A0A077Z051_TRITR Loading...

Sperm surface protein Sp17

AlphaFold DB , UniProt , Accession A0A077Z051, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 123 aa.

						>A0A077Z051_TRITR|A0A077Z051
MVALAREVLSNQPKDLYAFGALFFHTLMQVRDGKRLTTNALKAGVDPLLSKHAYEAFQSVLIREVSKFSLVTLLRRSYRMSLGMSTRAGTFIRRRWTTSECSARSYDKDLSATKIQAGIRYVF
					

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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	66.9	Low	82	Confident	168 Å²	168	78.6 Å²	78.6	83%	0.828	43%	0.43	S	S	*	.				0	-45.5	0	-67.6	-53.3	156.5	0	0	113.5	A3 L4 A5 F24	M1-A3 VanDerWaalsContact C-N 3.29Å; M1-A3 PolarHBondContact O-N 3.45Å; M1-L4 PolarHBondContact O-N 3.22Å; M1-L4 VanDerWaalsContact O-N 3.1Å; M1-L4 HydrophobicContact SD-CD2 4.39Å; M1-A5 PolarHBondContact O-N 3.23Å; M1-F24 HydrophobicContact CE-CE1 4.49Å; M1-F24 HydrophobicContact CE-CZ 3.78Å; M1-F24 HydrophobicContact SD-CZ 4.36Å
2	V	82.9	Confident	82.2	Confident	103 Å²	103	85.6 Å²	85.6	62%	0.624	46%	0.457	S	S	*	.	H	α-helix	trans	-53.4	-42.7	177.1	-179.7	0	0	0	0	113	A5 R6	V2-A5 PolarHBondContact O-N 2.81Å; V2-R6 WeakPolarHBondContact O-CG 3.47Å; V2-R6 PolarHBondContact O-N 3.47Å
3	A	80.8	Confident	82.3	Confident	24 Å²	24	81.2 Å²	81.2	20%	0.198	44%	0.436	C	S	.	.	H	α-helix	trans	-62.7	-42.4	177.4	0	0	0	0	0	113.1	M1 R6 E7 F23 L48	M1-A3 VanDerWaalsContact C-N 3.29Å; M1-A3 PolarHBondContact O-N 3.45Å; A3-R6 PolarHBondContact O-N 3.49Å; A3-E7 WeakPolarHBondContact O-CG 3.23Å; A3-E7 PolarHBondContact O-N 3.47Å; A3-F23 HydrophobicContact CB-CZ 3.94Å; A3-L48 HydrophobicContact CB-CD1 3.72Å
4	L	83.4	Confident	82.3	Confident	31 Å²	31	88.6 Å²	88.6	16%	0.162	46%	0.462	C	S	.	.	H	α-helix	trans	-62.7	-45.7	176	177.6	67.2	0	0	0	110.9	M1 R6 E7 V8 F19 F23 F24	M1-L4 PolarHBondContact O-N 3.22Å; M1-L4 VanDerWaalsContact O-N 3.1Å; M1-L4 HydrophobicContact SD-CD2 4.39Å; L4-R6 VanDerWaalsContact C-N 3.33Å; L4-R6 PolarHBondContact O-N 3.35Å; L4-E7 PolarHBondContact O-N 3.25Å; L4-V8 HydrophobicContact CD1-CG2 4.22Å; L4-V8 HydrophobicContact CG-CG2 4.33Å; L4-V8 WeakPolarHBondContact O-CB 3.37Å; L4-V8 VanDerWaalsContact O-CG2 3.3Å; L4-V8 WeakPolarHBondContact O-CG2 3.43Å; L4-V8 PolarHBondContact O-N 3.22Å; L4-F19 HydrophobicContact CD1-CD1 4.1Å; L4-F19 HydrophobicContact CD1-CE1 4.06Å; L4-F23 HydrophobicContact CB-CD1 4.27Å; L4-F23 HydrophobicContact CB-CE1 4.09Å; L4-F23 HydrophobicContact CB-CE2 4.45Å; L4-F23 HydrophobicContact CB-CZ 4.21Å; L4-F23 HydrophobicContact CD1-CB 3.69Å; L4-F23 HydrophobicContact CD1-CD1 3.77Å; L4-F23 HydrophobicContact CD1-CD2 3.85Å; L4-F23 HydrophobicContact CD1-CE1 4.42Å; L4-F23 HydrophobicContact CD1-CE2 4.48Å; L4-F23 HydrophobicContact CD1-CG 3.48Å; L4-F23 VanDerWaalsContact CD1-CG 3.48Å; L4-F24 HydrophobicContact CD2-CE2 4.03Å; L4-F24 HydrophobicContact CD2-CZ 4.1Å
5	A	84.6	Confident	82.6	Confident	53 Å²	53	88.3 Å²	88.3	44%	0.438	46%	0.462	S	S	.	.	H	α-helix	trans	-60.3	-42.6	178.7	0	0	0	0	0	111.9	M1 V2 V8 L9	M1-A5 PolarHBondContact O-N 3.23Å; V2-A5 PolarHBondContact O-N 2.81Å; A5-V8 PolarHBondContact O-N 2.88Å; A5-L9 VanDerWaalsContact O-CG 3.31Å; A5-L9 WeakPolarHBondContact O-CG 3.39Å; A5-L9 PolarHBondContact O-N 3.16Å
6	R	86.4	Confident	82.9	Confident	173 Å²	173	89.3 Å²	89.3	65%	0.653	47%	0.467	S	S	*	.	H	α-helix	trans	-59.5	-46.8	174.3	-74.2	177.9	176.1	-174.8	-1.3	112	V2 A3 L4 L9 S10	V2-R6 WeakPolarHBondContact O-CG 3.47Å; V2-R6 PolarHBondContact O-N 3.47Å; A3-R6 PolarHBondContact O-N 3.49Å; L4-R6 VanDerWaalsContact C-N 3.33Å; L4-R6 PolarHBondContact O-N 3.35Å; R6-L9 PolarHBondContact O-N 2.82Å; R6-S10 WeakPolarHBondContact O-CB 3.29Å; R6-S10 PolarHBondContact O-N 3.2Å
7	E	82	Confident	83.1	Confident	8 Å²	8	96.4 Å²	96.4	4%	0.037	49%	0.488	C	S	.	.	H	α-helix	trans	-69.4	-33.7	-180	-67.6	-57.8	154.5	0	0	112.5	A3 L4 S10 N11 F19 F23 Y54 Q58 L61	A3-E7 WeakPolarHBondContact O-CG 3.23Å; A3-E7 PolarHBondContact O-N 3.47Å; L4-E7 PolarHBondContact O-N 3.25Å; E7-S10 PolarHBondContact O-N 3.49Å; E7-N11 WeakPolarHBondContact O-CB 3.26Å; E7-N11 PolarHBondContact O-N 3.41Å; E7-N11 PolarHBondContact O-ND2 2.81Å; E7-N11 PolarHBondContact OE2-ND2 2.84Å; E7-F19 HydrophobicContact CB-CE1 4.05Å; E7-F19 HydrophobicContact CB-CZ 3.89Å; E7-F23 HydrophobicContact CB-CD2 4.19Å; E7-F23 HydrophobicContact CB-CE2 4.18Å; E7-F23 HydrophobicContact CG-CD2 4.15Å; E7-F23 HydrophobicContact CG-CE2 3.77Å; E7-Y54 PolarHBondContact OE1-OH 3.33Å; E7-Q58 PolarHBondContact OE1-NE2 3.5Å; E7-Q58 VanDerWaalsContact OE1-NE2 3.16Å; E7-L61 HydrophobicContact CB-CD2 4.12Å; E7-L61 HydrophobicContact CG-CD2 3.89Å
8	V	85.4	Confident	83.1	Confident	33 Å²	33	92.9 Å²	92.9	20%	0.2	48%	0.476	C	S	.	.	H	α-helix	trans	-64.5	-45.5	172.8	167.4	0	0	0	0	110.9	L4 A5 S10 Q12 P13 L16 F19	L4-V8 HydrophobicContact CD1-CG2 4.22Å; L4-V8 HydrophobicContact CG-CG2 4.33Å; L4-V8 WeakPolarHBondContact O-CB 3.37Å; L4-V8 VanDerWaalsContact O-CG2 3.3Å; L4-V8 WeakPolarHBondContact O-CG2 3.43Å; L4-V8 PolarHBondContact O-N 3.22Å; A5-V8 PolarHBondContact O-N 2.88Å; V8-S10 VanDerWaalsContact C-N 3.3Å; V8-S10 PolarHBondContact O-N 3.39Å; V8-Q12 WeakPolarHBondContact O-CA 2.87Å; V8-Q12 PolarHBondContact O-N 3.35Å; V8-P13 HydrophobicContact CG1-CG 4.33Å; V8-P13 HydrophobicContact CG2-CG 4.42Å; V8-P13 VanDerWaalsContact O-CD 3.29Å; V8-P13 WeakPolarHBondContact O-CD 3.44Å; V8-L16 HydrophobicContact CB-CD2 4.44Å; V8-L16 HydrophobicContact CG1-CD2 3.41Å; V8-L16 VanDerWaalsContact CG1-CD2 3.41Å; V8-L16 HydrophobicContact CG2-CD2 4.08Å; V8-F19 HydrophobicContact CB-CE1 4.44Å; V8-F19 HydrophobicContact CG2-CD1 3.58Å; V8-F19 HydrophobicContact CG2-CE1 3.58Å
9	L	85.9	Confident	83.3	Confident	134 Å²	134	88.5 Å²	88.5	70%	0.702	45%	0.453	S	S	*	.	H	α-helix	trans	-64.7	-35.9	177.8	-70.6	171.8	0	0	0	112.1	A5 R6	A5-L9 VanDerWaalsContact O-CG 3.31Å; A5-L9 WeakPolarHBondContact O-CG 3.39Å; A5-L9 PolarHBondContact O-N 3.16Å; R6-L9 PolarHBondContact O-N 2.82Å
10	S	84.2	Confident	83.5	Confident	92 Å²	92	84.6 Å²	84.6	64%	0.643	44%	0.436	S	S	*	.	H	α-helix	trans	-72.4	-46.7	178.8	-172.5	0	0	0	0	112.7	R6 E7 V8	R6-S10 WeakPolarHBondContact O-CB 3.29Å; R6-S10 PolarHBondContact O-N 3.2Å; E7-S10 PolarHBondContact O-N 3.49Å; V8-S10 VanDerWaalsContact C-N 3.3Å; V8-S10 PolarHBondContact O-N 3.39Å
11	N	79.6	Confident	83.7	Confident	46 Å²	46	83.7 Å²	83.7	25%	0.246	44%	0.441	C	S	.	.	H	α-helix	trans	-92	-14.1	-173	-66.2	-79.3	0	0	0	113.9	E7 F19	E7-N11 WeakPolarHBondContact O-CB 3.26Å; E7-N11 PolarHBondContact O-N 3.41Å; E7-N11 PolarHBondContact O-ND2 2.81Å; E7-N11 PolarHBondContact OE2-ND2 2.84Å; N11-F19 HydrophobicContact CB-CE2 3.85Å; N11-F19 HydrophobicContact CB-CZ 4.13Å
12	Q	84.2	Confident	84.6	Confident	162 Å²	162	76.2 Å²	76.2	76%	0.757	41%	0.405	S	S	*	.			trans	42.8	56.1	-177.7	-59.3	-175.7	3.1	0	0	113.2	V8	V8-Q12 WeakPolarHBondContact O-CA 2.87Å; V8-Q12 PolarHBondContact O-N 3.35Å
13	P	83.1	Confident	84.8	Confident	28 Å²	28	71.6 Å²	71.6	18%	0.182	38%	0.376	C	S	.	.			trans	-65.3	139.8	-177.3	30.2	-36.4	0	0	0	110.9	V8 D15 L16 F19	V8-P13 HydrophobicContact CG1-CG 4.33Å; V8-P13 HydrophobicContact CG2-CG 4.42Å; V8-P13 VanDerWaalsContact O-CD 3.29Å; V8-P13 WeakPolarHBondContact O-CD 3.44Å; P13-D15 VanDerWaalsContact C-N 3.28Å; P13-D15 PolarHBondContact O-N 3.44Å; P13-L16 HydrophobicContact CG-CD2 4.11Å; P13-F19 HydrophobicContact CB-CB 3.64Å; P13-F19 HydrophobicContact CB-CD2 3.61Å; P13-F19 HydrophobicContact CB-CE2 4.39Å; P13-F19 HydrophobicContact CB-CG 3.71Å; P13-F19 HydrophobicContact CG-CB 3.72Å; P13-F19 HydrophobicContact CG-CD1 3.94Å; P13-F19 HydrophobicContact CG-CD2 3.76Å; P13-F19 HydrophobicContact CG-CE1 4.49Å; P13-F19 HydrophobicContact CG-CE2 4.31Å; P13-F19 HydrophobicContact CG-CG 3.53Å
14	K	83.4	Confident	85.1	Confident	185 Å²	185	74.7 Å²	74.7	80%	0.804	39%	0.385	S	S	*	.	S	Bend	trans	-69.8	-27.1	176	-65.4	-178.3	-179	176.3	0	113
15	D	86	Confident	85.2	Confident	84 Å²	84	78.3 Å²	78.3	45%	0.449	40%	0.401	S	S	.	.			trans	-123.3	105	179.1	-177.4	-14.8	0	0	0	109	P13 Y17 A18 F19	P13-D15 VanDerWaalsContact C-N 3.28Å; P13-D15 PolarHBondContact O-N 3.44Å; D15-Y17 VanDerWaalsContact C-N 3.31Å; D15-Y17 WeakPolarHBondContact OD1-CB 3.49Å; D15-Y17 PolarHBondContact OD1-N 3.25Å; D15-A18 HydrophobicContact CB-CB 4.02Å; D15-A18 PolarHBondContact OD1-N 3.06Å; D15-A18 WeakPolarHBondContact OD2-CB 3.32Å; D15-F19 VanDerWaalsContact O-CB 3.27Å; D15-F19 WeakPolarHBondContact O-CB 3.29Å; D15-F19 PolarHBondContact O-N 3.49Å
16	L	86.8	Confident	85.1	Confident	105 Å²	105	75.9 Å²	75.9	55%	0.55	38%	0.381	S	S	.	.	H	α-helix	trans	-67.7	-31.4	-179.6	-68.4	172.2	0	0	0	112.4	V8 P13 G20	V8-L16 HydrophobicContact CB-CD2 4.44Å; V8-L16 HydrophobicContact CG1-CD2 3.41Å; V8-L16 VanDerWaalsContact CG1-CD2 3.41Å; V8-L16 HydrophobicContact CG2-CD2 4.08Å; P13-L16 HydrophobicContact CG-CD2 4.11Å; L16-G20 PolarHBondContact O-N 2.88Å
17	Y	86.5	Confident	84.9	Confident	209 Å²	209	69 Å²	69	82%	0.82	36%	0.357	S	S	*	.	H	α-helix	trans	-72.8	-48.4	-179.4	-69.7	-81.7	0	0	0	110.6	D15 F19 G20 A21	D15-Y17 VanDerWaalsContact C-N 3.31Å; D15-Y17 WeakPolarHBondContact OD1-CB 3.49Å; D15-Y17 PolarHBondContact OD1-N 3.25Å; Y17-F19 VanDerWaalsContact C-N 3.31Å; Y17-F19 PolarHBondContact O-N 2.74Å; Y17-G20 PolarHBondContact O-N 3.08Å; Y17-A21 PolarHBondContact O-N 2.85Å
18	A	83.9	Confident	84.8	Confident	34 Å²	34	72.6 Å²	72.6	28%	0.281	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-40.8	175.9	0	0	0	0	0	111.5	D15 A21 L22	D15-A18 HydrophobicContact CB-CB 4.02Å; D15-A18 PolarHBondContact OD1-N 3.06Å; D15-A18 WeakPolarHBondContact OD2-CB 3.32Å; A18-A21 PolarHBondContact O-N 2.75Å; A18-L22 WeakPolarHBondContact O-CB 3.5Å; A18-L22 PolarHBondContact O-N 3.14Å
19	F	86.2	Confident	84.3	Confident	9 Å²	9	74.4 Å²	74.4	4%	0.039	38%	0.381	C	S	.	.	H	α-helix	trans	-64.9	-43.7	175.7	-174.7	-93.6	0	0	0	112.4	L4 E7 V8 N11 P13 D15 Y17 A21 L22 F23 L61 V65	L4-F19 HydrophobicContact CD1-CD1 4.1Å; L4-F19 HydrophobicContact CD1-CE1 4.06Å; E7-F19 HydrophobicContact CB-CE1 4.05Å; E7-F19 HydrophobicContact CB-CZ 3.89Å; V8-F19 HydrophobicContact CB-CE1 4.44Å; V8-F19 HydrophobicContact CG2-CD1 3.58Å; V8-F19 HydrophobicContact CG2-CE1 3.58Å; N11-F19 HydrophobicContact CB-CE2 3.85Å; N11-F19 HydrophobicContact CB-CZ 4.13Å; P13-F19 HydrophobicContact CB-CB 3.64Å; P13-F19 HydrophobicContact CB-CD2 3.61Å; P13-F19 HydrophobicContact CB-CE2 4.39Å; P13-F19 HydrophobicContact CB-CG 3.71Å; P13-F19 HydrophobicContact CG-CB 3.72Å; P13-F19 HydrophobicContact CG-CD1 3.94Å; P13-F19 HydrophobicContact CG-CD2 3.76Å; P13-F19 HydrophobicContact CG-CE1 4.49Å; P13-F19 HydrophobicContact CG-CE2 4.31Å; P13-F19 HydrophobicContact CG-CG 3.53Å; D15-F19 VanDerWaalsContact O-CB 3.27Å; D15-F19 WeakPolarHBondContact O-CB 3.29Å; D15-F19 PolarHBondContact O-N 3.49Å; Y17-F19 VanDerWaalsContact C-N 3.31Å; Y17-F19 PolarHBondContact O-N 2.74Å; F19-A21 PolarHBondContact O-N 3.43Å; F19-L22 PolarHBondContact O-N 2.98Å; F19-F23 WeakPolarHBondContact O-CB 3.34Å; F19-F23 PolarHBondContact O-N 3.46Å; F19-L61 HydrophobicContact CZ-CD2 4.29Å; F19-V65 HydrophobicContact CD2-CG2 4Å; F19-V65 HydrophobicContact CE2-CG2 3.61Å
20	G	87.9	Confident	83.6	Confident	11 Å²	11	68.2 Å²	68.2	11%	0.113	35%	0.349	C	S	.	.	H	α-helix	trans	-59.6	-46.9	176.3	0	0	0	0	0	111.9	L16 Y17 L22 F23 F24	L16-G20 PolarHBondContact O-N 2.88Å; Y17-G20 PolarHBondContact O-N 3.08Å; G20-L22 VanDerWaalsContact C-N 3.33Å; G20-L22 PolarHBondContact O-N 3.23Å; G20-F23 PolarHBondContact O-N 3.44Å; G20-F24 WeakPolarHBondContact O-CD2 3.43Å; G20-F24 PolarHBondContact O-N 3.23Å
21	A	87.8	Confident	82.9	Confident	65 Å²	65	70.1 Å²	70.1	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-59.1	-44.5	175.5	0	0	0	0	0	111.7	Y17 A18 F19 H25	Y17-A21 PolarHBondContact O-N 2.85Å; A18-A21 PolarHBondContact O-N 2.75Å; F19-A21 PolarHBondContact O-N 3.43Å; A21-H25 WeakPolarHBondContact O-CB 3.25Å; A21-H25 PolarHBondContact O-N 3.44Å
22	L	85.6	Confident	82.3	Confident	12 Å²	12	72.1 Å²	72.1	6%	0.063	35%	0.352	C	S	.	.	H	α-helix	trans	-63.4	-43.4	177	-179.8	61.6	0	0	0	112.4	A18 F19 G20 H25 T26 L61 E64 V65 F68	A18-L22 WeakPolarHBondContact O-CB 3.5Å; A18-L22 PolarHBondContact O-N 3.14Å; F19-L22 PolarHBondContact O-N 2.98Å; G20-L22 VanDerWaalsContact C-N 3.33Å; G20-L22 PolarHBondContact O-N 3.23Å; L22-H25 PolarHBondContact O-N 3.29Å; L22-T26 VanDerWaalsContact O-CB 3.32Å; L22-T26 WeakPolarHBondContact O-CB 3.44Å; L22-T26 PolarHBondContact O-N 2.9Å; L22-T26 PolarHBondContact O-OG1 3.23Å; L22-L61 HydrophobicContact CD2-CD1 4.39Å; L22-L61 HydrophobicContact CG-CD1 4.23Å; L22-E64 HydrophobicContact CD1-CB 3.66Å; L22-E64 HydrophobicContact CD1-CG 4.1Å; L22-E64 HydrophobicContact CD2-CB 3.75Å; L22-E64 HydrophobicContact CG-CB 4.16Å; L22-V65 HydrophobicContact CD2-CG2 3.85Å; L22-F68 HydrophobicContact CB-CE2 4.49Å; L22-F68 HydrophobicContact CD1-CD2 4.41Å; L22-F68 HydrophobicContact CD1-CE2 3.74Å; L22-F68 HydrophobicContact CD2-CD2 3.6Å; L22-F68 HydrophobicContact CD2-CE2 3.76Å; L22-F68 HydrophobicContact CD2-CG 4.49Å; L22-F68 HydrophobicContact CG-CE2 4.19Å
23	F	87.7	Confident	81.1	Confident	5 Å²	5	65.2 Å²	65.2	2%	0.022	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-53.4	177.6	175.9	-82.1	0	0	0	110.5	A3 L4 E7 F19 G20 H25 T26 L27 F57 L61	A3-F23 HydrophobicContact CB-CZ 3.94Å; L4-F23 HydrophobicContact CB-CD1 4.27Å; L4-F23 HydrophobicContact CB-CE1 4.09Å; L4-F23 HydrophobicContact CB-CE2 4.45Å; L4-F23 HydrophobicContact CB-CZ 4.21Å; L4-F23 HydrophobicContact CD1-CB 3.69Å; L4-F23 HydrophobicContact CD1-CD1 3.77Å; L4-F23 HydrophobicContact CD1-CD2 3.85Å; L4-F23 HydrophobicContact CD1-CE1 4.42Å; L4-F23 HydrophobicContact CD1-CE2 4.48Å; L4-F23 HydrophobicContact CD1-CG 3.48Å; L4-F23 VanDerWaalsContact CD1-CG 3.48Å; E7-F23 HydrophobicContact CB-CD2 4.19Å; E7-F23 HydrophobicContact CB-CE2 4.18Å; E7-F23 HydrophobicContact CG-CD2 4.15Å; E7-F23 HydrophobicContact CG-CE2 3.77Å; F19-F23 WeakPolarHBondContact O-CB 3.34Å; F19-F23 PolarHBondContact O-N 3.46Å; G20-F23 PolarHBondContact O-N 3.44Å; F23-H25 PolarHBondContact O-N 2.96Å; F23-T26 PolarHBondContact O-N 3.45Å; F23-L27 HydrophobicContact CE1-CD1 3.83Å; F23-L27 HydrophobicContact CZ-CD1 4.11Å; F23-L27 WeakPolarHBondContact O-CB 3.33Å; F23-L27 PolarHBondContact O-N 2.9Å; F23-F57 HydrophobicContact CD2-CE1 4.18Å; F23-F57 HydrophobicContact CD2-CE2 4.49Å; F23-F57 AromaticContact CD2-CZ 3.49Å; F23-F57 HydrophobicContact CD2-CZ 3.49Å; F23-F57 VanDerWaalsContact CD2-CZ 3.49Å; F23-F57 AromaticContact CE2-CE1 3.74Å; F23-F57 HydrophobicContact CE2-CE1 3.74Å; F23-F57 HydrophobicContact CE2-CE2 4.47Å; F23-F57 AromaticContact CE2-CZ 3.37Å; F23-F57 HydrophobicContact CE2-CZ 3.37Å; F23-F57 HydrophobicContact CG-CZ 4.13Å; F23-F57 HydrophobicContact CZ-CE1 4.4Å; F23-F57 AromaticContact CZ-CZ 3.93Å; F23-F57 HydrophobicContact CZ-CZ 3.93Å; F23-L61 HydrophobicContact CB-CD1 4.43Å; F23-L61 HydrophobicContact CD2-CD2 4.19Å
24	F	86.8	Confident	79.8	Confident	89 Å²	89	72.5 Å²	72.5	39%	0.39	35%	0.354	S	S	.	.	H	α-helix	trans	-67.5	-38	-178.9	-71.3	-62.7	0	0	0	112.3	M1 L4 G20 T26 L27 M28	M1-F24 HydrophobicContact CE-CE1 4.49Å; M1-F24 HydrophobicContact CE-CZ 3.78Å; M1-F24 HydrophobicContact SD-CZ 4.36Å; L4-F24 HydrophobicContact CD2-CE2 4.03Å; L4-F24 HydrophobicContact CD2-CZ 4.1Å; G20-F24 WeakPolarHBondContact O-CD2 3.43Å; G20-F24 PolarHBondContact O-N 3.23Å; F24-T26 VanDerWaalsContact C-N 3.35Å; F24-T26 PolarHBondContact O-N 2.94Å; F24-L27 PolarHBondContact O-N 3.41Å; F24-M28 WeakPolarHBondContact O-CB 3.43Å; F24-M28 WeakPolarHBondContact O-CG 3.28Å; F24-M28 PolarHBondContact O-N 2.87Å
25	H	84.8	Confident	78.4	Confident	108 Å²	108	70 Å²	70	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-44.7	174.4	177.7	-102.5	0	0	0	111.6	A21 L22 F23 L27 M28 Q29	A21-H25 WeakPolarHBondContact O-CB 3.25Å; A21-H25 PolarHBondContact O-N 3.44Å; L22-H25 PolarHBondContact O-N 3.29Å; F23-H25 PolarHBondContact O-N 2.96Å; H25-L27 VanDerWaalsContact C-N 3.34Å; H25-L27 PolarHBondContact O-N 3.22Å; H25-M28 PolarHBondContact O-N 3.19Å; H25-Q29 PolarHBondContact CE1-NE2 2.68Å; H25-Q29 WeakPolarHBondContact O-CG 3.44Å; H25-Q29 PolarHBondContact O-N 2.82Å
26	T	81.9	Confident	76.8	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-40.3	176.9	-54.6	0	0	0	0	111.2	L22 F23 F24 M28 Q29 V30 F57 V60	L22-T26 VanDerWaalsContact O-CB 3.32Å; L22-T26 WeakPolarHBondContact O-CB 3.44Å; L22-T26 PolarHBondContact O-N 2.9Å; L22-T26 PolarHBondContact O-OG1 3.23Å; F23-T26 PolarHBondContact O-N 3.45Å; F24-T26 VanDerWaalsContact C-N 3.35Å; F24-T26 PolarHBondContact O-N 2.94Å; T26-M28 PolarHBondContact O-N 3.25Å; T26-Q29 PolarHBondContact O-N 2.79Å; T26-V30 WeakPolarHBondContact O-CG2 3.36Å; T26-V30 PolarHBondContact O-N 3.45Å; T26-F57 HydrophobicContact CG2-CD2 3.65Å; T26-F57 HydrophobicContact CG2-CE2 3.74Å; T26-V60 HydrophobicContact CG2-CB 3.6Å; T26-V60 HydrophobicContact CG2-CG1 3.63Å; T26-V60 HydrophobicContact CG2-CG2 4.47Å
27	L	82.5	Confident	75.2	Confident	29 Å²	29	68.8 Å²	68.8	15%	0.152	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-42	177.9	-169	145.1	0	0	0	111.4	F23 F24 H25 V30 R31 P47 L48 F57	F23-L27 HydrophobicContact CE1-CD1 3.83Å; F23-L27 HydrophobicContact CZ-CD1 4.11Å; F23-L27 WeakPolarHBondContact O-CB 3.33Å; F23-L27 PolarHBondContact O-N 2.9Å; F24-L27 PolarHBondContact O-N 3.41Å; H25-L27 VanDerWaalsContact C-N 3.34Å; H25-L27 PolarHBondContact O-N 3.22Å; L27-V30 PolarHBondContact O-N 2.84Å; L27-R31 WeakPolarHBondContact O-CB 3.36Å; L27-R31 PolarHBondContact O-N 3.45Å; L27-P47 HydrophobicContact CD2-CG 4.17Å; L27-P47 HydrophobicContact CG-CG 4.07Å; L27-L48 HydrophobicContact CD1-CD1 3.69Å; L27-L48 HydrophobicContact CD1-CD2 4.05Å; L27-L48 HydrophobicContact CD1-CG 3.86Å; L27-F57 HydrophobicContact CB-CD2 4.31Å; L27-F57 HydrophobicContact CB-CE2 3.89Å
28	M	79.5	Confident	73.5	Confident	83 Å²	83	64.5 Å²	64.5	41%	0.409	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-42.2	173	-73.2	-61.9	-61.3	0	0	111.9	F24 H25 T26 V30 R31 D32	F24-M28 WeakPolarHBondContact O-CB 3.43Å; F24-M28 WeakPolarHBondContact O-CG 3.28Å; F24-M28 PolarHBondContact O-N 2.87Å; H25-M28 PolarHBondContact O-N 3.19Å; T26-M28 PolarHBondContact O-N 3.25Å; M28-V30 VanDerWaalsContact C-N 3.3Å; M28-V30 PolarHBondContact O-N 3.19Å; M28-R31 PolarHBondContact O-N 3.44Å; M28-D32 WeakPolarHBondContact O-CB 3.3Å; M28-D32 PolarHBondContact O-N 3.37Å
29	Q	76.3	Confident	72	Confident	72 Å²	72	70.4 Å²	70.4	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-37.7	177	-75.3	-173.6	-9.4	0	0	113.5	H25 T26	H25-Q29 PolarHBondContact CE1-NE2 2.68Å; H25-Q29 WeakPolarHBondContact O-CG 3.44Å; H25-Q29 PolarHBondContact O-N 2.82Å; T26-Q29 PolarHBondContact O-N 2.79Å
30	V	70	Confident	70.4	Confident	4 Å²	4	73.3 Å²	73.3	2%	0.024	39%	0.386	C	S	.	.	H	α-helix	trans	-73.6	-40.5	176.1	-179.4	0	0	0	0	110.5	T26 L27 M28 G33 L36 P47 A53 F57	T26-V30 WeakPolarHBondContact O-CG2 3.36Å; T26-V30 PolarHBondContact O-N 3.45Å; L27-V30 PolarHBondContact O-N 2.84Å; M28-V30 VanDerWaalsContact C-N 3.3Å; M28-V30 PolarHBondContact O-N 3.19Å; V30-G33 PolarHBondContact O-N 2.97Å; V30-L36 HydrophobicContact CG1-CD1 3.82Å; V30-P47 HydrophobicContact CB-CB 4.12Å; V30-P47 HydrophobicContact CG1-CB 3.59Å; V30-A53 HydrophobicContact CG1-CB 4.19Å; V30-F57 HydrophobicContact CG2-CB 4.09Å; V30-F57 HydrophobicContact CG2-CD2 4.46Å
31	R	70.3	Confident	68.7	Low	131 Å²	131	76.6 Å²	76.6	49%	0.494	40%	0.401	S	S	.	.	H	α-helix	trans	-61.9	-41.1	175.8	-174.2	-177.7	179	-176.3	1.5	112.8	L27 M28 G33 L41 P47	L27-R31 WeakPolarHBondContact O-CB 3.36Å; L27-R31 PolarHBondContact O-N 3.45Å; M28-R31 PolarHBondContact O-N 3.44Å; R31-G33 PolarHBondContact O-N 2.89Å; R31-L41 VanDerWaalsContact O-CD1 3.3Å; R31-L41 WeakPolarHBondContact O-CD1 3.35Å; R31-P47 HydrophobicContact CB-CG 4.14Å
32	D	67.4	Low	67	Low	88 Å²	88	83.6 Å²	83.6	47%	0.471	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	4.8	-179.6	-65.2	-16.6	0	0	0	112.3	M28 K34 L41	M28-D32 WeakPolarHBondContact O-CB 3.3Å; M28-D32 PolarHBondContact O-N 3.37Å; D32-K34 PolarHBondContact O-N 3.46Å; D32-L41 VanDerWaalsContact C-CD2 3.46Å; D32-L41 WeakPolarHBondContact O-CD2 3.38Å
33	G	59.7	Low	65.5	Low	18 Å²	18	86.7 Å²	86.7	19%	0.186	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	11.5	168.1	0	0	0	0	0	115.2	V30 R31 R35 L36	V30-G33 PolarHBondContact O-N 2.97Å; R31-G33 PolarHBondContact O-N 2.89Å; G33-R35 PolarHBondContact O-N 2.98Å; G33-L36 PolarHBondContact O-N 2.91Å
34	K	55.9	Low	64	Low	181 Å²	181	89.3 Å²	89.3	79%	0.787	47%	0.474	S	S	*	.	S	Bend	trans	-62.8	-9.9	176.8	-74.6	-174.8	177.8	175.7	0	113.4	D32	D32-K34 PolarHBondContact O-N 3.46Å
35	R	53	Low	62.6	Low	132 Å²	132	88.8 Å²	88.8	50%	0.498	48%	0.478	S	S	.	.	S	Bend	trans	-128.2	-7.3	173.9	-84	-168.8	178.3	-177.3	8.3	116	G33	G33-R35 PolarHBondContact O-N 2.98Å
36	L	52.6	Low	61.7	Low	38 Å²	38	88 Å²	88	20%	0.199	48%	0.478	C	S	.	.	S	Bend	trans	-103.2	104.5	177.7	-71	167.4	0	0	0	107.6	V30 G33 T38 A53	V30-L36 HydrophobicContact CG1-CD1 3.82Å; G33-L36 PolarHBondContact O-N 2.91Å; L36-T38 PolarHBondContact O-N 2.73Å; L36-T38 VanDerWaalsContact O-N 3.12Å; L36-A53 HydrophobicContact CD1-CB 3.96Å
37	T	52.5	Low	60.6	Low	125 Å²	125	88.4 Å²	88.4	77%	0.767	48%	0.48	S	S	*	.			trans	-46.2	115.6	175.7	47.9	0	0	0	0	110.6	N39	T37-N39 PolarHBondContact O-N 3.25Å
38	T	50.4	Low	59.9	Low	120 Å²	120	90 Å²	90	74%	0.736	49%	0.489	S	S	*	.	S	Bend	trans	27.2	90.5	145.8	54.9	0	0	0	0	115.3	L36	L36-T38 PolarHBondContact O-N 2.73Å; L36-T38 VanDerWaalsContact O-N 3.12Å
39	N	52.8	Low	59.5	Low	158 Å²	158	92.4 Å²	92.4	85%	0.845	50%	0.503	S	S	*	.	S	Bend	trans	151.6	-20.3	144.8	-73.1	-16.5	0	0	0	112.9	T37	T37-N39 PolarHBondContact O-N 3.25Å
40	A	52.3	Low	59.2	Low	70 Å²	70	91.3 Å²	91.3	58%	0.579	50%	0.503	S	S	*	.	S	Bend	trans	-84.9	-14.5	-179.3	0	0	0	0	0	114.9	K42	A40-K42 PolarHBondContact O-N 3.48Å
41	L	52.4	Low	59.5	Low	80 Å²	80	98.8 Å²	98.8	42%	0.419	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-82.5	-12.6	-169	-138.2	83.3	0	0	0	115.8	R31 D32 A43	R31-L41 VanDerWaalsContact O-CD1 3.3Å; R31-L41 WeakPolarHBondContact O-CD1 3.35Å; D32-L41 VanDerWaalsContact C-CD2 3.46Å; D32-L41 WeakPolarHBondContact O-CD2 3.38Å; L41-A43 PolarHBondContact O-N 2.72Å
42	K	52.4	Low	59.6	Low	212 Å²	212	98.6 Å²	98.6	92%	0.922	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-71.3	-15.7	-179.9	-80.7	-174.5	175.4	-179.8	0	113.4	A40	A40-K42 PolarHBondContact O-N 3.48Å
43	A	54.5	Low	59.6	Low	77 Å²	77	94.6 Å²	94.6	64%	0.636	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-99	9	-169	0	0	0	0	0	114.8	L41 V45	L41-A43 PolarHBondContact O-N 2.72Å; A43-V45 HydrophobicContact CB-CG2 3.67Å; A43-V45 PolarHBondContact O-N 3.48Å
44	G	55.2	Low	60.4	Low	59 Å²	59	96.8 Å²	96.8	61%	0.608	52%	0.522	S	S	*	.			trans	57.4	22.7	178.3	0	0	0	0	0	113.7	D46	G44-D46 PolarHBondContact O-N 3.05Å
45	V	58.8	Low	61.4	Low	78 Å²	78	92.9 Å²	92.9	47%	0.473	51%	0.507	S	S	.	.			trans	-68.1	127.4	-173.8	179.8	0	0	0	0	108.7	A43	A43-V45 HydrophobicContact CB-CG2 3.67Å; A43-V45 PolarHBondContact O-N 3.48Å
46	D	64.8	Low	62.5	Low	93 Å²	93	87.6 Å²	87.6	50%	0.497	49%	0.491	S	S	.	.			trans	-58.7	125.5	175.5	-70.1	-43.7	0	0	0	109.4	G44 L48 L49	G44-D46 PolarHBondContact O-N 3.05Å; D46-L48 PolarHBondContact O-N 3.49Å; D46-L49 HydrophobicContact CB-CB 4.44Å; D46-L49 HydrophobicContact CB-CD1 3.72Å; D46-L49 HydrophobicContact CB-CG 3.91Å; D46-L49 WeakPolarHBondContact O-CB 3.35Å; D46-L49 PolarHBondContact O-N 2.94Å
47	P	59.8	Low	63.9	Low	8 Å²	8	85.9 Å²	85.9	5%	0.052	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-9.5	-178.6	27.2	-36.2	0	0	0	113	L27 V30 R31 A53 Y54	L27-P47 HydrophobicContact CD2-CG 4.17Å; L27-P47 HydrophobicContact CG-CG 4.07Å; V30-P47 HydrophobicContact CB-CB 4.12Å; V30-P47 HydrophobicContact CG1-CB 3.59Å; R31-P47 HydrophobicContact CB-CG 4.14Å; P47-A53 HydrophobicContact CB-CB 4.14Å; P47-A53 CarbonylContact O-C 3.31Å; P47-A53 VanDerWaalsContact O-C 3.31Å; P47-A53 WeakPolarHBondContact O-CB 3.29Å; P47-Y54 PolarHBondContact O-N 2.86Å
48	L	68.4	Low	65.2	Low	63 Å²	63	82.8 Å²	82.8	33%	0.33	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-13.3	174.1	-61.5	179.4	0	0	0	113.5	A3 L27 D46 Y54 F57	A3-L48 HydrophobicContact CB-CD1 3.72Å; L27-L48 HydrophobicContact CD1-CD1 3.69Å; L27-L48 HydrophobicContact CD1-CD2 4.05Å; L27-L48 HydrophobicContact CD1-CG 3.86Å; D46-L48 PolarHBondContact O-N 3.49Å; L48-Y54 HydrophobicContact CD2-CD2 3.79Å; L48-Y54 HydrophobicContact CD2-CE2 4.15Å; L48-F57 HydrophobicContact CD2-CD1 4.41Å
49	L	69.7	Low	66.6	Low	134 Å²	134	80.3 Å²	80.3	70%	0.702	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-34	179.9	-72.6	169.2	0	0	0	112.3	D46	D46-L49 HydrophobicContact CB-CB 4.44Å; D46-L49 HydrophobicContact CB-CD1 3.72Å; D46-L49 HydrophobicContact CB-CG 3.91Å; D46-L49 WeakPolarHBondContact O-CB 3.35Å; D46-L49 PolarHBondContact O-N 2.94Å
50	S	70.7	Confident	67.8	Low	49 Å²	49	73 Å²	73	34%	0.343	41%	0.407	S	S	.	.	S	Bend	trans	-82.6	123.3	175.7	166.9	0	0	0	0	110	H52 A53 Y54	S50-H52 PolarHBondContact O-N 2.91Å; S50-H52 PolarHBondContact OG-N 3.23Å; S50-A53 PolarHBondContact O-N 2.8Å; S50-A53 PolarHBondContact OG-N 3.26Å; S50-Y54 PolarHBondContact O-N 3.33Å
51	K	75	Confident	69.1	Low	160 Å²	160	69.6 Å²	69.6	70%	0.696	38%	0.38	S	S	*	.	H	α-helix	trans	-51.1	-44	174.9	-178.2	179.3	174.1	-177.3	0	111.6	Y54 E55	K51-Y54 PolarHBondContact O-N 3.37Å; K51-E55 WeakPolarHBondContact CE-OE1 3.02Å; K51-E55 WeakPolarHBondContact O-CG 3.46Å; K51-E55 PolarHBondContact O-N 3.44Å
52	H	72.5	Confident	70.4	Confident	128 Å²	128	70 Å²	70	59%	0.593	38%	0.382	S	S	*	.	H	α-helix	trans	-67.8	-38.2	179.9	-171.5	-63.6	0	0	0	112.3	S50 Y54 A56	S50-H52 PolarHBondContact O-N 2.91Å; S50-H52 PolarHBondContact OG-N 3.23Å; H52-Y54 VanDerWaalsContact C-N 3.35Å; H52-A56 WeakPolarHBondContact O-CB 3.4Å; H52-A56 PolarHBondContact O-N 2.78Å
53	A	68.6	Low	71.8	Confident	4 Å²	4	66.5 Å²	66.5	3%	0.033	36%	0.362	C	S	.	.	H	α-helix	trans	-70.4	-35.1	176.5	0	0	0	0	0	111.5	V30 L36 P47 S50 A56 F57	V30-A53 HydrophobicContact CG1-CB 4.19Å; L36-A53 HydrophobicContact CD1-CB 3.96Å; P47-A53 HydrophobicContact CB-CB 4.14Å; P47-A53 CarbonylContact O-C 3.31Å; P47-A53 VanDerWaalsContact O-C 3.31Å; P47-A53 WeakPolarHBondContact O-CB 3.29Å; S50-A53 PolarHBondContact O-N 2.8Å; S50-A53 PolarHBondContact OG-N 3.26Å; A53-A56 PolarHBondContact O-N 2.85Å; A53-F57 VanDerWaalsContact O-CB 3.27Å; A53-F57 WeakPolarHBondContact O-CB 3.31Å; A53-F57 PolarHBondContact O-N 3.25Å
54	Y	76.4	Confident	72.8	Confident	64 Å²	64	65.1 Å²	65.1	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-68.2	-43.5	175.1	-175.2	-110.5	0	0	0	112.3	E7 P47 L48 S50 K51 H52 A56 F57 Q58	E7-Y54 PolarHBondContact OE1-OH 3.33Å; P47-Y54 PolarHBondContact O-N 2.86Å; L48-Y54 HydrophobicContact CD2-CD2 3.79Å; L48-Y54 HydrophobicContact CD2-CE2 4.15Å; S50-Y54 PolarHBondContact O-N 3.33Å; K51-Y54 PolarHBondContact O-N 3.37Å; H52-Y54 VanDerWaalsContact C-N 3.35Å; Y54-A56 VanDerWaalsContact C-N 3.34Å; Y54-A56 PolarHBondContact O-N 3.29Å; Y54-F57 HydrophobicContact CD2-CD1 4.2Å; Y54-F57 HydrophobicContact CE2-CD1 4.2Å; Y54-F57 WeakPolarHBondContact O-CB 3.47Å; Y54-F57 PolarHBondContact O-N 3.2Å; Y54-Q58 HydrophobicContact CD1-CG 4.23Å; Y54-Q58 HydrophobicContact CD2-CG 4.49Å; Y54-Q58 HydrophobicContact CE1-CG 3.84Å; Y54-Q58 HydrophobicContact CE2-CG 4.08Å; Y54-Q58 VanDerWaalsContact CZ-CD 3.5Å; Y54-Q58 VanDerWaalsContact CZ-NE2 3.31Å; Y54-Q58 WeakPolarHBondContact O-CG 3.11Å; Y54-Q58 PolarHBondContact O-N 3.16Å; Y54-Q58 PolarHBondContact OH-NE2 2.82Å
55	E	77.6	Confident	73.8	Confident	99 Å²	99	63.6 Å²	63.6	46%	0.463	32%	0.322	S	S	.	.	H	α-helix	trans	-62.2	-42.4	174.2	-74.5	174.7	-175.1	0	0	111.4	K51 F57 Q58 S59	K51-E55 WeakPolarHBondContact CE-OE1 3.02Å; K51-E55 WeakPolarHBondContact O-CG 3.46Å; K51-E55 PolarHBondContact O-N 3.44Å; E55-F57 PolarHBondContact O-N 3.38Å; E55-Q58 PolarHBondContact O-N 2.93Å; E55-S59 WeakPolarHBondContact O-CB 3.42Å; E55-S59 PolarHBondContact O-N 3.16Å
56	A	75.7	Confident	74.5	Confident	21 Å²	21	62.7 Å²	62.7	17%	0.174	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-47.1	173.3	0	0	0	0	0	111	H52 A53 Y54 S59 V60	H52-A56 WeakPolarHBondContact O-CB 3.4Å; H52-A56 PolarHBondContact O-N 2.78Å; A53-A56 PolarHBondContact O-N 2.85Å; Y54-A56 VanDerWaalsContact C-N 3.34Å; Y54-A56 PolarHBondContact O-N 3.29Å; A56-S59 PolarHBondContact O-N 3.44Å; A56-S59 PolarHBondContact O-OG 3.49Å; A56-V60 WeakPolarHBondContact O-CG2 3.38Å; A56-V60 PolarHBondContact O-N 3.02Å; A56-V60 VanDerWaalsContact O-N 3.16Å
57	F	80.9	Confident	74.9	Confident	1 Å²	1	62.2 Å²	62.2	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-56.8	-50.3	175.3	169.6	-96.1	0	0	0	112.1	F23 T26 L27 V30 L48 A53 Y54 E55 S59 V60 L61	F23-F57 HydrophobicContact CD2-CE1 4.18Å; F23-F57 HydrophobicContact CD2-CE2 4.49Å; F23-F57 AromaticContact CD2-CZ 3.49Å; F23-F57 HydrophobicContact CD2-CZ 3.49Å; F23-F57 VanDerWaalsContact CD2-CZ 3.49Å; F23-F57 AromaticContact CE2-CE1 3.74Å; F23-F57 HydrophobicContact CE2-CE1 3.74Å; F23-F57 HydrophobicContact CE2-CE2 4.47Å; F23-F57 AromaticContact CE2-CZ 3.37Å; F23-F57 HydrophobicContact CE2-CZ 3.37Å; F23-F57 HydrophobicContact CG-CZ 4.13Å; F23-F57 HydrophobicContact CZ-CE1 4.4Å; F23-F57 AromaticContact CZ-CZ 3.93Å; F23-F57 HydrophobicContact CZ-CZ 3.93Å; T26-F57 HydrophobicContact CG2-CD2 3.65Å; T26-F57 HydrophobicContact CG2-CE2 3.74Å; L27-F57 HydrophobicContact CB-CD2 4.31Å; L27-F57 HydrophobicContact CB-CE2 3.89Å; V30-F57 HydrophobicContact CG2-CB 4.09Å; V30-F57 HydrophobicContact CG2-CD2 4.46Å; L48-F57 HydrophobicContact CD2-CD1 4.41Å; A53-F57 VanDerWaalsContact O-CB 3.27Å; A53-F57 WeakPolarHBondContact O-CB 3.31Å; A53-F57 PolarHBondContact O-N 3.25Å; Y54-F57 HydrophobicContact CD2-CD1 4.2Å; Y54-F57 HydrophobicContact CE2-CD1 4.2Å; Y54-F57 WeakPolarHBondContact O-CB 3.47Å; Y54-F57 PolarHBondContact O-N 3.2Å; E55-F57 PolarHBondContact O-N 3.38Å; F57-S59 PolarHBondContact O-N 3.04Å; F57-V60 PolarHBondContact O-N 3.03Å; F57-L61 HydrophobicContact CE1-CD2 3.89Å; F57-L61 HydrophobicContact CZ-CB 4.47Å; F57-L61 HydrophobicContact CZ-CD1 4.45Å; F57-L61 HydrophobicContact CZ-CD2 3.94Å; F57-L61 WeakPolarHBondContact O-CB 3.41Å; F57-L61 PolarHBondContact O-N 3.38Å
58	Q	80.8	Confident	75.1	Confident	60 Å²	60	66.3 Å²	66.3	28%	0.28	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-42.3	179.8	-75.5	-164.4	-45.9	0	0	112	E7 Y54 E55 V60 L61 I62	E7-Q58 PolarHBondContact OE1-NE2 3.5Å; E7-Q58 VanDerWaalsContact OE1-NE2 3.16Å; Y54-Q58 HydrophobicContact CD1-CG 4.23Å; Y54-Q58 HydrophobicContact CD2-CG 4.49Å; Y54-Q58 HydrophobicContact CE1-CG 3.84Å; Y54-Q58 HydrophobicContact CE2-CG 4.08Å; Y54-Q58 VanDerWaalsContact CZ-CD 3.5Å; Y54-Q58 VanDerWaalsContact CZ-NE2 3.31Å; Y54-Q58 WeakPolarHBondContact O-CG 3.11Å; Y54-Q58 PolarHBondContact O-N 3.16Å; Y54-Q58 PolarHBondContact OH-NE2 2.82Å; E55-Q58 PolarHBondContact O-N 2.93Å; Q58-V60 VanDerWaalsContact C-N 3.27Å; Q58-V60 PolarHBondContact O-N 3.21Å; Q58-L61 PolarHBondContact O-N 2.84Å; Q58-I62 WeakPolarHBondContact O-CB 3.4Å; Q58-I62 VanDerWaalsContact O-CG1 3.28Å; Q58-I62 WeakPolarHBondContact O-CG1 3.34Å; Q58-I62 PolarHBondContact O-N 3.38Å
59	S	78.6	Confident	74.8	Confident	69 Å²	69	66.2 Å²	66.2	48%	0.483	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-38	177.2	77.4	0	0	0	0	112.4	E55 A56 F57 R63	E55-S59 WeakPolarHBondContact O-CB 3.42Å; E55-S59 PolarHBondContact O-N 3.16Å; A56-S59 PolarHBondContact O-N 3.44Å; A56-S59 PolarHBondContact O-OG 3.49Å; F57-S59 PolarHBondContact O-N 3.04Å; S59-R63 WeakPolarHBondContact O-CB 3.27Å; S59-R63 PolarHBondContact O-N 2.98Å
60	V	78	Confident	74.3	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.018	33%	0.326	C	S	.	.	H	α-helix	trans	-72.7	-46.4	177	-172.2	0	0	0	0	110.1	T26 A56 F57 Q58 I62 R63 E64	T26-V60 HydrophobicContact CG2-CB 3.6Å; T26-V60 HydrophobicContact CG2-CG1 3.63Å; T26-V60 HydrophobicContact CG2-CG2 4.47Å; A56-V60 WeakPolarHBondContact O-CG2 3.38Å; A56-V60 PolarHBondContact O-N 3.02Å; A56-V60 VanDerWaalsContact O-N 3.16Å; F57-V60 PolarHBondContact O-N 3.03Å; Q58-V60 VanDerWaalsContact C-N 3.27Å; Q58-V60 PolarHBondContact O-N 3.21Å; V60-I62 PolarHBondContact O-N 3.42Å; V60-R63 WeakPolarHBondContact O-CB 3.4Å; V60-R63 PolarHBondContact O-N 2.93Å; V60-E64 HydrophobicContact CG1-CG 4.28Å; V60-E64 WeakPolarHBondContact O-CG 3.49Å; V60-E64 PolarHBondContact O-N 3.35Å
61	L	81.2	Confident	73.7	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-58.8	-49.2	-178.3	-172.4	68.4	0	0	0	110.7	E7 F19 L22 F23 F57 Q58 R63 E64 V65	E7-L61 HydrophobicContact CB-CD2 4.12Å; E7-L61 HydrophobicContact CG-CD2 3.89Å; F19-L61 HydrophobicContact CZ-CD2 4.29Å; L22-L61 HydrophobicContact CD2-CD1 4.39Å; L22-L61 HydrophobicContact CG-CD1 4.23Å; F23-L61 HydrophobicContact CB-CD1 4.43Å; F23-L61 HydrophobicContact CD2-CD2 4.19Å; F57-L61 HydrophobicContact CE1-CD2 3.89Å; F57-L61 HydrophobicContact CZ-CB 4.47Å; F57-L61 HydrophobicContact CZ-CD1 4.45Å; F57-L61 HydrophobicContact CZ-CD2 3.94Å; F57-L61 WeakPolarHBondContact O-CB 3.41Å; F57-L61 PolarHBondContact O-N 3.38Å; Q58-L61 PolarHBondContact O-N 2.84Å; L61-R63 VanDerWaalsContact C-N 3.33Å; L61-R63 PolarHBondContact O-N 3.01Å; L61-E64 PolarHBondContact O-N 2.93Å; L61-V65 HydrophobicContact CD1-CG2 4.32Å; L61-V65 HydrophobicContact CG-CG2 4.22Å; L61-V65 WeakPolarHBondContact O-CB 3.47Å; L61-V65 WeakPolarHBondContact O-CG2 3.16Å; L61-V65 PolarHBondContact O-N 3.05Å
62	I	79.5	Confident	72.7	Confident	89 Å²	89	62.1 Å²	62.1	46%	0.456	32%	0.321	S	S	.	.	H	α-helix	trans	-61.1	-43.1	178.4	-67.5	166.4	0	0	0	111	Q58 V60 E64 S66	Q58-I62 WeakPolarHBondContact O-CB 3.4Å; Q58-I62 VanDerWaalsContact O-CG1 3.28Å; Q58-I62 WeakPolarHBondContact O-CG1 3.34Å; Q58-I62 PolarHBondContact O-N 3.38Å; V60-I62 PolarHBondContact O-N 3.42Å; I62-E64 VanDerWaalsContact C-N 3.33Å; I62-E64 PolarHBondContact O-N 3.34Å; I62-S66 WeakPolarHBondContact O-CB 3.4Å; I62-S66 PolarHBondContact O-N 3.45Å; I62-S66 PolarHBondContact O-OG 2.86Å
63	R	80.8	Confident	71.8	Confident	138 Å²	138	61 Å²	61	52%	0.521	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-43.5	177.5	-179	179.6	179.1	-165.7	-3.5	111.5	S59 V60 L61 K67	S59-R63 WeakPolarHBondContact O-CB 3.27Å; S59-R63 PolarHBondContact O-N 2.98Å; V60-R63 WeakPolarHBondContact O-CB 3.4Å; V60-R63 PolarHBondContact O-N 2.93Å; L61-R63 VanDerWaalsContact C-N 3.33Å; L61-R63 PolarHBondContact O-N 3.01Å; R63-K67 WeakPolarHBondContact O-CG 3.4Å; R63-K67 PolarHBondContact O-N 3.05Å
64	E	75.8	Confident	71.2	Confident	47 Å²	47	64.6 Å²	64.6	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-73.7	-44.5	179.6	-67.9	-56.4	135.9	0	0	111.7	L22 V60 L61 I62 S66 K67 F68	L22-E64 HydrophobicContact CD1-CB 3.66Å; L22-E64 HydrophobicContact CD1-CG 4.1Å; L22-E64 HydrophobicContact CD2-CB 3.75Å; L22-E64 HydrophobicContact CG-CB 4.16Å; V60-E64 HydrophobicContact CG1-CG 4.28Å; V60-E64 WeakPolarHBondContact O-CG 3.49Å; V60-E64 PolarHBondContact O-N 3.35Å; L61-E64 PolarHBondContact O-N 2.93Å; I62-E64 VanDerWaalsContact C-N 3.33Å; I62-E64 PolarHBondContact O-N 3.34Å; E64-S66 PolarHBondContact O-N 3.23Å; E64-K67 CarbonylContact O-C 3.55Å; E64-K67 WeakPolarHBondContact O-CA 3.38Å; E64-K67 WeakPolarHBondContact O-CB 3.27Å; E64-K67 PolarHBondContact O-N 3.21Å; E64-K67 IonicContact OE1-NZ 2.72Å; E64-K67 PolarHBondContact OE1-NZ 3.49Å; E64-K67 IonicContact OE2-NZ 3.67Å; E64-F68 VanDerWaalsContact O-CD2 3.3Å; E64-F68 WeakPolarHBondContact O-CD2 3.3Å; E64-F68 PolarHBondContact O-N 3.49Å
65	V	76	Confident	70.1	Confident	28 Å²	28	70.7 Å²	70.7	17%	0.17	36%	0.36	C	S	.	.	H	α-helix	trans	-55.7	-41.2	175.1	171.4	0	0	0	0	111.2	F19 L22 L61 K67 F68 S69	F19-V65 HydrophobicContact CD2-CG2 4Å; F19-V65 HydrophobicContact CE2-CG2 3.61Å; L22-V65 HydrophobicContact CD2-CG2 3.85Å; L61-V65 HydrophobicContact CD1-CG2 4.32Å; L61-V65 HydrophobicContact CG-CG2 4.22Å; L61-V65 WeakPolarHBondContact O-CB 3.47Å; L61-V65 WeakPolarHBondContact O-CG2 3.16Å; L61-V65 PolarHBondContact O-N 3.05Å; V65-K67 VanDerWaalsContact C-N 3.34Å; V65-K67 PolarHBondContact O-N 2.86Å; V65-F68 PolarHBondContact O-N 3.29Å; V65-S69 PolarHBondContact O-N 2.9Å
66	S	73.8	Confident	68.8	Low	58 Å²	58	74.3 Å²	74.3	41%	0.406	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-43.6	174.7	-60.2	0	0	0	0	111.7	I62 E64 S69 L70	I62-S66 WeakPolarHBondContact O-CB 3.4Å; I62-S66 PolarHBondContact O-N 3.45Å; I62-S66 PolarHBondContact O-OG 2.86Å; E64-S66 PolarHBondContact O-N 3.23Å; S66-S69 PolarHBondContact O-N 3.33Å; S66-S69 PolarHBondContact O-OG 2.72Å; S66-L70 PolarHBondContact O-N 2.89Å; S66-L70 VanDerWaalsContact O-N 3.14Å
67	K	72.8	Confident	67.6	Low	84 Å²	84	76.7 Å²	76.7	37%	0.365	39%	0.385	S	S	.	.	H	α-helix	trans	-65.3	-41.7	173.7	-66.3	171.6	-174.9	171.7	0	112	R63 E64 V65 S69 L70 V71	R63-K67 WeakPolarHBondContact O-CG 3.4Å; R63-K67 PolarHBondContact O-N 3.05Å; E64-K67 CarbonylContact O-C 3.55Å; E64-K67 WeakPolarHBondContact O-CA 3.38Å; E64-K67 WeakPolarHBondContact O-CB 3.27Å; E64-K67 PolarHBondContact O-N 3.21Å; E64-K67 IonicContact OE1-NZ 2.72Å; E64-K67 PolarHBondContact OE1-NZ 3.49Å; E64-K67 IonicContact OE2-NZ 3.67Å; V65-K67 VanDerWaalsContact C-N 3.34Å; V65-K67 PolarHBondContact O-N 2.86Å; K67-S69 VanDerWaalsContact C-N 3.31Å; K67-S69 PolarHBondContact O-N 3.06Å; K67-L70 PolarHBondContact O-N 3.24Å; K67-V71 WeakPolarHBondContact O-CB 3.42Å; K67-V71 VanDerWaalsContact O-CG2 3.25Å; K67-V71 WeakPolarHBondContact O-CG2 3.32Å; K67-V71 PolarHBondContact O-N 3.27Å
68	F	65	Low	66.1	Low	93 Å²	93	83.8 Å²	83.8	41%	0.408	41%	0.413	S	S	.	.	H	α-helix	trans	-61.3	-41.1	177.4	-89.4	-86.3	0	0	0	111.5	L22 E64 V65 L70 V71 T72	L22-F68 HydrophobicContact CB-CE2 4.49Å; L22-F68 HydrophobicContact CD1-CD2 4.41Å; L22-F68 HydrophobicContact CD1-CE2 3.74Å; L22-F68 HydrophobicContact CD2-CD2 3.6Å; L22-F68 HydrophobicContact CD2-CE2 3.76Å; L22-F68 HydrophobicContact CD2-CG 4.49Å; L22-F68 HydrophobicContact CG-CE2 4.19Å; E64-F68 VanDerWaalsContact O-CD2 3.3Å; E64-F68 WeakPolarHBondContact O-CD2 3.3Å; E64-F68 PolarHBondContact O-N 3.49Å; V65-F68 PolarHBondContact O-N 3.29Å; F68-L70 PolarHBondContact O-N 3.49Å; F68-V71 PolarHBondContact O-N 3.43Å; F68-T72 VanDerWaalsContact O-CB 3.29Å; F68-T72 WeakPolarHBondContact O-CB 3.37Å; F68-T72 PolarHBondContact O-N 2.95Å; F68-T72 PolarHBondContact O-OG1 3.25Å
69	S	62	Low	64.7	Low	62 Å²	62	91.9 Å²	91.9	43%	0.434	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-42.7	175.2	78.8	0	0	0	0	112.1	V65 S66 K67 T72 L73	V65-S69 PolarHBondContact O-N 2.9Å; S66-S69 PolarHBondContact O-N 3.33Å; S66-S69 PolarHBondContact O-OG 2.72Å; K67-S69 VanDerWaalsContact C-N 3.31Å; K67-S69 PolarHBondContact O-N 3.06Å; S69-T72 PolarHBondContact O-N 3.1Å; S69-L73 WeakPolarHBondContact O-CB 3.09Å; S69-L73 WeakPolarHBondContact O-CG 3.36Å; S69-L73 PolarHBondContact O-N 3.39Å
70	L	59	Low	63.1	Low	103 Å²	103	95.7 Å²	95.7	54%	0.539	45%	0.453	S	S	.	.	H	α-helix	trans	-65.6	-45.7	175.4	-87.2	157.8	0	0	0	112.3	S66 K67 F68 T72 L73 L74	S66-L70 PolarHBondContact O-N 2.89Å; S66-L70 VanDerWaalsContact O-N 3.14Å; K67-L70 PolarHBondContact O-N 3.24Å; F68-L70 PolarHBondContact O-N 3.49Å; L70-T72 VanDerWaalsContact C-N 3.29Å; L70-T72 PolarHBondContact O-N 3.3Å; L70-L73 PolarHBondContact O-N 3.48Å; L70-L74 VanDerWaalsContact O-CB 3.26Å; L70-L74 WeakPolarHBondContact O-CB 3.15Å; L70-L74 VanDerWaalsContact O-CG 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.35Å; L70-L74 PolarHBondContact O-N 2.98Å
71	V	58.1	Low	61.5	Low	74 Å²	74	99.9 Å²	99.9	45%	0.448	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-34.9	179	172.8	0	0	0	0	111	K67 F68 R75	K67-V71 WeakPolarHBondContact O-CB 3.42Å; K67-V71 VanDerWaalsContact O-CG2 3.25Å; K67-V71 WeakPolarHBondContact O-CG2 3.32Å; K67-V71 PolarHBondContact O-N 3.27Å; F68-V71 PolarHBondContact O-N 3.43Å; V71-R75 WeakPolarHBondContact O-CB 3.33Å; V71-R75 PolarHBondContact O-N 3.04Å
72	T	53.2	Low	59.9	Low	79 Å²	79	107.8 Å²	107.8	49%	0.485	52%	0.523	S	S	.	.	H	α-helix	trans	-71.4	-41.3	177.4	-54.2	0	0	0	0	111	F68 S69 L70 R76	F68-T72 VanDerWaalsContact O-CB 3.29Å; F68-T72 WeakPolarHBondContact O-CB 3.37Å; F68-T72 PolarHBondContact O-N 2.95Å; F68-T72 PolarHBondContact O-OG1 3.25Å; S69-T72 PolarHBondContact O-N 3.1Å; L70-T72 VanDerWaalsContact C-N 3.29Å; L70-T72 PolarHBondContact O-N 3.3Å; T72-R76 WeakPolarHBondContact O-CB 3.48Å; T72-R76 PolarHBondContact O-N 3.2Å; T72-R76 VanDerWaalsContact O-N 3.08Å
73	L	54.3	Low	58.2	Low	105 Å²	105	106.5 Å²	106.5	55%	0.55	53%	0.532	S	S	.	.	H	α-helix	trans	-62.4	-47.6	172.8	-79.5	163.5	0	0	0	111.3	S69 L70 R76 S77	S69-L73 WeakPolarHBondContact O-CB 3.09Å; S69-L73 WeakPolarHBondContact O-CG 3.36Å; S69-L73 PolarHBondContact O-N 3.39Å; L70-L73 PolarHBondContact O-N 3.48Å; L73-R76 WeakPolarHBondContact O-CB 3.47Å; L73-R76 PolarHBondContact O-N 3.12Å; L73-R76 VanDerWaalsContact O-N 3.16Å; L73-S77 PolarHBondContact O-N 3.2Å; L73-S77 PolarHBondContact O-OG 2.94Å
74	L	56	Low	56.3	Low	79 Å²	79	107.4 Å²	107.4	41%	0.414	54%	0.544	S	S	.	.	H	α-helix	trans	-62.1	-47.6	178.6	-79.4	167.9	0	0	0	111.9	L70 R76 S77 Y78	L70-L74 VanDerWaalsContact O-CB 3.26Å; L70-L74 WeakPolarHBondContact O-CB 3.15Å; L70-L74 VanDerWaalsContact O-CG 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.35Å; L70-L74 PolarHBondContact O-N 2.98Å; L74-R76 PolarHBondContact O-N 2.98Å; L74-S77 CarbonylContact O-C 3.55Å; L74-S77 WeakPolarHBondContact O-CA 3.15Å; L74-S77 WeakPolarHBondContact O-CB 3.5Å; L74-S77 PolarHBondContact O-N 3.32Å; L74-Y78 VanDerWaalsContact C-CD2 3.41Å; L74-Y78 HydrophobicContact CB-CD2 4.25Å; L74-Y78 HydrophobicContact CB-CE2 3.77Å; L74-Y78 HydrophobicContact CD2-CE2 4.07Å; L74-Y78 HydrophobicContact CG-CE2 4.46Å; L74-Y78 WeakPolarHBondContact O-CD2 3.3Å; L74-Y78 PolarHBondContact O-N 3.37Å
75	R	53.8	Low	54.6	Low	192 Å²	192	110 Å²	110	73%	0.725	57%	0.567	S	S	*	*	H	α-helix	trans	-59	-34.1	174.9	-89	-175	139.5	151.7	-3.3	112.6	V71 R79	V71-R75 WeakPolarHBondContact O-CB 3.33Å; V71-R75 PolarHBondContact O-N 3.04Å; R75-R79 PolarHBondContact O-N 3.49Å
76	R	49.9	Very low	52.7	Low	176 Å²	176	114.7 Å²	114.7	66%	0.664	60%	0.596	S	S	*	*	H	α-helix	trans	-70.4	-39.5	175.1	-147.8	171.5	-174.6	169.7	0.9	111.4	T72 L73 L74 R79 M80	T72-R76 WeakPolarHBondContact O-CB 3.48Å; T72-R76 PolarHBondContact O-N 3.2Å; T72-R76 VanDerWaalsContact O-N 3.08Å; L73-R76 WeakPolarHBondContact O-CB 3.47Å; L73-R76 PolarHBondContact O-N 3.12Å; L73-R76 VanDerWaalsContact O-N 3.16Å; L74-R76 PolarHBondContact O-N 2.98Å; R76-R79 PolarHBondContact O-N 2.93Å; R76-M80 PolarHBondContact O-N 2.91Å
77	S	50.6	Low	51.2	Low	70 Å²	70	123.7 Å²	123.7	49%	0.49	62%	0.621	S	S	.	*	H	α-helix	trans	-66.6	-38.3	173.4	-63.3	0	0	0	0	112.8	L73 L74 R79 M80 S81	L73-S77 PolarHBondContact O-N 3.2Å; L73-S77 PolarHBondContact O-OG 2.94Å; L74-S77 CarbonylContact O-C 3.55Å; L74-S77 WeakPolarHBondContact O-CA 3.15Å; L74-S77 WeakPolarHBondContact O-CB 3.5Å; L74-S77 PolarHBondContact O-N 3.32Å; S77-R79 PolarHBondContact O-N 3.4Å; S77-M80 PolarHBondContact O-N 3.34Å; S77-S81 VanDerWaalsContact O-CB 3.23Å; S77-S81 WeakPolarHBondContact O-CB 3.35Å; S77-S81 PolarHBondContact O-N 2.91Å
78	Y	49.3	Very low	49.8	Very low	151 Å²	151	124.7 Å²	124.7	59%	0.592	65%	0.645	S	S	*	*	H	α-helix	trans	-69.4	-31.2	177.9	-67.3	-62.8	0	0	0	113	L74 L82	L74-Y78 VanDerWaalsContact C-CD2 3.41Å; L74-Y78 HydrophobicContact CB-CD2 4.25Å; L74-Y78 HydrophobicContact CB-CE2 3.77Å; L74-Y78 HydrophobicContact CD2-CE2 4.07Å; L74-Y78 HydrophobicContact CG-CE2 4.46Å; L74-Y78 WeakPolarHBondContact O-CD2 3.3Å; L74-Y78 PolarHBondContact O-N 3.37Å; Y78-L82 PolarHBondContact O-N 2.89Å
79	R	51.7	Low	48.4	Very low	230 Å²	230	123.4 Å²	123.4	87%	0.868	66%	0.658	S	S	*	*	H	α-helix	trans	-73.5	-29.8	171.8	-87.8	-173.1	160.7	-161.3	-4.5	113.4	R75 R76 S77	R75-R79 PolarHBondContact O-N 3.49Å; R76-R79 PolarHBondContact O-N 2.93Å; S77-R79 PolarHBondContact O-N 3.4Å
80	M	44.6	Very low	47.2	Very low	149 Å²	149	126.1 Å²	126.1	73%	0.734	67%	0.672	S	S	*	*	H	α-helix	trans	-80.4	-32.6	174.1	-81.4	-74.3	-175.9	0	0	112.5	R76 S77 G83	R76-M80 PolarHBondContact O-N 2.91Å; S77-M80 PolarHBondContact O-N 3.34Å; M80-G83 PolarHBondContact O-N 2.96Å
81	S	44.9	Very low	46.3	Very low	91 Å²	91	130.3 Å²	130.3	64%	0.636	69%	0.686	S	S	*	*	H	α-helix	trans	-81.7	-12.7	-175.1	-158.7	0	0	0	0	114.7	S77 G83	S77-S81 VanDerWaalsContact O-CB 3.23Å; S77-S81 WeakPolarHBondContact O-CB 3.35Å; S77-S81 PolarHBondContact O-N 2.91Å; S81-G83 VanDerWaalsContact C-N 3.35Å
82	L	46.8	Very low	45.8	Very low	165 Å²	165	133.2 Å²	133.2	86%	0.864	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-5.5	169.3	-109.1	86.1	0	0	0	113.3	Y78	Y78-L82 PolarHBondContact O-N 2.89Å
83	G	44.4	Very low	45.1	Very low	62 Å²	62	141.1 Å²	141.1	64%	0.639	72%	0.719	S	S	*	*	S	Bend	trans	-107.1	-7.4	-175.1	0	0	0	0	0	115.8	M80 S81	M80-G83 PolarHBondContact O-N 2.96Å; S81-G83 VanDerWaalsContact C-N 3.35Å
84	M	40.2	Very low	44.6	Very low	158 Å²	158	145.2 Å²	145.2	78%	0.778	73%	0.727	S	S	*	*	S	Bend	trans	-140.7	100.8	-178.8	-63.8	-154.6	90.1	0	0	112.2
85	S	41	Very low	43.9	Very low	101 Å²	101	151.1 Å²	151.1	71%	0.706	74%	0.744	S	S	*	*			trans	36.2	105.7	131.7	-168.8	0	0	0	0	117.7
86	T	35.5	Very low	43.3	Very low	126 Å²	126	153.1 Å²	153.1	77%	0.773	75%	0.751	S	S	*	*	S	Bend		16.4	114.6	126.3	33.5	0	0	0	0	117.4
87	R	41.4	Very low	43	Very low	248 Å²	248	149 Å²	149	94%	0.936	75%	0.746	S	S	*	*			trans	111.5	75	163.2	-70.2	178.3	155.3	-177.7	-5.1	116.1
88	A	43	Very low	42.2	Very low	105 Å²	105	152.9 Å²	152.9	87%	0.868	77%	0.767	S	S	*	*			trans	-175.5	107.3	141.1	0	0	0	0	0	105.7
89	G	36.8	Very low	41.5	Very low	65 Å²	65	150.1 Å²	150.1	67%	0.67	77%	0.77	S	S	*	*				92.9	69.6	51.3	0	0	0	0	0	109.8
90	T	35.7	Very low	41	Very low	119 Å²	119	147.4 Å²	147.4	73%	0.73	77%	0.767	S	S	*	*			trans	62.3	153.6	151.4	50.5	0	0	0	0	120.5
91	F	41	Very low	40.5	Very low	191 Å²	191	147.3 Å²	147.3	84%	0.838	78%	0.779	S	S	*	*			trans	76.9	119.3	175.9	-57.4	-92.3	0	0	0	113.4
92	I	48.5	Very low	40.4	Very low	136 Å²	136	147 Å²	147	70%	0.697	78%	0.777	S	S	*	*			cis	-154.5	112.4	49.9	-67.7	169.2	0	0	0	109	R94	I92-R94 HydrophobicContact CG2-CB 3.69Å; I92-R94 PolarHBondContact O-N 3.2Å
93	R	37.3	Very low	40	Very low	244 Å²	244	144 Å²	144	92%	0.921	78%	0.776	S	S	*	*			trans	-84.1	96.4	158.1	175.4	-178.5	162.5	-161.9	-3.7	106.5
94	R	43.3	Very low	40.1	Very low	191 Å²	191	151.8 Å²	151.8	72%	0.721	79%	0.786	S	S	*	*			trans	-117.6	97	171.1	-154.7	179.5	-80.3	-178.1	-3.1	110.8	I92 W96	I92-R94 HydrophobicContact CG2-CB 3.69Å; I92-R94 PolarHBondContact O-N 3.2Å; R94-W96 PolarHBondContact O-N 2.81Å
95	R	41.3	Very low	40.2	Very low	203 Å²	203	149.4 Å²	149.4	77%	0.766	79%	0.785	S	S	*	*			trans	-45.9	117.4	159.5	-165.1	-173.1	-151.9	164.4	4.3	109.5	T97	R95-T97 HydrophobicContact CG-CG2 3.81Å
96	W	42.9	Very low	40.2	Very low	234 Å²	234	154.4 Å²	154.4	89%	0.886	79%	0.79	S	S	*	*			trans	-98.3	93.2	158.9	-73.5	78.7	0	0	0	106.6	R94	R94-W96 PolarHBondContact O-N 2.81Å
97	T	42.5	Very low	40.4	Very low	89 Å²	89	155.3 Å²	155.3	55%	0.546	79%	0.79	S	S	.	*			trans	-69.8	136.4	166.8	35.3	0	0	0	0	109.6	R95 S99	R95-T97 HydrophobicContact CG-CG2 3.81Å; T97-S99 PolarHBondContact O-N 2.99Å
98	T	35	Very low	40.6	Very low	153 Å²	153	151.4 Å²	151.4	94%	0.939	78%	0.78	S	S	*	*			trans	-56.1	106.9	162.5	7.7	0	0	0	0	110.9
99	S	34.4	Very low	40.9	Very low	93 Å²	93	153.9 Å²	153.9	65%	0.65	78%	0.778	S	S	*	*			trans	-167.7	112.4	156.2	58.7	0	0	0	0	103.4	T97	T97-S99 PolarHBondContact O-N 2.99Å
100	E	41.1	Very low	41.6	Very low	173 Å²	173	158.5 Å²	158.5	81%	0.808	79%	0.787	S	S	*	*				-158.7	115.8	65.9	-76.3	163	168.8	0	0	108.4	S102	E100-S102 VanDerWaalsContact C-N 3.28Å; E100-S102 PolarHBondContact O-N 3.39Å
101	C	34.5	Very low	42.2	Very low	147 Å²	147	157.5 Å²	157.5	99%	0.993	79%	0.785	S	S	*	*			trans	-71	95.8	144	-83.3	0	0	0	0	105.9
102	S	42.2	Very low	42.2	Very low	84 Å²	84	153 Å²	153	59%	0.587	78%	0.782	S	S	*	*			trans	-110.3	102.2	166.5	170.8	0	0	0	0	108.6	E100 R104	E100-S102 VanDerWaalsContact C-N 3.28Å; E100-S102 PolarHBondContact O-N 3.39Å; S102-R104 PolarHBondContact O-N 3.49Å
103	A	37.9	Very low	42.1	Very low	101 Å²	101	152.1 Å²	152.1	84%	0.835	78%	0.784	S	S	*	*			trans	-62.2	115.6	161.1	0	0	0	0	0	109.9
104	R	45.8	Very low	42.3	Very low	226 Å²	226	148.8 Å²	148.8	85%	0.853	78%	0.776	S	S	*	*			trans	-136.3	95.1	154.8	-82.9	-174.4	176.9	177.1	-1.4	105.5	S102	S102-R104 PolarHBondContact O-N 3.49Å
105	S	43.1	Very low	42.4	Very low	109 Å²	109	147.8 Å²	147.8	76%	0.762	78%	0.783	S	S	*	*				58.4	106.2	88.9	-173.1	0	0	0	0	111.7
106	Y	41	Very low	42.4	Very low	206 Å²	206	146.4 Å²	146.4	81%	0.808	79%	0.786	S	S	*	*			trans	-15.9	124.7	162.1	-73.3	-98.9	0	0	0	116.1
107	D	39.8	Very low	42.8	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	78%	0.775	S	S	*	*			trans	-135.5	108.3	142.2	-152	2.7	0	0	0	108.2
108	K	44.7	Very low	42.5	Very low	167 Å²	167	138.6 Å²	138.6	73%	0.726	79%	0.787	S	S	*	*			trans	-93.8	111	167.3	-75.9	-179.5	177.6	179.9	0	104.2
109	D	50.3	Low	43.1	Very low	156 Å²	156	138 Å²	138	83%	0.834	78%	0.777	S	S	*	*			trans	146.9	61.1	158.2	-74.4	-17.5	0	0	0	111.7
110	L	51.6	Low	43.7	Very low	162 Å²	162	145 Å²	145	85%	0.848	79%	0.789	S	S	*	*			trans	-109.4	96.5	163	-93	149.2	0	0	0	109.7
111	S	48.2	Very low	44	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	79%	0.79	S	S	*	*			trans	-36.9	143.8	168.8	58.9	0	0	0	0	114.9
112	A	41.5	Very low	44.8	Very low	95 Å²	95	146 Å²	146	79%	0.785	78%	0.78	S	S	*	*			trans	-44.3	130.3	166.5	0	0	0	0	0	114.2
113	T	45.9	Very low	45.3	Very low	119 Å²	119	155.4 Å²	155.4	73%	0.73	81%	0.811	S	S	*	*			trans	-163.5	124.2	137.1	-17.8	0	0	0	0	112.2
114	K	42.3	Very low	45.6	Very low	173 Å²	173	158.2 Å²	158.2	75%	0.752	81%	0.81	S	S	*	*			trans	46	97.5	146.1	-72.1	173.1	179.7	178	0	118.5
115	I	45.1	Very low	45.6	Very low	170 Å²	170	154.6 Å²	154.6	87%	0.872	81%	0.808	S	S	*	*			trans	-106.2	84.9	142.4	-58.4	177.4	0	0	0	106.9	A117	I115-A117 HydrophobicContact CG2-CB 4.34Å
116	Q	39.8	Very low	45.8	Very low	175 Å²	175	157.1 Å²	157.1	82%	0.818	81%	0.81	S	S	*	*			trans	-93.7	87.2	166.1	-175.8	177.4	-10.5	0	0	106
117	A	51.2	Low	46	Very low	81 Å²	81	154.2 Å²	154.2	67%	0.669	81%	0.81	S	S	*	*			trans	-111	122.5	171.5	0	0	0	0	0	108.2	I115	I115-A117 HydrophobicContact CG2-CB 4.34Å
118	G	37.2	Very low	46.4	Very low	78 Å²	78	154.9 Å²	154.9	80%	0.804	81%	0.813	S	S	*	*			trans	-62.6	130.8	-159.2	0	0	0	0	0	115.8
119	I	48.4	Very low	46.6	Very low	141 Å²	141	154.1 Å²	154.1	72%	0.723	82%	0.818	S	S	*	*			trans	-105.2	99.9	152.7	-59.4	175.3	0	0	0	105.4	Y121	I119-Y121 HydrophobicContact CG2-CD2 3.93Å; I119-Y121 HydrophobicContact CG2-CE2 3.74Å; I119-Y121 PolarHBondContact O-N 3.31Å
120	R	45.2	Very low	46.3	Very low	239 Å²	239	153.9 Å²	153.9	90%	0.902	82%	0.817	S	S	*	*			trans	-74.2	110	165.3	-81.4	-177.4	172.1	-170.2	-2.5	107.1
121	Y	48.8	Very low	45.9	Very low	213 Å²	213	153.3 Å²	153.3	84%	0.835	82%	0.815	S	S	*	*			trans	-76.5	122.4	155.5	-81.8	-93.1	0	0	0	107.4	I119	I119-Y121 HydrophobicContact CG2-CD2 3.93Å; I119-Y121 HydrophobicContact CG2-CE2 3.74Å; I119-Y121 PolarHBondContact O-N 3.31Å
122	V	51.7	Low	45.7	Very low	127 Å²	127	157.8 Å²	157.8	77%	0.77	83%	0.825	S	S	*	*			trans	-88.5	124.4	163.9	175.4	0	0	0	0	105.7
123	F	51.2	Low	46.1	Very low	283 Å²	283	163.5 Å²	163.5	100%	1.241	83%	0.829	S	S	*	*			trans	6.5	0	172.7	-74	-88.8	0	0	0	119.4

Retrieved 123 of 123 residues in 262.7 ms (Link to these results)

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