A0A077YWP6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YWP6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 109 aa.

						>A0A077YWP6_TRITR|A0A077YWP6
METADADERFTYKCAVMLHGFTFLNGYVNRFCWLPLMTAGGAGSKVALNEHKCNTSIGRRAGAVGLARAHDELLIGVEQTFCILLELLKSEDSLLRLLLECAVARYAYL
					

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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	43.7	Very low	57.8	Low	240 Å²	240	113.3 Å²	113.3	100%	1.182	60%	0.596	S	S	*	*				0	9.7	0	-104.3	174.9	166.6	0	0	112.6
2	E	50.4	Low	58.1	Low	176 Å²	176	118 Å²	118	82%	0.822	60%	0.602	S	S	*	*			trans	-90	-4.2	-170.2	-65.2	-179.1	155.9	0	0	115.5
3	T	51.8	Low	57.8	Low	111 Å²	111	111.9 Å²	111.9	68%	0.681	57%	0.568	S	S	*	*	H	α-helix	trans	-77.7	-33.1	-170.6	48.9	0	0	0	0	114.4	D5 A6 D7	T3-D5 VanDerWaalsContact C-N 3.27Å; T3-D5 PolarHBondContact O-N 3.31Å; T3-A6 PolarHBondContact O-N 3.31Å; T3-D7 PolarHBondContact O-N 3.36Å
4	A	56.6	Low	57.5	Low	57 Å²	57	105.9 Å²	105.9	47%	0.471	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-34.2	-178.3	0	0	0	0	0	112.8	D7 E8	A4-D7 PolarHBondContact O-N 3.33Å; A4-E8 WeakPolarHBondContact O-CG 3.46Å; A4-E8 PolarHBondContact O-N 2.97Å; A4-E8 VanDerWaalsContact O-N 3.07Å
5	D	57.1	Low	57.8	Low	80 Å²	80	102.4 Å²	102.4	43%	0.428	54%	0.535	S	S	.	.	H	α-helix	trans	-73.7	-29.4	-177.3	-170.9	28.2	0	0	0	112.3	T3 R9	T3-D5 VanDerWaalsContact C-N 3.27Å; T3-D5 PolarHBondContact O-N 3.31Å; D5-R9 WeakPolarHBondContact O-CB 3.43Å; D5-R9 WeakPolarHBondContact O-CG 3.37Å; D5-R9 PolarHBondContact O-N 2.98Å; D5-R9 VanDerWaalsContact O-N 3.17Å; D5-R9 PolarHBondContact O-NE 3.4Å; D5-R9 IonicContact OD1-CZ 3.74Å; D5-R9 IonicContact OD1-NH1 3.06Å; D5-R9 PolarHBondContact OD1-NH1 3.47Å; D5-R9 IonicContact OD1-NH2 2.77Å; D5-R9 IonicContact OD2-CZ 3.44Å; D5-R9 IonicContact OD2-NH1 3.02Å; D5-R9 PolarHBondContact OD2-NH1 3.26Å; D5-R9 IonicContact OD2-NH2 3.44Å; D5-R9 PolarHBondContact OD2-NH2 3.49Å
6	A	58.7	Low	57.9	Low	50 Å²	50	99.3 Å²	99.3	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-71.4	-44	173.7	0	0	0	0	0	111.8	T3 R9 F10	T3-A6 PolarHBondContact O-N 3.31Å; A6-R9 PolarHBondContact O-N 2.98Å; A6-F10 WeakPolarHBondContact O-CB 3.41Å; A6-F10 PolarHBondContact O-N 3.33Å
7	D	59.1	Low	57.6	Low	108 Å²	108	95.1 Å²	95.1	58%	0.578	50%	0.499	S	S	*	.	H	α-helix	trans	-65.8	-41.6	179.5	-70.1	-24.1	0	0	0	111.7	T3 A4 F10 T11	T3-D7 PolarHBondContact O-N 3.36Å; A4-D7 PolarHBondContact O-N 3.33Å; D7-F10 PolarHBondContact O-N 3.08Å; D7-T11 VanDerWaalsContact O-CB 3.31Å; D7-T11 WeakPolarHBondContact O-CB 3.45Å; D7-T11 PolarHBondContact O-N 3.08Å; D7-T11 PolarHBondContact O-OG1 3.33Å
8	E	69.6	Low	57.7	Low	139 Å²	139	96.3 Å²	96.3	65%	0.65	51%	0.505	S	S	*	.	H	α-helix	trans	-64.5	-44.3	175.6	-75	-179.3	-170.8	0	0	111.8	A4 T11 Y12	A4-E8 WeakPolarHBondContact O-CG 3.46Å; A4-E8 PolarHBondContact O-N 2.97Å; A4-E8 VanDerWaalsContact O-N 3.07Å; E8-T11 PolarHBondContact O-N 3.22Å; E8-Y12 WeakPolarHBondContact O-CB 3.31Å; E8-Y12 PolarHBondContact O-N 3.02Å
9	R	62.3	Low	57.7	Low	127 Å²	127	98.4 Å²	98.4	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-43.1	174.9	-81.7	-170.6	-74.1	-102.4	-2.2	112.4	D5 A6 Y12 K13	D5-R9 WeakPolarHBondContact O-CB 3.43Å; D5-R9 WeakPolarHBondContact O-CG 3.37Å; D5-R9 PolarHBondContact O-N 2.98Å; D5-R9 VanDerWaalsContact O-N 3.17Å; D5-R9 PolarHBondContact O-NE 3.4Å; D5-R9 IonicContact OD1-CZ 3.74Å; D5-R9 IonicContact OD1-NH1 3.06Å; D5-R9 PolarHBondContact OD1-NH1 3.47Å; D5-R9 IonicContact OD1-NH2 2.77Å; D5-R9 IonicContact OD2-CZ 3.44Å; D5-R9 IonicContact OD2-NH1 3.02Å; D5-R9 PolarHBondContact OD2-NH1 3.26Å; D5-R9 IonicContact OD2-NH2 3.44Å; D5-R9 PolarHBondContact OD2-NH2 3.49Å; A6-R9 PolarHBondContact O-N 2.98Å; R9-Y12 PolarHBondContact O-N 3.04Å; R9-K13 VanDerWaalsContact O-CG 3.27Å; R9-K13 WeakPolarHBondContact O-CG 3.37Å; R9-K13 PolarHBondContact O-N 2.89Å
10	F	62.7	Low	57.9	Low	69 Å²	69	94.1 Å²	94.1	30%	0.303	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-46	177	178.6	-98.8	0	0	0	111.1	A6 D7 Y12 K13 C14 L94 L98	A6-F10 WeakPolarHBondContact O-CB 3.41Å; A6-F10 PolarHBondContact O-N 3.33Å; D7-F10 PolarHBondContact O-N 3.08Å; F10-Y12 VanDerWaalsContact C-N 3.31Å; F10-Y12 PolarHBondContact O-N 3.44Å; F10-K13 PolarHBondContact O-N 3.43Å; F10-C14 WeakPolarHBondContact CZ-SG 3.39Å; F10-C14 PolarHBondContact O-N 3.48Å; F10-L94 HydrophobicContact CE2-CD2 3.81Å; F10-L94 HydrophobicContact CE2-CG 4.32Å; F10-L94 HydrophobicContact CZ-CD2 3.7Å; F10-L94 HydrophobicContact CZ-CG 4.44Å; F10-L98 HydrophobicContact CE2-CD1 4.5Å; F10-L98 HydrophobicContact CZ-CD1 4.34Å
11	T	64.2	Low	57.8	Low	89 Å²	89	91.8 Å²	91.8	55%	0.546	48%	0.478	S	S	.	.	H	α-helix	trans	-59.5	-43.7	177	-58.2	0	0	0	0	111.1	D7 E8 C14 A15	D7-T11 VanDerWaalsContact O-CB 3.31Å; D7-T11 WeakPolarHBondContact O-CB 3.45Å; D7-T11 PolarHBondContact O-N 3.08Å; D7-T11 PolarHBondContact O-OG1 3.33Å; E8-T11 PolarHBondContact O-N 3.22Å; T11-C14 PolarHBondContact O-N 3.4Å; T11-A15 WeakPolarHBondContact O-CB 3.46Å; T11-A15 PolarHBondContact O-N 3.07Å
12	Y	61.3	Low	58.5	Low	170 Å²	170	84.8 Å²	84.8	67%	0.667	45%	0.449	S	S	*	.	H	α-helix	trans	-61.3	-47.2	175.5	-177.9	-97.3	0	0	0	112.1	E8 R9 F10 C14 A15 V16	E8-Y12 WeakPolarHBondContact O-CB 3.31Å; E8-Y12 PolarHBondContact O-N 3.02Å; R9-Y12 PolarHBondContact O-N 3.04Å; F10-Y12 VanDerWaalsContact C-N 3.31Å; F10-Y12 PolarHBondContact O-N 3.44Å; Y12-C14 PolarHBondContact O-N 2.77Å; Y12-A15 PolarHBondContact O-N 2.8Å; Y12-V16 HydrophobicContact CD1-CG2 4.27Å; Y12-V16 HydrophobicContact CE1-CG2 3.89Å; Y12-V16 HydrophobicContact CE2-CG2 4.47Å; Y12-V16 WeakPolarHBondContact O-CG2 3.33Å; Y12-V16 PolarHBondContact O-N 3.36Å
13	K	54.4	Low	58.8	Low	39 Å²	39	81.6 Å²	81.6	17%	0.17	43%	0.432	C	S	.	.	H	α-helix	trans	-58.8	-46	176.8	-72.3	170.9	174.9	-173.5	0	111.5	R9 F10 V16 M17 L87 D92 L95	R9-K13 VanDerWaalsContact O-CG 3.27Å; R9-K13 WeakPolarHBondContact O-CG 3.37Å; R9-K13 PolarHBondContact O-N 2.89Å; F10-K13 PolarHBondContact O-N 3.43Å; K13-V16 PolarHBondContact O-N 2.9Å; K13-M17 WeakPolarHBondContact O-CG 3.45Å; K13-M17 PolarHBondContact O-N 2.74Å; K13-L87 HydrophobicContact CD-CD2 4.08Å; K13-L87 HydrophobicContact CG-CD2 3.91Å; K13-D92 IonicContact NZ-OD2 2.66Å; K13-D92 PolarHBondContact NZ-OD2 2.92Å; K13-L95 HydrophobicContact CB-CD1 4.15Å; K13-L95 HydrophobicContact CD-CD1 4.29Å; K13-L95 HydrophobicContact CD-CD2 3.68Å
14	C	53.7	Low	59.2	Low	27 Å²	27	76.6 Å²	76.6	18%	0.182	40%	0.402	C	S	.	.	H	α-helix	trans	-62.4	-42.6	176.7	-75.7	0	0	0	0	112.3	F10 T11 Y12 V16 M17 L18	F10-C14 WeakPolarHBondContact CZ-SG 3.39Å; F10-C14 PolarHBondContact O-N 3.48Å; T11-C14 PolarHBondContact O-N 3.4Å; Y12-C14 PolarHBondContact O-N 2.77Å; C14-V16 PolarHBondContact O-N 2.66Å; C14-M17 PolarHBondContact O-N 3.33Å; C14-L18 WeakPolarHBondContact O-CB 3.4Å; C14-L18 WeakPolarHBondContact O-CG 3.48Å; C14-L18 PolarHBondContact O-N 3.17Å
15	A	61.1	Low	58.9	Low	54 Å²	54	77 Å²	77	45%	0.446	40%	0.396	S	S	.	.	H	α-helix	trans	-61.5	-42.9	176.6	0	0	0	0	0	111.8	T11 Y12 L18 H19	T11-A15 WeakPolarHBondContact O-CB 3.46Å; T11-A15 PolarHBondContact O-N 3.07Å; Y12-A15 PolarHBondContact O-N 2.8Å; A15-L18 PolarHBondContact O-N 3.33Å; A15-H19 VanDerWaalsContact O-CB 3.29Å; A15-H19 WeakPolarHBondContact O-CB 3.36Å; A15-H19 PolarHBondContact O-N 3.21Å
16	V	59.2	Low	59	Low	53 Å²	53	75.2 Å²	75.2	32%	0.321	40%	0.397	S	S	.	.	H	α-helix	trans	-61.8	-45.4	175.7	171.4	0	0	0	0	111.2	Y12 K13 C14 H19 G20	Y12-V16 HydrophobicContact CD1-CG2 4.27Å; Y12-V16 HydrophobicContact CE1-CG2 3.89Å; Y12-V16 HydrophobicContact CE2-CG2 4.47Å; Y12-V16 WeakPolarHBondContact O-CG2 3.33Å; Y12-V16 PolarHBondContact O-N 3.36Å; K13-V16 PolarHBondContact O-N 2.9Å; C14-V16 PolarHBondContact O-N 2.66Å; V16-H19 PolarHBondContact O-N 3.43Å; V16-G20 PolarHBondContact O-N 3.08Å
17	M	53.6	Low	58.9	Low	28 Å²	28	75.9 Å²	75.9	14%	0.138	39%	0.389	C	S	.	.	H	α-helix	trans	-62	-45.5	177.2	-69.3	-166	-70	0	0	112.3	K13 C14 G20 F21 L84 L95 L98 L99	K13-M17 WeakPolarHBondContact O-CG 3.45Å; K13-M17 PolarHBondContact O-N 2.74Å; C14-M17 PolarHBondContact O-N 3.33Å; M17-G20 PolarHBondContact O-N 3.47Å; M17-F21 WeakPolarHBondContact O-CB 3.35Å; M17-F21 PolarHBondContact O-N 3.29Å; M17-L84 HydrophobicContact CG-CD2 3.65Å; M17-L84 HydrophobicContact SD-CD2 3.81Å; M17-L95 HydrophobicContact CE-CD1 3.43Å; M17-L95 VanDerWaalsContact CE-CD1 3.43Å; M17-L95 HydrophobicContact SD-CD1 4Å; M17-L98 HydrophobicContact CE-CB 3.99Å; M17-L98 HydrophobicContact CE-CD1 3.9Å; M17-L98 HydrophobicContact SD-CB 4.46Å; M17-L99 HydrophobicContact SD-CD1 4.37Å
18	L	58.4	Low	58.5	Low	116 Å²	116	73.2 Å²	73.2	61%	0.607	38%	0.376	S	S	*	.	H	α-helix	trans	-64.9	-39.2	178.4	-75.5	171.2	0	0	0	112.3	C14 A15 F21 T22	C14-L18 WeakPolarHBondContact O-CB 3.4Å; C14-L18 WeakPolarHBondContact O-CG 3.48Å; C14-L18 PolarHBondContact O-N 3.17Å; A15-L18 PolarHBondContact O-N 3.33Å; L18-F21 PolarHBondContact O-N 3.42Å; L18-T22 WeakPolarHBondContact O-CB 3.23Å; L18-T22 PolarHBondContact O-N 3.13Å; L18-T22 PolarHBondContact O-OG1 3.21Å
19	H	57.9	Low	57.6	Low	136 Å²	136	70.4 Å²	70.4	63%	0.63	37%	0.366	S	S	*	.	H	α-helix	trans	-67.2	-46.5	177.1	-171	-87.7	0	0	0	111.3	A15 V16 F21 T22 F23	A15-H19 VanDerWaalsContact O-CB 3.29Å; A15-H19 WeakPolarHBondContact O-CB 3.36Å; A15-H19 PolarHBondContact O-N 3.21Å; V16-H19 PolarHBondContact O-N 3.43Å; H19-F21 VanDerWaalsContact C-N 3.31Å; H19-F21 PolarHBondContact O-N 3.45Å; H19-T22 PolarHBondContact O-N 3.02Å; H19-F23 WeakPolarHBondContact O-CB 3.22Å; H19-F23 PolarHBondContact O-N 3.39Å
20	G	62.1	Low	57.1	Low	12 Å²	12	72.2 Å²	72.2	12%	0.124	37%	0.372	C	S	.	.	H	α-helix	trans	-56.8	-44.8	173.9	0	0	0	0	0	112	V16 M17 F23 L24	V16-G20 PolarHBondContact O-N 3.08Å; M17-G20 PolarHBondContact O-N 3.47Å; G20-F23 PolarHBondContact O-N 3.41Å; G20-L24 WeakPolarHBondContact O-CB 3.27Å; G20-L24 WeakPolarHBondContact O-CD1 3.47Å; G20-L24 WeakPolarHBondContact O-CG 3.4Å; G20-L24 PolarHBondContact O-N 3.22Å
21	F	56.1	Low	56.4	Low	47 Å²	47	71.7 Å²	71.7	21%	0.206	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-45.5	177.3	-172.7	-92.1	0	0	0	112.9	M17 L18 H19 L24 N25 Y106	M17-F21 WeakPolarHBondContact O-CB 3.35Å; M17-F21 PolarHBondContact O-N 3.29Å; L18-F21 PolarHBondContact O-N 3.42Å; H19-F21 VanDerWaalsContact C-N 3.31Å; H19-F21 PolarHBondContact O-N 3.45Å; F21-L24 PolarHBondContact O-N 3.45Å; F21-N25 WeakPolarHBondContact O-CB 3.33Å; F21-N25 PolarHBondContact O-N 2.84Å; F21-Y106 AromaticContact CD2-CE2 3.78Å; F21-Y106 HydrophobicContact CD2-CE2 3.78Å; F21-Y106 AromaticContact CE2-CE2 3.81Å; F21-Y106 HydrophobicContact CE2-CE2 3.81Å
22	T	57.7	Low	55.8	Low	92 Å²	92	70.6 Å²	70.6	56%	0.564	37%	0.366	S	S	*	.	H	α-helix	trans	-65.1	-42.2	179.7	-56.7	0	0	0	0	111.2	L18 H19 N25 G26	L18-T22 WeakPolarHBondContact O-CB 3.23Å; L18-T22 PolarHBondContact O-N 3.13Å; L18-T22 PolarHBondContact O-OG1 3.21Å; H19-T22 PolarHBondContact O-N 3.02Å; T22-N25 PolarHBondContact O-N 2.91Å; T22-G26 PolarHBondContact O-N 3.31Å
23	F	57.3	Low	54.9	Low	109 Å²	109	69 Å²	69	48%	0.478	36%	0.358	S	S	.	.	H	α-helix	trans	-59.8	-51.1	176.9	-179.3	-93.4	0	0	0	111.2	H19 G20 N25 G26 Y27	H19-F23 WeakPolarHBondContact O-CB 3.22Å; H19-F23 PolarHBondContact O-N 3.39Å; G20-F23 PolarHBondContact O-N 3.41Å; F23-N25 PolarHBondContact O-N 3.24Å; F23-G26 PolarHBondContact O-N 2.91Å; F23-Y27 HydrophobicContact CD1-CD2 4.23Å; F23-Y27 HydrophobicContact CD2-CD2 4.36Å; F23-Y27 HydrophobicContact CD2-CE2 4.46Å; F23-Y27 AromaticContact CE1-CD2 3.72Å; F23-Y27 HydrophobicContact CE1-CD2 3.72Å; F23-Y27 AromaticContact CE1-CE2 3.88Å; F23-Y27 HydrophobicContact CE1-CE2 3.88Å; F23-Y27 HydrophobicContact CE1-CG 4.38Å; F23-Y27 AromaticContact CE2-CD2 3.88Å; F23-Y27 HydrophobicContact CE2-CD2 3.88Å; F23-Y27 AromaticContact CE2-CE2 3.59Å; F23-Y27 HydrophobicContact CE2-CE2 3.59Å; F23-Y27 AromaticContact CZ-CD2 3.53Å; F23-Y27 HydrophobicContact CZ-CD2 3.53Å; F23-Y27 AromaticContact CZ-CE2 3.23Å; F23-Y27 HydrophobicContact CZ-CE2 3.23Å; F23-Y27 WeakPolarHBondContact O-CB 3.27Å; F23-Y27 PolarHBondContact O-N 2.94Å
24	L	59.2	Low	54.3	Low	7 Å²	7	71.4 Å²	71.4	4%	0.037	37%	0.373	C	S	.	.	H	α-helix	trans	-60.6	-45.2	177.8	-82	156.2	0	0	0	112.2	G20 F21 G26 Y27 V28 L73 V77 T80 Y106	G20-L24 WeakPolarHBondContact O-CB 3.27Å; G20-L24 WeakPolarHBondContact O-CD1 3.47Å; G20-L24 WeakPolarHBondContact O-CG 3.4Å; G20-L24 PolarHBondContact O-N 3.22Å; F21-L24 PolarHBondContact O-N 3.45Å; L24-G26 PolarHBondContact O-N 3.06Å; L24-Y27 PolarHBondContact O-N 2.64Å; L24-V28 WeakPolarHBondContact O-CG2 3.4Å; L24-V28 PolarHBondContact O-N 2.94Å; L24-L73 HydrophobicContact CD2-CD1 3.97Å; L24-V77 HydrophobicContact CD2-CB 4.43Å; L24-V77 HydrophobicContact CD2-CG2 3.32Å; L24-T80 HydrophobicContact CD1-CG2 4.16Å; L24-Y106 HydrophobicContact CB-CE1 4.4Å; L24-Y106 WeakPolarHBondContact CB-OH 3.14Å; L24-Y106 HydrophobicContact CD1-CE2 4.35Å
25	N	52.1	Low	53.6	Low	65 Å²	65	73.5 Å²	73.5	35%	0.348	39%	0.386	S	S	.	.	H	α-helix	trans	-64.8	-40.9	178.3	-170.1	14.3	0	0	0	112.1	F21 T22 F23 Y27 N29	F21-N25 WeakPolarHBondContact O-CB 3.33Å; F21-N25 PolarHBondContact O-N 2.84Å; T22-N25 PolarHBondContact O-N 2.91Å; F23-N25 PolarHBondContact O-N 3.24Å; N25-Y27 VanDerWaalsContact C-N 3.31Å; N25-Y27 PolarHBondContact O-N 2.93Å; N25-N29 WeakPolarHBondContact O-CB 3.38Å; N25-N29 PolarHBondContact O-N 2.92Å; N25-N29 PolarHBondContact O-ND2 3.01Å; N25-N29 PolarHBondContact OD1-ND2 3.34Å
26	G	58.5	Low	52.5	Low	43 Å²	43	76.3 Å²	76.3	44%	0.443	39%	0.393	S	S	.	.	H	α-helix	trans	-62.1	-39.2	173.5	0	0	0	0	0	112.1	T22 F23 L24 R30	T22-G26 PolarHBondContact O-N 3.31Å; F23-G26 PolarHBondContact O-N 2.91Å; L24-G26 PolarHBondContact O-N 3.06Å; G26-R30 WeakPolarHBondContact O-CB 3.44Å; G26-R30 PolarHBondContact O-N 3.23Å
27	Y	55.4	Low	51.3	Low	64 Å²	64	80.8 Å²	80.8	25%	0.251	41%	0.412	S	S	.	.	H	α-helix	trans	-68.2	-51.9	176	-108.6	-98.9	0	0	0	112.3	F23 L24 N25 N29 R30 F31	F23-Y27 HydrophobicContact CD1-CD2 4.23Å; F23-Y27 HydrophobicContact CD2-CD2 4.36Å; F23-Y27 HydrophobicContact CD2-CE2 4.46Å; F23-Y27 AromaticContact CE1-CD2 3.72Å; F23-Y27 HydrophobicContact CE1-CD2 3.72Å; F23-Y27 AromaticContact CE1-CE2 3.88Å; F23-Y27 HydrophobicContact CE1-CE2 3.88Å; F23-Y27 HydrophobicContact CE1-CG 4.38Å; F23-Y27 AromaticContact CE2-CD2 3.88Å; F23-Y27 HydrophobicContact CE2-CD2 3.88Å; F23-Y27 AromaticContact CE2-CE2 3.59Å; F23-Y27 HydrophobicContact CE2-CE2 3.59Å; F23-Y27 AromaticContact CZ-CD2 3.53Å; F23-Y27 HydrophobicContact CZ-CD2 3.53Å; F23-Y27 AromaticContact CZ-CE2 3.23Å; F23-Y27 HydrophobicContact CZ-CE2 3.23Å; F23-Y27 WeakPolarHBondContact O-CB 3.27Å; F23-Y27 PolarHBondContact O-N 2.94Å; L24-Y27 PolarHBondContact O-N 2.64Å; N25-Y27 VanDerWaalsContact C-N 3.31Å; N25-Y27 PolarHBondContact O-N 2.93Å; Y27-N29 VanDerWaalsContact C-N 3.31Å; Y27-N29 PolarHBondContact O-N 3.4Å; Y27-R30 PolarHBondContact O-N 3.48Å; Y27-F31 AromaticContact CD1-CD2 3.49Å; Y27-F31 HydrophobicContact CD1-CD2 3.49Å; Y27-F31 VanDerWaalsContact CD1-CD2 3.49Å; Y27-F31 AromaticContact CD1-CE2 3.25Å; Y27-F31 HydrophobicContact CD1-CE2 3.25Å; Y27-F31 HydrophobicContact CD1-CZ 4.36Å; Y27-F31 AromaticContact CE1-CD2 3.94Å; Y27-F31 HydrophobicContact CE1-CD2 3.94Å; Y27-F31 AromaticContact CE1-CE2 3.2Å; Y27-F31 HydrophobicContact CE1-CE2 3.2Å; Y27-F31 AromaticContact CE1-CZ 3.95Å; Y27-F31 HydrophobicContact CE1-CZ 3.95Å; Y27-F31 HydrophobicContact CG-CD2 4.29Å; Y27-F31 HydrophobicContact CG-CE2 4.16Å; Y27-F31 VanDerWaalsContact O-CD2 3.3Å; Y27-F31 WeakPolarHBondContact O-CD2 3.36Å; Y27-F31 PolarHBondContact O-N 2.94Å
28	V	52	Low	51.1	Low	52 Å²	52	84.7 Å²	84.7	32%	0.315	44%	0.438	S	S	.	.	H	α-helix	trans	-55.5	-48.2	177.5	172.2	0	0	0	0	109.9	L24 R30 F31 C32 L73	L24-V28 WeakPolarHBondContact O-CG2 3.4Å; L24-V28 PolarHBondContact O-N 2.94Å; V28-R30 VanDerWaalsContact C-N 3.29Å; V28-R30 PolarHBondContact O-N 3.44Å; V28-F31 PolarHBondContact O-N 2.96Å; V28-C32 WeakPolarHBondContact O-CB 3.38Å; V28-C32 PolarHBondContact O-N 3.41Å; V28-C32 PolarHBondContact O-SG 2.87Å; V28-L73 HydrophobicContact CG2-CD1 4.29Å
29	N	50.8	Low	50.3	Low	79 Å²	79	83.2 Å²	83.2	42%	0.422	44%	0.442	S	S	.	.	H	α-helix	trans	-62.9	-31.9	176.4	-78.3	-51.4	0	0	0	113.6	N25 Y27 W33	N25-N29 WeakPolarHBondContact O-CB 3.38Å; N25-N29 PolarHBondContact O-N 2.92Å; N25-N29 PolarHBondContact O-ND2 3.01Å; N25-N29 PolarHBondContact OD1-ND2 3.34Å; Y27-N29 VanDerWaalsContact C-N 3.31Å; Y27-N29 PolarHBondContact O-N 3.4Å; N29-W33 WeakPolarHBondContact O-CB 3.43Å
30	R	51.6	Low	49	Very low	165 Å²	165	79.3 Å²	79.3	62%	0.623	44%	0.438	S	S	*	.	H	α-helix	trans	-73.7	-44.7	177.7	-171.6	175.5	-176.6	-173.7	-0.1	111.6	G26 Y27 V28 L34	G26-R30 WeakPolarHBondContact O-CB 3.44Å; G26-R30 PolarHBondContact O-N 3.23Å; Y27-R30 PolarHBondContact O-N 3.48Å; V28-R30 VanDerWaalsContact C-N 3.29Å; V28-R30 PolarHBondContact O-N 3.44Å; R30-L34 HydrophobicContact CG-CD1 4.36Å; R30-L34 VanDerWaalsContact O-CD1 3.31Å; R30-L34 WeakPolarHBondContact O-CD1 3.4Å; R30-L34 PolarHBondContact O-N 3.02Å
31	F	48.7	Very low	47.5	Very low	58 Å²	58	82.5 Å²	82.5	25%	0.254	47%	0.471	S	S	.	.	H	α-helix	trans	-89.9	-30.8	-171.6	-71	-80.7	0	0	0	113.6	Y27 V28 W33 L34 P35 A69	Y27-F31 AromaticContact CD1-CD2 3.49Å; Y27-F31 HydrophobicContact CD1-CD2 3.49Å; Y27-F31 VanDerWaalsContact CD1-CD2 3.49Å; Y27-F31 AromaticContact CD1-CE2 3.25Å; Y27-F31 HydrophobicContact CD1-CE2 3.25Å; Y27-F31 HydrophobicContact CD1-CZ 4.36Å; Y27-F31 AromaticContact CE1-CD2 3.94Å; Y27-F31 HydrophobicContact CE1-CD2 3.94Å; Y27-F31 AromaticContact CE1-CE2 3.2Å; Y27-F31 HydrophobicContact CE1-CE2 3.2Å; Y27-F31 AromaticContact CE1-CZ 3.95Å; Y27-F31 HydrophobicContact CE1-CZ 3.95Å; Y27-F31 HydrophobicContact CG-CD2 4.29Å; Y27-F31 HydrophobicContact CG-CE2 4.16Å; Y27-F31 VanDerWaalsContact O-CD2 3.3Å; Y27-F31 WeakPolarHBondContact O-CD2 3.36Å; Y27-F31 PolarHBondContact O-N 2.94Å; V28-F31 PolarHBondContact O-N 2.96Å; F31-W33 PolarHBondContact O-N 3.4Å; F31-L34 PolarHBondContact O-N 3.31Å; F31-P35 WeakPolarHBondContact O-CD 3.22Å; F31-A69 HydrophobicContact CD1-CB 3.56Å; F31-A69 HydrophobicContact CE1-CB 3.63Å; F31-A69 HydrophobicContact CG-CB 4.14Å; F31-A69 HydrophobicContact CZ-CB 4.29Å
32	C	50.2	Low	46.5	Very low	67 Å²	67	84.1 Å²	84.1	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-69.9	-24.4	175.5	83	0	0	0	0	112.3	V28 P35	V28-C32 WeakPolarHBondContact O-CB 3.38Å; V28-C32 PolarHBondContact O-N 3.41Å; V28-C32 PolarHBondContact O-SG 2.87Å; C32-P35 WeakPolarHBondContact O-CD 3.04Å
33	W	42.2	Very low	45.4	Very low	135 Å²	135	83.2 Å²	83.2	51%	0.511	50%	0.503	S	S	.	.	H	α-helix	trans	-91	-15.5	176.8	-72.4	80	0	0	0	114.3	N29 F31 P35 L36 M37	N29-W33 WeakPolarHBondContact O-CB 3.43Å; F31-W33 PolarHBondContact O-N 3.4Å; W33-P35 VanDerWaalsContact C-N 3.34Å; W33-L36 HydrophobicContact CE3-CD1 4.32Å; W33-L36 WeakPolarHBondContact O-CA 3.39Å; W33-L36 PolarHBondContact O-N 3.02Å; W33-M37 PolarHBondContact O-N 3.35Å
34	L	41.5	Very low	44.7	Very low	90 Å²	90	84 Å²	84	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-33.2	179.4	-121.8	119.1	0	0	0	113.5	R30 F31 L36 T38	R30-L34 HydrophobicContact CG-CD1 4.36Å; R30-L34 VanDerWaalsContact O-CD1 3.31Å; R30-L34 WeakPolarHBondContact O-CD1 3.4Å; R30-L34 PolarHBondContact O-N 3.02Å; F31-L34 PolarHBondContact O-N 3.31Å; L34-L36 VanDerWaalsContact C-N 3.29Å; L34-L36 PolarHBondContact O-N 3.07Å; L34-T38 PolarHBondContact O-N 3.16Å; L34-T38 PolarHBondContact O-OG1 3.14Å
35	P	40.2	Very low	43.8	Very low	72 Å²	72	92 Å²	92	47%	0.468	56%	0.556	S	S	.	*	H	α-helix	trans	-66.2	-26.7	168	-21.5	32.3	0	0	0	113.9	F31 C32 W33	F31-P35 WeakPolarHBondContact O-CD 3.22Å; C32-P35 WeakPolarHBondContact O-CD 3.04Å; W33-P35 VanDerWaalsContact C-N 3.34Å
36	L	38.4	Very low	43.4	Very low	113 Å²	113	91.4 Å²	91.4	59%	0.592	56%	0.555	S	S	*	*	H	α-helix	trans	-86.4	-36.7	-178.5	-73.8	166	0	0	0	112.3	W33 L34 A39	W33-L36 HydrophobicContact CE3-CD1 4.32Å; W33-L36 WeakPolarHBondContact O-CA 3.39Å; W33-L36 PolarHBondContact O-N 3.02Å; L34-L36 VanDerWaalsContact C-N 3.29Å; L34-L36 PolarHBondContact O-N 3.07Å; L36-A39 PolarHBondContact O-N 2.73Å
37	M	34.2	Very low	42.6	Very low	147 Å²	147	93.4 Å²	93.4	72%	0.724	57%	0.567	S	S	*	*	H	α-helix	trans	-78.3	-19.6	178.6	-72.3	-128.7	177.6	0	0	114.1	W33 A39	W33-M37 PolarHBondContact O-N 3.35Å; M37-A39 VanDerWaalsContact C-N 3.26Å
38	T	48.4	Very low	41.9	Very low	110 Å²	110	97.1 Å²	97.1	68%	0.675	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-9.1	168	38.6	0	0	0	0	113.2	L34	L34-T38 PolarHBondContact O-N 3.16Å; L34-T38 PolarHBondContact O-OG1 3.14Å
39	A	40.7	Very low	41.4	Very low	85 Å²	85	98.9 Å²	98.9	70%	0.702	60%	0.598	S	S	*	*	S	Bend	trans	-99.3	-4.2	176.8	0	0	0	0	0	114.5	L36 M37	L36-A39 PolarHBondContact O-N 2.73Å; M37-A39 VanDerWaalsContact C-N 3.26Å
40	G	31.6	Very low	41	Very low	53 Å²	53	100.5 Å²	100.5	55%	0.546	60%	0.603	S	S	.	*	S	Bend	trans	-162.2	99.9	-176.3	0	0	0	0	0	115.8
41	G	31.6	Very low	40.7	Very low	79 Å²	79	99.5 Å²	99.5	81%	0.814	61%	0.605	S	S	*	*			trans	82.7	93.8	137.9	0	0	0	0	0	118.8
42	A	35.1	Very low	40.7	Very low	81 Å²	81	103.5 Å²	103.5	67%	0.669	62%	0.623	S	S	*	*			trans	-152.7	111.3	138.9	0	0	0	0	0	108.5	V46	A42-V46 WeakPolarHBondContact O-CG2 3.42Å
43	G	34.5	Very low	40.3	Very low	74 Å²	74	103.3 Å²	103.3	76%	0.763	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	153	-161.8	0	0	0	0	0	117.1	K45	G43-K45 PolarHBondContact O-N 3.25Å
44	S	41.1	Very low	40.5	Very low	125 Å²	125	102 Å²	102	87%	0.874	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.2	-9.8	164.9	-152.5	0	0	0	0	119.9
45	K	40.9	Very low	41	Very low	174 Å²	174	100.3 Å²	100.3	76%	0.757	62%	0.618	S	S	*	*	S	Bend	trans	-103.5	-3.2	160.9	-72.5	-170.8	179.9	179	0	113.9	G43	G43-K45 PolarHBondContact O-N 3.25Å
46	V	43	Very low	42.1	Very low	54 Å²	54	100.3 Å²	100.3	33%	0.327	62%	0.62	S	S	.	*	H	α-helix	trans	-72.6	-34.7	-175.1	178.4	0	0	0	0	112.6	A42 L48 N49 E50	A42-V46 WeakPolarHBondContact O-CG2 3.42Å; V46-L48 VanDerWaalsContact C-N 3.31Å; V46-L48 PolarHBondContact O-N 3.21Å; V46-N49 PolarHBondContact O-N 2.84Å; V46-E50 HydrophobicContact CG1-CG 3.74Å; V46-E50 PolarHBondContact O-N 2.86Å
47	A	42.8	Very low	43.3	Very low	84 Å²	84	100.5 Å²	100.5	69%	0.694	62%	0.62	S	S	*	*	H	α-helix	trans	-63.7	-31.1	-175.1	0	0	0	0	0	114.3
48	L	41.1	Very low	43.7	Very low	142 Å²	142	94.6 Å²	94.6	74%	0.743	60%	0.597	S	S	*	*	H	α-helix	trans	-85.6	-25.3	174.9	-80.5	164.4	0	0	0	113	V46	V46-L48 VanDerWaalsContact C-N 3.31Å; V46-L48 PolarHBondContact O-N 3.21Å
49	N	41.7	Very low	43.8	Very low	89 Å²	89	97 Å²	97	48%	0.476	59%	0.593	S	S	.	*	H	α-helix	trans	-87.7	-31.2	-179.5	-81.3	-18.5	0	0	0	113	V46 H51 K52 C53	V46-N49 PolarHBondContact O-N 2.84Å; N49-H51 VanDerWaalsContact C-N 3.27Å; N49-H51 PolarHBondContact O-N 3.38Å; N49-K52 PolarHBondContact O-N 2.81Å; N49-K52 VanDerWaalsContact O-N 3.12Å; N49-C53 VanDerWaalsContact O-CB 3.28Å; N49-C53 WeakPolarHBondContact O-CB 3.5Å; N49-C53 PolarHBondContact O-N 3.17Å; N49-C53 PolarHBondContact O-SG 2.85Å; N49-C53 VanDerWaalsContact O-SG 3.33Å
50	E	40.4	Very low	44.2	Very low	114 Å²	114	100.5 Å²	100.5	53%	0.533	59%	0.588	S	S	.	*	H	α-helix	trans	-58.8	-41.4	172.1	-91.4	178.9	162.9	0	0	111.2	V46 K52 C53 N54	V46-E50 HydrophobicContact CG1-CG 3.74Å; V46-E50 PolarHBondContact O-N 2.86Å; E50-K52 VanDerWaalsContact C-N 3.34Å; E50-K52 PolarHBondContact O-N 3.46Å; E50-C53 PolarHBondContact O-N 3.29Å; E50-N54 WeakPolarHBondContact O-CB 3.49Å; E50-N54 PolarHBondContact O-N 2.94Å; E50-N54 PolarHBondContact O-ND2 3.47Å; E50-N54 VanDerWaalsContact O-ND2 3.15Å
51	H	46	Very low	45.2	Very low	144 Å²	144	101 Å²	101	67%	0.667	59%	0.587	S	S	*	*	H	α-helix	trans	-65.2	-38.3	176.5	-167.4	-83	0	0	0	112	N49 T55	N49-H51 VanDerWaalsContact C-N 3.27Å; N49-H51 PolarHBondContact O-N 3.38Å; H51-T55 WeakPolarHBondContact O-CG2 3.24Å; H51-T55 PolarHBondContact O-N 2.93Å
52	K	48.2	Very low	46.2	Very low	141 Å²	141	99.4 Å²	99.4	61%	0.613	57%	0.571	S	S	*	*	H	α-helix	trans	-71.5	-42.4	176.3	-72.5	-175.9	-179.6	-180	0	112.1	N49 E50 T55 G58	N49-K52 PolarHBondContact O-N 2.81Å; N49-K52 VanDerWaalsContact O-N 3.12Å; E50-K52 VanDerWaalsContact C-N 3.34Å; E50-K52 PolarHBondContact O-N 3.46Å; K52-T55 PolarHBondContact O-N 3.29Å; K52-T55 PolarHBondContact O-OG1 3.41Å; K52-G58 WeakPolarHBondContact O-CA 3.11Å
53	C	43.5	Very low	47	Very low	64 Å²	64	98.3 Å²	98.3	43%	0.432	56%	0.562	S	S	.	*	H	α-helix	trans	-68.1	-33.3	178.7	-71.5	0	0	0	0	112.7	N49 E50 R59	N49-C53 VanDerWaalsContact O-CB 3.28Å; N49-C53 WeakPolarHBondContact O-CB 3.5Å; N49-C53 PolarHBondContact O-N 3.17Å; N49-C53 PolarHBondContact O-SG 2.85Å; N49-C53 VanDerWaalsContact O-SG 3.33Å; E50-C53 PolarHBondContact O-N 3.29Å; C53-R59 VanDerWaalsContact O-CG 3.28Å; C53-R59 WeakPolarHBondContact O-CG 3.38Å
54	N	45.4	Very low	47.9	Very low	108 Å²	108	98.6 Å²	98.6	58%	0.578	55%	0.549	S	S	*	.	H	α-helix	trans	-80.2	-16.1	179.1	-72.1	-28.3	0	0	0	113.9	E50	E50-N54 WeakPolarHBondContact O-CB 3.49Å; E50-N54 PolarHBondContact O-N 2.94Å; E50-N54 PolarHBondContact O-ND2 3.47Å; E50-N54 VanDerWaalsContact O-ND2 3.15Å
55	T	51.4	Low	48.2	Very low	53 Å²	53	94.5 Å²	94.5	33%	0.325	53%	0.526	S	S	.	.	S	Bend	trans	-63.9	143.9	171.3	66.9	0	0	0	0	109.9	H51 K52 I57 G58 R59	H51-T55 WeakPolarHBondContact O-CG2 3.24Å; H51-T55 PolarHBondContact O-N 2.93Å; K52-T55 PolarHBondContact O-N 3.29Å; K52-T55 PolarHBondContact O-OG1 3.41Å; T55-I57 PolarHBondContact O-N 3.48Å; T55-G58 PolarHBondContact O-N 2.94Å; T55-G58 PolarHBondContact OG1-N 2.79Å; T55-G58 VanDerWaalsContact OG1-N 3.11Å; T55-R59 PolarHBondContact O-N 2.91Å; T55-R59 VanDerWaalsContact O-N 3.08Å
56	S	64.4	Low	48.6	Very low	73 Å²	73	90.7 Å²	90.7	51%	0.51	51%	0.514	S	S	.	.	H	α-helix	trans	-54.9	-22.2	173.8	-54	0	0	0	0	112.5	R60	S56-R60 WeakPolarHBondContact O-CB 3.34Å; S56-R60 WeakPolarHBondContact O-CG 3.38Å; S56-R60 PolarHBondContact O-N 3.42Å; S56-R60 PolarHBondContact O-NE 3.35Å
57	I	63.1	Low	49	Very low	117 Å²	117	90.4 Å²	90.4	60%	0.6	52%	0.517	S	S	*	.	H	α-helix	trans	-72.3	-50.1	172.6	-61.8	170.3	0	0	0	110.8	T55 R59 R60 A61	T55-I57 PolarHBondContact O-N 3.48Å; I57-R59 PolarHBondContact O-N 3.39Å; I57-R60 PolarHBondContact O-N 3.3Å; I57-A61 WeakPolarHBondContact O-CB 3.39Å; I57-A61 PolarHBondContact O-N 3.22Å
58	G	43.1	Very low	49.4	Very low	22 Å²	22	94.4 Å²	94.4	23%	0.227	51%	0.514	C	S	.	.	H	α-helix	trans	-58.7	-43.9	177.8	0	0	0	0	0	113	K52 T55 R60 A61 G62	K52-G58 WeakPolarHBondContact O-CA 3.11Å; T55-G58 PolarHBondContact O-N 2.94Å; T55-G58 PolarHBondContact OG1-N 2.79Å; T55-G58 VanDerWaalsContact OG1-N 3.11Å; G58-R60 PolarHBondContact O-N 2.76Å; G58-A61 PolarHBondContact O-N 3.45Å; G58-G62 PolarHBondContact O-N 3.43Å
59	R	49.4	Very low	50	Low	161 Å²	161	88.1 Å²	88.1	61%	0.608	48%	0.483	S	S	*	.	H	α-helix	trans	-63.4	-39.7	175.7	-68	-169.5	-77.9	-172	-2.6	112.9	C53 T55 I57 G62 A63	C53-R59 VanDerWaalsContact O-CG 3.28Å; C53-R59 WeakPolarHBondContact O-CG 3.38Å; T55-R59 PolarHBondContact O-N 2.91Å; T55-R59 VanDerWaalsContact O-N 3.08Å; I57-R59 PolarHBondContact O-N 3.39Å; R59-G62 PolarHBondContact O-N 2.9Å; R59-A63 WeakPolarHBondContact O-CB 3.29Å; R59-A63 PolarHBondContact O-N 2.96Å
60	R	50.7	Low	50.4	Low	158 Å²	158	88.6 Å²	88.6	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-68	-43.2	175.3	-76.8	-178.5	-63.8	-165.8	5.7	112	S56 I57 G58 G62 A63 V64	S56-R60 WeakPolarHBondContact O-CB 3.34Å; S56-R60 WeakPolarHBondContact O-CG 3.38Å; S56-R60 PolarHBondContact O-N 3.42Å; S56-R60 PolarHBondContact O-NE 3.35Å; I57-R60 PolarHBondContact O-N 3.3Å; G58-R60 PolarHBondContact O-N 2.76Å; R60-G62 VanDerWaalsContact C-N 3.29Å; R60-G62 PolarHBondContact O-N 2.76Å; R60-A63 PolarHBondContact O-N 2.73Å; R60-V64 WeakPolarHBondContact O-CB 3.33Å; R60-V64 VanDerWaalsContact O-CG2 3.24Å; R60-V64 WeakPolarHBondContact O-CG2 3.39Å; R60-V64 PolarHBondContact O-N 2.98Å
61	A	52.9	Low	51.3	Low	63 Å²	63	87.3 Å²	87.3	52%	0.521	48%	0.479	S	S	.	.	H	α-helix	trans	-61.2	-40.4	175.9	0	0	0	0	0	111.4	I57 G58 G65	I57-A61 WeakPolarHBondContact O-CB 3.39Å; I57-A61 PolarHBondContact O-N 3.22Å; G58-A61 PolarHBondContact O-N 3.45Å; A61-G65 PolarHBondContact O-N 2.85Å
62	G	51.1	Low	51.6	Low	46 Å²	46	85.9 Å²	85.9	47%	0.474	47%	0.472	S	S	.	.	H	α-helix	trans	-62.3	-47	172.9	0	0	0	0	0	112.9	G58 R59 R60 G65 L66	G58-G62 PolarHBondContact O-N 3.43Å; R59-G62 PolarHBondContact O-N 2.9Å; R60-G62 VanDerWaalsContact C-N 3.29Å; R60-G62 PolarHBondContact O-N 2.76Å; G62-G65 PolarHBondContact O-N 3.42Å; G62-L66 WeakPolarHBondContact O-CB 3.39Å; G62-L66 PolarHBondContact O-N 2.94Å
63	A	52.6	Low	51.8	Low	59 Å²	59	81.4 Å²	81.4	49%	0.488	46%	0.455	S	S	.	.	H	α-helix	trans	-65.8	-40.5	178	0	0	0	0	0	112.9	R59 R60 L66 A67	R59-A63 WeakPolarHBondContact O-CB 3.29Å; R59-A63 PolarHBondContact O-N 2.96Å; R60-A63 PolarHBondContact O-N 2.73Å; A63-L66 PolarHBondContact O-N 2.97Å; A63-A67 WeakPolarHBondContact O-CB 3.35Å; A63-A67 PolarHBondContact O-N 3.48Å
64	V	53.1	Low	52.2	Low	80 Å²	80	82.6 Å²	82.6	49%	0.485	46%	0.456	S	S	.	.	H	α-helix	trans	-67.2	-40.1	175.3	172.2	0	0	0	0	110.8	R60 L66 A67 R68	R60-V64 WeakPolarHBondContact O-CB 3.33Å; R60-V64 VanDerWaalsContact O-CG2 3.24Å; R60-V64 WeakPolarHBondContact O-CG2 3.39Å; R60-V64 PolarHBondContact O-N 2.98Å; V64-L66 VanDerWaalsContact C-N 3.34Å; V64-A67 PolarHBondContact O-N 3.48Å; V64-R68 WeakPolarHBondContact O-CB 2.93Å; V64-R68 WeakPolarHBondContact O-CG 3.29Å; V64-R68 PolarHBondContact O-N 3.43Å
65	G	48	Very low	52.9	Low	39 Å²	39	81.8 Å²	81.8	40%	0.402	45%	0.451	S	S	.	.	H	α-helix	trans	-62.7	-41	173.5	0	0	0	0	0	112.2	A61 G62 A69	A61-G65 PolarHBondContact O-N 2.85Å; G62-G65 PolarHBondContact O-N 3.42Å; G65-A69 WeakPolarHBondContact O-CB 3.5Å; G65-A69 PolarHBondContact O-N 3.21Å
66	L	47.7	Very low	53.2	Low	94 Å²	94	80 Å²	80	49%	0.492	44%	0.443	S	S	.	.	H	α-helix	trans	-65.5	-44.7	174.8	-176.6	66	0	0	0	111.8	G62 A63 V64 A69 H70	G62-L66 WeakPolarHBondContact O-CB 3.39Å; G62-L66 PolarHBondContact O-N 2.94Å; A63-L66 PolarHBondContact O-N 2.97Å; V64-L66 VanDerWaalsContact C-N 3.34Å; L66-A69 PolarHBondContact O-N 3.35Å; L66-H70 VanDerWaalsContact O-CB 3.31Å; L66-H70 WeakPolarHBondContact O-CB 3.33Å; L66-H70 PolarHBondContact O-N 3.49Å
67	A	52.7	Low	52.7	Low	48 Å²	48	79.2 Å²	79.2	40%	0.397	44%	0.436	S	S	.	.	H	α-helix	trans	-61.9	-43.5	177	0	0	0	0	0	111.3	A63 V64 H70 D71	A63-A67 WeakPolarHBondContact O-CB 3.35Å; A63-A67 PolarHBondContact O-N 3.48Å; V64-A67 PolarHBondContact O-N 3.48Å; A67-H70 CarbonylContact O-C 3.54Å; A67-H70 WeakPolarHBondContact O-CB 3.28Å; A67-H70 PolarHBondContact O-N 2.8Å; A67-D71 PolarHBondContact O-N 3.03Å
68	R	50.3	Low	52.2	Low	167 Å²	167	79.7 Å²	79.7	63%	0.63	44%	0.435	S	S	*	.	H	α-helix	trans	-65	-43	175.4	-80.6	-178.8	158.4	163.3	-5.2	113.1	V64 H70 D71 E72	V64-R68 WeakPolarHBondContact O-CB 2.93Å; V64-R68 WeakPolarHBondContact O-CG 3.29Å; V64-R68 PolarHBondContact O-N 3.43Å; R68-H70 PolarHBondContact O-N 2.9Å; R68-D71 PolarHBondContact O-N 3.46Å; R68-E72 WeakPolarHBondContact O-CB 3.34Å; R68-E72 WeakPolarHBondContact O-CG 3.44Å; R68-E72 PolarHBondContact O-N 2.91Å
69	A	53.4	Low	52.6	Low	10 Å²	10	84.5 Å²	84.5	8%	0.083	45%	0.452	C	S	.	.	H	α-helix	trans	-62.7	-34.7	174.8	0	0	0	0	0	111.2	F31 G65 L66 L73	F31-A69 HydrophobicContact CD1-CB 3.56Å; F31-A69 HydrophobicContact CE1-CB 3.63Å; F31-A69 HydrophobicContact CG-CB 4.14Å; F31-A69 HydrophobicContact CZ-CB 4.29Å; G65-A69 WeakPolarHBondContact O-CB 3.5Å; G65-A69 PolarHBondContact O-N 3.21Å; L66-A69 PolarHBondContact O-N 3.35Å; A69-L73 WeakPolarHBondContact O-CB 3.45Å; A69-L73 PolarHBondContact O-N 2.88Å
70	H	51.8	Low	53	Low	100 Å²	100	78.6 Å²	78.6	46%	0.463	43%	0.433	S	S	.	.	H	α-helix	trans	-68.8	-42.2	172.9	-173	-88.8	0	0	0	112	L66 A67 R68 L73 L74	L66-H70 VanDerWaalsContact O-CB 3.31Å; L66-H70 WeakPolarHBondContact O-CB 3.33Å; L66-H70 PolarHBondContact O-N 3.49Å; A67-H70 CarbonylContact O-C 3.54Å; A67-H70 WeakPolarHBondContact O-CB 3.28Å; A67-H70 PolarHBondContact O-N 2.8Å; R68-H70 PolarHBondContact O-N 2.9Å; H70-L73 WeakPolarHBondContact O-CB 3.45Å; H70-L73 PolarHBondContact O-N 2.81Å; H70-L74 WeakPolarHBondContact O-CB 3.34Å; H70-L74 WeakPolarHBondContact O-CG 3.24Å; H70-L74 PolarHBondContact O-N 3.33Å
71	D	58.2	Low	53.2	Low	87 Å²	87	75.3 Å²	75.3	47%	0.465	42%	0.424	S	S	.	.	H	α-helix	trans	-63.5	-45.2	175.8	-64.8	-25	0	0	0	111.1	A67 R68 L73 L74 I75	A67-D71 PolarHBondContact O-N 3.03Å; R68-D71 PolarHBondContact O-N 3.46Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 3.37Å; D71-L74 PolarHBondContact O-N 3.47Å; D71-I75 VanDerWaalsContact O-CG1 3.29Å; D71-I75 WeakPolarHBondContact O-CG1 3.24Å; D71-I75 PolarHBondContact O-N 2.82Å
72	E	51.9	Low	53.3	Low	113 Å²	113	75 Å²	75	53%	0.528	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-39.3	174.2	-72.6	176.8	-162.9	0	0	111.6	R68 I75 G76	R68-E72 WeakPolarHBondContact O-CB 3.34Å; R68-E72 WeakPolarHBondContact O-CG 3.44Å; R68-E72 PolarHBondContact O-N 2.91Å; E72-I75 PolarHBondContact O-N 3.22Å; E72-G76 PolarHBondContact O-N 2.95Å
73	L	52.1	Low	53.8	Low	47 Å²	47	76.6 Å²	76.6	25%	0.246	41%	0.414	C	S	.	.	H	α-helix	trans	-62.3	-47.5	173.3	-178.4	72.8	0	0	0	111.1	L24 V28 A69 H70 D71 I75 G76 V77	L24-L73 HydrophobicContact CD2-CD1 3.97Å; V28-L73 HydrophobicContact CG2-CD1 4.29Å; A69-L73 WeakPolarHBondContact O-CB 3.45Å; A69-L73 PolarHBondContact O-N 2.88Å; H70-L73 WeakPolarHBondContact O-CB 3.45Å; H70-L73 PolarHBondContact O-N 2.81Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 3.37Å; L73-I75 VanDerWaalsContact C-N 3.32Å; L73-I75 PolarHBondContact O-N 3.42Å; L73-G76 PolarHBondContact O-N 3.43Å; L73-V77 HydrophobicContact CD1-CG2 4.38Å; L73-V77 HydrophobicContact CG-CG2 4.3Å; L73-V77 WeakPolarHBondContact O-CB 3.3Å; L73-V77 VanDerWaalsContact O-CG2 3.24Å; L73-V77 WeakPolarHBondContact O-CG2 3.47Å; L73-V77 PolarHBondContact O-N 3.38Å
74	L	52.9	Low	53.9	Low	89 Å²	89	74.6 Å²	74.6	47%	0.466	40%	0.395	S	S	.	.	H	α-helix	trans	-59.7	-43.6	178.4	-75.5	177.5	0	0	0	111	H70 D71 V77 E78	H70-L74 WeakPolarHBondContact O-CB 3.34Å; H70-L74 WeakPolarHBondContact O-CG 3.24Å; H70-L74 PolarHBondContact O-N 3.33Å; D71-L74 PolarHBondContact O-N 3.47Å; L74-V77 PolarHBondContact O-N 2.86Å; L74-E78 VanDerWaalsContact O-CB 3.24Å; L74-E78 WeakPolarHBondContact O-CB 3.43Å; L74-E78 PolarHBondContact O-N 3.36Å
75	I	60.1	Low	54.1	Low	91 Å²	91	74.1 Å²	74.1	47%	0.467	39%	0.39	S	S	.	.	H	α-helix	trans	-63.2	-45.2	176.5	-66.3	164	0	0	0	110.7	D71 E72 L73 E78 Q79	D71-I75 VanDerWaalsContact O-CG1 3.29Å; D71-I75 WeakPolarHBondContact O-CG1 3.24Å; D71-I75 PolarHBondContact O-N 2.82Å; E72-I75 PolarHBondContact O-N 3.22Å; L73-I75 VanDerWaalsContact C-N 3.32Å; L73-I75 PolarHBondContact O-N 3.42Å; I75-E78 PolarHBondContact O-N 2.9Å; I75-Q79 HydrophobicContact CG2-CG 4.39Å; I75-Q79 WeakPolarHBondContact O-CB 3.21Å; I75-Q79 VanDerWaalsContact O-CG 3.3Å; I75-Q79 WeakPolarHBondContact O-CG 3.5Å; I75-Q79 PolarHBondContact O-N 3.32Å
76	G	56.9	Low	54.5	Low	16 Å²	16	78.6 Å²	78.6	17%	0.165	40%	0.4	C	S	.	.	H	α-helix	trans	-64.7	-39.9	178.5	0	0	0	0	0	113.1	E72 L73 T80	E72-G76 PolarHBondContact O-N 2.95Å; L73-G76 PolarHBondContact O-N 3.43Å; G76-T80 WeakPolarHBondContact O-CB 3.31Å; G76-T80 PolarHBondContact O-N 2.99Å; G76-T80 PolarHBondContact O-OG1 3.02Å
77	V	54.3	Low	54.8	Low	57 Å²	57	75.7 Å²	75.7	35%	0.345	39%	0.385	S	S	.	.	H	α-helix	trans	-64.8	-48	173.6	172.5	0	0	0	0	110.2	L24 L73 L74 T80 F81	L24-V77 HydrophobicContact CD2-CB 4.43Å; L24-V77 HydrophobicContact CD2-CG2 3.32Å; L73-V77 HydrophobicContact CD1-CG2 4.38Å; L73-V77 HydrophobicContact CG-CG2 4.3Å; L73-V77 WeakPolarHBondContact O-CB 3.3Å; L73-V77 VanDerWaalsContact O-CG2 3.24Å; L73-V77 WeakPolarHBondContact O-CG2 3.47Å; L73-V77 PolarHBondContact O-N 3.38Å; L74-V77 PolarHBondContact O-N 2.86Å; V77-T80 PolarHBondContact O-N 3.1Å; V77-F81 VanDerWaalsContact O-CB 3.29Å; V77-F81 WeakPolarHBondContact O-CB 3.38Å; V77-F81 PolarHBondContact O-N 2.82Å
78	E	52	Low	54.8	Low	127 Å²	127	74.8 Å²	74.8	59%	0.593	37%	0.373	S	S	*	.	H	α-helix	trans	-62	-45	179.9	-174.6	-178.1	166.8	0	0	111.3	L74 I75 F81 C82	L74-E78 VanDerWaalsContact O-CB 3.24Å; L74-E78 WeakPolarHBondContact O-CB 3.43Å; L74-E78 PolarHBondContact O-N 3.36Å; I75-E78 PolarHBondContact O-N 2.9Å; E78-F81 CarbonylContact O-C 3.58Å; E78-F81 PolarHBondContact O-N 3.27Å; E78-C82 WeakPolarHBondContact O-CB 3.34Å; E78-C82 PolarHBondContact O-N 3.47Å; E78-C82 PolarHBondContact O-SG 2.79Å
79	Q	52.7	Low	55.2	Low	122 Å²	122	74.7 Å²	74.7	57%	0.57	38%	0.377	S	S	*	.	H	α-helix	trans	-61.2	-46.9	175.1	-76	-179	-13.5	0	0	111.6	I75 F81 C82 I83	I75-Q79 HydrophobicContact CG2-CG 4.39Å; I75-Q79 WeakPolarHBondContact O-CB 3.21Å; I75-Q79 VanDerWaalsContact O-CG 3.3Å; I75-Q79 WeakPolarHBondContact O-CG 3.5Å; I75-Q79 PolarHBondContact O-N 3.32Å; Q79-F81 VanDerWaalsContact C-N 3.29Å; Q79-F81 PolarHBondContact O-N 2.9Å; Q79-C82 PolarHBondContact O-N 3.21Å; Q79-I83 VanDerWaalsContact O-CG1 3.28Å; Q79-I83 WeakPolarHBondContact O-CG1 3.3Å; Q79-I83 PolarHBondContact O-N 2.8Å
80	T	58.2	Low	55.3	Low	37 Å²	37	75.8 Å²	75.8	23%	0.227	38%	0.384	C	S	.	.	H	α-helix	trans	-58.6	-46.1	175.5	-56.9	0	0	0	0	109.5	L24 G76 V77 I83 L84	L24-T80 HydrophobicContact CD1-CG2 4.16Å; G76-T80 WeakPolarHBondContact O-CB 3.31Å; G76-T80 PolarHBondContact O-N 2.99Å; G76-T80 PolarHBondContact O-OG1 3.02Å; V77-T80 PolarHBondContact O-N 3.1Å; T80-I83 PolarHBondContact O-N 3.39Å; T80-L84 HydrophobicContact CG2-CD1 3.99Å; T80-L84 HydrophobicContact CG2-CG 4.24Å; T80-L84 VanDerWaalsContact O-CB 3.22Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 WeakPolarHBondContact O-CG 3.19Å; T80-L84 PolarHBondContact O-N 3.2Å
81	F	54.3	Low	55.6	Low	90 Å²	90	80.6 Å²	80.6	40%	0.395	41%	0.407	S	S	.	.	H	α-helix	trans	-64.8	-41.4	179.5	-166.2	-103.4	0	0	0	112.8	V77 E78 Q79 L84 L85 V103	V77-F81 VanDerWaalsContact O-CB 3.29Å; V77-F81 WeakPolarHBondContact O-CB 3.38Å; V77-F81 PolarHBondContact O-N 2.82Å; E78-F81 CarbonylContact O-C 3.58Å; E78-F81 PolarHBondContact O-N 3.27Å; Q79-F81 VanDerWaalsContact C-N 3.29Å; Q79-F81 PolarHBondContact O-N 2.9Å; F81-L84 CarbonylContact O-C 3.52Å; F81-L84 WeakPolarHBondContact O-CB 3.42Å; F81-L84 PolarHBondContact O-N 2.86Å; F81-L85 HydrophobicContact CD1-CD1 3.7Å; F81-L85 HydrophobicContact CD1-CG 3.84Å; F81-L85 HydrophobicContact CE1-CD1 3.48Å; F81-L85 VanDerWaalsContact CE1-CD1 3.48Å; F81-L85 HydrophobicContact CE1-CD2 3.9Å; F81-L85 HydrophobicContact CE1-CG 3.66Å; F81-L85 HydrophobicContact CZ-CD1 4.39Å; F81-L85 HydrophobicContact CZ-CD2 3.99Å; F81-L85 HydrophobicContact CZ-CG 4.19Å; F81-L85 WeakPolarHBondContact O-CB 3.36Å; F81-L85 WeakPolarHBondContact O-CG 3.31Å; F81-L85 PolarHBondContact O-N 2.95Å; F81-V103 HydrophobicContact CD2-CG2 4.04Å; F81-V103 HydrophobicContact CE2-CG1 4.16Å; F81-V103 HydrophobicContact CE2-CG2 3.66Å
82	C	54.9	Low	55.6	Low	57 Å²	57	80.3 Å²	80.3	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-46.9	175.7	-80.4	0	0	0	0	111.7	E78 Q79 L84 L85 E86	E78-C82 WeakPolarHBondContact O-CB 3.34Å; E78-C82 PolarHBondContact O-N 3.47Å; E78-C82 PolarHBondContact O-SG 2.79Å; Q79-C82 PolarHBondContact O-N 3.21Å; C82-L84 PolarHBondContact O-N 3.46Å; C82-L85 PolarHBondContact O-N 3.27Å; C82-E86 WeakPolarHBondContact O-CB 3.29Å; C82-E86 WeakPolarHBondContact O-CG 3.45Å; C82-E86 PolarHBondContact O-N 2.92Å
83	I	62.4	Low	56.2	Low	79 Å²	79	79.7 Å²	79.7	41%	0.405	41%	0.414	S	S	.	.	H	α-helix	trans	-57.8	-45	173	-67.9	166.2	0	0	0	109.2	Q79 T80 E86 L87	Q79-I83 VanDerWaalsContact O-CG1 3.28Å; Q79-I83 WeakPolarHBondContact O-CG1 3.3Å; Q79-I83 PolarHBondContact O-N 2.8Å; T80-I83 PolarHBondContact O-N 3.39Å; I83-E86 PolarHBondContact O-N 3.47Å; I83-L87 HydrophobicContact CG2-CD1 4.05Å; I83-L87 HydrophobicContact CG2-CG 4.39Å; I83-L87 WeakPolarHBondContact O-CB 3.18Å; I83-L87 VanDerWaalsContact O-CG 3.24Å; I83-L87 WeakPolarHBondContact O-CG 3.32Å; I83-L87 PolarHBondContact O-N 3.35Å
84	L	54.8	Low	56.4	Low	16 Å²	16	81.9 Å²	81.9	8%	0.084	43%	0.425	C	S	.	.	H	α-helix	trans	-62.8	-45	179.2	-76.1	-179	0	0	0	111.7	M17 T80 F81 C82 E86 L87 L88 L99	M17-L84 HydrophobicContact CG-CD2 3.65Å; M17-L84 HydrophobicContact SD-CD2 3.81Å; T80-L84 HydrophobicContact CG2-CD1 3.99Å; T80-L84 HydrophobicContact CG2-CG 4.24Å; T80-L84 VanDerWaalsContact O-CB 3.22Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 WeakPolarHBondContact O-CG 3.19Å; T80-L84 PolarHBondContact O-N 3.2Å; F81-L84 CarbonylContact O-C 3.52Å; F81-L84 WeakPolarHBondContact O-CB 3.42Å; F81-L84 PolarHBondContact O-N 2.86Å; C82-L84 PolarHBondContact O-N 3.46Å; L84-E86 VanDerWaalsContact C-N 3.34Å; L84-E86 PolarHBondContact O-N 2.78Å; L84-L87 CarbonylContact O-C 3.53Å; L84-L87 WeakPolarHBondContact O-CA 3.47Å; L84-L87 WeakPolarHBondContact O-CB 3.34Å; L84-L87 PolarHBondContact O-N 3.39Å; L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 3.21Å; L84-L99 HydrophobicContact CB-CD1 3.57Å; L84-L99 HydrophobicContact CB-CD2 3.57Å; L84-L99 HydrophobicContact CB-CG 3.66Å; L84-L99 HydrophobicContact CD1-CD2 4.39Å; L84-L99 HydrophobicContact CD1-CG 4.22Å; L84-L99 HydrophobicContact CD2-CD1 3.41Å; L84-L99 VanDerWaalsContact CD2-CD1 3.41Å; L84-L99 HydrophobicContact CD2-CG 3.71Å; L84-L99 HydrophobicContact CG-CD1 3.98Å; L84-L99 HydrophobicContact CG-CD2 4.35Å; L84-L99 HydrophobicContact CG-CG 4.02Å; L84-L99 WeakPolarHBondContact O-CD1 3.21Å
85	L	57.2	Low	56.4	Low	71 Å²	71	77.6 Å²	77.6	37%	0.372	40%	0.403	S	S	.	.	H	α-helix	trans	-63.2	-37.7	174.9	-74.4	-177.1	0	0	0	112.4	F81 C82 L87 L88 K89	F81-L85 HydrophobicContact CD1-CD1 3.7Å; F81-L85 HydrophobicContact CD1-CG 3.84Å; F81-L85 HydrophobicContact CE1-CD1 3.48Å; F81-L85 VanDerWaalsContact CE1-CD1 3.48Å; F81-L85 HydrophobicContact CE1-CD2 3.9Å; F81-L85 HydrophobicContact CE1-CG 3.66Å; F81-L85 HydrophobicContact CZ-CD1 4.39Å; F81-L85 HydrophobicContact CZ-CD2 3.99Å; F81-L85 HydrophobicContact CZ-CG 4.19Å; F81-L85 WeakPolarHBondContact O-CB 3.36Å; F81-L85 WeakPolarHBondContact O-CG 3.31Å; F81-L85 PolarHBondContact O-N 2.95Å; C82-L85 PolarHBondContact O-N 3.27Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L85-L88 HydrophobicContact CD2-CD1 3.87Å; L85-L88 WeakPolarHBondContact O-CB 3.37Å; L85-L88 PolarHBondContact O-N 2.84Å; L85-K89 PolarHBondContact O-N 3.42Å
86	E	56.6	Low	56.3	Low	133 Å²	133	78.9 Å²	78.9	62%	0.621	40%	0.401	S	S	*	.	H	α-helix	trans	-64.6	-40.8	173	-75.5	-177.3	169	0	0	111.1	C82 I83 L84 K89	C82-E86 WeakPolarHBondContact O-CB 3.29Å; C82-E86 WeakPolarHBondContact O-CG 3.45Å; C82-E86 PolarHBondContact O-N 2.92Å; I83-E86 PolarHBondContact O-N 3.47Å; L84-E86 VanDerWaalsContact C-N 3.34Å; L84-E86 PolarHBondContact O-N 2.78Å; E86-K89 WeakPolarHBondContact O-CB 3.45Å; E86-K89 PolarHBondContact O-N 2.85Å
87	L	53.8	Low	56.3	Low	32 Å²	32	82.9 Å²	82.9	17%	0.168	42%	0.418	C	S	.	.	H	α-helix	trans	-64.7	-36.9	172.8	-71.3	177.4	0	0	0	111.9	K13 I83 L84 L85 K89 S90 L95 L99	K13-L87 HydrophobicContact CD-CD2 4.08Å; K13-L87 HydrophobicContact CG-CD2 3.91Å; I83-L87 HydrophobicContact CG2-CD1 4.05Å; I83-L87 HydrophobicContact CG2-CG 4.39Å; I83-L87 WeakPolarHBondContact O-CB 3.18Å; I83-L87 VanDerWaalsContact O-CG 3.24Å; I83-L87 WeakPolarHBondContact O-CG 3.32Å; I83-L87 PolarHBondContact O-N 3.35Å; L84-L87 CarbonylContact O-C 3.53Å; L84-L87 WeakPolarHBondContact O-CA 3.47Å; L84-L87 WeakPolarHBondContact O-CB 3.34Å; L84-L87 PolarHBondContact O-N 3.39Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L87-K89 PolarHBondContact O-N 3.36Å; L87-S90 VanDerWaalsContact O-CB 3.27Å; L87-S90 WeakPolarHBondContact O-CB 3.4Å; L87-S90 PolarHBondContact O-N 3.48Å; L87-S90 PolarHBondContact O-OG 3.36Å; L87-L95 HydrophobicContact CB-CD2 3.77Å; L87-L95 HydrophobicContact CB-CG 4.41Å; L87-L95 HydrophobicContact CD2-CD2 4.17Å; L87-L95 HydrophobicContact CG-CD2 4.43Å; L87-L99 HydrophobicContact CB-CD1 4.12Å
88	L	52.9	Low	56.2	Low	30 Å²	30	83.5 Å²	83.5	16%	0.157	42%	0.419	C	S	.	.	H	α-helix	trans	-60.6	-25.4	174	-74.8	-172.9	0	0	0	114	L84 L85 S90 R96 L99	L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 3.21Å; L85-L88 HydrophobicContact CD2-CD1 3.87Å; L85-L88 WeakPolarHBondContact O-CB 3.37Å; L85-L88 PolarHBondContact O-N 2.84Å; L88-S90 PolarHBondContact O-N 2.91Å; L88-R96 HydrophobicContact CD2-CB 3.66Å; L88-R96 HydrophobicContact CD2-CG 3.57Å; L88-R96 PolarHBondContact O-NE 2.83Å; L88-R96 PolarHBondContact O-NH2 3.43Å; L88-L99 HydrophobicContact CD1-CD2 3.59Å; L88-L99 HydrophobicContact CD2-CB 3.59Å; L88-L99 HydrophobicContact CD2-CD1 3.93Å; L88-L99 HydrophobicContact CD2-CD2 3.58Å; L88-L99 HydrophobicContact CD2-CG 3.86Å; L88-L99 HydrophobicContact CG-CB 4.32Å; L88-L99 HydrophobicContact CG-CD1 4.02Å; L88-L99 HydrophobicContact CG-CD2 3.37Å; L88-L99 HydrophobicContact CG-CG 4.05Å
89	K	57.1	Low	56.4	Low	165 Å²	165	77.5 Å²	77.5	72%	0.717	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-12.9	174.9	-65	173.2	-174.9	171.6	0	112.1	L85 E86 L87	L85-K89 PolarHBondContact O-N 3.42Å; E86-K89 WeakPolarHBondContact O-CB 3.45Å; E86-K89 PolarHBondContact O-N 2.85Å; L87-K89 PolarHBondContact O-N 3.36Å
90	S	56.9	Low	56.5	Low	32 Å²	32	76.9 Å²	76.9	22%	0.224	39%	0.389	C	S	.	.	S	Bend	trans	-68.7	143.6	169.4	71.8	0	0	0	0	110.4	L87 L88 D92 L95	L87-S90 VanDerWaalsContact O-CB 3.27Å; L87-S90 WeakPolarHBondContact O-CB 3.4Å; L87-S90 PolarHBondContact O-N 3.48Å; L87-S90 PolarHBondContact O-OG 3.36Å; L88-S90 PolarHBondContact O-N 2.91Å; S90-D92 PolarHBondContact O-N 2.85Å; S90-L95 WeakPolarHBondContact OG-CD2 3.36Å
91	E	57.6	Low	56.1	Low	202 Å²	202	79 Å²	79	94%	0.944	40%	0.404	S	S	*	.	S	Bend	trans	-66.2	-4.2	-179.3	-62.2	-172.6	165.4	0	0	113.2	S93	E91-S93 PolarHBondContact O-N 2.92Å
92	D	58.9	Low	56.1	Low	81 Å²	81	76 Å²	76	43%	0.433	40%	0.396	S	S	.	.			trans	-70.1	96.3	179.3	-78.5	-49.5	0	0	0	111.9	K13 S90 L94 L95 R96	K13-D92 IonicContact NZ-OD2 2.66Å; K13-D92 PolarHBondContact NZ-OD2 2.92Å; S90-D92 PolarHBondContact O-N 2.85Å; D92-L94 PolarHBondContact O-N 3.36Å; D92-L95 HydrophobicContact CB-CB 3.77Å; D92-L95 WeakPolarHBondContact O-CB 3.28Å; D92-L95 PolarHBondContact O-N 3.31Å; D92-L95 VanDerWaalsContact O-N 3.08Å; D92-R96 PolarHBondContact O-N 2.95Å; D92-R96 VanDerWaalsContact O-N 3.08Å
93	S	63.1	Low	56	Low	100 Å²	100	75.8 Å²	75.8	70%	0.699	39%	0.393	S	S	*	.	H	α-helix	trans	-53.8	-36.6	174.9	59	0	0	0	0	113.6	E91 R96 L97	E91-S93 PolarHBondContact O-N 2.92Å; S93-R96 PolarHBondContact O-N 3.27Å; S93-L97 PolarHBondContact O-N 3.15Å
94	L	56	Low	55.6	Low	92 Å²	92	75 Å²	75	48%	0.482	40%	0.398	S	S	.	.	H	α-helix	trans	-66.5	-41.5	177.7	-177.4	63.1	0	0	0	111.8	F10 D92 R96 L97 L98	F10-L94 HydrophobicContact CE2-CD2 3.81Å; F10-L94 HydrophobicContact CE2-CG 4.32Å; F10-L94 HydrophobicContact CZ-CD2 3.7Å; F10-L94 HydrophobicContact CZ-CG 4.44Å; D92-L94 PolarHBondContact O-N 3.36Å; L94-R96 VanDerWaalsContact C-N 3.3Å; L94-R96 PolarHBondContact O-N 3.47Å; L94-L97 PolarHBondContact O-N 2.92Å; L94-L98 HydrophobicContact CG-CD1 4.47Å; L94-L98 WeakPolarHBondContact O-CG 3.45Å; L94-L98 PolarHBondContact O-N 2.76Å
95	L	54.6	Low	55	Low	0 Å²	0	81.3 Å²	81.3	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-63.4	-42.1	176	-172.5	66.1	0	0	0	110.2	K13 M17 L87 S90 D92 L97 L98 L99	K13-L95 HydrophobicContact CB-CD1 4.15Å; K13-L95 HydrophobicContact CD-CD1 4.29Å; K13-L95 HydrophobicContact CD-CD2 3.68Å; M17-L95 HydrophobicContact CE-CD1 3.43Å; M17-L95 VanDerWaalsContact CE-CD1 3.43Å; M17-L95 HydrophobicContact SD-CD1 4Å; L87-L95 HydrophobicContact CB-CD2 3.77Å; L87-L95 HydrophobicContact CB-CG 4.41Å; L87-L95 HydrophobicContact CD2-CD2 4.17Å; L87-L95 HydrophobicContact CG-CD2 4.43Å; S90-L95 WeakPolarHBondContact OG-CD2 3.36Å; D92-L95 HydrophobicContact CB-CB 3.77Å; D92-L95 WeakPolarHBondContact O-CB 3.28Å; D92-L95 PolarHBondContact O-N 3.31Å; D92-L95 VanDerWaalsContact O-N 3.08Å; L95-L97 PolarHBondContact O-N 3.36Å; L95-L98 PolarHBondContact O-N 3.12Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.37Å
96	R	56.9	Low	54.5	Low	117 Å²	117	81 Å²	81	44%	0.442	42%	0.415	S	S	.	.	H	α-helix	trans	-59.3	-45	175.3	175.9	168.5	-64	-161.9	4.4	112.8	L88 D92 S93 L94 L99 E100	L88-R96 HydrophobicContact CD2-CB 3.66Å; L88-R96 HydrophobicContact CD2-CG 3.57Å; L88-R96 PolarHBondContact O-NE 2.83Å; L88-R96 PolarHBondContact O-NH2 3.43Å; D92-R96 PolarHBondContact O-N 2.95Å; D92-R96 VanDerWaalsContact O-N 3.08Å; S93-R96 PolarHBondContact O-N 3.27Å; L94-R96 VanDerWaalsContact C-N 3.3Å; L94-R96 PolarHBondContact O-N 3.47Å; R96-L99 WeakPolarHBondContact O-CB 3.39Å; R96-L99 PolarHBondContact O-N 3.21Å; R96-E100 WeakPolarHBondContact O-CG 3.4Å; R96-E100 PolarHBondContact O-N 2.97Å
97	L	57.1	Low	54.2	Low	100 Å²	100	78.9 Å²	78.9	52%	0.524	42%	0.42	S	S	.	.	H	α-helix	trans	-61.9	-45.9	176.6	-176.8	67.8	0	0	0	112.4	S93 L94 L95 L99 E100 C101	S93-L97 PolarHBondContact O-N 3.15Å; L94-L97 PolarHBondContact O-N 2.92Å; L95-L97 PolarHBondContact O-N 3.36Å; L97-L99 PolarHBondContact O-N 2.86Å; L97-E100 PolarHBondContact O-N 2.81Å; L97-C101 WeakPolarHBondContact O-CB 3.24Å; L97-C101 PolarHBondContact O-N 3.33Å
98	L	52.4	Low	53.8	Low	70 Å²	70	87.5 Å²	87.5	37%	0.366	45%	0.452	S	S	.	.	H	α-helix	trans	-58.4	-35.7	177.5	-73.7	172.3	0	0	0	111.6	F10 M17 L94 L95 C101 A102	F10-L98 HydrophobicContact CE2-CD1 4.5Å; F10-L98 HydrophobicContact CZ-CD1 4.34Å; M17-L98 HydrophobicContact CE-CB 3.99Å; M17-L98 HydrophobicContact CE-CD1 3.9Å; M17-L98 HydrophobicContact SD-CB 4.46Å; L94-L98 HydrophobicContact CG-CD1 4.47Å; L94-L98 WeakPolarHBondContact O-CG 3.45Å; L94-L98 PolarHBondContact O-N 2.76Å; L95-L98 PolarHBondContact O-N 3.12Å; L98-C101 WeakPolarHBondContact O-CB 3.19Å; L98-A102 PolarHBondContact O-N 3.47Å
99	L	55.5	Low	53.2	Low	2 Å²	2	94.3 Å²	94.3	1%	0.01	49%	0.488	C	S	.	.	H	α-helix	trans	-75.3	-45.6	-178.5	-148.2	129.9	0	0	0	113.1	M17 L84 L87 L88 L95 R96 L97 C101 A102 V103	M17-L99 HydrophobicContact SD-CD1 4.37Å; L84-L99 HydrophobicContact CB-CD1 3.57Å; L84-L99 HydrophobicContact CB-CD2 3.57Å; L84-L99 HydrophobicContact CB-CG 3.66Å; L84-L99 HydrophobicContact CD1-CD2 4.39Å; L84-L99 HydrophobicContact CD1-CG 4.22Å; L84-L99 HydrophobicContact CD2-CD1 3.41Å; L84-L99 VanDerWaalsContact CD2-CD1 3.41Å; L84-L99 HydrophobicContact CD2-CG 3.71Å; L84-L99 HydrophobicContact CG-CD1 3.98Å; L84-L99 HydrophobicContact CG-CD2 4.35Å; L84-L99 HydrophobicContact CG-CG 4.02Å; L84-L99 WeakPolarHBondContact O-CD1 3.21Å; L87-L99 HydrophobicContact CB-CD1 4.12Å; L88-L99 HydrophobicContact CD1-CD2 3.59Å; L88-L99 HydrophobicContact CD2-CB 3.59Å; L88-L99 HydrophobicContact CD2-CD1 3.93Å; L88-L99 HydrophobicContact CD2-CD2 3.58Å; L88-L99 HydrophobicContact CD2-CG 3.86Å; L88-L99 HydrophobicContact CG-CB 4.32Å; L88-L99 HydrophobicContact CG-CD1 4.02Å; L88-L99 HydrophobicContact CG-CD2 3.37Å; L88-L99 HydrophobicContact CG-CG 4.05Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.37Å; R96-L99 WeakPolarHBondContact O-CB 3.39Å; R96-L99 PolarHBondContact O-N 3.21Å; L97-L99 PolarHBondContact O-N 2.86Å; L99-C101 PolarHBondContact O-N 3.21Å; L99-A102 PolarHBondContact O-N 3.08Å; L99-A102 VanDerWaalsContact O-N 3.13Å; L99-V103 HydrophobicContact CD2-CG2 4.35Å; L99-V103 WeakPolarHBondContact O-CG2 3.28Å; L99-V103 PolarHBondContact O-N 3.07Å
100	E	54.9	Low	53	Low	108 Å²	108	90.8 Å²	90.8	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-57.4	-41.7	171.8	-74.4	177.9	-170.6	0	0	110.6	R96 L97 V103 A104	R96-E100 WeakPolarHBondContact O-CG 3.4Å; R96-E100 PolarHBondContact O-N 2.97Å; L97-E100 PolarHBondContact O-N 2.81Å; E100-V103 PolarHBondContact O-N 3.27Å; E100-A104 VanDerWaalsContact O-CB 3.23Å; E100-A104 WeakPolarHBondContact O-CB 3.39Å; E100-A104 PolarHBondContact O-N 3.44Å
101	C	50.1	Low	52.8	Low	82 Å²	82	93.9 Å²	93.9	55%	0.554	49%	0.489	S	S	*	.	H	α-helix	trans	-60.5	-44.8	173.1	-92.6	0	0	0	0	112.9	L97 L98 L99 R105	L97-C101 WeakPolarHBondContact O-CB 3.24Å; L97-C101 PolarHBondContact O-N 3.33Å; L98-C101 WeakPolarHBondContact O-CB 3.19Å; L99-C101 PolarHBondContact O-N 3.21Å; C101-R105 PolarHBondContact O-N 2.95Å; C101-R105 VanDerWaalsContact O-N 3.08Å
102	A	54.2	Low	52.5	Low	28 Å²	28	87.9 Å²	87.9	23%	0.231	46%	0.464	C	S	.	.	H	α-helix	trans	-62.3	-45.4	178.3	0	0	0	0	0	111.4	L98 L99 R105 Y106	L98-A102 PolarHBondContact O-N 3.47Å; L99-A102 PolarHBondContact O-N 3.08Å; L99-A102 VanDerWaalsContact O-N 3.13Å; A102-R105 PolarHBondContact O-N 2.98Å; A102-Y106 WeakPolarHBondContact O-CD2 3.48Å; A102-Y106 PolarHBondContact O-N 3.41Å
103	V	53.7	Low	52.1	Low	52 Å²	52	88.3 Å²	88.3	32%	0.315	47%	0.466	S	S	.	.	H	α-helix	trans	-65	-45.9	177.8	174.8	0	0	0	0	111.4	F81 L99 E100 R105 Y106 A107	F81-V103 HydrophobicContact CD2-CG2 4.04Å; F81-V103 HydrophobicContact CE2-CG1 4.16Å; F81-V103 HydrophobicContact CE2-CG2 3.66Å; L99-V103 HydrophobicContact CD2-CG2 4.35Å; L99-V103 WeakPolarHBondContact O-CG2 3.28Å; L99-V103 PolarHBondContact O-N 3.07Å; E100-V103 PolarHBondContact O-N 3.27Å; V103-R105 PolarHBondContact O-N 3.44Å; V103-Y106 PolarHBondContact O-N 2.85Å; V103-Y106 VanDerWaalsContact O-N 3.07Å; V103-A107 PolarHBondContact O-N 2.86Å
104	A	52.9	Low	51.4	Low	61 Å²	61	87.6 Å²	87.6	50%	0.504	45%	0.451	S	S	.	.	H	α-helix	trans	-59.3	-36.4	178.6	0	0	0	0	0	112.2	E100 A107 Y108	E100-A104 VanDerWaalsContact O-CB 3.23Å; E100-A104 WeakPolarHBondContact O-CB 3.39Å; E100-A104 PolarHBondContact O-N 3.44Å; A104-A107 PolarHBondContact O-N 2.74Å; A104-Y108 PolarHBondContact O-N 3.11Å
105	R	43.4	Very low	51.1	Low	150 Å²	150	87.3 Å²	87.3	57%	0.566	45%	0.449	S	S	*	.	H	α-helix	trans	-66.5	-35.8	176	-174.4	172.2	175	165	-2	112.7	C101 A102 V103	C101-R105 PolarHBondContact O-N 2.95Å; C101-R105 VanDerWaalsContact O-N 3.08Å; A102-R105 PolarHBondContact O-N 2.98Å; V103-R105 PolarHBondContact O-N 3.44Å
106	Y	46.5	Very low	50.9	Low	64 Å²	64	93.5 Å²	93.5	25%	0.251	48%	0.482	S	S	.	.	H	α-helix	trans	-72.6	-38.2	175.1	-87.1	-76.9	0	0	0	112.8	F21 L24 A102 V103 Y108 L109	F21-Y106 AromaticContact CD2-CE2 3.78Å; F21-Y106 HydrophobicContact CD2-CE2 3.78Å; F21-Y106 AromaticContact CE2-CE2 3.81Å; F21-Y106 HydrophobicContact CE2-CE2 3.81Å; L24-Y106 HydrophobicContact CB-CE1 4.4Å; L24-Y106 WeakPolarHBondContact CB-OH 3.14Å; L24-Y106 HydrophobicContact CD1-CE2 4.35Å; A102-Y106 WeakPolarHBondContact O-CD2 3.48Å; A102-Y106 PolarHBondContact O-N 3.41Å; V103-Y106 PolarHBondContact O-N 2.85Å; V103-Y106 VanDerWaalsContact O-N 3.07Å; Y106-Y108 PolarHBondContact O-N 3.43Å; Y106-Y108 VanDerWaalsContact O-N 3.14Å; Y106-L109 PolarHBondContact O-N 3.44Å; Y106-L109 VanDerWaalsContact O-N 3.16Å
107	A	49	Very low	50.4	Low	88 Å²	88	91.7 Å²	91.7	73%	0.727	49%	0.485	S	S	*	.	H	α-helix	trans	-64.4	-17.1	179.1	0	0	0	0	0	113.7	V103 A104	V103-A107 PolarHBondContact O-N 2.86Å; A104-A107 PolarHBondContact O-N 2.74Å
108	Y	46.5	Very low	49.9	Very low	213 Å²	213	91 Å²	91	84%	0.835	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-15.4	178	-165.4	-93	0	0	0	113.8	A104 Y106	A104-Y108 PolarHBondContact O-N 3.11Å; Y106-Y108 PolarHBondContact O-N 3.43Å; Y106-Y108 VanDerWaalsContact O-N 3.14Å
109	L	39.4	Very low	49.6	Very low	174 Å²	174	92.9 Å²	92.9	91%	0.911	49%	0.492	S	S	*	.			trans	-87.9	0	176	-71.4	174	0	0	0	110.7	Y106	Y106-L109 PolarHBondContact O-N 3.44Å; Y106-L109 VanDerWaalsContact O-N 3.16Å

Retrieved 109 of 109 residues in 51.5 ms (Link to these results)

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