A0A061AKK5_CAEEL Loading...

Recep_L_domain domain-containing protein

AlphaFold DB , UniProt , Accession A0A061AKK5, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 216 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	28.7	Very low	36	Very low	246 Å²	246	126.7 Å²	126.7	100%	1.212	67%	0.667	S	S	*	*				0	98.8	0	-65.9	169.3	-173.4	0	0	106.5
2	R	24.4	Very low	36.8	Very low	252 Å²	252	120.5 Å²	120.5	95%	0.951	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-94.1	128.4	173.2	-81.1	-176.9	-176.9	170.1	0.8	106.9
3	A	26.9	Very low	37.1	Very low	99 Å²	99	117.6 Å²	117.6	82%	0.818	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-54.9	145.7	-175.2	0	0	0	0	0	111.4
4	G	33.3	Very low	37.9	Very low	55 Å²	55	111.6 Å²	111.6	57%	0.567	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-53.2	151.8	170.9	0	0	0	0	0	111
5	H	36.7	Very low	38.8	Very low	161 Å²	161	107.1 Å²	107.1	75%	0.745	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-62.4	150.5	178.2	-98.6	-92.6	0	0	0	110	Y7 D113	H5-Y7 PolarHBondContact O-N 3.38Å; H5-D113 WeakPolarHBondContact CB-OD2 3.02Å
6	V	40.1	Very low	39.1	Very low	132 Å²	132	108.9 Å²	108.9	80%	0.8	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-68.3	124.8	-179.3	177.5	0	0	0	0	107.7	D8	V6-D8 PolarHBondContact O-N 2.92Å
7	Y	34.3	Very low	39.6	Very low	138 Å²	138	108.2 Å²	108.2	54%	0.541	56%	0.562	S	S	.	*			trans	-34.9	118.7	165.8	175.9	-100.8	0	0	0	110.4	H5 P9 D12	H5-Y7 PolarHBondContact O-N 3.38Å; Y7-P9 HydrophobicContact CD1-CB 4.39Å; Y7-P9 HydrophobicContact CD1-CG 4.24Å; Y7-P9 HydrophobicContact CE1-CB 3.81Å; Y7-P9 HydrophobicContact CE1-CG 4.11Å; Y7-P9 VanDerWaalsContact O-CD 3.24Å; Y7-P9 WeakPolarHBondContact O-CD 3.4Å; Y7-D12 WeakPolarHBondContact CD2-OD2 3.26Å; Y7-D12 HydrophobicContact CE2-CB 4.11Å; Y7-D12 WeakPolarHBondContact CE2-OD2 3.49Å
8	D	42.8	Very low	40.1	Very low	85 Å²	85	103.4 Å²	103.4	46%	0.455	54%	0.544	S	S	.	.			trans	-100.4	99.2	174.7	-170.4	-19.5	0	0	0	108.4	V6 L10 I11	V6-D8 PolarHBondContact O-N 2.92Å; D8-L10 PolarHBondContact O-N 3.07Å; D8-L10 WeakPolarHBondContact OD1-CB 3.44Å; D8-L10 PolarHBondContact OD1-N 3.37Å; D8-L10 VanDerWaalsContact OD1-N 3.09Å; D8-I11 PolarHBondContact O-N 3.47Å
9	P	38.8	Very low	41	Very low	60 Å²	60	99 Å²	99	39%	0.39	52%	0.522	S	S	.	.	H	α-helix	trans	-57.6	-21.2	-176	1.7	-3	0	0	0	112.9	Y7 H13	Y7-P9 HydrophobicContact CD1-CB 4.39Å; Y7-P9 HydrophobicContact CD1-CG 4.24Å; Y7-P9 HydrophobicContact CE1-CB 3.81Å; Y7-P9 HydrophobicContact CE1-CG 4.11Å; Y7-P9 VanDerWaalsContact O-CD 3.24Å; Y7-P9 WeakPolarHBondContact O-CD 3.4Å; P9-H13 WeakPolarHBondContact O-CB 3.34Å; P9-H13 PolarHBondContact O-CD2 2.72Å; P9-H13 PolarHBondContact O-N 3.37Å
10	L	42.3	Very low	41.5	Very low	111 Å²	111	103.4 Å²	103.4	58%	0.581	53%	0.531	S	S	*	.	H	α-helix	trans	-66.9	-45.5	-177.9	-152.7	84.4	0	0	0	111.4	D8 L14	D8-L10 PolarHBondContact O-N 3.07Å; D8-L10 WeakPolarHBondContact OD1-CB 3.44Å; D8-L10 PolarHBondContact OD1-N 3.37Å; D8-L10 VanDerWaalsContact OD1-N 3.09Å; L10-L14 WeakPolarHBondContact O-CB 3.32Å; L10-L14 WeakPolarHBondContact O-CD1 3.26Å; L10-L14 WeakPolarHBondContact O-CG 3.5Å; L10-L14 PolarHBondContact O-N 3.22Å
11	I	48.2	Very low	41.4	Very low	55 Å²	55	108.2 Å²	108.2	28%	0.282	54%	0.544	S	S	.	.	H	α-helix	trans	-72.4	-41.4	-175.6	-62.5	176.5	0	0	0	110.8	D8 L14 I128	D8-I11 PolarHBondContact O-N 3.47Å; I11-L14 PolarHBondContact O-N 3.43Å; I11-I128 HydrophobicContact CG2-CB 4.37Å; I11-I128 HydrophobicContact CG2-CD1 4.35Å
12	D	44.8	Very low	42.3	Very low	52 Å²	52	102 Å²	102	28%	0.278	52%	0.522	S	S	.	.	H	α-helix	trans	-74.6	-38	179.9	-73	-29.1	0	0	0	111.9	Y7 L14 L15 E16	Y7-D12 WeakPolarHBondContact CD2-OD2 3.26Å; Y7-D12 HydrophobicContact CE2-CB 4.11Å; Y7-D12 WeakPolarHBondContact CE2-OD2 3.49Å; D12-L14 VanDerWaalsContact C-N 3.33Å; D12-L14 PolarHBondContact O-N 2.85Å; D12-L15 PolarHBondContact O-N 3.18Å; D12-E16 PolarHBondContact O-N 2.73Å
13	H	41.5	Very low	43.8	Very low	83 Å²	83	92.3 Å²	92.3	38%	0.384	49%	0.491	S	S	.	.	H	α-helix	trans	-69	-27.3	171.8	-80.1	-61.6	0	0	0	113.5	P9 L15 E16 D17	P9-H13 WeakPolarHBondContact O-CB 3.34Å; P9-H13 PolarHBondContact O-CD2 2.72Å; P9-H13 PolarHBondContact O-N 3.37Å; H13-L15 PolarHBondContact O-N 2.91Å; H13-E16 PolarHBondContact O-N 2.87Å; H13-D17 IonicContact ND1-OD2 3.55Å; H13-D17 PolarHBondContact O-N 3.46Å
14	L	47.7	Very low	45.1	Very low	34 Å²	34	98.8 Å²	98.8	18%	0.178	49%	0.494	C	S	.	.	I	π-helix	trans	-61.7	-30.3	175.5	-86	160.8	0	0	0	112.3	L10 I11 D12 G18 C19 F96 L130	L10-L14 WeakPolarHBondContact O-CB 3.32Å; L10-L14 WeakPolarHBondContact O-CD1 3.26Å; L10-L14 WeakPolarHBondContact O-CG 3.5Å; L10-L14 PolarHBondContact O-N 3.22Å; I11-L14 PolarHBondContact O-N 3.43Å; D12-L14 VanDerWaalsContact C-N 3.33Å; D12-L14 PolarHBondContact O-N 2.85Å; L14-G18 WeakPolarHBondContact O-CA 3.19Å; L14-G18 PolarHBondContact O-N 3.45Å; L14-C19 PolarHBondContact O-N 3.24Å; L14-F96 HydrophobicContact CD1-CD1 4.26Å; L14-F96 HydrophobicContact CD1-CE1 3.27Å; L14-F96 HydrophobicContact CD1-CZ 3.71Å; L14-F96 HydrophobicContact CD2-CE1 3.78Å; L14-F96 HydrophobicContact CD2-CE2 4.07Å; L14-F96 HydrophobicContact CD2-CZ 3.36Å; L14-F96 HydrophobicContact CG-CE1 4.04Å; L14-F96 HydrophobicContact CG-CZ 4.13Å; L14-L130 HydrophobicContact CD1-CD2 4.32Å
15	L	52.1	Low	46.4	Very low	44 Å²	44	101.4 Å²	101.4	23%	0.23	49%	0.492	C	S	.	.	I	π-helix	trans	-79.5	-31.9	176.4	-67.5	156.7	0	0	0	112.7	D12 H13 F117 I128	D12-L15 PolarHBondContact O-N 3.18Å; H13-L15 PolarHBondContact O-N 2.91Å; L15-F117 HydrophobicContact CD1-CE1 3.67Å; L15-F117 HydrophobicContact CD1-CE2 3.74Å; L15-F117 HydrophobicContact CD1-CZ 3.18Å; L15-F117 HydrophobicContact CD2-CD1 4.3Å; L15-F117 HydrophobicContact CD2-CE1 3.91Å; L15-F117 HydrophobicContact CD2-CZ 4.26Å; L15-F117 HydrophobicContact CG-CE1 4.27Å; L15-F117 HydrophobicContact CG-CZ 4.24Å; L15-I128 HydrophobicContact CD1-CD1 3.84Å; L15-I128 HydrophobicContact CD2-CD1 4.02Å; L15-I128 HydrophobicContact CG-CD1 4.22Å
16	E	42.8	Very low	47.9	Very low	135 Å²	135	95.7 Å²	95.7	63%	0.631	47%	0.469	S	S	*	.	I	π-helix	trans	-88.1	-37.4	-179.9	-69	-169.7	153.1	0	0	113.8	D12 H13	D12-E16 PolarHBondContact O-N 2.73Å; H13-E16 PolarHBondContact O-N 2.87Å
17	D	47.3	Very low	49.4	Very low	97 Å²	97	96.5 Å²	96.5	52%	0.519	46%	0.461	S	S	.	.	I	π-helix	trans	-118.1	-14.9	-170	-72.3	-40.5	0	0	0	114.9	H13	H13-D17 IonicContact ND1-OD2 3.55Å; H13-D17 PolarHBondContact O-N 3.46Å
18	G	48.9	Very low	51.1	Low	22 Å²	22	91 Å²	91	23%	0.227	44%	0.442	C	S	.	.	I	π-helix	trans	-98.5	-38.9	-173.3	0	0	0	0	0	115.3	L14	L14-G18 WeakPolarHBondContact O-CA 3.19Å; L14-G18 PolarHBondContact O-N 3.45Å
19	C	57.1	Low	52.5	Low	20 Å²	20	87.6 Å²	87.6	14%	0.135	42%	0.423	C	S	.	.	S	Bend	trans	-128.4	48.4	-166	-59.2	0	0	0	0	111.6	L14 Y21 V23 C89	L14-C19 PolarHBondContact O-N 3.24Å; C19-Y21 PolarHBondContact O-N 2.84Å; C19-Y21 VanDerWaalsContact O-N 3.09Å; C19-V23 HydrophobicContact CB-CG2 4.42Å; C19-C89 HydrophobicContact CB-CB 3.57Å; C19-C89 WeakPolarHBondContact CB-SG 3.3Å; C19-C89 WeakPolarHBondContact SG-CB 3.37Å; C19-C89 CovalentContact SG-SG 2.01Å; C19-C89 PolarHBondContact SG-SG 3.41Å
20	R	51.2	Low	54.1	Low	187 Å²	187	91.7 Å²	91.7	71%	0.706	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-55.5	116.1	178.2	-77.5	-173.3	179.9	-178.4	2.6	110.4	P22 V23	R20-P22 CarbonylContact O-C 3.3Å; R20-V23 VanDerWaalsContact O-CG2 3.29Å; R20-V23 WeakPolarHBondContact O-CG2 3.29Å
21	Y	40	Very low	55.7	Low	204 Å²	204	88.1 Å²	88.1	80%	0.8	41%	0.411	S	S	*	.	S	Bend	trans	-68.2	141	172.9	-154.2	-92.4	0	0	0	109.9	C19	C19-Y21 PolarHBondContact O-N 2.84Å; C19-Y21 VanDerWaalsContact O-N 3.09Å
22	P	47.2	Very low	57	Low	115 Å²	115	85.5 Å²	85.5	75%	0.747	40%	0.397	S	S	*	.	S	Bend	cis	-83.4	121.9	-0.8	32	-29.9	0	0	0	111.9	R20	R20-P22 CarbonylContact O-C 3.3Å
23	V	55.1	Low	58.5	Low	50 Å²	50	85.8 Å²	85.8	30%	0.303	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-81.2	121.9	175.8	-173.4	0	0	0	0	107.9	C19 R20 Q25	C19-V23 HydrophobicContact CB-CG2 4.42Å; R20-V23 VanDerWaalsContact O-CG2 3.29Å; R20-V23 WeakPolarHBondContact O-CG2 3.29Å; V23-Q25 PolarHBondContact O-N 3.41Å
24	R	54.9	Low	60.1	Low	234 Å²	234	88.2 Å²	88.2	88%	0.883	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-61.6	122.8	163.4	-86	-176.3	177.6	176.2	0.3	107	T26	R24-T26 PolarHBondContact O-N 3.5Å; R24-T26 VanDerWaalsContact O-N 3.09Å
25	Q	60.2	Low	61.5	Low	111 Å²	111	88.3 Å²	88.3	52%	0.519	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-52.6	120	179.3	-79.2	-178.7	-19.5	0	0	110.6	V23 E29	V23-Q25 PolarHBondContact O-N 3.41Å; Q25-E29 WeakPolarHBondContact CA-OE2 3.37Å
26	T	68.7	Low	62.5	Low	41 Å²	41	86.2 Å²	86.2	25%	0.252	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-73.3	162.8	176.7	56.8	0	0	0	0	110.6	R24 L28 E29 R30 S90	R24-T26 PolarHBondContact O-N 3.5Å; R24-T26 VanDerWaalsContact O-N 3.09Å; T26-L28 PolarHBondContact O-N 2.84Å; T26-E29 PolarHBondContact O-N 2.83Å; T26-E29 VanDerWaalsContact OG1-CG 3.26Å; T26-E29 WeakPolarHBondContact OG1-CG 3.35Å; T26-E29 PolarHBondContact OG1-N 3.25Å; T26-E29 PolarHBondContact OG1-OE1 2.84Å; T26-R30 PolarHBondContact O-N 2.62Å; T26-S90 WeakPolarHBondContact CB-OG 3.19Å; T26-S90 WeakPolarHBondContact OG1-CB 3.38Å; T26-S90 PolarHBondContact OG1-OG 2.77Å
27	F	71.5	Confident	63.9	Low	148 Å²	148	83.2 Å²	83.2	65%	0.649	38%	0.384	S	S	*	.	H	α-helix	trans	-53.5	-43.1	177.2	175.1	-96.2	0	0	0	111.7	R30 E31	F27-R30 PolarHBondContact O-N 3.29Å; F27-E31 WeakPolarHBondContact CE1-OE2 3.43Å; F27-E31 WeakPolarHBondContact O-CB 3.23Å; F27-E31 PolarHBondContact O-N 3.33Å
28	L	70.9	Confident	64.9	Low	24 Å²	24	81.3 Å²	81.3	13%	0.126	39%	0.387	C	S	.	.	H	α-helix	trans	-65.4	-40.2	179.7	-62.5	-177.5	0	0	0	113.4	T26 R30 F32 L95 I134	T26-L28 PolarHBondContact O-N 2.84Å; L28-R30 VanDerWaalsContact C-N 3.3Å; L28-F32 WeakPolarHBondContact O-CB 3.26Å; L28-F32 PolarHBondContact O-N 2.82Å; L28-L95 HydrophobicContact CB-CD1 4.34Å; L28-I134 HydrophobicContact CD1-CD1 4.03Å; L28-I134 HydrophobicContact CD2-CD1 3.34Å; L28-I134 HydrophobicContact CG-CD1 4.18Å
29	E	70.8	Confident	65.4	Low	12 Å²	12	87.6 Å²	87.6	6%	0.056	42%	0.415	C	S	.	.	H	α-helix	trans	-64.7	-39.6	174.8	-72.4	160.7	-133.7	0	0	111	Q25 T26 I33 P87 C89 S90 L95	Q25-E29 WeakPolarHBondContact CA-OE2 3.37Å; T26-E29 PolarHBondContact O-N 2.83Å; T26-E29 VanDerWaalsContact OG1-CG 3.26Å; T26-E29 WeakPolarHBondContact OG1-CG 3.35Å; T26-E29 PolarHBondContact OG1-N 3.25Å; T26-E29 PolarHBondContact OG1-OE1 2.84Å; E29-I33 WeakPolarHBondContact O-CB 3.28Å; E29-I33 WeakPolarHBondContact O-CD1 3.37Å; E29-I33 WeakPolarHBondContact O-CG1 3.36Å; E29-I33 PolarHBondContact O-N 2.88Å; E29-P87 HydrophobicContact CG-CB 4.41Å; E29-C89 VanDerWaalsContact OE1-CA 3.26Å; E29-C89 WeakPolarHBondContact OE1-CA 3.44Å; E29-S90 PolarHBondContact OE1-N 2.81Å; E29-L95 HydrophobicContact CG-CD1 4.13Å
30	R	72.9	Confident	65.4	Low	147 Å²	147	88.1 Å²	88.1	56%	0.555	42%	0.418	S	S	*	.	H	α-helix	trans	-67.4	-46.7	178.5	-171.9	-177.1	-61.5	171.6	3.2	111.7	T26 F27 L28 I33 E34	T26-R30 PolarHBondContact O-N 2.62Å; F27-R30 PolarHBondContact O-N 3.29Å; L28-R30 VanDerWaalsContact C-N 3.3Å; R30-I33 PolarHBondContact O-N 3.23Å; R30-E34 WeakPolarHBondContact O-CB 3.39Å; R30-E34 PolarHBondContact O-N 3.43Å
31	E	75.4	Confident	65.6	Low	35 Å²	35	84 Å²	84	16%	0.164	41%	0.413	C	S	.	.	H	α-helix	trans	-59.5	-46.5	177	-177.9	176.4	-152.8	0	0	110.9	F27 I33 E34 V35 I137	F27-E31 WeakPolarHBondContact CE1-OE2 3.43Å; F27-E31 WeakPolarHBondContact O-CB 3.23Å; F27-E31 PolarHBondContact O-N 3.33Å; E31-I33 VanDerWaalsContact C-N 3.34Å; E31-I33 PolarHBondContact O-N 3.35Å; E31-E34 PolarHBondContact O-N 2.91Å; E31-V35 HydrophobicContact CG-CG2 4.42Å; E31-V35 WeakPolarHBondContact O-CB 3.34Å; E31-V35 VanDerWaalsContact O-CG2 3.28Å; E31-V35 WeakPolarHBondContact O-CG2 3.43Å; E31-V35 PolarHBondContact O-N 2.97Å; E31-I137 VanDerWaalsContact OE1-CG2 3.22Å; E31-I137 WeakPolarHBondContact OE1-CG2 2.99Å
32	F	76.5	Confident	66.5	Low	1 Å²	1	77.3 Å²	77.3	0%	0.004	41%	0.407	C	S	.	.	H	α-helix	trans	-57.4	-46.9	173.8	-178.6	-87.3	0	0	0	111.8	L28 E34 V35 V36 Y37 I51 F56 P87 L95 L97	L28-F32 WeakPolarHBondContact O-CB 3.26Å; L28-F32 PolarHBondContact O-N 2.82Å; F32-E34 VanDerWaalsContact C-N 3.35Å; F32-E34 PolarHBondContact O-N 3.22Å; F32-V35 PolarHBondContact O-N 3.36Å; F32-V36 HydrophobicContact CD1-CB 4.38Å; F32-V36 HydrophobicContact CD1-CG2 4.2Å; F32-V36 HydrophobicContact CD2-CG2 3.88Å; F32-V36 HydrophobicContact CE1-CB 4.07Å; F32-V36 HydrophobicContact CE1-CG1 4.19Å; F32-V36 HydrophobicContact CE1-CG2 3.98Å; F32-V36 HydrophobicContact CE2-CG2 3.67Å; F32-V36 HydrophobicContact CG-CG2 4.15Å; F32-V36 HydrophobicContact CZ-CB 4.2Å; F32-V36 HydrophobicContact CZ-CG1 4.13Å; F32-V36 HydrophobicContact CZ-CG2 3.72Å; F32-V36 WeakPolarHBondContact O-CB 2.91Å; F32-V36 VanDerWaalsContact O-CG2 3.23Å; F32-V36 WeakPolarHBondContact O-CG2 3.45Å; F32-V36 PolarHBondContact O-N 3.26Å; F32-Y37 HydrophobicContact CE1-CE2 4.09Å; F32-I51 HydrophobicContact CE2-CG2 3.54Å; F32-I51 HydrophobicContact CZ-CG2 3.86Å; F32-F56 HydrophobicContact CD2-CD1 4.09Å; F32-F56 HydrophobicContact CD2-CE1 4.19Å; F32-F56 HydrophobicContact CD2-CG 4.34Å; F32-P87 HydrophobicContact CD1-CB 4.06Å; F32-P87 HydrophobicContact CD1-CG 3.74Å; F32-P87 HydrophobicContact CE1-CB 4.49Å; F32-P87 HydrophobicContact CE1-CG 4.2Å; F32-L95 HydrophobicContact CB-CD2 3.92Å; F32-L95 HydrophobicContact CD2-CD2 3.69Å; F32-L95 HydrophobicContact CG-CD2 3.99Å; F32-L97 HydrophobicContact CD1-CD2 4.3Å; F32-L97 HydrophobicContact CD2-CD2 3.79Å; F32-L97 HydrophobicContact CE1-CD2 3.91Å; F32-L97 HydrophobicContact CE2-CD1 3.95Å; F32-L97 HydrophobicContact CE2-CD2 3.32Å; F32-L97 HydrophobicContact CE2-CG 4.32Å; F32-L97 HydrophobicContact CG-CD2 4.25Å; F32-L97 HydrophobicContact CZ-CD2 3.4Å
33	I	75.4	Confident	67.5	Low	57 Å²	57	80 Å²	80	29%	0.292	40%	0.403	S	S	.	.	H	α-helix	trans	-62	-44.7	179.2	-71.1	164.9	0	0	0	110.6	E29 R30 E31 Y37 G38 P87	E29-I33 WeakPolarHBondContact O-CB 3.28Å; E29-I33 WeakPolarHBondContact O-CD1 3.37Å; E29-I33 WeakPolarHBondContact O-CG1 3.36Å; E29-I33 PolarHBondContact O-N 2.88Å; R30-I33 PolarHBondContact O-N 3.23Å; E31-I33 VanDerWaalsContact C-N 3.34Å; E31-I33 PolarHBondContact O-N 3.35Å; I33-Y37 VanDerWaalsContact O-CA 3.31Å; I33-Y37 WeakPolarHBondContact O-CA 3.48Å; I33-Y37 WeakPolarHBondContact O-CB 3.33Å; I33-Y37 PolarHBondContact O-N 2.97Å; I33-G38 PolarHBondContact O-N 2.95Å; I33-P87 HydrophobicContact CD1-CG 4.34Å; I33-P87 HydrophobicContact CG1-CG 4.07Å
34	E	76.3	Confident	68.3	Low	135 Å²	135	79.4 Å²	79.4	63%	0.631	40%	0.4	S	S	*	.	I	π-helix	trans	-63.8	-45.8	-179.5	-173.8	170.9	-177.6	0	0	112	R30 E31 F32 G38	R30-E34 WeakPolarHBondContact O-CB 3.39Å; R30-E34 PolarHBondContact O-N 3.43Å; E31-E34 PolarHBondContact O-N 2.91Å; F32-E34 VanDerWaalsContact C-N 3.35Å; F32-E34 PolarHBondContact O-N 3.22Å; E34-G38 WeakPolarHBondContact O-CA 3.41Å; E34-G38 PolarHBondContact O-N 3.42Å
35	V	76.1	Confident	69.1	Low	36 Å²	36	71.3 Å²	71.3	22%	0.218	38%	0.379	C	S	.	.	I	π-helix	trans	-67.3	-50.3	179.9	169	0	0	0	0	111.3	E31 F32 T50 D54 F56	E31-V35 HydrophobicContact CG-CG2 4.42Å; E31-V35 WeakPolarHBondContact O-CB 3.34Å; E31-V35 VanDerWaalsContact O-CG2 3.28Å; E31-V35 WeakPolarHBondContact O-CG2 3.43Å; E31-V35 PolarHBondContact O-N 2.97Å; F32-V35 PolarHBondContact O-N 3.36Å; V35-T50 HydrophobicContact CG1-CG2 3.61Å; V35-D54 WeakPolarHBondContact CG1-OD2 3.3Å; V35-F56 HydrophobicContact CG1-CE2 4.12Å
36	V	73.6	Confident	69.7	Low	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.359	C	S	.	.	I	π-helix	trans	-83.7	-32.1	-170.4	-178.9	0	0	0	0	112.3	F32 R47 I51	F32-V36 HydrophobicContact CD1-CB 4.38Å; F32-V36 HydrophobicContact CD1-CG2 4.2Å; F32-V36 HydrophobicContact CD2-CG2 3.88Å; F32-V36 HydrophobicContact CE1-CB 4.07Å; F32-V36 HydrophobicContact CE1-CG1 4.19Å; F32-V36 HydrophobicContact CE1-CG2 3.98Å; F32-V36 HydrophobicContact CE2-CG2 3.67Å; F32-V36 HydrophobicContact CG-CG2 4.15Å; F32-V36 HydrophobicContact CZ-CB 4.2Å; F32-V36 HydrophobicContact CZ-CG1 4.13Å; F32-V36 HydrophobicContact CZ-CG2 3.72Å; F32-V36 WeakPolarHBondContact O-CB 2.91Å; F32-V36 VanDerWaalsContact O-CG2 3.23Å; F32-V36 WeakPolarHBondContact O-CG2 3.45Å; F32-V36 PolarHBondContact O-N 3.26Å; V36-R47 HydrophobicContact CG1-CB 3.71Å; V36-R47 HydrophobicContact CG1-CG 4.08Å; V36-R47 WeakPolarHBondContact O-CG 3.25Å; V36-I51 HydrophobicContact CB-CG2 4.41Å; V36-I51 HydrophobicContact CG1-CG2 4.11Å; V36-I51 HydrophobicContact CG2-CG2 3.35Å
37	Y	72.7	Confident	70	Confident	72 Å²	72	66.8 Å²	66.8	28%	0.282	36%	0.356	S	S	.	.	I	π-helix	trans	-111.3	-18.6	-177.3	-65.9	-101	0	0	0	114.2	F32 I33 R47 D84 L85	F32-Y37 HydrophobicContact CE1-CE2 4.09Å; I33-Y37 VanDerWaalsContact O-CA 3.31Å; I33-Y37 WeakPolarHBondContact O-CA 3.48Å; I33-Y37 WeakPolarHBondContact O-CB 3.33Å; I33-Y37 PolarHBondContact O-N 2.97Å; Y37-R47 VanDerWaalsContact CD1-CZ 3.48Å; Y37-R47 VanDerWaalsContact CE1-CZ 3.45Å; Y37-D84 PolarHBondContact OH-OD1 3.45Å; Y37-L85 PolarHBondContact OH-O 2.85Å
38	G	67.4	Low	70.1	Confident	56 Å²	56	59.8 Å²	59.8	58%	0.577	33%	0.325	S	S	*	.	I	π-helix	trans	-84.3	-31	-178.5	0	0	0	0	0	114.2	I33 E34	I33-G38 PolarHBondContact O-N 2.95Å; E34-G38 WeakPolarHBondContact O-CA 3.41Å; E34-G38 PolarHBondContact O-N 3.42Å
39	N	58.8	Low	70.3	Confident	154 Å²	154	63.4 Å²	63.4	82%	0.824	34%	0.341	S	S	*	.	S	Bend	trans	-113.2	-6.7	-170.3	-110.1	-10.7	0	0	0	115.6
40	V	57.6	Low	70.6	Confident	31 Å²	31	63.9 Å²	63.9	19%	0.188	35%	0.345	C	S	.	.	S	Bend	trans	-112.4	132.5	-168.3	-164.8	0	0	0	0	111.4	G42 G46 R47 T50	V40-G42 PolarHBondContact O-N 3.48Å; V40-G46 VanDerWaalsContact CG1-C 3.44Å; V40-R47 HydrophobicContact CB-CG 4.5Å; V40-T50 HydrophobicContact CG2-CG2 4.31Å; V40-T50 VanDerWaalsContact CG2-OG1 3.25Å; V40-T50 WeakPolarHBondContact CG2-OG1 3.26Å
41	T	54.8	Low	70.7	Confident	100 Å²	100	56.9 Å²	56.9	61%	0.613	32%	0.319	S	S	*	.			trans	-40.7	137.4	167.6	52.1	0	0	0	0	110.2	Y43	T41-Y43 PolarHBondContact O-N 3.34Å
42	G	59.6	Low	70.8	Confident	64 Å²	64	57.1 Å²	57.1	66%	0.66	32%	0.322	S	S	*	.	S	Bend	trans	-59.7	14.1	-169.1	0	0	0	0	0	118.2	V40	V40-G42 PolarHBondContact O-N 3.48Å
43	Y	69	Low	70.8	Confident	171 Å²	171	63.2 Å²	63.2	67%	0.671	35%	0.351	S	S	*	.			trans	-89	137.5	173.6	-58.3	-74.7	0	0	0	111.7	T41 S45 G46 R47	T41-Y43 PolarHBondContact O-N 3.34Å; Y43-S45 VanDerWaalsContact C-N 3.28Å; Y43-S45 PolarHBondContact O-N 3.34Å; Y43-G46 PolarHBondContact O-N 3.45Å; Y43-R47 PolarHBondContact O-N 3.39Å
44	V	71.3	Confident	70.8	Confident	38 Å²	38	64.1 Å²	64.1	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-35.3	-179.1	179.1	0	0	0	0	111.9	G46 R47 I48 V82 E83	V44-G46 VanDerWaalsContact C-N 3.35Å; V44-G46 PolarHBondContact O-N 3.32Å; V44-R47 WeakPolarHBondContact O-CB 3.28Å; V44-R47 PolarHBondContact O-N 2.83Å; V44-I48 HydrophobicContact CG1-CD1 3.93Å; V44-I48 HydrophobicContact CG1-CG1 4.33Å; V44-I48 VanDerWaalsContact O-CG1 3.3Å; V44-I48 WeakPolarHBondContact O-CG1 3.46Å; V44-I48 PolarHBondContact O-N 2.9Å; V44-V82 HydrophobicContact CG1-CG1 4.06Å; V44-V82 WeakPolarHBondContact CG1-O 3.21Å; V44-E83 WeakPolarHBondContact CG2-O 3.39Å
45	S	71.8	Confident	70.6	Confident	65 Å²	65	60 Å²	60	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-58.6	-43.1	177.3	52.1	0	0	0	0	112.9	Y43 R47 I48 Q49	Y43-S45 VanDerWaalsContact C-N 3.28Å; Y43-S45 PolarHBondContact O-N 3.34Å; S45-R47 VanDerWaalsContact C-N 3.33Å; S45-R47 PolarHBondContact O-N 3.45Å; S45-I48 PolarHBondContact O-N 3.24Å; S45-Q49 PolarHBondContact O-N 2.89Å
46	G	73.1	Confident	70.4	Confident	10 Å²	10	58.3 Å²	58.3	10%	0.103	34%	0.34	C	S	.	.	H	α-helix	trans	-63.6	-41.7	177.1	0	0	0	0	0	111.4	V40 Y43 V44 I48 Q49 T50	V40-G46 VanDerWaalsContact CG1-C 3.44Å; Y43-G46 PolarHBondContact O-N 3.45Å; V44-G46 VanDerWaalsContact C-N 3.35Å; V44-G46 PolarHBondContact O-N 3.32Å; G46-I48 VanDerWaalsContact C-N 3.3Å; G46-I48 PolarHBondContact O-N 2.89Å; G46-Q49 WeakPolarHBondContact O-CB 3.44Å; G46-Q49 PolarHBondContact O-N 3.36Å; G46-T50 PolarHBondContact O-N 2.9Å; G46-T50 PolarHBondContact O-OG1 2.96Å; G46-T50 VanDerWaalsContact O-OG1 3.1Å
47	R	75.9	Confident	70.5	Confident	47 Å²	47	58.8 Å²	58.8	18%	0.177	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-39.8	177.5	-62.4	-171.4	-176.1	154.2	1.7	112	V36 Y37 V40 Y43 V44 S45 T50 I51 D84	V36-R47 HydrophobicContact CG1-CB 3.71Å; V36-R47 HydrophobicContact CG1-CG 4.08Å; V36-R47 WeakPolarHBondContact O-CG 3.25Å; Y37-R47 VanDerWaalsContact CD1-CZ 3.48Å; Y37-R47 VanDerWaalsContact CE1-CZ 3.45Å; V40-R47 HydrophobicContact CB-CG 4.5Å; Y43-R47 PolarHBondContact O-N 3.39Å; V44-R47 WeakPolarHBondContact O-CB 3.28Å; V44-R47 PolarHBondContact O-N 2.83Å; S45-R47 VanDerWaalsContact C-N 3.33Å; S45-R47 PolarHBondContact O-N 3.45Å; R47-T50 PolarHBondContact O-N 2.99Å; R47-I51 PolarHBondContact O-N 3.47Å; R47-I51 VanDerWaalsContact O-N 3.12Å; R47-D84 IonicContact NH1-OD1 3.92Å
48	I	73.2	Confident	70.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-67.4	-42.6	177.6	-53.2	154.4	0	0	0	110.2	V44 S45 G46 T50 I51 V52 W59 Y79 V82 L85	V44-I48 HydrophobicContact CG1-CD1 3.93Å; V44-I48 HydrophobicContact CG1-CG1 4.33Å; V44-I48 VanDerWaalsContact O-CG1 3.3Å; V44-I48 WeakPolarHBondContact O-CG1 3.46Å; V44-I48 PolarHBondContact O-N 2.9Å; S45-I48 PolarHBondContact O-N 3.24Å; G46-I48 VanDerWaalsContact C-N 3.3Å; G46-I48 PolarHBondContact O-N 2.89Å; I48-T50 VanDerWaalsContact C-N 3.31Å; I48-T50 PolarHBondContact O-N 3.33Å; I48-I51 HydrophobicContact CG2-CD1 4.27Å; I48-I51 HydrophobicContact CG2-CG1 4.24Å; I48-I51 WeakPolarHBondContact O-CG1 3.49Å; I48-I51 PolarHBondContact O-N 2.79Å; I48-V52 HydrophobicContact CG2-CG2 4.34Å; I48-V52 VanDerWaalsContact O-CG2 3.3Å; I48-V52 WeakPolarHBondContact O-CG2 3.31Å; I48-V52 PolarHBondContact O-N 2.82Å; I48-V52 VanDerWaalsContact O-N 3.11Å; I48-W59 HydrophobicContact CG2-CE3 4.45Å; I48-W59 HydrophobicContact CG2-CZ3 4.28Å; I48-Y79 HydrophobicContact CB-CD1 3.72Å; I48-Y79 HydrophobicContact CB-CE1 3.75Å; I48-Y79 HydrophobicContact CB-CG 4.34Å; I48-Y79 HydrophobicContact CD1-CD1 3.48Å; I48-Y79 VanDerWaalsContact CD1-CD1 3.48Å; I48-Y79 HydrophobicContact CD1-CE1 4.36Å; I48-Y79 HydrophobicContact CD1-CG 3.8Å; I48-Y79 HydrophobicContact CG1-CD1 4.14Å; I48-Y79 HydrophobicContact CG2-CD1 3.36Å; I48-Y79 HydrophobicContact CG2-CE1 3.03Å; I48-Y79 HydrophobicContact CG2-CG 4.4Å; I48-V82 HydrophobicContact CD1-CB 3.56Å; I48-V82 HydrophobicContact CD1-CG1 3.57Å; I48-V82 HydrophobicContact CD1-CG2 4.09Å; I48-V82 HydrophobicContact CG1-CG1 4.08Å; I48-L85 HydrophobicContact CB-CD1 4.01Å; I48-L85 HydrophobicContact CG1-CD1 3.33Å; I48-L85 HydrophobicContact CG1-CG 4.15Å; I48-L85 HydrophobicContact CG2-CD1 4.37Å
49	Q	75.5	Confident	71	Confident	100 Å²	100	57.5 Å²	57.5	47%	0.467	33%	0.327	S	S	.	.	H	α-helix	trans	-56.3	-47.1	175.4	-177.2	175.4	-0.4	0	0	111.2	S45 G46 I51 V52 E53	S45-Q49 PolarHBondContact O-N 2.89Å; G46-Q49 WeakPolarHBondContact O-CB 3.44Å; G46-Q49 PolarHBondContact O-N 3.36Å; Q49-I51 PolarHBondContact O-N 3.31Å; Q49-V52 PolarHBondContact O-N 3.47Å; Q49-V52 VanDerWaalsContact O-N 3.14Å; Q49-E53 HydrophobicContact CG-CG 4.2Å; Q49-E53 VanDerWaalsContact CG-OE1 3.28Å; Q49-E53 WeakPolarHBondContact CG-OE1 3.07Å; Q49-E53 PolarHBondContact NE2-OE1 3.41Å; Q49-E53 WeakPolarHBondContact O-CB 3.22Å; Q49-E53 WeakPolarHBondContact O-CG 3.48Å; Q49-E53 PolarHBondContact O-N 3.49Å
50	T	76.4	Confident	71.7	Confident	22 Å²	22	54.2 Å²	54.2	14%	0.135	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-44.4	177.6	-56.7	0	0	0	0	112.8	V35 V40 G46 R47 I48 V52 E53 D54	V35-T50 HydrophobicContact CG1-CG2 3.61Å; V40-T50 HydrophobicContact CG2-CG2 4.31Å; V40-T50 VanDerWaalsContact CG2-OG1 3.25Å; V40-T50 WeakPolarHBondContact CG2-OG1 3.26Å; G46-T50 PolarHBondContact O-N 2.9Å; G46-T50 PolarHBondContact O-OG1 2.96Å; G46-T50 VanDerWaalsContact O-OG1 3.1Å; R47-T50 PolarHBondContact O-N 2.99Å; I48-T50 VanDerWaalsContact C-N 3.31Å; I48-T50 PolarHBondContact O-N 3.33Å; T50-V52 PolarHBondContact O-N 2.98Å; T50-E53 PolarHBondContact O-N 3.32Å; T50-D54 WeakPolarHBondContact CG2-OD2 3.25Å; T50-D54 VanDerWaalsContact O-CB 3.31Å; T50-D54 WeakPolarHBondContact O-CB 3.44Å; T50-D54 PolarHBondContact O-N 2.96Å
51	I	75.5	Confident	72.3	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-67.1	-26.5	178.5	64	162.3	0	0	0	113.1	F32 V36 R47 I48 Q49 G55 F56 L57 L85	F32-I51 HydrophobicContact CE2-CG2 3.54Å; F32-I51 HydrophobicContact CZ-CG2 3.86Å; V36-I51 HydrophobicContact CB-CG2 4.41Å; V36-I51 HydrophobicContact CG1-CG2 4.11Å; V36-I51 HydrophobicContact CG2-CG2 3.35Å; R47-I51 PolarHBondContact O-N 3.47Å; R47-I51 VanDerWaalsContact O-N 3.12Å; I48-I51 HydrophobicContact CG2-CD1 4.27Å; I48-I51 HydrophobicContact CG2-CG1 4.24Å; I48-I51 WeakPolarHBondContact O-CG1 3.49Å; I48-I51 PolarHBondContact O-N 2.79Å; Q49-I51 PolarHBondContact O-N 3.31Å; I51-G55 PolarHBondContact O-N 3.14Å; I51-F56 HydrophobicContact CB-CB 3.98Å; I51-F56 HydrophobicContact CG2-CB 4.47Å; I51-F56 WeakPolarHBondContact O-CA 3.34Å; I51-F56 WeakPolarHBondContact O-CB 3.22Å; I51-F56 PolarHBondContact O-N 2.76Å; I51-L57 HydrophobicContact CD1-CB 3.99Å; I51-L57 HydrophobicContact CD1-CD2 3.72Å; I51-L57 HydrophobicContact CG1-CB 4.39Å; I51-L57 PolarHBondContact O-N 2.81Å; I51-L85 HydrophobicContact CD1-CD1 3.5Å; I51-L85 VanDerWaalsContact CD1-CD1 3.5Å; I51-L85 HydrophobicContact CD1-CD2 3.99Å; I51-L85 HydrophobicContact CD1-CG 4.38Å; I51-L85 HydrophobicContact CG1-CD1 4.11Å
52	V	76.8	Confident	73.2	Confident	40 Å²	40	50.5 Å²	50.5	24%	0.242	28%	0.284	C	S	.	.	H	α-helix	trans	-78.8	-46.8	176.9	175.8	0	0	0	0	110.2	I48 Q49 T50 G55 W59	I48-V52 HydrophobicContact CG2-CG2 4.34Å; I48-V52 VanDerWaalsContact O-CG2 3.3Å; I48-V52 WeakPolarHBondContact O-CG2 3.31Å; I48-V52 PolarHBondContact O-N 2.82Å; I48-V52 VanDerWaalsContact O-N 3.11Å; Q49-V52 PolarHBondContact O-N 3.47Å; Q49-V52 VanDerWaalsContact O-N 3.14Å; T50-V52 PolarHBondContact O-N 2.98Å; V52-G55 PolarHBondContact O-N 3.31Å; V52-G55 VanDerWaalsContact O-N 3.12Å; V52-W59 HydrophobicContact CG1-CB 4.06Å; V52-W59 HydrophobicContact CG2-CB 3.72Å; V52-W59 HydrophobicContact CG2-CG 4.25Å
53	E	76.8	Confident	73.7	Confident	130 Å²	130	47.7 Å²	47.7	61%	0.607	25%	0.254	S	S	*	.	H	α-helix	trans	-62.9	-42.1	178.7	-73.1	177.2	174.6	0	0	112.2	Q49 T50 G55	Q49-E53 HydrophobicContact CG-CG 4.2Å; Q49-E53 VanDerWaalsContact CG-OE1 3.28Å; Q49-E53 WeakPolarHBondContact CG-OE1 3.07Å; Q49-E53 PolarHBondContact NE2-OE1 3.41Å; Q49-E53 WeakPolarHBondContact O-CB 3.22Å; Q49-E53 WeakPolarHBondContact O-CG 3.48Å; Q49-E53 PolarHBondContact O-N 3.49Å; T50-E53 PolarHBondContact O-N 3.32Å; E53-G55 PolarHBondContact O-N 2.7Å
54	D	74.6	Confident	73.5	Confident	76 Å²	76	46.2 Å²	46.2	41%	0.406	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	2.1	177.5	-69.2	-22.7	0	0	0	112.9	V35 T50 F56	V35-D54 WeakPolarHBondContact CG1-OD2 3.3Å; T50-D54 WeakPolarHBondContact CG2-OD2 3.25Å; T50-D54 VanDerWaalsContact O-CB 3.31Å; T50-D54 WeakPolarHBondContact O-CB 3.44Å; T50-D54 PolarHBondContact O-N 2.96Å; D54-F56 VanDerWaalsContact C-N 3.28Å; D54-F56 HydrophobicContact CB-CD2 3.62Å; D54-F56 HydrophobicContact CB-CE2 3.62Å; D54-F56 PolarHBondContact O-N 2.91Å
55	G	72.8	Confident	73.2	Confident	48 Å²	48	53 Å²	53	50%	0.495	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	17.5	173.8	0	0	0	0	0	114.5	I51 V52 E53 L57	I51-G55 PolarHBondContact O-N 3.14Å; V52-G55 PolarHBondContact O-N 3.31Å; V52-G55 VanDerWaalsContact O-N 3.12Å; E53-G55 PolarHBondContact O-N 2.7Å; G55-L57 PolarHBondContact O-N 2.87Å
56	F	71.7	Confident	72.9	Confident	1 Å²	1	54.6 Å²	54.6	0%	0.004	28%	0.275	C	S	.	.	S	Bend	trans	-69	-22.6	170.4	-68.3	-81.7	0	0	0	112.4	F32 V35 I51 D54 L95 N131 I137	F32-F56 HydrophobicContact CD2-CD1 4.09Å; F32-F56 HydrophobicContact CD2-CE1 4.19Å; F32-F56 HydrophobicContact CD2-CG 4.34Å; V35-F56 HydrophobicContact CG1-CE2 4.12Å; I51-F56 HydrophobicContact CB-CB 3.98Å; I51-F56 HydrophobicContact CG2-CB 4.47Å; I51-F56 WeakPolarHBondContact O-CA 3.34Å; I51-F56 WeakPolarHBondContact O-CB 3.22Å; I51-F56 PolarHBondContact O-N 2.76Å; D54-F56 VanDerWaalsContact C-N 3.28Å; D54-F56 HydrophobicContact CB-CD2 3.62Å; D54-F56 HydrophobicContact CB-CE2 3.62Å; D54-F56 PolarHBondContact O-N 2.91Å; F56-L95 HydrophobicContact CD1-CD2 4.27Å; F56-L95 HydrophobicContact CE1-CD2 4.42Å; F56-N131 WeakPolarHBondContact CA-ND2 3.06Å; F56-N131 PolarHBondContact O-ND2 3.46Å; F56-I137 HydrophobicContact CD1-CD1 3.84Å; F56-I137 HydrophobicContact CD2-CD1 4.06Å; F56-I137 HydrophobicContact CE1-CD1 3.34Å; F56-I137 HydrophobicContact CE2-CD1 3.59Å; F56-I137 HydrophobicContact CG-CD1 4.19Å; F56-I137 HydrophobicContact CZ-CD1 3.21Å
57	L	75	Confident	72.4	Confident	10 Å²	10	55 Å²	55	5%	0.052	27%	0.274	C	S	.	.			trans	-145.9	118.2	179	-179.5	57.3	0	0	0	111.4	I51 G55 W59 F62 I99 F129	I51-L57 HydrophobicContact CD1-CB 3.99Å; I51-L57 HydrophobicContact CD1-CD2 3.72Å; I51-L57 HydrophobicContact CG1-CB 4.39Å; I51-L57 PolarHBondContact O-N 2.81Å; G55-L57 PolarHBondContact O-N 2.87Å; L57-W59 HydrophobicContact CD2-CE3 3.56Å; L57-W59 HydrophobicContact CD2-CZ3 3.83Å; L57-W59 HydrophobicContact CG-CE3 4.24Å; L57-W59 PolarHBondContact O-N 2.92Å; L57-W59 VanDerWaalsContact O-N 3.07Å; L57-F62 HydrophobicContact CD1-CB 3.74Å; L57-F62 HydrophobicContact CD1-CD2 3.93Å; L57-F62 HydrophobicContact CD1-CG 3.86Å; L57-F62 HydrophobicContact CG-CB 4.45Å; L57-I99 HydrophobicContact CD2-CD1 4.02Å; L57-F129 HydrophobicContact CB-CE2 4.33Å; L57-F129 HydrophobicContact CB-CZ 4.4Å; L57-F129 HydrophobicContact CD1-CD2 4.06Å; L57-F129 HydrophobicContact CD1-CE2 3.63Å; L57-F129 HydrophobicContact CD1-CZ 3.94Å; L57-F129 HydrophobicContact CD2-CZ 4.09Å; L57-F129 HydrophobicContact CG-CE2 4.4Å; L57-F129 HydrophobicContact CG-CZ 4.38Å
58	D	75.5	Confident	71.7	Confident	94 Å²	94	57.7 Å²	57.7	50%	0.503	29%	0.289	S	S	.	.			trans	-73.5	95.2	164.4	-179.8	-11.3	0	0	0	108.8	D60 N61 F62	D58-D60 PolarHBondContact O-N 2.72Å; D58-N61 HydrophobicContact CB-CB 4Å; D58-N61 VanDerWaalsContact OD1-CB 3.31Å; D58-N61 WeakPolarHBondContact OD1-CB 2.95Å; D58-N61 PolarHBondContact OD1-N 3.46Å; D58-N61 WeakPolarHBondContact OD2-CB 3.28Å; D58-N61 PolarHBondContact OD2-ND2 2.9Å; D58-F62 WeakPolarHBondContact O-CB 3.17Å; D58-F62 PolarHBondContact O-N 2.7Å
59	W	75.1	Confident	71.1	Confident	7 Å²	7	59.5 Å²	59.5	3%	0.027	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-39.8	-171.1	-172.5	-120.8	0	0	0	113.4	I48 V52 L57 F62 K63 Y79 V82	I48-W59 HydrophobicContact CG2-CE3 4.45Å; I48-W59 HydrophobicContact CG2-CZ3 4.28Å; V52-W59 HydrophobicContact CG1-CB 4.06Å; V52-W59 HydrophobicContact CG2-CB 3.72Å; V52-W59 HydrophobicContact CG2-CG 4.25Å; L57-W59 HydrophobicContact CD2-CE3 3.56Å; L57-W59 HydrophobicContact CD2-CZ3 3.83Å; L57-W59 HydrophobicContact CG-CE3 4.24Å; L57-W59 PolarHBondContact O-N 2.92Å; L57-W59 VanDerWaalsContact O-N 3.07Å; W59-F62 HydrophobicContact CE3-CD1 4.08Å; W59-F62 AromaticContact CZ3-CD1 3.87Å; W59-F62 HydrophobicContact CZ3-CD1 3.87Å; W59-F62 HydrophobicContact CZ3-CE1 4.14Å; W59-F62 PolarHBondContact O-N 2.67Å; W59-K63 HydrophobicContact CD2-CG 4.4Å; W59-K63 HydrophobicContact CZ2-CG 4.37Å; W59-K63 WeakPolarHBondContact O-CB 3.37Å; W59-K63 WeakPolarHBondContact O-CG 3.31Å; W59-K63 PolarHBondContact O-N 3.42Å; W59-Y79 AromaticContact CD2-CE1 3.85Å; W59-Y79 HydrophobicContact CD2-CE1 3.85Å; W59-Y79 AromaticContact CE2-CD1 3.97Å; W59-Y79 AromaticContact CE2-CE1 3.39Å; W59-Y79 HydrophobicContact CE3-CE1 4.29Å; W59-Y79 HydrophobicContact CG-CE1 4.39Å; W59-Y79 AromaticContact CH2-CD1 3.98Å; W59-Y79 HydrophobicContact CH2-CD1 3.98Å; W59-Y79 HydrophobicContact CH2-CE1 4.01Å; W59-Y79 AromaticContact CZ2-CD1 3.58Å; W59-Y79 HydrophobicContact CZ2-CD1 3.58Å; W59-Y79 AromaticContact CZ2-CE1 3.5Å; W59-Y79 HydrophobicContact CZ2-CE1 3.5Å; W59-Y79 HydrophobicContact CZ3-CE1 4.37Å; W59-Y79 AromaticContact NE1-CE1 3.63Å; W59-Y79 AromaticContact NE1-CZ 4Å; W59-V82 HydrophobicContact CH2-CG2 4.14Å
60	D	73.9	Confident	70.2	Confident	85 Å²	85	58 Å²	58	46%	0.455	30%	0.297	S	S	.	.	H	α-helix	trans	-69.7	-43.3	-178	-74.3	-32.3	0	0	0	111.2	D58 F62 K63 Q64	D58-D60 PolarHBondContact O-N 2.72Å; D60-F62 VanDerWaalsContact C-N 3.34Å; D60-K63 PolarHBondContact O-N 2.91Å; D60-K63 WeakPolarHBondContact OD1-CE 3.46Å; D60-K63 IonicContact OD1-NZ 2.74Å; D60-K63 PolarHBondContact OD1-NZ 3.4Å; D60-Q64 WeakPolarHBondContact O-CB 3.42Å; D60-Q64 PolarHBondContact O-N 2.76Å
61	N	71.3	Confident	69.3	Low	47 Å²	47	65.7 Å²	65.7	25%	0.251	33%	0.325	S	S	.	.	H	α-helix	trans	-64.5	-41.5	174.7	-168	-8	0	0	0	111.4	D58 Q64 R65	D58-N61 HydrophobicContact CB-CB 4Å; D58-N61 VanDerWaalsContact OD1-CB 3.31Å; D58-N61 WeakPolarHBondContact OD1-CB 2.95Å; D58-N61 PolarHBondContact OD1-N 3.46Å; D58-N61 WeakPolarHBondContact OD2-CB 3.28Å; D58-N61 PolarHBondContact OD2-ND2 2.9Å; N61-Q64 PolarHBondContact O-N 2.78Å; N61-R65 WeakPolarHBondContact O-CB 3.28Å; N61-R65 WeakPolarHBondContact O-CG 3.43Å; N61-R65 PolarHBondContact O-N 3.35Å; N61-R65 WeakPolarHBondContact OD1-CD 3.45Å; N61-R65 WeakPolarHBondContact OD1-CG 3.31Å; N61-R65 PolarHBondContact OD1-NE 3.11Å
62	F	72.3	Confident	68.2	Low	6 Å²	6	72.3 Å²	72.3	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-48.8	174.9	-179.7	-99.3	0	0	0	112	L57 D58 W59 D60 Q64 H66 L67 I99 F101 M127 F129	L57-F62 HydrophobicContact CD1-CB 3.74Å; L57-F62 HydrophobicContact CD1-CD2 3.93Å; L57-F62 HydrophobicContact CD1-CG 3.86Å; L57-F62 HydrophobicContact CG-CB 4.45Å; D58-F62 WeakPolarHBondContact O-CB 3.17Å; D58-F62 PolarHBondContact O-N 2.7Å; W59-F62 HydrophobicContact CE3-CD1 4.08Å; W59-F62 AromaticContact CZ3-CD1 3.87Å; W59-F62 HydrophobicContact CZ3-CD1 3.87Å; W59-F62 HydrophobicContact CZ3-CE1 4.14Å; W59-F62 PolarHBondContact O-N 2.67Å; D60-F62 VanDerWaalsContact C-N 3.34Å; F62-Q64 VanDerWaalsContact C-N 3.32Å; F62-Q64 PolarHBondContact O-N 2.87Å; F62-H66 HydrophobicContact CD2-CB 4.19Å; F62-H66 AromaticContact CD2-CD2 3.59Å; F62-H66 HydrophobicContact CE2-CB 4.09Å; F62-H66 VanDerWaalsContact O-CB 3.29Å; F62-H66 WeakPolarHBondContact O-CB 3.41Å; F62-H66 PolarHBondContact O-N 3.1Å; F62-L67 HydrophobicContact CD1-CD1 4.01Å; F62-L67 HydrophobicContact CD1-CG 4.21Å; F62-L67 HydrophobicContact CE1-CD1 3.67Å; F62-L67 HydrophobicContact CE1-CD2 4.09Å; F62-L67 HydrophobicContact CE1-CG 3.83Å; F62-L67 HydrophobicContact CZ-CD2 4.33Å; F62-L67 HydrophobicContact CZ-CG 4.45Å; F62-L67 PolarHBondContact O-N 2.86Å; F62-I99 HydrophobicContact CE1-CD1 3.75Å; F62-I99 HydrophobicContact CE2-CD1 4.17Å; F62-I99 HydrophobicContact CZ-CD1 3.55Å; F62-F101 HydrophobicContact CE1-CZ 4.42Å; F62-M127 HydrophobicContact CE2-CE 4.27Å; F62-M127 HydrophobicContact CE2-SD 3.56Å; F62-M127 VanDerWaalsContact CE2-SD 3.56Å; F62-M127 HydrophobicContact CZ-SD 3.55Å; F62-M127 VanDerWaalsContact CZ-SD 3.55Å; F62-F129 HydrophobicContact CE2-CB 4.37Å; F62-F129 HydrophobicContact CE2-CD1 4.31Å; F62-F129 HydrophobicContact CE2-CG 4.41Å
63	K	70.1	Confident	67.1	Low	5 Å²	5	75.7 Å²	75.7	2%	0.022	37%	0.367	C	S	.	.	H	α-helix	trans	-54.8	-47.6	174.7	-82.2	-174.4	-60.1	179.7	0	111.6	W59 D60 L67 E68 I69	W59-K63 HydrophobicContact CD2-CG 4.4Å; W59-K63 HydrophobicContact CZ2-CG 4.37Å; W59-K63 WeakPolarHBondContact O-CB 3.37Å; W59-K63 WeakPolarHBondContact O-CG 3.31Å; W59-K63 PolarHBondContact O-N 3.42Å; D60-K63 PolarHBondContact O-N 2.91Å; D60-K63 WeakPolarHBondContact OD1-CE 3.46Å; D60-K63 IonicContact OD1-NZ 2.74Å; D60-K63 PolarHBondContact OD1-NZ 3.4Å; K63-L67 HydrophobicContact CG-CD1 4.44Å; K63-L67 CarbonylContact O-C 3.31Å; K63-L67 VanDerWaalsContact O-C 3.31Å; K63-L67 WeakPolarHBondContact O-CA 3.46Å; K63-L67 WeakPolarHBondContact O-CB 3.23Å; K63-L67 PolarHBondContact O-N 3.21Å; K63-L67 VanDerWaalsContact O-N 3.16Å; K63-E68 PolarHBondContact O-N 3.49Å; K63-I69 HydrophobicContact CB-CB 4.14Å; K63-I69 HydrophobicContact CD-CG2 4.24Å; K63-I69 HydrophobicContact CG-CB 4.37Å; K63-I69 PolarHBondContact O-N 3.3Å
64	Q	66.2	Low	65.8	Low	140 Å²	140	72.9 Å²	72.9	65%	0.654	36%	0.36	S	S	*	.	H	α-helix	trans	-72.6	-46.2	-174.2	-170.5	-179.5	23.2	0	0	112.5	D60 N61 F62	D60-Q64 WeakPolarHBondContact O-CB 3.42Å; D60-Q64 PolarHBondContact O-N 2.76Å; N61-Q64 PolarHBondContact O-N 2.78Å; F62-Q64 VanDerWaalsContact C-N 3.32Å; F62-Q64 PolarHBondContact O-N 2.87Å
65	R	64.9	Low	64.6	Low	180 Å²	180	75 Å²	75	68%	0.679	37%	0.368	S	S	*	.	H	α-helix	trans	-82	-30.1	-173.4	-68.6	-167.4	-174.9	179	5.6	113.8	N61	N61-R65 WeakPolarHBondContact O-CB 3.28Å; N61-R65 WeakPolarHBondContact O-CG 3.43Å; N61-R65 PolarHBondContact O-N 3.35Å; N61-R65 WeakPolarHBondContact OD1-CD 3.45Å; N61-R65 WeakPolarHBondContact OD1-CG 3.31Å; N61-R65 PolarHBondContact OD1-NE 3.11Å
66	H	64.4	Low	63.4	Low	99 Å²	99	78.2 Å²	78.2	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-118.4	-28	-168.8	-61.3	-58.4	0	0	0	113.7	F62 M127	F62-H66 HydrophobicContact CD2-CB 4.19Å; F62-H66 AromaticContact CD2-CD2 3.59Å; F62-H66 HydrophobicContact CE2-CB 4.09Å; F62-H66 VanDerWaalsContact O-CB 3.29Å; F62-H66 WeakPolarHBondContact O-CB 3.41Å; F62-H66 PolarHBondContact O-N 3.1Å; H66-M127 HydrophobicContact CB-CE 3.57Å; H66-M127 HydrophobicContact CB-SD 3.82Å
67	L	63	Low	62.1	Low	19 Å²	19	81.6 Å²	81.6	10%	0.099	40%	0.395	C	S	.	.	S	Bend	trans	-105.8	-9.3	177.4	-52.1	-177.9	0	0	0	113	F62 K63 I69 F101	F62-L67 HydrophobicContact CD1-CD1 4.01Å; F62-L67 HydrophobicContact CD1-CG 4.21Å; F62-L67 HydrophobicContact CE1-CD1 3.67Å; F62-L67 HydrophobicContact CE1-CD2 4.09Å; F62-L67 HydrophobicContact CE1-CG 3.83Å; F62-L67 HydrophobicContact CZ-CD2 4.33Å; F62-L67 HydrophobicContact CZ-CG 4.45Å; F62-L67 PolarHBondContact O-N 2.86Å; K63-L67 HydrophobicContact CG-CD1 4.44Å; K63-L67 CarbonylContact O-C 3.31Å; K63-L67 VanDerWaalsContact O-C 3.31Å; K63-L67 WeakPolarHBondContact O-CA 3.46Å; K63-L67 WeakPolarHBondContact O-CB 3.23Å; K63-L67 PolarHBondContact O-N 3.21Å; K63-L67 VanDerWaalsContact O-N 3.16Å; L67-I69 HydrophobicContact CB-CB 4.4Å; L67-I69 HydrophobicContact CB-CD1 3.64Å; L67-I69 HydrophobicContact CB-CG1 3.68Å; L67-I69 HydrophobicContact CD1-CD1 3.7Å; L67-I69 HydrophobicContact CG-CD1 4.35Å; L67-I69 PolarHBondContact O-N 2.76Å; L67-I69 VanDerWaalsContact O-N 3.09Å; L67-F101 HydrophobicContact CD1-CE1 4.44Å; L67-F101 HydrophobicContact CD2-CZ 4.07Å
68	E	61.3	Low	60.9	Low	102 Å²	102	81.5 Å²	81.5	48%	0.477	40%	0.397	S	S	.	.			trans	50.5	28.1	-171.7	-57.8	-177.2	-166.5	0	0	113.1	K63 F109	K63-E68 PolarHBondContact O-N 3.49Å; E68-F109 WeakPolarHBondContact OE2-CD1 3.18Å; E68-F109 WeakPolarHBondContact OE2-CD2 3.34Å; E68-F109 WeakPolarHBondContact OE2-CE1 3.43Å; E68-F109 WeakPolarHBondContact OE2-CE2 3.26Å; E68-F109 WeakPolarHBondContact OE2-CG 3.18Å; E68-F109 WeakPolarHBondContact OE2-CZ 3.21Å
69	I	60.9	Low	59.9	Low	39 Å²	39	78.7 Å²	78.7	20%	0.2	38%	0.38	C	S	.	.			trans	-81.4	125	179.4	-65.1	172.9	0	0	0	108.1	K63 L67 F73	K63-I69 HydrophobicContact CB-CB 4.14Å; K63-I69 HydrophobicContact CD-CG2 4.24Å; K63-I69 HydrophobicContact CG-CB 4.37Å; K63-I69 PolarHBondContact O-N 3.3Å; L67-I69 HydrophobicContact CB-CB 4.4Å; L67-I69 HydrophobicContact CB-CD1 3.64Å; L67-I69 HydrophobicContact CB-CG1 3.68Å; L67-I69 HydrophobicContact CD1-CD1 3.7Å; L67-I69 HydrophobicContact CG-CD1 4.35Å; L67-I69 PolarHBondContact O-N 2.76Å; L67-I69 VanDerWaalsContact O-N 3.09Å; I69-F73 HydrophobicContact CG2-CB 3.67Å; I69-F73 HydrophobicContact CG2-CD2 4.21Å; I69-F73 HydrophobicContact CG2-CG 3.98Å
70	P	55.9	Low	59	Low	67 Å²	67	83.3 Å²	83.3	44%	0.435	40%	0.404	S	S	.	.			trans	-59.8	147.4	176	-21.5	31.9	0	0	0	112	E72 F73	P70-E72 PolarHBondContact O-N 2.9Å; P70-F73 PolarHBondContact O-N 3.41Å; P70-F73 VanDerWaalsContact O-N 3.1Å
71	Y	58	Low	58.5	Low	184 Å²	184	83 Å²	83	72%	0.722	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.3	177.8	62.4	-92.5	0	0	0	113.3	F73	Y71-F73 PolarHBondContact O-N 3.28Å
72	E	52.8	Low	58.5	Low	139 Å²	139	81.2 Å²	81.2	65%	0.65	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-11.7	-179.6	-58.8	175.4	176.7	0	0	113.5	P70 P74	P70-E72 PolarHBondContact O-N 2.9Å; E72-P74 VanDerWaalsContact O-CD 3.32Å; E72-P74 WeakPolarHBondContact O-CD 3.38Å
73	F	52.1	Low	58.4	Low	112 Å²	112	84.1 Å²	84.1	49%	0.491	40%	0.403	S	S	.	.	S	Bend	trans	-79.1	113.4	172.1	-93	-99.3	0	0	0	110.2	I69 P70 Y71	I69-F73 HydrophobicContact CG2-CB 3.67Å; I69-F73 HydrophobicContact CG2-CD2 4.21Å; I69-F73 HydrophobicContact CG2-CG 3.98Å; P70-F73 PolarHBondContact O-N 3.41Å; P70-F73 VanDerWaalsContact O-N 3.1Å; Y71-F73 PolarHBondContact O-N 3.28Å
74	P	50	Low	58.5	Low	71 Å²	71	85.7 Å²	85.7	46%	0.461	41%	0.412	S	S	.	.			trans	-64.9	148.2	-174	25.5	-33.2	0	0	0	111.7	E72 V76 N77	E72-P74 VanDerWaalsContact O-CD 3.32Å; E72-P74 WeakPolarHBondContact O-CD 3.38Å; P74-V76 PolarHBondContact O-N 3.47Å; P74-N77 HydrophobicContact CG-CB 4.26Å; P74-N77 WeakPolarHBondContact CG-ND2 3.45Å; P74-N77 PolarHBondContact O-N 3.35Å
75	E	50.5	Low	58.9	Low	121 Å²	121	79.2 Å²	79.2	57%	0.565	38%	0.382	S	S	*	.	H	α-helix	trans	-45.1	-41.4	-178	-70.4	169.8	155.1	0	0	112.8	N77 G78 Y79	E75-N77 VanDerWaalsContact C-N 3.28Å; E75-N77 PolarHBondContact O-N 3.41Å; E75-G78 PolarHBondContact O-N 3.12Å; E75-Y79 WeakPolarHBondContact O-CD2 3.3Å; E75-Y79 WeakPolarHBondContact O-CE2 3.05Å
76	V	45.8	Very low	59.2	Low	114 Å²	114	71.8 Å²	71.8	69%	0.691	36%	0.357	S	S	*	.	H	α-helix	trans	-66.6	-25.2	-177.8	-168.5	0	0	0	0	113.3	P74	P74-V76 PolarHBondContact O-N 3.47Å
77	N	44.8	Very low	59.5	Low	72 Å²	72	68.5 Å²	68.5	39%	0.385	35%	0.345	S	S	.	.	H	α-helix	trans	-93.9	-21.4	-176.8	-75.1	-20.9	0	0	0	113.8	P74 E75 Y79 I80	P74-N77 HydrophobicContact CG-CB 4.26Å; P74-N77 WeakPolarHBondContact CG-ND2 3.45Å; P74-N77 PolarHBondContact O-N 3.35Å; E75-N77 VanDerWaalsContact C-N 3.28Å; E75-N77 PolarHBondContact O-N 3.41Å; N77-Y79 VanDerWaalsContact C-N 3.3Å; N77-Y79 PolarHBondContact O-N 3.45Å; N77-I80 HydrophobicContact CB-CD1 4.25Å
78	G	50.3	Low	59.8	Low	9 Å²	9	69.5 Å²	69.5	9%	0.093	35%	0.35	C	S	.	.	H	α-helix	trans	-68.9	-29.7	-179.9	0	0	0	0	0	113.2	E75	E75-G78 PolarHBondContact O-N 3.12Å
79	Y	54.2	Low	60.1	Low	34 Å²	34	64.8 Å²	64.8	13%	0.133	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-79	-15	-177.3	-54.8	-44.3	0	0	0	114.5	I48 W59 E75 N77 F81 V82	I48-Y79 HydrophobicContact CB-CD1 3.72Å; I48-Y79 HydrophobicContact CB-CE1 3.75Å; I48-Y79 HydrophobicContact CB-CG 4.34Å; I48-Y79 HydrophobicContact CD1-CD1 3.48Å; I48-Y79 VanDerWaalsContact CD1-CD1 3.48Å; I48-Y79 HydrophobicContact CD1-CE1 4.36Å; I48-Y79 HydrophobicContact CD1-CG 3.8Å; I48-Y79 HydrophobicContact CG1-CD1 4.14Å; I48-Y79 HydrophobicContact CG2-CD1 3.36Å; I48-Y79 HydrophobicContact CG2-CE1 3.03Å; I48-Y79 HydrophobicContact CG2-CG 4.4Å; W59-Y79 AromaticContact CD2-CE1 3.85Å; W59-Y79 HydrophobicContact CD2-CE1 3.85Å; W59-Y79 AromaticContact CE2-CD1 3.97Å; W59-Y79 AromaticContact CE2-CE1 3.39Å; W59-Y79 HydrophobicContact CE3-CE1 4.29Å; W59-Y79 HydrophobicContact CG-CE1 4.39Å; W59-Y79 AromaticContact CH2-CD1 3.98Å; W59-Y79 HydrophobicContact CH2-CD1 3.98Å; W59-Y79 HydrophobicContact CH2-CE1 4.01Å; W59-Y79 AromaticContact CZ2-CD1 3.58Å; W59-Y79 HydrophobicContact CZ2-CD1 3.58Å; W59-Y79 AromaticContact CZ2-CE1 3.5Å; W59-Y79 HydrophobicContact CZ2-CE1 3.5Å; W59-Y79 HydrophobicContact CZ3-CE1 4.37Å; W59-Y79 AromaticContact NE1-CE1 3.63Å; W59-Y79 AromaticContact NE1-CZ 4Å; E75-Y79 WeakPolarHBondContact O-CD2 3.3Å; E75-Y79 WeakPolarHBondContact O-CE2 3.05Å; N77-Y79 VanDerWaalsContact C-N 3.3Å; N77-Y79 PolarHBondContact O-N 3.45Å; Y79-F81 PolarHBondContact O-N 3.32Å; Y79-V82 PolarHBondContact O-N 2.66Å
80	I	56.7	Low	60.5	Low	105 Å²	105	63.8 Å²	63.8	54%	0.538	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-58.9	-27.9	-176.9	-61.5	172.4	0	0	0	111.2	N77	N77-I80 HydrophobicContact CB-CD1 4.25Å
81	F	62.9	Low	61	Low	79 Å²	79	64.7 Å²	64.7	35%	0.346	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-95.6	-4.8	-179	-52.3	-67.2	0	0	0	113.4	Y79 F101 S102 K103	Y79-F81 PolarHBondContact O-N 3.32Å; F81-F101 HydrophobicContact CB-CD1 4.41Å; F81-F101 CarbonylContact O-C 3.46Å; F81-F101 VanDerWaalsContact O-C 3.3Å; F81-F101 WeakPolarHBondContact O-CA 3.39Å; F81-F101 VanDerWaalsContact O-CB 3.26Å; F81-F101 WeakPolarHBondContact O-CB 3.32Å; F81-F101 WeakPolarHBondContact O-CD1 3.37Å; F81-S102 WeakPolarHBondContact CA-OG 3.34Å; F81-S102 PolarHBondContact O-N 2.71Å; F81-S102 PolarHBondContact O-OG 2.61Å; F81-K103 HydrophobicContact CD1-CB 4.28Å; F81-K103 HydrophobicContact CD1-CD 4.32Å; F81-K103 HydrophobicContact CE1-CD 4.26Å
82	V	71.3	Confident	61.4	Low	9 Å²	9	62.9 Å²	62.9	6%	0.055	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121	177.9	178.4	0	0	0	0	108.6	V44 I48 W59 Y79 L85 I99 C100 F101	V44-V82 HydrophobicContact CG1-CG1 4.06Å; V44-V82 WeakPolarHBondContact CG1-O 3.21Å; I48-V82 HydrophobicContact CD1-CB 3.56Å; I48-V82 HydrophobicContact CD1-CG1 3.57Å; I48-V82 HydrophobicContact CD1-CG2 4.09Å; I48-V82 HydrophobicContact CG1-CG1 4.08Å; W59-V82 HydrophobicContact CH2-CG2 4.14Å; Y79-V82 PolarHBondContact O-N 2.66Å; V82-L85 HydrophobicContact CG1-CD2 4.41Å; V82-L85 HydrophobicContact CG1-CG 4.23Å; V82-I99 HydrophobicContact CG1-CG2 3.73Å; V82-I99 HydrophobicContact CG2-CG2 4.04Å; V82-C100 CarbonylContact C-O 3.48Å; V82-C100 WeakPolarHBondContact CA-O 3.11Å; V82-F101 HydrophobicContact CG2-CD1 3.89Å; V82-F101 HydrophobicContact CG2-CE1 3.66Å
83	E	71.2	Confident	62	Low	66 Å²	66	58.4 Å²	58.4	31%	0.308	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-31.7	177.5	-73.6	-170.5	163.6	0	0	113.3	V44 C100 S102 A122	V44-E83 WeakPolarHBondContact CG2-O 3.39Å; E83-C100 HydrophobicContact CB-CB 4.39Å; E83-C100 PolarHBondContact N-O 3.49Å; E83-S102 VanDerWaalsContact CD-CA 3.4Å; E83-S102 VanDerWaalsContact CG-CA 3.47Å; E83-S102 WeakPolarHBondContact OE1-CA 3.37Å; E83-S102 WeakPolarHBondContact OE1-CB 3.31Å; E83-A122 WeakPolarHBondContact OE2-CB 3.11Å; E83-A122 PolarHBondContact OE2-N 3.48Å
84	D	72.1	Confident	62.8	Low	39 Å²	39	55.5 Å²	55.5	21%	0.209	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	159.2	-175.3	-154.7	5.2	0	0	0	111.9	Y37 R47 C100	Y37-D84 PolarHBondContact OH-OD1 3.45Å; R47-D84 IonicContact NH1-OD1 3.92Å; D84-C100 HydrophobicContact CB-CB 3.88Å; D84-C100 PolarHBondContact N-O 3.25Å; D84-C100 PolarHBondContact O-N 3.03Å
85	L	74.4	Confident	63.9	Low	4 Å²	4	52.1 Å²	52.1	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	108.1	179.8	-74.5	170.5	0	0	0	109.4	Y37 I48 I51 V82 R98 I99	Y37-L85 PolarHBondContact OH-O 2.85Å; I48-L85 HydrophobicContact CB-CD1 4.01Å; I48-L85 HydrophobicContact CG1-CD1 3.33Å; I48-L85 HydrophobicContact CG1-CG 4.15Å; I48-L85 HydrophobicContact CG2-CD1 4.37Å; I51-L85 HydrophobicContact CD1-CD1 3.5Å; I51-L85 VanDerWaalsContact CD1-CD1 3.5Å; I51-L85 HydrophobicContact CD1-CD2 3.99Å; I51-L85 HydrophobicContact CD1-CG 4.38Å; I51-L85 HydrophobicContact CG1-CD1 4.11Å; V82-L85 HydrophobicContact CG1-CD2 4.41Å; V82-L85 HydrophobicContact CG1-CG 4.23Å; L85-R98 CarbonylContact C-O 3.58Å; L85-R98 WeakPolarHBondContact CA-O 3.39Å; L85-I99 HydrophobicContact CD2-CB 4Å; L85-I99 HydrophobicContact CD2-CD1 3.96Å; L85-I99 HydrophobicContact CD2-CG1 3.6Å; L85-I99 HydrophobicContact CD2-CG2 3.78Å
86	S	70.5	Confident	64.9	Low	23 Å²	23	46.8 Å²	46.8	16%	0.161	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.6	-176.2	-75	0	0	0	0	111.6	R98	S86-R98 PolarHBondContact N-O 2.82Å; S86-R98 WeakPolarHBondContact O-CA 3.46Å; S86-R98 VanDerWaalsContact O-CB 3.32Å; S86-R98 WeakPolarHBondContact O-CB 3.17Å; S86-R98 PolarHBondContact O-N 2.88Å
87	P	70.5	Confident	66.1	Low	30 Å²	30	41.4 Å²	41.4	20%	0.195	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.6	167	32.3	-31.7	0	0	0	108.9	E29 F32 I33 L95 L97	E29-P87 HydrophobicContact CG-CB 4.41Å; F32-P87 HydrophobicContact CD1-CB 4.06Å; F32-P87 HydrophobicContact CD1-CG 3.74Å; F32-P87 HydrophobicContact CE1-CB 4.49Å; F32-P87 HydrophobicContact CE1-CG 4.2Å; I33-P87 HydrophobicContact CD1-CG 4.34Å; I33-P87 HydrophobicContact CG1-CG 4.07Å; P87-L95 HydrophobicContact CB-CD1 4.19Å; P87-L97 HydrophobicContact CB-CD2 4.18Å
88	I	69.4	Low	67.5	Low	40 Å²	40	39.5 Å²	39.5	21%	0.205	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-51.1	174.3	-57.4	-178.9	0	0	0	108.8	F96 R98 I128	I88-F96 HydrophobicContact CB-CB 4.21Å; I88-F96 PolarHBondContact N-O 3.24Å; I88-R98 HydrophobicContact CD1-CB 3.86Å; I88-R98 HydrophobicContact CD1-CG 4.46Å; I88-R98 HydrophobicContact CG1-CB 3.73Å; I88-I128 HydrophobicContact CD1-CB 4.41Å; I88-I128 HydrophobicContact CD1-CD1 3.66Å; I88-I128 HydrophobicContact CD1-CG1 3.67Å; I88-I128 HydrophobicContact CD1-CG2 4.04Å
89	C	68.3	Low	68.6	Low	3 Å²	3	39 Å²	39	2%	0.02	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	171.3	-179.6	49.9	0	0	0	0	109.7	C19 E29 F96	C19-C89 HydrophobicContact CB-CB 3.57Å; C19-C89 WeakPolarHBondContact CB-SG 3.3Å; C19-C89 WeakPolarHBondContact SG-CB 3.37Å; C19-C89 CovalentContact SG-SG 2.01Å; C19-C89 PolarHBondContact SG-SG 3.41Å; E29-C89 VanDerWaalsContact OE1-CA 3.26Å; E29-C89 WeakPolarHBondContact OE1-CA 3.44Å; C89-F96 WeakPolarHBondContact O-CB 3.46Å; C89-F96 WeakPolarHBondContact O-CD2 3.36Å; C89-F96 PolarHBondContact O-N 2.97Å
90	S	68.8	Low	69.4	Low	19 Å²	19	37.5 Å²	37.5	13%	0.133	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145.3	162.5	89.5	0	0	0	0	111.9	T26 E29 I94	T26-S90 WeakPolarHBondContact CB-OG 3.19Å; T26-S90 WeakPolarHBondContact OG1-CB 3.38Å; T26-S90 PolarHBondContact OG1-OG 2.77Å; E29-S90 PolarHBondContact OE1-N 2.81Å; S90-I94 CarbonylContact C-O 3.53Å; S90-I94 WeakPolarHBondContact CA-O 3.26Å; S90-I94 VanDerWaalsContact CB-O 3.31Å; S90-I94 WeakPolarHBondContact CB-O 3.13Å
91	K	66.5	Low	70.1	Confident	85 Å²	85	32.9 Å²	32.9	37%	0.37	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135.9	177.8	-172.2	174.2	-179.9	177.2	0	109.5	G93 I94 F96	K91-G93 VanDerWaalsContact C-N 3.26Å; K91-G93 PolarHBondContact O-N 3.18Å; K91-I94 PolarHBondContact N-O 3.28Å; K91-I94 WeakPolarHBondContact O-CB 3.36Å; K91-I94 PolarHBondContact O-N 3.48Å; K91-F96 HydrophobicContact CB-CE2 4.19Å
92	N	65.8	Low	69.9	Low	147 Å²	147	31 Å²	31	79%	0.786	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	39.3	176.9	-59.2	-15.4	0	0	0	114.1	I94	N92-I94 PolarHBondContact O-N 3.49Å
93	G	65.4	Low	69.2	Low	45 Å²	45	37.3 Å²	37.3	46%	0.464	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	9.4	-179.2	0	0	0	0	0	114.8	K91	K91-G93 VanDerWaalsContact C-N 3.26Å; K91-G93 PolarHBondContact O-N 3.18Å
94	I	69.8	Low	68.2	Low	51 Å²	51	37.9 Å²	37.9	26%	0.262	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.6	177.8	-57.9	169.3	0	0	0	108.7	S90 K91 N92 F96 L130	S90-I94 CarbonylContact C-O 3.53Å; S90-I94 WeakPolarHBondContact CA-O 3.26Å; S90-I94 VanDerWaalsContact CB-O 3.31Å; S90-I94 WeakPolarHBondContact CB-O 3.13Å; K91-I94 PolarHBondContact N-O 3.28Å; K91-I94 WeakPolarHBondContact O-CB 3.36Å; K91-I94 PolarHBondContact O-N 3.48Å; N92-I94 PolarHBondContact O-N 3.49Å; I94-F96 HydrophobicContact CB-CE2 4.42Å; I94-F96 HydrophobicContact CG2-CE2 4.19Å; I94-F96 HydrophobicContact CG2-CZ 4.12Å; I94-L130 HydrophobicContact CG2-CB 4.19Å; I94-L130 HydrophobicContact CG2-CD2 3.69Å; I94-L130 HydrophobicContact CG2-CG 4.49Å
95	L	72.7	Confident	67.1	Low	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.6	174.5	-174.9	66.3	0	0	0	109.7	L28 E29 F32 F56 P87 L97 N131	L28-L95 HydrophobicContact CB-CD1 4.34Å; E29-L95 HydrophobicContact CG-CD1 4.13Å; F32-L95 HydrophobicContact CB-CD2 3.92Å; F32-L95 HydrophobicContact CD2-CD2 3.69Å; F32-L95 HydrophobicContact CG-CD2 3.99Å; F56-L95 HydrophobicContact CD1-CD2 4.27Å; F56-L95 HydrophobicContact CE1-CD2 4.42Å; P87-L95 HydrophobicContact CB-CD1 4.19Å; L95-L97 HydrophobicContact CD2-CD1 4.15Å; L95-L97 HydrophobicContact CD2-CD2 3.86Å; L95-L97 HydrophobicContact CD2-CG 4.03Å; L95-L97 HydrophobicContact CG-CD2 4.14Å; L95-L97 HydrophobicContact CG-CG 4.05Å; L95-N131 PolarHBondContact N-O 3.06Å; L95-N131 PolarHBondContact O-N 3.07Å; L95-N131 VanDerWaalsContact O-N 3.1Å
96	F	72.5	Confident	65.7	Low	8 Å²	8	39.7 Å²	39.7	4%	0.035	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.2	174.6	-65.2	-87.1	0	0	0	109.5	L14 I88 C89 K91 I94 I128 L130	L14-F96 HydrophobicContact CD1-CD1 4.26Å; L14-F96 HydrophobicContact CD1-CE1 3.27Å; L14-F96 HydrophobicContact CD1-CZ 3.71Å; L14-F96 HydrophobicContact CD2-CE1 3.78Å; L14-F96 HydrophobicContact CD2-CE2 4.07Å; L14-F96 HydrophobicContact CD2-CZ 3.36Å; L14-F96 HydrophobicContact CG-CE1 4.04Å; L14-F96 HydrophobicContact CG-CZ 4.13Å; I88-F96 HydrophobicContact CB-CB 4.21Å; I88-F96 PolarHBondContact N-O 3.24Å; C89-F96 WeakPolarHBondContact O-CB 3.46Å; C89-F96 WeakPolarHBondContact O-CD2 3.36Å; C89-F96 PolarHBondContact O-N 2.97Å; K91-F96 HydrophobicContact CB-CE2 4.19Å; I94-F96 HydrophobicContact CB-CE2 4.42Å; I94-F96 HydrophobicContact CG2-CE2 4.19Å; I94-F96 HydrophobicContact CG2-CZ 4.12Å; F96-I128 HydrophobicContact CD1-CG2 4.3Å; F96-L130 HydrophobicContact CD1-CD2 4.08Å; F96-L130 HydrophobicContact CD1-CG 4.12Å; F96-L130 HydrophobicContact CE1-CD2 3.11Å; F96-L130 HydrophobicContact CE1-CG 3.56Å; F96-L130 HydrophobicContact CZ-CD2 3.42Å; F96-L130 VanDerWaalsContact CZ-CD2 3.42Å; F96-L130 HydrophobicContact CZ-CG 4.34Å
97	L	71.1	Confident	64.1	Low	2 Å²	2	50.7 Å²	50.7	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.9	-176.5	-71.5	170	0	0	0	110.2	F32 P87 L95 I128 F129	F32-L97 HydrophobicContact CD1-CD2 4.3Å; F32-L97 HydrophobicContact CD2-CD2 3.79Å; F32-L97 HydrophobicContact CE1-CD2 3.91Å; F32-L97 HydrophobicContact CE2-CD1 3.95Å; F32-L97 HydrophobicContact CE2-CD2 3.32Å; F32-L97 HydrophobicContact CE2-CG 4.32Å; F32-L97 HydrophobicContact CG-CD2 4.25Å; F32-L97 HydrophobicContact CZ-CD2 3.4Å; P87-L97 HydrophobicContact CB-CD2 4.18Å; L95-L97 HydrophobicContact CD2-CD1 4.15Å; L95-L97 HydrophobicContact CD2-CD2 3.86Å; L95-L97 HydrophobicContact CD2-CG 4.03Å; L95-L97 HydrophobicContact CG-CD2 4.14Å; L95-L97 HydrophobicContact CG-CG 4.05Å; L97-I128 WeakPolarHBondContact O-CA 3.48Å; L97-F129 HydrophobicContact CB-CD1 3.88Å; L97-F129 HydrophobicContact CB-CD2 4.34Å; L97-F129 HydrophobicContact CB-CE1 3.22Å; L97-F129 HydrophobicContact CB-CE2 3.8Å; L97-F129 HydrophobicContact CB-CG 4.4Å; L97-F129 HydrophobicContact CB-CZ 3.24Å; L97-F129 HydrophobicContact CD1-CE1 4.22Å; L97-F129 HydrophobicContact CD1-CE2 3.48Å; L97-F129 VanDerWaalsContact CD1-CE2 3.48Å; L97-F129 HydrophobicContact CD1-CZ 3.3Å; L97-F129 HydrophobicContact CG-CE1 4.33Å; L97-F129 HydrophobicContact CG-CE2 4.21Å; L97-F129 HydrophobicContact CG-CZ 3.87Å; L97-F129 PolarHBondContact N-O 3.41Å; L97-F129 VanDerWaalsContact N-O 3.16Å; L97-F129 WeakPolarHBondContact O-CD1 3.37Å; L97-F129 PolarHBondContact O-N 3.28Å; L97-F129 VanDerWaalsContact O-N 3.08Å
98	R	73.6	Confident	62.6	Low	31 Å²	31	58 Å²	58	12%	0.117	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.8	172.2	-169	178.4	-65.2	174.3	3.6	109.5	L85 S86 I88 F117 G118 A126 M127	L85-R98 CarbonylContact C-O 3.58Å; L85-R98 WeakPolarHBondContact CA-O 3.39Å; S86-R98 PolarHBondContact N-O 2.82Å; S86-R98 WeakPolarHBondContact O-CA 3.46Å; S86-R98 VanDerWaalsContact O-CB 3.32Å; S86-R98 WeakPolarHBondContact O-CB 3.17Å; S86-R98 PolarHBondContact O-N 2.88Å; I88-R98 HydrophobicContact CD1-CB 3.86Å; I88-R98 HydrophobicContact CD1-CG 4.46Å; I88-R98 HydrophobicContact CG1-CB 3.73Å; R98-F117 VanDerWaalsContact CZ-CB 3.45Å; R98-F117 PolarHBondContact NH1-O 3.19Å; R98-G118 PolarHBondContact NH1-O 3.43Å; R98-A126 HydrophobicContact CG-CB 3.89Å; R98-M127 WeakPolarHBondContact CA-O 3.31Å
99	I	73.3	Confident	61.1	Low	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.7	168.2	-45.5	-165.7	0	0	0	108.9	L57 F62 V82 L85 F101 A126 M127 F129	L57-I99 HydrophobicContact CD2-CD1 4.02Å; F62-I99 HydrophobicContact CE1-CD1 3.75Å; F62-I99 HydrophobicContact CE2-CD1 4.17Å; F62-I99 HydrophobicContact CZ-CD1 3.55Å; V82-I99 HydrophobicContact CG1-CG2 3.73Å; V82-I99 HydrophobicContact CG2-CG2 4.04Å; L85-I99 HydrophobicContact CD2-CB 4Å; L85-I99 HydrophobicContact CD2-CD1 3.96Å; L85-I99 HydrophobicContact CD2-CG1 3.6Å; L85-I99 HydrophobicContact CD2-CG2 3.78Å; I99-F101 HydrophobicContact CB-CE2 3.91Å; I99-F101 HydrophobicContact CB-CZ 4.04Å; I99-F101 HydrophobicContact CG2-CD2 4.33Å; I99-F101 HydrophobicContact CG2-CE1 3.97Å; I99-F101 HydrophobicContact CG2-CE2 3.7Å; I99-F101 HydrophobicContact CG2-CZ 3.5Å; I99-A126 CarbonylContact O-C 3.49Å; I99-A126 WeakPolarHBondContact O-CA 3.37Å; I99-M127 PolarHBondContact N-O 2.99Å; I99-M127 PolarHBondContact O-N 2.97Å; I99-F129 HydrophobicContact CD1-CD1 3.93Å; I99-F129 HydrophobicContact CD1-CE1 3.43Å; I99-F129 VanDerWaalsContact CD1-CE1 3.43Å; I99-F129 HydrophobicContact CD1-CZ 4.21Å; I99-F129 HydrophobicContact CG1-CD1 3.83Å; I99-F129 HydrophobicContact CG1-CE1 3.34Å; I99-F129 HydrophobicContact CG1-CZ 4.41Å
100	C	71.8	Confident	59.3	Low	2 Å²	2	63.9 Å²	63.9	1%	0.014	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.5	173.6	-65.3	0	0	0	0	110	V82 E83 D84 C120	V82-C100 CarbonylContact C-O 3.48Å; V82-C100 WeakPolarHBondContact CA-O 3.11Å; E83-C100 HydrophobicContact CB-CB 4.39Å; E83-C100 PolarHBondContact N-O 3.49Å; D84-C100 HydrophobicContact CB-CB 3.88Å; D84-C100 PolarHBondContact N-O 3.25Å; D84-C100 PolarHBondContact O-N 3.03Å; C100-C120 HydrophobicContact CB-CB 3.67Å; C100-C120 WeakPolarHBondContact CB-SG 3.35Å; C100-C120 VanDerWaalsContact SG-CA 3.51Å; C100-C120 WeakPolarHBondContact SG-CB 3.47Å; C100-C120 CovalentContact SG-SG 2.04Å; C100-C120 PolarHBondContact SG-SG 3.11Å
101	F	69.4	Low	57.7	Low	7 Å²	7	68 Å²	68	3%	0.031	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.6	178.1	-58.2	-92.9	0	0	0	113.5	F62 L67 F81 V82 I99 K103 P105 A122 T125 M127	F62-F101 HydrophobicContact CE1-CZ 4.42Å; L67-F101 HydrophobicContact CD1-CE1 4.44Å; L67-F101 HydrophobicContact CD2-CZ 4.07Å; F81-F101 HydrophobicContact CB-CD1 4.41Å; F81-F101 CarbonylContact O-C 3.46Å; F81-F101 VanDerWaalsContact O-C 3.3Å; F81-F101 WeakPolarHBondContact O-CA 3.39Å; F81-F101 VanDerWaalsContact O-CB 3.26Å; F81-F101 WeakPolarHBondContact O-CB 3.32Å; F81-F101 WeakPolarHBondContact O-CD1 3.37Å; V82-F101 HydrophobicContact CG2-CD1 3.89Å; V82-F101 HydrophobicContact CG2-CE1 3.66Å; I99-F101 HydrophobicContact CB-CE2 3.91Å; I99-F101 HydrophobicContact CB-CZ 4.04Å; I99-F101 HydrophobicContact CG2-CD2 4.33Å; I99-F101 HydrophobicContact CG2-CE1 3.97Å; I99-F101 HydrophobicContact CG2-CE2 3.7Å; I99-F101 HydrophobicContact CG2-CZ 3.5Å; F101-K103 WeakPolarHBondContact CB-O 3.08Å; F101-P105 HydrophobicContact CD1-CB 4.42Å; F101-P105 HydrophobicContact CD1-CG 4.39Å; F101-P105 HydrophobicContact CD2-CG 4.34Å; F101-P105 HydrophobicContact CG-CG 4.22Å; F101-A122 WeakPolarHBondContact O-CB 3.08Å; F101-T125 PolarHBondContact N-O 3.21Å; F101-T125 PolarHBondContact O-OG1 3.29Å; F101-M127 HydrophobicContact CE2-CB 4.17Å
102	S	58.7	Low	56.4	Low	41 Å²	41	66.2 Å²	66.2	29%	0.287	35%	0.349	S	S	.	.	S	Bend	trans	-76.6	-25.4	-178.2	61.5	0	0	0	0	113.6	F81 E83	F81-S102 WeakPolarHBondContact CA-OG 3.34Å; F81-S102 PolarHBondContact O-N 2.71Å; F81-S102 PolarHBondContact O-OG 2.61Å; E83-S102 VanDerWaalsContact CD-CA 3.4Å; E83-S102 VanDerWaalsContact CG-CA 3.47Å; E83-S102 WeakPolarHBondContact OE1-CA 3.37Å; E83-S102 WeakPolarHBondContact OE1-CB 3.31Å
103	K	57.5	Low	55.1	Low	141 Å²	141	63.6 Å²	63.6	61%	0.613	34%	0.336	S	S	*	.	S	Bend	trans	-137.4	151.9	175.1	-64.7	-178	-176.5	174	0	107	F81 F101 P105	F81-K103 HydrophobicContact CD1-CB 4.28Å; F81-K103 HydrophobicContact CD1-CD 4.32Å; F81-K103 HydrophobicContact CE1-CD 4.26Å; F101-K103 WeakPolarHBondContact CB-O 3.08Å; K103-P105 WeakPolarHBondContact O-CD 3.37Å
104	N	50.7	Low	54	Low	77 Å²	77	63 Å²	63	41%	0.412	32%	0.323	S	S	.	.			trans	-56.9	111	172.5	-153.6	-10.6	0	0	0	107.7	T106 T125	N104-T106 PolarHBondContact O-N 3.09Å; N104-T106 PolarHBondContact OD1-OG1 2.99Å; N104-T125 HydrophobicContact CB-CG2 4.07Å; N104-T125 VanDerWaalsContact OD1-CG2 3.28Å; N104-T125 WeakPolarHBondContact OD1-CG2 3.21Å
105	P	48.9	Very low	52.4	Low	46 Å²	46	62.6 Å²	62.6	30%	0.299	33%	0.331	S	S	.	.	S	Bend	trans	-63.6	-18.5	-171.3	23.9	-31.6	0	0	0	111.1	F101 K103	F101-P105 HydrophobicContact CD1-CB 4.42Å; F101-P105 HydrophobicContact CD1-CG 4.39Å; F101-P105 HydrophobicContact CD2-CG 4.34Å; F101-P105 HydrophobicContact CG-CG 4.22Å; K103-P105 WeakPolarHBondContact O-CD 3.37Å
106	T	43.7	Very low	50.8	Low	35 Å²	35	70 Å²	70	22%	0.215	37%	0.368	C	S	.	.			trans	-96.6	89.7	178.4	48.2	0	0	0	0	112	N104 K108 F109	N104-T106 PolarHBondContact O-N 3.09Å; N104-T106 PolarHBondContact OD1-OG1 2.99Å; T106-K108 PolarHBondContact O-N 3.4Å; T106-F109 WeakPolarHBondContact CB-O 3.41Å; T106-F109 HydrophobicContact CG2-CB 3.86Å; T106-F109 PolarHBondContact OG1-O 3.3Å
107	R	38.3	Very low	49.2	Very low	254 Å²	254	72.5 Å²	72.5	96%	0.958	38%	0.38	S	S	*	.	S	Bend	trans	-75.5	3.3	161.3	-143	-179.7	-174.4	-173.4	0.9	112.6
108	K	38.7	Very low	47.9	Very low	183 Å²	183	75 Å²	75	80%	0.796	41%	0.406	S	S	*	.	S	Bend	trans	-145.7	-0.2	-179.6	-126.8	-177	-176	-178.3	0	117.9	T106	T106-K108 PolarHBondContact O-N 3.4Å
109	F	37.6	Very low	46.5	Very low	108 Å²	108	83.3 Å²	83.3	47%	0.474	44%	0.437	S	S	.	.	S	Bend	trans	-132.2	151.6	-177.8	-64.9	-80	0	0	0	110.1	E68 T106	E68-F109 WeakPolarHBondContact OE2-CD1 3.18Å; E68-F109 WeakPolarHBondContact OE2-CD2 3.34Å; E68-F109 WeakPolarHBondContact OE2-CE1 3.43Å; E68-F109 WeakPolarHBondContact OE2-CE2 3.26Å; E68-F109 WeakPolarHBondContact OE2-CG 3.18Å; E68-F109 WeakPolarHBondContact OE2-CZ 3.21Å; T106-F109 WeakPolarHBondContact CB-O 3.41Å; T106-F109 HydrophobicContact CG2-CB 3.86Å; T106-F109 PolarHBondContact OG1-O 3.3Å
110	G	31.6	Very low	45.5	Very low	59 Å²	59	84.6 Å²	84.6	61%	0.608	45%	0.446	S	S	*	.			trans	-51.3	166.9	-161.5	0	0	0	0	0	115.2
111	T	34.8	Very low	44.3	Very low	107 Å²	107	94.1 Å²	94.1	66%	0.656	49%	0.487	S	S	*	.			trans	-34.1	123.6	167.7	31.7	0	0	0	0	110.3	D113	T111-D113 PolarHBondContact O-N 3.44Å; T111-D113 VanDerWaalsContact O-N 3.08Å
112	P	38.7	Very low	43.1	Very low	46 Å²	46	94.7 Å²	94.7	30%	0.299	49%	0.493	S	S	.	.			trans	-56.2	121.9	168.8	19.5	-25.7	0	0	0	106.8	V114 T125	P112-V114 HydrophobicContact CB-CG2 4.17Å; P112-V114 PolarHBondContact O-N 2.86Å; P112-T125 HydrophobicContact CG-CG2 3.89Å
113	D	38.3	Very low	42.3	Very low	93 Å²	93	102 Å²	102	50%	0.497	52%	0.52	S	S	.	.	S	Bend	trans	-72.1	53.7	173.9	-76.1	-32.9	0	0	0	109.6	H5 T111	H5-D113 WeakPolarHBondContact CB-OD2 3.02Å; T111-D113 PolarHBondContact O-N 3.44Å; T111-D113 VanDerWaalsContact O-N 3.08Å
114	V	41.6	Very low	41.7	Very low	33 Å²	33	98.6 Å²	98.6	20%	0.2	51%	0.514	C	S	.	.			trans	-138.6	110.5	-176.4	-154.8	0	0	0	0	107.1	P112 F117 A126 I128	P112-V114 HydrophobicContact CB-CG2 4.17Å; P112-V114 PolarHBondContact O-N 2.86Å; V114-F117 HydrophobicContact CG1-CD2 4.29Å; V114-F117 HydrophobicContact CG1-CE2 4.36Å; V114-A126 WeakPolarHBondContact CB-O 3.29Å; V114-A126 WeakPolarHBondContact CG1-O 3.4Å; V114-A126 WeakPolarHBondContact CG2-O 3.32Å; V114-I128 HydrophobicContact CG1-CG1 4.44Å
115	G	37.7	Very low	41.9	Very low	41 Å²	41	95.3 Å²	95.3	42%	0.423	50%	0.496	S	S	.	.			trans	-53.7	161.3	176.9	0	0	0	0	0	112.7	F117	G115-F117 VanDerWaalsContact C-N 3.27Å; G115-F117 WeakPolarHBondContact O-CD2 3.34Å; G115-F117 PolarHBondContact O-N 3.14Å
116	I	39	Very low	42	Very low	155 Å²	155	93.5 Å²	93.5	80%	0.795	49%	0.485	S	S	*	.			trans	-69.5	86.4	176.6	-55.7	168.5	0	0	0	108.2
117	F	37.8	Very low	42.7	Very low	61 Å²	61	93.8 Å²	93.8	27%	0.268	49%	0.485	S	S	.	.			trans	-87.6	113.6	172	-65.6	-78	0	0	0	109.3	L15 R98 V114 G115	L15-F117 HydrophobicContact CD1-CE1 3.67Å; L15-F117 HydrophobicContact CD1-CE2 3.74Å; L15-F117 HydrophobicContact CD1-CZ 3.18Å; L15-F117 HydrophobicContact CD2-CD1 4.3Å; L15-F117 HydrophobicContact CD2-CE1 3.91Å; L15-F117 HydrophobicContact CD2-CZ 4.26Å; L15-F117 HydrophobicContact CG-CE1 4.27Å; L15-F117 HydrophobicContact CG-CZ 4.24Å; R98-F117 VanDerWaalsContact CZ-CB 3.45Å; R98-F117 PolarHBondContact NH1-O 3.19Å; V114-F117 HydrophobicContact CG1-CD2 4.29Å; V114-F117 HydrophobicContact CG1-CE2 4.36Å; G115-F117 VanDerWaalsContact C-N 3.27Å; G115-F117 WeakPolarHBondContact O-CD2 3.34Å; G115-F117 PolarHBondContact O-N 3.14Å
118	G	44.6	Very low	43.6	Very low	55 Å²	55	82.5 Å²	82.5	57%	0.567	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	155.2	-177.4	0	0	0	0	0	114.5	R98	R98-G118 PolarHBondContact NH1-O 3.43Å
119	R	45	Very low	44.7	Very low	205 Å²	205	74.6 Å²	74.6	77%	0.774	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.6	-14.5	-174.4	-66.9	-166.9	-178.4	177.1	2.8	117.4
120	C	50.3	Low	45.6	Very low	27 Å²	27	73.2 Å²	73.2	18%	0.182	41%	0.406	C	S	.	.			trans	-74.9	135.2	164.7	-54.8	0	0	0	0	109.7	C100	C100-C120 HydrophobicContact CB-CB 3.67Å; C100-C120 WeakPolarHBondContact CB-SG 3.35Å; C100-C120 VanDerWaalsContact SG-CA 3.51Å; C100-C120 WeakPolarHBondContact SG-CB 3.47Å; C100-C120 CovalentContact SG-SG 2.04Å; C100-C120 PolarHBondContact SG-SG 3.11Å
121	K	48.2	Very low	47	Very low	203 Å²	203	71.8 Å²	71.8	88%	0.883	38%	0.384	S	S	*	.	S	Bend	trans	-73.2	-39.3	177.5	-79.4	-176.9	179	175.2	0	111.4	K123	K121-K123 PolarHBondContact O-N 3.27Å
122	A	43.2	Very low	47.7	Very low	19 Å²	19	68.7 Å²	68.7	16%	0.157	37%	0.374	C	S	.	.	S	Bend	trans	-71.4	119.5	167.9	0	0	0	0	0	110.6	E83 F101 S124	E83-A122 WeakPolarHBondContact OE2-CB 3.11Å; E83-A122 PolarHBondContact OE2-N 3.48Å; F101-A122 WeakPolarHBondContact O-CB 3.08Å; A122-S124 PolarHBondContact O-N 3.12Å
123	K	42.1	Very low	48	Very low	195 Å²	195	72.2 Å²	72.2	85%	0.848	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	123.4	169	-74.8	177	175.3	178	0	108	K121	K121-K123 PolarHBondContact O-N 3.27Å
124	S	45.7	Very low	48.6	Very low	69 Å²	69	69.7 Å²	69.7	48%	0.483	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.1	-1.8	153.7	75.9	0	0	0	0	121.7	A122	A122-S124 PolarHBondContact O-N 3.12Å
125	T	53.4	Low	48.6	Very low	7 Å²	7	75 Å²	75	4%	0.043	40%	0.403	C	S	.	.			trans	-137.4	93.6	179.4	52.4	0	0	0	0	113.8	F101 N104 P112	F101-T125 PolarHBondContact N-O 3.21Å; F101-T125 PolarHBondContact O-OG1 3.29Å; N104-T125 HydrophobicContact CB-CG2 4.07Å; N104-T125 VanDerWaalsContact OD1-CG2 3.28Å; N104-T125 WeakPolarHBondContact OD1-CG2 3.21Å; P112-T125 HydrophobicContact CG-CG2 3.89Å
126	A	51.3	Low	48.7	Very low	8 Å²	8	82.1 Å²	82.1	7%	0.066	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	148.9	164.3	0	0	0	0	0	109	R98 I99 V114	R98-A126 HydrophobicContact CG-CB 3.89Å; I99-A126 CarbonylContact O-C 3.49Å; I99-A126 WeakPolarHBondContact O-CA 3.37Å; V114-A126 WeakPolarHBondContact CB-O 3.29Å; V114-A126 WeakPolarHBondContact CG1-O 3.4Å; V114-A126 WeakPolarHBondContact CG2-O 3.32Å
127	M	58.4	Low	48.8	Very low	41 Å²	41	76.4 Å²	76.4	20%	0.202	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135	166.4	-171.2	177.2	-176.5	0	0	109.8	F62 H66 R98 I99 F101	F62-M127 HydrophobicContact CE2-CE 4.27Å; F62-M127 HydrophobicContact CE2-SD 3.56Å; F62-M127 VanDerWaalsContact CE2-SD 3.56Å; F62-M127 HydrophobicContact CZ-SD 3.55Å; F62-M127 VanDerWaalsContact CZ-SD 3.55Å; H66-M127 HydrophobicContact CB-CE 3.57Å; H66-M127 HydrophobicContact CB-SD 3.82Å; R98-M127 WeakPolarHBondContact CA-O 3.31Å; I99-M127 PolarHBondContact N-O 2.99Å; I99-M127 PolarHBondContact O-N 2.97Å; F101-M127 HydrophobicContact CE2-CB 4.17Å
128	I	58.6	Low	48.6	Very low	18 Å²	18	75.6 Å²	75.6	9%	0.092	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128.4	173.1	-52.8	-177.3	0	0	0	107.9	I11 L15 I88 F96 L97 V114	I11-I128 HydrophobicContact CG2-CB 4.37Å; I11-I128 HydrophobicContact CG2-CD1 4.35Å; L15-I128 HydrophobicContact CD1-CD1 3.84Å; L15-I128 HydrophobicContact CD2-CD1 4.02Å; L15-I128 HydrophobicContact CG-CD1 4.22Å; I88-I128 HydrophobicContact CD1-CB 4.41Å; I88-I128 HydrophobicContact CD1-CD1 3.66Å; I88-I128 HydrophobicContact CD1-CG1 3.67Å; I88-I128 HydrophobicContact CD1-CG2 4.04Å; F96-I128 HydrophobicContact CD1-CG2 4.3Å; L97-I128 WeakPolarHBondContact O-CA 3.48Å; V114-I128 HydrophobicContact CG1-CG1 4.44Å
129	F	61.6	Low	48.3	Very low	17 Å²	17	78.8 Å²	78.8	8%	0.075	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.3	170.9	67	-81.3	0	0	0	110.6	L57 F62 L97 I99	L57-F129 HydrophobicContact CB-CE2 4.33Å; L57-F129 HydrophobicContact CB-CZ 4.4Å; L57-F129 HydrophobicContact CD1-CD2 4.06Å; L57-F129 HydrophobicContact CD1-CE2 3.63Å; L57-F129 HydrophobicContact CD1-CZ 3.94Å; L57-F129 HydrophobicContact CD2-CZ 4.09Å; L57-F129 HydrophobicContact CG-CE2 4.4Å; L57-F129 HydrophobicContact CG-CZ 4.38Å; F62-F129 HydrophobicContact CE2-CB 4.37Å; F62-F129 HydrophobicContact CE2-CD1 4.31Å; F62-F129 HydrophobicContact CE2-CG 4.41Å; L97-F129 HydrophobicContact CB-CD1 3.88Å; L97-F129 HydrophobicContact CB-CD2 4.34Å; L97-F129 HydrophobicContact CB-CE1 3.22Å; L97-F129 HydrophobicContact CB-CE2 3.8Å; L97-F129 HydrophobicContact CB-CG 4.4Å; L97-F129 HydrophobicContact CB-CZ 3.24Å; L97-F129 HydrophobicContact CD1-CE1 4.22Å; L97-F129 HydrophobicContact CD1-CE2 3.48Å; L97-F129 VanDerWaalsContact CD1-CE2 3.48Å; L97-F129 HydrophobicContact CD1-CZ 3.3Å; L97-F129 HydrophobicContact CG-CE1 4.33Å; L97-F129 HydrophobicContact CG-CE2 4.21Å; L97-F129 HydrophobicContact CG-CZ 3.87Å; L97-F129 PolarHBondContact N-O 3.41Å; L97-F129 VanDerWaalsContact N-O 3.16Å; L97-F129 WeakPolarHBondContact O-CD1 3.37Å; L97-F129 PolarHBondContact O-N 3.28Å; L97-F129 VanDerWaalsContact O-N 3.08Å; I99-F129 HydrophobicContact CD1-CD1 3.93Å; I99-F129 HydrophobicContact CD1-CE1 3.43Å; I99-F129 VanDerWaalsContact CD1-CE1 3.43Å; I99-F129 HydrophobicContact CD1-CZ 4.21Å; I99-F129 HydrophobicContact CG1-CD1 3.83Å; I99-F129 HydrophobicContact CG1-CE1 3.34Å; I99-F129 HydrophobicContact CG1-CZ 4.41Å
130	L	56.5	Low	48	Very low	78 Å²	78	73.7 Å²	73.7	41%	0.408	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.6	173.6	-71.8	128.2	0	0	0	107.9	L14 I94 F96	L14-L130 HydrophobicContact CD1-CD2 4.32Å; I94-L130 HydrophobicContact CG2-CB 4.19Å; I94-L130 HydrophobicContact CG2-CD2 3.69Å; I94-L130 HydrophobicContact CG2-CG 4.49Å; F96-L130 HydrophobicContact CD1-CD2 4.08Å; F96-L130 HydrophobicContact CD1-CG 4.12Å; F96-L130 HydrophobicContact CE1-CD2 3.11Å; F96-L130 HydrophobicContact CE1-CG 3.56Å; F96-L130 HydrophobicContact CZ-CD2 3.42Å; F96-L130 VanDerWaalsContact CZ-CD2 3.42Å; F96-L130 HydrophobicContact CZ-CG 4.34Å
131	N	59.7	Low	47.3	Very low	29 Å²	29	77.8 Å²	77.8	16%	0.155	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	100.8	161.5	-171.4	12.4	0	0	0	110	F56 L95	F56-N131 WeakPolarHBondContact CA-ND2 3.06Å; F56-N131 PolarHBondContact O-ND2 3.46Å; L95-N131 PolarHBondContact N-O 3.06Å; L95-N131 PolarHBondContact O-N 3.07Å; L95-N131 VanDerWaalsContact O-N 3.1Å
132	G	51	Low	46.3	Very low	42 Å²	42	70.9 Å²	70.9	43%	0.433	41%	0.41	S	S	.	.			trans	-98.6	85.6	170.2	0	0	0	0	0	109.7
133	N	45.2	Very low	45.9	Very low	120 Å²	120	75.3 Å²	75.3	64%	0.642	44%	0.438	S	S	*	.			trans	172.2	87.1	150.8	-91.1	-28.8	0	0	0	110.2	L135	N133-L135 PolarHBondContact O-N 2.84Å
134	I	49.5	Very low	45.4	Very low	40 Å²	40	72.4 Å²	72.4	21%	0.205	43%	0.43	C	S	.	.			trans	-95.8	61.8	155.3	-56.4	172.7	0	0	0	107.6	L28 K136 I137	L28-I134 HydrophobicContact CD1-CD1 4.03Å; L28-I134 HydrophobicContact CD2-CD1 3.34Å; L28-I134 HydrophobicContact CG-CD1 4.18Å; I134-K136 VanDerWaalsContact C-N 3.34Å; I134-I137 HydrophobicContact CG2-CB 3.74Å; I134-I137 HydrophobicContact CG2-CG1 4.22Å
135	L	41.6	Very low	45.2	Very low	146 Å²	146	75.1 Å²	75.1	76%	0.764	44%	0.438	S	S	*	.	S	Bend	trans	-98.4	8.1	156.9	-97.3	159.2	0	0	0	110.9	N133	N133-L135 PolarHBondContact O-N 2.84Å
136	K	40.5	Very low	44.4	Very low	190 Å²	190	80.8 Å²	80.8	83%	0.826	47%	0.467	S	S	*	.	S	Bend	trans	-125.5	-4.6	178.1	-78.3	-170	175.9	-179.3	0	116.5	I134	I134-K136 VanDerWaalsContact C-N 3.34Å
137	I	41.8	Very low	44	Very low	35 Å²	35	88.1 Å²	88.1	18%	0.179	49%	0.494	C	S	.	.	S	Bend	trans	-108.4	67.1	172.8	-40.2	179.1	0	0	0	108.6	E31 F56 I134	E31-I137 VanDerWaalsContact OE1-CG2 3.22Å; E31-I137 WeakPolarHBondContact OE1-CG2 2.99Å; F56-I137 HydrophobicContact CD1-CD1 3.84Å; F56-I137 HydrophobicContact CD2-CD1 4.06Å; F56-I137 HydrophobicContact CE1-CD1 3.34Å; F56-I137 HydrophobicContact CE2-CD1 3.59Å; F56-I137 HydrophobicContact CG-CD1 4.19Å; F56-I137 HydrophobicContact CZ-CD1 3.21Å; I134-I137 HydrophobicContact CG2-CB 3.74Å; I134-I137 HydrophobicContact CG2-CG1 4.22Å
138	S	32.3	Very low	43.5	Very low	44 Å²	44	88.4 Å²	88.4	31%	0.308	50%	0.5	S	S	.	.			trans	-153.7	52.6	154.8	43.7	0	0	0	0	107.2	S140 S142	S138-S140 PolarHBondContact O-N 2.85Å; S138-S142 PolarHBondContact O-N 3.37Å; S138-S142 VanDerWaalsContact O-N 3.11Å; S138-S142 PolarHBondContact OG-OG 2.95Å
139	S	37.8	Very low	43.4	Very low	121 Å²	121	91.3 Å²	91.3	85%	0.846	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	18.4	156.3	51.9	0	0	0	0	112.1
140	S	39.4	Very low	43	Very low	98 Å²	98	100.7 Å²	100.7	69%	0.685	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.5	108.4	140.6	59.6	0	0	0	0	108	S138	S138-S140 PolarHBondContact O-N 2.85Å
141	S	35	Very low	43.2	Very low	113 Å²	113	100.3 Å²	100.3	79%	0.79	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.9	56.6	175.3	68.8	0	0	0	0	118.5
142	S	28.2	Very low	43.4	Very low	58 Å²	58	103.5 Å²	103.5	41%	0.406	57%	0.574	S	S	.	*				-66.3	136.2	128	-86	0	0	0	0	106.9	S138 I144	S138-S142 PolarHBondContact O-N 3.37Å; S138-S142 VanDerWaalsContact O-N 3.11Å; S138-S142 PolarHBondContact OG-OG 2.95Å; S142-I144 PolarHBondContact O-N 3.21Å
143	P	33.9	Very low	44.3	Very low	113 Å²	113	108.5 Å²	108.5	73%	0.734	59%	0.585	S	S	*	*			trans	-63.7	102.8	168.8	28.6	-28.2	0	0	0	103.8	I145	P143-I145 PolarHBondContact O-N 3.36Å
144	I	33	Very low	45.6	Very low	134 Å²	134	104.8 Å²	104.8	69%	0.687	57%	0.574	S	S	*	*			trans	-54.8	107.7	156.6	-41.8	171.2	0	0	0	100.6	S142 L146	S142-I144 PolarHBondContact O-N 3.21Å; I144-L146 HydrophobicContact CB-CB 4.41Å; I144-L146 HydrophobicContact CB-CD1 4.04Å; I144-L146 HydrophobicContact CD1-CD1 4.4Å; I144-L146 HydrophobicContact CG2-CB 4.2Å; I144-L146 HydrophobicContact CG2-CD1 3.32Å; I144-L146 HydrophobicContact CG2-CG 4.36Å; I144-L146 PolarHBondContact O-N 3.19Å
145	I	40.7	Very low	47	Very low	126 Å²	126	107.1 Å²	107.1	65%	0.646	59%	0.59	S	S	*	*			trans	-68.1	64.1	151	-49.3	175.1	0	0	0	103.5	P143 Y147	P143-I145 PolarHBondContact O-N 3.36Å; I145-Y147 HydrophobicContact CG2-CD2 3.74Å; I145-Y147 HydrophobicContact CG2-CE2 3.68Å; I145-Y147 HydrophobicContact CG2-CG 4.22Å; I145-Y147 PolarHBondContact O-N 3.22Å
146	L	36.4	Very low	49	Very low	125 Å²	125	104 Å²	104	65%	0.654	57%	0.573	S	S	*	*			trans	-52	98.4	133.4	-118.8	81.9	0	0	0	99	I144 S148	I144-L146 HydrophobicContact CB-CB 4.41Å; I144-L146 HydrophobicContact CB-CD1 4.04Å; I144-L146 HydrophobicContact CD1-CD1 4.4Å; I144-L146 HydrophobicContact CG2-CB 4.2Å; I144-L146 HydrophobicContact CG2-CD1 3.32Å; I144-L146 HydrophobicContact CG2-CG 4.36Å; I144-L146 PolarHBondContact O-N 3.19Å; L146-S148 PolarHBondContact O-N 3.03Å
147	Y	43.3	Very low	50.9	Low	163 Å²	163	96 Å²	96	64%	0.639	55%	0.546	S	S	*	.			trans	-49.8	92.7	140.1	-73.8	-86.5	0	0	0	102.8	I145 S149 T151	I145-Y147 HydrophobicContact CG2-CD2 3.74Å; I145-Y147 HydrophobicContact CG2-CE2 3.68Å; I145-Y147 HydrophobicContact CG2-CG 4.22Å; I145-Y147 PolarHBondContact O-N 3.22Å; Y147-S149 PolarHBondContact O-N 3.35Å; Y147-S149 VanDerWaalsContact O-N 3.14Å; Y147-T151 WeakPolarHBondContact CA-OG1 3.45Å
148	S	48.5	Very low	52.9	Low	47 Å²	47	101.3 Å²	101.3	33%	0.329	57%	0.568	S	S	.	*			trans	-45.3	130.4	166.1	173.4	0	0	0	0	102.7	L146 W150 T151	L146-S148 PolarHBondContact O-N 3.03Å; S148-W150 CarbonylContact O-C 3.55Å; S148-W150 PolarHBondContact O-N 3.01Å; S148-W150 VanDerWaalsContact OG-CB 3.31Å; S148-W150 WeakPolarHBondContact OG-CB 3.41Å; S148-W150 VanDerWaalsContact OG-CD1 3.25Å; S148-T151 PolarHBondContact N-OG1 3.35Å; S148-T151 PolarHBondContact O-N 2.52Å; S148-T151 PolarHBondContact O-OG1 3.27Å
149	S	54.8	Low	55.6	Low	79 Å²	79	104.2 Å²	104.2	55%	0.552	58%	0.578	S	S	*	*	H	α-helix	trans	-49.6	-27.3	-179.3	-47.7	0	0	0	0	110	Y147 L152 F153	Y147-S149 PolarHBondContact O-N 3.35Å; Y147-S149 VanDerWaalsContact O-N 3.14Å; S149-L152 PolarHBondContact O-N 2.8Å; S149-F153 VanDerWaalsContact C-CD2 3.49Å; S149-F153 WeakPolarHBondContact O-CB 3.36Å; S149-F153 WeakPolarHBondContact O-CD2 3.09Å; S149-F153 WeakPolarHBondContact O-CG 3.17Å; S149-F153 PolarHBondContact O-N 3.16Å
150	W	52.9	Low	57.9	Low	214 Å²	214	102.5 Å²	102.5	81%	0.811	56%	0.559	S	S	*	*	H	α-helix	trans	-57	-38.3	167.9	-61.9	80.9	0	0	0	117.2	S148 G154	S148-W150 CarbonylContact O-C 3.55Å; S148-W150 PolarHBondContact O-N 3.01Å; S148-W150 VanDerWaalsContact OG-CB 3.31Å; S148-W150 WeakPolarHBondContact OG-CB 3.41Å; S148-W150 VanDerWaalsContact OG-CD1 3.25Å; W150-G154 WeakPolarHBondContact O-CA 3.4Å; W150-G154 PolarHBondContact O-N 2.88Å
151	T	62.8	Low	60.2	Low	69 Å²	69	102.9 Å²	102.9	42%	0.423	55%	0.552	S	S	.	*	H	α-helix	trans	-71.8	-34.6	175	52.2	0	0	0	0	111.5	Y147 S148 G154 V155	Y147-T151 WeakPolarHBondContact CA-OG1 3.45Å; S148-T151 PolarHBondContact N-OG1 3.35Å; S148-T151 PolarHBondContact O-N 2.52Å; S148-T151 PolarHBondContact O-OG1 3.27Å; T151-G154 PolarHBondContact O-N 2.95Å; T151-V155 WeakPolarHBondContact O-CB 3.48Å; T151-V155 VanDerWaalsContact O-CG2 3.22Å; T151-V155 WeakPolarHBondContact O-CG2 3.21Å; T151-V155 PolarHBondContact O-N 3.46Å
152	L	63.3	Low	62.6	Low	96 Å²	96	99.2 Å²	99.2	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-74.1	-42.8	177.6	-154.8	132.1	0	0	0	110.8	S149 G154 V155 I156	S149-L152 PolarHBondContact O-N 2.8Å; L152-G154 VanDerWaalsContact C-N 3.31Å; L152-G154 PolarHBondContact O-N 2.89Å; L152-V155 PolarHBondContact O-N 3.1Å; L152-I156 HydrophobicContact CD2-CD1 3.64Å; L152-I156 WeakPolarHBondContact O-CB 3.15Å; L152-I156 WeakPolarHBondContact O-CD1 3.05Å; L152-I156 WeakPolarHBondContact O-CG1 3.14Å; L152-I156 PolarHBondContact O-N 2.74Å
153	F	68.5	Low	65.6	Low	148 Å²	148	103 Å²	103	65%	0.649	54%	0.536	S	S	*	.	H	α-helix	trans	-63.8	-34.8	169.8	-71.9	-60.5	0	0	0	112.6	S149 G157	S149-F153 VanDerWaalsContact C-CD2 3.49Å; S149-F153 WeakPolarHBondContact O-CB 3.36Å; S149-F153 WeakPolarHBondContact O-CD2 3.09Å; S149-F153 WeakPolarHBondContact O-CG 3.17Å; S149-F153 PolarHBondContact O-N 3.16Å; F153-G157 PolarHBondContact O-N 2.83Å
154	G	72.9	Confident	68.1	Low	41 Å²	41	103.4 Å²	103.4	42%	0.423	53%	0.527	S	S	.	.	H	α-helix	trans	-67	-44.6	176.3	0	0	0	0	0	112.7	W150 T151 L152 G157 F158	W150-G154 WeakPolarHBondContact O-CA 3.4Å; W150-G154 PolarHBondContact O-N 2.88Å; T151-G154 PolarHBondContact O-N 2.95Å; L152-G154 VanDerWaalsContact C-N 3.31Å; L152-G154 PolarHBondContact O-N 2.89Å; G154-G157 PolarHBondContact O-N 3.28Å; G154-F158 WeakPolarHBondContact O-CB 3.29Å; G154-F158 PolarHBondContact O-N 3.06Å
155	V	80.4	Confident	70.7	Confident	89 Å²	89	101.9 Å²	101.9	54%	0.539	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-43.6	176	172.2	0	0	0	0	110.8	T151 L152 G157 F158 I159	T151-V155 WeakPolarHBondContact O-CB 3.48Å; T151-V155 VanDerWaalsContact O-CG2 3.22Å; T151-V155 WeakPolarHBondContact O-CG2 3.21Å; T151-V155 PolarHBondContact O-N 3.46Å; L152-V155 PolarHBondContact O-N 3.1Å; V155-G157 VanDerWaalsContact C-N 3.35Å; V155-G157 PolarHBondContact O-N 3.48Å; V155-F158 PolarHBondContact O-N 2.84Å; V155-I159 HydrophobicContact CG1-CD1 3.9Å; V155-I159 VanDerWaalsContact O-CG1 3.26Å; V155-I159 WeakPolarHBondContact O-CG1 3.46Å; V155-I159 PolarHBondContact O-N 2.89Å
156	I	82.2	Confident	73	Confident	80 Å²	80	101 Å²	101	41%	0.41	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-44.9	175.1	-67.6	167.6	0	0	0	110.4	L152 F158 I159 I160	L152-I156 HydrophobicContact CD2-CD1 3.64Å; L152-I156 WeakPolarHBondContact O-CB 3.15Å; L152-I156 WeakPolarHBondContact O-CD1 3.05Å; L152-I156 WeakPolarHBondContact O-CG1 3.14Å; L152-I156 PolarHBondContact O-N 2.74Å; I156-F158 PolarHBondContact O-N 3.42Å; I156-I159 PolarHBondContact O-N 3.28Å; I156-I160 HydrophobicContact CG2-CD1 3.73Å; I156-I160 HydrophobicContact CG2-CG1 4.45Å; I156-I160 VanDerWaalsContact O-CG1 3.26Å; I156-I160 WeakPolarHBondContact O-CG1 3.26Å; I156-I160 PolarHBondContact O-N 3.1Å
157	G	81.6	Confident	75.5	Confident	24 Å²	24	98.6 Å²	98.6	25%	0.247	50%	0.502	C	S	.	.	H	α-helix	trans	-60.6	-43.1	176.2	0	0	0	0	0	112.5	F153 G154 V155 I160 I161	F153-G157 PolarHBondContact O-N 2.83Å; G154-G157 PolarHBondContact O-N 3.28Å; V155-G157 VanDerWaalsContact C-N 3.35Å; V155-G157 PolarHBondContact O-N 3.48Å; G157-I160 PolarHBondContact O-N 3.02Å; G157-I161 WeakPolarHBondContact O-CB 3.47Å; G157-I161 VanDerWaalsContact O-CG1 3.23Å; G157-I161 WeakPolarHBondContact O-CG1 3.49Å; G157-I161 PolarHBondContact O-N 2.88Å
158	F	83.9	Confident	77.5	Confident	146 Å²	146	95.6 Å²	95.6	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-63.7	-41.4	177.1	-176.7	-96.7	0	0	0	112.4	G154 V155 I156 S162	G154-F158 WeakPolarHBondContact O-CB 3.29Å; G154-F158 PolarHBondContact O-N 3.06Å; V155-F158 PolarHBondContact O-N 2.84Å; I156-F158 PolarHBondContact O-N 3.42Å; F158-S162 VanDerWaalsContact O-CB 3.25Å; F158-S162 WeakPolarHBondContact O-CB 3.2Å; F158-S162 PolarHBondContact O-N 2.88Å; F158-S162 PolarHBondContact O-OG 3.07Å
159	I	87.1	Confident	79.3	Confident	104 Å²	104	97.8 Å²	97.8	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-45.1	175.8	-67.8	165.6	0	0	0	110.4	V155 I156 S162 F163	V155-I159 HydrophobicContact CG1-CD1 3.9Å; V155-I159 VanDerWaalsContact O-CG1 3.26Å; V155-I159 WeakPolarHBondContact O-CG1 3.46Å; V155-I159 PolarHBondContact O-N 2.89Å; I156-I159 PolarHBondContact O-N 3.28Å; I159-S162 PolarHBondContact O-N 3.09Å; I159-F163 WeakPolarHBondContact O-CB 3.1Å; I159-F163 PolarHBondContact O-N 2.97Å
160	I	87.9	Confident	80.8	Confident	86 Å²	86	97.5 Å²	97.5	44%	0.441	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-49.5	178.8	-68.1	167.4	0	0	0	110.5	I156 G157 S162 F163 F164	I156-I160 HydrophobicContact CG2-CD1 3.73Å; I156-I160 HydrophobicContact CG2-CG1 4.45Å; I156-I160 VanDerWaalsContact O-CG1 3.26Å; I156-I160 WeakPolarHBondContact O-CG1 3.26Å; I156-I160 PolarHBondContact O-N 3.1Å; G157-I160 PolarHBondContact O-N 3.02Å; I160-S162 VanDerWaalsContact C-N 3.32Å; I160-S162 PolarHBondContact O-N 2.97Å; I160-F163 PolarHBondContact O-N 2.83Å; I160-F164 HydrophobicContact CG2-CD2 3.7Å; I160-F164 HydrophobicContact CG2-CE2 3.68Å; I160-F164 VanDerWaalsContact O-CD2 3.28Å; I160-F164 WeakPolarHBondContact O-CD2 3.08Å; I160-F164 PolarHBondContact O-N 2.83Å
161	I	87	Confident	82.1	Confident	105 Å²	105	91.9 Å²	91.9	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-61	-43.4	179.3	-68.5	166.1	0	0	0	110.5	G157 F163 F164 L165	G157-I161 WeakPolarHBondContact O-CB 3.47Å; G157-I161 VanDerWaalsContact O-CG1 3.23Å; G157-I161 WeakPolarHBondContact O-CG1 3.49Å; G157-I161 PolarHBondContact O-N 2.88Å; I161-F163 VanDerWaalsContact C-N 3.33Å; I161-F163 PolarHBondContact O-N 3.34Å; I161-F164 PolarHBondContact O-N 2.95Å; I161-L165 HydrophobicContact CG2-CD1 4.03Å; I161-L165 HydrophobicContact CG2-CG 4.37Å; I161-L165 WeakPolarHBondContact O-CG 2.98Å; I161-L165 PolarHBondContact O-N 3.43Å
162	S	86.2	Confident	82.8	Confident	36 Å²	36	91.6 Å²	91.6	25%	0.252	49%	0.488	S	S	.	.	H	α-helix	trans	-61.4	-41.9	177.7	-62	0	0	0	0	111.7	F158 I159 I160 L165 I166	F158-S162 VanDerWaalsContact O-CB 3.25Å; F158-S162 WeakPolarHBondContact O-CB 3.2Å; F158-S162 PolarHBondContact O-N 2.88Å; F158-S162 PolarHBondContact O-OG 3.07Å; I159-S162 PolarHBondContact O-N 3.09Å; I160-S162 VanDerWaalsContact C-N 3.32Å; I160-S162 PolarHBondContact O-N 2.97Å; S162-L165 PolarHBondContact O-N 3.36Å; S162-I166 VanDerWaalsContact O-CG1 3.28Å; S162-I166 WeakPolarHBondContact O-CG1 3.19Å; S162-I166 PolarHBondContact O-N 3.41Å
163	F	89.9	Confident	83.5	Confident	137 Å²	137	90.5 Å²	90.5	60%	0.601	49%	0.488	S	S	*	.	H	α-helix	trans	-63.4	-43.2	175.4	-171.4	-94.7	0	0	0	112.1	I159 I160 I161 L165 I166 L167	I159-F163 WeakPolarHBondContact O-CB 3.1Å; I159-F163 PolarHBondContact O-N 2.97Å; I160-F163 PolarHBondContact O-N 2.83Å; I161-F163 VanDerWaalsContact C-N 3.33Å; I161-F163 PolarHBondContact O-N 3.34Å; F163-L165 PolarHBondContact O-N 3.45Å; F163-I166 PolarHBondContact O-N 2.96Å; F163-L167 WeakPolarHBondContact O-CB 3.15Å; F163-L167 PolarHBondContact O-N 2.79Å
164	F	87.4	Confident	83.9	Confident	123 Å²	123	88.1 Å²	88.1	54%	0.539	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-40.3	175.4	-88.2	-75.4	0	0	0	112.5	I160 I161 L167 L168	I160-F164 HydrophobicContact CG2-CD2 3.7Å; I160-F164 HydrophobicContact CG2-CE2 3.68Å; I160-F164 VanDerWaalsContact O-CD2 3.28Å; I160-F164 WeakPolarHBondContact O-CD2 3.08Å; I160-F164 PolarHBondContact O-N 2.83Å; I161-F164 PolarHBondContact O-N 2.95Å; F164-L167 PolarHBondContact O-N 2.77Å; F164-L168 WeakPolarHBondContact O-CB 3.4Å; F164-L168 WeakPolarHBondContact O-CG 3.36Å; F164-L168 PolarHBondContact O-N 2.01Å
165	L	87.8	Confident	83.7	Confident	101 Å²	101	95 Å²	95	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-65.1	-43.9	176.4	-71.2	173.4	0	0	0	111.7	I161 S162 F163 L167 L168 V169	I161-L165 HydrophobicContact CG2-CD1 4.03Å; I161-L165 HydrophobicContact CG2-CG 4.37Å; I161-L165 WeakPolarHBondContact O-CG 2.98Å; I161-L165 PolarHBondContact O-N 3.43Å; S162-L165 PolarHBondContact O-N 3.36Å; F163-L165 PolarHBondContact O-N 3.45Å; L165-L167 VanDerWaalsContact C-N 3.31Å; L165-L167 PolarHBondContact O-N 3.08Å; L165-L168 PolarHBondContact O-N 3.16Å; L165-V169 WeakPolarHBondContact O-CG2 3.34Å; L165-V169 PolarHBondContact O-N 3.38Å
166	I	87.8	Confident	83	Confident	107 Å²	107	96.1 Å²	96.1	55%	0.549	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-43.3	174.7	-67.3	165.4	0	0	0	110.3	S162 F163 L168 V169 V170	S162-I166 VanDerWaalsContact O-CG1 3.28Å; S162-I166 WeakPolarHBondContact O-CG1 3.19Å; S162-I166 PolarHBondContact O-N 3.41Å; F163-I166 PolarHBondContact O-N 2.96Å; I166-L168 VanDerWaalsContact C-N 3.35Å; I166-L168 PolarHBondContact O-N 2.89Å; I166-V169 PolarHBondContact O-N 2.04Å; I166-V170 HydrophobicContact CG2-CG2 4.42Å; I166-V170 WeakPolarHBondContact O-CG2 3.12Å; I166-V170 PolarHBondContact O-N 3.37Å
167	L	88.6	Confident	82	Confident	75 Å²	75	102 Å²	102	39%	0.393	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-42.3	177.2	-164.6	79.5	0	0	0	111.7	F163 F164 L165 V170 L171	F163-L167 WeakPolarHBondContact O-CB 3.15Å; F163-L167 PolarHBondContact O-N 2.79Å; F164-L167 PolarHBondContact O-N 2.77Å; L165-L167 VanDerWaalsContact C-N 3.31Å; L165-L167 PolarHBondContact O-N 3.08Å; L167-V170 PolarHBondContact O-N 2.98Å; L167-L171 HydrophobicContact CD2-CD1 4.43Å; L167-L171 HydrophobicContact CG-CD1 4.21Å; L167-L171 WeakPolarHBondContact O-CB 3.21Å; L167-L171 VanDerWaalsContact O-CG 3.29Å; L167-L171 WeakPolarHBondContact O-CG 3.34Å; L167-L171 PolarHBondContact O-N 3.44Å
168	L	86.1	Confident	80.9	Confident	101 Å²	101	108.3 Å²	108.3	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-63.9	-39.1	175.9	-75	173.5	0	0	0	112.2	F164 L165 I166 S172	F164-L168 WeakPolarHBondContact O-CB 3.4Å; F164-L168 WeakPolarHBondContact O-CG 3.36Å; F164-L168 PolarHBondContact O-N 2.01Å; L165-L168 PolarHBondContact O-N 3.16Å; I166-L168 VanDerWaalsContact C-N 3.35Å; I166-L168 PolarHBondContact O-N 2.89Å; L168-S172 VanDerWaalsContact O-CB 3.26Å; L168-S172 WeakPolarHBondContact O-CB 3.42Å; L168-S172 PolarHBondContact O-N 2.88Å; L168-S172 PolarHBondContact O-OG 3.24Å
169	V	86.3	Confident	79.6	Confident	92 Å²	92	105.9 Å²	105.9	56%	0.558	53%	0.528	S	S	*	.	H	α-helix	trans	-65	-45.5	174.3	171.5	0	0	0	0	110.5	L165 I166 L171 S172 C173	L165-V169 WeakPolarHBondContact O-CG2 3.34Å; L165-V169 PolarHBondContact O-N 3.38Å; I166-V169 PolarHBondContact O-N 2.04Å; V169-L171 PolarHBondContact O-N 3.48Å; V169-S172 PolarHBondContact O-N 3.02Å; V169-C173 WeakPolarHBondContact O-CB 3.06Å; V169-C173 PolarHBondContact O-N 2.8Å; V169-C173 PolarHBondContact O-SG 2.73Å; V169-C173 VanDerWaalsContact O-SG 3.36Å
170	V	85.6	Confident	77.9	Confident	73 Å²	73	104.5 Å²	104.5	44%	0.442	52%	0.524	S	S	.	.	H	α-helix	trans	-63	-44.5	177.6	172	0	0	0	0	111.3	I166 L167 S172 C173 I174	I166-V170 HydrophobicContact CG2-CG2 4.42Å; I166-V170 WeakPolarHBondContact O-CG2 3.12Å; I166-V170 PolarHBondContact O-N 3.37Å; L167-V170 PolarHBondContact O-N 2.98Å; V170-S172 VanDerWaalsContact C-N 3.32Å; V170-S172 PolarHBondContact O-N 2.91Å; V170-C173 PolarHBondContact O-N 3.22Å; V170-I174 HydrophobicContact CG1-CD1 3.87Å; V170-I174 HydrophobicContact CG1-CG1 4.47Å; V170-I174 VanDerWaalsContact O-CG1 3.3Å; V170-I174 WeakPolarHBondContact O-CG1 3.13Å; V170-I174 PolarHBondContact O-N 3.31Å
171	L	81.6	Confident	76	Confident	97 Å²	97	102.9 Å²	102.9	51%	0.508	53%	0.528	S	S	.	.	H	α-helix	trans	-63.7	-38	175.6	-74.1	170.3	0	0	0	111.9	L167 V169 I174 R175	L167-L171 HydrophobicContact CD2-CD1 4.43Å; L167-L171 HydrophobicContact CG-CD1 4.21Å; L167-L171 WeakPolarHBondContact O-CB 3.21Å; L167-L171 VanDerWaalsContact O-CG 3.29Å; L167-L171 WeakPolarHBondContact O-CG 3.34Å; L167-L171 PolarHBondContact O-N 3.44Å; V169-L171 PolarHBondContact O-N 3.48Å; L171-I174 PolarHBondContact O-N 2.73Å; L171-R175 VanDerWaalsContact O-CB 3.26Å; L171-R175 WeakPolarHBondContact O-CB 3.17Å; L171-R175 PolarHBondContact O-N 3.16Å
172	S	77.8	Confident	74.1	Confident	62 Å²	62	104 Å²	104	43%	0.434	53%	0.534	S	S	.	.	H	α-helix	trans	-66	-42.4	174.3	-61.1	0	0	0	0	111.2	L168 V169 V170 R175 I176	L168-S172 VanDerWaalsContact O-CB 3.26Å; L168-S172 WeakPolarHBondContact O-CB 3.42Å; L168-S172 PolarHBondContact O-N 2.88Å; L168-S172 PolarHBondContact O-OG 3.24Å; V169-S172 PolarHBondContact O-N 3.02Å; V170-S172 VanDerWaalsContact C-N 3.32Å; V170-S172 PolarHBondContact O-N 2.91Å; S172-R175 PolarHBondContact O-N 3.46Å; S172-I176 WeakPolarHBondContact O-CB 3.49Å; S172-I176 WeakPolarHBondContact O-CG1 3.28Å; S172-I176 PolarHBondContact O-N 2.94Å
173	C	77.9	Confident	72.1	Confident	74 Å²	74	109.5 Å²	109.5	50%	0.5	56%	0.556	S	S	.	*	H	α-helix	trans	-63	-41.6	174	-75.6	0	0	0	0	112.1	V169 V170 R177	V169-C173 WeakPolarHBondContact O-CB 3.06Å; V169-C173 PolarHBondContact O-N 2.8Å; V169-C173 PolarHBondContact O-SG 2.73Å; V169-C173 VanDerWaalsContact O-SG 3.36Å; V170-C173 PolarHBondContact O-N 3.22Å; C173-R177 WeakPolarHBondContact O-CB 3.2Å; C173-R177 PolarHBondContact O-N 3.42Å
174	I	75.3	Confident	69.7	Low	98 Å²	98	111.9 Å²	111.9	50%	0.503	57%	0.565	S	S	.	*	H	α-helix	trans	-65.4	-42.6	175	-68.2	166.8	0	0	0	110.5	V170 L171 R177 K178	V170-I174 HydrophobicContact CG1-CD1 3.87Å; V170-I174 HydrophobicContact CG1-CG1 4.47Å; V170-I174 VanDerWaalsContact O-CG1 3.3Å; V170-I174 WeakPolarHBondContact O-CG1 3.13Å; V170-I174 PolarHBondContact O-N 3.31Å; L171-I174 PolarHBondContact O-N 2.73Å; I174-R177 PolarHBondContact O-N 3.24Å; I174-K178 WeakPolarHBondContact O-CB 3.18Å; I174-K178 PolarHBondContact O-N 3.28Å
175	R	68.7	Low	67.3	Low	186 Å²	186	113.3 Å²	113.3	70%	0.702	58%	0.579	S	S	*	*	H	α-helix	trans	-65.7	-42.4	177.7	-169.4	174.6	-174.7	159.3	0.4	111.8	L171 S172 K178 N179	L171-R175 VanDerWaalsContact O-CB 3.26Å; L171-R175 WeakPolarHBondContact O-CB 3.17Å; L171-R175 PolarHBondContact O-N 3.16Å; S172-R175 PolarHBondContact O-N 3.46Å; R175-K178 PolarHBondContact O-N 3.44Å; R175-N179 WeakPolarHBondContact O-CB 3.07Å; R175-N179 PolarHBondContact O-N 3.04Å
176	I	65.9	Low	65.2	Low	112 Å²	112	119 Å²	119	57%	0.574	59%	0.593	S	S	*	*	H	α-helix	trans	-61	-49.2	172.7	-70.8	165	0	0	0	109.2	S172 K178 N179 T180	S172-I176 WeakPolarHBondContact O-CB 3.49Å; S172-I176 WeakPolarHBondContact O-CG1 3.28Å; S172-I176 PolarHBondContact O-N 2.94Å; I176-K178 VanDerWaalsContact C-N 3.3Å; I176-K178 PolarHBondContact O-N 3.09Å; I176-N179 CarbonylContact O-C 3.56Å; I176-N179 WeakPolarHBondContact O-CA 3.49Å; I176-N179 PolarHBondContact O-N 3.09Å; I176-T180 PolarHBondContact O-N 3.21Å; I176-T180 PolarHBondContact O-OG1 2.81Å
177	R	61.5	Low	62.9	Low	204 Å²	204	123 Å²	123	77%	0.77	61%	0.61	S	S	*	*	H	α-helix	trans	-61.9	-35.4	179.4	-161.4	175.6	-172.1	177.5	2.1	112.5	C173 I174 T180 G181	C173-R177 WeakPolarHBondContact O-CB 3.2Å; C173-R177 PolarHBondContact O-N 3.42Å; I174-R177 PolarHBondContact O-N 3.24Å; R177-T180 WeakPolarHBondContact CA-OG1 3.12Å; R177-G181 PolarHBondContact O-N 3.05Å
178	K	58.9	Low	60.4	Low	156 Å²	156	127.6 Å²	127.6	68%	0.678	64%	0.635	S	S	*	*	H	α-helix	trans	-68.5	-39.7	173.1	-163.5	173.3	-179.4	177.4	0	111.4	I174 R175 I176 I182	I174-K178 WeakPolarHBondContact O-CB 3.18Å; I174-K178 PolarHBondContact O-N 3.28Å; R175-K178 PolarHBondContact O-N 3.44Å; I176-K178 VanDerWaalsContact C-N 3.3Å; I176-K178 PolarHBondContact O-N 3.09Å; K178-I182 WeakPolarHBondContact O-CG1 3.24Å; K178-I182 PolarHBondContact O-N 2.98Å
179	N	56.3	Low	58	Low	95 Å²	95	128.8 Å²	128.8	51%	0.508	65%	0.646	S	S	.	*	H	α-helix	trans	-73.6	-32.4	175.1	-73.6	-0.4	0	0	0	113.1	R175 I176 I182 H183	R175-N179 WeakPolarHBondContact O-CB 3.07Å; R175-N179 PolarHBondContact O-N 3.04Å; I176-N179 CarbonylContact O-C 3.56Å; I176-N179 WeakPolarHBondContact O-CA 3.49Å; I176-N179 PolarHBondContact O-N 3.09Å; N179-I182 PolarHBondContact O-N 3.09Å; N179-H183 PolarHBondContact O-N 3.39Å
180	T	52.7	Low	56.1	Low	75 Å²	75	129.4 Å²	129.4	46%	0.46	65%	0.652	S	S	.	*	H	α-helix	trans	-77.1	-28.6	173.5	12.5	0	0	0	0	112	I176 R177 I182 H183 K184	I176-T180 PolarHBondContact O-N 3.21Å; I176-T180 PolarHBondContact O-OG1 2.81Å; R177-T180 WeakPolarHBondContact CA-OG1 3.12Å; T180-I182 PolarHBondContact O-N 3.2Å; T180-H183 PolarHBondContact O-N 2.77Å; T180-K184 WeakPolarHBondContact O-CB 3.15Å; T180-K184 PolarHBondContact O-N 3.3Å
181	G	47.3	Very low	53.5	Low	51 Å²	51	132.8 Å²	132.8	53%	0.526	67%	0.667	S	S	.	*	H	α-helix	trans	-65.5	-26.8	171	0	0	0	0	0	113.3	R177	R177-G181 PolarHBondContact O-N 3.05Å
182	I	45.9	Very low	51.2	Low	128 Å²	128	136.8 Å²	136.8	66%	0.656	69%	0.688	S	S	*	*	H	α-helix	trans	-78.3	-32.2	172.7	-63.4	169.6	0	0	0	111	K178 N179 T180	K178-I182 WeakPolarHBondContact O-CG1 3.24Å; K178-I182 PolarHBondContact O-N 2.98Å; N179-I182 PolarHBondContact O-N 3.09Å; T180-I182 PolarHBondContact O-N 3.2Å
183	H	44.3	Very low	49.2	Very low	153 Å²	153	140.9 Å²	140.9	71%	0.708	70%	0.704	S	S	*	*	H	α-helix	trans	-83.9	-23.2	178.2	-94.4	-76.5	0	0	0	114.9	N179 T180 N185 R186	N179-H183 PolarHBondContact O-N 3.39Å; T180-H183 PolarHBondContact O-N 2.77Å; H183-N185 PolarHBondContact O-N 3.21Å; H183-R186 PolarHBondContact O-N 3.08Å
184	K	40.4	Very low	47.5	Very low	186 Å²	186	142.9 Å²	142.9	81%	0.809	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-0	-176.9	-116.1	-177	179	-177.1	0	115.8	T180 R186	T180-K184 WeakPolarHBondContact O-CB 3.15Å; T180-K184 PolarHBondContact O-N 3.3Å; K184-R186 VanDerWaalsContact C-N 3.33Å
185	N	37.8	Very low	45.5	Very low	154 Å²	154	144.5 Å²	144.5	82%	0.824	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	2.7	175.4	-121.3	-6.6	0	0	0	113.7	H183	H183-N185 PolarHBondContact O-N 3.21Å
186	R	42.9	Very low	43.8	Very low	220 Å²	220	144.4 Å²	144.4	83%	0.83	73%	0.73	S	S	*	*	S	Bend	trans	-135.2	90.8	170.2	-80.3	-175.5	175.2	176.4	-1.7	108.7	H183 K184	H183-R186 PolarHBondContact O-N 3.08Å; K184-R186 VanDerWaalsContact C-N 3.33Å
187	E	39.3	Very low	42.1	Very low	191 Å²	191	146.5 Å²	146.5	89%	0.893	74%	0.742	S	S	*	*				175	131.9	125.5	-95.2	166.4	-179	0	0	110.7
188	N	36.1	Very low	40.6	Very low	171 Å²	171	141.2 Å²	141.2	91%	0.914	74%	0.736	S	S	*	*			trans	-74.4	143.7	-177.7	-72.1	-41.2	0	0	0	111.8
189	V	36.3	Very low	39.3	Very low	126 Å²	126	142 Å²	142	76%	0.764	75%	0.747	S	S	*	*			trans	-49.6	160.5	162.6	176.5	0	0	0	0	111.1
190	P	46.5	Very low	38	Very low	106 Å²	106	142.8 Å²	142.8	69%	0.688	76%	0.76	S	S	*	*			cis	-145.6	164.8	35.2	14.2	15.7	0	0	0	122.2
191	N	30.2	Very low	37.3	Very low	143 Å²	143	147.7 Å²	147.7	77%	0.765	78%	0.777	S	S	*	*			trans	62.2	122.2	136.3	-64.6	-17.4	0	0	0	123.4
192	L	33.5	Very low	37.1	Very low	181 Å²	181	150.2 Å²	150.2	95%	0.948	78%	0.784	S	S	*	*				-156.5	144.5	127.8	-100.9	132.5	0	0	0	111.4
193	I	35.5	Very low	36.4	Very low	148 Å²	148	151.6 Å²	151.6	76%	0.759	79%	0.793	S	S	*	*			trans	-83	153.2	-160.7	-65.9	154.5	0	0	0	112.7
194	P	42.7	Very low	36.1	Very low	116 Å²	116	150.9 Å²	150.9	75%	0.753	79%	0.793	S	S	*	*			trans	-97.8	140.3	170.6	35.8	-27	0	0	0	111.9
195	D	33.1	Very low	36	Very low	133 Å²	133	147.6 Å²	147.6	71%	0.711	79%	0.791	S	S	*	*			trans	-138.9	120.5	169.7	-112	-28.1	0	0	0	113.2
196	K	32.7	Very low	35.9	Very low	184 Å²	184	148.9 Å²	148.9	80%	0.8	79%	0.79	S	S	*	*			trans	40.9	126.5	142.2	-68.3	171	-177.6	170.1	0	120.8
197	L	30.3	Very low	35.6	Very low	156 Å²	156	146.3 Å²	146.3	82%	0.817	79%	0.79	S	S	*	*				96.6	122.6	54.3	-157.5	84.6	0	0	0	113.1
198	S	30	Very low	35.5	Very low	93 Å²	93	143.5 Å²	143.5	65%	0.65	78%	0.781	S	S	*	*			trans	71.7	122.9	150.8	61.3	0	0	0	0	122.5
199	L	31.6	Very low	35.5	Very low	171 Å²	171	145 Å²	145	90%	0.895	78%	0.783	S	S	*	*				-165.7	101.3	116	-122.7	90.3	0	0	0	108.8
200	S	29.5	Very low	35.5	Very low	113 Å²	113	146.1 Å²	146.1	79%	0.79	79%	0.785	S	S	*	*				80	107.2	101.1	-163.8	0	0	0	0	116.6
201	H	37	Very low	35	Very low	177 Å²	177	146 Å²	146	82%	0.819	79%	0.786	S	S	*	*			trans	-56	179.6	154.9	-70.7	-55.4	0	0	0	112.3
202	P	42.5	Very low	35.2	Very low	104 Å²	104	145.6 Å²	145.6	68%	0.675	78%	0.783	S	S	*	*			cis	-143.9	163.6	15.3	39.7	-18.9	0	0	0	117.3
203	N	31.6	Very low	35.4	Very low	158 Å²	158	144 Å²	144	85%	0.845	77%	0.774	S	S	*	*			trans	172.2	104.7	132.2	-89.4	-13.8	0	0	0	110.4
204	I	38.8	Very low	35.2	Very low	137 Å²	137	145.4 Å²	145.4	70%	0.703	78%	0.775	S	S	*	*			trans	-88.4	147.8	166.8	-62.6	162	0	0	0	106.9	F206	I204-F206 HydrophobicContact CG2-CD2 3.62Å; I204-F206 HydrophobicContact CG2-CE2 3.96Å; I204-F206 HydrophobicContact CG2-CG 4.42Å
205	P	38.4	Very low	34.7	Very low	118 Å²	118	147.5 Å²	147.5	77%	0.766	78%	0.78	S	S	*	*				-127.7	139.1	117.3	27.7	-14.2	0	0	0	111.5
206	F	35.2	Very low	35.1	Very low	181 Å²	181	152.6 Å²	152.6	79%	0.794	80%	0.804	S	S	*	*			trans	-50.4	137	172	-75.3	-110.1	0	0	0	110.4	I204	I204-F206 HydrophobicContact CG2-CD2 3.62Å; I204-F206 HydrophobicContact CG2-CE2 3.96Å; I204-F206 HydrophobicContact CG2-CG 4.42Å
207	I	36.8	Very low	35.2	Very low	165 Å²	165	151.1 Å²	151.1	85%	0.846	81%	0.805	S	S	*	*			trans	-116.6	129.5	160.3	-64.3	179.6	0	0	0	106.9
208	D	36.2	Very low	35.4	Very low	132 Å²	132	150.8 Å²	150.8	71%	0.706	80%	0.804	S	S	*	*			trans	-63.4	154.2	-161.7	-65.7	-60.4	0	0	0	115.8	D210	D208-D210 PolarHBondContact O-N 3.17Å
209	E	36.1	Very low	35.7	Very low	202 Å²	202	154 Å²	154	94%	0.944	81%	0.813	S	S	*	*	S	Bend	trans	-68.4	18.9	173.3	-69.5	-177.1	143.1	0	0	114.5
210	D	37.6	Very low	36	Very low	151 Å²	151	153 Å²	153	81%	0.807	81%	0.808	S	S	*	*			trans	-123.5	56.4	-176	-79.9	-32.8	0	0	0	113.1	D208	D208-D210 PolarHBondContact O-N 3.17Å
211	S	35.9	Very low	36.4	Very low	103 Å²	103	155.5 Å²	155.5	72%	0.72	81%	0.809	S	S	*	*			trans	-110.3	92.7	165.7	54.1	0	0	0	0	111.4	I213	S211-I213 PolarHBondContact O-N 3.42Å
212	I	34.2	Very low	36.3	Very low	134 Å²	134	154.1 Å²	154.1	69%	0.687	81%	0.808	S	S	*	*			trans	-70.4	109.3	166.1	-63.1	168.8	0	0	0	107.4	F214	I212-F214 HydrophobicContact CB-CE2 4.34Å; I212-F214 HydrophobicContact CG2-CD2 4.04Å; I212-F214 HydrophobicContact CG2-CE1 4.47Å; I212-F214 HydrophobicContact CG2-CE2 3.65Å; I212-F214 HydrophobicContact CG2-CZ 3.89Å
213	I	38.3	Very low	35.9	Very low	149 Å²	149	157.6 Å²	157.6	76%	0.764	82%	0.818	S	S	*	*			trans	-77.2	118.9	169.1	-60.5	171.4	0	0	0	107.3	S211	S211-I213 PolarHBondContact O-N 3.42Å
214	F	30.6	Very low	36.2	Very low	177 Å²	177	157.6 Å²	157.6	78%	0.776	82%	0.815	S	S	*	*			trans	-93.7	115.8	165.7	-70.2	-89	0	0	0	108.2	I212	I212-F214 HydrophobicContact CB-CE2 4.34Å; I212-F214 HydrophobicContact CG2-CD2 4.04Å; I212-F214 HydrophobicContact CG2-CE1 4.47Å; I212-F214 HydrophobicContact CG2-CE2 3.65Å; I212-F214 HydrophobicContact CG2-CZ 3.89Å
215	D	33.4	Very low	36	Very low	160 Å²	160	159.3 Å²	159.3	86%	0.856	83%	0.825	S	S	*	*			trans	-82.4	132.7	161.4	-99.5	-23.3	0	0	0	108.9
216	I	39.7	Very low	35.8	Very low	240 Å²	240	163.1 Å²	163.1	100%	1.231	83%	0.83	S	S	*	*			trans	-78.8	0	177.7	-66.5	169.9	0	0	0	110.2

Retrieved 216 of 216 residues in 328 ms (Link to these results)

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