.8	Very high	94.8	Very high	132 Å²	132	65.1 Å²	65.1	62%	0.617	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-64.2	-26.2	-179.2	65.7	-85.8	30.6	0	0	113.5	V81 Y85 S86	V81-Q83 VanDerWaalsContact C-N 3.29Å; V81-Q83 HydrophobicContact CG1-CG 4.37Å; V81-Q83 PolarHBondContact O-N 2.9Å; Q83-Y85 PolarHBondContact O-N 2.96Å; Q83-S86 PolarHBondContact O-OG 2.81Å
84	L	93.1	Very high	94.7	Very high	26 Å²	26	64.9 Å²	64.9	14%	0.136	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-67.9	-23.2	-176.8	-169.2	63	0	0	0	112.8	F64 Y65 V81 P82 L89 H105	F64-L84 HydrophobicContact CD2-CD2 3.96Å; Y65-L84 HydrophobicContact CD2-CD1 4.12Å; Y65-L84 HydrophobicContact CE2-CD1 4.02Å; Y65-L84 HydrophobicContact CE2-CD2 3.95Å; Y65-L84 HydrophobicContact CE2-CG 4.07Å; V81-L84 HydrophobicContact CB-CB 4.03Å; V81-L84 HydrophobicContact CB-CD2 4.3Å; V81-L84 HydrophobicContact CG1-CB 3.84Å; V81-L84 HydrophobicContact CG1-CD2 4.45Å; V81-L84 VanDerWaalsContact O-CB 3.26Å; V81-L84 WeakPolarHBondContact O-CB 3.39Å; V81-L84 PolarHBondContact O-N 2.73Å; V81-L84 VanDerWaalsContact O-N 3.08Å; P82-L84 PolarHBondContact O-N 2.6Å; L84-L89 WeakPolarHBondContact O-CD2 3.42Å; L84-H105 WeakPolarHBondContact CD1-NE2 3.46Å; L84-H105 PolarHBondContact O-CE1 3.01Å; L84-H105 VanDerWaalsContact O-CE1 3.24Å; L84-H105 PolarHBondContact O-NE2 3.23Å
85	Y	93.7	Very high	94.6	Very high	45 Å²	45	66.7 Å²	66.7	18%	0.176	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-130.3	27.1	-176.3	-52.2	-60.4	0	0	0	112.6	Y65 P82 Q83 V106 F107 W140 C144	Y65-Y85 HydrophobicContact CE2-CE1 4.14Å; Y65-Y85 VanDerWaalsContact OH-CE1 3.31Å; Y65-Y85 WeakPolarHBondContact OH-CE1 3.2Å; Y65-Y85 PolarHBondContact OH-OH 3.39Å; P82-Y85 PolarHBondContact O-N 3.22Å; Q83-Y85 PolarHBondContact O-N 2.96Å; Y85-V106 HydrophobicContact CE1-CG1 4.4Å; Y85-F107 HydrophobicContact CD1-CZ 4.15Å; Y85-W140 HydrophobicContact CD2-CZ2 4.22Å; Y85-W140 AromaticContact CD2-NE1 3.68Å; Y85-W140 HydrophobicContact CE2-CZ2 4.34Å; Y85-W140 AromaticContact CE2-NE1 3.14Å; Y85-W140 AromaticContact CZ-NE1 3.49Å; Y85-C144 HydrophobicContact CD1-CB 4.43Å; Y85-C144 WeakPolarHBondContact CD1-SG 3.47Å; Y85-C144 HydrophobicContact CE1-CB 4.47Å; Y85-C144 VanDerWaalsContact CE1-SG 3.56Å
86	S	95.3	Very high	94.5	Very high	26 Å²	26	65 Å²	65	18%	0.182	34%	0.342	C	S	.	.			trans	-67.8	144.7	179.2	62.3	0	0	0	0	111.4	Q83 E88 L89 M90	Q83-S86 PolarHBondContact O-OG 2.81Å; S86-E88 WeakPolarHBondContact CB-OE2 3.4Å; S86-E88 PolarHBondContact O-N 3.32Å; S86-L89 PolarHBondContact O-N 3.25Å; S86-L89 VanDerWaalsContact OG-CB 3.27Å; S86-L89 WeakPolarHBondContact OG-CB 3.37Å; S86-L89 PolarHBondContact OG-N 3.13Å; S86-M90 WeakPolarHBondContact O-CG 3.22Å; S86-M90 PolarHBondContact O-N 3.13Å; S86-M90 VanDerWaalsContact O-N 3.08Å
87	P	94.2	Very high	94.4	Very high	61 Å²	61	68.1 Å²	68.1	40%	0.396	37%	0.365	S	S	.	.	H	α-helix	trans	-57	-31.5	172.4	-25	34.8	0	0	0	113.1	M90 R91	P87-M90 PolarHBondContact O-N 2.85Å; P87-R91 WeakPolarHBondContact O-CG 3.38Å; P87-R91 PolarHBondContact O-N 2.97Å
88	E	94.9	Very high	94.3	Very high	111 Å²	111	71.5 Å²	71.5	52%	0.519	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-48.5	175.9	-65.6	64.1	-132.5	0	0	110.8	S86 M90 R91 E92	S86-E88 WeakPolarHBondContact CB-OE2 3.4Å; S86-E88 PolarHBondContact O-N 3.32Å; E88-M90 VanDerWaalsContact C-N 3.34Å; E88-M90 PolarHBondContact O-N 3.34Å; E88-R91 PolarHBondContact O-N 2.7Å; E88-R91 IonicContact OE1-NH2 3.74Å; E88-R91 PolarHBondContact OE1-NH2 2.91Å; E88-E92 PolarHBondContact O-N 3.32Å
89	L	96.1	Very high	94.1	Very high	34 Å²	34	63.9 Å²	63.9	18%	0.178	35%	0.346	C	S	.	.	H	α-helix	trans	-64.4	-39.2	176.6	-169.6	65.9	0	0	0	111.5	L84 S86 R91 E92 Y93 F107	L84-L89 WeakPolarHBondContact O-CD2 3.42Å; S86-L89 PolarHBondContact O-N 3.25Å; S86-L89 VanDerWaalsContact OG-CB 3.27Å; S86-L89 WeakPolarHBondContact OG-CB 3.37Å; S86-L89 PolarHBondContact OG-N 3.13Å; L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.29Å; L89-E92 WeakPolarHBondContact O-CB 3.25Å; L89-E92 PolarHBondContact O-N 3.04Å; L89-Y93 HydrophobicContact CD1-CD2 4.06Å; L89-Y93 HydrophobicContact CD1-CE2 3.72Å; L89-Y93 HydrophobicContact CD2-CE2 4.44Å; L89-Y93 HydrophobicContact CG-CD2 4.01Å; L89-Y93 HydrophobicContact CG-CE2 3.89Å; L89-Y93 WeakPolarHBondContact O-CD2 3.41Å; L89-Y93 PolarHBondContact O-N 3.03Å; L89-F107 HydrophobicContact CB-CE2 4.31Å; L89-F107 HydrophobicContact CD2-CD2 4.41Å; L89-F107 HydrophobicContact CD2-CE2 4.09Å; L89-F107 HydrophobicContact CG-CD2 4.22Å; L89-F107 HydrophobicContact CG-CE2 4.14Å
90	M	96.9	Very high	94	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.02	35%	0.35	C	S	.	.	H	α-helix	trans	-57.1	-45.2	174.3	-65.5	177.3	-178.8	0	0	111.4	S86 P87 E88 Y93 H94 F107 K147 F148 V151	S86-M90 WeakPolarHBondContact O-CG 3.22Å; S86-M90 PolarHBondContact O-N 3.13Å; S86-M90 VanDerWaalsContact O-N 3.08Å; P87-M90 PolarHBondContact O-N 2.85Å; E88-M90 VanDerWaalsContact C-N 3.34Å; E88-M90 PolarHBondContact O-N 3.34Å; M90-Y93 PolarHBondContact O-N 2.86Å; M90-H94 PolarHBondContact O-N 3.39Å; M90-H94 VanDerWaalsContact O-N 3.1Å; M90-F107 HydrophobicContact CB-CE2 4.38Å; M90-F107 HydrophobicContact CE-CE1 3.78Å; M90-F107 HydrophobicContact CE-CZ 3.5Å; M90-F107 HydrophobicContact CG-CD1 4.36Å; M90-F107 HydrophobicContact CG-CD2 4.11Å; M90-F107 HydrophobicContact CG-CE1 3.78Å; M90-F107 HydrophobicContact CG-CE2 3.51Å; M90-F107 HydrophobicContact CG-CZ 3.34Å; M90-F107 HydrophobicContact SD-CE1 4.48Å; M90-F107 HydrophobicContact SD-CZ 4.26Å; M90-K147 HydrophobicContact CE-CB 3.92Å; M90-F148 HydrophobicContact CB-CD2 3.83Å; M90-F148 HydrophobicContact CB-CE2 4.31Å; M90-F148 HydrophobicContact CG-CD2 3.95Å; M90-F148 WeakPolarHBondContact O-CE2 3.32Å; M90-F148 HydrophobicContact SD-CB 4.44Å; M90-V151 HydrophobicContact CB-CG1 4.17Å; M90-V151 HydrophobicContact SD-CB 4.13Å; M90-V151 HydrophobicContact SD-CG2 3.77Å
91	R	95.5	Very high	94.1	Very high	119 Å²	119	66.4 Å²	66.4	45%	0.449	35%	0.346	S	S	.	.	H	α-helix	trans	-66.6	-37.2	177.2	-73.4	-176.3	-71.5	-113	-0.6	112.5	P87 E88 L89 H94 A95 V151	P87-R91 WeakPolarHBondContact O-CG 3.38Å; P87-R91 PolarHBondContact O-N 2.97Å; E88-R91 PolarHBondContact O-N 2.7Å; E88-R91 IonicContact OE1-NH2 3.74Å; E88-R91 PolarHBondContact OE1-NH2 2.91Å; L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.29Å; R91-H94 PolarHBondContact O-N 3.32Å; R91-A95 WeakPolarHBondContact O-CB 3.4Å; R91-A95 PolarHBondContact O-N 3.08Å; R91-V151 HydrophobicContact CG-CG1 4.11Å
92	E	96	Very high	94.2	Very high	106 Å²	106	68 Å²	68	50%	0.495	35%	0.354	S	S	.	.	H	α-helix	trans	-58.9	-49.9	175.1	-175.1	-173.9	154.8	0	0	111.5	E88 L89 H94 A95 A96	E88-E92 PolarHBondContact O-N 3.32Å; L89-E92 WeakPolarHBondContact O-CB 3.25Å; L89-E92 PolarHBondContact O-N 3.04Å; E92-H94 VanDerWaalsContact C-N 3.3Å; E92-H94 PolarHBondContact O-N 3.39Å; E92-A95 PolarHBondContact O-N 3.08Å; E92-A96 WeakPolarHBondContact O-CB 3.16Å; E92-A96 PolarHBondContact O-N 2.73Å
93	Y	97.6	Very high	94.6	Very high	10 Å²	10	68.8 Å²	68.8	4%	0.039	35%	0.347	C	S	.	.	H	α-helix	trans	-63.2	-36.7	177.7	-86.1	-96	0	0	0	112.5	L89 M90 L102 K103 H105 F107 T108	L89-Y93 HydrophobicContact CD1-CD2 4.06Å; L89-Y93 HydrophobicContact CD1-CE2 3.72Å; L89-Y93 HydrophobicContact CD2-CE2 4.44Å; L89-Y93 HydrophobicContact CG-CD2 4.01Å; L89-Y93 HydrophobicContact CG-CE2 3.89Å; L89-Y93 WeakPolarHBondContact O-CD2 3.41Å; L89-Y93 PolarHBondContact O-N 3.03Å; M90-Y93 PolarHBondContact O-N 2.86Å; Y93-L102 HydrophobicContact CD1-CB 4.39Å; Y93-L102 HydrophobicContact CD1-CD1 3.66Å; Y93-L102 HydrophobicContact CD2-CD1 4.19Å; Y93-L102 HydrophobicContact CE1-CB 3.71Å; Y93-L102 HydrophobicContact CE1-CD1 3.77Å; Y93-L102 HydrophobicContact CE1-CG 4.4Å; Y93-L102 HydrophobicContact CE2-CD1 4.31Å; Y93-L102 HydrophobicContact CG-CD1 3.88Å; Y93-K103 PolarHBondContact OH-O 2.8Å; Y93-H105 HydrophobicContact CE1-CB 3.73Å; Y93-H105 HydrophobicContact CE2-CB 4.17Å; Y93-H105 VanDerWaalsContact CZ-CB 3.49Å; Y93-H105 WeakPolarHBondContact OH-CB 3.48Å; Y93-F107 HydrophobicContact CD1-CB 3.91Å; Y93-F107 HydrophobicContact CD2-CB 4.06Å; Y93-F107 AromaticContact CD2-CD2 3.99Å; Y93-F107 HydrophobicContact CD2-CD2 3.99Å; Y93-F107 HydrophobicContact CE2-CD2 4.49Å; Y93-F107 HydrophobicContact CG-CB 3.61Å; Y93-F107 HydrophobicContact CG-CD2 4.38Å; Y93-T108 WeakPolarHBondContact CE1-OG1 3.3Å
94	H	96.3	Very high	94.9	Very high	35 Å²	35	62.9 Å²	62.9	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-45.2	177.7	-175.2	54.2	0	0	0	112.6	M90 R91 E92 A96 E111 Y114 R115 V152	M90-H94 PolarHBondContact O-N 3.39Å; M90-H94 VanDerWaalsContact O-N 3.1Å; R91-H94 PolarHBondContact O-N 3.32Å; E92-H94 VanDerWaalsContact C-N 3.3Å; E92-H94 PolarHBondContact O-N 3.39Å; H94-A96 VanDerWaalsContact C-N 3.31Å; H94-A96 PolarHBondContact O-N 2.9Å; H94-E111 IonicContact CE1-OE1 3.99Å; H94-E111 IonicContact CE1-OE2 3.89Å; H94-E111 IonicContact CG-OE2 3.01Å; H94-E111 IonicContact ND1-OE1 3.34Å; H94-E111 PolarHBondContact ND1-OE1 3Å; H94-E111 IonicContact ND1-OE2 2.86Å; H94-E111 PolarHBondContact ND1-OE2 2.93Å; H94-Y114 AromaticContact CE1-CE1 3.76Å; H94-R115 PolarHBondContact O-NH2 3.47Å; H94-V152 HydrophobicContact CB-CB 4.46Å; H94-V152 HydrophobicContact CB-CG1 3.6Å
95	A	94.8	Very high	95.2	Very high	81 Å²	81	62 Å²	62	67%	0.669	32%	0.315	S	S	*	.	H	α-helix	trans	-73.6	-21	-178	0	0	0	0	0	113.4	R91 E92 P97	R91-A95 WeakPolarHBondContact O-CB 3.4Å; R91-A95 PolarHBondContact O-N 3.08Å; E92-A95 PolarHBondContact O-N 3.08Å; A95-P97 WeakPolarHBondContact O-CD 3.44Å
96	A	96.1	Very high	95.3	Very high	13 Å²	13	60 Å²	60	11%	0.107	31%	0.308	C	S	.	.			trans	-63.9	124.7	-177.7	0	0	0	0	0	111.7	E92 H94 Q98 P99 L102 R115	E92-A96 WeakPolarHBondContact O-CB 3.16Å; E92-A96 PolarHBondContact O-N 2.73Å; H94-A96 VanDerWaalsContact C-N 3.31Å; H94-A96 PolarHBondContact O-N 2.9Å; A96-Q98 PolarHBondContact O-N 3.31Å; A96-Q98 VanDerWaalsContact O-N 3.16Å; A96-P99 WeakPolarHBondContact O-CD 3.39Å; A96-L102 HydrophobicContact CB-CD1 3.67Å; A96-L102 HydrophobicContact CB-CG 4.24Å; A96-R115 PolarHBondContact O-NH1 3.41Å; A96-R115 PolarHBondContact O-NH2 2.93Å
97	P	93.9	Very high	95.5	Very high	114 Å²	114	58.7 Å²	58.7	74%	0.74	30%	0.299	S	S	*	.	S	Bend	trans	-59.1	-33.1	177.9	-25.7	34.3	0	0	0	112.8	A95 R115	A95-P97 WeakPolarHBondContact O-CD 3.44Å; P97-R115 PolarHBondContact O-NH1 3.22Å
98	Q	93.5	Very high	95.6	Very high	88 Å²	88	57 Å²	57	41%	0.411	29%	0.287	S	S	.	.			trans	-131.3	77.3	-177.3	-64.8	178.9	10.4	0	0	110.1	A96 Q100 K101	A96-Q98 PolarHBondContact O-N 3.31Å; A96-Q98 VanDerWaalsContact O-N 3.16Å; Q98-Q100 VanDerWaalsContact CA-OE1 3.27Å; Q98-Q100 PolarHBondContact O-N 3.1Å; Q98-Q100 VanDerWaalsContact O-N 3.13Å; Q98-K101 HydrophobicContact CB-CB 4.49Å; Q98-K101 HydrophobicContact CB-CD 4.17Å; Q98-K101 HydrophobicContact CB-CG 4.2Å; Q98-K101 WeakPolarHBondContact O-CB 3.31Å; Q98-K101 PolarHBondContact O-N 3.21Å
99	P	92.1	Very high	95.8	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-62	-21.4	-175.4	26.8	-36.3	0	0	0	113.3	A96 K101 L102 T108 E111	A96-P99 WeakPolarHBondContact O-CD 3.39Å; P99-K101 PolarHBondContact O-N 3.44Å; P99-L102 WeakPolarHBondContact O-CB 3.33Å; P99-L102 PolarHBondContact O-N 3.23Å; P99-T108 HydrophobicContact CB-CG2 4.4Å; P99-E111 HydrophobicContact CB-CG 4.23Å; P99-E111 HydrophobicContact CG-CB 4.48Å; P99-E111 HydrophobicContact CG-CG 3.92Å
100	Q	91.2	Very high	95.8	Very high	110 Å²	110	52.3 Å²	52.3	51%	0.514	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-68.8	-17.5	173.3	71.8	-79.8	15.4	0	0	114.1	Q98	Q98-Q100 VanDerWaalsContact CA-OE1 3.27Å; Q98-Q100 PolarHBondContact O-N 3.1Å; Q98-Q100 VanDerWaalsContact O-N 3.13Å
101	K	93.1	Very high	95.8	Very high	161 Å²	161	52.3 Å²	52.3	70%	0.7	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-86.6	-13.7	173.3	-71.4	-172.7	171.6	168.6	0	112.9	Q98 P99	Q98-K101 HydrophobicContact CB-CB 4.49Å; Q98-K101 HydrophobicContact CB-CD 4.17Å; Q98-K101 HydrophobicContact CB-CG 4.2Å; Q98-K101 WeakPolarHBondContact O-CB 3.31Å; Q98-K101 PolarHBondContact O-N 3.21Å; P99-K101 PolarHBondContact O-N 3.44Å
102	L	95.6	Very high	95.8	Very high	52 Å²	52	50.7 Å²	50.7	27%	0.272	27%	0.265	S	S	.	.	S	Bend	trans	-73.8	173.2	172.7	-59.1	-178.5	0	0	0	110.3	Y93 A96 P99	Y93-L102 HydrophobicContact CD1-CB 4.39Å; Y93-L102 HydrophobicContact CD1-CD1 3.66Å; Y93-L102 HydrophobicContact CD2-CD1 4.19Å; Y93-L102 HydrophobicContact CE1-CB 3.71Å; Y93-L102 HydrophobicContact CE1-CD1 3.77Å; Y93-L102 HydrophobicContact CE1-CG 4.4Å; Y93-L102 HydrophobicContact CE2-CD1 4.31Å; Y93-L102 HydrophobicContact CG-CD1 3.88Å; A96-L102 HydrophobicContact CB-CD1 3.67Å; A96-L102 HydrophobicContact CB-CG 4.24Å; P99-L102 WeakPolarHBondContact O-CB 3.33Å; P99-L102 PolarHBondContact O-N 3.23Å
103	K	96.1	Very high	95.8	Very high	117 Å²	117	46.8 Å²	46.8	51%	0.509	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-57.6	146.7	174.4	-70.9	-60.6	-170.1	174.8	0	111	D38 Y93 H105	D38-K103 IonicContact OD1-NZ 3.3Å; D38-K103 PolarHBondContact OD1-NZ 3.48Å; D38-K103 VanDerWaalsContact OD2-CD 3.24Å; D38-K103 WeakPolarHBondContact OD2-CD 3.33Å; D38-K103 IonicContact OD2-NZ 2.66Å; D38-K103 PolarHBondContact OD2-NZ 3.05Å; Y93-K103 PolarHBondContact OH-O 2.8Å; K103-H105 PolarHBondContact O-N 3.41Å
104	P	97.7	Very high	95.6	Very high	8 Å²	8	48.6 Å²	48.6	5%	0.052	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-53.6	128	174.7	-25.4	33.6	0	0	0	110.3	D38 Y65 L72	D38-P104 HydrophobicContact CB-CG 3.57Å; D38-P104 WeakPolarHBondContact O-CG 3.27Å; Y65-P104 WeakPolarHBondContact CB-O 3.42Å; L72-P104 HydrophobicContact CD1-CB 3.91Å
105	H	97.9	Very high	95.5	Very high	6 Å²	6	50.1 Å²	50.1	3%	0.028	26%	0.26	C	S	.	.			trans	-158.2	154.9	179.4	-157.1	-98.7	0	0	0	111	Y65 L72 L84 Y93 K103 F107 T108	Y65-H105 AromaticContact CD2-CD2 3.46Å; Y65-H105 VanDerWaalsContact CD2-CD2 3.46Å; Y65-H105 WeakPolarHBondContact CD2-CD2 3.31Å; Y65-H105 AromaticContact CD2-NE2 3.79Å; Y65-H105 AromaticContact CE2-CD2 3.65Å; Y65-H105 AromaticContact CE2-NE2 3.47Å; Y65-H105 WeakPolarHBondContact CE2-NE2 3.08Å; L72-H105 VanDerWaalsContact CD2-C 3.5Å; L84-H105 WeakPolarHBondContact CD1-NE2 3.46Å; L84-H105 PolarHBondContact O-CE1 3.01Å; L84-H105 VanDerWaalsContact O-CE1 3.24Å; L84-H105 PolarHBondContact O-NE2 3.23Å; Y93-H105 HydrophobicContact CE1-CB 3.73Å; Y93-H105 HydrophobicContact CE2-CB 4.17Å; Y93-H105 VanDerWaalsContact CZ-CB 3.49Å; Y93-H105 WeakPolarHBondContact OH-CB 3.48Å; K103-H105 PolarHBondContact O-N 3.41Å; H105-F107 AromaticContact CE1-CD2 3.31Å; H105-F107 WeakPolarHBondContact CE1-CD2 3.21Å; H105-F107 AromaticContact CE1-CE1 3.99Å; H105-F107 AromaticContact CE1-CE2 3.27Å; H105-F107 WeakPolarHBondContact CE1-CE2 3.41Å; H105-F107 AromaticContact CE1-CG 3.66Å; H105-F107 AromaticContact CE1-CZ 3.61Å; H105-F107 AromaticContact ND1-CD1 3.78Å; H105-F107 AromaticContact ND1-CD2 3.08Å; H105-F107 WeakPolarHBondContact ND1-CD2 3.42Å; H105-F107 AromaticContact ND1-CE2 3.6Å; H105-F107 AromaticContact ND1-CG 3.15Å; H105-F107 WeakPolarHBondContact ND1-CG 3.47Å; H105-F107 PolarHBondContact ND1-N 3.16Å; H105-F107 PolarHBondContact O-N 2.78Å; H105-F107 VanDerWaalsContact O-N 3.16Å; H105-T108 WeakPolarHBondContact O-CB 3.47Å; H105-T108 PolarHBondContact O-N 3.16Å
106	V	97.7	Very high	95.4	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-25.4	173.6	65.4	0	0	0	0	112	Y65 L72 Y85 T108 V109 G110 T141 L145	Y65-V106 HydrophobicContact CE1-CB 4.1Å; L72-V106 HydrophobicContact CD2-CB 4.33Å; Y85-V106 HydrophobicContact CE1-CG1 4.4Å; V106-T108 VanDerWaalsContact C-N 3.34Å; V106-V109 WeakPolarHBondContact O-CB 3.5Å; V106-V109 PolarHBondContact O-N 3.21Å; V106-G110 PolarHBondContact O-N 3.1Å; V106-T141 HydrophobicContact CG2-CG2 3.83Å; V106-L145 HydrophobicContact CG2-CD1 4.16Å; V106-L145 HydrophobicContact CG2-CD2 3.65Å; V106-L145 HydrophobicContact CG2-CG 3.65Å
107	F	97.9	Very high	95.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.5	-29.1	176.4	-59.1	-25.6	0	0	0	112.8	Y85 L89 M90 Y93 H105 V109 G110 E111 C144 F148	Y85-F107 HydrophobicContact CD1-CZ 4.15Å; L89-F107 HydrophobicContact CB-CE2 4.31Å; L89-F107 HydrophobicContact CD2-CD2 4.41Å; L89-F107 HydrophobicContact CD2-CE2 4.09Å; L89-F107 HydrophobicContact CG-CD2 4.22Å; L89-F107 HydrophobicContact CG-CE2 4.14Å; M90-F107 HydrophobicContact CB-CE2 4.38Å; M90-F107 HydrophobicContact CE-CE1 3.78Å; M90-F107 HydrophobicContact CE-CZ 3.5Å; M90-F107 HydrophobicContact CG-CD1 4.36Å; M90-F107 HydrophobicContact CG-CD2 4.11Å; M90-F107 HydrophobicContact CG-CE1 3.78Å; M90-F107 HydrophobicContact CG-CE2 3.51Å; M90-F107 HydrophobicContact CG-CZ 3.34Å; M90-F107 HydrophobicContact SD-CE1 4.48Å; M90-F107 HydrophobicContact SD-CZ 4.26Å; Y93-F107 HydrophobicContact CD1-CB 3.91Å; Y93-F107 HydrophobicContact CD2-CB 4.06Å; Y93-F107 AromaticContact CD2-CD2 3.99Å; Y93-F107 HydrophobicContact CD2-CD2 3.99Å; Y93-F107 HydrophobicContact CE2-CD2 4.49Å; Y93-F107 HydrophobicContact CG-CB 3.61Å; Y93-F107 HydrophobicContact CG-CD2 4.38Å; H105-F107 AromaticContact CE1-CD2 3.31Å; H105-F107 WeakPolarHBondContact CE1-CD2 3.21Å; H105-F107 AromaticContact CE1-CE1 3.99Å; H105-F107 AromaticContact CE1-CE2 3.27Å; H105-F107 WeakPolarHBondContact CE1-CE2 3.41Å; H105-F107 AromaticContact CE1-CG 3.66Å; H105-F107 AromaticContact CE1-CZ 3.61Å; H105-F107 AromaticContact ND1-CD1 3.78Å; H105-F107 AromaticContact ND1-CD2 3.08Å; H105-F107 WeakPolarHBondContact ND1-CD2 3.42Å; H105-F107 AromaticContact ND1-CE2 3.6Å; H105-F107 AromaticContact ND1-CG 3.15Å; H105-F107 WeakPolarHBondContact ND1-CG 3.47Å; H105-F107 PolarHBondContact ND1-N 3.16Å; H105-F107 PolarHBondContact O-N 2.78Å; H105-F107 VanDerWaalsContact O-N 3.16Å; F107-V109 VanDerWaalsContact C-N 3.31Å; F107-V109 PolarHBondContact O-N 2.71Å; F107-G110 PolarHBondContact O-N 2.91Å; F107-E111 WeakPolarHBondContact O-CB 3.15Å; F107-E111 PolarHBondContact O-N 3.49Å; F107-C144 WeakPolarHBondContact CE1-SG 3.34Å; F107-F148 HydrophobicContact CB-CD2 3.9Å; F107-F148 HydrophobicContact CB-CE2 3.81Å; F107-F148 HydrophobicContact CD1-CB 3.87Å; F107-F148 AromaticContact CD1-CD2 3.43Å; F107-F148 HydrophobicContact CD1-CD2 3.43Å; F107-F148 VanDerWaalsContact CD1-CD2 3.43Å; F107-F148 HydrophobicContact CD1-CE2 4.24Å; F107-F148 AromaticContact CD1-CG 3.85Å; F107-F148 HydrophobicContact CD1-CG 3.85Å; F107-F148 HydrophobicContact CD2-CD2 4.43Å; F107-F148 HydrophobicContact CE1-CB 3.98Å; F107-F148 HydrophobicContact CE1-CD2 4.07Å; F107-F148 HydrophobicContact CE1-CG 4.39Å; F107-F148 AromaticContact CG-CD2 3.67Å; F107-F148 HydrophobicContact CG-CD2 3.67Å; F107-F148 HydrophobicContact CG-CE2 4.05Å; F107-F148 HydrophobicContact CG-CG 4.47Å
108	T	97.5	Very high	95.1	Very high	24 Å²	24	51.3 Å²	51.3	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-41.9	170.7	-51.5	0	0	0	0	110.9	Y93 P99 H105 V106 Q112	Y93-T108 WeakPolarHBondContact CE1-OG1 3.3Å; P99-T108 HydrophobicContact CB-CG2 4.4Å; H105-T108 WeakPolarHBondContact O-CB 3.47Å; H105-T108 PolarHBondContact O-N 3.16Å; V106-T108 VanDerWaalsContact C-N 3.34Å; T108-Q112 WeakPolarHBondContact O-CB 3.48Å; T108-Q112 PolarHBondContact O-N 2.8Å
109	V	97.5	Very high	94.8	Very high	48 Å²	48	51.2 Å²	51.2	29%	0.291	25%	0.252	S	S	.	.	H	α-helix	trans	-66.6	-44.6	177.8	-178.9	0	0	0	0	110.9	L72 V106 F107 T113 I128	L72-V109 HydrophobicContact CB-CG2 4.16Å; L72-V109 HydrophobicContact CD2-CG2 3.98Å; V106-V109 WeakPolarHBondContact O-CB 3.5Å; V106-V109 PolarHBondContact O-N 3.21Å; F107-V109 VanDerWaalsContact C-N 3.31Å; F107-V109 PolarHBondContact O-N 2.71Å; V109-T113 WeakPolarHBondContact O-CB 3.41Å; V109-T113 PolarHBondContact O-N 3.3Å; V109-T113 VanDerWaalsContact O-N 3.09Å; V109-T113 PolarHBondContact O-OG1 3.36Å; V109-I128 HydrophobicContact CG1-CD1 4.07Å; V109-I128 HydrophobicContact CG1-CG1 4.23Å; V109-I128 HydrophobicContact CG1-CG2 4.15Å
110	G	97.2	Very high	94.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-48.3	175.5	0	0	0	0	0	112.3	V106 F107 T113 Y114 Y149	V106-G110 PolarHBondContact O-N 3.1Å; F107-G110 PolarHBondContact O-N 2.91Å; G110-T113 WeakPolarHBondContact O-CB 3.4Å; G110-T113 PolarHBondContact O-N 2.8Å; G110-Y114 WeakPolarHBondContact O-CB 3.34Å; G110-Y114 PolarHBondContact O-N 3.48Å; G110-Y149 WeakPolarHBondContact O-CE1 3.44Å; G110-Y149 PolarHBondContact O-OH 2.97Å
111	E	96.9	Very high	93.9	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-42.9	179.8	-176.9	59.2	-165.1	0	0	112.1	H94 P99 F107 T113 Y114 R115 F148	H94-E111 IonicContact CE1-OE1 3.99Å; H94-E111 IonicContact CE1-OE2 3.89Å; H94-E111 IonicContact CG-OE2 3.01Å; H94-E111 IonicContact ND1-OE1 3.34Å; H94-E111 PolarHBondContact ND1-OE1 3Å; H94-E111 IonicContact ND1-OE2 2.86Å; H94-E111 PolarHBondContact ND1-OE2 2.93Å; P99-E111 HydrophobicContact CB-CG 4.23Å; P99-E111 HydrophobicContact CG-CB 4.48Å; P99-E111 HydrophobicContact CG-CG 3.92Å; F107-E111 WeakPolarHBondContact O-CB 3.15Å; F107-E111 PolarHBondContact O-N 3.49Å; E111-T113 VanDerWaalsContact C-N 3.28Å; E111-T113 PolarHBondContact O-N 3.49Å; E111-Y114 PolarHBondContact O-N 3.45Å; E111-R115 HydrophobicContact CG-CG 4.47Å; E111-R115 WeakPolarHBondContact O-CB 3.36Å; E111-R115 WeakPolarHBondContact O-CG 3.4Å; E111-R115 PolarHBondContact O-N 3.15Å; E111-R115 IonicContact OE1-CZ 3.27Å; E111-R115 VanDerWaalsContact OE1-CZ 3.27Å; E111-R115 IonicContact OE1-NE 2.68Å; E111-R115 PolarHBondContact OE1-NE 3.39Å; E111-R115 IonicContact OE1-NH2 2.95Å; E111-R115 PolarHBondContact OE1-NH2 3.2Å; E111-F148 HydrophobicContact CB-CE1 4.29Å; E111-F148 HydrophobicContact CB-CZ 3.9Å; E111-F148 WeakPolarHBondContact OE2-CZ 3.38Å
112	Q	95.4	Very high	93.7	Very high	85 Å²	85	58.4 Å²	58.4	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-59.7	-43.1	176.1	-174.4	62.1	57.3	0	0	111.1	T108 R115 N116	T108-Q112 WeakPolarHBondContact O-CB 3.48Å; T108-Q112 PolarHBondContact O-N 2.8Å; Q112-R115 PolarHBondContact O-N 3.16Å; Q112-N116 PolarHBondContact NE2-OD1 3.27Å; Q112-N116 WeakPolarHBondContact O-CB 3.44Å; Q112-N116 PolarHBondContact O-N 3.21Å; Q112-N116 PolarHBondContact O-OD1 3.08Å; Q112-N116 VanDerWaalsContact O-OD1 3.14Å
113	T	95.4	Very high	93.4	Very high	24 Å²	24	60.1 Å²	60.1	15%	0.147	31%	0.309	C	S	.	.	H	α-helix	trans	-63.9	-45	177.4	-64.6	0	0	0	0	111.3	V109 G110 E111 N116 V117 Q126 I128 Y149	V109-T113 WeakPolarHBondContact O-CB 3.41Å; V109-T113 PolarHBondContact O-N 3.3Å; V109-T113 VanDerWaalsContact O-N 3.09Å; V109-T113 PolarHBondContact O-OG1 3.36Å; G110-T113 WeakPolarHBondContact O-CB 3.4Å; G110-T113 PolarHBondContact O-N 2.8Å; E111-T113 VanDerWaalsContact C-N 3.28Å; E111-T113 PolarHBondContact O-N 3.49Å; T113-N116 PolarHBondContact O-N 3.46Å; T113-V117 WeakPolarHBondContact O-CG2 3.49Å; T113-V117 PolarHBondContact O-N 3.4Å; T113-Q126 HydrophobicContact CG2-CB 3.59Å; T113-Q126 HydrophobicContact CG2-CG 4Å; T113-I128 HydrophobicContact CG2-CD1 4.23Å; T113-I128 HydrophobicContact CG2-CG1 4.46Å; T113-Y149 WeakPolarHBondContact CB-OH 3.32Å; T113-Y149 WeakPolarHBondContact CG2-OH 3.33Å
114	Y	94.9	Very high	93.2	Very high	48 Å²	48	58.5 Å²	58.5	19%	0.188	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-47.5	176.7	-179.7	-96.4	0	0	0	111.9	H94 G110 E111 N116 V117 K118 V152	H94-Y114 AromaticContact CE1-CE1 3.76Å; G110-Y114 WeakPolarHBondContact O-CB 3.34Å; G110-Y114 PolarHBondContact O-N 3.48Å; E111-Y114 PolarHBondContact O-N 3.45Å; Y114-N116 PolarHBondContact O-N 3.32Å; Y114-V117 PolarHBondContact O-N 3.06Å; Y114-K118 HydrophobicContact CE1-CD 4.16Å; Y114-K118 HydrophobicContact CE1-CG 4.21Å; Y114-K118 PolarHBondContact O-N 3.43Å; Y114-K118 VanDerWaalsContact OH-CE 3.32Å; Y114-K118 WeakPolarHBondContact OH-CE 3.46Å; Y114-V152 HydrophobicContact CD2-CG2 4.24Å; Y114-V152 HydrophobicContact CE2-CG2 4.27Å
115	R	93.6	Very high	93.1	Very high	67 Å²	67	65.7 Å²	65.7	25%	0.253	35%	0.346	S	S	.	.	H	α-helix	trans	-62.5	-42.4	177.7	-72	-178.4	-170.7	-171.4	6.2	112.4	H94 A96 P97 E111 Q112 V117 K118 S119	H94-R115 PolarHBondContact O-NH2 3.47Å; A96-R115 PolarHBondContact O-NH1 3.41Å; A96-R115 PolarHBondContact O-NH2 2.93Å; P97-R115 PolarHBondContact O-NH1 3.22Å; E111-R115 HydrophobicContact CG-CG 4.47Å; E111-R115 WeakPolarHBondContact O-CB 3.36Å; E111-R115 WeakPolarHBondContact O-CG 3.4Å; E111-R115 PolarHBondContact O-N 3.15Å; E111-R115 IonicContact OE1-CZ 3.27Å; E111-R115 VanDerWaalsContact OE1-CZ 3.27Å; E111-R115 IonicContact OE1-NE 2.68Å; E111-R115 PolarHBondContact OE1-NE 3.39Å; E111-R115 IonicContact OE1-NH2 2.95Å; E111-R115 PolarHBondContact OE1-NH2 3.2Å; Q112-R115 PolarHBondContact O-N 3.16Å; R115-V117 VanDerWaalsContact C-N 3.26Å; R115-V117 PolarHBondContact O-N 3.32Å; R115-K118 PolarHBondContact O-N 3.34Å; R115-K118 VanDerWaalsContact O-N 3.13Å; R115-S119 VanDerWaalsContact O-CB 3.28Å; R115-S119 WeakPolarHBondContact O-CB 3.41Å; R115-S119 PolarHBondContact O-N 3.07Å; R115-S119 PolarHBondContact O-OG 2.86Å; R115-S119 VanDerWaalsContact O-OG 3.13Å
116	N	93.4	Very high	93	Very high	51 Å²	51	69 Å²	69	27%	0.273	36%	0.362	S	S	.	.	H	α-helix	trans	-58.7	-39.2	177.9	-71.6	-3.4	0	0	0	112.1	Q112 T113 Y114 S119 Q126	Q112-N116 PolarHBondContact NE2-OD1 3.27Å; Q112-N116 WeakPolarHBondContact O-CB 3.44Å; Q112-N116 PolarHBondContact O-N 3.21Å; Q112-N116 PolarHBondContact O-OD1 3.08Å; Q112-N116 VanDerWaalsContact O-OD1 3.14Å; T113-N116 PolarHBondContact O-N 3.46Å; Y114-N116 PolarHBondContact O-N 3.32Å; N116-S119 PolarHBondContact O-OG 3.49Å; N116-Q126 HydrophobicContact CB-CG 4.21Å; N116-Q126 PolarHBondContact ND2-OE1 3.34Å
117	V	92.8	Very high	92.9	Very high	57 Å²	57	73.9 Å²	73.9	35%	0.345	40%	0.396	S	S	.	.	H	α-helix	trans	-68.8	-43.5	175.6	176	0	0	0	0	110.8	T113 Y114 R115 P123 Q126	T113-V117 WeakPolarHBondContact O-CG2 3.49Å; T113-V117 PolarHBondContact O-N 3.4Å; Y114-V117 PolarHBondContact O-N 3.06Å; R115-V117 VanDerWaalsContact C-N 3.26Å; R115-V117 PolarHBondContact O-N 3.32Å; V117-P123 HydrophobicContact CG1-CB 4.05Å; V117-Q126 HydrophobicContact CG2-CB 4.44Å; V117-Q126 HydrophobicContact CG2-CG 3.55Å
118	K	89.6	Confident	92.9	Very high	124 Å²	124	76.6 Å²	76.6	54%	0.539	41%	0.41	S	S	.	.	H	α-helix	trans	-75	-25.7	-177.6	-98.3	-136.6	173.2	-172.7	0	114.9	Y114 R115 L120	Y114-K118 HydrophobicContact CE1-CD 4.16Å; Y114-K118 HydrophobicContact CE1-CG 4.21Å; Y114-K118 PolarHBondContact O-N 3.43Å; Y114-K118 VanDerWaalsContact OH-CE 3.32Å; Y114-K118 WeakPolarHBondContact OH-CE 3.46Å; R115-K118 PolarHBondContact O-N 3.34Å; R115-K118 VanDerWaalsContact O-N 3.13Å; K118-L120 VanDerWaalsContact C-N 3.29Å; K118-L120 PolarHBondContact O-N 3.21Å
119	S	87.1	Confident	92.9	Very high	87 Å²	87	81.6 Å²	81.6	61%	0.608	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.8	-171.8	59.1	0	0	0	0	114.3	R115 N116	R115-S119 VanDerWaalsContact O-CB 3.28Å; R115-S119 WeakPolarHBondContact O-CB 3.41Å; R115-S119 PolarHBondContact O-N 3.07Å; R115-S119 PolarHBondContact O-OG 2.86Å; R115-S119 VanDerWaalsContact O-OG 3.13Å; N116-S119 PolarHBondContact O-OG 3.49Å
120	L	82.1	Confident	92.9	Very high	82 Å²	82	81.6 Å²	81.6	43%	0.429	44%	0.44	S	S	.	.	S	Bend	trans	-103.8	139.5	-174.4	-58.7	176.8	0	0	0	110.3	K118 E122 V124	K118-L120 VanDerWaalsContact C-N 3.29Å; K118-L120 PolarHBondContact O-N 3.21Å; L120-E122 VanDerWaalsContact CB-O 3.22Å; L120-E122 WeakPolarHBondContact CB-O 3.48Å; L120-E122 PolarHBondContact O-N 3.23Å; L120-V124 HydrophobicContact CD1-CB 4.05Å; L120-V124 HydrophobicContact CD1-CG2 3.68Å
121	I	82.6	Confident	93	Very high	178 Å²	178	86.6 Å²	86.6	91%	0.913	48%	0.475	S	S	*	.	S	Bend	trans	-58.6	-41	172.6	-60.9	173.2	0	0	0	109.6
122	E	88.3	Confident	92.9	Very high	161 Å²	161	88.6 Å²	88.6	75%	0.752	50%	0.497	S	S	*	.	S	Bend	trans	-107.8	107.9	169.9	-67.1	-172.6	168.3	0	0	109.1	L120 V124	L120-E122 VanDerWaalsContact CB-O 3.22Å; L120-E122 WeakPolarHBondContact CB-O 3.48Å; L120-E122 PolarHBondContact O-N 3.23Å; E122-V124 PolarHBondContact O-N 3.32Å
123	P	89.3	Confident	93	Very high	88 Å²	88	92.5 Å²	92.5	57%	0.571	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-61.8	132.2	-178.3	-24.2	34	0	0	0	112.2	V117	V117-P123 HydrophobicContact CG1-CB 4.05Å
124	V	93.4	Very high	93.1	Very high	83 Å²	83	97.2 Å²	97.2	50%	0.503	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-102.2	128.2	174.2	177.9	0	0	0	0	109.8	L120 E122 Q126	L120-V124 HydrophobicContact CD1-CB 4.05Å; L120-V124 HydrophobicContact CD1-CG2 3.68Å; E122-V124 PolarHBondContact O-N 3.32Å; V124-Q126 PolarHBondContact O-N 3.46Å; V124-Q126 PolarHBondContact O-NE2 2.73Å
125	N	94.1	Very high	93.1	Very high	159 Å²	159	97.2 Å²	97.2	85%	0.85	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-56.3	132.8	177.4	-69	-34.2	0	0	0	111.5
126	Q	95.8	Very high	93.2	Very high	76 Å²	76	96 Å²	96	36%	0.355	57%	0.568	S	S	.	*			trans	-109.2	154.2	179.4	-57.2	-65.1	-72	0	0	110.7	T113 N116 V117 V124	T113-Q126 HydrophobicContact CG2-CB 3.59Å; T113-Q126 HydrophobicContact CG2-CG 4Å; N116-Q126 HydrophobicContact CB-CG 4.21Å; N116-Q126 PolarHBondContact ND2-OE1 3.34Å; V117-Q126 HydrophobicContact CG2-CB 4.44Å; V117-Q126 HydrophobicContact CG2-CG 3.55Å; V124-Q126 PolarHBondContact O-N 3.46Å; V124-Q126 PolarHBondContact O-NE2 2.73Å
127	S	96.9	Very high	93.3	Very high	106 Å²	106	94.4 Å²	94.4	74%	0.741	56%	0.564	S	S	*	*			trans	-129	138.2	174	63.6	0	0	0	0	111.1
128	I	97.5	Very high	93.5	Very high	57 Å²	57	94.9 Å²	94.9	29%	0.292	56%	0.561	S	S	.	*			trans	-114.5	117.1	171	-60.9	172.7	0	0	0	107.2	V109 T113 V130 L145 Y149	V109-I128 HydrophobicContact CG1-CD1 4.07Å; V109-I128 HydrophobicContact CG1-CG1 4.23Å; V109-I128 HydrophobicContact CG1-CG2 4.15Å; T113-I128 HydrophobicContact CG2-CD1 4.23Å; T113-I128 HydrophobicContact CG2-CG1 4.46Å; I128-V130 HydrophobicContact CG2-CG2 4.19Å; I128-L145 HydrophobicContact CD1-CD1 3.98Å; I128-L145 HydrophobicContact CD1-CD2 3.99Å; I128-L145 HydrophobicContact CG2-CD1 3.94Å; I128-Y149 VanDerWaalsContact CD1-OH 3.29Å; I128-Y149 WeakPolarHBondContact CD1-OH 3.4Å
129	V	97.9	Very high	93.9	Very high	128 Å²	128	94.8 Å²	94.8	78%	0.776	57%	0.571	S	S	*	*			trans	-94.5	120.4	178.1	-177.8	0	0	0	0	109.2
130	V	97.7	Very high	94.2	Very high	48 Å²	48	96.5 Å²	96.5	29%	0.291	56%	0.564	S	S	.	*			trans	-112	108.3	176.8	-170.9	0	0	0	0	109	I128 K138 T141	I128-V130 HydrophobicContact CG2-CG2 4.19Å; V130-K138 HydrophobicContact CG1-CB 3.97Å; V130-K138 HydrophobicContact CG1-CG 4.1Å; V130-T141 HydrophobicContact CG1-CG2 4.14Å; V130-T141 HydrophobicContact CG2-CG2 4.29Å
131	S	97.5	Very high	94.9	Very high	105 Å²	105	93.5 Å²	93.5	73%	0.734	55%	0.549	S	S	*	.			trans	-109.9	167.1	-178.5	62.4	0	0	0	0	112.2
132	G	96.7	Very high	95.6	Very high	46 Å²	46	87.5 Å²	87.5	47%	0.474	52%	0.524	S	S	.	.			trans	138.7	165.8	179.4	0	0	0	0	0	113	K138	G132-K138 WeakPolarHBondContact O-CD 3.44Å; G132-K138 WeakPolarHBondContact O-CE 3.4Å; G132-K138 PolarHBondContact O-NZ 2.86Å
133	E	97.1	Very high	96	Very high	167 Å²	167	85.5 Å²	85.5	78%	0.78	51%	0.509	S	S	*	.	S	Bend	trans	-71	176	179.5	-64.8	-175.1	176.8	0	0	113	G135 A136 K138	E133-G135 PolarHBondContact O-N 2.94Å; E133-A136 VanDerWaalsContact O-CB 3.25Å; E133-A136 WeakPolarHBondContact O-CB 3.49Å; E133-A136 PolarHBondContact O-N 2.84Å; E133-K138 PolarHBondContact O-NZ 3.24Å
134	S	97.3	Very high	96.3	Very high	124 Å²	124	81.6 Å²	81.6	87%	0.867	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	135.9	172.4	-167.9	0	0	0	0	110.2	A136	S134-A136 VanDerWaalsContact C-N 3.26Å; S134-A136 PolarHBondContact O-N 2.98Å
135	G	94.6	Very high	96.5	Very high	47 Å²	47	78 Å²	78	49%	0.485	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	-5.1	-177.4	0	0	0	0	0	116.1	N76 E133 G137	N76-G135 PolarHBondContact ND2-O 3.21Å; E133-G135 PolarHBondContact O-N 2.94Å; G135-G137 PolarHBondContact O-N 2.99Å; G135-G137 VanDerWaalsContact O-N 3.07Å
136	A	95.8	Very high	96.6	Very high	41 Å²	41	76.3 Å²	76.3	34%	0.339	45%	0.45	S	S	.	.	S	Bend	trans	-67.1	-8.5	179.9	0	0	0	0	0	115	E133 S134	E133-A136 VanDerWaalsContact O-CB 3.25Å; E133-A136 WeakPolarHBondContact O-CB 3.49Å; E133-A136 PolarHBondContact O-N 2.84Å; S134-A136 VanDerWaalsContact C-N 3.26Å; S134-A136 PolarHBondContact O-N 2.98Å
137	G	95.6	Very high	96.6	Very high	19 Å²	19	77.7 Å²	77.7	20%	0.196	46%	0.455	C	S	.	.	S	Bend	trans	99.4	8.8	177.7	0	0	0	0	0	115.7	G135 T139 W140 T141	G135-G137 PolarHBondContact O-N 2.99Å; G135-G137 VanDerWaalsContact O-N 3.07Å; G137-T139 PolarHBondContact O-N 2.97Å; G137-W140 WeakPolarHBondContact O-CB 3.19Å; G137-W140 PolarHBondContact O-N 3.34Å; G137-W140 VanDerWaalsContact O-N 3.08Å; G137-T141 PolarHBondContact O-N 3.38Å; G137-T141 PolarHBondContact O-OG1 2.76Å
138	K	97.6	Very high	96.6	Very high	67 Å²	67	72.7 Å²	72.7	29%	0.291	42%	0.42	S	S	.	.	H	α-helix	trans	-49.4	-54.7	-179.2	-58.1	-172.4	-66.1	-74.7	0	113.8	V130 G132 E133 W140 T141 S142	V130-K138 HydrophobicContact CG1-CB 3.97Å; V130-K138 HydrophobicContact CG1-CG 4.1Å; G132-K138 WeakPolarHBondContact O-CD 3.44Å; G132-K138 WeakPolarHBondContact O-CE 3.4Å; G132-K138 PolarHBondContact O-NZ 2.86Å; E133-K138 PolarHBondContact O-NZ 3.24Å; K138-W140 VanDerWaalsContact C-N 3.27Å; K138-W140 PolarHBondContact O-N 2.68Å; K138-T141 PolarHBondContact O-N 2.87Å; K138-S142 PolarHBondContact O-N 3.49Å; K138-S142 PolarHBondContact O-OG 3.26Å
139	T	96.6	Very high	96.6	Very high	122 Å²	122	72.4 Å²	72.4	75%	0.748	42%	0.415	S	S	*	.	H	α-helix	trans	-59.8	-38.1	179.9	-51.9	0	0	0	0	112.1	G137 R143	G137-T139 PolarHBondContact O-N 2.97Å; T139-R143 WeakPolarHBondContact O-CB 3.25Å; T139-R143 PolarHBondContact O-N 2.95Å
140	W	94.7	Very high	96.4	Very high	122 Å²	122	69 Å²	69	46%	0.462	40%	0.401	S	S	.	.	H	α-helix	trans	-67.3	-46.2	177.7	-174.5	-91.9	0	0	0	111.5	Y85 G137 K138 S142 R143 C144	Y85-W140 HydrophobicContact CD2-CZ2 4.22Å; Y85-W140 AromaticContact CD2-NE1 3.68Å; Y85-W140 HydrophobicContact CE2-CZ2 4.34Å; Y85-W140 AromaticContact CE2-NE1 3.14Å; Y85-W140 AromaticContact CZ-NE1 3.49Å; G137-W140 WeakPolarHBondContact O-CB 3.19Å; G137-W140 PolarHBondContact O-N 3.34Å; G137-W140 VanDerWaalsContact O-N 3.08Å; K138-W140 VanDerWaalsContact C-N 3.27Å; K138-W140 PolarHBondContact O-N 2.68Å; W140-S142 PolarHBondContact O-N 2.95Å; W140-R143 VanDerWaalsContact CE3-NH2 3.31Å; W140-R143 WeakPolarHBondContact O-CB 3.36Å; W140-R143 PolarHBondContact O-N 3.25Å; W140-C144 WeakPolarHBondContact O-CB 3.48Å; W140-C144 PolarHBondContact O-N 3.09Å
141	T	96.6	Very high	96.3	Very high	19 Å²	19	68.4 Å²	68.4	12%	0.117	40%	0.397	C	S	.	.	H	α-helix	trans	-57.8	-47.6	176	-62.7	0	0	0	0	111.5	V106 V130 G137 K138 R143 C144 L145	V106-T141 HydrophobicContact CG2-CG2 3.83Å; V130-T141 HydrophobicContact CG1-CG2 4.14Å; V130-T141 HydrophobicContact CG2-CG2 4.29Å; G137-T141 PolarHBondContact O-N 3.38Å; G137-T141 PolarHBondContact O-OG1 2.76Å; K138-T141 PolarHBondContact O-N 2.87Å; T141-R143 VanDerWaalsContact C-N 3.34Å; T141-R143 PolarHBondContact O-N 3Å; T141-C144 WeakPolarHBondContact O-CB 3.45Å; T141-C144 PolarHBondContact O-N 3.24Å; T141-C144 VanDerWaalsContact O-N 3.16Å; T141-L145 PolarHBondContact O-N 3.12Å
142	S	96.9	Very high	96	Very high	53 Å²	53	63.4 Å²	63.4	37%	0.371	36%	0.363	S	S	.	.	H	α-helix	trans	-59.9	-43.2	175.9	-58.8	0	0	0	0	112.1	K138 W140 C144 L145 M146	K138-S142 PolarHBondContact O-N 3.49Å; K138-S142 PolarHBondContact O-OG 3.26Å; W140-S142 PolarHBondContact O-N 2.95Å; S142-C144 VanDerWaalsContact C-N 3.3Å; S142-C144 PolarHBondContact O-N 2.83Å; S142-L145 PolarHBondContact O-N 2.88Å; S142-M146 WeakPolarHBondContact O-CG 3.48Å; S142-M146 PolarHBondContact O-N 3.38Å; S142-M146 VanDerWaalsContact O-N 3.1Å
143	R	95.9	Very high	95.5	Very high	119 Å²	119	64.1 Å²	64.1	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-37.9	176.2	-169.5	175.1	74.8	151.4	11.3	112.2	T139 W140 T141 M146 K147	T139-R143 WeakPolarHBondContact O-CB 3.25Å; T139-R143 PolarHBondContact O-N 2.95Å; W140-R143 VanDerWaalsContact CE3-NH2 3.31Å; W140-R143 WeakPolarHBondContact O-CB 3.36Å; W140-R143 PolarHBondContact O-N 3.25Å; T141-R143 VanDerWaalsContact C-N 3.34Å; T141-R143 PolarHBondContact O-N 3Å; R143-M146 PolarHBondContact O-N 2.92Å; R143-K147 WeakPolarHBondContact O-CG 3.14Å; R143-K147 PolarHBondContact O-N 3.03Å
144	C	95.9	Very high	94.8	Very high	6 Å²	6	61.5 Å²	61.5	4%	0.041	36%	0.359	C	S	.	.	H	α-helix	trans	-64.5	-42.5	177.1	-171.5	0	0	0	0	111.9	Y85 F107 W140 T141 S142 K147 F148	Y85-C144 HydrophobicContact CD1-CB 4.43Å; Y85-C144 WeakPolarHBondContact CD1-SG 3.47Å; Y85-C144 HydrophobicContact CE1-CB 4.47Å; Y85-C144 VanDerWaalsContact CE1-SG 3.56Å; F107-C144 WeakPolarHBondContact CE1-SG 3.34Å; W140-C144 WeakPolarHBondContact O-CB 3.48Å; W140-C144 PolarHBondContact O-N 3.09Å; T141-C144 WeakPolarHBondContact O-CB 3.45Å; T141-C144 PolarHBondContact O-N 3.24Å; T141-C144 VanDerWaalsContact O-N 3.16Å; S142-C144 VanDerWaalsContact C-N 3.3Å; S142-C144 PolarHBondContact O-N 2.83Å; C144-K147 PolarHBondContact O-N 3.39Å; C144-F148 PolarHBondContact O-N 3.05Å
145	L	97.6	Very high	93.3	Very high	7 Å²	7	57 Å²	57	4%	0.037	33%	0.328	C	S	.	.	H	α-helix	trans	-60.1	-45.4	173.6	-75.9	164.4	0	0	0	112	V106 I128 T141 S142 K147 F148 Y149	V106-L145 HydrophobicContact CG2-CD1 4.16Å; V106-L145 HydrophobicContact CG2-CD2 3.65Å; V106-L145 HydrophobicContact CG2-CG 3.65Å; I128-L145 HydrophobicContact CD1-CD1 3.98Å; I128-L145 HydrophobicContact CD1-CD2 3.99Å; I128-L145 HydrophobicContact CG2-CD1 3.94Å; T141-L145 PolarHBondContact O-N 3.12Å; S142-L145 PolarHBondContact O-N 2.88Å; L145-K147 VanDerWaalsContact C-N 3.32Å; L145-K147 PolarHBondContact O-N 3.4Å; L145-F148 WeakPolarHBondContact O-CB 3.44Å; L145-F148 PolarHBondContact O-N 3.42Å; L145-Y149 HydrophobicContact CB-CE2 4.36Å; L145-Y149 WeakPolarHBondContact O-CD2 3.41Å; L145-Y149 PolarHBondContact O-N 3.23Å
146	M	96.9	Very high	91.4	Very high	123 Å²	123	59.2 Å²	59.2	61%	0.606	33%	0.334	S	S	*	.	H	α-helix	trans	-61.7	-40.5	177.6	-66.1	-59.3	121.7	0	0	112.2	S142 R143 Y149 A150	S142-M146 WeakPolarHBondContact O-CG 3.48Å; S142-M146 PolarHBondContact O-N 3.38Å; S142-M146 VanDerWaalsContact O-N 3.1Å; R143-M146 PolarHBondContact O-N 2.92Å; M146-Y149 HydrophobicContact CE-CD2 4.12Å; M146-Y149 HydrophobicContact CE-CE2 4.18Å; M146-Y149 PolarHBondContact O-N 2.95Å; M146-A150 PolarHBondContact O-N 3.05Å
147	K	95.9	Very high	89.4	Confident	106 Å²	106	61.1 Å²	61.1	46%	0.461	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-44.1	174.2	-73.4	-180	175.8	-169.5	0	112	M90 R143 C144 L145 Y149 A150 V151	M90-K147 HydrophobicContact CE-CB 3.92Å; R143-K147 WeakPolarHBondContact O-CG 3.14Å; R143-K147 PolarHBondContact O-N 3.03Å; C144-K147 PolarHBondContact O-N 3.39Å; L145-K147 VanDerWaalsContact C-N 3.32Å; L145-K147 PolarHBondContact O-N 3.4Å; K147-Y149 VanDerWaalsContact C-N 3.34Å; K147-Y149 PolarHBondContact O-N 3.1Å; K147-A150 PolarHBondContact O-N 3.33Å; K147-V151 WeakPolarHBondContact O-CG2 3.46Å; K147-V151 PolarHBondContact O-N 3.22Å
148	F	97.1	Very high	87.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-55.3	-50.5	175.5	175.9	-94.5	0	0	0	110.8	M90 F107 E111 C144 L145 A150 V151 V152	M90-F148 HydrophobicContact CB-CD2 3.83Å; M90-F148 HydrophobicContact CB-CE2 4.31Å; M90-F148 HydrophobicContact CG-CD2 3.95Å; M90-F148 WeakPolarHBondContact O-CE2 3.32Å; M90-F148 HydrophobicContact SD-CB 4.44Å; F107-F148 HydrophobicContact CB-CD2 3.9Å; F107-F148 HydrophobicContact CB-CE2 3.81Å; F107-F148 HydrophobicContact CD1-CB 3.87Å; F107-F148 AromaticContact CD1-CD2 3.43Å; F107-F148 HydrophobicContact CD1-CD2 3.43Å; F107-F148 VanDerWaalsContact CD1-CD2 3.43Å; F107-F148 HydrophobicContact CD1-CE2 4.24Å; F107-F148 AromaticContact CD1-CG 3.85Å; F107-F148 HydrophobicContact CD1-CG 3.85Å; F107-F148 HydrophobicContact CD2-CD2 4.43Å; F107-F148 HydrophobicContact CE1-CB 3.98Å; F107-F148 HydrophobicContact CE1-CD2 4.07Å; F107-F148 HydrophobicContact CE1-CG 4.39Å; F107-F148 AromaticContact CG-CD2 3.67Å; F107-F148 HydrophobicContact CG-CD2 3.67Å; F107-F148 HydrophobicContact CG-CE2 4.05Å; F107-F148 HydrophobicContact CG-CG 4.47Å; E111-F148 HydrophobicContact CB-CE1 4.29Å; E111-F148 HydrophobicContact CB-CZ 3.9Å; E111-F148 WeakPolarHBondContact OE2-CZ 3.38Å; C144-F148 PolarHBondContact O-N 3.05Å; L145-F148 WeakPolarHBondContact O-CB 3.44Å; L145-F148 PolarHBondContact O-N 3.42Å; F148-A150 PolarHBondContact O-N 3.3Å; F148-V151 PolarHBondContact O-N 3.39Å; F148-V151 VanDerWaalsContact O-N 3.15Å; F148-V152 HydrophobicContact CD1-CG1 4.43Å; F148-V152 HydrophobicContact CD2-CG1 4.31Å; F148-V152 HydrophobicContact CE1-CG1 4.01Å; F148-V152 HydrophobicContact CE1-CG2 4.26Å; F148-V152 HydrophobicContact CE2-CG1 3.88Å; F148-V152 HydrophobicContact CZ-CG1 3.71Å; F148-V152 WeakPolarHBondContact O-CG1 3.28Å; F148-V152 WeakPolarHBondContact O-CG2 3.45Å; F148-V152 PolarHBondContact O-N 3.13Å
149	Y	96.4	Very high	84.6	Confident	51 Å²	51	67.8 Å²	67.8	20%	0.2	38%	0.375	C	S	.	.	H	α-helix	trans	-60.5	-41.2	178	-64.4	-44.9	0	0	0	113.5	G110 T113 I128 L145 M146 K147 V151 V152 A153	G110-Y149 WeakPolarHBondContact O-CE1 3.44Å; G110-Y149 PolarHBondContact O-OH 2.97Å; T113-Y149 WeakPolarHBondContact CB-OH 3.32Å; T113-Y149 WeakPolarHBondContact CG2-OH 3.33Å; I128-Y149 VanDerWaalsContact CD1-OH 3.29Å; I128-Y149 WeakPolarHBondContact CD1-OH 3.4Å; L145-Y149 HydrophobicContact CB-CE2 4.36Å; L145-Y149 WeakPolarHBondContact O-CD2 3.41Å; L145-Y149 PolarHBondContact O-N 3.23Å; M146-Y149 HydrophobicContact CE-CD2 4.12Å; M146-Y149 HydrophobicContact CE-CE2 4.18Å; M146-Y149 PolarHBondContact O-N 2.95Å; K147-Y149 VanDerWaalsContact C-N 3.34Å; K147-Y149 PolarHBondContact O-N 3.1Å; Y149-V151 VanDerWaalsContact C-N 3.33Å; Y149-V151 PolarHBondContact O-N 3.42Å; Y149-V152 PolarHBondContact O-N 3.34Å; Y149-A153 WeakPolarHBondContact O-CB 3.45Å; Y149-A153 PolarHBondContact O-N 2.73Å
150	A	95.1	Very high	81.9	Confident	58 Å²	58	69.2 Å²	69.2	48%	0.479	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-40.1	175.8	0	0	0	0	0	112.4	M146 K147 F148 T154	M146-A150 PolarHBondContact O-N 3.05Å; K147-A150 PolarHBondContact O-N 3.33Å; F148-A150 PolarHBondContact O-N 3.3Å; A150-T154 WeakPolarHBondContact O-CG2 3.29Å; A150-T154 PolarHBondContact O-N 3.5Å; A150-T154 PolarHBondContact O-OG1 2.96Å
151	V	93.8	Very high	79.3	Confident	34 Å²	34	68.8 Å²	68.8	21%	0.206	39%	0.389	C	S	.	.	H	α-helix	trans	-68.9	-45.3	178.5	170.4	0	0	0	0	111.6	M90 R91 K147 F148 Y149 T154 S155	M90-V151 HydrophobicContact CB-CG1 4.17Å; M90-V151 HydrophobicContact SD-CB 4.13Å; M90-V151 HydrophobicContact SD-CG2 3.77Å; R91-V151 HydrophobicContact CG-CG1 4.11Å; K147-V151 WeakPolarHBondContact O-CG2 3.46Å; K147-V151 PolarHBondContact O-N 3.22Å; F148-V151 PolarHBondContact O-N 3.39Å; F148-V151 VanDerWaalsContact O-N 3.15Å; Y149-V151 VanDerWaalsContact C-N 3.33Å; Y149-V151 PolarHBondContact O-N 3.42Å; V151-T154 PolarHBondContact O-N 2.81Å; V151-T154 PolarHBondContact O-OG1 3.13Å; V151-T154 VanDerWaalsContact O-OG1 3.1Å; V151-S155 PolarHBondContact O-N 3.46Å
152	V	92.1	Very high	76.4	Confident	1 Å²	1	80.4 Å²	80.4	1%	0.006	44%	0.441	C	S	.	.	H	α-helix	trans	-75	-33.3	-176.9	-56.1	0	0	0	0	112.5	H94 Y114 F148 Y149 T154 S155	H94-V152 HydrophobicContact CB-CB 4.46Å; H94-V152 HydrophobicContact CB-CG1 3.6Å; Y114-V152 HydrophobicContact CD2-CG2 4.24Å; Y114-V152 HydrophobicContact CE2-CG2 4.27Å; F148-V152 HydrophobicContact CD1-CG1 4.43Å; F148-V152 HydrophobicContact CD2-CG1 4.31Å; F148-V152 HydrophobicContact CE1-CG1 4.01Å; F148-V152 HydrophobicContact CE1-CG2 4.26Å; F148-V152 HydrophobicContact CE2-CG1 3.88Å; F148-V152 HydrophobicContact CZ-CG1 3.71Å; F148-V152 WeakPolarHBondContact O-CG1 3.28Å; F148-V152 WeakPolarHBondContact O-CG2 3.45Å; F148-V152 PolarHBondContact O-N 3.13Å; Y149-V152 PolarHBondContact O-N 3.34Å; V152-T154 VanDerWaalsContact C-N 3.27Å; V152-T154 PolarHBondContact O-N 3.26Å; V152-S155 WeakPolarHBondContact O-CB 3.22Å; V152-S155 PolarHBondContact O-N 3.05Å
153	A	86.8	Confident	75.4	Confident	60 Å²	60	81.8 Å²	81.8	50%	0.496	45%	0.445	S	S	.	.	H	α-helix	trans	-68.8	-24.8	176.8	0	0	0	0	0	113.2	Y149	Y149-A153 WeakPolarHBondContact O-CB 3.45Å; Y149-A153 PolarHBondContact O-N 2.73Å
154	T	80.9	Confident	74.3	Confident	113 Å²	113	79.8 Å²	79.8	69%	0.693	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-4.7	177.9	52.6	0	0	0	0	113.2	A150 V151 V152	A150-T154 WeakPolarHBondContact O-CG2 3.29Å; A150-T154 PolarHBondContact O-N 3.5Å; A150-T154 PolarHBondContact O-OG1 2.96Å; V151-T154 PolarHBondContact O-N 2.81Å; V151-T154 PolarHBondContact O-OG1 3.13Å; V151-T154 VanDerWaalsContact O-OG1 3.1Å; V152-T154 VanDerWaalsContact C-N 3.27Å; V152-T154 PolarHBondContact O-N 3.26Å
155	S	66.8	Low	73.1	Confident	28 Å²	28	83.9 Å²	83.9	20%	0.196	47%	0.467	C	S	.	.	S	Bend	trans	-69.7	129.2	178.2	-171.9	0	0	0	0	110.5	V151 V152 A157 S158	V151-S155 PolarHBondContact O-N 3.46Å; V152-S155 WeakPolarHBondContact O-CB 3.22Å; V152-S155 PolarHBondContact O-N 3.05Å; S155-A157 PolarHBondContact O-N 3.4Å; S155-S158 PolarHBondContact O-N 3.4Å; S155-S158 PolarHBondContact O-OG 3.14Å
156	P	54.6	Low	71.6	Confident	94 Å²	94	88.4 Å²	88.4	61%	0.61	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-67.7	5.4	-179.2	26.6	-32.6	0	0	0	113.9	S158 W159	P156-S158 PolarHBondContact O-N 3.03Å; P156-W159 PolarHBondContact O-NE1 3.41Å
157	A	52.9	Low	70	Confident	81 Å²	81	86.3 Å²	86.3	67%	0.669	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-74.7	-3.2	168.1	0	0	0	0	0	113.3	S155	S155-A157 PolarHBondContact O-N 3.4Å
158	S	47.7	Very low	68.3	Low	52 Å²	52	84.9 Å²	84.9	36%	0.364	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-92.1	-4.9	-170.4	56	0	0	0	0	115.9	S155 P156	S155-S158 PolarHBondContact O-N 3.4Å; S155-S158 PolarHBondContact O-OG 3.14Å; P156-S158 PolarHBondContact O-N 3.03Å
159	W	46.3	Very low	66.3	Low	175 Å²	175	91 Å²	91	66%	0.663	52%	0.521	S	S	*	.	S	Bend	trans	-113.3	-0.4	-172.2	62.2	-77.8	0	0	0	116.3	P156	P156-W159 PolarHBondContact O-NE1 3.41Å
160	E	38.6	Very low	64	Low	151 Å²	151	94.1 Å²	94.1	71%	0.706	55%	0.546	S	S	*	.	S	Bend	trans	-100.9	29.7	-176.8	-71.8	-175.6	164	0	0	114.7
161	S	39.6	Very low	61.4	Low	114 Å²	114	97.1 Å²	97.1	80%	0.797	55%	0.552	S	S	*	*			trans	-142.2	69	171.9	-56.5	0	0	0	0	111.6
162	H	36.2	Very low	58.4	Low	262 Å²	262	102.8 Å²	102.8	100%	1.213	58%	0.583	S	S	*	*			trans	-126	0	156.6	-77.7	-47.6	0	0	0	109

Retrieved 162 of 162 residues in 423.4 ms (Link to these results)

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