A0A087WQA9_MOUSE Loading...

ABPBG21

AlphaFold DB , UniProt , Accession A0A087WQA9, Species MOUSE (Mus musculus, Mouse), Gene Scgb2b21, Length 112 aa.

						>A0A087WQA9_MOUSE|A0A087WQA9|Scgb2b21
MKGTLLLLGLLVTGELSFQTTEACVPFFEGYASVVSGSRVWMYQEFQAFDATAEEKVALEKIQGCYREESLRNILLEPKIMEAMVASPECLSYYSSNNIRCILDLLSKLLGQ
					

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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	64.7	Low	76	Confident	208 Å²	208	106 Å²	106	100%	1.025	58%	0.578	S	S	*	*				0	-35.9	0	-73.6	-170.6	-81.5	0	0	114.6
2	K	76.8	Confident	75.4	Confident	193 Å²	193	107.3 Å²	107.3	84%	0.839	59%	0.591	S	S	*	*	H	α-helix	trans	-63.9	-39.1	176.7	-71.6	-177.7	177.6	-179.5	0	114.2	L5 L6	K2-L5 PolarHBondContact O-N 3.39Å; K2-L6 PolarHBondContact O-N 3.37Å; K2-L6 VanDerWaalsContact O-N 3.13Å
3	G	79.4	Confident	75.3	Confident	46 Å²	46	106.1 Å²	106.1	47%	0.474	59%	0.589	S	S	.	*	H	α-helix	trans	-61.5	-44.7	-180	0	0	0	0	0	113.3	L5 L6 L7	G3-L5 PolarHBondContact O-N 3.35Å; G3-L6 PolarHBondContact O-N 3.09Å; G3-L6 VanDerWaalsContact O-N 3.17Å; G3-L7 WeakPolarHBondContact O-CG 3.39Å; G3-L7 PolarHBondContact O-N 3.23Å
4	T	82.5	Confident	74.2	Confident	103 Å²	103	100.9 Å²	100.9	63%	0.632	57%	0.571	S	S	*	*	H	α-helix	trans	-61.9	-40.8	179	-42.6	0	0	0	0	112.5	L6 L7 L8	T4-L6 VanDerWaalsContact C-N 3.33Å; T4-L7 PolarHBondContact O-N 3.13Å; T4-L8 WeakPolarHBondContact O-CB 3.36Å; T4-L8 PolarHBondContact O-N 2.66Å
5	L	81.3	Confident	73.5	Confident	125 Å²	125	103.7 Å²	103.7	65%	0.654	58%	0.578	S	S	*	*	H	α-helix	trans	-66.8	-35.2	176	-76.3	170.6	0	0	0	112.3	K2 G3 G9	K2-L5 PolarHBondContact O-N 3.39Å; G3-L5 PolarHBondContact O-N 3.35Å; L5-G9 PolarHBondContact O-N 3.22Å
6	L	80.8	Confident	72.5	Confident	112 Å²	112	101.6 Å²	101.6	59%	0.586	57%	0.565	S	S	*	*	H	α-helix	trans	-69.1	-44.6	176.1	-172.8	127.2	0	0	0	111.2	K2 G3 T4 L8 G9 L10	K2-L6 PolarHBondContact O-N 3.37Å; K2-L6 VanDerWaalsContact O-N 3.13Å; G3-L6 PolarHBondContact O-N 3.09Å; G3-L6 VanDerWaalsContact O-N 3.17Å; T4-L6 VanDerWaalsContact C-N 3.33Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 2.99Å; L6-G9 PolarHBondContact O-N 3.34Å; L6-L10 HydrophobicContact CD2-CD1 3.59Å; L6-L10 HydrophobicContact CD2-CG 4.46Å; L6-L10 HydrophobicContact CG-CD1 4.18Å; L6-L10 WeakPolarHBondContact O-CB 3.36Å; L6-L10 VanDerWaalsContact O-CG 3.25Å; L6-L10 WeakPolarHBondContact O-CG 3.37Å; L6-L10 PolarHBondContact O-N 3.31Å
7	L	76.9	Confident	71.5	Confident	91 Å²	91	99.1 Å²	99.1	48%	0.476	56%	0.556	S	S	.	*	H	α-helix	trans	-58.7	-46.8	173.5	-68.5	173.9	0	0	0	111.1	G3 T4 G9 L10 L11 L16	G3-L7 WeakPolarHBondContact O-CG 3.39Å; G3-L7 PolarHBondContact O-N 3.23Å; T4-L7 PolarHBondContact O-N 3.13Å; L7-G9 VanDerWaalsContact C-N 3.33Å; L7-G9 PolarHBondContact O-N 3.09Å; L7-L10 PolarHBondContact O-N 2.71Å; L7-L11 WeakPolarHBondContact O-CB 3.39Å; L7-L11 WeakPolarHBondContact O-CD1 3.45Å; L7-L11 PolarHBondContact O-N 2.87Å; L7-L16 HydrophobicContact CB-CD1 4.48Å; L7-L16 HydrophobicContact CD2-CD1 3.31Å; L7-L16 HydrophobicContact CG-CD1 4.47Å
8	L	74.1	Confident	70.5	Confident	104 Å²	104	103.4 Å²	103.4	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-62.5	-42.2	177.3	-158.8	82.3	0	0	0	111.3	T4 L6 L11 V12	T4-L8 WeakPolarHBondContact O-CB 3.36Å; T4-L8 PolarHBondContact O-N 2.66Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 2.99Å; L8-L11 WeakPolarHBondContact O-CB 3.29Å; L8-L11 PolarHBondContact O-N 3.48Å; L8-V12 WeakPolarHBondContact O-CB 3.31Å; L8-V12 WeakPolarHBondContact O-CG2 3.49Å; L8-V12 PolarHBondContact O-N 3.14Å
9	G	77.5	Confident	69.8	Low	33 Å²	33	104.4 Å²	104.4	34%	0.34	57%	0.568	S	S	.	*	H	α-helix	trans	-58.4	-49.1	175.4	0	0	0	0	0	111.6	L5 L6 L7 L11 V12 T13	L5-G9 PolarHBondContact O-N 3.22Å; L6-G9 PolarHBondContact O-N 3.34Å; L7-G9 VanDerWaalsContact C-N 3.33Å; L7-G9 PolarHBondContact O-N 3.09Å; G9-L11 PolarHBondContact O-N 2.87Å; G9-V12 PolarHBondContact O-N 3.36Å; G9-T13 VanDerWaalsContact O-CG2 3.32Å; G9-T13 WeakPolarHBondContact O-CG2 3.22Å; G9-T13 PolarHBondContact O-N 3.02Å; G9-T13 PolarHBondContact O-OG1 3Å
10	L	74.6	Confident	69.4	Low	53 Å²	53	102.5 Å²	102.5	28%	0.277	56%	0.56	S	S	.	*	H	α-helix	trans	-66.2	-35.5	177	-65.9	169.4	0	0	0	112.3	L6 L7 T13 G14 E15 L16	L6-L10 HydrophobicContact CD2-CD1 3.59Å; L6-L10 HydrophobicContact CD2-CG 4.46Å; L6-L10 HydrophobicContact CG-CD1 4.18Å; L6-L10 WeakPolarHBondContact O-CB 3.36Å; L6-L10 VanDerWaalsContact O-CG 3.25Å; L6-L10 WeakPolarHBondContact O-CG 3.37Å; L6-L10 PolarHBondContact O-N 3.31Å; L7-L10 PolarHBondContact O-N 2.71Å; L10-T13 WeakPolarHBondContact CA-OG1 3.26Å; L10-T13 PolarHBondContact O-OG1 3.34Å; L10-G14 CarbonylContact O-C 3.38Å; L10-G14 WeakPolarHBondContact O-CA 3.35Å; L10-G14 PolarHBondContact O-N 2.83Å; L10-E15 HydrophobicContact CB-CB 4.07Å; L10-E15 HydrophobicContact CD2-CB 3.49Å; L10-E15 VanDerWaalsContact CD2-CB 3.49Å; L10-E15 HydrophobicContact CD2-CG 4.01Å; L10-E15 HydrophobicContact CG-CB 4.36Å; L10-E15 PolarHBondContact O-N 2.96Å; L10-L16 HydrophobicContact CB-CB 3.62Å; L10-L16 HydrophobicContact CB-CD1 3.7Å; L10-L16 HydrophobicContact CB-CG 3.81Å; L10-L16 HydrophobicContact CD1-CD1 3.55Å; L10-L16 HydrophobicContact CD1-CG 4.08Å; L10-L16 HydrophobicContact CG-CD1 4.29Å; L10-L16 PolarHBondContact O-N 3.33Å
11	L	67.1	Low	69.6	Low	98 Å²	98	99.3 Å²	99.3	51%	0.513	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-41.9	172.6	-95.7	145.3	0	0	0	111.4	L7 L8 G9 G14 L16	L7-L11 WeakPolarHBondContact O-CB 3.39Å; L7-L11 WeakPolarHBondContact O-CD1 3.45Å; L7-L11 PolarHBondContact O-N 2.87Å; L8-L11 WeakPolarHBondContact O-CB 3.29Å; L8-L11 PolarHBondContact O-N 3.48Å; G9-L11 PolarHBondContact O-N 2.87Å; L11-G14 PolarHBondContact O-N 3.37Å; L11-L16 WeakPolarHBondContact CD2-O 3.14Å; L11-L16 HydrophobicContact CG-CB 4.27Å; L11-L16 WeakPolarHBondContact CG-O 3.26Å
12	V	69.2	Low	70.2	Confident	121 Å²	121	93.3 Å²	93.3	73%	0.733	51%	0.513	S	S	*	.	H	α-helix	trans	-73.5	-37.3	179.8	170.3	0	0	0	0	111.8	L8 G9 G14	L8-V12 WeakPolarHBondContact O-CB 3.31Å; L8-V12 WeakPolarHBondContact O-CG2 3.49Å; L8-V12 PolarHBondContact O-N 3.14Å; G9-V12 PolarHBondContact O-N 3.36Å; V12-G14 VanDerWaalsContact C-N 3.26Å
13	T	74.1	Confident	70.4	Confident	92 Å²	92	85.6 Å²	85.6	56%	0.564	49%	0.486	S	S	*	.	H	α-helix	trans	-76.8	-15.7	174.5	61.6	0	0	0	0	112.7	G9 L10 E15	G9-T13 VanDerWaalsContact O-CG2 3.32Å; G9-T13 WeakPolarHBondContact O-CG2 3.22Å; G9-T13 PolarHBondContact O-N 3.02Å; G9-T13 PolarHBondContact O-OG1 3Å; L10-T13 WeakPolarHBondContact CA-OG1 3.26Å; L10-T13 PolarHBondContact O-OG1 3.34Å; T13-E15 VanDerWaalsContact CB-OE2 3.27Å; T13-E15 WeakPolarHBondContact CB-OE2 3.03Å; T13-E15 PolarHBondContact OG1-OE2 3.09Å
14	G	59.8	Low	70.6	Confident	33 Å²	33	83.8 Å²	83.8	34%	0.34	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-4.5	-177.9	0	0	0	0	0	114.5	L10 L11 V12 L16 S17	L10-G14 CarbonylContact O-C 3.38Å; L10-G14 WeakPolarHBondContact O-CA 3.35Å; L10-G14 PolarHBondContact O-N 2.83Å; L11-G14 PolarHBondContact O-N 3.37Å; V12-G14 VanDerWaalsContact C-N 3.26Å; G14-L16 VanDerWaalsContact C-N 3.28Å; G14-L16 PolarHBondContact O-N 3.09Å; G14-S17 VanDerWaalsContact O-CB 3.32Å; G14-S17 WeakPolarHBondContact O-CB 3.37Å; G14-S17 PolarHBondContact O-N 3.15Å; G14-S17 PolarHBondContact O-OG 3.45Å
15	E	63.6	Low	70.7	Confident	143 Å²	143	79.5 Å²	79.5	67%	0.668	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.7	173.4	-102.9	86	-160	0	0	113.4	L10 T13	L10-E15 HydrophobicContact CB-CB 4.07Å; L10-E15 HydrophobicContact CD2-CB 3.49Å; L10-E15 VanDerWaalsContact CD2-CB 3.49Å; L10-E15 HydrophobicContact CD2-CG 4.01Å; L10-E15 HydrophobicContact CG-CB 4.36Å; L10-E15 PolarHBondContact O-N 2.96Å; T13-E15 VanDerWaalsContact CB-OE2 3.27Å; T13-E15 WeakPolarHBondContact CB-OE2 3.03Å; T13-E15 PolarHBondContact OG1-OE2 3.09Å
16	L	57	Low	71	Confident	71 Å²	71	74.8 Å²	74.8	37%	0.372	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	39.1	169.5	-90.6	172.6	0	0	0	110.1	L7 L10 L11 G14 F18	L7-L16 HydrophobicContact CB-CD1 4.48Å; L7-L16 HydrophobicContact CD2-CD1 3.31Å; L7-L16 HydrophobicContact CG-CD1 4.47Å; L10-L16 HydrophobicContact CB-CB 3.62Å; L10-L16 HydrophobicContact CB-CD1 3.7Å; L10-L16 HydrophobicContact CB-CG 3.81Å; L10-L16 HydrophobicContact CD1-CD1 3.55Å; L10-L16 HydrophobicContact CD1-CG 4.08Å; L10-L16 HydrophobicContact CG-CD1 4.29Å; L10-L16 PolarHBondContact O-N 3.33Å; L11-L16 WeakPolarHBondContact CD2-O 3.14Å; L11-L16 HydrophobicContact CG-CB 4.27Å; L11-L16 WeakPolarHBondContact CG-O 3.26Å; G14-L16 VanDerWaalsContact C-N 3.28Å; G14-L16 PolarHBondContact O-N 3.09Å; L16-F18 PolarHBondContact O-N 3.15Å; L16-F18 VanDerWaalsContact O-N 3.17Å
17	S	55.4	Low	71.2	Confident	59 Å²	59	74.8 Å²	74.8	41%	0.413	41%	0.412	S	S	.	.			trans	-54.5	126.9	157.7	48.8	0	0	0	0	107.1	G14 Q19	G14-S17 VanDerWaalsContact O-CB 3.32Å; G14-S17 WeakPolarHBondContact O-CB 3.37Å; G14-S17 PolarHBondContact O-N 3.15Å; G14-S17 PolarHBondContact O-OG 3.45Å; S17-Q19 PolarHBondContact O-N 2.95Å
18	F	54.7	Low	71.5	Confident	176 Å²	176	71.1 Å²	71.1	77%	0.772	39%	0.392	S	S	*	.			trans	-38.6	132.5	164.2	-140.6	-92.5	0	0	0	106.8	L16 T20 A23	L16-F18 PolarHBondContact O-N 3.15Å; L16-F18 VanDerWaalsContact O-N 3.17Å; F18-T20 WeakPolarHBondContact O-CA 3.35Å; F18-T20 WeakPolarHBondContact O-CG2 3.18Å; F18-T20 PolarHBondContact O-N 3.14Å; F18-A23 HydrophobicContact CD1-CB 4.45Å
19	Q	56.3	Low	72.1	Confident	123 Å²	123	69.5 Å²	69.5	58%	0.575	38%	0.382	S	S	*	.			trans	-45.4	93.2	-176.3	-93.6	-175.9	-4	0	0	109.9	S17 T21 E22 A23	S17-Q19 PolarHBondContact O-N 2.95Å; Q19-T21 PolarHBondContact O-N 3Å; Q19-T21 VanDerWaalsContact O-N 3.16Å; Q19-E22 HydrophobicContact CB-CG 4.42Å; Q19-E22 PolarHBondContact O-N 2.81Å; Q19-E22 VanDerWaalsContact O-N 3.1Å; Q19-A23 PolarHBondContact O-N 3.11Å; Q19-A23 VanDerWaalsContact O-N 3.17Å
20	T	62.9	Low	72.6	Confident	66 Å²	66	69 Å²	69	41%	0.405	38%	0.376	S	S	.	.	H	α-helix	trans	-68.6	-23.7	-169.4	49.3	0	0	0	0	108.5	F18 E22 A23 C24	F18-T20 WeakPolarHBondContact O-CA 3.35Å; F18-T20 WeakPolarHBondContact O-CG2 3.18Å; F18-T20 PolarHBondContact O-N 3.14Å; T20-E22 PolarHBondContact O-N 3.24Å; T20-A23 PolarHBondContact O-N 3.34Å; T20-C24 WeakPolarHBondContact O-CA 3.49Å; T20-C24 WeakPolarHBondContact O-CB 3.47Å; T20-C24 PolarHBondContact O-N 2.94Å
21	T	72.7	Confident	73	Confident	35 Å²	35	69.6 Å²	69.6	22%	0.215	38%	0.375	C	S	.	.	H	α-helix	trans	-47.5	-53.6	168.5	50.4	0	0	0	0	113.1	Q19 C24 E89 Y94	Q19-T21 PolarHBondContact O-N 3Å; Q19-T21 VanDerWaalsContact O-N 3.16Å; T21-C24 PolarHBondContact O-SG 3.49Å; T21-E89 HydrophobicContact CG2-CB 3.52Å; T21-E89 HydrophobicContact CG2-CG 4.17Å; T21-Y94 WeakPolarHBondContact O-CE2 3.21Å
22	E	77.1	Confident	73.8	Confident	83 Å²	83	65.5 Å²	65.5	39%	0.388	36%	0.355	S	S	.	.	H	α-helix	trans	-88	-30.1	-175.4	-49.2	-158.4	143.7	0	0	111	Q19 T20 P26 Y93 Y94	Q19-E22 HydrophobicContact CB-CG 4.42Å; Q19-E22 PolarHBondContact O-N 2.81Å; Q19-E22 VanDerWaalsContact O-N 3.1Å; T20-E22 PolarHBondContact O-N 3.24Å; E22-P26 VanDerWaalsContact O-CD 3.31Å; E22-P26 WeakPolarHBondContact O-CD 3.48Å; E22-P26 WeakPolarHBondContact O-CG 3.25Å; E22-Y93 HydrophobicContact CB-CE1 4.15Å; E22-Y93 HydrophobicContact CB-CE2 4.44Å; E22-Y93 HydrophobicContact CG-CD2 4.01Å; E22-Y93 HydrophobicContact CG-CE1 4.06Å; E22-Y93 HydrophobicContact CG-CE2 3.49Å; E22-Y93 VanDerWaalsContact CG-CE2 3.49Å; E22-Y93 HydrophobicContact CG-CG 4.48Å; E22-Y93 VanDerWaalsContact CG-CZ 3.49Å; E22-Y93 WeakPolarHBondContact OE1-CE2 3.49Å; E22-Y93 VanDerWaalsContact OE1-CZ 3.23Å; E22-Y93 PolarHBondContact OE1-OH 3.49Å; E22-Y94 PolarHBondContact O-OH 3.11Å
23	A	81.5	Confident	74.7	Confident	31 Å²	31	59.8 Å²	59.8	26%	0.256	32%	0.321	S	S	.	.	H	α-helix	trans	-83.8	-12.4	-177.4	0	0	0	0	0	113.6	F18 Q19 T20 V25 F27	F18-A23 HydrophobicContact CD1-CB 4.45Å; Q19-A23 PolarHBondContact O-N 3.11Å; Q19-A23 VanDerWaalsContact O-N 3.17Å; T20-A23 PolarHBondContact O-N 3.34Å; A23-V25 PolarHBondContact O-N 2.54Å; A23-F27 WeakPolarHBondContact O-CB 3.49Å; A23-F27 PolarHBondContact O-N 2.84Å
24	C	84.1	Confident	75.4	Confident	8 Å²	8	55.9 Å²	55.9	5%	0.054	30%	0.297	C	S	.	.	H	α-helix	trans	-60.1	-50.2	-171	57.3	0	0	0	0	113.4	T20 T21 F28 C90 Y94	T20-C24 WeakPolarHBondContact O-CA 3.49Å; T20-C24 WeakPolarHBondContact O-CB 3.47Å; T20-C24 PolarHBondContact O-N 2.94Å; T21-C24 PolarHBondContact O-SG 3.49Å; C24-F28 WeakPolarHBondContact O-CB 3.39Å; C24-F28 PolarHBondContact O-N 3.4Å; C24-C90 HydrophobicContact CB-CB 3.64Å; C24-C90 WeakPolarHBondContact CB-SG 3.37Å; C24-C90 VanDerWaalsContact SG-CA 3.57Å; C24-C90 WeakPolarHBondContact SG-CB 3.44Å; C24-C90 CovalentContact SG-SG 2.02Å; C24-C90 PolarHBondContact SG-SG 3.46Å; C24-Y94 VanDerWaalsContact SG-CD2 3.57Å; C24-Y94 VanDerWaalsContact SG-CE2 3.56Å
25	V	85.1	Confident	76.5	Confident	12 Å²	12	54.9 Å²	54.9	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-70.7	-48.9	179.5	173.6	0	0	0	0	110.8	A23 F27 F28 E29 Y94 I99 I102	A23-V25 PolarHBondContact O-N 2.54Å; V25-F27 VanDerWaalsContact C-N 3.28Å; V25-F27 PolarHBondContact O-N 3.49Å; V25-F28 WeakPolarHBondContact O-CA 3.35Å; V25-F28 WeakPolarHBondContact O-CB 3.26Å; V25-F28 PolarHBondContact O-N 2.75Å; V25-F28 VanDerWaalsContact O-N 3.08Å; V25-E29 HydrophobicContact CG1-CG 4.18Å; V25-E29 WeakPolarHBondContact O-CG 3.41Å; V25-E29 PolarHBondContact O-N 3.44Å; V25-Y94 HydrophobicContact CB-CD1 4.37Å; V25-Y94 HydrophobicContact CB-CD2 4.12Å; V25-Y94 HydrophobicContact CB-CE1 4.01Å; V25-Y94 HydrophobicContact CB-CE2 3.74Å; V25-Y94 HydrophobicContact CB-CG 4.43Å; V25-Y94 HydrophobicContact CG1-CE1 4.46Å; V25-Y94 HydrophobicContact CG2-CD1 4.03Å; V25-Y94 HydrophobicContact CG2-CD2 3.49Å; V25-Y94 VanDerWaalsContact CG2-CD2 3.49Å; V25-Y94 HydrophobicContact CG2-CE1 4.17Å; V25-Y94 HydrophobicContact CG2-CE2 3.65Å; V25-Y94 HydrophobicContact CG2-CG 3.71Å; V25-I99 HydrophobicContact CG2-CG1 4.31Å; V25-I102 HydrophobicContact CG1-CD1 3.99Å; V25-I102 HydrophobicContact CG2-CD1 4.06Å
26	P	87.1	Confident	77.3	Confident	27 Å²	27	50.7 Å²	50.7	18%	0.175	27%	0.271	C	S	.	.	H	α-helix	trans	-49.5	-44.5	170.4	-37.1	40.1	0	0	0	114.7	E22 E29 G30 F49 Y94	E22-P26 VanDerWaalsContact O-CD 3.31Å; E22-P26 WeakPolarHBondContact O-CD 3.48Å; E22-P26 WeakPolarHBondContact O-CG 3.25Å; P26-E29 PolarHBondContact O-N 3.13Å; P26-G30 PolarHBondContact O-N 3.16Å; P26-F49 HydrophobicContact CB-CE1 3.99Å; P26-F49 HydrophobicContact CB-CE2 4.26Å; P26-F49 HydrophobicContact CB-CZ 3.47Å; P26-F49 VanDerWaalsContact CB-CZ 3.47Å; P26-F49 HydrophobicContact CG-CE1 4.35Å; P26-F49 HydrophobicContact CG-CZ 3.91Å; P26-Y94 WeakPolarHBondContact CD-OH 3.48Å
27	F	84.2	Confident	78.6	Confident	111 Å²	111	48 Å²	48	49%	0.487	26%	0.26	S	S	.	.	H	α-helix	trans	-67.5	-43.9	178.6	-177.5	-89.3	0	0	0	111	A23 V25 Y31 M84	A23-F27 WeakPolarHBondContact O-CB 3.49Å; A23-F27 PolarHBondContact O-N 2.84Å; V25-F27 VanDerWaalsContact C-N 3.28Å; V25-F27 PolarHBondContact O-N 3.49Å; F27-Y31 WeakPolarHBondContact O-CB 3.42Å; F27-Y31 PolarHBondContact O-N 2.87Å; F27-M84 HydrophobicContact CD1-CE 3.74Å; F27-M84 HydrophobicContact CD1-SD 3.75Å; F27-M84 HydrophobicContact CE1-CE 3.51Å; F27-M84 HydrophobicContact CE1-SD 3.67Å
28	F	83.5	Confident	80.2	Confident	14 Å²	14	47.3 Å²	47.3	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-56.7	-50.8	173.9	170.4	-86.5	0	0	0	111.2	C24 V25 Y31 A32 M81 V85 I102 L106	C24-F28 WeakPolarHBondContact O-CB 3.39Å; C24-F28 PolarHBondContact O-N 3.4Å; V25-F28 WeakPolarHBondContact O-CA 3.35Å; V25-F28 WeakPolarHBondContact O-CB 3.26Å; V25-F28 PolarHBondContact O-N 2.75Å; V25-F28 VanDerWaalsContact O-N 3.08Å; F28-Y31 PolarHBondContact O-N 3.43Å; F28-A32 HydrophobicContact CE1-CB 4.38Å; F28-A32 HydrophobicContact CZ-CB 4.48Å; F28-A32 WeakPolarHBondContact O-CB 3.24Å; F28-A32 PolarHBondContact O-N 3.32Å; F28-M81 HydrophobicContact CD2-CB 4.16Å; F28-M81 HydrophobicContact CD2-CE 3.41Å; F28-M81 VanDerWaalsContact CD2-CE 3.41Å; F28-M81 HydrophobicContact CE2-CB 4.37Å; F28-M81 HydrophobicContact CE2-CE 3.53Å; F28-M81 HydrophobicContact CE2-SD 4.4Å; F28-M81 HydrophobicContact CG-CE 4.15Å; F28-M81 HydrophobicContact CZ-CE 4.4Å; F28-V85 HydrophobicContact CB-CG2 3.86Å; F28-V85 HydrophobicContact CD2-CG2 3.9Å; F28-V85 HydrophobicContact CG-CG2 4.03Å; F28-I102 HydrophobicContact CD1-CD1 4.18Å; F28-I102 HydrophobicContact CD1-CG1 4.45Å; F28-I102 HydrophobicContact CD1-CG2 3.9Å; F28-I102 HydrophobicContact CD2-CG2 3.84Å; F28-I102 HydrophobicContact CE1-CD1 4.45Å; F28-I102 HydrophobicContact CE1-CG1 4.22Å; F28-I102 HydrophobicContact CE1-CG2 3.65Å; F28-I102 HydrophobicContact CE2-CG2 3.62Å; F28-I102 HydrophobicContact CG-CG2 4.03Å; F28-I102 HydrophobicContact CZ-CG2 3.54Å; F28-L106 HydrophobicContact CD2-CD1 4.33Å; F28-L106 HydrophobicContact CE2-CD1 3.87Å; F28-L106 HydrophobicContact CE2-CD2 3.97Å; F28-L106 HydrophobicContact CE2-CG 4Å
29	E	86.8	Confident	82	Confident	71 Å²	71	42.4 Å²	42.4	33%	0.332	23%	0.232	S	C	.	.	H	α-helix	trans	-66.2	-45.7	-177.7	-70.2	178.5	153.8	0	0	111.3	V25 P26 Y31 A32 S33	V25-E29 HydrophobicContact CG1-CG 4.18Å; V25-E29 WeakPolarHBondContact O-CG 3.41Å; V25-E29 PolarHBondContact O-N 3.44Å; P26-E29 PolarHBondContact O-N 3.13Å; E29-Y31 PolarHBondContact O-N 3.06Å; E29-A32 PolarHBondContact O-N 3.17Å; E29-S33 VanDerWaalsContact O-CB 3.29Å; E29-S33 WeakPolarHBondContact O-CB 3.34Å; E29-S33 PolarHBondContact O-N 3.18Å
30	G	87.6	Confident	83.8	Confident	22 Å²	22	41.5 Å²	41.5	23%	0.227	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-50.9	174.4	0	0	0	0	0	111.9	P26 S33 V34	P26-G30 PolarHBondContact O-N 3.16Å; G30-S33 PolarHBondContact O-N 2.89Å; G30-S33 PolarHBondContact O-OG 3.28Å; G30-V34 WeakPolarHBondContact O-CG2 2.92Å; G30-V34 PolarHBondContact O-N 2.92Å; G30-V34 VanDerWaalsContact O-N 3.17Å
31	Y	84.2	Confident	85.3	Confident	65 Å²	65	42.7 Å²	42.7	26%	0.255	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-48.2	177.1	-176.7	-83.6	0	0	0	111.7	F27 F28 E29 S33 V34 V35 M81	F27-Y31 WeakPolarHBondContact O-CB 3.42Å; F27-Y31 PolarHBondContact O-N 2.87Å; F28-Y31 PolarHBondContact O-N 3.43Å; E29-Y31 PolarHBondContact O-N 3.06Å; Y31-S33 VanDerWaalsContact C-N 3.28Å; Y31-S33 PolarHBondContact O-N 3.46Å; Y31-V34 PolarHBondContact O-N 3.3Å; Y31-V34 VanDerWaalsContact O-N 3.16Å; Y31-V35 HydrophobicContact CD1-CG1 4Å; Y31-V35 HydrophobicContact CD1-CG2 4.22Å; Y31-V35 HydrophobicContact CE1-CB 4.47Å; Y31-V35 HydrophobicContact CE1-CG1 3.55Å; Y31-V35 HydrophobicContact CE1-CG2 4.12Å; Y31-V35 HydrophobicContact CE2-CG1 4.37Å; Y31-V35 WeakPolarHBondContact O-CG2 3.48Å; Y31-V35 PolarHBondContact O-N 3.23Å; Y31-M81 HydrophobicContact CD1-CE 3.34Å; Y31-M81 HydrophobicContact CD1-CG 4.5Å; Y31-M81 HydrophobicContact CD1-SD 3.63Å; Y31-M81 HydrophobicContact CE1-CE 4.07Å; Y31-M81 HydrophobicContact CE1-SD 3.71Å; Y31-M81 HydrophobicContact CG-CE 4.1Å
32	A	83.9	Confident	86.3	Confident	12 Å²	12	41 Å²	41	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-42.4	178.2	0	0	0	0	0	111.3	F28 E29 V34 V35 S36 W41 M81	F28-A32 HydrophobicContact CE1-CB 4.38Å; F28-A32 HydrophobicContact CZ-CB 4.48Å; F28-A32 WeakPolarHBondContact O-CB 3.24Å; F28-A32 PolarHBondContact O-N 3.32Å; E29-A32 PolarHBondContact O-N 3.17Å; A32-V34 VanDerWaalsContact C-N 3.34Å; A32-V34 PolarHBondContact O-N 3.49Å; A32-V35 WeakPolarHBondContact O-CG2 3.4Å; A32-V35 PolarHBondContact O-N 3.2Å; A32-S36 WeakPolarHBondContact O-CB 3.47Å; A32-S36 PolarHBondContact O-N 2.95Å; A32-S36 PolarHBondContact O-OG 3.38Å; A32-W41 HydrophobicContact CB-CH2 4.04Å; A32-W41 HydrophobicContact CB-CZ2 4.34Å; A32-M81 HydrophobicContact CB-CE 4.37Å
33	S	88.3	Confident	87.1	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-41.3	178.3	82.5	0	0	0	0	111.8	E29 G30 Y31 S36 Q63	E29-S33 VanDerWaalsContact O-CB 3.29Å; E29-S33 WeakPolarHBondContact O-CB 3.34Å; E29-S33 PolarHBondContact O-N 3.18Å; G30-S33 PolarHBondContact O-N 2.89Å; G30-S33 PolarHBondContact O-OG 3.28Å; Y31-S33 VanDerWaalsContact C-N 3.28Å; Y31-S33 PolarHBondContact O-N 3.46Å; S33-S36 PolarHBondContact O-OG 3.1Å; S33-Q63 PolarHBondContact O-NE2 3.01Å
34	V	87.7	Confident	87.8	Confident	11 Å²	11	45.8 Å²	45.8	7%	0.067	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-53.3	177.4	172.5	0	0	0	0	110	G30 Y31 A32 S36 G37 M42 L59 I62 Q63 Y66	G30-V34 WeakPolarHBondContact O-CG2 2.92Å; G30-V34 PolarHBondContact O-N 2.92Å; G30-V34 VanDerWaalsContact O-N 3.17Å; Y31-V34 PolarHBondContact O-N 3.3Å; Y31-V34 VanDerWaalsContact O-N 3.16Å; A32-V34 VanDerWaalsContact C-N 3.34Å; A32-V34 PolarHBondContact O-N 3.49Å; V34-S36 VanDerWaalsContact C-N 3.32Å; V34-S36 PolarHBondContact O-N 3.48Å; V34-G37 PolarHBondContact O-N 3.16Å; V34-M42 HydrophobicContact CG2-CG 4.41Å; V34-M42 HydrophobicContact CG2-SD 4.12Å; V34-L59 HydrophobicContact CG2-CD2 4.04Å; V34-I62 HydrophobicContact CG1-CB 4.34Å; V34-I62 HydrophobicContact CG1-CG2 3.67Å; V34-Q63 HydrophobicContact CG1-CB 4.2Å; V34-Q63 WeakPolarHBondContact O-CG 3.38Å; V34-Q63 PolarHBondContact O-NE2 3.1Å; V34-Q63 VanDerWaalsContact O-NE2 3.13Å; V34-Y66 HydrophobicContact CG1-CD2 4.12Å; V34-Y66 HydrophobicContact CG1-CE2 4.28Å
35	V	82.1	Confident	88.2	Confident	11 Å²	11	46.5 Å²	46.5	7%	0.067	24%	0.237	C	C	.	.	H	α-helix	trans	-72.8	-23.3	-175.6	-55.1	0	0	0	0	113.3	Y31 A32 G37 Y66 I74	Y31-V35 HydrophobicContact CD1-CG1 4Å; Y31-V35 HydrophobicContact CD1-CG2 4.22Å; Y31-V35 HydrophobicContact CE1-CB 4.47Å; Y31-V35 HydrophobicContact CE1-CG1 3.55Å; Y31-V35 HydrophobicContact CE1-CG2 4.12Å; Y31-V35 HydrophobicContact CE2-CG1 4.37Å; Y31-V35 WeakPolarHBondContact O-CG2 3.48Å; Y31-V35 PolarHBondContact O-N 3.23Å; A32-V35 WeakPolarHBondContact O-CG2 3.4Å; A32-V35 PolarHBondContact O-N 3.2Å; V35-G37 PolarHBondContact O-N 3.35Å; V35-G37 VanDerWaalsContact O-N 3.14Å; V35-Y66 HydrophobicContact CG1-CD1 4.25Å; V35-Y66 HydrophobicContact CG1-CD2 4.11Å; V35-Y66 HydrophobicContact CG1-CE1 4.05Å; V35-Y66 HydrophobicContact CG1-CE2 3.91Å; V35-Y66 HydrophobicContact CG1-CG 4.28Å; V35-I74 HydrophobicContact CB-CG2 3.98Å; V35-I74 HydrophobicContact CG2-CG2 4.08Å; V35-I74 WeakPolarHBondContact O-CD1 3.46Å
36	S	82.1	Confident	88.5	Confident	56 Å²	56	46.5 Å²	46.5	39%	0.392	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.9	176.7	74.1	0	0	0	0	113.5	A32 S33 V34 S38	A32-S36 WeakPolarHBondContact O-CB 3.47Å; A32-S36 PolarHBondContact O-N 2.95Å; A32-S36 PolarHBondContact O-OG 3.38Å; S33-S36 PolarHBondContact O-OG 3.1Å; V34-S36 VanDerWaalsContact C-N 3.32Å; V34-S36 PolarHBondContact O-N 3.48Å; S36-S38 PolarHBondContact O-N 3.46Å; S36-S38 WeakPolarHBondContact OG-CB 3.19Å; S36-S38 PolarHBondContact OG-N 3.01Å
37	G	83.6	Confident	88.9	Confident	14 Å²	14	52.6 Å²	52.6	14%	0.144	26%	0.263	C	S	.	.			trans	72.2	-1.2	-170.3	0	0	0	0	0	113.8	V34 V35 R39 Q63 R67	V34-G37 PolarHBondContact O-N 3.16Å; V35-G37 PolarHBondContact O-N 3.35Å; V35-G37 VanDerWaalsContact O-N 3.14Å; G37-R39 PolarHBondContact O-N 3.45Å; G37-Q63 VanDerWaalsContact C-NE2 3.32Å; G37-Q63 PolarHBondContact O-OE1 3.43Å; G37-R67 PolarHBondContact O-NE 3.31Å; G37-R67 PolarHBondContact O-NH2 2.96Å
38	S	89.6	Confident	89.3	Confident	45 Å²	45	50.6 Å²	50.6	32%	0.315	27%	0.267	S	S	.	.			trans	-77.8	113	179	-178.6	0	0	0	0	111	S36 V40 W41 M42 Q63	S36-S38 PolarHBondContact O-N 3.46Å; S36-S38 WeakPolarHBondContact OG-CB 3.19Å; S36-S38 PolarHBondContact OG-N 3.01Å; S38-V40 VanDerWaalsContact C-N 3.33Å; S38-W41 PolarHBondContact OG-N 2.97Å; S38-M42 VanDerWaalsContact O-CB 3.26Å; S38-M42 WeakPolarHBondContact O-CB 3.18Å; S38-M42 PolarHBondContact O-N 3.03Å; S38-M42 VanDerWaalsContact O-N 3.11Å; S38-Q63 PolarHBondContact O-NE2 3.04Å
39	R	92.2	Very high	89.6	Confident	73 Å²	73	55.6 Å²	55.6	28%	0.275	29%	0.288	S	S	.	.	H	α-helix	trans	-66.9	-37.7	173.7	-74	-75.4	163.6	139.8	-4.1	111.9	G37 M42 Y43 E60 Q63	G37-R39 PolarHBondContact O-N 3.45Å; R39-M42 PolarHBondContact O-N 2.93Å; R39-Y43 HydrophobicContact CB-CD2 4.35Å; R39-Y43 HydrophobicContact CB-CE2 4.14Å; R39-Y43 WeakPolarHBondContact O-CB 3.13Å; R39-Y43 WeakPolarHBondContact O-CD2 3.28Å; R39-Y43 PolarHBondContact O-N 3.11Å; R39-E60 VanDerWaalsContact NH1-CB 3.3Å; R39-E60 IonicContact NH1-OE1 3.92Å; R39-E60 IonicContact NH1-OE2 2.87Å; R39-E60 PolarHBondContact NH1-OE2 2.86Å; R39-E60 PolarHBondContact NH2-O 2.79Å; R39-Q63 VanDerWaalsContact CD-OE1 3.27Å
40	V	94.6	Very high	90	Very high	104 Å²	104	59.2 Å²	59.2	63%	0.63	31%	0.31	S	S	*	.	H	α-helix	trans	-62.6	-50.7	-178.9	176.5	0	0	0	0	110.3	S38 Y43 Q44	S38-V40 VanDerWaalsContact C-N 3.33Å; V40-Y43 PolarHBondContact O-N 3.16Å; V40-Q44 WeakPolarHBondContact O-CG 3.48Å; V40-Q44 PolarHBondContact O-N 3Å; V40-Q44 VanDerWaalsContact O-N 3.16Å
41	W	92.9	Very high	90.2	Very high	90 Å²	90	58.8 Å²	58.8	34%	0.341	31%	0.305	S	S	.	.	H	α-helix	trans	-63.7	-47.9	178.8	-174.5	2.7	0	0	0	110.8	A32 S38 Y43 Q44 E45	A32-W41 HydrophobicContact CB-CH2 4.04Å; A32-W41 HydrophobicContact CB-CZ2 4.34Å; S38-W41 PolarHBondContact OG-N 2.97Å; W41-Y43 VanDerWaalsContact C-N 3.3Å; W41-Y43 PolarHBondContact O-N 3.49Å; W41-Q44 WeakPolarHBondContact O-CA 3.36Å; W41-Q44 WeakPolarHBondContact O-CB 3.37Å; W41-Q44 PolarHBondContact O-N 3.36Å; W41-E45 PolarHBondContact NE1-OE1 3.05Å; W41-E45 PolarHBondContact O-N 3.43Å
42	M	93.6	Very high	90.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.1	-39	-179.9	-173.8	-178.9	73.1	0	0	112.9	V34 S38 R39 Q44 E45 F46 L59 E60 Q63	V34-M42 HydrophobicContact CG2-CG 4.41Å; V34-M42 HydrophobicContact CG2-SD 4.12Å; S38-M42 VanDerWaalsContact O-CB 3.26Å; S38-M42 WeakPolarHBondContact O-CB 3.18Å; S38-M42 PolarHBondContact O-N 3.03Å; S38-M42 VanDerWaalsContact O-N 3.11Å; R39-M42 PolarHBondContact O-N 2.93Å; M42-Q44 VanDerWaalsContact C-N 3.34Å; M42-Q44 PolarHBondContact O-N 3.49Å; M42-E45 PolarHBondContact O-N 3.45Å; M42-F46 HydrophobicContact CE-CE2 3.86Å; M42-F46 HydrophobicContact CE-CZ 3.85Å; M42-F46 HydrophobicContact CG-CD1 4.35Å; M42-F46 HydrophobicContact CG-CE1 3.5Å; M42-F46 HydrophobicContact CG-CE2 3.82Å; M42-F46 HydrophobicContact CG-CZ 3.21Å; M42-F46 WeakPolarHBondContact O-CD1 3.4Å; M42-F46 WeakPolarHBondContact O-CG 3.29Å; M42-F46 PolarHBondContact O-N 2.93Å; M42-F46 HydrophobicContact SD-CE1 4.34Å; M42-F46 HydrophobicContact SD-CE2 4.22Å; M42-F46 HydrophobicContact SD-CZ 3.6Å; M42-F46 VanDerWaalsContact SD-CZ 3.6Å; M42-L59 HydrophobicContact SD-CB 4.5Å; M42-E60 HydrophobicContact CE-CB 4.36Å; M42-E60 HydrophobicContact CE-CG 3.65Å; M42-Q63 HydrophobicContact SD-CB 3.98Å; M42-Q63 HydrophobicContact SD-CG 4.48Å
43	Y	95.4	Very high	91.3	Very high	99 Å²	99	61.3 Å²	61.3	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-69.7	-28.6	174.6	-73	-50.5	0	0	0	113.8	R39 V40 W41 F46 Q47 E60	R39-Y43 HydrophobicContact CB-CD2 4.35Å; R39-Y43 HydrophobicContact CB-CE2 4.14Å; R39-Y43 WeakPolarHBondContact O-CB 3.13Å; R39-Y43 WeakPolarHBondContact O-CD2 3.28Å; R39-Y43 PolarHBondContact O-N 3.11Å; V40-Y43 PolarHBondContact O-N 3.16Å; W41-Y43 VanDerWaalsContact C-N 3.3Å; W41-Y43 PolarHBondContact O-N 3.49Å; Y43-F46 AromaticContact CD1-CD2 3.66Å; Y43-F46 HydrophobicContact CD1-CD2 3.66Å; Y43-F46 HydrophobicContact CD1-CE2 4.11Å; Y43-F46 HydrophobicContact CE1-CD2 4.14Å; Y43-F46 HydrophobicContact CE1-CE2 4.23Å; Y43-F46 PolarHBondContact O-N 3.07Å; Y43-Q47 PolarHBondContact O-N 3.26Å; Y43-E60 VanDerWaalsContact CE1-OE1 3.26Å; Y43-E60 WeakPolarHBondContact CE1-OE1 3.42Å; Y43-E60 VanDerWaalsContact CZ-OE1 3.28Å; Y43-E60 PolarHBondContact OH-OE1 2.88Å
44	Q	94.3	Very high	91.7	Very high	115 Å²	115	68.1 Å²	68.1	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-65.4	-45.1	172.2	-71.8	171.7	-31.8	0	0	110.5	V40 W41 M42 F46 Q47 A48	V40-Q44 WeakPolarHBondContact O-CG 3.48Å; V40-Q44 PolarHBondContact O-N 3Å; V40-Q44 VanDerWaalsContact O-N 3.16Å; W41-Q44 WeakPolarHBondContact O-CA 3.36Å; W41-Q44 WeakPolarHBondContact O-CB 3.37Å; W41-Q44 PolarHBondContact O-N 3.36Å; M42-Q44 VanDerWaalsContact C-N 3.34Å; M42-Q44 PolarHBondContact O-N 3.49Å; Q44-F46 VanDerWaalsContact C-N 3.33Å; Q44-F46 PolarHBondContact O-N 3.11Å; Q44-Q47 PolarHBondContact O-N 3.27Å; Q44-Q47 VanDerWaalsContact O-N 3.16Å; Q44-A48 PolarHBondContact O-N 3.3Å
45	E	92.6	Very high	91.9	Very high	24 Å²	24	72.2 Å²	72.2	11%	0.112	38%	0.382	C	S	.	.	H	α-helix	trans	-59.5	-44.7	173.9	-61.3	-53.1	143.3	0	0	111.1	W41 M42 Q47 A48 F49	W41-E45 PolarHBondContact NE1-OE1 3.05Å; W41-E45 PolarHBondContact O-N 3.43Å; M42-E45 PolarHBondContact O-N 3.45Å; E45-Q47 PolarHBondContact O-N 3.37Å; E45-A48 PolarHBondContact O-N 3.5Å; E45-A48 VanDerWaalsContact O-N 3.09Å; E45-F49 VanDerWaalsContact O-CD2 3.28Å; E45-F49 WeakPolarHBondContact O-CD2 3.12Å; E45-F49 PolarHBondContact O-N 3.03Å; E45-F49 VanDerWaalsContact O-N 3.09Å
46	F	93.2	Very high	92.5	Very high	11 Å²	11	75.2 Å²	75.2	5%	0.048	39%	0.394	C	S	.	.	H	α-helix	trans	-61.3	-31.9	178	-65.8	-6.1	0	0	0	113.4	M42 Y43 Q44 D50 A51 K56 L59	M42-F46 HydrophobicContact CE-CE2 3.86Å; M42-F46 HydrophobicContact CE-CZ 3.85Å; M42-F46 HydrophobicContact CG-CD1 4.35Å; M42-F46 HydrophobicContact CG-CE1 3.5Å; M42-F46 HydrophobicContact CG-CE2 3.82Å; M42-F46 HydrophobicContact CG-CZ 3.21Å; M42-F46 WeakPolarHBondContact O-CD1 3.4Å; M42-F46 WeakPolarHBondContact O-CG 3.29Å; M42-F46 PolarHBondContact O-N 2.93Å; M42-F46 HydrophobicContact SD-CE1 4.34Å; M42-F46 HydrophobicContact SD-CE2 4.22Å; M42-F46 HydrophobicContact SD-CZ 3.6Å; M42-F46 VanDerWaalsContact SD-CZ 3.6Å; Y43-F46 AromaticContact CD1-CD2 3.66Å; Y43-F46 HydrophobicContact CD1-CD2 3.66Å; Y43-F46 HydrophobicContact CD1-CE2 4.11Å; Y43-F46 HydrophobicContact CE1-CD2 4.14Å; Y43-F46 HydrophobicContact CE1-CE2 4.23Å; Y43-F46 PolarHBondContact O-N 3.07Å; Q44-F46 VanDerWaalsContact C-N 3.33Å; Q44-F46 PolarHBondContact O-N 3.11Å; F46-D50 PolarHBondContact O-N 2.64Å; F46-A51 HydrophobicContact CB-CB 3.84Å; F46-A51 HydrophobicContact CD1-CB 4.35Å; F46-A51 HydrophobicContact CG-CB 4.13Å; F46-A51 PolarHBondContact O-N 2.75Å; F46-K56 HydrophobicContact CB-CG 4.34Å; F46-K56 HydrophobicContact CD2-CB 4.01Å; F46-K56 HydrophobicContact CD2-CD 4.21Å; F46-K56 HydrophobicContact CD2-CG 3.49Å; F46-K56 VanDerWaalsContact CD2-CG 3.49Å; F46-K56 HydrophobicContact CE2-CB 4.02Å; F46-K56 HydrophobicContact CE2-CG 4Å; F46-K56 HydrophobicContact CG-CG 4.11Å; F46-L59 HydrophobicContact CD1-CD1 4.13Å; F46-L59 HydrophobicContact CE1-CB 3.85Å; F46-L59 HydrophobicContact CE1-CD1 3.29Å; F46-L59 HydrophobicContact CE1-CG 4.17Å; F46-L59 HydrophobicContact CE2-CB 4.34Å; F46-L59 HydrophobicContact CZ-CB 3.33Å; F46-L59 HydrophobicContact CZ-CD1 3.68Å; F46-L59 HydrophobicContact CZ-CG 4.13Å
47	Q	94.4	Very high	93.1	Very high	156 Å²	156	76 Å²	76	73%	0.729	40%	0.396	S	S	*	.	H	α-helix	trans	-75.5	-38.4	175.5	-175.2	170.1	44.8	0	0	111.5	Y43 Q44 E45 F49 D50	Y43-Q47 PolarHBondContact O-N 3.26Å; Q44-Q47 PolarHBondContact O-N 3.27Å; Q44-Q47 VanDerWaalsContact O-N 3.16Å; E45-Q47 PolarHBondContact O-N 3.37Å; Q47-F49 PolarHBondContact O-N 2.81Å; Q47-D50 PolarHBondContact O-N 3.36Å
48	A	92.4	Very high	93.7	Very high	69 Å²	69	77.5 Å²	77.5	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-63.3	-30.3	177.5	0	0	0	0	0	112.7	Q44 E45	Q44-A48 PolarHBondContact O-N 3.3Å; E45-A48 PolarHBondContact O-N 3.5Å; E45-A48 VanDerWaalsContact O-N 3.09Å
49	F	90.6	Very high	93.8	Very high	118 Å²	118	78 Å²	78	52%	0.518	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	16.5	-178.7	-64.3	-72.9	0	0	0	114.4	P26 E45 Q47 A51	P26-F49 HydrophobicContact CB-CE1 3.99Å; P26-F49 HydrophobicContact CB-CE2 4.26Å; P26-F49 HydrophobicContact CB-CZ 3.47Å; P26-F49 VanDerWaalsContact CB-CZ 3.47Å; P26-F49 HydrophobicContact CG-CE1 4.35Å; P26-F49 HydrophobicContact CG-CZ 3.91Å; E45-F49 VanDerWaalsContact O-CD2 3.28Å; E45-F49 WeakPolarHBondContact O-CD2 3.12Å; E45-F49 PolarHBondContact O-N 3.03Å; E45-F49 VanDerWaalsContact O-N 3.09Å; Q47-F49 PolarHBondContact O-N 2.81Å; F49-A51 PolarHBondContact O-N 3.37Å; F49-A51 VanDerWaalsContact O-N 3.12Å
50	D	94.5	Very high	93.9	Very high	147 Å²	147	76.8 Å²	76.8	79%	0.786	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	41	177.6	-69.1	-48.2	0	0	0	114	F46 Q47 T52	F46-D50 PolarHBondContact O-N 2.64Å; Q47-D50 PolarHBondContact O-N 3.36Å; D50-T52 PolarHBondContact O-N 3.22Å
51	A	93	Very high	93.8	Very high	14 Å²	14	78.8 Å²	78.8	12%	0.116	40%	0.404	C	S	.	.			trans	-59	134.9	-174.9	0	0	0	0	0	111.8	F46 F49 E55 K56	F46-A51 HydrophobicContact CB-CB 3.84Å; F46-A51 HydrophobicContact CD1-CB 4.35Å; F46-A51 HydrophobicContact CG-CB 4.13Å; F46-A51 PolarHBondContact O-N 2.75Å; F49-A51 PolarHBondContact O-N 3.37Å; F49-A51 VanDerWaalsContact O-N 3.12Å; A51-E55 HydrophobicContact CB-CB 4.33Å; A51-K56 HydrophobicContact CB-CG 4.14Å; A51-K56 WeakPolarHBondContact O-CE 3.24Å; A51-K56 PolarHBondContact O-NZ 3.47Å
52	T	95.4	Very high	93.6	Very high	66 Å²	66	78 Å²	78	41%	0.405	41%	0.406	S	S	.	.			trans	-64.7	161	175.9	62.5	0	0	0	0	111.5	D50 E54 E55 K56	D50-T52 PolarHBondContact O-N 3.22Å; T52-E54 PolarHBondContact O-N 3.38Å; T52-E55 WeakPolarHBondContact CB-OE2 3.43Å; T52-E55 WeakPolarHBondContact CG2-OE2 3.21Å; T52-E55 PolarHBondContact N-OE2 2.96Å; T52-E55 PolarHBondContact O-N 2.84Å; T52-E55 WeakPolarHBondContact OG1-CB 3.45Å; T52-E55 WeakPolarHBondContact OG1-CG 3.47Å; T52-E55 PolarHBondContact OG1-N 3.46Å; T52-E55 PolarHBondContact OG1-OE2 2.8Å; T52-K56 VanDerWaalsContact O-CG 3.28Å; T52-K56 WeakPolarHBondContact O-CG 3.1Å; T52-K56 PolarHBondContact O-N 3.28Å
53	A	95.8	Very high	93.3	Very high	63 Å²	63	78 Å²	78	52%	0.521	41%	0.406	S	S	.	.	H	α-helix	trans	-60.2	-37.2	178.8	0	0	0	0	0	111.7	K56 V57	A53-K56 PolarHBondContact O-N 2.94Å; A53-V57 WeakPolarHBondContact O-CG2 3.45Å; A53-V57 PolarHBondContact O-N 3.23Å; A53-V57 VanDerWaalsContact O-N 3.11Å
54	E	95.2	Very high	93	Very high	145 Å²	145	74.2 Å²	74.2	68%	0.678	40%	0.397	S	S	*	.	H	α-helix	trans	-66.5	-44.1	178.4	-64.3	70.9	-156.1	0	0	111.6	T52 V57 A58	T52-E54 PolarHBondContact O-N 3.38Å; E54-V57 PolarHBondContact O-N 2.87Å; E54-A58 WeakPolarHBondContact O-CB 3.48Å; E54-A58 PolarHBondContact O-N 2.75Å
55	E	92.6	Very high	92.5	Very high	97 Å²	97	72.4 Å²	72.4	45%	0.453	40%	0.396	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.3	-75.2	162.2	155.4	0	0	111.7	A51 T52 V57 A58 L59	A51-E55 HydrophobicContact CB-CB 4.33Å; T52-E55 WeakPolarHBondContact CB-OE2 3.43Å; T52-E55 WeakPolarHBondContact CG2-OE2 3.21Å; T52-E55 PolarHBondContact N-OE2 2.96Å; T52-E55 PolarHBondContact O-N 2.84Å; T52-E55 WeakPolarHBondContact OG1-CB 3.45Å; T52-E55 WeakPolarHBondContact OG1-CG 3.47Å; T52-E55 PolarHBondContact OG1-N 3.46Å; T52-E55 PolarHBondContact OG1-OE2 2.8Å; E55-V57 PolarHBondContact O-N 3.07Å; E55-A58 PolarHBondContact O-N 3.41Å; E55-L59 WeakPolarHBondContact O-CB 3.17Å; E55-L59 WeakPolarHBondContact O-CG 3.46Å; E55-L59 PolarHBondContact O-N 2.98Å
56	K	94.9	Very high	91.8	Very high	73 Å²	73	74.1 Å²	74.1	32%	0.317	40%	0.402	S	S	.	.	H	α-helix	trans	-56.7	-53.3	175.3	-65.9	179.9	177.6	161.8	0	110	F46 A51 T52 A53 A58 L59 E60	F46-K56 HydrophobicContact CB-CG 4.34Å; F46-K56 HydrophobicContact CD2-CB 4.01Å; F46-K56 HydrophobicContact CD2-CD 4.21Å; F46-K56 HydrophobicContact CD2-CG 3.49Å; F46-K56 VanDerWaalsContact CD2-CG 3.49Å; F46-K56 HydrophobicContact CE2-CB 4.02Å; F46-K56 HydrophobicContact CE2-CG 4Å; F46-K56 HydrophobicContact CG-CG 4.11Å; A51-K56 HydrophobicContact CB-CG 4.14Å; A51-K56 WeakPolarHBondContact O-CE 3.24Å; A51-K56 PolarHBondContact O-NZ 3.47Å; T52-K56 VanDerWaalsContact O-CG 3.28Å; T52-K56 WeakPolarHBondContact O-CG 3.1Å; T52-K56 PolarHBondContact O-N 3.28Å; A53-K56 PolarHBondContact O-N 2.94Å; K56-A58 VanDerWaalsContact C-N 3.28Å; K56-A58 PolarHBondContact O-N 3.5Å; K56-L59 PolarHBondContact O-N 2.97Å; K56-E60 WeakPolarHBondContact O-CB 3.28Å; K56-E60 WeakPolarHBondContact O-CG 3.45Å; K56-E60 PolarHBondContact O-N 3.22Å
57	V	95.4	Very high	90.9	Very high	72 Å²	72	80.4 Å²	80.4	44%	0.436	43%	0.425	S	S	.	.	H	α-helix	trans	-59.9	-38.6	179.7	171.7	0	0	0	0	112	A53 E54 E55 K61	A53-V57 WeakPolarHBondContact O-CG2 3.45Å; A53-V57 PolarHBondContact O-N 3.23Å; A53-V57 VanDerWaalsContact O-N 3.11Å; E54-V57 PolarHBondContact O-N 2.87Å; E55-V57 PolarHBondContact O-N 3.07Å; V57-K61 WeakPolarHBondContact O-CG 3.49Å; V57-K61 PolarHBondContact O-N 3.09Å
58	A	94.8	Very high	89.8	Confident	47 Å²	47	81.1 Å²	81.1	39%	0.388	43%	0.429	S	S	.	.	H	α-helix	trans	-65	-49.7	177.8	0	0	0	0	0	112	E54 E55 K56 E60 K61 I62	E54-A58 WeakPolarHBondContact O-CB 3.48Å; E54-A58 PolarHBondContact O-N 2.75Å; E55-A58 PolarHBondContact O-N 3.41Å; K56-A58 VanDerWaalsContact C-N 3.28Å; K56-A58 PolarHBondContact O-N 3.5Å; A58-E60 VanDerWaalsContact C-N 3.33Å; A58-E60 PolarHBondContact O-N 3.22Å; A58-K61 WeakPolarHBondContact O-CB 3.37Å; A58-K61 PolarHBondContact O-N 3.35Å; A58-I62 WeakPolarHBondContact O-CG1 3.4Å; A58-I62 PolarHBondContact O-N 2.76Å
59	L	92.2	Very high	88.3	Confident	56 Å²	56	82.8 Å²	82.8	29%	0.293	43%	0.425	S	S	.	.	H	α-helix	trans	-69.8	-31.4	-178.3	-70.3	166.3	0	0	0	112.2	V34 M42 F46 E55 K56 K61 I62 Q63	V34-L59 HydrophobicContact CG2-CD2 4.04Å; M42-L59 HydrophobicContact SD-CB 4.5Å; F46-L59 HydrophobicContact CD1-CD1 4.13Å; F46-L59 HydrophobicContact CE1-CB 3.85Å; F46-L59 HydrophobicContact CE1-CD1 3.29Å; F46-L59 HydrophobicContact CE1-CG 4.17Å; F46-L59 HydrophobicContact CE2-CB 4.34Å; F46-L59 HydrophobicContact CZ-CB 3.33Å; F46-L59 HydrophobicContact CZ-CD1 3.68Å; F46-L59 HydrophobicContact CZ-CG 4.13Å; E55-L59 WeakPolarHBondContact O-CB 3.17Å; E55-L59 WeakPolarHBondContact O-CG 3.46Å; E55-L59 PolarHBondContact O-N 2.98Å; K56-L59 PolarHBondContact O-N 2.97Å; L59-K61 VanDerWaalsContact C-N 3.35Å; L59-K61 PolarHBondContact O-N 3.16Å; L59-I62 HydrophobicContact CD2-CD1 4.12Å; L59-I62 PolarHBondContact O-N 3.44Å; L59-Q63 WeakPolarHBondContact O-CB 3.16Å; L59-Q63 PolarHBondContact O-N 3.09Å
60	E	93.5	Very high	86.8	Confident	46 Å²	46	80.9 Å²	80.9	22%	0.215	43%	0.426	C	S	.	.	H	α-helix	trans	-61.3	-41.4	170	-75	-175.3	-160	0	0	112.9	R39 M42 Y43 K56 A58 G64	R39-E60 VanDerWaalsContact NH1-CB 3.3Å; R39-E60 IonicContact NH1-OE1 3.92Å; R39-E60 IonicContact NH1-OE2 2.87Å; R39-E60 PolarHBondContact NH1-OE2 2.86Å; R39-E60 PolarHBondContact NH2-O 2.79Å; M42-E60 HydrophobicContact CE-CB 4.36Å; M42-E60 HydrophobicContact CE-CG 3.65Å; Y43-E60 VanDerWaalsContact CE1-OE1 3.26Å; Y43-E60 WeakPolarHBondContact CE1-OE1 3.42Å; Y43-E60 VanDerWaalsContact CZ-OE1 3.28Å; Y43-E60 PolarHBondContact OH-OE1 2.88Å; K56-E60 WeakPolarHBondContact O-CB 3.28Å; K56-E60 WeakPolarHBondContact O-CG 3.45Å; K56-E60 PolarHBondContact O-N 3.22Å; A58-E60 VanDerWaalsContact C-N 3.33Å; A58-E60 PolarHBondContact O-N 3.22Å; E60-G64 PolarHBondContact O-N 3.23Å
61	K	92.6	Very high	84.8	Confident	146 Å²	146	80 Å²	80	64%	0.635	42%	0.421	S	S	*	.	H	α-helix	trans	-65.6	-44.5	174.7	-72.5	172.6	-179.3	178.2	0	110.9	V57 A58 L59 Q63 G64 C65	V57-K61 WeakPolarHBondContact O-CG 3.49Å; V57-K61 PolarHBondContact O-N 3.09Å; A58-K61 WeakPolarHBondContact O-CB 3.37Å; A58-K61 PolarHBondContact O-N 3.35Å; L59-K61 VanDerWaalsContact C-N 3.35Å; L59-K61 PolarHBondContact O-N 3.16Å; K61-Q63 VanDerWaalsContact C-N 3.34Å; K61-Q63 PolarHBondContact O-N 3.38Å; K61-G64 WeakPolarHBondContact O-CA 3.37Å; K61-G64 PolarHBondContact O-N 2.91Å; K61-C65 PolarHBondContact O-N 3.08Å; K61-C65 PolarHBondContact O-SG 2.75Å; K61-C65 VanDerWaalsContact O-SG 3.33Å
62	I	88.6	Confident	82.8	Confident	74 Å²	74	90 Å²	90	38%	0.379	46%	0.456	S	S	.	.	H	α-helix	trans	-58.8	-46.7	177.3	-67	165.3	0	0	0	110.6	V34 A58 L59 G64 C65 Y66	V34-I62 HydrophobicContact CG1-CB 4.34Å; V34-I62 HydrophobicContact CG1-CG2 3.67Å; A58-I62 WeakPolarHBondContact O-CG1 3.4Å; A58-I62 PolarHBondContact O-N 2.76Å; L59-I62 HydrophobicContact CD2-CD1 4.12Å; L59-I62 PolarHBondContact O-N 3.44Å; I62-G64 VanDerWaalsContact C-N 3.26Å; I62-G64 PolarHBondContact O-N 3.36Å; I62-C65 WeakPolarHBondContact O-CB 3.36Å; I62-C65 PolarHBondContact O-N 3.26Å; I62-C65 VanDerWaalsContact O-N 3.15Å; I62-Y66 HydrophobicContact CG2-CD2 3.86Å; I62-Y66 HydrophobicContact CG2-CE2 3.62Å; I62-Y66 VanDerWaalsContact O-CD2 3.29Å; I62-Y66 WeakPolarHBondContact O-CD2 3.42Å; I62-Y66 PolarHBondContact O-N 2.92Å; I62-Y66 VanDerWaalsContact O-N 3.09Å
63	Q	87.8	Confident	80.8	Confident	0 Å²	0	89.4 Å²	89.4	0%	0	45%	0.45	C	S	.	.	H	α-helix	trans	-60.3	-37.7	174.4	177.1	173.3	92.4	0	0	111.9	S33 V34 G37 S38 R39 M42 L59 K61 Y66 R67	S33-Q63 PolarHBondContact O-NE2 3.01Å; V34-Q63 HydrophobicContact CG1-CB 4.2Å; V34-Q63 WeakPolarHBondContact O-CG 3.38Å; V34-Q63 PolarHBondContact O-NE2 3.1Å; V34-Q63 VanDerWaalsContact O-NE2 3.13Å; G37-Q63 VanDerWaalsContact C-NE2 3.32Å; G37-Q63 PolarHBondContact O-OE1 3.43Å; S38-Q63 PolarHBondContact O-NE2 3.04Å; R39-Q63 VanDerWaalsContact CD-OE1 3.27Å; M42-Q63 HydrophobicContact SD-CB 3.98Å; M42-Q63 HydrophobicContact SD-CG 4.48Å; L59-Q63 WeakPolarHBondContact O-CB 3.16Å; L59-Q63 PolarHBondContact O-N 3.09Å; K61-Q63 VanDerWaalsContact C-N 3.34Å; K61-Q63 PolarHBondContact O-N 3.38Å; Q63-Y66 PolarHBondContact O-N 3.12Å; Q63-R67 PolarHBondContact O-N 3.44Å; Q63-R67 VanDerWaalsContact O-N 3.09Å
64	G	88.3	Confident	78.9	Confident	20 Å²	20	87.5 Å²	87.5	21%	0.206	43%	0.431	C	S	.	.	H	α-helix	trans	-56.5	-49.2	172.2	0	0	0	0	0	112.1	E60 K61 I62 Y66 R67 E68	E60-G64 PolarHBondContact O-N 3.23Å; K61-G64 WeakPolarHBondContact O-CA 3.37Å; K61-G64 PolarHBondContact O-N 2.91Å; I62-G64 VanDerWaalsContact C-N 3.26Å; I62-G64 PolarHBondContact O-N 3.36Å; G64-Y66 VanDerWaalsContact C-N 3.32Å; G64-Y66 PolarHBondContact O-N 2.83Å; G64-R67 PolarHBondContact O-N 3.48Å; G64-R67 VanDerWaalsContact O-N 3.09Å; G64-E68 PolarHBondContact O-N 2.79Å; G64-E68 VanDerWaalsContact O-N 3.13Å
65	C	84	Confident	77	Confident	76 Å²	76	83.5 Å²	83.5	51%	0.514	41%	0.414	S	S	.	.	H	α-helix	trans	-57.2	-44	176.5	-59	0	0	0	0	112.1	K61 I62 R67 E68 E69	K61-C65 PolarHBondContact O-N 3.08Å; K61-C65 PolarHBondContact O-SG 2.75Å; K61-C65 VanDerWaalsContact O-SG 3.33Å; I62-C65 WeakPolarHBondContact O-CB 3.36Å; I62-C65 PolarHBondContact O-N 3.26Å; I62-C65 VanDerWaalsContact O-N 3.15Å; C65-R67 VanDerWaalsContact C-N 3.3Å; C65-R67 PolarHBondContact O-N 2.84Å; C65-E68 PolarHBondContact O-N 3.3Å; C65-E69 PolarHBondContact O-N 3.37Å; C65-E69 VanDerWaalsContact O-N 3.09Å
66	Y	78.5	Confident	75.4	Confident	60 Å²	60	84 Å²	84	24%	0.235	42%	0.419	C	S	.	.	H	α-helix	trans	-66.3	-28.3	177.6	-80.8	-69.3	0	0	0	113.9	V34 V35 I62 Q63 G64 I74	V34-Y66 HydrophobicContact CG1-CD2 4.12Å; V34-Y66 HydrophobicContact CG1-CE2 4.28Å; V35-Y66 HydrophobicContact CG1-CD1 4.25Å; V35-Y66 HydrophobicContact CG1-CD2 4.11Å; V35-Y66 HydrophobicContact CG1-CE1 4.05Å; V35-Y66 HydrophobicContact CG1-CE2 3.91Å; V35-Y66 HydrophobicContact CG1-CG 4.28Å; I62-Y66 HydrophobicContact CG2-CD2 3.86Å; I62-Y66 HydrophobicContact CG2-CE2 3.62Å; I62-Y66 VanDerWaalsContact O-CD2 3.29Å; I62-Y66 WeakPolarHBondContact O-CD2 3.42Å; I62-Y66 PolarHBondContact O-N 2.92Å; I62-Y66 VanDerWaalsContact O-N 3.09Å; Q63-Y66 PolarHBondContact O-N 3.12Å; G64-Y66 VanDerWaalsContact C-N 3.32Å; G64-Y66 PolarHBondContact O-N 2.83Å; Y66-I74 HydrophobicContact CD1-CG1 4.21Å
67	R	75	Confident	73.7	Confident	143 Å²	143	85.5 Å²	85.5	54%	0.54	43%	0.427	S	S	.	.	H	α-helix	trans	-74.3	-32.4	174	-73.1	-173	-170.5	-177.5	6.3	112.5	G37 Q63 G64 C65	G37-R67 PolarHBondContact O-NE 3.31Å; G37-R67 PolarHBondContact O-NH2 2.96Å; Q63-R67 PolarHBondContact O-N 3.44Å; Q63-R67 VanDerWaalsContact O-N 3.09Å; G64-R67 PolarHBondContact O-N 3.48Å; G64-R67 VanDerWaalsContact O-N 3.09Å; C65-R67 VanDerWaalsContact C-N 3.3Å; C65-R67 PolarHBondContact O-N 2.84Å
68	E	71.2	Confident	72.4	Confident	172 Å²	172	82.7 Å²	82.7	80%	0.804	41%	0.41	S	S	*	.	H	α-helix	trans	-73.8	-33.3	178.8	-70.5	177.3	-167.9	0	0	111.5	G64 C65	G64-E68 PolarHBondContact O-N 2.79Å; G64-E68 VanDerWaalsContact O-N 3.13Å; C65-E68 PolarHBondContact O-N 3.3Å
69	E	61.5	Low	71.4	Confident	104 Å²	104	86.3 Å²	86.3	49%	0.486	42%	0.417	S	S	.	.	S	Bend	trans	-80.2	144.9	171.3	-67.7	-164.9	175.1	0	0	112.1	C65 L71 N73	C65-E69 PolarHBondContact O-N 3.37Å; C65-E69 VanDerWaalsContact O-N 3.09Å; E69-L71 PolarHBondContact O-N 3.27Å; E69-N73 PolarHBondContact OE2-ND2 2.98Å
70	S	57.4	Low	70.5	Confident	78 Å²	78	88.1 Å²	88.1	55%	0.545	43%	0.426	S	S	.	.			trans	-57.4	135.9	176.2	70.9	0	0	0	0	109.9	R72 N73	S70-R72 PolarHBondContact O-N 2.72Å; S70-R72 WeakPolarHBondContact OG-CB 3.09Å; S70-N73 PolarHBondContact O-N 2.81Å
71	L	53.2	Low	69.7	Low	129 Å²	129	86.6 Å²	86.6	68%	0.675	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.4	-21.1	168.8	-87.5	152.5	0	0	0	115.7	E69 N73 I74	E69-L71 PolarHBondContact O-N 3.27Å; L71-N73 PolarHBondContact O-N 3.25Å; L71-N73 VanDerWaalsContact O-N 3.14Å; L71-I74 HydrophobicContact CB-CD1 4.47Å; L71-I74 HydrophobicContact CD2-CB 4.24Å; L71-I74 HydrophobicContact CD2-CD1 3.46Å; L71-I74 VanDerWaalsContact CD2-CD1 3.46Å; L71-I74 HydrophobicContact CD2-CG1 4.37Å; L71-I74 HydrophobicContact CD2-CG2 4.19Å; L71-I74 HydrophobicContact CG-CD1 3.84Å; L71-I74 PolarHBondContact O-N 3.44Å; L71-I74 VanDerWaalsContact O-N 3.15Å
72	R	51.9	Low	69.1	Low	224 Å²	224	82 Å²	82	85%	0.845	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-25.4	170.4	-147.7	176.3	-177.1	-173.7	-0.6	113.3	S70	S70-R72 PolarHBondContact O-N 2.72Å; S70-R72 WeakPolarHBondContact OG-CB 3.09Å
73	N	53.6	Low	68.7	Low	52 Å²	52	81.6 Å²	81.6	28%	0.278	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-18.3	177.1	-74.5	-3	0	0	0	115.3	E69 S70 L71 L75 L76	E69-N73 PolarHBondContact OE2-ND2 2.98Å; S70-N73 PolarHBondContact O-N 2.81Å; L71-N73 PolarHBondContact O-N 3.25Å; L71-N73 VanDerWaalsContact O-N 3.14Å; N73-L75 PolarHBondContact O-N 3.45Å; N73-L76 HydrophobicContact CB-CD1 3.63Å; N73-L76 HydrophobicContact CB-CG 4.12Å; N73-L76 VanDerWaalsContact CG-CD1 3.45Å; N73-L76 VanDerWaalsContact O-CB 3.31Å; N73-L76 WeakPolarHBondContact O-CB 3.43Å; N73-L76 PolarHBondContact O-N 3.01Å; N73-L76 WeakPolarHBondContact OD1-CD1 3.05Å
74	I	54.9	Low	68.3	Low	24 Å²	24	84.4 Å²	84.4	12%	0.123	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.5	-177.4	-85.1	173.4	0	0	0	112.4	V35 Y66 L71	V35-I74 HydrophobicContact CB-CG2 3.98Å; V35-I74 HydrophobicContact CG2-CG2 4.08Å; V35-I74 WeakPolarHBondContact O-CD1 3.46Å; Y66-I74 HydrophobicContact CD1-CG1 4.21Å; L71-I74 HydrophobicContact CB-CD1 4.47Å; L71-I74 HydrophobicContact CD2-CB 4.24Å; L71-I74 HydrophobicContact CD2-CD1 3.46Å; L71-I74 VanDerWaalsContact CD2-CD1 3.46Å; L71-I74 HydrophobicContact CD2-CG1 4.37Å; L71-I74 HydrophobicContact CD2-CG2 4.19Å; L71-I74 HydrophobicContact CG-CD1 3.84Å; L71-I74 PolarHBondContact O-N 3.44Å; L71-I74 VanDerWaalsContact O-N 3.15Å
75	L	55.9	Low	68	Low	60 Å²	60	83.5 Å²	83.5	31%	0.314	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	23.1	-179.4	-81.9	151.1	0	0	0	111.8	N73 E77 P78 L109	N73-L75 PolarHBondContact O-N 3.45Å; L75-E77 CarbonylContact O-C 3.44Å; L75-E77 VanDerWaalsContact O-CA 3.24Å; L75-E77 WeakPolarHBondContact O-CA 3.37Å; L75-E77 PolarHBondContact O-N 3.35Å; L75-P78 HydrophobicContact CB-CG 3.98Å; L75-P78 HydrophobicContact CD2-CB 4.04Å; L75-P78 HydrophobicContact CD2-CG 3.61Å; L75-P78 HydrophobicContact CG-CG 4.4Å; L75-P78 WeakPolarHBondContact O-CD 3.47Å; L75-P78 WeakPolarHBondContact O-CG 3.31Å; L75-L109 HydrophobicContact CD1-CD2 3.87Å; L75-L109 HydrophobicContact CD2-CB 3.98Å; L75-L109 HydrophobicContact CD2-CD1 3.74Å; L75-L109 HydrophobicContact CD2-CD2 3.97Å; L75-L109 HydrophobicContact CD2-CG 4.11Å
76	L	57.5	Low	68	Low	109 Å²	109	81.7 Å²	81.7	57%	0.571	40%	0.403	S	S	*	.	S	Bend	trans	-54.4	-21.2	-158.7	-112.2	164.8	0	0	0	116.3	N73	N73-L76 HydrophobicContact CB-CD1 3.63Å; N73-L76 HydrophobicContact CB-CG 4.12Å; N73-L76 VanDerWaalsContact CG-CD1 3.45Å; N73-L76 VanDerWaalsContact O-CB 3.31Å; N73-L76 WeakPolarHBondContact O-CB 3.43Å; N73-L76 PolarHBondContact O-N 3.01Å; N73-L76 WeakPolarHBondContact OD1-CD1 3.05Å
77	E	61	Low	68.2	Low	103 Å²	103	79.9 Å²	79.9	48%	0.481	40%	0.399	S	S	.	.			trans	-147.2	102.1	144.5	-72.1	-158.5	-174	0	0	111.2	L75 K79 I80 M81	L75-E77 CarbonylContact O-C 3.44Å; L75-E77 VanDerWaalsContact O-CA 3.24Å; L75-E77 WeakPolarHBondContact O-CA 3.37Å; L75-E77 PolarHBondContact O-N 3.35Å; E77-K79 HydrophobicContact CB-CB 4.31Å; E77-K79 PolarHBondContact O-N 3.07Å; E77-K79 VanDerWaalsContact O-N 3.07Å; E77-I80 HydrophobicContact CB-CB 4.12Å; E77-I80 HydrophobicContact CB-CD1 3.77Å; E77-I80 HydrophobicContact CB-CG1 3.63Å; E77-I80 HydrophobicContact CG-CD1 4.18Å; E77-I80 HydrophobicContact CG-CG1 4.33Å; E77-I80 PolarHBondContact O-N 2.67Å; E77-I80 WeakPolarHBondContact OE2-CG1 3.12Å; E77-M81 PolarHBondContact O-N 3.27Å
78	P	68.2	Low	68.5	Low	14 Å²	14	77.7 Å²	77.7	9%	0.091	40%	0.403	C	S	.	.	H	α-helix	trans	-64.6	-15.1	168.4	-4	25.4	0	0	0	109.4	L75 M81 E82 L106 L110	L75-P78 HydrophobicContact CB-CG 3.98Å; L75-P78 HydrophobicContact CD2-CB 4.04Å; L75-P78 HydrophobicContact CD2-CG 3.61Å; L75-P78 HydrophobicContact CG-CG 4.4Å; L75-P78 WeakPolarHBondContact O-CD 3.47Å; L75-P78 WeakPolarHBondContact O-CG 3.31Å; P78-M81 PolarHBondContact O-N 3.29Å; P78-E82 WeakPolarHBondContact O-CB 3.22Å; P78-E82 PolarHBondContact O-N 3.47Å; P78-L106 HydrophobicContact CB-CD2 3.88Å; P78-L110 HydrophobicContact CB-CD1 4.38Å; P78-L110 HydrophobicContact CB-CD2 3.62Å; P78-L110 HydrophobicContact CB-CG 3.8Å; P78-L110 HydrophobicContact CG-CD2 3.58Å; P78-L110 HydrophobicContact CG-CG 4.14Å
79	K	72.6	Confident	69	Low	122 Å²	122	74 Å²	74	53%	0.53	39%	0.386	S	S	.	.	H	α-helix	trans	-63.8	-38.2	169.8	-65.9	-173.3	177.1	-179.9	0	113	E77 A83 L110	E77-K79 HydrophobicContact CB-CB 4.31Å; E77-K79 PolarHBondContact O-N 3.07Å; E77-K79 VanDerWaalsContact O-N 3.07Å; K79-A83 VanDerWaalsContact O-CB 3.22Å; K79-A83 WeakPolarHBondContact O-CB 3.28Å; K79-A83 PolarHBondContact O-N 2.9Å; K79-L110 HydrophobicContact CG-CD2 3.69Å
80	I	72.9	Confident	70	Confident	95 Å²	95	69.1 Å²	69.1	49%	0.487	36%	0.363	S	S	.	.	H	α-helix	trans	-67.2	-46.4	175.7	-66.8	172.7	0	0	0	108.5	E77 E82 A83 M84	E77-I80 HydrophobicContact CB-CB 4.12Å; E77-I80 HydrophobicContact CB-CD1 3.77Å; E77-I80 HydrophobicContact CB-CG1 3.63Å; E77-I80 HydrophobicContact CG-CD1 4.18Å; E77-I80 HydrophobicContact CG-CG1 4.33Å; E77-I80 PolarHBondContact O-N 2.67Å; E77-I80 WeakPolarHBondContact OE2-CG1 3.12Å; I80-E82 VanDerWaalsContact C-N 3.33Å; I80-E82 PolarHBondContact O-N 2.02Å; I80-A83 PolarHBondContact O-N 2.72Å; I80-M84 HydrophobicContact CG2-CE 3.79Å; I80-M84 HydrophobicContact CG2-SD 4.38Å; I80-M84 WeakPolarHBondContact O-CE 3.19Å; I80-M84 WeakPolarHBondContact O-CG 3Å; I80-M84 PolarHBondContact O-N 3.23Å
81	M	77.1	Confident	71.3	Confident	13 Å²	13	68.3 Å²	68.3	6%	0.064	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-44.4	176.1	-60	-173.5	85	0	0	112	F28 Y31 A32 E77 P78 M84 V85 L106	F28-M81 HydrophobicContact CD2-CB 4.16Å; F28-M81 HydrophobicContact CD2-CE 3.41Å; F28-M81 VanDerWaalsContact CD2-CE 3.41Å; F28-M81 HydrophobicContact CE2-CB 4.37Å; F28-M81 HydrophobicContact CE2-CE 3.53Å; F28-M81 HydrophobicContact CE2-SD 4.4Å; F28-M81 HydrophobicContact CG-CE 4.15Å; F28-M81 HydrophobicContact CZ-CE 4.4Å; Y31-M81 HydrophobicContact CD1-CE 3.34Å; Y31-M81 HydrophobicContact CD1-CG 4.5Å; Y31-M81 HydrophobicContact CD1-SD 3.63Å; Y31-M81 HydrophobicContact CE1-CE 4.07Å; Y31-M81 HydrophobicContact CE1-SD 3.71Å; Y31-M81 HydrophobicContact CG-CE 4.1Å; A32-M81 HydrophobicContact CB-CE 4.37Å; E77-M81 PolarHBondContact O-N 3.27Å; P78-M81 PolarHBondContact O-N 3.29Å; M81-M84 HydrophobicContact CB-CE 4.49Å; M81-M84 HydrophobicContact CG-CE 4.34Å; M81-M84 PolarHBondContact O-N 3.48Å; M81-V85 WeakPolarHBondContact O-CG2 3.49Å; M81-V85 PolarHBondContact O-N 3.48Å; M81-L106 HydrophobicContact CB-CD1 4.21Å; M81-L106 HydrophobicContact CB-CD2 3.95Å
82	E	80.5	Confident	72.7	Confident	50 Å²	50	67.1 Å²	67.1	23%	0.234	36%	0.355	C	S	.	.	H	α-helix	trans	-62.1	-47.8	175.2	-177.2	-178.3	-145.4	0	0	110.9	P78 I80 M84 V85 A86 L103 L106 L110	P78-E82 WeakPolarHBondContact O-CB 3.22Å; P78-E82 PolarHBondContact O-N 3.47Å; I80-E82 VanDerWaalsContact C-N 3.33Å; I80-E82 PolarHBondContact O-N 2.02Å; E82-M84 VanDerWaalsContact C-N 3.27Å; E82-M84 PolarHBondContact O-N 3.48Å; E82-V85 PolarHBondContact O-N 3.46Å; E82-A86 HydrophobicContact CG-CB 4.46Å; E82-A86 WeakPolarHBondContact O-CA 3.31Å; E82-A86 WeakPolarHBondContact O-CB 3.44Å; E82-A86 PolarHBondContact O-N 3.18Å; E82-L103 HydrophobicContact CG-CD2 4.46Å; E82-L106 HydrophobicContact CB-CD1 4.09Å; E82-L110 HydrophobicContact CB-CD1 4.35Å; E82-L110 WeakPolarHBondContact OE2-CD1 3.46Å
83	A	80.5	Confident	74.2	Confident	66 Å²	66	62 Å²	62	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-36.7	178.8	0	0	0	0	0	112.4	K79 I80 S87	K79-A83 VanDerWaalsContact O-CB 3.22Å; K79-A83 WeakPolarHBondContact O-CB 3.28Å; K79-A83 PolarHBondContact O-N 2.9Å; I80-A83 PolarHBondContact O-N 2.72Å; A83-S87 PolarHBondContact O-N 3.28Å
84	M	78.2	Confident	75.5	Confident	59 Å²	59	62.1 Å²	62.1	29%	0.291	33%	0.333	S	S	.	.	H	α-helix	trans	-67.9	-48.8	175.8	-71.3	-178	-64	0	0	111.6	F27 I80 M81 E82 S87	F27-M84 HydrophobicContact CD1-CE 3.74Å; F27-M84 HydrophobicContact CD1-SD 3.75Å; F27-M84 HydrophobicContact CE1-CE 3.51Å; F27-M84 HydrophobicContact CE1-SD 3.67Å; I80-M84 HydrophobicContact CG2-CE 3.79Å; I80-M84 HydrophobicContact CG2-SD 4.38Å; I80-M84 WeakPolarHBondContact O-CE 3.19Å; I80-M84 WeakPolarHBondContact O-CG 3Å; I80-M84 PolarHBondContact O-N 3.23Å; M81-M84 HydrophobicContact CB-CE 4.49Å; M81-M84 HydrophobicContact CG-CE 4.34Å; M81-M84 PolarHBondContact O-N 3.48Å; E82-M84 VanDerWaalsContact C-N 3.27Å; E82-M84 PolarHBondContact O-N 3.48Å; M84-S87 WeakPolarHBondContact O-CB 3.18Å; M84-S87 PolarHBondContact O-N 2.97Å; M84-S87 PolarHBondContact O-OG 3.43Å
85	V	82.6	Confident	76.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-76.7	-33.4	-175.2	174.7	0	0	0	0	112.7	F28 M81 E82 S87 C90 I99 I102 L103	F28-V85 HydrophobicContact CB-CG2 3.86Å; F28-V85 HydrophobicContact CD2-CG2 3.9Å; F28-V85 HydrophobicContact CG-CG2 4.03Å; M81-V85 WeakPolarHBondContact O-CG2 3.49Å; M81-V85 PolarHBondContact O-N 3.48Å; E82-V85 PolarHBondContact O-N 3.46Å; V85-S87 VanDerWaalsContact C-N 3.26Å; V85-S87 PolarHBondContact O-N 3.08Å; V85-C90 WeakPolarHBondContact O-CB 3.39Å; V85-C90 PolarHBondContact O-SG 2.91Å; V85-I99 HydrophobicContact CG1-CB 4.4Å; V85-I99 HydrophobicContact CG1-CG1 4.24Å; V85-I99 HydrophobicContact CG1-CG2 3.48Å; V85-I99 VanDerWaalsContact CG1-CG2 3.48Å; V85-I102 HydrophobicContact CB-CG2 4.42Å; V85-I102 HydrophobicContact CG1-CB 4.24Å; V85-I102 HydrophobicContact CG1-CG2 3.83Å; V85-I102 HydrophobicContact CG2-CG2 4.13Å; V85-L103 HydrophobicContact CB-CD2 4.43Å; V85-L103 HydrophobicContact CG1-CD2 4.02Å; V85-L103 HydrophobicContact CG1-CG 4.43Å
86	A	84.2	Confident	77	Confident	39 Å²	39	64.2 Å²	64.2	32%	0.322	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	1.9	176.9	0	0	0	0	0	113	E82 L91 L103	E82-A86 HydrophobicContact CG-CB 4.46Å; E82-A86 WeakPolarHBondContact O-CA 3.31Å; E82-A86 WeakPolarHBondContact O-CB 3.44Å; E82-A86 PolarHBondContact O-N 3.18Å; A86-L91 WeakPolarHBondContact O-CD1 3Å; A86-L103 HydrophobicContact CB-CD2 3.88Å
87	S	82.7	Confident	77.7	Confident	21 Å²	21	63.7 Å²	63.7	15%	0.147	35%	0.353	C	S	.	.	S	Bend	trans	-59.8	140.6	174.5	64.3	0	0	0	0	110.5	A83 M84 V85 E89 C90 L91	A83-S87 PolarHBondContact O-N 3.28Å; M84-S87 WeakPolarHBondContact O-CB 3.18Å; M84-S87 PolarHBondContact O-N 2.97Å; M84-S87 PolarHBondContact O-OG 3.43Å; V85-S87 VanDerWaalsContact C-N 3.26Å; V85-S87 PolarHBondContact O-N 3.08Å; S87-E89 WeakPolarHBondContact CB-OE2 3.46Å; S87-E89 PolarHBondContact O-N 3.04Å; S87-E89 VanDerWaalsContact O-N 3.17Å; S87-C90 PolarHBondContact O-N 2.8Å; S87-C90 VanDerWaalsContact O-N 3.11Å; S87-C90 WeakPolarHBondContact OG-CB 3.47Å; S87-C90 PolarHBondContact OG-N 3.45Å; S87-L91 WeakPolarHBondContact O-CG 3.2Å; S87-L91 PolarHBondContact O-N 2.99Å
88	P	82.1	Confident	78.2	Confident	97 Å²	97	63.7 Å²	63.7	63%	0.63	36%	0.357	S	S	*	.	H	α-helix	trans	-52.1	-37.2	175.4	-27.3	34.4	0	0	0	112.7	S92	P88-S92 VanDerWaalsContact O-CB 3.28Å; P88-S92 WeakPolarHBondContact O-CB 3.45Å; P88-S92 PolarHBondContact O-N 3.12Å
89	E	81.1	Confident	78.9	Confident	96 Å²	96	63 Å²	63	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-58.1	-52.7	176.3	-69.6	77.2	-157.6	0	0	111.7	T21 S87 S92 Y93	T21-E89 HydrophobicContact CG2-CB 3.52Å; T21-E89 HydrophobicContact CG2-CG 4.17Å; S87-E89 WeakPolarHBondContact CB-OE2 3.46Å; S87-E89 PolarHBondContact O-N 3.04Å; S87-E89 VanDerWaalsContact O-N 3.17Å; E89-S92 PolarHBondContact O-N 3.48Å; E89-Y93 PolarHBondContact O-N 3.17Å
90	C	83	Confident	79.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.8	-44.6	179.3	-171.9	0	0	0	0	111.8	C24 V85 S87 S92 Y93 Y94 I99	C24-C90 HydrophobicContact CB-CB 3.64Å; C24-C90 WeakPolarHBondContact CB-SG 3.37Å; C24-C90 VanDerWaalsContact SG-CA 3.57Å; C24-C90 WeakPolarHBondContact SG-CB 3.44Å; C24-C90 CovalentContact SG-SG 2.02Å; C24-C90 PolarHBondContact SG-SG 3.46Å; V85-C90 WeakPolarHBondContact O-CB 3.39Å; V85-C90 PolarHBondContact O-SG 2.91Å; S87-C90 PolarHBondContact O-N 2.8Å; S87-C90 VanDerWaalsContact O-N 3.11Å; S87-C90 WeakPolarHBondContact OG-CB 3.47Å; S87-C90 PolarHBondContact OG-N 3.45Å; C90-S92 VanDerWaalsContact C-N 3.29Å; C90-S92 PolarHBondContact O-N 3.1Å; C90-Y93 PolarHBondContact O-N 3.38Å; C90-Y93 VanDerWaalsContact O-N 3.12Å; C90-Y94 PolarHBondContact O-N 3.16Å; C90-I99 HydrophobicContact CB-CD1 4.35Å; C90-I99 VanDerWaalsContact O-CD1 3.28Å; C90-I99 WeakPolarHBondContact O-CD1 3.32Å; C90-I99 VanDerWaalsContact SG-CD1 3.57Å
91	L	84	Confident	79.9	Confident	61 Å²	61	63.7 Å²	63.7	32%	0.319	36%	0.359	S	S	.	.	H	α-helix	trans	-61.3	-37.5	178.7	-73.4	171	0	0	0	112.7	A86 S87 Y93 S95 I99	A86-L91 WeakPolarHBondContact O-CD1 3Å; S87-L91 WeakPolarHBondContact O-CG 3.2Å; S87-L91 PolarHBondContact O-N 2.99Å; L91-Y93 VanDerWaalsContact C-N 3.32Å; L91-S95 PolarHBondContact O-N 3.17Å; L91-I99 HydrophobicContact CD2-CB 4.06Å; L91-I99 HydrophobicContact CD2-CD1 3.88Å; L91-I99 HydrophobicContact CD2-CG2 3.6Å; L91-I99 HydrophobicContact CG-CD1 4.37Å
92	S	82.3	Confident	80.2	Confident	105 Å²	105	64 Å²	64	73%	0.734	36%	0.361	S	S	*	.	H	α-helix	trans	-67.3	-33	176.3	-173.2	0	0	0	0	112.3	P88 E89 C90	P88-S92 VanDerWaalsContact O-CB 3.28Å; P88-S92 WeakPolarHBondContact O-CB 3.45Å; P88-S92 PolarHBondContact O-N 3.12Å; E89-S92 PolarHBondContact O-N 3.48Å; C90-S92 VanDerWaalsContact C-N 3.29Å; C90-S92 PolarHBondContact O-N 3.1Å
93	Y	83.1	Confident	80.3	Confident	116 Å²	116	63.9 Å²	63.9	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-83	-53	-176.2	-171.5	-94.7	0	0	0	112.9	E22 E89 C90 L91 S95	E22-Y93 HydrophobicContact CB-CE1 4.15Å; E22-Y93 HydrophobicContact CB-CE2 4.44Å; E22-Y93 HydrophobicContact CG-CD2 4.01Å; E22-Y93 HydrophobicContact CG-CE1 4.06Å; E22-Y93 HydrophobicContact CG-CE2 3.49Å; E22-Y93 VanDerWaalsContact CG-CE2 3.49Å; E22-Y93 HydrophobicContact CG-CG 4.48Å; E22-Y93 VanDerWaalsContact CG-CZ 3.49Å; E22-Y93 WeakPolarHBondContact OE1-CE2 3.49Å; E22-Y93 VanDerWaalsContact OE1-CZ 3.23Å; E22-Y93 PolarHBondContact OE1-OH 3.49Å; E89-Y93 PolarHBondContact O-N 3.17Å; C90-Y93 PolarHBondContact O-N 3.38Å; C90-Y93 VanDerWaalsContact O-N 3.12Å; L91-Y93 VanDerWaalsContact C-N 3.32Å; Y93-S95 VanDerWaalsContact C-N 3.35Å; Y93-S95 PolarHBondContact O-N 2.58Å
94	Y	81.7	Confident	80.5	Confident	54 Å²	54	64.4 Å²	64.4	21%	0.212	36%	0.355	C	S	.	.	H	α-helix	trans	-84.5	-5.1	-172.2	-80.7	-79.1	0	0	0	114.9	T21 E22 C24 V25 P26 C90 N98 I99	T21-Y94 WeakPolarHBondContact O-CE2 3.21Å; E22-Y94 PolarHBondContact O-OH 3.11Å; C24-Y94 VanDerWaalsContact SG-CD2 3.57Å; C24-Y94 VanDerWaalsContact SG-CE2 3.56Å; V25-Y94 HydrophobicContact CB-CD1 4.37Å; V25-Y94 HydrophobicContact CB-CD2 4.12Å; V25-Y94 HydrophobicContact CB-CE1 4.01Å; V25-Y94 HydrophobicContact CB-CE2 3.74Å; V25-Y94 HydrophobicContact CB-CG 4.43Å; V25-Y94 HydrophobicContact CG1-CE1 4.46Å; V25-Y94 HydrophobicContact CG2-CD1 4.03Å; V25-Y94 HydrophobicContact CG2-CD2 3.49Å; V25-Y94 VanDerWaalsContact CG2-CD2 3.49Å; V25-Y94 HydrophobicContact CG2-CE1 4.17Å; V25-Y94 HydrophobicContact CG2-CE2 3.65Å; V25-Y94 HydrophobicContact CG2-CG 3.71Å; P26-Y94 WeakPolarHBondContact CD-OH 3.48Å; C90-Y94 PolarHBondContact O-N 3.16Å; Y94-N98 WeakPolarHBondContact O-CB 3.35Å; Y94-N98 PolarHBondContact O-ND2 2.75Å; Y94-I99 HydrophobicContact CG-CD1 4.48Å
95	S	72.6	Confident	80.6	Confident	57 Å²	57	65.8 Å²	65.8	40%	0.399	36%	0.363	S	S	.	.	H	α-helix	trans	62.3	145.9	-166.2	84.4	0	0	0	0	113.3	L91 Y93 N97 N98	L91-S95 PolarHBondContact O-N 3.17Å; Y93-S95 VanDerWaalsContact C-N 3.35Å; Y93-S95 PolarHBondContact O-N 2.58Å; S95-N97 PolarHBondContact O-N 3.27Å; S95-N97 VanDerWaalsContact O-N 3.08Å; S95-N98 PolarHBondContact O-N 3.17Å
96	S	69.8	Low	80.5	Confident	72 Å²	72	65.8 Å²	65.8	50%	0.503	36%	0.363	S	S	.	.	H	α-helix	trans	-62	-22.3	-174.3	60.8	0	0	0	0	114.4	R100	S96-R100 VanDerWaalsContact O-CB 3.31Å; S96-R100 WeakPolarHBondContact O-CB 3.41Å; S96-R100 PolarHBondContact O-N 3.39Å
97	N	72	Confident	80.4	Confident	97 Å²	97	65.3 Å²	65.3	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-68.4	-43.3	179	-75.8	-31.5	0	0	0	112.4	S95 R100	S95-N97 PolarHBondContact O-N 3.27Å; S95-N97 VanDerWaalsContact O-N 3.08Å; N97-R100 PolarHBondContact OD1-NH1 3.48Å; N97-R100 PolarHBondContact OD1-NH2 2.82Å
98	N	72	Confident	80.2	Confident	104 Å²	104	71 Å²	71	56%	0.556	38%	0.379	S	S	*	.	H	α-helix	trans	-71.3	-41.3	-177.9	-67.7	-18	0	0	0	110.8	Y94 S95 R100	Y94-N98 WeakPolarHBondContact O-CB 3.35Å; Y94-N98 PolarHBondContact O-ND2 2.75Å; S95-N98 PolarHBondContact O-N 3.17Å; N98-R100 VanDerWaalsContact C-N 3.34Å; N98-R100 PolarHBondContact O-N 3.02Å
99	I	81	Confident	79.8	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-72.2	-26.8	-179.6	-74.6	168.7	0	0	0	112.3	V25 V85 C90 L91 Y94 C101 I102 L103	V25-I99 HydrophobicContact CG2-CG1 4.31Å; V85-I99 HydrophobicContact CG1-CB 4.4Å; V85-I99 HydrophobicContact CG1-CG1 4.24Å; V85-I99 HydrophobicContact CG1-CG2 3.48Å; V85-I99 VanDerWaalsContact CG1-CG2 3.48Å; C90-I99 HydrophobicContact CB-CD1 4.35Å; C90-I99 VanDerWaalsContact O-CD1 3.28Å; C90-I99 WeakPolarHBondContact O-CD1 3.32Å; C90-I99 VanDerWaalsContact SG-CD1 3.57Å; L91-I99 HydrophobicContact CD2-CB 4.06Å; L91-I99 HydrophobicContact CD2-CD1 3.88Å; L91-I99 HydrophobicContact CD2-CG2 3.6Å; L91-I99 HydrophobicContact CG-CD1 4.37Å; Y94-I99 HydrophobicContact CG-CD1 4.48Å; I99-C101 VanDerWaalsContact C-N 3.29Å; I99-C101 PolarHBondContact O-N 2.9Å; I99-I102 WeakPolarHBondContact O-CB 3.42Å; I99-I102 PolarHBondContact O-N 3.32Å; I99-L103 HydrophobicContact CG2-CD1 3.58Å; I99-L103 HydrophobicContact CG2-CD2 4.31Å; I99-L103 HydrophobicContact CG2-CG 3.61Å; I99-L103 PolarHBondContact O-N 2.82Å
100	R	83.7	Confident	79.4	Confident	136 Å²	136	67.5 Å²	67.5	51%	0.513	36%	0.357	S	S	.	.	H	α-helix	trans	-55.2	-42.5	-178.1	-171.6	-176.2	-53.7	133.2	11.4	113.1	S96 N97 N98 I102 L103 D104	S96-R100 VanDerWaalsContact O-CB 3.31Å; S96-R100 WeakPolarHBondContact O-CB 3.41Å; S96-R100 PolarHBondContact O-N 3.39Å; N97-R100 PolarHBondContact OD1-NH1 3.48Å; N97-R100 PolarHBondContact OD1-NH2 2.82Å; N98-R100 VanDerWaalsContact C-N 3.34Å; N98-R100 PolarHBondContact O-N 3.02Å; R100-I102 VanDerWaalsContact C-N 3.28Å; R100-I102 PolarHBondContact O-N 3.17Å; R100-L103 PolarHBondContact O-N 3.43Å; R100-D104 WeakPolarHBondContact O-CB 3.37Å; R100-D104 PolarHBondContact O-N 3.33Å
101	C	82.9	Confident	78.9	Confident	95 Å²	95	70.9 Å²	70.9	64%	0.642	39%	0.393	S	S	*	.	H	α-helix	trans	-63	-38.3	179	-66.4	0	0	0	0	111.7	I99 L105	I99-C101 VanDerWaalsContact C-N 3.29Å; I99-C101 PolarHBondContact O-N 2.9Å; C101-L105 PolarHBondContact O-N 2.96Å; C101-L105 VanDerWaalsContact O-N 3.1Å
102	I	83.7	Confident	77.9	Confident	20 Å²	20	76 Å²	76	10%	0.103	42%	0.415	C	S	.	.	H	α-helix	trans	-68.7	-46	177.7	-61.2	172.2	0	0	0	110.2	V25 F28 V85 I99 R100 D104 L105 L106	V25-I102 HydrophobicContact CG1-CD1 3.99Å; V25-I102 HydrophobicContact CG2-CD1 4.06Å; F28-I102 HydrophobicContact CD1-CD1 4.18Å; F28-I102 HydrophobicContact CD1-CG1 4.45Å; F28-I102 HydrophobicContact CD1-CG2 3.9Å; F28-I102 HydrophobicContact CD2-CG2 3.84Å; F28-I102 HydrophobicContact CE1-CD1 4.45Å; F28-I102 HydrophobicContact CE1-CG1 4.22Å; F28-I102 HydrophobicContact CE1-CG2 3.65Å; F28-I102 HydrophobicContact CE2-CG2 3.62Å; F28-I102 HydrophobicContact CG-CG2 4.03Å; F28-I102 HydrophobicContact CZ-CG2 3.54Å; V85-I102 HydrophobicContact CB-CG2 4.42Å; V85-I102 HydrophobicContact CG1-CB 4.24Å; V85-I102 HydrophobicContact CG1-CG2 3.83Å; V85-I102 HydrophobicContact CG2-CG2 4.13Å; I99-I102 WeakPolarHBondContact O-CB 3.42Å; I99-I102 PolarHBondContact O-N 3.32Å; R100-I102 VanDerWaalsContact C-N 3.28Å; R100-I102 PolarHBondContact O-N 3.17Å; I102-D104 PolarHBondContact O-N 2.64Å; I102-L105 WeakPolarHBondContact O-CB 3.5Å; I102-L105 PolarHBondContact O-N 3.24Å; I102-L106 HydrophobicContact CG2-CD1 4.02Å; I102-L106 WeakPolarHBondContact O-CG 3.49Å; I102-L106 PolarHBondContact O-N 2.85Å
103	L	82.8	Confident	77.6	Confident	46 Å²	46	74.6 Å²	74.6	24%	0.241	40%	0.399	C	S	.	.	H	α-helix	trans	-63.3	-39.7	178.1	-66	178.2	0	0	0	112.4	E82 V85 A86 I99 R100 L105 L106 S107	E82-L103 HydrophobicContact CG-CD2 4.46Å; V85-L103 HydrophobicContact CB-CD2 4.43Å; V85-L103 HydrophobicContact CG1-CD2 4.02Å; V85-L103 HydrophobicContact CG1-CG 4.43Å; A86-L103 HydrophobicContact CB-CD2 3.88Å; I99-L103 HydrophobicContact CG2-CD1 3.58Å; I99-L103 HydrophobicContact CG2-CD2 4.31Å; I99-L103 HydrophobicContact CG2-CG 3.61Å; I99-L103 PolarHBondContact O-N 2.82Å; R100-L103 PolarHBondContact O-N 3.43Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L106 PolarHBondContact O-N 3.5Å; L103-S107 PolarHBondContact O-N 3.29Å; L103-S107 PolarHBondContact O-OG 2.82Å
104	D	84.8	Confident	77.4	Confident	78 Å²	78	72.4 Å²	72.4	42%	0.417	40%	0.396	S	S	.	.	H	α-helix	trans	-66.8	-33.9	175.9	-178.9	64.7	0	0	0	112.5	R100 I102 S107 K108	R100-D104 WeakPolarHBondContact O-CB 3.37Å; R100-D104 PolarHBondContact O-N 3.33Å; I102-D104 PolarHBondContact O-N 2.64Å; D104-S107 WeakPolarHBondContact CA-OG 3.49Å; D104-S107 PolarHBondContact O-OG 3.47Å; D104-K108 WeakPolarHBondContact O-CD 3.27Å; D104-K108 VanDerWaalsContact O-CG 3.26Å; D104-K108 WeakPolarHBondContact O-CG 3.42Å; D104-K108 PolarHBondContact O-N 2.93Å; D104-K108 IonicContact OD1-NZ 3.78Å; D104-K108 WeakPolarHBondContact OD2-CE 3.32Å; D104-K108 IonicContact OD2-NZ 2.64Å; D104-K108 PolarHBondContact OD2-NZ 2.87Å
105	L	80.9	Confident	77.1	Confident	87 Å²	87	73.4 Å²	73.4	46%	0.455	41%	0.407	S	S	.	.	H	α-helix	trans	-66.6	-45.6	171.8	179.8	64.6	0	0	0	110.8	C101 I102 L103 K108 L109	C101-L105 PolarHBondContact O-N 2.96Å; C101-L105 VanDerWaalsContact O-N 3.1Å; I102-L105 WeakPolarHBondContact O-CB 3.5Å; I102-L105 PolarHBondContact O-N 3.24Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L105-K108 PolarHBondContact O-N 3.46Å; L105-L109 HydrophobicContact CD1-CD1 4.38Å; L105-L109 HydrophobicContact CG-CD1 4.03Å; L105-L109 WeakPolarHBondContact O-CD1 3.28Å; L105-L109 VanDerWaalsContact O-CG 3.25Å; L105-L109 WeakPolarHBondContact O-CG 3.05Å; L105-L109 PolarHBondContact O-N 3.17Å; L105-L109 VanDerWaalsContact O-N 3.1Å
106	L	81.2	Confident	77.4	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-65.7	-40.5	-180	-75	172.3	0	0	0	112.6	F28 P78 M81 E82 I102 L103 K108 L109 L110	F28-L106 HydrophobicContact CD2-CD1 4.33Å; F28-L106 HydrophobicContact CE2-CD1 3.87Å; F28-L106 HydrophobicContact CE2-CD2 3.97Å; F28-L106 HydrophobicContact CE2-CG 4Å; P78-L106 HydrophobicContact CB-CD2 3.88Å; M81-L106 HydrophobicContact CB-CD1 4.21Å; M81-L106 HydrophobicContact CB-CD2 3.95Å; E82-L106 HydrophobicContact CB-CD1 4.09Å; I102-L106 HydrophobicContact CG2-CD1 4.02Å; I102-L106 WeakPolarHBondContact O-CG 3.49Å; I102-L106 PolarHBondContact O-N 2.85Å; L103-L106 PolarHBondContact O-N 3.5Å; L106-K108 PolarHBondContact O-N 2.8Å; L106-L109 HydrophobicContact CD2-CD1 4.41Å; L106-L109 WeakPolarHBondContact O-CB 3.37Å; L106-L109 PolarHBondContact O-N 3.42Å; L106-L109 VanDerWaalsContact O-N 3.16Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 VanDerWaalsContact O-CG 3.24Å; L106-L110 WeakPolarHBondContact O-CG 3.25Å; L106-L110 PolarHBondContact O-N 3.13Å
107	S	81	Confident	77.9	Confident	28 Å²	28	74.6 Å²	74.6	20%	0.196	40%	0.401	C	S	.	.	H	α-helix	trans	-61	-44.4	176.3	63.6	0	0	0	0	111.6	L103 D104 L109 L110 G111 Q112	L103-S107 PolarHBondContact O-N 3.29Å; L103-S107 PolarHBondContact O-OG 2.82Å; D104-S107 WeakPolarHBondContact CA-OG 3.49Å; D104-S107 PolarHBondContact O-OG 3.47Å; S107-L109 VanDerWaalsContact C-N 3.29Å; S107-L109 PolarHBondContact O-N 2.93Å; S107-L110 CarbonylContact O-C 3.52Å; S107-L110 PolarHBondContact O-N 2.87Å; S107-L110 VanDerWaalsContact O-N 3.11Å; S107-G111 PolarHBondContact O-N 3.25Å; S107-Q112 PolarHBondContact O-N 3.41Å
108	K	79.5	Confident	78.2	Confident	140 Å²	140	73.1 Å²	73.1	61%	0.609	39%	0.393	S	S	*	.	H	α-helix	trans	-59.2	-39.4	174.3	-73.3	167.9	-178.4	162.2	0	112.4	D104 L105 L106 G111	D104-K108 WeakPolarHBondContact O-CD 3.27Å; D104-K108 VanDerWaalsContact O-CG 3.26Å; D104-K108 WeakPolarHBondContact O-CG 3.42Å; D104-K108 PolarHBondContact O-N 2.93Å; D104-K108 IonicContact OD1-NZ 3.78Å; D104-K108 WeakPolarHBondContact OD2-CE 3.32Å; D104-K108 IonicContact OD2-NZ 2.64Å; D104-K108 PolarHBondContact OD2-NZ 2.87Å; L105-K108 PolarHBondContact O-N 3.46Å; L106-K108 PolarHBondContact O-N 2.8Å; K108-G111 PolarHBondContact O-N 3.29Å
109	L	72.4	Confident	78.7	Confident	79 Å²	79	70.9 Å²	70.9	41%	0.414	38%	0.382	S	S	.	.	H	α-helix	trans	-71.3	-32.3	177.1	-69.9	165.9	0	0	0	112.5	L75 L105 L106 S107 G111	L75-L109 HydrophobicContact CD1-CD2 3.87Å; L75-L109 HydrophobicContact CD2-CB 3.98Å; L75-L109 HydrophobicContact CD2-CD1 3.74Å; L75-L109 HydrophobicContact CD2-CD2 3.97Å; L75-L109 HydrophobicContact CD2-CG 4.11Å; L105-L109 HydrophobicContact CD1-CD1 4.38Å; L105-L109 HydrophobicContact CG-CD1 4.03Å; L105-L109 WeakPolarHBondContact O-CD1 3.28Å; L105-L109 VanDerWaalsContact O-CG 3.25Å; L105-L109 WeakPolarHBondContact O-CG 3.05Å; L105-L109 PolarHBondContact O-N 3.17Å; L105-L109 VanDerWaalsContact O-N 3.1Å; L106-L109 HydrophobicContact CD2-CD1 4.41Å; L106-L109 WeakPolarHBondContact O-CB 3.37Å; L106-L109 PolarHBondContact O-N 3.42Å; L106-L109 VanDerWaalsContact O-N 3.16Å; S107-L109 VanDerWaalsContact C-N 3.29Å; S107-L109 PolarHBondContact O-N 2.93Å; L109-G111 VanDerWaalsContact C-N 3.33Å
110	L	73.5	Confident	78.5	Confident	41 Å²	41	76.3 Å²	76.3	22%	0.215	41%	0.411	C	S	.	.	H	α-helix	trans	-81	-11.9	176.5	-70	167.9	0	0	0	113.4	P78 K79 E82 L106 S107 Q112	P78-L110 HydrophobicContact CB-CD1 4.38Å; P78-L110 HydrophobicContact CB-CD2 3.62Å; P78-L110 HydrophobicContact CB-CG 3.8Å; P78-L110 HydrophobicContact CG-CD2 3.58Å; P78-L110 HydrophobicContact CG-CG 4.14Å; K79-L110 HydrophobicContact CG-CD2 3.69Å; E82-L110 HydrophobicContact CB-CD1 4.35Å; E82-L110 WeakPolarHBondContact OE2-CD1 3.46Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 VanDerWaalsContact O-CG 3.24Å; L106-L110 WeakPolarHBondContact O-CG 3.25Å; L106-L110 PolarHBondContact O-N 3.13Å; S107-L110 CarbonylContact O-C 3.52Å; S107-L110 PolarHBondContact O-N 2.87Å; S107-L110 VanDerWaalsContact O-N 3.11Å; L110-Q112 VanDerWaalsContact C-N 3.29Å; L110-Q112 HydrophobicContact CB-CG 3.98Å
111	G	72.7	Confident	78.1	Confident	72 Å²	72	71.3 Å²	71.3	74%	0.742	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	29.6	-174	0	0	0	0	0	113.1	S107 K108 L109	S107-G111 PolarHBondContact O-N 3.25Å; K108-G111 PolarHBondContact O-N 3.29Å; L109-G111 VanDerWaalsContact C-N 3.33Å
112	Q	61.6	Low	77.6	Confident	169 Å²	169	69.2 Å²	69.2	79%	0.79	38%	0.381	S	S	*	.			trans	-97.4	0	176.7	-65.3	-176.4	36.5	0	0	111.7	S107 L110	S107-Q112 PolarHBondContact O-N 3.41Å; L110-Q112 VanDerWaalsContact C-N 3.29Å; L110-Q112 HydrophobicContact CB-CG 3.98Å

Retrieved 112 of 112 residues in 717.5 ms (Link to these results)

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