A0A077Z7R8_TRITR Loading...

Secreted protein

AlphaFold DB , UniProt , Accession A0A077Z7R8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 201 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	41.1	Very low	209 Å²	209	77.1 Å²	77.1	100%	1.03	44%	0.439	S	S	*	.				0	139.9	0	-71.4	162.4	91.1	0	0	108.1	I62	M1-I62 HydrophobicContact CE-CD1 4.03Å; M1-I62 HydrophobicContact CE-CG1 4.17Å
2	S	29.6	Very low	42.2	Very low	52 Å²	52	77 Å²	77	36%	0.364	44%	0.435	S	S	.	.			trans	-71.9	128	-167.6	-165.9	0	0	0	0	112.1	T4 G5	S2-T4 PolarHBondContact O-N 3.12Å; S2-T4 PolarHBondContact OG-OG1 3.03Å; S2-G5 PolarHBondContact O-N 2.96Å
3	A	34.8	Very low	43	Very low	68 Å²	68	71.9 Å²	71.9	56%	0.562	41%	0.408	S	S	*	.	H	α-helix	trans	-56.4	-21.7	177	0	0	0	0	0	113.6
4	T	38.8	Very low	44	Very low	53 Å²	53	68.1 Å²	68.1	33%	0.325	39%	0.385	S	S	.	.	H	α-helix	trans	-69.7	-28.2	174.2	31.2	0	0	0	0	113.9	S2	S2-T4 PolarHBondContact O-N 3.12Å; S2-T4 PolarHBondContact OG-OG1 3.03Å
5	G	38.1	Very low	44.6	Very low	28 Å²	28	65.7 Å²	65.7	29%	0.289	38%	0.377	S	S	.	.	H	α-helix	trans	-67	-47.1	176.4	0	0	0	0	0	111.9	S2 C7 M8 Y9	S2-G5 PolarHBondContact O-N 2.96Å; G5-C7 VanDerWaalsContact C-N 3.32Å; G5-C7 PolarHBondContact O-N 3.07Å; G5-M8 PolarHBondContact O-N 3Å; G5-Y9 WeakPolarHBondContact O-CD2 3.27Å; G5-Y9 PolarHBondContact O-N 3.42Å; G5-Y9 VanDerWaalsContact O-N 3.15Å
6	N	44.5	Very low	45	Very low	114 Å²	114	63.8 Å²	63.8	61%	0.61	37%	0.371	S	S	*	.	H	α-helix	trans	-61.7	-37.4	-176.6	-74.5	0.4	0	0	0	112.7	M8 V10	N6-M8 PolarHBondContact O-N 3.31Å; N6-V10 WeakPolarHBondContact O-CB 3.34Å; N6-V10 WeakPolarHBondContact O-CG2 3.03Å; N6-V10 PolarHBondContact O-N 3.38Å; N6-V10 VanDerWaalsContact O-N 3.11Å
7	C	38.1	Very low	45.5	Very low	41 Å²	41	62.3 Å²	62.3	28%	0.277	36%	0.363	S	S	.	.	H	α-helix	trans	-67.8	-37.3	-179.9	-63.4	0	0	0	0	112.6	G5 V10 A11	G5-C7 VanDerWaalsContact C-N 3.32Å; G5-C7 PolarHBondContact O-N 3.07Å; C7-V10 PolarHBondContact O-N 3.02Å; C7-A11 PolarHBondContact O-N 2.97Å
8	M	46.3	Very low	45.9	Very low	75 Å²	75	61.6 Å²	61.6	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-70.8	-42.7	178.7	-166.4	-178.9	-81.9	0	0	111.4	G5 N6 V10 A11 I12	G5-M8 PolarHBondContact O-N 3Å; N6-M8 PolarHBondContact O-N 3.31Å; M8-V10 PolarHBondContact O-N 3.32Å; M8-A11 PolarHBondContact O-N 2.94Å; M8-I12 HydrophobicContact CG-CD1 4.08Å; M8-I12 VanDerWaalsContact O-CG1 3.26Å; M8-I12 WeakPolarHBondContact O-CG1 3.37Å; M8-I12 PolarHBondContact O-N 2.83Å
9	Y	47.6	Very low	45.9	Very low	149 Å²	149	61.4 Å²	61.4	58%	0.584	35%	0.353	S	S	*	.	H	α-helix	trans	-59.5	-36.7	173.8	-78.4	-70.6	0	0	0	112.3	G5 I12 A13	G5-Y9 WeakPolarHBondContact O-CD2 3.27Å; G5-Y9 PolarHBondContact O-N 3.42Å; G5-Y9 VanDerWaalsContact O-N 3.15Å; Y9-I12 PolarHBondContact O-N 2.91Å; Y9-A13 VanDerWaalsContact O-CB 3.24Å; Y9-A13 WeakPolarHBondContact O-CB 3.19Å; Y9-A13 PolarHBondContact O-N 3.21Å
10	V	49	Very low	45.7	Very low	32 Å²	32	62.7 Å²	62.7	19%	0.194	36%	0.358	C	S	.	.	H	α-helix	trans	-69.6	-44.4	178.6	170.4	0	0	0	0	111.5	N6 C7 M8 I12 A13 F14 V149	N6-V10 WeakPolarHBondContact O-CB 3.34Å; N6-V10 WeakPolarHBondContact O-CG2 3.03Å; N6-V10 PolarHBondContact O-N 3.38Å; N6-V10 VanDerWaalsContact O-N 3.11Å; C7-V10 PolarHBondContact O-N 3.02Å; M8-V10 PolarHBondContact O-N 3.32Å; V10-I12 VanDerWaalsContact C-N 3.29Å; V10-I12 PolarHBondContact O-N 3.38Å; V10-A13 PolarHBondContact O-N 2.88Å; V10-F14 WeakPolarHBondContact O-CB 3.38Å; V10-F14 PolarHBondContact O-N 3.36Å; V10-V149 HydrophobicContact CB-CG1 4.29Å; V10-V149 HydrophobicContact CB-CG2 4.09Å; V10-V149 HydrophobicContact CG1-CB 4.12Å; V10-V149 HydrophobicContact CG1-CG1 3.69Å; V10-V149 HydrophobicContact CG1-CG2 3.85Å; V10-V149 HydrophobicContact CG2-CB 4.08Å; V10-V149 HydrophobicContact CG2-CG1 3.61Å; V10-V149 HydrophobicContact CG2-CG2 3.34Å
11	A	49	Very low	45.5	Very low	27 Å²	27	61.4 Å²	61.4	22%	0.223	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-40.5	176.2	0	0	0	0	0	111.5	C7 M8 F14 A15	C7-A11 PolarHBondContact O-N 2.97Å; M8-A11 PolarHBondContact O-N 2.94Å; A11-F14 PolarHBondContact O-N 3.14Å; A11-A15 VanDerWaalsContact O-CB 3.27Å; A11-A15 WeakPolarHBondContact O-CB 3.48Å; A11-A15 PolarHBondContact O-N 3.14Å
12	I	53.8	Low	45.6	Very low	76 Å²	76	54.5 Å²	54.5	39%	0.39	33%	0.325	S	S	.	.	H	α-helix	trans	-66.9	-46.4	176.5	-65.9	165.6	0	0	0	110.9	M8 Y9 V10 F14 A15 A16	M8-I12 HydrophobicContact CG-CD1 4.08Å; M8-I12 VanDerWaalsContact O-CG1 3.26Å; M8-I12 WeakPolarHBondContact O-CG1 3.37Å; M8-I12 PolarHBondContact O-N 2.83Å; Y9-I12 PolarHBondContact O-N 2.91Å; V10-I12 VanDerWaalsContact C-N 3.29Å; V10-I12 PolarHBondContact O-N 3.38Å; I12-F14 VanDerWaalsContact C-N 3.27Å; I12-F14 PolarHBondContact O-N 3.05Å; I12-A15 PolarHBondContact O-N 2.89Å; I12-A16 VanDerWaalsContact O-CB 3.3Å; I12-A16 WeakPolarHBondContact O-CB 3.22Å; I12-A16 PolarHBondContact O-N 2.82Å
13	A	53	Low	46.1	Very low	11 Å²	11	55.4 Å²	55.4	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-40.7	176.8	0	0	0	0	0	111.9	Y9 V10 T17 F45	Y9-A13 VanDerWaalsContact O-CB 3.24Å; Y9-A13 WeakPolarHBondContact O-CB 3.19Å; Y9-A13 PolarHBondContact O-N 3.21Å; V10-A13 PolarHBondContact O-N 2.88Å; A13-T17 WeakPolarHBondContact O-CB 3.36Å; A13-T17 PolarHBondContact O-N 2.78Å; A13-T17 PolarHBondContact O-OG1 3.48Å; A13-F45 HydrophobicContact CB-CD1 3.99Å; A13-F45 HydrophobicContact CB-CE1 3.28Å; A13-F45 HydrophobicContact CB-CE2 4.37Å; A13-F45 HydrophobicContact CB-CZ 3.51Å
14	F	56.5	Low	46.2	Very low	18 Å²	18	55.8 Å²	55.8	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-72	-42.9	180	-162.9	-94.4	0	0	0	111.9	V10 A11 I12 A16 T17 I18 W107 L140 F156	V10-F14 WeakPolarHBondContact O-CB 3.38Å; V10-F14 PolarHBondContact O-N 3.36Å; A11-F14 PolarHBondContact O-N 3.14Å; I12-F14 VanDerWaalsContact C-N 3.27Å; I12-F14 PolarHBondContact O-N 3.05Å; F14-A16 VanDerWaalsContact C-N 3.34Å; F14-A16 PolarHBondContact O-N 3.42Å; F14-T17 PolarHBondContact O-N 3.47Å; F14-I18 HydrophobicContact CD1-CD1 3.57Å; F14-I18 HydrophobicContact CD1-CG1 4.28Å; F14-I18 HydrophobicContact CE1-CD1 3.28Å; F14-I18 HydrophobicContact CE1-CG1 3.98Å; F14-I18 HydrophobicContact CZ-CD1 4.24Å; F14-I18 WeakPolarHBondContact O-CG1 3.02Å; F14-I18 PolarHBondContact O-N 3.41Å; F14-W107 HydrophobicContact CD1-CZ2 4.25Å; F14-W107 AromaticContact CE1-CH2 3.92Å; F14-W107 HydrophobicContact CE1-CH2 3.92Å; F14-W107 AromaticContact CE1-CZ2 3.9Å; F14-W107 HydrophobicContact CE1-CZ2 3.9Å; F14-L140 HydrophobicContact CE1-CD1 3.99Å; F14-L140 HydrophobicContact CE1-CD2 3.45Å; F14-L140 VanDerWaalsContact CE1-CD2 3.45Å; F14-L140 HydrophobicContact CE1-CG 4.21Å; F14-L140 HydrophobicContact CE2-CD1 3.91Å; F14-L140 HydrophobicContact CE2-CD2 4.41Å; F14-L140 HydrophobicContact CZ-CD1 3.55Å; F14-L140 HydrophobicContact CZ-CD2 3.31Å; F14-L140 HydrophobicContact CZ-CG 4.05Å; F14-F156 HydrophobicContact CE2-CB 3.8Å; F14-F156 HydrophobicContact CE2-CD2 4.27Å; F14-F156 HydrophobicContact CE2-CG 4.1Å; F14-F156 HydrophobicContact CZ-CB 4.01Å; F14-F156 AromaticContact CZ-CD2 3.88Å; F14-F156 HydrophobicContact CZ-CD2 3.88Å; F14-F156 HydrophobicContact CZ-CG 4.17Å
15	A	52.7	Low	46.4	Very low	32 Å²	32	60.5 Å²	60.5	26%	0.264	34%	0.344	S	S	.	.	H	α-helix	trans	-61.8	-41.2	173	0	0	0	0	0	111.8	A11 I12 I18 H19	A11-A15 VanDerWaalsContact O-CB 3.27Å; A11-A15 WeakPolarHBondContact O-CB 3.48Å; A11-A15 PolarHBondContact O-N 3.14Å; I12-A15 PolarHBondContact O-N 2.89Å; A15-I18 PolarHBondContact O-N 3.45Å; A15-H19 WeakPolarHBondContact O-CB 3.13Å; A15-H19 PolarHBondContact O-CD2 2.08Å; A15-H19 PolarHBondContact O-N 3.46Å
16	A	52.3	Low	46.5	Very low	35 Å²	35	64.4 Å²	64.4	29%	0.289	36%	0.358	S	S	.	.	H	α-helix	trans	-63.6	-40.6	173.7	0	0	0	0	0	111.8	I12 F14 H19 L20	I12-A16 VanDerWaalsContact O-CB 3.3Å; I12-A16 WeakPolarHBondContact O-CB 3.22Å; I12-A16 PolarHBondContact O-N 2.82Å; F14-A16 VanDerWaalsContact C-N 3.34Å; F14-A16 PolarHBondContact O-N 3.42Å; A16-H19 PolarHBondContact O-N 2.94Å; A16-L20 WeakPolarHBondContact O-CB 3.43Å; A16-L20 VanDerWaalsContact O-CG 3.26Å; A16-L20 WeakPolarHBondContact O-CG 3.08Å; A16-L20 PolarHBondContact O-N 2.77Å
17	T	52.3	Low	46.3	Very low	39 Å²	39	63.9 Å²	63.9	24%	0.239	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-41.2	177.7	-56.2	0	0	0	0	111.6	A13 F14 L20 C21 F156	A13-T17 WeakPolarHBondContact O-CB 3.36Å; A13-T17 PolarHBondContact O-N 2.78Å; A13-T17 PolarHBondContact O-OG1 3.48Å; F14-T17 PolarHBondContact O-N 3.47Å; T17-L20 PolarHBondContact O-N 2.83Å; T17-C21 WeakPolarHBondContact O-CB 2.89Å; T17-C21 PolarHBondContact O-N 3.48Å; T17-C21 PolarHBondContact O-SG 3.42Å; T17-F156 HydrophobicContact CG2-CE1 3.92Å; T17-F156 HydrophobicContact CG2-CZ 4.29Å
18	I	52.8	Low	46.3	Very low	50 Å²	50	65.3 Å²	65.3	26%	0.256	35%	0.353	S	S	.	.	H	α-helix	trans	-64.8	-42.4	172.7	-67.6	166.4	0	0	0	110.7	F14 A15 L20 C21 S22 W107 F156	F14-I18 HydrophobicContact CD1-CD1 3.57Å; F14-I18 HydrophobicContact CD1-CG1 4.28Å; F14-I18 HydrophobicContact CE1-CD1 3.28Å; F14-I18 HydrophobicContact CE1-CG1 3.98Å; F14-I18 HydrophobicContact CZ-CD1 4.24Å; F14-I18 WeakPolarHBondContact O-CG1 3.02Å; F14-I18 PolarHBondContact O-N 3.41Å; A15-I18 PolarHBondContact O-N 3.45Å; I18-L20 PolarHBondContact O-N 3.06Å; I18-C21 PolarHBondContact O-N 3.07Å; I18-S22 WeakPolarHBondContact O-CB 3.42Å; I18-S22 PolarHBondContact O-N 2.96Å; I18-W107 HydrophobicContact CD1-CH2 4.47Å; I18-W107 HydrophobicContact CD1-CZ2 3.83Å; I18-F156 HydrophobicContact CG1-CE2 4.31Å
19	H	45.9	Very low	45.8	Very low	58 Å²	58	64.8 Å²	64.8	27%	0.269	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-43.7	177.2	-101.5	-72.1	0	0	0	112.3	A15 A16 S22 A23 I82	A15-H19 WeakPolarHBondContact O-CB 3.13Å; A15-H19 PolarHBondContact O-CD2 2.08Å; A15-H19 PolarHBondContact O-N 3.46Å; A16-H19 PolarHBondContact O-N 2.94Å; H19-S22 PolarHBondContact O-N 3.4Å; H19-A23 VanDerWaalsContact O-CB 3.31Å; H19-A23 WeakPolarHBondContact O-CB 2.98Å; H19-A23 PolarHBondContact O-N 2.78Å; H19-I82 WeakPolarHBondContact NE2-CD1 3.36Å
20	L	42.4	Very low	45.3	Very low	86 Å²	86	65 Å²	65	45%	0.45	35%	0.353	S	S	.	.	H	α-helix	trans	-64.8	-40.1	175.7	-71.8	164.8	0	0	0	111.4	A16 T17 I18 S22 A23 E24	A16-L20 WeakPolarHBondContact O-CB 3.43Å; A16-L20 VanDerWaalsContact O-CG 3.26Å; A16-L20 WeakPolarHBondContact O-CG 3.08Å; A16-L20 PolarHBondContact O-N 2.77Å; T17-L20 PolarHBondContact O-N 2.83Å; I18-L20 PolarHBondContact O-N 3.06Å; L20-S22 PolarHBondContact O-N 2.77Å; L20-A23 PolarHBondContact O-N 3.08Å; L20-E24 PolarHBondContact O-N 3.47Å
21	C	40.9	Very low	44.5	Very low	36 Å²	36	69.8 Å²	69.8	24%	0.243	38%	0.377	C	S	.	.	H	α-helix	trans	-71.7	-26.7	176.6	-68.7	0	0	0	0	113.9	T17 I18 F29 F156	T17-C21 WeakPolarHBondContact O-CB 2.89Å; T17-C21 PolarHBondContact O-N 3.48Å; T17-C21 PolarHBondContact O-SG 3.42Å; I18-C21 PolarHBondContact O-N 3.07Å; C21-F29 HydrophobicContact CB-CE2 4.43Å; C21-F29 WeakPolarHBondContact SG-CZ 3.19Å; C21-F156 HydrophobicContact CB-CZ 4.48Å
22	S	39.7	Very low	43.8	Very low	64 Å²	64	71 Å²	71	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-83.5	-21.4	176.1	176	0	0	0	0	112.8	I18 H19 L20 R75	I18-S22 WeakPolarHBondContact O-CB 3.42Å; I18-S22 PolarHBondContact O-N 2.96Å; H19-S22 PolarHBondContact O-N 3.4Å; L20-S22 PolarHBondContact O-N 2.77Å; S22-R75 PolarHBondContact OG-NH1 3.33Å
23	A	39.6	Very low	42.6	Very low	71 Å²	71	71.3 Å²	71.3	59%	0.587	39%	0.386	S	S	*	.	H	α-helix	trans	-86.8	-25.7	-179.2	0	0	0	0	0	113.5	H19 L20	H19-A23 VanDerWaalsContact O-CB 3.31Å; H19-A23 WeakPolarHBondContact O-CB 2.98Å; H19-A23 PolarHBondContact O-N 2.78Å; L20-A23 PolarHBondContact O-N 3.08Å
24	E	37.4	Very low	41.9	Very low	77 Å²	77	76.8 Å²	76.8	36%	0.36	41%	0.408	S	S	.	.			trans	-125.9	79.3	-178.9	-80.4	-175.8	99.1	0	0	112.6	L20 N26 F28	L20-E24 PolarHBondContact O-N 3.47Å; E24-N26 PolarHBondContact O-N 2.97Å; E24-F28 HydrophobicContact CB-CB 3.98Å; E24-F28 WeakPolarHBondContact OE2-CB 3.27Å; E24-F28 WeakPolarHBondContact OE2-CD2 3.25Å
25	E	42.4	Very low	40.8	Very low	151 Å²	151	83.4 Å²	83.4	71%	0.706	45%	0.445	S	S	*	.	S	Bend	trans	-67.1	91.6	148.5	-66.1	-162.6	149.4	0	0	107.9
26	N	39.6	Very low	39.9	Very low	110 Å²	110	86.7 Å²	86.7	59%	0.588	46%	0.458	S	S	*	.	S	Bend	trans	146.1	-12.7	138	-70	-46.7	0	0	0	117.1	E24	E24-N26 PolarHBondContact O-N 2.97Å
27	E	41.5	Very low	39	Very low	103 Å²	103	86.5 Å²	86.5	48%	0.481	46%	0.456	S	S	.	.	S	Bend	trans	-127.8	-32.7	-173.2	-69.5	-73.9	116.1	0	0	115.5	F29 K30 L31	E27-F29 PolarHBondContact O-N 3.41Å; E27-K30 WeakPolarHBondContact O-CB 3.22Å; E27-K30 PolarHBondContact O-N 3.31Å; E27-K30 IonicContact OE1-NZ 3.77Å; E27-K30 PolarHBondContact OE1-NZ 3.39Å; E27-L31 PolarHBondContact O-N 2.87Å
28	F	37.6	Very low	38.5	Very low	71 Å²	71	90.2 Å²	90.2	31%	0.311	47%	0.469	S	S	.	.	H	α-helix	trans	-59.1	-40.8	-178.1	-160.9	-104.1	0	0	0	114.3	E24 K30 L31 L32	E24-F28 HydrophobicContact CB-CB 3.98Å; E24-F28 WeakPolarHBondContact OE2-CB 3.27Å; E24-F28 WeakPolarHBondContact OE2-CD2 3.25Å; F28-K30 VanDerWaalsContact C-N 3.26Å; F28-K30 PolarHBondContact O-N 2.88Å; F28-L31 PolarHBondContact O-N 3.43Å; F28-L32 HydrophobicContact CD1-CD1 4.03Å; F28-L32 HydrophobicContact CE1-CD1 3.93Å; F28-L32 HydrophobicContact CE1-CG 4.42Å; F28-L32 PolarHBondContact O-N 3.41Å
29	F	36.3	Very low	38	Very low	65 Å²	65	91.3 Å²	91.3	29%	0.285	48%	0.475	S	S	.	.	H	α-helix	trans	-73	-15.3	179.3	-77.7	-73.8	0	0	0	113.8	C21 E27 L32 F34 V160	C21-F29 HydrophobicContact CB-CE2 4.43Å; C21-F29 WeakPolarHBondContact SG-CZ 3.19Å; E27-F29 PolarHBondContact O-N 3.41Å; F29-L32 HydrophobicContact CD1-CD1 4.35Å; F29-F34 HydrophobicContact CB-CZ 4.27Å; F29-F34 HydrophobicContact CD1-CE1 4.08Å; F29-F34 AromaticContact CD1-CZ 3.82Å; F29-F34 HydrophobicContact CD1-CZ 3.82Å; F29-F34 WeakPolarHBondContact O-CE2 3.26Å; F29-F34 WeakPolarHBondContact O-CZ 3.14Å; F29-V160 HydrophobicContact CE1-CG1 4.25Å; F29-V160 HydrophobicContact CZ-CG1 4.39Å
30	K	36.1	Very low	37.6	Very low	154 Å²	154	91.5 Å²	91.5	67%	0.67	48%	0.483	S	S	*	.	H	α-helix	trans	-81.2	-25.2	171.7	-69.2	-179.9	-170.6	160	0	112	E27 F28	E27-K30 WeakPolarHBondContact O-CB 3.22Å; E27-K30 PolarHBondContact O-N 3.31Å; E27-K30 IonicContact OE1-NZ 3.77Å; E27-K30 PolarHBondContact OE1-NZ 3.39Å; F28-K30 VanDerWaalsContact C-N 3.26Å; F28-K30 PolarHBondContact O-N 2.88Å
31	L	33.4	Very low	37.4	Very low	131 Å²	131	89.9 Å²	89.9	69%	0.686	47%	0.473	S	S	*	.	H	α-helix	trans	-85.4	-10.3	-179.1	-77.1	162.7	0	0	0	113.6	E27 F28 P33	E27-L31 PolarHBondContact O-N 2.87Å; F28-L31 PolarHBondContact O-N 3.43Å; L31-P33 WeakPolarHBondContact O-CD 3.35Å
32	L	33.1	Very low	37.4	Very low	53 Å²	53	91.8 Å²	91.8	28%	0.277	48%	0.477	S	S	.	.			trans	-87	106.5	175.4	-70.8	169.6	0	0	0	109.5	F28 F29 F34 A37	F28-L32 HydrophobicContact CD1-CD1 4.03Å; F28-L32 HydrophobicContact CE1-CD1 3.93Å; F28-L32 HydrophobicContact CE1-CG 4.42Å; F28-L32 PolarHBondContact O-N 3.41Å; F29-L32 HydrophobicContact CD1-CD1 4.35Å; L32-F34 VanDerWaalsContact C-N 3.27Å; L32-F34 HydrophobicContact CB-CE1 4.49Å; L32-F34 HydrophobicContact CB-CZ 4.46Å; L32-F34 WeakPolarHBondContact O-CD2 3.25Å; L32-F34 PolarHBondContact O-N 3.36Å; L32-A37 HydrophobicContact CD2-CB 4.28Å
33	P	29.5	Very low	37.5	Very low	82 Å²	82	97.7 Å²	97.7	53%	0.532	49%	0.489	S	S	.	.			trans	-63	97.9	160.8	27.1	-32.2	0	0	0	106.7	L31 N35 N36 A37	L31-P33 WeakPolarHBondContact O-CD 3.35Å; P33-N35 PolarHBondContact O-N 3.17Å; P33-N36 HydrophobicContact CG-CB 4.47Å; P33-N36 PolarHBondContact O-N 3.35Å; P33-A37 PolarHBondContact O-N 2.83Å
34	F	38.1	Very low	37.3	Very low	126 Å²	126	100.3 Å²	100.3	55%	0.553	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-6.4	-175.8	-70.9	-81.3	0	0	0	114.2	F29 L32	F29-F34 HydrophobicContact CB-CZ 4.27Å; F29-F34 HydrophobicContact CD1-CE1 4.08Å; F29-F34 AromaticContact CD1-CZ 3.82Å; F29-F34 HydrophobicContact CD1-CZ 3.82Å; F29-F34 WeakPolarHBondContact O-CE2 3.26Å; F29-F34 WeakPolarHBondContact O-CZ 3.14Å; L32-F34 VanDerWaalsContact C-N 3.27Å; L32-F34 HydrophobicContact CB-CE1 4.49Å; L32-F34 HydrophobicContact CB-CZ 4.46Å; L32-F34 WeakPolarHBondContact O-CD2 3.25Å; L32-F34 PolarHBondContact O-N 3.36Å
35	N	32.5	Very low	37.4	Very low	158 Å²	158	100.1 Å²	100.1	85%	0.845	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-23	170.4	-79.4	-11.1	0	0	0	114	P33	P33-N35 PolarHBondContact O-N 3.17Å
36	N	35.1	Very low	37.2	Very low	101 Å²	101	99.6 Å²	99.6	54%	0.54	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-17.6	-175.9	-70	-11.7	0	0	0	113.9	P33 F38 D39 S40	P33-N36 HydrophobicContact CG-CB 4.47Å; P33-N36 PolarHBondContact O-N 3.35Å; N36-F38 PolarHBondContact O-N 2.89Å; N36-D39 PolarHBondContact O-N 2.93Å; N36-S40 PolarHBondContact O-N 2.87Å; N36-S40 PolarHBondContact O-OG 3.32Å
37	A	33.5	Very low	36.9	Very low	30 Å²	30	97.1 Å²	97.1	25%	0.248	48%	0.48	C	S	.	.	H	α-helix	trans	-57.2	-34.8	-177.5	0	0	0	0	0	112.5	L32 P33 F41	L32-A37 HydrophobicContact CD2-CB 4.28Å; P33-A37 PolarHBondContact O-N 2.83Å; A37-F41 WeakPolarHBondContact O-CB 3.08Å; A37-F41 PolarHBondContact O-N 3.12Å
38	F	40.7	Very low	36.4	Very low	118 Å²	118	99.7 Å²	99.7	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-68.1	-36.3	177.2	-169.2	-121.5	0	0	0	112.8	N36 K42	N36-F38 PolarHBondContact O-N 2.89Å; F38-K42 HydrophobicContact CD1-CD 4.18Å; F38-K42 HydrophobicContact CE1-CD 4.1Å; F38-K42 VanDerWaalsContact CZ-CE 3.49Å; F38-K42 WeakPolarHBondContact O-CB 3.31Å; F38-K42 VanDerWaalsContact O-CG 3.27Å; F38-K42 WeakPolarHBondContact O-CG 3.25Å; F38-K42 PolarHBondContact O-N 2.91Å
39	D	41.8	Very low	36	Very low	72 Å²	72	101 Å²	101	39%	0.385	51%	0.507	S	S	.	.	H	α-helix	trans	-77.4	-38.4	179.1	-152.4	39.5	0	0	0	110.9	N36 F41 K42 R43	N36-D39 PolarHBondContact O-N 2.93Å; D39-F41 VanDerWaalsContact C-N 3.34Å; D39-F41 PolarHBondContact O-N 2.86Å; D39-K42 PolarHBondContact O-N 3.45Å; D39-R43 WeakPolarHBondContact O-CB 3.31Å; D39-R43 WeakPolarHBondContact O-CG 3.37Å; D39-R43 PolarHBondContact O-N 2.83Å; D39-R43 IonicContact OD2-CZ 3.45Å; D39-R43 IonicContact OD2-NE 3.48Å; D39-R43 PolarHBondContact OD2-NE 3.27Å; D39-R43 IonicContact OD2-NH2 2.88Å; D39-R43 PolarHBondContact OD2-NH2 3.46Å
40	S	37.5	Very low	35.6	Very low	63 Å²	63	104.7 Å²	104.7	44%	0.441	54%	0.535	S	S	.	.	H	α-helix	trans	-62.9	-39.1	170.2	-66	0	0	0	0	112.2	N36 R43 L44	N36-S40 PolarHBondContact O-N 2.87Å; N36-S40 PolarHBondContact O-OG 3.32Å; S40-R43 PolarHBondContact O-N 3.42Å; S40-L44 WeakPolarHBondContact O-CB 3.36Å; S40-L44 PolarHBondContact O-N 2.96Å
41	F	39.5	Very low	35.2	Very low	52 Å²	52	103.6 Å²	103.6	23%	0.228	54%	0.537	C	S	.	.	H	α-helix	trans	-69.3	-43.4	176.4	-174.2	-88.1	0	0	0	111.7	A37 D39 R43 L44 F45 L47 I153	A37-F41 WeakPolarHBondContact O-CB 3.08Å; A37-F41 PolarHBondContact O-N 3.12Å; D39-F41 VanDerWaalsContact C-N 3.34Å; D39-F41 PolarHBondContact O-N 2.86Å; F41-R43 VanDerWaalsContact C-N 3.28Å; F41-R43 PolarHBondContact O-N 3.42Å; F41-L44 PolarHBondContact O-N 2.92Å; F41-F45 HydrophobicContact CD1-CD2 4.03Å; F41-F45 AromaticContact CD2-CD2 3.67Å; F41-F45 HydrophobicContact CD2-CD2 3.67Å; F41-F45 AromaticContact CD2-CE2 3.58Å; F41-F45 HydrophobicContact CD2-CE2 3.58Å; F41-F45 AromaticContact CE1-CD2 3.83Å; F41-F45 HydrophobicContact CE1-CD2 3.83Å; F41-F45 HydrophobicContact CE1-CE2 4.44Å; F41-F45 AromaticContact CE2-CD2 3.47Å; F41-F45 HydrophobicContact CE2-CD2 3.47Å; F41-F45 VanDerWaalsContact CE2-CD2 3.47Å; F41-F45 AromaticContact CE2-CE2 3.25Å; F41-F45 HydrophobicContact CE2-CE2 3.25Å; F41-F45 HydrophobicContact CE2-CZ 4.27Å; F41-F45 AromaticContact CG-CD2 3.95Å; F41-F45 HydrophobicContact CG-CD2 3.95Å; F41-F45 HydrophobicContact CG-CE2 4.32Å; F41-F45 AromaticContact CZ-CD2 3.55Å; F41-F45 HydrophobicContact CZ-CD2 3.55Å; F41-F45 AromaticContact CZ-CE2 3.74Å; F41-F45 HydrophobicContact CZ-CE2 3.74Å; F41-F45 HydrophobicContact CZ-CG 4.37Å; F41-F45 WeakPolarHBondContact O-CD2 3.3Å; F41-F45 PolarHBondContact O-N 3.41Å; F41-L47 HydrophobicContact CD1-CD1 3.93Å; F41-L47 HydrophobicContact CE1-CD1 3.44Å; F41-L47 VanDerWaalsContact CE1-CD1 3.44Å; F41-L47 HydrophobicContact CZ-CD1 4.43Å; F41-I153 HydrophobicContact CE1-CD1 3.5Å; F41-I153 HydrophobicContact CZ-CD1 3.75Å
42	K	41.4	Very low	35	Very low	76 Å²	76	103 Å²	103	33%	0.33	54%	0.539	S	S	.	.	H	α-helix	trans	-57	-42	171	-82.4	175.2	171.6	177.5	0	112.1	F38 D39 N46 L47	F38-K42 HydrophobicContact CD1-CD 4.18Å; F38-K42 HydrophobicContact CE1-CD 4.1Å; F38-K42 VanDerWaalsContact CZ-CE 3.49Å; F38-K42 WeakPolarHBondContact O-CB 3.31Å; F38-K42 VanDerWaalsContact O-CG 3.27Å; F38-K42 WeakPolarHBondContact O-CG 3.25Å; F38-K42 PolarHBondContact O-N 2.91Å; D39-K42 PolarHBondContact O-N 3.45Å; K42-N46 VanDerWaalsContact O-CA 3.29Å; K42-N46 WeakPolarHBondContact O-CA 3.17Å; K42-N46 PolarHBondContact O-N 3.43Å; K42-L47 PolarHBondContact O-N 2.78Å; K42-L47 VanDerWaalsContact O-N 3.13Å
43	R	39.9	Very low	34.8	Very low	187 Å²	187	108.8 Å²	108.8	71%	0.706	56%	0.564	S	S	*	*	H	α-helix	trans	-69.1	-41.1	176.2	-72.7	175.4	-163.6	-160.5	7.5	112.4	D39 S40 F41	D39-R43 WeakPolarHBondContact O-CB 3.31Å; D39-R43 WeakPolarHBondContact O-CG 3.37Å; D39-R43 PolarHBondContact O-N 2.83Å; D39-R43 IonicContact OD2-CZ 3.45Å; D39-R43 IonicContact OD2-NE 3.48Å; D39-R43 PolarHBondContact OD2-NE 3.27Å; D39-R43 IonicContact OD2-NH2 2.88Å; D39-R43 PolarHBondContact OD2-NH2 3.46Å; S40-R43 PolarHBondContact O-N 3.42Å; F41-R43 VanDerWaalsContact C-N 3.28Å; F41-R43 PolarHBondContact O-N 3.42Å
44	L	36.6	Very low	34.6	Very low	126 Å²	126	113.2 Å²	113.2	66%	0.66	58%	0.578	S	S	*	*	H	α-helix	trans	-64.7	-40.6	179.7	-118.4	108.6	0	0	0	112	S40 F41	S40-L44 WeakPolarHBondContact O-CB 3.36Å; S40-L44 PolarHBondContact O-N 2.96Å; F41-L44 PolarHBondContact O-N 2.92Å
45	F	39.2	Very low	34.1	Very low	74 Å²	74	115.3 Å²	115.3	33%	0.325	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102	6.3	-174.9	-68.6	-73.6	0	0	0	113.7	A13 F41 L47	A13-F45 HydrophobicContact CB-CD1 3.99Å; A13-F45 HydrophobicContact CB-CE1 3.28Å; A13-F45 HydrophobicContact CB-CE2 4.37Å; A13-F45 HydrophobicContact CB-CZ 3.51Å; F41-F45 HydrophobicContact CD1-CD2 4.03Å; F41-F45 AromaticContact CD2-CD2 3.67Å; F41-F45 HydrophobicContact CD2-CD2 3.67Å; F41-F45 AromaticContact CD2-CE2 3.58Å; F41-F45 HydrophobicContact CD2-CE2 3.58Å; F41-F45 AromaticContact CE1-CD2 3.83Å; F41-F45 HydrophobicContact CE1-CD2 3.83Å; F41-F45 HydrophobicContact CE1-CE2 4.44Å; F41-F45 AromaticContact CE2-CD2 3.47Å; F41-F45 HydrophobicContact CE2-CD2 3.47Å; F41-F45 VanDerWaalsContact CE2-CD2 3.47Å; F41-F45 AromaticContact CE2-CE2 3.25Å; F41-F45 HydrophobicContact CE2-CE2 3.25Å; F41-F45 HydrophobicContact CE2-CZ 4.27Å; F41-F45 AromaticContact CG-CD2 3.95Å; F41-F45 HydrophobicContact CG-CD2 3.95Å; F41-F45 HydrophobicContact CG-CE2 4.32Å; F41-F45 AromaticContact CZ-CD2 3.55Å; F41-F45 HydrophobicContact CZ-CD2 3.55Å; F41-F45 AromaticContact CZ-CE2 3.74Å; F41-F45 HydrophobicContact CZ-CE2 3.74Å; F41-F45 HydrophobicContact CZ-CG 4.37Å; F41-F45 WeakPolarHBondContact O-CD2 3.3Å; F41-F45 PolarHBondContact O-N 3.41Å; F45-L47 HydrophobicContact CB-CD1 3.62Å; F45-L47 HydrophobicContact CB-CG 3.64Å; F45-L47 HydrophobicContact CG-CD1 4.45Å; F45-L47 PolarHBondContact O-N 3.45Å
46	N	38.1	Very low	33.8	Very low	139 Å²	139	113.1 Å²	113.1	74%	0.743	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	42.7	39.2	-175.5	-144.9	12	0	0	0	112	K42 Q48	K42-N46 VanDerWaalsContact O-CA 3.29Å; K42-N46 WeakPolarHBondContact O-CA 3.17Å; K42-N46 PolarHBondContact O-N 3.43Å; N46-Q48 PolarHBondContact O-N 3.14Å
47	L	33.6	Very low	33.4	Very low	59 Å²	59	116.3 Å²	116.3	31%	0.309	59%	0.593	S	S	.	*			trans	-76.2	78	-176.3	-75	163.4	0	0	0	107.5	F41 K42 F45 P49 V149	F41-L47 HydrophobicContact CD1-CD1 3.93Å; F41-L47 HydrophobicContact CE1-CD1 3.44Å; F41-L47 VanDerWaalsContact CE1-CD1 3.44Å; F41-L47 HydrophobicContact CZ-CD1 4.43Å; K42-L47 PolarHBondContact O-N 2.78Å; K42-L47 VanDerWaalsContact O-N 3.13Å; F45-L47 HydrophobicContact CB-CD1 3.62Å; F45-L47 HydrophobicContact CB-CG 3.64Å; F45-L47 HydrophobicContact CG-CD1 4.45Å; F45-L47 PolarHBondContact O-N 3.45Å; L47-P49 WeakPolarHBondContact O-CD 3.49Å; L47-V149 HydrophobicContact CD2-CG1 4.23Å
48	Q	30.7	Very low	33.1	Very low	157 Å²	157	121.9 Å²	121.9	73%	0.734	62%	0.624	S	S	*	*			trans	-65.2	125.4	162.2	-85.2	-153.9	-41.3	0	0	107.9	N46 T50	N46-Q48 PolarHBondContact O-N 3.14Å; Q48-T50 PolarHBondContact O-N 2.78Å
49	P	29.7	Very low	32.4	Very low	98 Å²	98	119.7 Å²	119.7	64%	0.636	64%	0.635	S	S	*	*			trans	-61.6	106.7	169.6	26	-30.3	0	0	0	106.6	L47 N51	L47-P49 WeakPolarHBondContact O-CD 3.49Å; P49-N51 PolarHBondContact O-N 3.47Å
50	T	28.4	Very low	31.6	Very low	143 Å²	143	126 Å²	126	88%	0.877	66%	0.659	S	S	*	*			trans	-76.6	71.9	174.7	5.7	0	0	0	0	107.2	Q48 T52	Q48-T50 PolarHBondContact O-N 2.78Å; T50-T52 PolarHBondContact O-N 2.97Å
51	N	27.1	Very low	31	Very low	131 Å²	131	128.6 Å²	128.6	70%	0.701	68%	0.675	S	S	*	*			trans	-74	116	157.6	-75.8	-40.3	0	0	0	106.3	P49	P49-N51 PolarHBondContact O-N 3.47Å
52	T	29.1	Very low	30.4	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.724	69%	0.691	S	S	*	*	S	Bend	trans	76.8	139.3	148.7	-28	0	0	0	0	116.4	T50 Q54	T50-T52 PolarHBondContact O-N 2.97Å; T52-Q54 PolarHBondContact O-N 3.47Å
53	E	28	Very low	29.5	Very low	175 Å²	175	134.2 Å²	134.2	82%	0.818	71%	0.709	S	S	*	*	S	Bend	trans	-37.7	122.3	170.4	-62.7	161.1	96.4	0	0	112.9
54	Q	25.9	Very low	28.7	Very low	174 Å²	174	134.2 Å²	134.2	81%	0.813	71%	0.714	S	S	*	*			trans	149.2	142.1	138.9	-83.1	-178.5	-13.2	0	0	112.8	T52	T52-Q54 PolarHBondContact O-N 3.47Å
55	Q	28.1	Very low	28.1	Very low	170 Å²	170	136 Å²	136	79%	0.794	72%	0.717	S	S	*	*			trans	82.7	100.2	161.9	-48.2	-142.1	-11	0	0	116.3
56	V	26.5	Very low	27.3	Very low	112 Å²	112	137.7 Å²	137.7	68%	0.679	74%	0.738	S	S	*	*				75.6	113.6	69.9	174.4	0	0	0	0	112.6
57	Q	25.4	Very low	26.8	Very low	168 Å²	168	138.6 Å²	138.6	79%	0.785	74%	0.736	S	S	*	*			trans	40.5	117.3	143.8	-60.8	166.7	1.5	0	0	118
58	T	28.5	Very low	26.3	Very low	147 Å²	147	144.3 Å²	144.3	90%	0.902	76%	0.761	S	S	*	*				178.8	141.9	108.9	30.3	0	0	0	0	109.9
59	G	25.2	Very low	26.2	Very low	73 Å²	73	142.9 Å²	142.9	75%	0.753	76%	0.757	S	S	*	*			trans	-74.9	147.8	-168.1	0	0	0	0	0	115.1
60	K	25.5	Very low	25.9	Very low	203 Å²	203	144.1 Å²	144.1	88%	0.883	76%	0.762	S	S	*	*			trans	-171.8	156.7	146.7	-105	163.6	-176	-179.4	0	110
61	P	25.1	Very low	25.7	Very low	118 Å²	118	146.1 Å²	146.1	77%	0.766	76%	0.761	S	S	*	*			trans	-80.5	146.9	-143.9	31.6	-35.7	0	0	0	114.2	L63	P61-L63 PolarHBondContact O-N 3.32Å
62	I	26.1	Very low	25.6	Very low	112 Å²	112	148.9 Å²	148.9	57%	0.574	77%	0.768	S	S	*	*			trans	-68.8	111.6	172.6	-62.2	170.4	0	0	0	108.1	M1 F64	M1-I62 HydrophobicContact CE-CD1 4.03Å; M1-I62 HydrophobicContact CE-CG1 4.17Å; I62-F64 PolarHBondContact O-N 2.79Å
63	L	22.4	Very low	25.5	Very low	135 Å²	135	148.1 Å²	148.1	71%	0.707	77%	0.767	S	S	*	*			trans	-65	109.7	165.2	-97.7	157.7	0	0	0	108.4	P61 F65	P61-L63 PolarHBondContact O-N 3.32Å; L63-F65 HydrophobicContact CB-CD2 4.3Å; L63-F65 HydrophobicContact CB-CE2 3.97Å; L63-F65 PolarHBondContact O-N 2.79Å; L63-F65 VanDerWaalsContact O-N 3.13Å
64	F	22.8	Very low	25.5	Very low	187 Å²	187	150.6 Å²	150.6	82%	0.82	77%	0.769	S	S	*	*			trans	-64.6	104.4	163.7	-99.2	-99.5	0	0	0	108.1	I62 S66	I62-F64 PolarHBondContact O-N 2.79Å; F64-S66 PolarHBondContact O-N 3.23Å
65	F	24.3	Very low	25.7	Very low	162 Å²	162	148 Å²	148	71%	0.711	75%	0.751	S	S	*	*			trans	-83.4	103.4	163.7	-78.2	-84.2	0	0	0	108.2	L63 F67	L63-F65 HydrophobicContact CB-CD2 4.3Å; L63-F65 HydrophobicContact CB-CE2 3.97Å; L63-F65 PolarHBondContact O-N 2.79Å; L63-F65 VanDerWaalsContact O-N 3.13Å; F65-F67 PolarHBondContact O-N 3.31Å
66	S	22.8	Very low	25.8	Very low	110 Å²	110	146.9 Å²	146.9	77%	0.769	75%	0.751	S	S	*	*			trans	-67.6	112.8	161.1	-65	0	0	0	0	107.9	F64 E68	F64-S66 PolarHBondContact O-N 3.23Å; S66-E68 PolarHBondContact O-N 3.4Å
67	F	26.6	Very low	26.1	Very low	158 Å²	158	145.6 Å²	145.6	69%	0.693	75%	0.752	S	S	*	*			trans	-75.6	106.7	162.6	-94.9	-95	0	0	0	107.5	F65 I69	F65-F67 PolarHBondContact O-N 3.31Å; F67-I69 PolarHBondContact O-N 2.89Å; F67-I69 VanDerWaalsContact O-N 3.09Å
68	E	24	Very low	26.5	Very low	180 Å²	180	140 Å²	140	84%	0.841	73%	0.727	S	S	*	*			trans	-66.9	103.2	159.3	-86.8	-173.8	124.1	0	0	107.7	S66 V70	S66-E68 PolarHBondContact O-N 3.4Å; E68-V70 VanDerWaalsContact C-N 3.31Å; E68-V70 PolarHBondContact O-N 3.31Å
69	I	28.8	Very low	26.6	Very low	127 Å²	127	137 Å²	137	65%	0.651	71%	0.705	S	S	*	*			trans	-70.4	96.6	165.5	-60	175.3	0	0	0	105.6	F67 H71	F67-I69 PolarHBondContact O-N 2.89Å; F67-I69 VanDerWaalsContact O-N 3.09Å; I69-H71 PolarHBondContact O-N 2.91Å; I69-H71 VanDerWaalsContact O-N 3.15Å
70	V	23.7	Very low	26.8	Very low	123 Å²	123	137 Å²	137	75%	0.745	69%	0.693	S	S	*	*			trans	-58.7	120.7	174.8	176.9	0	0	0	0	108.2	E68 F72	E68-V70 VanDerWaalsContact C-N 3.31Å; E68-V70 PolarHBondContact O-N 3.31Å; V70-F72 PolarHBondContact O-N 3.39Å
71	H	24.5	Very low	27.2	Very low	186 Å²	186	130.1 Å²	130.1	86%	0.861	67%	0.671	S	S	*	*			trans	-51.7	96.3	-176.6	-139.3	-98.6	0	0	0	111.1	I69	I69-H71 PolarHBondContact O-N 2.91Å; I69-H71 VanDerWaalsContact O-N 3.15Å
72	F	25.2	Very low	27.7	Very low	189 Å²	189	127.1 Å²	127.1	83%	0.829	65%	0.648	S	S	*	*			trans	-110.3	109	170.5	-146.6	-93.1	0	0	0	110.1	V70	V70-F72 PolarHBondContact O-N 3.39Å
73	S	26.2	Very low	27.8	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	65%	0.646	S	S	*	*	S	Bend	trans	-65.3	137.1	179.6	-166.1	0	0	0	0	110.7
74	R	28.2	Very low	28.2	Very low	227 Å²	227	122.2 Å²	122.2	86%	0.857	64%	0.639	S	S	*	*	S	Bend	trans	84.3	80.1	-171.1	-66.1	-178.3	168.8	-166.7	-2.8	116.1
75	R	29.2	Very low	28.7	Very low	120 Å²	120	117.8 Å²	117.8	45%	0.453	62%	0.619	S	S	.	*			trans	-179.5	59.3	150.9	-100.5	169.1	-160.8	-152.6	16.9	111.5	S22 A77 L78	S22-R75 PolarHBondContact OG-NH1 3.33Å; R75-A77 PolarHBondContact O-N 3.47Å; R75-L78 HydrophobicContact CB-CB 4.39Å; R75-L78 HydrophobicContact CG-CD1 4.02Å; R75-L78 PolarHBondContact O-N 3Å
76	D	30.3	Very low	29.1	Very low	147 Å²	147	114.6 Å²	114.6	79%	0.786	61%	0.613	S	S	*	*	H	α-helix	trans	-64.7	-20.5	-179.7	-63.4	-49.3	0	0	0	113.9
77	A	32.9	Very low	29.5	Very low	84 Å²	84	113 Å²	113	69%	0.694	61%	0.606	S	S	*	*	H	α-helix	trans	-78.8	-25.6	178	0	0	0	0	0	114.2	R75	R75-A77 PolarHBondContact O-N 3.47Å
78	L	34.3	Very low	29.8	Very low	52 Å²	52	110.2 Å²	110.2	27%	0.272	60%	0.597	S	S	.	*	H	α-helix	trans	-89.9	-33.9	-175.6	-95.7	160.1	0	0	0	112.4	R75 S80 S81 I82	R75-L78 HydrophobicContact CB-CB 4.39Å; R75-L78 HydrophobicContact CG-CD1 4.02Å; R75-L78 PolarHBondContact O-N 3Å; L78-S80 VanDerWaalsContact C-N 3.31Å; L78-S80 PolarHBondContact O-N 3.45Å; L78-S81 PolarHBondContact O-N 2.98Å; L78-I82 PolarHBondContact O-N 2.81Å
79	L	30.3	Very low	30.1	Very low	84 Å²	84	107.1 Å²	107.1	44%	0.44	59%	0.592	S	S	.	*	H	α-helix	trans	-67	-33	175.8	-74	163.1	0	0	0	112.3	S81 I82 A83	L79-S81 VanDerWaalsContact C-N 3.31Å; L79-S81 PolarHBondContact O-N 2.82Å; L79-I82 PolarHBondContact O-N 3.01Å; L79-A83 WeakPolarHBondContact O-CB 3.41Å; L79-A83 PolarHBondContact O-N 2.71Å
80	S	29.8	Very low	30.4	Very low	72 Å²	72	105.6 Å²	105.6	50%	0.503	59%	0.593	S	S	.	*	H	α-helix	trans	-56.4	-42.7	172.2	163.4	0	0	0	0	112.7	L78 S84	L78-S80 VanDerWaalsContact C-N 3.31Å; L78-S80 PolarHBondContact O-N 3.45Å; S80-S84 PolarHBondContact O-N 2.97Å; S80-S84 VanDerWaalsContact O-N 3.14Å; S80-S84 PolarHBondContact O-OG 3.33Å
81	S	34.2	Very low	30.7	Very low	59 Å²	59	106.7 Å²	106.7	41%	0.413	59%	0.594	S	S	.	*	H	α-helix	trans	-67	-42.7	178.4	-63.9	0	0	0	0	111.2	L78 L79 S84 F85	L78-S81 PolarHBondContact O-N 2.98Å; L79-S81 VanDerWaalsContact C-N 3.31Å; L79-S81 PolarHBondContact O-N 2.82Å; S81-S84 WeakPolarHBondContact O-CB 3.47Å; S81-S84 PolarHBondContact O-N 3.48Å; S81-F85 VanDerWaalsContact O-CD2 3.3Å; S81-F85 WeakPolarHBondContact O-CD2 3.32Å; S81-F85 PolarHBondContact O-N 3.48Å
82	I	34.4	Very low	31.1	Very low	54 Å²	54	103.4 Å²	103.4	28%	0.277	58%	0.583	S	S	.	*	H	α-helix	trans	-68.8	-38.8	179.5	-57.8	167.2	0	0	0	111.8	H19 L78 L79 S84 F85 V86	H19-I82 WeakPolarHBondContact NE2-CD1 3.36Å; L78-I82 PolarHBondContact O-N 2.81Å; L79-I82 PolarHBondContact O-N 3.01Å; I82-S84 VanDerWaalsContact C-N 3.26Å; I82-S84 PolarHBondContact O-N 3.12Å; I82-F85 VanDerWaalsContact O-CB 3.26Å; I82-F85 WeakPolarHBondContact O-CB 3.2Å; I82-F85 PolarHBondContact O-N 3.45Å; I82-V86 PolarHBondContact O-N 2.87Å
83	A	29.2	Very low	31.4	Very low	64 Å²	64	103.5 Å²	103.5	53%	0.529	58%	0.578	S	S	.	*	H	α-helix	trans	-63.3	-35.3	175.7	0	0	0	0	0	111.8	L79 F85 V86 A87	L79-A83 WeakPolarHBondContact O-CB 3.41Å; L79-A83 PolarHBondContact O-N 2.71Å; A83-F85 PolarHBondContact O-N 3.43Å; A83-V86 PolarHBondContact O-N 2.8Å; A83-A87 PolarHBondContact O-N 2.76Å
84	S	30.8	Very low	31.9	Very low	80 Å²	80	103.1 Å²	103.1	56%	0.559	58%	0.575	S	S	*	*	H	α-helix	trans	-67.5	-25.4	173.7	-55	0	0	0	0	112.8	S80 S81 I82	S80-S84 PolarHBondContact O-N 2.97Å; S80-S84 VanDerWaalsContact O-N 3.14Å; S80-S84 PolarHBondContact O-OG 3.33Å; S81-S84 WeakPolarHBondContact O-CB 3.47Å; S81-S84 PolarHBondContact O-N 3.48Å; I82-S84 VanDerWaalsContact C-N 3.26Å; I82-S84 PolarHBondContact O-N 3.12Å
85	F	32.5	Very low	32.3	Very low	94 Å²	94	95.3 Å²	95.3	41%	0.412	55%	0.551	S	S	.	*	H	α-helix	trans	-75.4	-34.4	177.3	-100.3	-86	0	0	0	113.3	S81 I82 A83 W107	S81-F85 VanDerWaalsContact O-CD2 3.3Å; S81-F85 WeakPolarHBondContact O-CD2 3.32Å; S81-F85 PolarHBondContact O-N 3.48Å; I82-F85 VanDerWaalsContact O-CB 3.26Å; I82-F85 WeakPolarHBondContact O-CB 3.2Å; I82-F85 PolarHBondContact O-N 3.45Å; A83-F85 PolarHBondContact O-N 3.43Å; F85-W107 AromaticContact CZ-CD1 3.81Å
86	V	33.3	Very low	32.3	Very low	95 Å²	95	91.7 Å²	91.7	58%	0.576	54%	0.543	S	S	*	.	H	α-helix	trans	-80	-21	-178.1	179.3	0	0	0	0	111.8	I82 A83 M88	I82-V86 PolarHBondContact O-N 2.87Å; A83-V86 PolarHBondContact O-N 2.8Å; V86-M88 VanDerWaalsContact C-N 3.34Å; V86-M88 PolarHBondContact O-N 2.97Å
87	A	30.6	Very low	32.4	Very low	77 Å²	77	88.2 Å²	88.2	64%	0.636	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	7.5	-173.3	0	0	0	0	0	115.5	A83 P89	A83-A87 PolarHBondContact O-N 2.76Å; A87-P89 WeakPolarHBondContact O-CD 3.5Å
88	M	32.9	Very low	32.6	Very low	100 Å²	100	88.2 Å²	88.2	49%	0.493	52%	0.518	S	S	.	.			trans	-78.1	119.3	-176.7	-101.5	-179.1	174.1	0	0	112.5	V86 S90 T103	V86-M88 VanDerWaalsContact C-N 3.34Å; V86-M88 PolarHBondContact O-N 2.97Å; M88-S90 PolarHBondContact O-N 3.43Å; M88-T103 HydrophobicContact CE-CG2 3.72Å; M88-T103 HydrophobicContact SD-CG2 3.99Å
89	P	31.8	Very low	32.5	Very low	114 Å²	114	88.6 Å²	88.6	74%	0.74	52%	0.522	S	S	*	.			trans	-68	122.1	-179.1	26.3	-32.3	0	0	0	110.8	A87 N91	A87-P89 WeakPolarHBondContact O-CD 3.5Å; P89-N91 VanDerWaalsContact C-N 3.33Å; P89-N91 PolarHBondContact O-N 2.85Å
90	S	34.5	Very low	32.5	Very low	96 Å²	96	85.1 Å²	85.1	67%	0.671	51%	0.506	S	S	*	.			trans	-73.9	77.7	176.3	54.5	0	0	0	0	111.1	M88	M88-S90 PolarHBondContact O-N 3.43Å
91	N	30.3	Very low	32.8	Very low	145 Å²	145	85.1 Å²	85.1	78%	0.775	50%	0.503	S	S	*	.			trans	-129.4	132.9	166.9	-85.7	-22.8	0	0	0	110.6	P89	P89-N91 VanDerWaalsContact C-N 3.33Å; P89-N91 PolarHBondContact O-N 2.85Å
92	D	31.7	Very low	33	Very low	117 Å²	117	89.1 Å²	89.1	63%	0.626	51%	0.513	S	S	*	.			trans	80.6	105.3	177.5	-73.8	-40.9	0	0	0	120.6	S94 N95	D92-S94 PolarHBondContact O-N 2.82Å; D92-N95 PolarHBondContact O-N 2.85Å
93	R	32.7	Very low	33.2	Very low	192 Å²	192	88.7 Å²	88.7	73%	0.725	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-16.2	174.7	-125.9	176.1	-161	-173.4	3.1	114.7
94	S	36.3	Very low	33.3	Very low	92 Å²	92	86 Å²	86	64%	0.643	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-12.7	-176.6	50.6	0	0	0	0	113.7	D92	D92-S94 PolarHBondContact O-N 2.82Å
95	N	35.5	Very low	33.8	Very low	64 Å²	64	90.3 Å²	90.3	34%	0.342	50%	0.5	S	S	.	.			trans	-95.7	7.8	-176.5	-95.6	-14.3	0	0	0	113.9	D92 S97 I98 T99	D92-N95 PolarHBondContact O-N 2.85Å; N95-S97 PolarHBondContact O-N 3.33Å; N95-I98 PolarHBondContact O-N 3.21Å; N95-I98 VanDerWaalsContact O-N 3.13Å; N95-I98 WeakPolarHBondContact OD1-CD1 3.34Å; N95-T99 WeakPolarHBondContact O-CB 3.45Å; N95-T99 PolarHBondContact O-N 3.19Å; N95-T99 PolarHBondContact O-OG1 3.46Å; N95-T99 VanDerWaalsContact O-OG1 3.05Å
96	C	30.5	Very low	34.3	Very low	43 Å²	43	90.6 Å²	90.6	29%	0.291	51%	0.505	S	S	.	.	H	α-helix	trans	-59.5	-34.2	-177.2	-153.7	0	0	0	0	112.2	A100	C96-A100 WeakPolarHBondContact O-CB 3.43Å; C96-A100 PolarHBondContact O-N 2.85Å
97	S	32.2	Very low	34.8	Very low	75 Å²	75	88 Å²	88	52%	0.524	49%	0.485	S	S	.	.	H	α-helix	trans	-76.4	-37.1	175.8	72.6	0	0	0	0	113.2	N95 T101	N95-S97 PolarHBondContact O-N 3.33Å; S97-T101 WeakPolarHBondContact O-CB 3.29Å; S97-T101 VanDerWaalsContact O-CG2 3.27Å; S97-T101 WeakPolarHBondContact O-CG2 3.39Å; S97-T101 PolarHBondContact O-N 2.87Å; S97-T101 PolarHBondContact O-OG1 3.18Å
98	I	35.9	Very low	35.2	Very low	83 Å²	83	85.1 Å²	85.1	43%	0.426	46%	0.463	S	S	.	.	H	α-helix	trans	-76.2	-39.4	-177.4	-63	171.5	0	0	0	110.7	N95 T101 K102	N95-I98 PolarHBondContact O-N 3.21Å; N95-I98 VanDerWaalsContact O-N 3.13Å; N95-I98 WeakPolarHBondContact OD1-CD1 3.34Å; I98-T101 WeakPolarHBondContact CA-OG1 3.3Å; I98-T101 PolarHBondContact O-OG1 3.4Å; I98-K102 WeakPolarHBondContact O-CG 3.22Å; I98-K102 PolarHBondContact O-N 3.26Å; I98-K102 VanDerWaalsContact O-N 3.15Å
99	T	32.8	Very low	35.8	Very low	60 Å²	60	83 Å²	83	37%	0.368	46%	0.458	S	S	.	.	H	α-helix	trans	-75.3	-38.9	176.6	-50.7	0	0	0	0	110.6	N95 K102 T103	N95-T99 WeakPolarHBondContact O-CB 3.45Å; N95-T99 PolarHBondContact O-N 3.19Å; N95-T99 PolarHBondContact O-OG1 3.46Å; N95-T99 VanDerWaalsContact O-OG1 3.05Å; T99-K102 PolarHBondContact O-N 2.84Å; T99-T103 HydrophobicContact CG2-CG2 4.42Å; T99-T103 WeakPolarHBondContact O-CB 3.28Å; T99-T103 WeakPolarHBondContact O-CG2 3.33Å; T99-T103 PolarHBondContact O-N 3.48Å; T99-T103 PolarHBondContact O-OG1 3.39Å
100	A	31.2	Very low	36.4	Very low	11 Å²	11	84.6 Å²	84.6	9%	0.091	45%	0.449	C	S	.	.	H	α-helix	trans	-68.4	-32.7	174.9	0	0	0	0	0	113.3	C96 T103 G104	C96-A100 WeakPolarHBondContact O-CB 3.43Å; C96-A100 PolarHBondContact O-N 2.85Å; A100-T103 VanDerWaalsContact CA-OG1 3.3Å; A100-T103 WeakPolarHBondContact CA-OG1 2.96Å; A100-T103 PolarHBondContact O-OG1 3.15Å; A100-G104 WeakPolarHBondContact O-CA 3.35Å; A100-G104 PolarHBondContact O-N 2.76Å
101	T	34.7	Very low	36.9	Very low	73 Å²	73	81.7 Å²	81.7	45%	0.448	43%	0.426	S	S	.	.	H	α-helix	trans	-70.8	-44	173.8	41.5	0	0	0	0	111.6	S97 I98 F105 A145	S97-T101 WeakPolarHBondContact O-CB 3.29Å; S97-T101 VanDerWaalsContact O-CG2 3.27Å; S97-T101 WeakPolarHBondContact O-CG2 3.39Å; S97-T101 PolarHBondContact O-N 2.87Å; S97-T101 PolarHBondContact O-OG1 3.18Å; I98-T101 WeakPolarHBondContact CA-OG1 3.3Å; I98-T101 PolarHBondContact O-OG1 3.4Å; T101-F105 VanDerWaalsContact O-CB 3.29Å; T101-F105 WeakPolarHBondContact O-CB 3.35Å; T101-F105 PolarHBondContact O-N 3.26Å; T101-A145 HydrophobicContact CG2-CB 4.31Å
102	K	38.8	Very low	37.6	Very low	142 Å²	142	82 Å²	82	62%	0.617	42%	0.416	S	S	*	.	H	α-helix	trans	-64.4	-46	174.6	-74.1	-175.8	178.7	-177.3	0	112	I98 T99 I106	I98-K102 WeakPolarHBondContact O-CG 3.22Å; I98-K102 PolarHBondContact O-N 3.26Å; I98-K102 VanDerWaalsContact O-N 3.15Å; T99-K102 PolarHBondContact O-N 2.84Å; K102-I106 WeakPolarHBondContact O-CB 3.39Å; K102-I106 WeakPolarHBondContact O-CD1 3.28Å; K102-I106 WeakPolarHBondContact O-CG1 3.38Å; K102-I106 PolarHBondContact O-N 3.49Å
103	T	38.2	Very low	38.3	Very low	46 Å²	46	81.6 Å²	81.6	28%	0.282	41%	0.411	S	S	.	.	H	α-helix	trans	-70.3	-37.5	178.7	47.3	0	0	0	0	112.4	M88 T99 A100 I106 W107	M88-T103 HydrophobicContact CE-CG2 3.72Å; M88-T103 HydrophobicContact SD-CG2 3.99Å; T99-T103 HydrophobicContact CG2-CG2 4.42Å; T99-T103 WeakPolarHBondContact O-CB 3.28Å; T99-T103 WeakPolarHBondContact O-CG2 3.33Å; T99-T103 PolarHBondContact O-N 3.48Å; T99-T103 PolarHBondContact O-OG1 3.39Å; A100-T103 VanDerWaalsContact CA-OG1 3.3Å; A100-T103 WeakPolarHBondContact CA-OG1 2.96Å; A100-T103 PolarHBondContact O-OG1 3.15Å; T103-I106 PolarHBondContact O-N 2.86Å; T103-W107 WeakPolarHBondContact O-CA 3.49Å; T103-W107 WeakPolarHBondContact O-CB 3.42Å; T103-W107 PolarHBondContact O-N 3.26Å
104	G	33	Very low	38.7	Very low	6 Å²	6	77.2 Å²	77.2	6%	0.062	40%	0.401	C	S	.	.	H	α-helix	trans	-66.3	-37.7	175.4	0	0	0	0	0	113.1	A100 G108	A100-G104 WeakPolarHBondContact O-CA 3.35Å; A100-G104 PolarHBondContact O-N 2.76Å; G104-G108 PolarHBondContact O-N 2.77Å
105	F	39.5	Very low	39	Very low	171 Å²	171	75.8 Å²	75.8	75%	0.75	39%	0.385	S	S	*	.	H	α-helix	trans	-71.9	-41.6	175.5	-153.6	-89.1	0	0	0	111.8	T101 W107 G108 S109	T101-F105 VanDerWaalsContact O-CB 3.29Å; T101-F105 WeakPolarHBondContact O-CB 3.35Å; T101-F105 PolarHBondContact O-N 3.26Å; F105-W107 VanDerWaalsContact C-N 3.35Å; F105-G108 PolarHBondContact O-N 2.88Å; F105-S109 WeakPolarHBondContact O-CB 3.36Å; F105-S109 PolarHBondContact O-N 3.43Å; F105-S109 PolarHBondContact O-OG 2.98Å
106	I	44.9	Very low	39.4	Very low	101 Å²	101	77 Å²	77	52%	0.518	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-45.6	172.6	-68.4	165.4	0	0	0	109.8	K102 T103 S109 R110	K102-I106 WeakPolarHBondContact O-CB 3.39Å; K102-I106 WeakPolarHBondContact O-CD1 3.28Å; K102-I106 WeakPolarHBondContact O-CG1 3.38Å; K102-I106 PolarHBondContact O-N 3.49Å; T103-I106 PolarHBondContact O-N 2.86Å; I106-S109 WeakPolarHBondContact CA-OG 3.15Å; I106-S109 PolarHBondContact O-N 3.02Å; I106-S109 PolarHBondContact O-OG 3.4Å; I106-R110 HydrophobicContact CG2-CG 4.3Å; I106-R110 WeakPolarHBondContact O-CB 3.41Å; I106-R110 WeakPolarHBondContact O-CG 3.5Å; I106-R110 PolarHBondContact O-N 2.65Å
107	W	42.2	Very low	39.9	Very low	40 Å²	40	78.5 Å²	78.5	15%	0.152	41%	0.41	C	S	.	.	H	α-helix	trans	-60.8	-49	177.6	-170.3	74.3	0	0	0	111.2	F14 I18 F85 T103 F105 S109 R110 L111 L140 L144	F14-W107 HydrophobicContact CD1-CZ2 4.25Å; F14-W107 AromaticContact CE1-CH2 3.92Å; F14-W107 HydrophobicContact CE1-CH2 3.92Å; F14-W107 AromaticContact CE1-CZ2 3.9Å; F14-W107 HydrophobicContact CE1-CZ2 3.9Å; I18-W107 HydrophobicContact CD1-CH2 4.47Å; I18-W107 HydrophobicContact CD1-CZ2 3.83Å; F85-W107 AromaticContact CZ-CD1 3.81Å; T103-W107 WeakPolarHBondContact O-CA 3.49Å; T103-W107 WeakPolarHBondContact O-CB 3.42Å; T103-W107 PolarHBondContact O-N 3.26Å; F105-W107 VanDerWaalsContact C-N 3.35Å; W107-S109 VanDerWaalsContact C-N 3.33Å; W107-S109 PolarHBondContact O-N 3.5Å; W107-R110 PolarHBondContact O-N 2.97Å; W107-L111 HydrophobicContact CH2-CD1 4.09Å; W107-L111 HydrophobicContact CH2-CD2 3.59Å; W107-L111 HydrophobicContact CH2-CG 4.42Å; W107-L111 HydrophobicContact CZ2-CD1 3.61Å; W107-L111 HydrophobicContact CZ2-CD2 4.01Å; W107-L111 HydrophobicContact CZ2-CG 4.41Å; W107-L111 HydrophobicContact CZ3-CD2 4.1Å; W107-L111 VanDerWaalsContact O-CB 3.3Å; W107-L111 WeakPolarHBondContact O-CB 3.33Å; W107-L111 PolarHBondContact O-N 3.19Å; W107-L140 HydrophobicContact CH2-CD2 3.15Å; W107-L140 HydrophobicContact CH2-CG 3.84Å; W107-L140 HydrophobicContact CZ2-CD2 4.26Å; W107-L140 HydrophobicContact CZ3-CB 4.35Å; W107-L140 HydrophobicContact CZ3-CD2 3.44Å; W107-L140 VanDerWaalsContact CZ3-CD2 3.44Å; W107-L140 HydrophobicContact CZ3-CG 3.65Å; W107-L144 HydrophobicContact CD2-CD1 4.11Å; W107-L144 HydrophobicContact CE3-CD1 3.61Å; W107-L144 HydrophobicContact CH2-CD1 4.45Å; W107-L144 HydrophobicContact CZ3-CD1 3.82Å
108	G	39	Very low	40.4	Very low	17 Å²	17	82.5 Å²	82.5	18%	0.175	42%	0.42	C	S	.	.	H	α-helix	trans	-60.1	-40.4	176.4	0	0	0	0	0	112.9	G104 F105 R112	G104-G108 PolarHBondContact O-N 2.77Å; F105-G108 PolarHBondContact O-N 2.88Å; G108-R112 WeakPolarHBondContact O-CB 3.38Å; G108-R112 PolarHBondContact O-N 3.28Å
109	S	46.3	Very low	40.4	Very low	56 Å²	56	85.1 Å²	85.1	39%	0.392	44%	0.435	S	S	.	.	H	α-helix	trans	-69	-41.5	177	69.3	0	0	0	0	113	F105 I106 W107 R112 E113	F105-S109 WeakPolarHBondContact O-CB 3.36Å; F105-S109 PolarHBondContact O-N 3.43Å; F105-S109 PolarHBondContact O-OG 2.98Å; I106-S109 WeakPolarHBondContact CA-OG 3.15Å; I106-S109 PolarHBondContact O-N 3.02Å; I106-S109 PolarHBondContact O-OG 3.4Å; W107-S109 VanDerWaalsContact C-N 3.33Å; W107-S109 PolarHBondContact O-N 3.5Å; S109-R112 PolarHBondContact O-N 3.35Å; S109-E113 WeakPolarHBondContact O-CB 3.27Å; S109-E113 PolarHBondContact O-N 3.43Å
110	R	44.1	Very low	40.3	Very low	147 Å²	147	86.3 Å²	86.3	56%	0.555	45%	0.445	S	S	*	.	H	α-helix	trans	-72.8	-36.3	178.3	-70	-61.7	-169.8	-175.8	4.4	112.5	I106 W107 E113 L114	I106-R110 HydrophobicContact CG2-CG 4.3Å; I106-R110 WeakPolarHBondContact O-CB 3.41Å; I106-R110 WeakPolarHBondContact O-CG 3.5Å; I106-R110 PolarHBondContact O-N 2.65Å; W107-R110 PolarHBondContact O-N 2.97Å; R110-E113 IonicContact CZ-OE2 3.93Å; R110-E113 IonicContact NH1-OE1 2.91Å; R110-E113 IonicContact NH1-OE2 3.75Å; R110-E113 PolarHBondContact NH1-OE2 2.92Å; R110-E113 PolarHBondContact O-N 3.05Å; R110-L114 WeakPolarHBondContact O-CB 3.31Å; R110-L114 WeakPolarHBondContact O-CD1 3.07Å; R110-L114 VanDerWaalsContact O-CG 3.28Å; R110-L114 WeakPolarHBondContact O-CG 3.45Å; R110-L114 PolarHBondContact O-N 2.81Å
111	L	46	Very low	40.3	Very low	34 Å²	34	95.7 Å²	95.7	18%	0.178	48%	0.48	C	S	.	.	H	α-helix	trans	-65.2	-44.7	171.7	-137.5	86	0	0	0	110	W107 E113 L114 I115 C137	W107-L111 HydrophobicContact CH2-CD1 4.09Å; W107-L111 HydrophobicContact CH2-CD2 3.59Å; W107-L111 HydrophobicContact CH2-CG 4.42Å; W107-L111 HydrophobicContact CZ2-CD1 3.61Å; W107-L111 HydrophobicContact CZ2-CD2 4.01Å; W107-L111 HydrophobicContact CZ2-CG 4.41Å; W107-L111 HydrophobicContact CZ3-CD2 4.1Å; W107-L111 VanDerWaalsContact O-CB 3.3Å; W107-L111 WeakPolarHBondContact O-CB 3.33Å; W107-L111 PolarHBondContact O-N 3.19Å; L111-E113 VanDerWaalsContact C-N 3.3Å; L111-E113 PolarHBondContact O-N 2.87Å; L111-L114 PolarHBondContact O-N 3.36Å; L111-I115 HydrophobicContact CB-CD1 4.44Å; L111-I115 HydrophobicContact CD2-CD1 3.94Å; L111-I115 HydrophobicContact CG-CD1 3.98Å; L111-I115 VanDerWaalsContact O-CB 3.25Å; L111-I115 WeakPolarHBondContact O-CB 3.33Å; L111-I115 VanDerWaalsContact O-CD1 3.31Å; L111-I115 WeakPolarHBondContact O-CD1 3.35Å; L111-I115 WeakPolarHBondContact O-CG1 3.25Å; L111-I115 PolarHBondContact O-N 3.12Å; L111-C137 VanDerWaalsContact CD2-SG 3.56Å
112	R	45	Very low	40.4	Very low	152 Å²	152	97.9 Å²	97.9	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-61.1	-39.3	176.1	-174.1	177.3	-70	-164.1	-1.5	111.7	G108 S109 S116 D138	G108-R112 WeakPolarHBondContact O-CB 3.38Å; G108-R112 PolarHBondContact O-N 3.28Å; S109-R112 PolarHBondContact O-N 3.35Å; R112-S116 WeakPolarHBondContact O-CB 3.37Å; R112-S116 PolarHBondContact O-N 3.41Å; R112-D138 IonicContact NH2-OD1 3.56Å
113	E	45	Very low	40.4	Very low	109 Å²	109	99 Å²	99	51%	0.509	50%	0.501	S	S	.	.	H	α-helix	trans	-67.4	-46.4	175.8	-167.3	175	-162.5	0	0	111.7	S109 R110 L111 I115 S116 S117	S109-E113 WeakPolarHBondContact O-CB 3.27Å; S109-E113 PolarHBondContact O-N 3.43Å; R110-E113 IonicContact CZ-OE2 3.93Å; R110-E113 IonicContact NH1-OE1 2.91Å; R110-E113 IonicContact NH1-OE2 3.75Å; R110-E113 PolarHBondContact NH1-OE2 2.92Å; R110-E113 PolarHBondContact O-N 3.05Å; L111-E113 VanDerWaalsContact C-N 3.3Å; L111-E113 PolarHBondContact O-N 2.87Å; E113-I115 VanDerWaalsContact C-N 3.28Å; E113-I115 PolarHBondContact O-N 2.95Å; E113-S116 PolarHBondContact O-N 3Å; E113-S117 VanDerWaalsContact O-CB 3.25Å; E113-S117 WeakPolarHBondContact O-CB 3.27Å; E113-S117 PolarHBondContact O-N 3.44Å; E113-S117 PolarHBondContact O-OG 2.84Å
114	L	41.6	Very low	40.2	Very low	99 Å²	99	100.2 Å²	100.2	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-64.3	-30.4	176.5	-77.7	164	0	0	0	113.5	R110 L111 S117	R110-L114 WeakPolarHBondContact O-CB 3.31Å; R110-L114 WeakPolarHBondContact O-CD1 3.07Å; R110-L114 VanDerWaalsContact O-CG 3.28Å; R110-L114 WeakPolarHBondContact O-CG 3.45Å; R110-L114 PolarHBondContact O-N 2.81Å; L111-L114 PolarHBondContact O-N 3.36Å; L114-S117 PolarHBondContact O-OG 3.38Å
115	I	42.6	Very low	40.5	Very low	62 Å²	62	104.3 Å²	104.3	32%	0.318	54%	0.539	S	S	.	.	H	α-helix	trans	-83.3	-38.6	178.2	-67.9	165.5	0	0	0	110.5	L111 E113	L111-I115 HydrophobicContact CB-CD1 4.44Å; L111-I115 HydrophobicContact CD2-CD1 3.94Å; L111-I115 HydrophobicContact CG-CD1 3.98Å; L111-I115 VanDerWaalsContact O-CB 3.25Å; L111-I115 WeakPolarHBondContact O-CB 3.33Å; L111-I115 VanDerWaalsContact O-CD1 3.31Å; L111-I115 WeakPolarHBondContact O-CD1 3.35Å; L111-I115 WeakPolarHBondContact O-CG1 3.25Å; L111-I115 PolarHBondContact O-N 3.12Å; E113-I115 VanDerWaalsContact C-N 3.28Å; E113-I115 PolarHBondContact O-N 2.95Å
116	S	43.3	Very low	40.9	Very low	90 Å²	90	100.3 Å²	100.3	63%	0.629	52%	0.522	S	S	*	.	H	α-helix	trans	-77.6	-20.1	179.1	-170.6	0	0	0	0	113.3	R112 E113 H118	R112-S116 WeakPolarHBondContact O-CB 3.37Å; R112-S116 PolarHBondContact O-N 3.41Å; E113-S116 PolarHBondContact O-N 3Å; S116-H118 PolarHBondContact O-N 3.19Å
117	S	41.5	Very low	41.1	Very low	74 Å²	74	99 Å²	99	52%	0.517	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	5.5	176.1	71.5	0	0	0	0	113.4	E113 L114 D119	E113-S117 VanDerWaalsContact O-CB 3.25Å; E113-S117 WeakPolarHBondContact O-CB 3.27Å; E113-S117 PolarHBondContact O-N 3.44Å; E113-S117 PolarHBondContact O-OG 2.84Å; L114-S117 PolarHBondContact O-OG 3.38Å; S117-D119 PolarHBondContact O-N 3.43Å; S117-D119 VanDerWaalsContact O-N 3.14Å
118	H	43.5	Very low	41.1	Very low	159 Å²	159	99.9 Å²	99.9	74%	0.736	53%	0.53	S	S	*	.	S	Bend	trans	-82.7	86.9	172.5	-122.9	-81.3	0	0	0	109	S116 S120	S116-H118 PolarHBondContact O-N 3.19Å; H118-S120 PolarHBondContact O-N 3.1Å
119	D	34.3	Very low	41.4	Very low	138 Å²	138	101.4 Å²	101.4	74%	0.738	53%	0.533	S	S	*	.			trans	-47.7	123.7	176.6	-82.4	-45	0	0	0	112.9	S117	S117-D119 PolarHBondContact O-N 3.43Å; S117-D119 VanDerWaalsContact O-N 3.14Å
120	S	31.8	Very low	41.5	Very low	85 Å²	85	103.5 Å²	103.5	59%	0.594	54%	0.537	S	S	*	.				79.5	56.4	127.3	70.8	0	0	0	0	121.2	H118	H118-S120 PolarHBondContact O-N 3.1Å
121	Y	31.1	Very low	41.7	Very low	208 Å²	208	102.2 Å²	102.2	82%	0.816	54%	0.538	S	S	*	.	S	Bend	trans	-147.4	116.6	157.2	-78.7	-81.9	0	0	0	113.5
122	D	36.8	Very low	41.7	Very low	119 Å²	119	101.3 Å²	101.3	64%	0.636	54%	0.536	S	S	*	.			trans	68.9	87.3	164.7	-83.6	-41.4	0	0	0	119.8	G124 K125 E126	D122-G124 PolarHBondContact O-N 2.78Å; D122-K125 HydrophobicContact CB-CB 4.2Å; D122-K125 PolarHBondContact O-N 3.48Å; D122-E126 PolarHBondContact O-N 2.88Å
123	L	38.2	Very low	42	Very low	167 Å²	167	95.8 Å²	95.8	87%	0.874	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-7.8	173.2	-90.4	122.1	0	0	0	117.6
124	G	34.7	Very low	42.2	Very low	71 Å²	71	92.9 Å²	92.9	73%	0.732	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-13.6	175.8	0	0	0	0	0	114.8	D122	D122-G124 PolarHBondContact O-N 2.78Å
125	K	40.2	Very low	42.8	Very low	92 Å²	92	93.2 Å²	93.2	40%	0.4	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-28	-176.5	-161.2	174.4	179.1	164	0	111.4	D122 T127 S170	D122-K125 HydrophobicContact CB-CB 4.2Å; D122-K125 PolarHBondContact O-N 3.48Å; K125-T127 VanDerWaalsContact C-N 3.35Å; K125-T127 PolarHBondContact O-N 3.38Å; K125-S170 WeakPolarHBondContact CE-OG 3.42Å; K125-S170 PolarHBondContact NZ-OG 3.3Å
126	E	47.6	Very low	43.3	Very low	86 Å²	86	90.7 Å²	90.7	40%	0.402	50%	0.496	S	S	.	.	H	α-helix	trans	-59.6	-34.9	179.4	-109.1	175.7	147.3	0	0	113.7	D122 C128 E129 Q130	D122-E126 PolarHBondContact O-N 2.88Å; E126-C128 PolarHBondContact O-N 3.4Å; E126-E129 PolarHBondContact O-N 2.86Å; E126-Q130 WeakPolarHBondContact O-CA 3.33Å; E126-Q130 WeakPolarHBondContact O-CB 3.35Å; E126-Q130 PolarHBondContact O-N 3.39Å
127	T	47.8	Very low	43.6	Very low	75 Å²	75	87.3 Å²	87.3	46%	0.46	47%	0.472	S	S	.	.	H	α-helix	trans	-71.1	-34	-170.6	11.6	0	0	0	0	114.3	K125 M131	K125-T127 VanDerWaalsContact C-N 3.35Å; K125-T127 PolarHBondContact O-N 3.38Å; T127-M131 WeakPolarHBondContact O-CB 3.43Å; T127-M131 WeakPolarHBondContact O-CE 3.49Å; T127-M131 VanDerWaalsContact O-CG 3.22Å; T127-M131 WeakPolarHBondContact O-CG 3.42Å; T127-M131 PolarHBondContact O-N 2.9Å
128	C	42.8	Very low	44.2	Very low	57 Å²	57	87.6 Å²	87.6	39%	0.385	47%	0.468	S	S	.	.	H	α-helix	trans	-70.3	-48.1	176.4	-172.4	0	0	0	0	110.9	E126 A132 C166	E126-C128 PolarHBondContact O-N 3.4Å; C128-A132 VanDerWaalsContact O-CB 3.26Å; C128-A132 WeakPolarHBondContact O-CB 3.5Å; C128-A132 PolarHBondContact O-N 3.42Å; C128-C166 VanDerWaalsContact C-SG 3.52Å; C128-C166 HydrophobicContact CB-CB 4.12Å; C128-C166 WeakPolarHBondContact CB-SG 3.36Å; C128-C166 WeakPolarHBondContact SG-CB 3.22Å; C128-C166 CovalentContact SG-SG 2.08Å; C128-C166 PolarHBondContact SG-SG 3.32Å
129	E	45.2	Very low	44.7	Very low	49 Å²	49	83.5 Å²	83.5	23%	0.229	45%	0.449	C	S	.	.	H	α-helix	trans	-70.5	-41.1	-178.1	-65.4	-167.2	166.8	0	0	110.8	E126 A132 Q133 C166	E126-E129 PolarHBondContact O-N 2.86Å; E129-A132 PolarHBondContact O-N 2.82Å; E129-Q133 WeakPolarHBondContact O-CB 3.48Å; E129-Q133 WeakPolarHBondContact O-CG 3.31Å; E129-Q133 PolarHBondContact O-N 3.14Å; E129-C166 HydrophobicContact CG-CB 3.87Å
130	Q	48	Very low	45.5	Very low	100 Å²	100	77.5 Å²	77.5	47%	0.467	42%	0.417	S	S	.	.	H	α-helix	trans	-68	-37.6	177.9	-166.9	177.1	29.3	0	0	112.2	E126 S134	E126-Q130 WeakPolarHBondContact O-CA 3.33Å; E126-Q130 WeakPolarHBondContact O-CB 3.35Å; E126-Q130 PolarHBondContact O-N 3.39Å; Q130-S134 WeakPolarHBondContact O-CB 3.18Å; Q130-S134 PolarHBondContact O-N 3.31Å; Q130-S134 PolarHBondContact O-OG 2.91Å
131	M	48.4	Very low	46.4	Very low	120 Å²	120	75.1 Å²	75.1	59%	0.591	40%	0.4	S	S	*	.	H	α-helix	trans	-70.7	-41.5	173.2	-77.4	-167.1	-78.9	0	0	112.5	T127 Q133 S134 Q135	T127-M131 WeakPolarHBondContact O-CB 3.43Å; T127-M131 WeakPolarHBondContact O-CE 3.49Å; T127-M131 VanDerWaalsContact O-CG 3.22Å; T127-M131 WeakPolarHBondContact O-CG 3.42Å; T127-M131 PolarHBondContact O-N 2.9Å; M131-Q133 VanDerWaalsContact C-N 3.28Å; M131-Q133 PolarHBondContact O-N 3.26Å; M131-S134 PolarHBondContact O-N 3.24Å; M131-S134 PolarHBondContact O-OG 2.59Å; M131-S134 VanDerWaalsContact O-OG 3.07Å; M131-Q135 VanDerWaalsContact O-CB 3.27Å; M131-Q135 WeakPolarHBondContact O-CB 3.14Å; M131-Q135 PolarHBondContact O-N 3.36Å
132	A	47.2	Very low	47.6	Very low	15 Å²	15	67.3 Å²	67.3	12%	0.124	38%	0.378	C	S	.	.	H	α-helix	trans	-64.6	-37	174.6	0	0	0	0	0	111.3	C128 E129 A136 F159 A162	C128-A132 VanDerWaalsContact O-CB 3.26Å; C128-A132 WeakPolarHBondContact O-CB 3.5Å; C128-A132 PolarHBondContact O-N 3.42Å; E129-A132 PolarHBondContact O-N 2.82Å; A132-A136 WeakPolarHBondContact O-CB 3.38Å; A132-A136 PolarHBondContact O-N 3.45Å; A132-F159 WeakPolarHBondContact O-CD2 3.28Å; A132-A162 HydrophobicContact CB-CB 4.03Å
133	Q	49.7	Very low	48.3	Very low	37 Å²	37	63.8 Å²	63.8	17%	0.173	36%	0.358	C	S	.	.	H	α-helix	trans	-68.1	-45.6	175.3	-78	168.4	10.6	0	0	111.6	E129 M131 A136 C137 F159	E129-Q133 WeakPolarHBondContact O-CB 3.48Å; E129-Q133 WeakPolarHBondContact O-CG 3.31Å; E129-Q133 PolarHBondContact O-N 3.14Å; M131-Q133 VanDerWaalsContact C-N 3.28Å; M131-Q133 PolarHBondContact O-N 3.26Å; Q133-A136 PolarHBondContact O-N 3.28Å; Q133-C137 VanDerWaalsContact O-CB 3.31Å; Q133-C137 WeakPolarHBondContact O-CB 3.32Å; Q133-C137 PolarHBondContact O-N 3.47Å; Q133-C137 PolarHBondContact O-SG 2.95Å; Q133-F159 HydrophobicContact CB-CE2 4.02Å; Q133-F159 HydrophobicContact CB-CZ 4.46Å; Q133-F159 HydrophobicContact CG-CE2 3.32Å; Q133-F159 HydrophobicContact CG-CZ 3.41Å; Q133-F159 VanDerWaalsContact CG-CZ 3.41Å
134	S	50.5	Low	48.8	Very low	48 Å²	48	58.1 Å²	58.1	34%	0.336	33%	0.328	S	S	.	.	H	α-helix	trans	-64.1	-45.3	178.5	73.2	0	0	0	0	110.6	Q130 M131 A136 C137 D138	Q130-S134 WeakPolarHBondContact O-CB 3.18Å; Q130-S134 PolarHBondContact O-N 3.31Å; Q130-S134 PolarHBondContact O-OG 2.91Å; M131-S134 PolarHBondContact O-N 3.24Å; M131-S134 PolarHBondContact O-OG 2.59Å; M131-S134 VanDerWaalsContact O-OG 3.07Å; S134-A136 PolarHBondContact O-N 3.04Å; S134-C137 PolarHBondContact O-N 3.43Å; S134-D138 WeakPolarHBondContact O-CB 3.26Å; S134-D138 PolarHBondContact O-N 3.05Å
135	Q	54	Low	49.6	Very low	105 Å²	105	56.3 Å²	56.3	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-42.2	178.4	-174.4	176.9	-1.3	0	0	111.9	M131 D138 Q139	M131-Q135 VanDerWaalsContact O-CB 3.27Å; M131-Q135 WeakPolarHBondContact O-CB 3.14Å; M131-Q135 PolarHBondContact O-N 3.36Å; Q135-D138 PolarHBondContact O-N 2.8Å; Q135-Q139 WeakPolarHBondContact O-CB 3.43Å; Q135-Q139 VanDerWaalsContact O-CG 3.3Å; Q135-Q139 WeakPolarHBondContact O-CG 3.43Å; Q135-Q139 PolarHBondContact O-N 2.98Å
136	A	51.9	Low	50.2	Low	10 Å²	10	59.6 Å²	59.6	8%	0.083	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-41.1	175.8	0	0	0	0	0	112.2	A132 Q133 S134 L140 F159	A132-A136 WeakPolarHBondContact O-CB 3.38Å; A132-A136 PolarHBondContact O-N 3.45Å; Q133-A136 PolarHBondContact O-N 3.28Å; S134-A136 PolarHBondContact O-N 3.04Å; A136-L140 WeakPolarHBondContact O-CB 3.3Å; A136-L140 PolarHBondContact O-N 3.48Å; A136-F159 HydrophobicContact CB-CB 3.56Å; A136-F159 HydrophobicContact CB-CD2 3.39Å; A136-F159 HydrophobicContact CB-CE2 4.34Å; A136-F159 HydrophobicContact CB-CG 3.64Å
137	C	49.7	Very low	50.2	Low	19 Å²	19	57.8 Å²	57.8	13%	0.128	32%	0.317	C	S	.	.	H	α-helix	trans	-65.2	-40.8	176.1	-70.8	0	0	0	0	111.7	L111 Q133 S134 S141	L111-C137 VanDerWaalsContact CD2-SG 3.56Å; Q133-C137 VanDerWaalsContact O-CB 3.31Å; Q133-C137 WeakPolarHBondContact O-CB 3.32Å; Q133-C137 PolarHBondContact O-N 3.47Å; Q133-C137 PolarHBondContact O-SG 2.95Å; S134-C137 PolarHBondContact O-N 3.43Å; C137-S141 VanDerWaalsContact O-CB 3.22Å; C137-S141 WeakPolarHBondContact O-CB 3.18Å; C137-S141 PolarHBondContact O-N 2.88Å; C137-S141 PolarHBondContact O-OG 3.48Å
138	D	54.7	Low	50	Low	80 Å²	80	57.1 Å²	57.1	43%	0.428	31%	0.311	S	S	.	.	H	α-helix	trans	-68.1	-46.4	179	-69.5	-16.1	0	0	0	110.6	R112 S134 Q135 L140 S141 A142	R112-D138 IonicContact NH2-OD1 3.56Å; S134-D138 WeakPolarHBondContact O-CB 3.26Å; S134-D138 PolarHBondContact O-N 3.05Å; Q135-D138 PolarHBondContact O-N 2.8Å; D138-L140 PolarHBondContact O-N 3.36Å; D138-S141 PolarHBondContact O-N 3.47Å; D138-S141 PolarHBondContact O-OG 3.13Å; D138-A142 WeakPolarHBondContact O-CB 3.44Å; D138-A142 PolarHBondContact O-N 3.2Å
139	Q	53.7	Low	50.2	Low	73 Å²	73	56.1 Å²	56.1	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-46.6	174.7	-75.9	-178.1	-18.9	0	0	111.5	Q135 S141 A142 H143	Q135-Q139 WeakPolarHBondContact O-CB 3.43Å; Q135-Q139 VanDerWaalsContact O-CG 3.3Å; Q135-Q139 WeakPolarHBondContact O-CG 3.43Å; Q135-Q139 PolarHBondContact O-N 2.98Å; Q139-S141 VanDerWaalsContact C-N 3.34Å; Q139-S141 PolarHBondContact O-N 3.44Å; Q139-A142 WeakPolarHBondContact O-CB 3.34Å; Q139-A142 PolarHBondContact O-N 3.02Å; Q139-A142 VanDerWaalsContact O-N 3.12Å; Q139-H143 PolarHBondContact O-CD2 2.85Å; Q139-H143 PolarHBondContact O-N 2.86Å
140	L	52	Low	50.4	Low	12 Å²	12	57.3 Å²	57.3	6%	0.063	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-37.2	179.6	-177.5	58.8	0	0	0	112.3	F14 W107 A136 D138 A142 H143 L144	F14-L140 HydrophobicContact CE1-CD1 3.99Å; F14-L140 HydrophobicContact CE1-CD2 3.45Å; F14-L140 VanDerWaalsContact CE1-CD2 3.45Å; F14-L140 HydrophobicContact CE1-CG 4.21Å; F14-L140 HydrophobicContact CE2-CD1 3.91Å; F14-L140 HydrophobicContact CE2-CD2 4.41Å; F14-L140 HydrophobicContact CZ-CD1 3.55Å; F14-L140 HydrophobicContact CZ-CD2 3.31Å; F14-L140 HydrophobicContact CZ-CG 4.05Å; W107-L140 HydrophobicContact CH2-CD2 3.15Å; W107-L140 HydrophobicContact CH2-CG 3.84Å; W107-L140 HydrophobicContact CZ2-CD2 4.26Å; W107-L140 HydrophobicContact CZ3-CB 4.35Å; W107-L140 HydrophobicContact CZ3-CD2 3.44Å; W107-L140 VanDerWaalsContact CZ3-CD2 3.44Å; W107-L140 HydrophobicContact CZ3-CG 3.65Å; A136-L140 WeakPolarHBondContact O-CB 3.3Å; A136-L140 PolarHBondContact O-N 3.48Å; D138-L140 PolarHBondContact O-N 3.36Å; L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 3.21Å; L140-H143 PolarHBondContact O-N 2.71Å; L140-L144 HydrophobicContact CD1-CD1 4.12Å; L140-L144 HydrophobicContact CD1-CG 4.37Å; L140-L144 HydrophobicContact CG-CD1 3.88Å; L140-L144 VanDerWaalsContact O-CB 3.25Å; L140-L144 WeakPolarHBondContact O-CB 3.27Å; L140-L144 WeakPolarHBondContact O-CD1 3.26Å; L140-L144 VanDerWaalsContact O-CG 3.27Å; L140-L144 WeakPolarHBondContact O-CG 3.36Å; L140-L144 PolarHBondContact O-N 3.34Å
141	S	50.2	Low	50.2	Low	35 Å²	35	52.9 Å²	52.9	25%	0.245	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-39.1	172.1	78.8	0	0	0	0	111.4	C137 D138 Q139 A145	C137-S141 VanDerWaalsContact O-CB 3.22Å; C137-S141 WeakPolarHBondContact O-CB 3.18Å; C137-S141 PolarHBondContact O-N 2.88Å; C137-S141 PolarHBondContact O-OG 3.48Å; D138-S141 PolarHBondContact O-N 3.47Å; D138-S141 PolarHBondContact O-OG 3.13Å; Q139-S141 VanDerWaalsContact C-N 3.34Å; Q139-S141 PolarHBondContact O-N 3.44Å; S141-A145 WeakPolarHBondContact O-CB 3.44Å; S141-A145 PolarHBondContact O-N 3.16Å
142	A	55.4	Low	50.2	Low	43 Å²	43	47.5 Å²	47.5	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-69.4	-39	177.1	0	0	0	0	0	112.1	D138 Q139 L140 K146	D138-A142 WeakPolarHBondContact O-CB 3.44Å; D138-A142 PolarHBondContact O-N 3.2Å; Q139-A142 WeakPolarHBondContact O-CB 3.34Å; Q139-A142 PolarHBondContact O-N 3.02Å; Q139-A142 VanDerWaalsContact O-N 3.12Å; L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 3.21Å; A142-K146 WeakPolarHBondContact O-CB 3.32Å; A142-K146 VanDerWaalsContact O-CG 3.31Å; A142-K146 WeakPolarHBondContact O-CG 3.3Å; A142-K146 PolarHBondContact O-N 2.87Å; A142-K146 VanDerWaalsContact O-N 3.12Å
143	H	52.5	Low	50.3	Low	46 Å²	46	48.4 Å²	48.4	21%	0.213	28%	0.28	C	S	.	.	H	α-helix	trans	-71.3	-40.1	176	-72.2	-65.1	0	0	0	111.9	Q139 L140 K146 C147 D148 G151 S155	Q139-H143 PolarHBondContact O-CD2 2.85Å; Q139-H143 PolarHBondContact O-N 2.86Å; L140-H143 PolarHBondContact O-N 2.71Å; H143-K146 CarbonylContact O-C 3.44Å; H143-K146 PolarHBondContact O-N 2.81Å; H143-K146 VanDerWaalsContact O-N 3.16Å; H143-C147 PolarHBondContact O-N 3.03Å; H143-D148 HydrophobicContact CB-CB 4.32Å; H143-D148 IonicContact CE1-OD2 2.79Å; H143-D148 PolarHBondContact CE1-OD2 3.2Å; H143-D148 IonicContact ND1-OD2 2.76Å; H143-D148 PolarHBondContact ND1-OD2 3.47Å; H143-D148 PolarHBondContact O-N 3.16Å; H143-G151 VanDerWaalsContact CD2-C 3.43Å; H143-G151 PolarHBondContact CD2-O 2.92Å; H143-G151 VanDerWaalsContact CD2-O 3.3Å; H143-G151 VanDerWaalsContact CE1-CA 3.49Å; H143-G151 WeakPolarHBondContact CE1-CA 3.36Å; H143-G151 WeakPolarHBondContact ND1-CA 3.14Å; H143-S155 PolarHBondContact CD2-OG 3.28Å; H143-S155 PolarHBondContact NE2-OG 3.29Å
144	L	48.4	Very low	50.3	Low	48 Å²	48	49.1 Å²	49.1	25%	0.251	29%	0.292	S	S	.	.	H	α-helix	trans	-62.2	-42.1	172.1	-78.9	159.2	0	0	0	111.6	W107 L140 K146 C147	W107-L144 HydrophobicContact CD2-CD1 4.11Å; W107-L144 HydrophobicContact CE3-CD1 3.61Å; W107-L144 HydrophobicContact CH2-CD1 4.45Å; W107-L144 HydrophobicContact CZ3-CD1 3.82Å; L140-L144 HydrophobicContact CD1-CD1 4.12Å; L140-L144 HydrophobicContact CD1-CG 4.37Å; L140-L144 HydrophobicContact CG-CD1 3.88Å; L140-L144 VanDerWaalsContact O-CB 3.25Å; L140-L144 WeakPolarHBondContact O-CB 3.27Å; L140-L144 WeakPolarHBondContact O-CD1 3.26Å; L140-L144 VanDerWaalsContact O-CG 3.27Å; L140-L144 WeakPolarHBondContact O-CG 3.36Å; L140-L144 PolarHBondContact O-N 3.34Å; L144-K146 PolarHBondContact O-N 3.08Å; L144-C147 PolarHBondContact O-N 3.31Å; L144-C147 VanDerWaalsContact O-N 3.08Å
145	A	50.9	Low	50.3	Low	32 Å²	32	47.2 Å²	47.2	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-63.5	-27.5	175.3	0	0	0	0	0	112.9	T101 S141	T101-A145 HydrophobicContact CG2-CB 4.31Å; S141-A145 WeakPolarHBondContact O-CB 3.44Å; S141-A145 PolarHBondContact O-N 3.16Å
146	K	53.2	Low	50.2	Low	161 Å²	161	43.9 Å²	43.9	70%	0.7	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	1.8	175.8	-69.7	176.2	-178.3	177.8	0	113.6	A142 H143 L144 D148	A142-K146 WeakPolarHBondContact O-CB 3.32Å; A142-K146 VanDerWaalsContact O-CG 3.31Å; A142-K146 WeakPolarHBondContact O-CG 3.3Å; A142-K146 PolarHBondContact O-N 2.87Å; A142-K146 VanDerWaalsContact O-N 3.12Å; H143-K146 CarbonylContact O-C 3.44Å; H143-K146 PolarHBondContact O-N 2.81Å; H143-K146 VanDerWaalsContact O-N 3.16Å; L144-K146 PolarHBondContact O-N 3.08Å; K146-D148 HydrophobicContact CB-CB 4.19Å; K146-D148 PolarHBondContact O-N 3.3Å; K146-D148 VanDerWaalsContact O-N 3.16Å
147	C	47.5	Very low	50.3	Low	49 Å²	49	47.7 Å²	47.7	33%	0.331	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	30.3	-170.2	-60.6	0	0	0	0	113.2	H143 L144 V149	H143-C147 PolarHBondContact O-N 3.03Å; L144-C147 PolarHBondContact O-N 3.31Å; L144-C147 VanDerWaalsContact O-N 3.08Å; C147-V149 PolarHBondContact O-N 3.07Å
148	D	44.7	Very low	50.4	Low	61 Å²	61	47.8 Å²	47.8	33%	0.326	28%	0.284	S	S	.	.			trans	-91.7	87.9	-178.1	179.1	12.1	0	0	0	110.4	H143 K146 A150 G151 G152	H143-D148 HydrophobicContact CB-CB 4.32Å; H143-D148 IonicContact CE1-OD2 2.79Å; H143-D148 PolarHBondContact CE1-OD2 3.2Å; H143-D148 IonicContact ND1-OD2 2.76Å; H143-D148 PolarHBondContact ND1-OD2 3.47Å; H143-D148 PolarHBondContact O-N 3.16Å; K146-D148 HydrophobicContact CB-CB 4.19Å; K146-D148 PolarHBondContact O-N 3.3Å; K146-D148 VanDerWaalsContact O-N 3.16Å; D148-A150 VanDerWaalsContact C-N 3.3Å; D148-A150 PolarHBondContact O-N 3.36Å; D148-A150 PolarHBondContact OD1-N 2.98Å; D148-G151 PolarHBondContact O-N 3.44Å; D148-G151 PolarHBondContact OD1-N 3.35Å; D148-G152 PolarHBondContact O-N 2.83Å
149	V	46.6	Very low	50.3	Low	36 Å²	36	45.6 Å²	45.6	22%	0.218	27%	0.271	C	S	.	.	H	α-helix	trans	-57.8	-43.2	178.9	-174.1	0	0	0	0	111.8	V10 L47 C147 G151 G152 I153	V10-V149 HydrophobicContact CB-CG1 4.29Å; V10-V149 HydrophobicContact CB-CG2 4.09Å; V10-V149 HydrophobicContact CG1-CB 4.12Å; V10-V149 HydrophobicContact CG1-CG1 3.69Å; V10-V149 HydrophobicContact CG1-CG2 3.85Å; V10-V149 HydrophobicContact CG2-CB 4.08Å; V10-V149 HydrophobicContact CG2-CG1 3.61Å; V10-V149 HydrophobicContact CG2-CG2 3.34Å; L47-V149 HydrophobicContact CD2-CG1 4.23Å; C147-V149 PolarHBondContact O-N 3.07Å; V149-G151 VanDerWaalsContact C-N 3.35Å; V149-G152 PolarHBondContact O-N 3.27Å; V149-I153 HydrophobicContact CG1-CD1 3.85Å; V149-I153 WeakPolarHBondContact O-CD1 3.41Å; V149-I153 VanDerWaalsContact O-CG1 3.29Å; V149-I153 WeakPolarHBondContact O-CG1 3.18Å; V149-I153 PolarHBondContact O-N 2.88Å; V149-I153 VanDerWaalsContact O-N 3.07Å
150	A	48.7	Very low	50.4	Low	73 Å²	73	43.5 Å²	43.5	60%	0.603	26%	0.263	S	S	*	.	H	α-helix	trans	-66.4	-42.6	-177.2	0	0	0	0	0	110.2	D148 A154	D148-A150 VanDerWaalsContact C-N 3.3Å; D148-A150 PolarHBondContact O-N 3.36Å; D148-A150 PolarHBondContact OD1-N 2.98Å; A150-A154 VanDerWaalsContact O-CB 3.28Å; A150-A154 WeakPolarHBondContact O-CB 3.45Å; A150-A154 PolarHBondContact O-N 3.48Å
151	G	44.9	Very low	50.5	Low	8 Å²	8	47.3 Å²	47.3	8%	0.082	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-36.5	175.9	0	0	0	0	0	114.3	H143 D148 V149 A154 S155	H143-G151 VanDerWaalsContact CD2-C 3.43Å; H143-G151 PolarHBondContact CD2-O 2.92Å; H143-G151 VanDerWaalsContact CD2-O 3.3Å; H143-G151 VanDerWaalsContact CE1-CA 3.49Å; H143-G151 WeakPolarHBondContact CE1-CA 3.36Å; H143-G151 WeakPolarHBondContact ND1-CA 3.14Å; D148-G151 PolarHBondContact O-N 3.44Å; D148-G151 PolarHBondContact OD1-N 3.35Å; V149-G151 VanDerWaalsContact C-N 3.35Å; G151-A154 PolarHBondContact O-N 3.42Å; G151-S155 WeakPolarHBondContact O-CB 3.29Å; G151-S155 PolarHBondContact O-N 3.39Å; G151-S155 PolarHBondContact O-OG 3.32Å
152	G	48.3	Very low	50.6	Low	6 Å²	6	47.2 Å²	47.2	6%	0.062	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-42.3	174.9	0	0	0	0	0	112.6	D148 V149 S155 F156	D148-G152 PolarHBondContact O-N 2.83Å; V149-G152 PolarHBondContact O-N 3.27Å; G152-S155 PolarHBondContact O-N 2.87Å; G152-F156 PolarHBondContact O-N 3.01Å
153	I	48.7	Very low	50.5	Low	35 Å²	35	50.2 Å²	50.2	18%	0.179	28%	0.284	C	S	.	.	H	α-helix	trans	-68.8	-42.1	174.9	-64.3	163.9	0	0	0	110.7	F41 V149 S155 F156 I157	F41-I153 HydrophobicContact CE1-CD1 3.5Å; F41-I153 HydrophobicContact CZ-CD1 3.75Å; V149-I153 HydrophobicContact CG1-CD1 3.85Å; V149-I153 WeakPolarHBondContact O-CD1 3.41Å; V149-I153 VanDerWaalsContact O-CG1 3.29Å; V149-I153 WeakPolarHBondContact O-CG1 3.18Å; V149-I153 PolarHBondContact O-N 2.88Å; V149-I153 VanDerWaalsContact O-N 3.07Å; I153-S155 VanDerWaalsContact C-N 3.29Å; I153-S155 PolarHBondContact O-N 3.15Å; I153-F156 PolarHBondContact O-N 3.37Å; I153-I157 HydrophobicContact CG2-CD1 3.82Å; I153-I157 HydrophobicContact CG2-CG1 4.32Å; I153-I157 VanDerWaalsContact O-CG1 3.32Å; I153-I157 WeakPolarHBondContact O-CG1 2.91Å; I153-I157 PolarHBondContact O-N 3.43Å
154	A	50.7	Low	50.6	Low	52 Å²	52	52.9 Å²	52.9	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-40.5	175.6	0	0	0	0	0	111.8	A150 G151 I157 G158	A150-A154 VanDerWaalsContact O-CB 3.28Å; A150-A154 WeakPolarHBondContact O-CB 3.45Å; A150-A154 PolarHBondContact O-N 3.48Å; G151-A154 PolarHBondContact O-N 3.42Å; A154-I157 PolarHBondContact O-N 3.48Å; A154-G158 PolarHBondContact O-N 3.18Å
155	S	49.8	Very low	50.7	Low	7 Å²	7	56.1 Å²	56.1	5%	0.049	31%	0.305	C	S	.	.	H	α-helix	trans	-65.9	-39.2	175.6	-59.4	0	0	0	0	111.8	H143 G151 G152 I153 G158 F159	H143-S155 PolarHBondContact CD2-OG 3.28Å; H143-S155 PolarHBondContact NE2-OG 3.29Å; G151-S155 WeakPolarHBondContact O-CB 3.29Å; G151-S155 PolarHBondContact O-N 3.39Å; G151-S155 PolarHBondContact O-OG 3.32Å; G152-S155 PolarHBondContact O-N 2.87Å; I153-S155 VanDerWaalsContact C-N 3.29Å; I153-S155 PolarHBondContact O-N 3.15Å; S155-G158 PolarHBondContact O-N 3.01Å; S155-F159 WeakPolarHBondContact O-CB 3Å; S155-F159 PolarHBondContact O-N 3.35Å
156	F	52.1	Low	50.5	Low	35 Å²	35	55.1 Å²	55.1	15%	0.154	30%	0.297	C	S	.	.	H	α-helix	trans	-69	-40.7	175.3	-175.9	-98.8	0	0	0	112.8	F14 T17 I18 C21 G152 I153 G158 F159 V160	F14-F156 HydrophobicContact CE2-CB 3.8Å; F14-F156 HydrophobicContact CE2-CD2 4.27Å; F14-F156 HydrophobicContact CE2-CG 4.1Å; F14-F156 HydrophobicContact CZ-CB 4.01Å; F14-F156 AromaticContact CZ-CD2 3.88Å; F14-F156 HydrophobicContact CZ-CD2 3.88Å; F14-F156 HydrophobicContact CZ-CG 4.17Å; T17-F156 HydrophobicContact CG2-CE1 3.92Å; T17-F156 HydrophobicContact CG2-CZ 4.29Å; I18-F156 HydrophobicContact CG1-CE2 4.31Å; C21-F156 HydrophobicContact CB-CZ 4.48Å; G152-F156 PolarHBondContact O-N 3.01Å; I153-F156 PolarHBondContact O-N 3.37Å; F156-G158 VanDerWaalsContact C-N 3.32Å; F156-F159 WeakPolarHBondContact O-CB 3.5Å; F156-F159 PolarHBondContact O-N 3.07Å; F156-V160 HydrophobicContact CD1-CG2 4.12Å; F156-V160 HydrophobicContact CE1-CG2 3.68Å; F156-V160 HydrophobicContact CE2-CG2 4.42Å; F156-V160 HydrophobicContact CZ-CG2 3.85Å; F156-V160 WeakPolarHBondContact O-CG2 3.3Å; F156-V160 PolarHBondContact O-N 3.5Å
157	I	53.4	Low	50.3	Low	90 Å²	90	53.2 Å²	53.2	46%	0.462	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-44.5	173.3	-67.6	167.9	0	0	0	109.7	I153 A154 F159 V160 Q161	I153-I157 HydrophobicContact CG2-CD1 3.82Å; I153-I157 HydrophobicContact CG2-CG1 4.32Å; I153-I157 VanDerWaalsContact O-CG1 3.32Å; I153-I157 WeakPolarHBondContact O-CG1 2.91Å; I153-I157 PolarHBondContact O-N 3.43Å; A154-I157 PolarHBondContact O-N 3.48Å; I157-F159 VanDerWaalsContact C-N 3.26Å; I157-F159 PolarHBondContact O-N 3.43Å; I157-V160 PolarHBondContact O-N 3.24Å; I157-Q161 VanDerWaalsContact O-CB 3.28Å; I157-Q161 WeakPolarHBondContact O-CB 3.34Å; I157-Q161 PolarHBondContact O-N 3.31Å
158	G	52.2	Low	50.4	Low	21 Å²	21	58.4 Å²	58.4	22%	0.216	31%	0.305	C	S	.	.	H	α-helix	trans	-57.1	-41.1	173.1	0	0	0	0	0	111.9	A154 S155 F156 Q161 A162	A154-G158 PolarHBondContact O-N 3.18Å; S155-G158 PolarHBondContact O-N 3.01Å; F156-G158 VanDerWaalsContact C-N 3.32Å; G158-Q161 PolarHBondContact O-N 3.31Å; G158-A162 WeakPolarHBondContact O-CB 3.5Å; G158-A162 PolarHBondContact O-N 3.34Å
159	F	53.3	Low	50.4	Low	34 Å²	34	59.3 Å²	59.3	15%	0.149	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-48.8	175.8	178.8	-111.9	0	0	0	113.2	A132 Q133 A136 S155 F156 I157 Q161 A162 R163	A132-F159 WeakPolarHBondContact O-CD2 3.28Å; Q133-F159 HydrophobicContact CB-CE2 4.02Å; Q133-F159 HydrophobicContact CB-CZ 4.46Å; Q133-F159 HydrophobicContact CG-CE2 3.32Å; Q133-F159 HydrophobicContact CG-CZ 3.41Å; Q133-F159 VanDerWaalsContact CG-CZ 3.41Å; A136-F159 HydrophobicContact CB-CB 3.56Å; A136-F159 HydrophobicContact CB-CD2 3.39Å; A136-F159 HydrophobicContact CB-CE2 4.34Å; A136-F159 HydrophobicContact CB-CG 3.64Å; S155-F159 WeakPolarHBondContact O-CB 3Å; S155-F159 PolarHBondContact O-N 3.35Å; F156-F159 WeakPolarHBondContact O-CB 3.5Å; F156-F159 PolarHBondContact O-N 3.07Å; I157-F159 VanDerWaalsContact C-N 3.26Å; I157-F159 PolarHBondContact O-N 3.43Å; F159-Q161 VanDerWaalsContact C-N 3.27Å; F159-Q161 PolarHBondContact O-N 3.11Å; F159-A162 PolarHBondContact O-N 3.15Å; F159-R163 WeakPolarHBondContact O-CB 3.24Å; F159-R163 PolarHBondContact O-N 3.49Å
160	V	54.1	Low	50.2	Low	29 Å²	29	58.3 Å²	58.3	18%	0.176	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-40.3	177	173.3	0	0	0	0	110.1	F29 F156 I157 R163 Q164	F29-V160 HydrophobicContact CE1-CG1 4.25Å; F29-V160 HydrophobicContact CZ-CG1 4.39Å; F156-V160 HydrophobicContact CD1-CG2 4.12Å; F156-V160 HydrophobicContact CE1-CG2 3.68Å; F156-V160 HydrophobicContact CE2-CG2 4.42Å; F156-V160 HydrophobicContact CZ-CG2 3.85Å; F156-V160 WeakPolarHBondContact O-CG2 3.3Å; F156-V160 PolarHBondContact O-N 3.5Å; I157-V160 PolarHBondContact O-N 3.24Å; V160-R163 PolarHBondContact O-N 2.84Å; V160-Q164 WeakPolarHBondContact O-CG 3.26Å; V160-Q164 PolarHBondContact O-N 3.42Å
161	Q	55.3	Low	49.9	Very low	93 Å²	93	59.1 Å²	59.1	44%	0.435	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-41.2	176.1	-163.8	-179.7	22.1	0	0	111.8	I157 G158 F159 Q164 R165	I157-Q161 VanDerWaalsContact O-CB 3.28Å; I157-Q161 WeakPolarHBondContact O-CB 3.34Å; I157-Q161 PolarHBondContact O-N 3.31Å; G158-Q161 PolarHBondContact O-N 3.31Å; F159-Q161 VanDerWaalsContact C-N 3.27Å; F159-Q161 PolarHBondContact O-N 3.11Å; Q161-Q164 PolarHBondContact O-N 3.01Å; Q161-R165 WeakPolarHBondContact O-CG 3.1Å; Q161-R165 PolarHBondContact O-N 3.18Å
162	A	51.5	Low	49.7	Very low	32 Å²	32	66.7 Å²	66.7	26%	0.264	33%	0.33	S	S	.	.	H	α-helix	trans	-64	-41.9	175	0	0	0	0	0	111.3	A132 G158 F159 R165 C166	A132-A162 HydrophobicContact CB-CB 4.03Å; G158-A162 WeakPolarHBondContact O-CB 3.5Å; G158-A162 PolarHBondContact O-N 3.34Å; F159-A162 PolarHBondContact O-N 3.15Å; A162-R165 CarbonylContact O-C 3.54Å; A162-R165 WeakPolarHBondContact O-CB 3.03Å; A162-R165 PolarHBondContact O-N 2.86Å; A162-R165 VanDerWaalsContact O-N 3.14Å; A162-C166 PolarHBondContact O-N 3.43Å
163	R	53.2	Low	49.2	Very low	107 Å²	107	70.7 Å²	70.7	40%	0.404	35%	0.346	S	S	.	.	H	α-helix	trans	-65	-40.5	175.9	-165.9	176.1	-176.4	-169.6	-3	111.9	F159 V160 R165 C166 K167	F159-R163 WeakPolarHBondContact O-CB 3.24Å; F159-R163 PolarHBondContact O-N 3.49Å; V160-R163 PolarHBondContact O-N 2.84Å; R163-R165 VanDerWaalsContact C-N 3.3Å; R163-R165 PolarHBondContact O-N 2.9Å; R163-C166 PolarHBondContact O-N 3.28Å; R163-K167 WeakPolarHBondContact O-CB 3.41Å; R163-K167 PolarHBondContact O-N 3.32Å
164	Q	54.8	Low	48.9	Very low	101 Å²	101	73.7 Å²	73.7	47%	0.472	37%	0.365	S	S	.	.	H	α-helix	trans	-63.6	-36.2	172.3	-75.6	-176.5	-0.4	0	0	112.3	V160 Q161 K167 K168	V160-Q164 WeakPolarHBondContact O-CG 3.26Å; V160-Q164 PolarHBondContact O-N 3.42Å; Q161-Q164 PolarHBondContact O-N 3.01Å; Q164-K167 PolarHBondContact O-N 2.69Å; Q164-K168 PolarHBondContact O-N 3.05Å
165	R	51.2	Low	48.6	Very low	116 Å²	116	78.1 Å²	78.1	44%	0.438	38%	0.382	S	S	.	.	H	α-helix	trans	-69.3	-42.1	173.7	-71	179	-171.3	-177.9	7.5	111.8	Q161 A162 R163 K167 K168 L169	Q161-R165 WeakPolarHBondContact O-CG 3.1Å; Q161-R165 PolarHBondContact O-N 3.18Å; A162-R165 CarbonylContact O-C 3.54Å; A162-R165 WeakPolarHBondContact O-CB 3.03Å; A162-R165 PolarHBondContact O-N 2.86Å; A162-R165 VanDerWaalsContact O-N 3.14Å; R163-R165 VanDerWaalsContact C-N 3.3Å; R163-R165 PolarHBondContact O-N 2.9Å; R165-K167 VanDerWaalsContact C-N 3.33Å; R165-K167 PolarHBondContact O-N 2.95Å; R165-K168 PolarHBondContact O-N 2.98Å; R165-L169 PolarHBondContact O-N 2.95Å
166	C	45.6	Very low	47.9	Very low	12 Å²	12	79.2 Å²	79.2	8%	0.081	39%	0.389	C	S	.	.	H	α-helix	trans	-63.9	-36.5	173	-68.6	0	0	0	0	111.1	C128 E129 A162 R163 L169 S170	C128-C166 VanDerWaalsContact C-SG 3.52Å; C128-C166 HydrophobicContact CB-CB 4.12Å; C128-C166 WeakPolarHBondContact CB-SG 3.36Å; C128-C166 WeakPolarHBondContact SG-CB 3.22Å; C128-C166 CovalentContact SG-SG 2.08Å; C128-C166 PolarHBondContact SG-SG 3.32Å; E129-C166 HydrophobicContact CG-CB 3.87Å; A162-C166 PolarHBondContact O-N 3.43Å; R163-C166 PolarHBondContact O-N 3.28Å; C166-L169 PolarHBondContact O-N 2.99Å; C166-S170 WeakPolarHBondContact O-CB 3.27Å; C166-S170 PolarHBondContact O-N 3.09Å
167	K	50.5	Low	47.3	Very low	120 Å²	120	84.5 Å²	84.5	52%	0.522	42%	0.419	S	S	.	.	H	α-helix	trans	-67.7	-39.4	174.9	-165.1	170.8	-176.7	173	0	112.4	R163 Q164 R165 N171	R163-K167 WeakPolarHBondContact O-CB 3.41Å; R163-K167 PolarHBondContact O-N 3.32Å; Q164-K167 PolarHBondContact O-N 2.69Å; R165-K167 VanDerWaalsContact C-N 3.33Å; R165-K167 PolarHBondContact O-N 2.95Å; K167-N171 PolarHBondContact O-N 3.25Å; K167-N171 VanDerWaalsContact O-N 3.08Å
168	K	48.7	Very low	47	Very low	158 Å²	158	87.8 Å²	87.8	69%	0.687	44%	0.438	S	S	*	.	H	α-helix	trans	-67.1	-40.2	172.9	-79.6	-173.8	178.6	-178.2	0	112.3	Q164 R165 F172	Q164-K168 PolarHBondContact O-N 3.05Å; R165-K168 PolarHBondContact O-N 2.98Å; K168-F172 PolarHBondContact O-N 2.79Å
169	L	45.6	Very low	46.6	Very low	80 Å²	80	89.9 Å²	89.9	42%	0.419	45%	0.446	S	S	.	.	H	α-helix	trans	-67.3	-42.9	174	-105.2	96.8	0	0	0	111.9	R165 C166 N171 F172 F173	R165-L169 PolarHBondContact O-N 2.95Å; C166-L169 PolarHBondContact O-N 2.99Å; L169-N171 VanDerWaalsContact C-N 3.29Å; L169-N171 PolarHBondContact O-N 3.01Å; L169-F172 WeakPolarHBondContact O-CA 3.08Å; L169-F172 WeakPolarHBondContact O-CB 3.29Å; L169-F172 PolarHBondContact O-N 3.38Å; L169-F173 HydrophobicContact CD2-CE2 4.23Å; L169-F173 WeakPolarHBondContact O-CD2 3.34Å; L169-F173 PolarHBondContact O-N 2.91Å
170	S	41.7	Very low	45.9	Very low	16 Å²	16	97.7 Å²	97.7	11%	0.112	48%	0.475	C	S	.	.	H	α-helix	trans	-52.9	-48.5	174.3	151.1	0	0	0	0	110.9	K125 C166 F172 F173 T174	K125-S170 WeakPolarHBondContact CE-OG 3.42Å; K125-S170 PolarHBondContact NZ-OG 3.3Å; C166-S170 WeakPolarHBondContact O-CB 3.27Å; C166-S170 PolarHBondContact O-N 3.09Å; S170-F172 VanDerWaalsContact C-N 3.26Å; S170-F172 PolarHBondContact O-N 3.39Å; S170-F173 PolarHBondContact O-N 2.82Å; S170-F173 VanDerWaalsContact O-N 3.14Å; S170-T174 PolarHBondContact O-N 3.13Å; S170-T174 PolarHBondContact O-OG1 2.97Å
171	N	41.3	Very low	45.4	Very low	90 Å²	90	105.7 Å²	105.7	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-69.5	-22.5	-179.7	-74.7	-2.9	0	0	0	113.6	K167 L169 N175	K167-N171 PolarHBondContact O-N 3.25Å; K167-N171 VanDerWaalsContact O-N 3.08Å; L169-N171 VanDerWaalsContact C-N 3.29Å; L169-N171 PolarHBondContact O-N 3.01Å; N171-N175 PolarHBondContact O-ND2 2.9Å
172	F	42.1	Very low	44.7	Very low	167 Å²	167	108.4 Å²	108.4	73%	0.732	53%	0.525	S	S	*	.	H	α-helix	trans	-75.4	-39	169.1	-104.6	-87.5	0	0	0	111.6	K168 L169 S170 S176	K168-F172 PolarHBondContact O-N 2.79Å; L169-F172 WeakPolarHBondContact O-CA 3.08Å; L169-F172 WeakPolarHBondContact O-CB 3.29Å; L169-F172 PolarHBondContact O-N 3.38Å; S170-F172 VanDerWaalsContact C-N 3.26Å; S170-F172 PolarHBondContact O-N 3.39Å; F172-S176 PolarHBondContact O-OG 3.46Å
173	F	37.7	Very low	44.3	Very low	90 Å²	90	109 Å²	109	40%	0.395	53%	0.525	S	S	.	.	H	α-helix	trans	-74.2	-29.6	179.8	-91.6	-83.2	0	0	0	113.9	L169 S170	L169-F173 HydrophobicContact CD2-CE2 4.23Å; L169-F173 WeakPolarHBondContact O-CD2 3.34Å; L169-F173 PolarHBondContact O-N 2.91Å; S170-F173 PolarHBondContact O-N 2.82Å; S170-F173 VanDerWaalsContact O-N 3.14Å
174	T	41.3	Very low	43.5	Very low	97 Å²	97	108.1 Å²	108.1	60%	0.595	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.4	175.1	32.1	0	0	0	0	114.7	S170	S170-T174 PolarHBondContact O-N 3.13Å; S170-T174 PolarHBondContact O-OG1 2.97Å
175	N	44.5	Very low	42.5	Very low	146 Å²	146	106.6 Å²	106.6	78%	0.781	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	4	178.4	-91.2	-58.7	0	0	0	114.2	N171	N171-N175 PolarHBondContact O-ND2 2.9Å
176	S	35.4	Very low	41.8	Very low	29 Å²	29	107.6 Å²	107.6	20%	0.203	57%	0.574	C	S	.	*			trans	-136.4	76.4	-179.8	75.9	0	0	0	0	111.9	F172 N178 V179	F172-S176 PolarHBondContact O-OG 3.46Å; S176-N178 PolarHBondContact O-N 3.45Å; S176-V179 PolarHBondContact O-N 3.35Å; S176-V179 VanDerWaalsContact O-N 3.07Å; S176-V179 VanDerWaalsContact OG-CB 3.27Å; S176-V179 WeakPolarHBondContact OG-CB 3.49Å; S176-V179 WeakPolarHBondContact OG-CG2 3.37Å
177	D	40.4	Very low	41.4	Very low	146 Å²	146	111 Å²	111	78%	0.781	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.4	-19.1	162.7	-84.1	-47	0	0	0	112.3
178	N	45.6	Very low	40.9	Very low	160 Å²	160	110.2 Å²	110.2	86%	0.856	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-6.2	179	-71.7	-24.6	0	0	0	115.9	S176	S176-N178 PolarHBondContact O-N 3.45Å
179	V	44	Very low	40.5	Very low	65 Å²	65	109.9 Å²	109.9	39%	0.394	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.6	-19.4	-175.6	179.3	0	0	0	0	112.4	S176 K181 N182 V183	S176-V179 PolarHBondContact O-N 3.35Å; S176-V179 VanDerWaalsContact O-N 3.07Å; S176-V179 VanDerWaalsContact OG-CB 3.27Å; S176-V179 WeakPolarHBondContact OG-CB 3.49Å; S176-V179 WeakPolarHBondContact OG-CG2 3.37Å; V179-K181 PolarHBondContact O-N 2.83Å; V179-N182 PolarHBondContact O-N 2.91Å; V179-N182 VanDerWaalsContact O-N 3.12Å; V179-V183 HydrophobicContact CG1-CG2 3.4Å; V179-V183 VanDerWaalsContact CG1-CG2 3.4Å; V179-V183 WeakPolarHBondContact O-CG2 3.2Å
180	R	38.9	Very low	40.2	Very low	197 Å²	197	113.8 Å²	113.8	74%	0.743	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-13.8	-178.6	-120.9	173.6	83.5	-178.3	6.8	115.4
181	K	43.6	Very low	40.2	Very low	197 Å²	197	119.3 Å²	119.3	86%	0.857	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-13.9	176.4	-77.3	-177.6	176.4	174.5	0	114.9	V179	V179-K181 PolarHBondContact O-N 2.83Å
182	N	40.8	Very low	40.2	Very low	151 Å²	151	120 Å²	120	81%	0.807	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.7	-6.5	-170.6	-102.4	24.3	0	0	0	116.3	V179	V179-N182 PolarHBondContact O-N 2.91Å; V179-N182 VanDerWaalsContact O-N 3.12Å
183	V	43.5	Very low	39.8	Very low	44 Å²	44	114.4 Å²	114.4	27%	0.267	64%	0.641	S	S	.	*			trans	-104.6	4	-179	-107.7	0	0	0	0	114.7	V179 G185 L187	V179-V183 HydrophobicContact CG1-CG2 3.4Å; V179-V183 VanDerWaalsContact CG1-CG2 3.4Å; V179-V183 WeakPolarHBondContact O-CG2 3.2Å; V183-G185 PolarHBondContact O-N 3.41Å; V183-L187 HydrophobicContact CB-CD1 3.88Å; V183-L187 HydrophobicContact CG1-CD1 3.63Å; V183-L187 HydrophobicContact CG1-CG 4.43Å
184	G	35.5	Very low	39.6	Very low	89 Å²	89	112.6 Å²	112.6	92%	0.918	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	12.3	178.3	0	0	0	0	0	116.1
185	G	34	Very low	39.6	Very low	68 Å²	68	111.3 Å²	111.3	70%	0.701	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.1	-5.2	-177.6	0	0	0	0	0	116.7	V183	V183-G185 PolarHBondContact O-N 3.41Å
186	L	36.5	Very low	39.3	Very low	137 Å²	137	110 Å²	110	72%	0.717	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	-15.7	-173.5	-112.3	88.6	0	0	0	115.6
187	L	38	Very low	39.5	Very low	83 Å²	83	116.3 Å²	116.3	44%	0.435	65%	0.654	S	S	.	*	H	α-helix	trans	-90.5	-8.5	-171.4	-82.2	154	0	0	0	115.1	V183	V183-L187 HydrophobicContact CB-CD1 3.88Å; V183-L187 HydrophobicContact CG1-CD1 3.63Å; V183-L187 HydrophobicContact CG1-CG 4.43Å
188	S	39.6	Very low	39.7	Very low	104 Å²	104	118 Å²	118	73%	0.727	65%	0.654	S	S	*	*	H	α-helix	trans	-82.1	-15.4	-176.1	-67.7	0	0	0	0	115
189	N	39.5	Very low	39.5	Very low	152 Å²	152	116.9 Å²	116.9	81%	0.813	64%	0.642	S	S	*	*	H	α-helix	trans	-110.5	-25.7	-173.9	-101.9	-7.5	0	0	0	115.6
190	E	40.6	Very low	39.1	Very low	161 Å²	161	120.5 Å²	120.5	75%	0.752	66%	0.657	S	S	*	*	H	α-helix	trans	-92.8	-27.7	-175.1	-99.7	180	144.7	0	0	114.6
191	F	41.2	Very low	38.7	Very low	132 Å²	132	117.1 Å²	117.1	58%	0.579	68%	0.684	S	S	*	*	H	α-helix	trans	-81.5	-21.3	-178.3	-113.9	-94.3	0	0	0	113.9
192	V	41.9	Very low	38.5	Very low	106 Å²	106	113.1 Å²	113.1	64%	0.642	68%	0.675	S	S	*	*	H	α-helix	trans	-83.5	-30.4	179.6	176.1	0	0	0	0	111.6
193	G	32.6	Very low	38.4	Very low	49 Å²	49	111.1 Å²	111.1	51%	0.505	67%	0.668	S	S	.	*	H	α-helix	trans	-76.2	-41.6	179.1	0	0	0	0	0	114.4
194	G	34.6	Very low	38.1	Very low	51 Å²	51	114.8 Å²	114.8	53%	0.526	69%	0.691	S	S	.	*	H	α-helix	trans	-77.7	-20.9	-175.1	0	0	0	0	0	115.1
195	L	40.6	Very low	38.2	Very low	70 Å²	70	116.4 Å²	116.4	37%	0.366	68%	0.677	S	S	.	*	H	α-helix	trans	-86.8	-29.3	-178.5	-142	122.9	0	0	0	112.2	F199	L195-F199 HydrophobicContact CD2-CD2 4.34Å; L195-F199 HydrophobicContact CD2-CE2 4.15Å
196	M	39.6	Very low	38.5	Very low	119 Å²	119	119.4 Å²	119.4	59%	0.586	68%	0.676	S	S	*	*	H	α-helix	trans	-68.4	-33.5	174	-85.5	-67.4	-164.7	0	0	112.8	K198 F199 I200	M196-K198 VanDerWaalsContact C-N 3.25Å; M196-K198 PolarHBondContact O-N 3.13Å; M196-F199 PolarHBondContact O-N 3.21Å; M196-I200 PolarHBondContact O-N 3.28Å; M196-I200 HydrophobicContact SD-CD1 3.96Å
197	Q	38	Very low	38.6	Very low	162 Å²	162	118.2 Å²	118.2	76%	0.757	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-17.3	-178.4	-155.8	170.1	22.5	0	0	113.6
198	K	45.8	Very low	38.7	Very low	181 Å²	181	120.7 Å²	120.7	79%	0.787	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-4.8	-179	-124.6	176	-177.3	177.4	0	114.4	M196	M196-K198 VanDerWaalsContact C-N 3.25Å; M196-K198 PolarHBondContact O-N 3.13Å
199	F	41.3	Very low	38.6	Very low	137 Å²	137	122 Å²	122	60%	0.601	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	-8.4	177.7	-87	-82.9	0	0	0	113.3	L195 M196	L195-F199 HydrophobicContact CD2-CD2 4.34Å; L195-F199 HydrophobicContact CD2-CE2 4.15Å; M196-F199 PolarHBondContact O-N 3.21Å
200	I	35.2	Very low	38.5	Very low	140 Å²	140	119.5 Å²	119.5	72%	0.718	68%	0.677	S	S	*	*			trans	-121.1	-0	-175.6	-72.3	170.4	0	0	0	112.8	M196	M196-I200 PolarHBondContact O-N 3.28Å; M196-I200 HydrophobicContact SD-CD1 3.96Å
201	G	30.8	Very low	38.3	Very low	126 Å²	126	115.7 Å²	115.7	100%	1.299	67%	0.67	S	S	*	*			trans	-105.1	0	169.2	0	0	0	0	0	111.4

Retrieved 201 of 201 residues in 115.6 ms (Link to these results)

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