A0A3Q0KSU0_SCHMA Loading...

Akirin

AlphaFold DB , UniProt , Accession A0A3Q0KSU0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 218 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	32.8	Very low	33	Very low	233 Å²	233	153.7 Å²	153.7	100%	1.148	81%	0.813	S	S	*	*				0	108.5	0	-79.8	175.9	141.9	0	0	107.6	S3	M1-S3 PolarHBondContact O-N 2.97Å
2	N	29.6	Very low	34	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	80%	0.798	S	S	*	*			trans	-81.8	103.5	180	-76.1	-11.9	0	0	0	108.8	R4	N2-R4 VanDerWaalsContact C-N 3.26Å; N2-R4 PolarHBondContact O-N 2.78Å
3	S	27.2	Very low	34.7	Very low	114 Å²	114	156.5 Å²	156.5	80%	0.797	80%	0.802	S	S	*	*			trans	-71.2	82.7	173.8	-60.4	0	0	0	0	109.7	M1 V5	M1-S3 PolarHBondContact O-N 2.97Å; S3-V5 PolarHBondContact O-N 3.12Å
4	R	26.5	Very low	35.4	Very low	222 Å²	222	157.4 Å²	157.4	84%	0.838	80%	0.801	S	S	*	*			trans	-70	106.3	163.5	-109.3	-178.7	-165.7	-178.4	4.6	107	N2 H6	N2-R4 VanDerWaalsContact C-N 3.26Å; N2-R4 PolarHBondContact O-N 2.78Å; R4-H6 PolarHBondContact O-N 3.33Å
5	V	29	Very low	35.7	Very low	130 Å²	130	153.9 Å²	153.9	79%	0.788	79%	0.785	S	S	*	*			trans	-63.7	101.4	170.6	-176.7	0	0	0	0	107	S3 L7	S3-V5 PolarHBondContact O-N 3.12Å; V5-L7 PolarHBondContact O-N 3.01Å; V5-L7 VanDerWaalsContact O-N 3.08Å
6	H	27.3	Very low	35.9	Very low	170 Å²	170	147.3 Å²	147.3	79%	0.787	76%	0.756	S	S	*	*			trans	-67.8	103.6	171.5	-85.9	-85.9	0	0	0	108	R4 K8	R4-H6 PolarHBondContact O-N 3.33Å; H6-K8 PolarHBondContact O-N 2.86Å
7	L	31.7	Very low	36.1	Very low	133 Å²	133	142.9 Å²	142.9	70%	0.696	74%	0.741	S	S	*	*			trans	-59.4	103.5	165.8	-94	134.6	0	0	0	107.8	V5 N9	V5-L7 PolarHBondContact O-N 3.01Å; V5-L7 VanDerWaalsContact O-N 3.08Å; L7-N9 PolarHBondContact O-N 3.33Å; L7-N9 VanDerWaalsContact O-N 3.1Å
8	K	37.4	Very low	36.5	Very low	188 Å²	188	141.4 Å²	141.4	82%	0.817	73%	0.73	S	S	*	*			trans	-64.9	108.2	174.9	-165.4	170.5	-174.7	176.4	0	107	H6 C10	H6-K8 PolarHBondContact O-N 2.86Å; K8-C10 PolarHBondContact O-N 3.05Å
9	N	38.9	Very low	37.4	Very low	162 Å²	162	137 Å²	137	87%	0.866	71%	0.712	S	S	*	*			trans	-52.4	106.4	173.5	-82.6	-26.4	0	0	0	108.6	L7	L7-N9 PolarHBondContact O-N 3.33Å; L7-N9 VanDerWaalsContact O-N 3.1Å
10	C	35.3	Very low	38.1	Very low	73 Å²	73	135.7 Å²	135.7	49%	0.493	71%	0.706	S	S	.	*			trans	-76	127	174.6	-72.6	0	0	0	0	108.5	K8	K8-C10 PolarHBondContact O-N 3.05Å
11	A	47.3	Very low	39.4	Very low	99 Å²	99	136.3 Å²	136.3	82%	0.818	70%	0.703	S	S	*	*	S	Bend	trans	-72.4	-20.4	174.5	0	0	0	0	0	112.2	R13	A11-R13 PolarHBondContact O-N 3.37Å
12	D	44.6	Very low	40.4	Very low	118 Å²	118	129.4 Å²	129.4	63%	0.631	67%	0.673	S	S	*	*			trans	-84.5	100.9	178.7	-68.3	-35.3	0	0	0	110.8	E14 N15 C16	D12-E14 PolarHBondContact O-N 3.06Å; D12-N15 PolarHBondContact O-N 3.02Å; D12-N15 VanDerWaalsContact O-N 3.08Å; D12-C16 PolarHBondContact O-N 2.86Å
13	R	43.2	Very low	41.9	Very low	226 Å²	226	125.9 Å²	125.9	85%	0.853	65%	0.653	S	S	*	*	H	α-helix	trans	-54.8	-25.6	-179.4	-72	-172	174.1	-166.4	-0.7	113.8	A11	A11-R13 PolarHBondContact O-N 3.37Å
14	E	44.6	Very low	43.8	Very low	169 Å²	169	125 Å²	125	79%	0.79	64%	0.639	S	S	*	*	H	α-helix	trans	-74.7	-33.4	179.4	-69.5	-176.6	164.8	0	0	112.9	D12 H18	D12-E14 PolarHBondContact O-N 3.06Å; E14-H18 PolarHBondContact O-ND1 3.48Å
15	N	40.8	Very low	45.6	Very low	105 Å²	105	120.7 Å²	120.7	56%	0.561	63%	0.627	S	S	*	*	H	α-helix	trans	-82.7	-26.3	-179.2	-118.9	-10	0	0	0	112.7	D12 C17 H18 S19	D12-N15 PolarHBondContact O-N 3.02Å; D12-N15 VanDerWaalsContact O-N 3.08Å; N15-C17 VanDerWaalsContact C-N 3.33Å; N15-C17 PolarHBondContact O-N 2.96Å; N15-H18 PolarHBondContact O-N 2.82Å; N15-S19 PolarHBondContact O-N 3.5Å; N15-S19 VanDerWaalsContact O-N 3.09Å
16	C	39.2	Very low	47.1	Very low	48 Å²	48	118 Å²	118	32%	0.324	61%	0.61	S	S	.	*	H	α-helix	trans	-62.7	-36.4	175.1	-91.3	0	0	0	0	113	D12 H18 S19 L20	D12-C16 PolarHBondContact O-N 2.86Å; C16-H18 VanDerWaalsContact C-N 3.34Å; C16-H18 PolarHBondContact O-N 3.05Å; C16-S19 WeakPolarHBondContact O-CB 3.35Å; C16-S19 PolarHBondContact O-N 3.45Å; C16-L20 PolarHBondContact O-N 2.73Å
17	C	38.8	Very low	48.9	Very low	73 Å²	73	112.2 Å²	112.2	49%	0.493	59%	0.587	S	S	.	*	H	α-helix	trans	-66.1	-38.2	179.8	-67.1	0	0	0	0	111.9	N15 K21	N15-C17 VanDerWaalsContact C-N 3.33Å; N15-C17 PolarHBondContact O-N 2.96Å; C17-K21 WeakPolarHBondContact O-CG 3.34Å; C17-K21 PolarHBondContact O-N 3.04Å; C17-K21 VanDerWaalsContact O-N 3.11Å
18	H	43.1	Very low	50.6	Low	116 Å²	116	110.3 Å²	110.3	54%	0.537	58%	0.577	S	S	.	*	H	α-helix	trans	-67.4	-42.3	174.5	-65.3	88.8	0	0	0	110.8	E14 N15 C16 L20 K21 V22	E14-H18 PolarHBondContact O-ND1 3.48Å; N15-H18 PolarHBondContact O-N 2.82Å; C16-H18 VanDerWaalsContact C-N 3.34Å; C16-H18 PolarHBondContact O-N 3.05Å; H18-L20 PolarHBondContact O-N 3.06Å; H18-K21 PolarHBondContact O-N 3.29Å; H18-V22 VanDerWaalsContact O-CG2 3.29Å; H18-V22 WeakPolarHBondContact O-CG2 3.35Å; H18-V22 PolarHBondContact O-N 3.37Å
19	S	53.3	Low	51.9	Low	57 Å²	57	104.9 Å²	104.9	40%	0.399	56%	0.556	S	S	.	*	H	α-helix	trans	-58.6	-45.1	175.7	-172.2	0	0	0	0	112.3	N15 C16 V22 M23	N15-S19 PolarHBondContact O-N 3.5Å; N15-S19 VanDerWaalsContact O-N 3.09Å; C16-S19 WeakPolarHBondContact O-CB 3.35Å; C16-S19 PolarHBondContact O-N 3.45Å; S19-V22 PolarHBondContact O-N 2.96Å; S19-M23 VanDerWaalsContact O-CG 3.32Å; S19-M23 WeakPolarHBondContact O-CG 3.46Å; S19-M23 PolarHBondContact O-N 3.37Å
20	L	52.1	Low	53.2	Low	111 Å²	111	102.6 Å²	102.6	58%	0.581	54%	0.541	S	S	*	.	H	α-helix	trans	-61.5	-45.8	175.6	-80.4	162.4	0	0	0	112	C16 H18 V22 M23 D24	C16-L20 PolarHBondContact O-N 2.73Å; H18-L20 PolarHBondContact O-N 3.06Å; L20-V22 VanDerWaalsContact C-N 3.32Å; L20-V22 PolarHBondContact O-N 2.99Å; L20-M23 PolarHBondContact O-N 3.46Å; L20-D24 VanDerWaalsContact O-CG 3.31Å; L20-D24 PolarHBondContact O-N 3.31Å
21	K	64.2	Low	55	Low	149 Å²	149	105.4 Å²	105.4	65%	0.648	55%	0.545	S	S	*	.	H	α-helix	trans	-61.4	-39.8	176.9	-74.4	-179.6	178.4	-178.4	0	112.6	C17 H18 D24 F25	C17-K21 WeakPolarHBondContact O-CG 3.34Å; C17-K21 PolarHBondContact O-N 3.04Å; C17-K21 VanDerWaalsContact O-N 3.11Å; H18-K21 PolarHBondContact O-N 3.29Å; K21-D24 PolarHBondContact O-N 3.23Å; K21-F25 WeakPolarHBondContact O-CB 3.25Å; K21-F25 PolarHBondContact O-N 3.16Å
22	V	55.5	Low	56.1	Low	87 Å²	87	104 Å²	104	53%	0.527	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-42.4	175.7	173.2	0	0	0	0	110.3	H18 S19 L20 F25 V26	H18-V22 VanDerWaalsContact O-CG2 3.29Å; H18-V22 WeakPolarHBondContact O-CG2 3.35Å; H18-V22 PolarHBondContact O-N 3.37Å; S19-V22 PolarHBondContact O-N 2.96Å; L20-V22 VanDerWaalsContact C-N 3.32Å; L20-V22 PolarHBondContact O-N 2.99Å; V22-F25 WeakPolarHBondContact O-CB 3.44Å; V22-F25 PolarHBondContact O-N 3.4Å; V22-V26 HydrophobicContact CG1-CG2 4.45Å; V22-V26 VanDerWaalsContact O-CG2 3.3Å; V22-V26 WeakPolarHBondContact O-CG2 3.47Å; V22-V26 PolarHBondContact O-N 2.9Å
23	M	60.3	Low	57.1	Low	93 Å²	93	101 Å²	101	46%	0.458	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-40.5	176.7	-72.2	-59	-59.6	0	0	112.5	S19 L20 F25 V26 T27	S19-M23 VanDerWaalsContact O-CG 3.32Å; S19-M23 WeakPolarHBondContact O-CG 3.46Å; S19-M23 PolarHBondContact O-N 3.37Å; L20-M23 PolarHBondContact O-N 3.46Å; M23-F25 VanDerWaalsContact C-N 3.32Å; M23-V26 PolarHBondContact O-N 2.99Å; M23-T27 WeakPolarHBondContact O-CB 3.42Å; M23-T27 PolarHBondContact O-N 3.43Å; M23-T27 PolarHBondContact O-OG1 3.08Å
24	D	67.7	Low	58.3	Low	95 Å²	95	93.7 Å²	93.7	51%	0.508	49%	0.49	S	S	.	.	H	α-helix	trans	-62.7	-41.9	174.7	-71.4	-23.2	0	0	0	111	L20 K21 T27 N28	L20-D24 VanDerWaalsContact O-CG 3.31Å; L20-D24 PolarHBondContact O-N 3.31Å; K21-D24 PolarHBondContact O-N 3.23Å; D24-T27 PolarHBondContact O-N 3.21Å; D24-N28 WeakPolarHBondContact O-CB 3.29Å; D24-N28 VanDerWaalsContact O-CG 3.23Å; D24-N28 PolarHBondContact O-N 3.06Å; D24-N28 PolarHBondContact O-ND2 2.9Å
25	F	63.2	Low	59.5	Low	133 Å²	133	93.1 Å²	93.1	58%	0.583	48%	0.481	S	S	*	.	H	α-helix	trans	-62.4	-48.1	175.8	-176.9	-106.4	0	0	0	112.1	K21 V22 M23 T27 N28 I29	K21-F25 WeakPolarHBondContact O-CB 3.25Å; K21-F25 PolarHBondContact O-N 3.16Å; V22-F25 WeakPolarHBondContact O-CB 3.44Å; V22-F25 PolarHBondContact O-N 3.4Å; M23-F25 VanDerWaalsContact C-N 3.32Å; F25-T27 VanDerWaalsContact C-N 3.32Å; F25-T27 PolarHBondContact O-N 2.96Å; F25-N28 PolarHBondContact O-N 3.29Å; F25-I29 HydrophobicContact CD1-CD1 3.77Å; F25-I29 HydrophobicContact CE1-CD1 3.28Å; F25-I29 HydrophobicContact CE1-CG1 4.33Å; F25-I29 HydrophobicContact CE2-CD1 4.31Å; F25-I29 HydrophobicContact CG-CD1 4.48Å; F25-I29 HydrophobicContact CZ-CD1 3.59Å; F25-I29 HydrophobicContact CZ-CG1 4.34Å; F25-I29 WeakPolarHBondContact O-CG1 3.49Å; F25-I29 PolarHBondContact O-N 3.3Å
26	V	61.9	Low	60.6	Low	72 Å²	72	90.6 Å²	90.6	44%	0.436	47%	0.465	S	S	.	.	H	α-helix	trans	-59.5	-44.1	176.4	171.2	0	0	0	0	110.9	V22 M23 N28 I29 E30	V22-V26 HydrophobicContact CG1-CG2 4.45Å; V22-V26 VanDerWaalsContact O-CG2 3.3Å; V22-V26 WeakPolarHBondContact O-CG2 3.47Å; V22-V26 PolarHBondContact O-N 2.9Å; M23-V26 PolarHBondContact O-N 2.99Å; V26-N28 VanDerWaalsContact C-N 3.34Å; V26-N28 PolarHBondContact O-N 3.4Å; V26-I29 PolarHBondContact O-N 2.85Å; V26-E30 PolarHBondContact O-N 2.65Å
27	T	64.4	Low	61.7	Low	49 Å²	49	91.8 Å²	91.8	30%	0.301	47%	0.467	S	S	.	.	H	α-helix	trans	-63.3	-39.6	178.6	-56.5	0	0	0	0	111.7	M23 D24 F25 E30 K31	M23-T27 WeakPolarHBondContact O-CB 3.42Å; M23-T27 PolarHBondContact O-N 3.43Å; M23-T27 PolarHBondContact O-OG1 3.08Å; D24-T27 PolarHBondContact O-N 3.21Å; F25-T27 VanDerWaalsContact C-N 3.32Å; F25-T27 PolarHBondContact O-N 2.96Å; T27-E30 PolarHBondContact O-N 3.15Å; T27-K31 HydrophobicContact CG2-CD 4.42Å; T27-K31 WeakPolarHBondContact O-CG 3.48Å; T27-K31 PolarHBondContact O-N 2.75Å
28	N	66.3	Low	63.1	Low	93 Å²	93	94.2 Å²	94.2	50%	0.497	48%	0.479	S	S	.	.	H	α-helix	trans	-68.5	-38	177.2	-74.7	-22.1	0	0	0	112.3	D24 F25 V26 S32	D24-N28 WeakPolarHBondContact O-CB 3.29Å; D24-N28 VanDerWaalsContact O-CG 3.23Å; D24-N28 PolarHBondContact O-N 3.06Å; D24-N28 PolarHBondContact O-ND2 2.9Å; F25-N28 PolarHBondContact O-N 3.29Å; V26-N28 VanDerWaalsContact C-N 3.34Å; V26-N28 PolarHBondContact O-N 3.4Å; N28-S32 WeakPolarHBondContact O-CB 3.32Å; N28-S32 PolarHBondContact O-N 2.92Å; N28-S32 PolarHBondContact O-OG 3.09Å
29	I	66	Low	64	Low	74 Å²	74	93.7 Å²	93.7	38%	0.379	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-49.4	172	-70.8	173.1	0	0	0	109.8	F25 V26 K31 S32 L33	F25-I29 HydrophobicContact CD1-CD1 3.77Å; F25-I29 HydrophobicContact CE1-CD1 3.28Å; F25-I29 HydrophobicContact CE1-CG1 4.33Å; F25-I29 HydrophobicContact CE2-CD1 4.31Å; F25-I29 HydrophobicContact CG-CD1 4.48Å; F25-I29 HydrophobicContact CZ-CD1 3.59Å; F25-I29 HydrophobicContact CZ-CG1 4.34Å; F25-I29 WeakPolarHBondContact O-CG1 3.49Å; F25-I29 PolarHBondContact O-N 3.3Å; V26-I29 PolarHBondContact O-N 2.85Å; I29-K31 PolarHBondContact O-N 3.42Å; I29-S32 WeakPolarHBondContact O-CB 3.3Å; I29-S32 PolarHBondContact O-N 3.05Å; I29-S32 VanDerWaalsContact O-N 3.13Å; I29-L33 HydrophobicContact CG2-CD1 3.77Å; I29-L33 HydrophobicContact CG2-CG 4.13Å; I29-L33 WeakPolarHBondContact O-CG 3.48Å; I29-L33 PolarHBondContact O-N 2.91Å
30	E	66.1	Low	64.7	Low	115 Å²	115	95 Å²	95	54%	0.537	48%	0.482	S	S	.	.	H	α-helix	trans	-58.9	-46.6	-179.1	-173.8	-179.6	178.7	0	0	112	V26 T27 S32 L33 N34	V26-E30 PolarHBondContact O-N 2.65Å; T27-E30 PolarHBondContact O-N 3.15Å; E30-S32 VanDerWaalsContact C-N 3.31Å; E30-S32 PolarHBondContact O-N 3.28Å; E30-L33 PolarHBondContact O-N 3.25Å; E30-N34 WeakPolarHBondContact O-CB 3.37Å; E30-N34 PolarHBondContact O-N 3.35Å; E30-N34 PolarHBondContact O-ND2 3.16Å
31	K	71.8	Confident	64.9	Low	132 Å²	132	90.8 Å²	90.8	57%	0.574	47%	0.466	S	S	*	.	H	α-helix	trans	-59.3	-41.9	175.4	-74.8	176.2	-179.1	174.6	0	112.2	T27 I29 N34 R35	T27-K31 HydrophobicContact CG2-CD 4.42Å; T27-K31 WeakPolarHBondContact O-CG 3.48Å; T27-K31 PolarHBondContact O-N 2.75Å; I29-K31 PolarHBondContact O-N 3.42Å; K31-N34 PolarHBondContact O-N 3.44Å; K31-R35 WeakPolarHBondContact O-CB 3.41Å; K31-R35 PolarHBondContact O-N 3.42Å
32	S	70.3	Confident	64.8	Low	68 Å²	68	88.2 Å²	88.2	48%	0.476	47%	0.465	S	S	.	.	H	α-helix	trans	-66	-45.1	178.9	-57.9	0	0	0	0	111.2	N28 I29 E30 N34 R35 E36	N28-S32 WeakPolarHBondContact O-CB 3.32Å; N28-S32 PolarHBondContact O-N 2.92Å; N28-S32 PolarHBondContact O-OG 3.09Å; I29-S32 WeakPolarHBondContact O-CB 3.3Å; I29-S32 PolarHBondContact O-N 3.05Å; I29-S32 VanDerWaalsContact O-N 3.13Å; E30-S32 VanDerWaalsContact C-N 3.31Å; E30-S32 PolarHBondContact O-N 3.28Å; S32-N34 PolarHBondContact O-N 3.48Å; S32-R35 PolarHBondContact O-N 2.93Å; S32-E36 WeakPolarHBondContact O-CG 3.5Å; S32-E36 PolarHBondContact O-N 2.69Å
33	L	67	Low	64.8	Low	55 Å²	55	90.9 Å²	90.9	29%	0.288	48%	0.476	S	S	.	.	H	α-helix	trans	-63.8	-40.8	177	-67.3	178.2	0	0	0	112.1	I29 E30 E36 M37 L45 L48	I29-L33 HydrophobicContact CG2-CD1 3.77Å; I29-L33 HydrophobicContact CG2-CG 4.13Å; I29-L33 WeakPolarHBondContact O-CG 3.48Å; I29-L33 PolarHBondContact O-N 2.91Å; E30-L33 PolarHBondContact O-N 3.25Å; L33-E36 PolarHBondContact O-N 2.7Å; L33-M37 VanDerWaalsContact O-CB 3.29Å; L33-M37 WeakPolarHBondContact O-CB 3.29Å; L33-M37 PolarHBondContact O-N 3.23Å; L33-L45 HydrophobicContact CB-CD2 4.45Å; L33-L45 HydrophobicContact CD2-CD2 3.87Å; L33-L48 HydrophobicContact CD2-CD2 3.54Å
34	N	67.7	Low	64.7	Low	73 Å²	73	90.9 Å²	90.9	39%	0.39	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-42.6	175.5	-77.3	-29.8	0	0	0	111.6	E30 K31 S32 M37 V38	E30-N34 WeakPolarHBondContact O-CB 3.37Å; E30-N34 PolarHBondContact O-N 3.35Å; E30-N34 PolarHBondContact O-ND2 3.16Å; K31-N34 PolarHBondContact O-N 3.44Å; S32-N34 PolarHBondContact O-N 3.48Å; N34-M37 PolarHBondContact O-N 3.37Å; N34-V38 VanDerWaalsContact O-CG2 3.3Å; N34-V38 WeakPolarHBondContact O-CG2 3.06Å; N34-V38 PolarHBondContact O-N 3.11Å
35	R	70.8	Confident	63.9	Low	158 Å²	158	87.6 Å²	87.6	60%	0.596	46%	0.456	S	S	*	.	H	α-helix	trans	-59.5	-47.2	174.1	-179.2	-177.7	176.8	-87.6	2.8	111.5	K31 S32 V38 L39	K31-R35 WeakPolarHBondContact O-CB 3.41Å; K31-R35 PolarHBondContact O-N 3.42Å; S32-R35 PolarHBondContact O-N 2.93Å; R35-V38 PolarHBondContact O-N 3.13Å; R35-L39 HydrophobicContact CG-CD1 4.03Å; R35-L39 WeakPolarHBondContact O-CG 3.46Å; R35-L39 PolarHBondContact O-N 2.93Å
36	E	63.7	Low	63.3	Low	51 Å²	51	84.3 Å²	84.3	24%	0.238	45%	0.453	C	S	.	.	H	α-helix	trans	-68.5	-33.6	179.3	-67.3	-51.6	125.2	0	0	112.6	S32 L33 V38 L39 N40 F44	S32-E36 WeakPolarHBondContact O-CG 3.5Å; S32-E36 PolarHBondContact O-N 2.69Å; L33-E36 PolarHBondContact O-N 2.7Å; E36-V38 VanDerWaalsContact C-N 3.34Å; E36-L39 PolarHBondContact O-N 2.82Å; E36-N40 WeakPolarHBondContact O-CB 3.35Å; E36-N40 PolarHBondContact O-N 3.19Å; E36-N40 PolarHBondContact O-ND2 2.97Å; E36-N40 PolarHBondContact OE2-ND2 3.3Å; E36-F44 HydrophobicContact CB-CD1 4.03Å; E36-F44 HydrophobicContact CB-CE1 3.84Å; E36-F44 HydrophobicContact CG-CE1 4.21Å
37	M	62.3	Low	62.4	Low	73 Å²	73	81.9 Å²	81.9	36%	0.36	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-39.5	173.3	-176	176	61.9	0	0	111.8	L33 N34 G41 L45	L33-M37 VanDerWaalsContact O-CB 3.29Å; L33-M37 WeakPolarHBondContact O-CB 3.29Å; L33-M37 PolarHBondContact O-N 3.23Å; N34-M37 PolarHBondContact O-N 3.37Å; M37-G41 CarbonylContact O-C 3.57Å; M37-G41 WeakPolarHBondContact O-CA 3.38Å; M37-G41 PolarHBondContact O-N 3.48Å; M37-L45 HydrophobicContact CB-CD1 3.99Å; M37-L45 HydrophobicContact CB-CG 4.47Å; M37-L45 HydrophobicContact CG-CD1 4.13Å; M37-L45 HydrophobicContact SD-CD1 4.02Å
38	V	66.9	Low	61.4	Low	124 Å²	124	83.1 Å²	83.1	75%	0.752	45%	0.447	S	S	*	.	H	α-helix	trans	-67.4	-40.1	176.1	171	0	0	0	0	111.1	N34 R35 E36	N34-V38 VanDerWaalsContact O-CG2 3.3Å; N34-V38 WeakPolarHBondContact O-CG2 3.06Å; N34-V38 PolarHBondContact O-N 3.11Å; R35-V38 PolarHBondContact O-N 3.13Å; E36-V38 VanDerWaalsContact C-N 3.34Å
39	L	61.6	Low	60.2	Low	106 Å²	106	86.6 Å²	86.6	56%	0.555	46%	0.458	S	S	*	.	H	α-helix	trans	-77.6	-44.6	-177.2	-69.1	172	0	0	0	113.4	R35 E36	R35-L39 HydrophobicContact CG-CD1 4.03Å; R35-L39 WeakPolarHBondContact O-CG 3.46Å; R35-L39 PolarHBondContact O-N 2.93Å; E36-L39 PolarHBondContact O-N 2.82Å
40	N	68.1	Low	58.8	Low	83 Å²	83	92.7 Å²	92.7	44%	0.444	48%	0.476	S	S	.	.	H	α-helix	trans	-108.8	-5.3	-170	-56.2	-56.9	0	0	0	113.6	E36 F44	E36-N40 WeakPolarHBondContact O-CB 3.35Å; E36-N40 PolarHBondContact O-N 3.19Å; E36-N40 PolarHBondContact O-ND2 2.97Å; E36-N40 PolarHBondContact OE2-ND2 3.3Å; N40-F44 HydrophobicContact CB-CB 3.55Å; N40-F44 HydrophobicContact CB-CD1 4.33Å; N40-F44 HydrophobicContact CB-CD2 3.91Å; N40-F44 HydrophobicContact CB-CG 3.68Å
41	G	56.7	Low	57.2	Low	23 Å²	23	91 Å²	91	24%	0.237	47%	0.47	C	S	.	.			trans	77.9	171.9	-177.2	0	0	0	0	0	114.1	M37 N43 F44	M37-G41 CarbonylContact O-C 3.57Å; M37-G41 WeakPolarHBondContact O-CA 3.38Å; M37-G41 PolarHBondContact O-N 3.48Å; G41-N43 PolarHBondContact O-N 2.85Å; G41-N43 VanDerWaalsContact O-N 3.17Å; G41-F44 WeakPolarHBondContact O-CB 3.5Å; G41-F44 PolarHBondContact O-N 3.17Å; G41-F44 VanDerWaalsContact O-N 3.16Å
42	P	61.9	Low	55.2	Low	96 Å²	96	89.8 Å²	89.8	62%	0.623	47%	0.474	S	S	*	.	H	α-helix	trans	-63.9	-24.8	-173.4	24.6	-34.3	0	0	0	113.8	F44 L45	P42-F44 PolarHBondContact O-N 2.91Å; P42-L45 PolarHBondContact O-N 3.4Å
43	N	56.9	Low	53.4	Low	142 Å²	142	91.1 Å²	91.1	76%	0.759	48%	0.481	S	S	*	.	H	α-helix	trans	-67.6	-22.7	179.3	-66.7	-27.4	0	0	0	113.1	G41 A46	G41-N43 PolarHBondContact O-N 2.85Å; G41-N43 VanDerWaalsContact O-N 3.17Å; N43-A46 PolarHBondContact O-N 2.95Å
44	F	57	Low	51.4	Low	93 Å²	93	99.4 Å²	99.4	41%	0.408	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-41.8	176.1	-177.8	-102.2	0	0	0	111.4	E36 N40 G41 P42 A46 G47	E36-F44 HydrophobicContact CB-CD1 4.03Å; E36-F44 HydrophobicContact CB-CE1 3.84Å; E36-F44 HydrophobicContact CG-CE1 4.21Å; N40-F44 HydrophobicContact CB-CB 3.55Å; N40-F44 HydrophobicContact CB-CD1 4.33Å; N40-F44 HydrophobicContact CB-CD2 3.91Å; N40-F44 HydrophobicContact CB-CG 3.68Å; G41-F44 WeakPolarHBondContact O-CB 3.5Å; G41-F44 PolarHBondContact O-N 3.17Å; G41-F44 VanDerWaalsContact O-N 3.16Å; P42-F44 PolarHBondContact O-N 2.91Å; F44-A46 VanDerWaalsContact C-N 3.29Å; F44-A46 PolarHBondContact O-N 3.1Å; F44-G47 PolarHBondContact O-N 2.95Å
45	L	50.3	Low	49.7	Very low	27 Å²	27	103.1 Å²	103.1	14%	0.141	53%	0.526	C	S	.	.	H	α-helix	trans	-69.7	-26.1	-179.5	-63.2	-175.3	0	0	0	113	L33 M37 P42 G47 L48 F49	L33-L45 HydrophobicContact CB-CD2 4.45Å; L33-L45 HydrophobicContact CD2-CD2 3.87Å; M37-L45 HydrophobicContact CB-CD1 3.99Å; M37-L45 HydrophobicContact CB-CG 4.47Å; M37-L45 HydrophobicContact CG-CD1 4.13Å; M37-L45 HydrophobicContact SD-CD1 4.02Å; P42-L45 PolarHBondContact O-N 3.4Å; L45-G47 PolarHBondContact O-N 2.68Å; L45-L48 WeakPolarHBondContact O-CA 3.4Å; L45-L48 WeakPolarHBondContact O-CB 3.33Å; L45-L48 PolarHBondContact O-N 2.99Å; L45-F49 HydrophobicContact CB-CE2 4.48Å; L45-F49 VanDerWaalsContact O-CD2 3.27Å; L45-F49 WeakPolarHBondContact O-CD2 3.38Å; L45-F49 PolarHBondContact O-N 3.31Å
46	A	52.4	Low	47.7	Very low	63 Å²	63	102.3 Å²	102.3	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-59.5	-29.4	174.9	0	0	0	0	0	112.4	N43 F44	N43-A46 PolarHBondContact O-N 2.95Å; F44-A46 VanDerWaalsContact C-N 3.29Å; F44-A46 PolarHBondContact O-N 3.1Å
47	G	41.6	Very low	46.1	Very low	21 Å²	21	104.1 Å²	104.1	22%	0.216	55%	0.548	C	S	.	.	H	α-helix	trans	-67.1	-38.5	171.4	0	0	0	0	0	112.3	F44 L45 R50 I51	F44-G47 PolarHBondContact O-N 2.95Å; L45-G47 PolarHBondContact O-N 2.68Å; G47-R50 PolarHBondContact O-N 2.88Å; G47-I51 WeakPolarHBondContact O-CG1 3.25Å
48	L	44	Very low	44.6	Very low	76 Å²	76	109 Å²	109	40%	0.398	57%	0.567	S	S	.	*	H	α-helix	trans	-67.3	-40	-177.1	-134	91.4	0	0	0	112.9	L33 L45 R50 I51	L33-L48 HydrophobicContact CD2-CD2 3.54Å; L45-L48 WeakPolarHBondContact O-CA 3.4Å; L45-L48 WeakPolarHBondContact O-CB 3.33Å; L45-L48 PolarHBondContact O-N 2.99Å; L48-R50 PolarHBondContact O-N 3Å; L48-I51 HydrophobicContact CD1-CD1 4.3Å; L48-I51 HydrophobicContact CG-CD1 4.37Å; L48-I51 WeakPolarHBondContact O-CB 3.34Å; L48-I51 WeakPolarHBondContact O-CG1 3.47Å; L48-I51 PolarHBondContact O-N 3.32Å
49	F	40.9	Very low	42.9	Very low	166 Å²	166	110.3 Å²	110.3	73%	0.728	57%	0.569	S	S	*	*	H	α-helix	trans	-63.8	-20.9	179.8	-76.7	-75.6	0	0	0	113.4	L45 I51 T52	L45-F49 HydrophobicContact CB-CE2 4.48Å; L45-F49 VanDerWaalsContact O-CD2 3.27Å; L45-F49 WeakPolarHBondContact O-CD2 3.38Å; L45-F49 PolarHBondContact O-N 3.31Å; F49-I51 VanDerWaalsContact C-N 3.35Å; F49-T52 PolarHBondContact O-OG1 3.23Å; F49-T52 VanDerWaalsContact O-OG1 3.12Å
50	R	35.9	Very low	41.5	Very low	202 Å²	202	109.7 Å²	109.7	76%	0.762	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-16.1	171.7	-81.1	-167.2	175.6	-152.9	0.3	113.7	G47 L48 T52	G47-R50 PolarHBondContact O-N 2.88Å; L48-R50 PolarHBondContact O-N 3Å; R50-T52 PolarHBondContact O-N 3.28Å
51	I	33.5	Very low	39.8	Very low	80 Å²	80	112.9 Å²	112.9	41%	0.41	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.5	15.2	179.7	-30.5	174	0	0	0	111.4	G47 L48 F49 P53 I200	G47-I51 WeakPolarHBondContact O-CG1 3.25Å; L48-I51 HydrophobicContact CD1-CD1 4.3Å; L48-I51 HydrophobicContact CG-CD1 4.37Å; L48-I51 WeakPolarHBondContact O-CB 3.34Å; L48-I51 WeakPolarHBondContact O-CG1 3.47Å; L48-I51 PolarHBondContact O-N 3.32Å; F49-I51 VanDerWaalsContact C-N 3.35Å; I51-P53 WeakPolarHBondContact O-CD 3.32Å; I51-I200 HydrophobicContact CD1-CD1 4.45Å; I51-I200 HydrophobicContact CG2-CD1 4.48Å
52	T	29.6	Very low	38.5	Very low	106 Å²	106	117 Å²	117	65%	0.65	62%	0.617	S	S	*	*			trans	-54.1	110.6	164.9	-46	0	0	0	0	106.4	F49 R50 R54	F49-T52 PolarHBondContact O-OG1 3.23Å; F49-T52 VanDerWaalsContact O-OG1 3.12Å; R50-T52 PolarHBondContact O-N 3.28Å; T52-R54 PolarHBondContact O-N 2.98Å
53	P	32.1	Very low	37	Very low	96 Å²	96	117.9 Å²	117.9	62%	0.623	62%	0.616	S	S	*	*			trans	-57.9	119.6	179.4	21.6	-28.9	0	0	0	104.9	I51 I55	I51-P53 WeakPolarHBondContact O-CD 3.32Å; P53-I55 PolarHBondContact O-N 2.92Å
54	R	26.5	Very low	35.9	Very low	229 Å²	229	119.9 Å²	119.9	86%	0.864	62%	0.618	S	S	*	*			trans	-57.6	93.3	157	-93	-177.9	172.1	174.1	-2.7	103.2	T52 Q56	T52-R54 PolarHBondContact O-N 2.98Å; R54-Q56 PolarHBondContact O-N 3.42Å
55	I	30.7	Very low	34.7	Very low	150 Å²	150	126.6 Å²	126.6	77%	0.769	64%	0.641	S	S	*	*			trans	-60.7	87	158.5	-59	171.5	0	0	0	101.5	P53 S57	P53-I55 PolarHBondContact O-N 2.92Å; I55-S57 PolarHBondContact O-N 3.44Å
56	Q	29.5	Very low	34.1	Very low	141 Å²	141	130.8 Å²	130.8	66%	0.659	67%	0.67	S	S	*	*			trans	-59	106.6	164.2	-72.8	-170.9	5.9	0	0	102.1	R54 K58	R54-Q56 PolarHBondContact O-N 3.42Å; Q56-K58 PolarHBondContact O-N 3.4Å
57	S	30.3	Very low	33.3	Very low	90 Å²	90	137.5 Å²	137.5	63%	0.629	69%	0.687	S	S	*	*			trans	-59.6	86	165.1	49.5	0	0	0	0	105.5	I55 I59	I55-S57 PolarHBondContact O-N 3.44Å; S57-I59 PolarHBondContact O-N 2.9Å
58	K	31.1	Very low	32.7	Very low	175 Å²	175	143.9 Å²	143.9	76%	0.761	72%	0.716	S	S	*	*			trans	-69.9	65.4	159.5	-74.1	-170.9	177.9	-177.4	0	106.5	Q56 S60	Q56-K58 PolarHBondContact O-N 3.4Å; K58-S60 PolarHBondContact O-N 2.9Å; K58-S60 VanDerWaalsContact O-N 3.16Å
59	I	30.6	Very low	32.3	Very low	152 Å²	152	145.5 Å²	145.5	78%	0.779	73%	0.731	S	S	*	*			trans	-77.7	77.5	153.1	-60	164.7	0	0	0	103.6	S57	S57-I59 PolarHBondContact O-N 2.9Å
60	S	32	Very low	31.9	Very low	92 Å²	92	144.3 Å²	144.3	64%	0.643	74%	0.737	S	S	*	*			trans	-167.2	134.6	156.6	47.5	0	0	0	0	108.6	K58	K58-S60 PolarHBondContact O-N 2.9Å; K58-S60 VanDerWaalsContact O-N 3.16Å
61	Q	31.9	Very low	31.8	Very low	151 Å²	151	139 Å²	139	71%	0.706	73%	0.731	S	S	*	*			trans	73.6	75.2	175.8	-50.1	-73.4	22	0	0	114.5	D63	Q61-D63 HydrophobicContact CB-CB 4.41Å; Q61-D63 PolarHBondContact O-N 3.4Å
62	A	29.1	Very low	31.3	Very low	109 Å²	109	140.8 Å²	140.8	90%	0.901	75%	0.749	S	S	*	*			trans	-61.6	64.3	142.2	0	0	0	0	0	109.4	K64	A62-K64 VanDerWaalsContact C-N 3.34Å; A62-K64 PolarHBondContact O-N 2.73Å
63	D	32.3	Very low	31.4	Very low	114 Å²	114	143.3 Å²	143.3	61%	0.61	75%	0.753	S	S	*	*			trans	-79.2	92.7	170.8	-95.1	-40.2	0	0	0	107.7	Q61 R65	Q61-D63 HydrophobicContact CB-CB 4.41Å; Q61-D63 PolarHBondContact O-N 3.4Å; D63-R65 PolarHBondContact O-N 3.08Å
64	K	33.8	Very low	31.3	Very low	184 Å²	184	144 Å²	144	80%	0.8	76%	0.758	S	S	*	*			trans	34.8	83.6	148.8	-63.2	175.3	-177.7	172.6	0	114.3	A62 P66	A62-K64 VanDerWaalsContact C-N 3.34Å; A62-K64 PolarHBondContact O-N 2.73Å; K64-P66 WeakPolarHBondContact O-CD 3.48Å
65	R	31.2	Very low	31.4	Very low	234 Å²	234	139.5 Å²	139.5	88%	0.883	75%	0.75	S	S	*	*			trans	-44.5	123	160.1	-87.5	-175.3	179	162.9	-0.3	109.3	D63 K67	D63-R65 PolarHBondContact O-N 3.08Å; R65-K67 PolarHBondContact O-N 2.94Å
66	P	37	Very low	31.4	Very low	115 Å²	115	141.4 Å²	141.4	75%	0.747	76%	0.755	S	S	*	*			trans	-58.7	128.6	155	-14.3	28.4	0	0	0	106.8	K64 L68	K64-P66 WeakPolarHBondContact O-CD 3.48Å; P66-L68 PolarHBondContact O-N 3.39Å
67	K	36	Very low	31.4	Very low	205 Å²	205	142.3 Å²	142.3	89%	0.891	76%	0.759	S	S	*	*			trans	-55.1	104	167.7	-83	172.7	175.8	173	0	107	R65	R65-K67 PolarHBondContact O-N 2.94Å
68	L	30	Very low	31.3	Very low	155 Å²	155	143.2 Å²	143.2	81%	0.812	77%	0.765	S	S	*	*			trans	-65.2	125.3	172.7	-155.5	74.3	0	0	0	106.5	P66 T70	P66-L68 PolarHBondContact O-N 3.39Å; L68-T70 PolarHBondContact O-N 3.33Å; L68-T70 VanDerWaalsContact O-N 3.12Å
69	P	33.7	Very low	31.2	Very low	110 Å²	110	144.4 Å²	144.4	71%	0.714	77%	0.771	S	S	*	*			trans	-61.6	119.7	-179.9	21.4	-29.5	0	0	0	109.1	S71	P69-S71 PolarHBondContact O-N 2.93Å
70	T	34.4	Very low	31	Very low	141 Å²	141	141.8 Å²	141.8	87%	0.865	77%	0.766	S	S	*	*			trans	-61.2	82.9	172	-43.1	0	0	0	0	109.2	L68	L68-T70 PolarHBondContact O-N 3.33Å; L68-T70 VanDerWaalsContact O-N 3.12Å
71	S	32.5	Very low	30.6	Very low	90 Å²	90	147.9 Å²	147.9	63%	0.629	78%	0.775	S	S	*	*			trans	-122.3	79.4	165.6	-166.2	0	0	0	0	107.6	P69 Q73	P69-S71 PolarHBondContact O-N 2.93Å; S71-Q73 VanDerWaalsContact C-N 3.27Å; S71-Q73 PolarHBondContact O-N 3.12Å
72	C	23.9	Very low	30.2	Very low	117 Å²	117	146 Å²	146	79%	0.791	77%	0.774	S	S	*	*			trans	-66.1	91.1	164.3	-64.4	0	0	0	0	107.5	P74	C72-P74 WeakPolarHBondContact O-CD 3.4Å
73	Q	30.1	Very low	30	Very low	159 Å²	159	146.5 Å²	146.5	74%	0.743	76%	0.761	S	S	*	*			trans	-79.7	115.6	161.6	-76.6	-101.3	-25	0	0	106.8	S71 I75	S71-Q73 VanDerWaalsContact C-N 3.27Å; S71-Q73 PolarHBondContact O-N 3.12Å; Q73-I75 PolarHBondContact O-N 2.9Å
74	P	30.6	Very low	29.5	Very low	112 Å²	112	148.5 Å²	148.5	73%	0.727	77%	0.771	S	S	*	*			trans	-61.6	113.7	174.1	23.2	-29.7	0	0	0	108.3	C72 Q76	C72-P74 WeakPolarHBondContact O-CD 3.4Å; P74-Q76 PolarHBondContact O-N 2.85Å
75	I	29.7	Very low	29	Very low	133 Å²	133	148.8 Å²	148.8	68%	0.682	77%	0.772	S	S	*	*			trans	-59.7	111.5	173.1	-63.5	170.5	0	0	0	106.4	Q73 H77	Q73-I75 PolarHBondContact O-N 2.9Å; I75-H77 VanDerWaalsContact C-N 3.3Å; I75-H77 PolarHBondContact O-CD2 3.32Å; I75-H77 PolarHBondContact O-N 2.76Å
76	Q	30.2	Very low	28.7	Very low	191 Å²	191	142 Å²	142	89%	0.893	76%	0.761	S	S	*	*			trans	-64.4	95.6	171.3	-76.2	-170.5	-14.3	0	0	107.8	P74 S78	P74-Q76 PolarHBondContact O-N 2.85Å; Q76-S78 PolarHBondContact O-N 3.39Å
77	H	29.5	Very low	28.1	Very low	160 Å²	160	147.3 Å²	147.3	74%	0.741	77%	0.766	S	S	*	*			trans	-66.4	100.7	171.3	-66.4	-74.1	0	0	0	108.4	I75 K79	I75-H77 VanDerWaalsContact C-N 3.3Å; I75-H77 PolarHBondContact O-CD2 3.32Å; I75-H77 PolarHBondContact O-N 2.76Å; H77-K79 PolarHBondContact O-N 3.13Å
78	S	28.6	Very low	27.6	Very low	108 Å²	108	144 Å²	144	76%	0.755	76%	0.757	S	S	*	*			trans	-59.3	111.6	159.6	59.6	0	0	0	0	106.7	Q76 S80	Q76-S78 PolarHBondContact O-N 3.39Å; S78-S80 PolarHBondContact O-N 2.89Å
79	K	27.9	Very low	27.6	Very low	200 Å²	200	143.9 Å²	143.9	87%	0.87	76%	0.756	S	S	*	*			trans	-62.4	81.4	173.3	-73.9	173	177.4	171.8	0	108.9	H77 R81	H77-K79 PolarHBondContact O-N 3.13Å; K79-R81 VanDerWaalsContact C-N 3.32Å; K79-R81 PolarHBondContact O-N 3.03Å
80	S	26.2	Very low	27.2	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	76%	0.757	S	S	*	*			trans	-71.4	95.8	165.6	-175.9	0	0	0	0	106.6	S78 V82	S78-S80 PolarHBondContact O-N 2.89Å; S80-V82 VanDerWaalsContact C-N 3.29Å; S80-V82 PolarHBondContact O-N 3.41Å
81	R	25.1	Very low	26.8	Very low	219 Å²	219	144.1 Å²	144.1	83%	0.826	75%	0.754	S	S	*	*			trans	-66.7	93.3	169.3	-81.1	-178.6	165.2	-176.3	-4.5	107.3	K79 N83	K79-R81 VanDerWaalsContact C-N 3.32Å; K79-R81 PolarHBondContact O-N 3.03Å; R81-N83 VanDerWaalsContact C-N 3.35Å; R81-N83 PolarHBondContact O-N 3.32Å
82	V	23.8	Very low	26.6	Very low	113 Å²	113	144.8 Å²	144.8	69%	0.685	76%	0.759	S	S	*	*			trans	-70.2	98.6	163.6	-176.2	0	0	0	0	106.3	S80 L84	S80-V82 VanDerWaalsContact C-N 3.29Å; S80-V82 PolarHBondContact O-N 3.41Å; V82-L84 VanDerWaalsContact C-N 3.33Å; V82-L84 HydrophobicContact CG1-CG 4.44Å; V82-L84 PolarHBondContact O-N 2.99Å
83	N	23.8	Very low	26.9	Very low	118 Å²	118	146.7 Å²	146.7	63%	0.631	76%	0.761	S	S	*	*			trans	-69.8	92.9	170.2	-78	-24.5	0	0	0	107.9	R81 F85	R81-N83 VanDerWaalsContact C-N 3.35Å; R81-N83 PolarHBondContact O-N 3.32Å; N83-F85 HydrophobicContact CB-CD2 4.36Å; N83-F85 HydrophobicContact CB-CE2 4.04Å; N83-F85 WeakPolarHBondContact O-CD2 3.37Å; N83-F85 PolarHBondContact O-N 3.41Å
84	L	22.9	Very low	26.9	Very low	156 Å²	156	144.9 Å²	144.9	82%	0.817	77%	0.765	S	S	*	*			trans	-69.4	96.8	164.1	-77	161.8	0	0	0	107.4	V82 S86	V82-L84 VanDerWaalsContact C-N 3.33Å; V82-L84 HydrophobicContact CG1-CG 4.44Å; V82-L84 PolarHBondContact O-N 2.99Å; L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 2.94Å
85	F	22.9	Very low	26.9	Very low	190 Å²	190	147.3 Å²	147.3	83%	0.833	77%	0.771	S	S	*	*			trans	-67.7	87.9	168.5	-73.1	-86.8	0	0	0	108.7	N83 R87	N83-F85 HydrophobicContact CB-CD2 4.36Å; N83-F85 HydrophobicContact CB-CE2 4.04Å; N83-F85 WeakPolarHBondContact O-CD2 3.37Å; N83-F85 PolarHBondContact O-N 3.41Å; F85-R87 PolarHBondContact O-N 2.88Å
86	S	25	Very low	26.8	Very low	92 Å²	92	147.1 Å²	147.1	64%	0.643	78%	0.778	S	S	*	*			trans	-71	107	158	43.7	0	0	0	0	106.9	L84 I88	L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 2.94Å; S86-I88 PolarHBondContact O-N 3.23Å
87	R	23.8	Very low	26.7	Very low	226 Å²	226	142.3 Å²	142.3	85%	0.853	77%	0.766	S	S	*	*			trans	-66.6	87.2	167.9	-175.1	-177.5	-106	178.8	-5.7	107	F85 L89	F85-R87 PolarHBondContact O-N 2.88Å; R87-L89 VanDerWaalsContact C-N 3.3Å; R87-L89 PolarHBondContact O-N 3.36Å
88	I	24.9	Very low	26.6	Very low	136 Å²	136	143.9 Å²	143.9	70%	0.697	77%	0.773	S	S	*	*			trans	-68.1	95.9	166.5	-57.5	171.8	0	0	0	104.9	S86 S90	S86-I88 PolarHBondContact O-N 3.23Å; I88-S90 PolarHBondContact O-N 3.29Å
89	L	29.5	Very low	26.4	Very low	152 Å²	152	146.3 Å²	146.3	80%	0.796	77%	0.773	S	S	*	*			trans	-61.7	116	164.9	-89.7	149.3	0	0	0	106.5	R87	R87-L89 VanDerWaalsContact C-N 3.3Å; R87-L89 PolarHBondContact O-N 3.36Å
90	S	25.9	Very low	26.3	Very low	105 Å²	105	142 Å²	142	73%	0.734	77%	0.768	S	S	*	*			trans	-54.5	142.2	-173.6	-54	0	0	0	0	112.7	I88 S92	I88-S90 PolarHBondContact O-N 3.29Å; S90-S92 PolarHBondContact O-N 2.92Å
91	D	27.2	Very low	26.3	Very low	151 Å²	151	145 Å²	145	81%	0.807	78%	0.775	S	S	*	*			trans	-45.9	100.4	170.8	-63.7	-51.4	0	0	0	112.1
92	S	28.3	Very low	26.1	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	78%	0.777	S	S	*	*			trans	-99.7	102.9	156.8	66.3	0	0	0	0	108	S90 C94	S90-S92 PolarHBondContact O-N 2.92Å; S92-C94 VanDerWaalsContact C-N 3.32Å; S92-C94 PolarHBondContact O-N 3.18Å
93	N	29.4	Very low	26.3	Very low	158 Å²	158	146 Å²	146	85%	0.845	79%	0.787	S	S	*	*			trans	-57.7	90.1	166.4	-65.3	-56.3	0	0	0	109.8
94	C	29.4	Very low	26.4	Very low	120 Å²	120	145.5 Å²	145.5	81%	0.811	79%	0.792	S	S	*	*			trans	-143.2	126	169.1	-103.7	0	0	0	0	109.8	S92	S92-C94 VanDerWaalsContact C-N 3.32Å; S92-C94 PolarHBondContact O-N 3.18Å
95	L	30.3	Very low	26.5	Very low	163 Å²	163	143.6 Å²	143.6	85%	0.853	79%	0.792	S	S	*	*			trans	-46.3	153.1	-177.6	-73.8	150.6	0	0	0	113.4	S97	L95-S97 VanDerWaalsContact C-N 3.31Å; L95-S97 PolarHBondContact O-N 2.88Å
96	P	29.1	Very low	26.6	Very low	130 Å²	130	141.8 Å²	141.8	84%	0.844	79%	0.789	S	S	*	*			trans	-71.6	85.2	-177.1	31.8	-33.8	0	0	0	110
97	S	28	Very low	26.6	Very low	90 Å²	90	146 Å²	146	63%	0.629	80%	0.799	S	S	*	*			trans	-79.5	120.9	163.9	-179.8	0	0	0	0	107.7	L95 E99	L95-S97 VanDerWaalsContact C-N 3.31Å; L95-S97 PolarHBondContact O-N 2.88Å; S97-E99 PolarHBondContact O-N 3.42Å
98	Q	26.2	Very low	26.7	Very low	192 Å²	192	141.2 Å²	141.2	90%	0.897	80%	0.795	S	S	*	*			trans	-63.9	81.4	170.1	-77.1	-171.6	-38.4	0	0	109.8	S100	Q98-S100 PolarHBondContact O-N 3.15Å
99	E	25.8	Very low	26.6	Very low	160 Å²	160	142.7 Å²	142.7	75%	0.748	80%	0.803	S	S	*	*			trans	-82.9	106.7	169.1	-71.1	-168.6	170.1	0	0	109.3	S97 L101	S97-E99 PolarHBondContact O-N 3.42Å; E99-L101 PolarHBondContact O-N 3.16Å; E99-L101 VanDerWaalsContact O-N 3.11Å
100	S	25.2	Very low	26.3	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	80%	0.802	S	S	*	*			trans	-61.8	105.1	170.1	8.7	0	0	0	0	107.7	Q98 Q102	Q98-S100 PolarHBondContact O-N 3.15Å; S100-Q102 VanDerWaalsContact C-N 3.31Å; S100-Q102 PolarHBondContact O-N 2.9Å
101	L	25.3	Very low	26.4	Very low	159 Å²	159	142.5 Å²	142.5	83%	0.832	80%	0.798	S	S	*	*			trans	-68.4	92.2	174.2	-69.3	173	0	0	0	108.8	E99 L103	E99-L101 PolarHBondContact O-N 3.16Å; E99-L101 VanDerWaalsContact O-N 3.11Å; L101-L103 PolarHBondContact O-N 3.35Å; L101-L103 VanDerWaalsContact O-N 3.1Å
102	Q	22.5	Very low	26.3	Very low	183 Å²	183	144.4 Å²	144.4	86%	0.855	80%	0.802	S	S	*	*			trans	-62.1	106.5	163.7	-72.8	-174	-20.3	0	0	107.5	S100 S104	S100-Q102 VanDerWaalsContact C-N 3.31Å; S100-Q102 PolarHBondContact O-N 2.9Å; Q102-S104 PolarHBondContact O-N 2.91Å
103	L	26.8	Very low	26.3	Very low	172 Å²	172	143.3 Å²	143.3	90%	0.901	79%	0.794	S	S	*	*			trans	-66.8	99.9	173	-67.6	169.9	0	0	0	108.1	L101	L101-L103 PolarHBondContact O-N 3.35Å; L101-L103 VanDerWaalsContact O-N 3.1Å
104	S	25	Very low	26.4	Very low	106 Å²	106	143.6 Å²	143.6	74%	0.741	79%	0.79	S	S	*	*			trans	-67.9	136.8	169.8	54.7	0	0	0	0	110.1	Q102 I106	Q102-S104 PolarHBondContact O-N 2.91Å; S104-I106 PolarHBondContact O-N 3.17Å; S104-I106 VanDerWaalsContact O-N 3.13Å
105	S	25	Very low	26.5	Very low	117 Å²	117	144.8 Å²	144.8	82%	0.818	79%	0.789	S	S	*	*			trans	-37	106.7	-179.1	-49	0	0	0	0	114	E107	S105-E107 PolarHBondContact O-N 2.79Å
106	I	26.9	Very low	26.5	Very low	151 Å²	151	144.1 Å²	144.1	77%	0.774	79%	0.786	S	S	*	*			trans	-75.4	110.7	162.1	-71.7	170.3	0	0	0	106.3	S104 V108	S104-I106 PolarHBondContact O-N 3.17Å; S104-I106 VanDerWaalsContact O-N 3.13Å; I106-V108 PolarHBondContact O-N 3.36Å
107	E	24.4	Very low	26.8	Very low	182 Å²	182	147.1 Å²	147.1	85%	0.85	79%	0.786	S	S	*	*			trans	-55.1	103	162.2	-69	179.6	152	0	0	107.4	S105 L109	S105-E107 PolarHBondContact O-N 2.79Å; E107-L109 PolarHBondContact O-N 2.83Å
108	V	26.6	Very low	27	Very low	125 Å²	125	151.9 Å²	151.9	76%	0.758	80%	0.795	S	S	*	*			trans	-67.2	100.5	176.8	178.1	0	0	0	0	106.7	I106 N110	I106-V108 PolarHBondContact O-N 3.36Å; V108-N110 PolarHBondContact O-N 3.35Å
109	L	22.7	Very low	27.1	Very low	166 Å²	166	148.3 Å²	148.3	87%	0.869	79%	0.79	S	S	*	*			trans	-53.5	131.5	173.2	-146.4	89.9	0	0	0	109	E107 V111	E107-L109 PolarHBondContact O-N 2.83Å; L109-V111 PolarHBondContact O-N 3.37Å
110	N	23.5	Very low	27.4	Very low	146 Å²	146	147.9 Å²	147.9	78%	0.781	79%	0.791	S	S	*	*			trans	-50.8	113.9	-164.9	-163.7	33.1	0	0	0	115.2	V108 H112	V108-N110 PolarHBondContact O-N 3.35Å; N110-H112 PolarHBondContact O-N 2.95Å
111	V	26.2	Very low	27.7	Very low	107 Å²	107	149 Å²	149	65%	0.648	79%	0.794	S	S	*	*			trans	0.5	102.9	144.8	-152.4	0	0	0	0	116.2	L109	L109-V111 PolarHBondContact O-N 3.37Å
112	H	26.2	Very low	27.8	Very low	191 Å²	191	143 Å²	143	88%	0.884	77%	0.771	S	S	*	*			trans	-106.6	91.2	148.5	-159.3	61	0	0	0	107.5	N110	N110-H112 PolarHBondContact O-N 2.95Å
113	S	28.6	Very low	28.4	Very low	81 Å²	81	140.1 Å²	140.1	57%	0.566	77%	0.768	S	S	*	*			trans	-80.9	118.6	-177.2	56.2	0	0	0	0	110.9
114	E	31.3	Very low	29	Very low	164 Å²	164	138.7 Å²	138.7	77%	0.766	76%	0.76	S	S	*	*	S	Bend	trans	-149.2	105.3	148.7	-122.4	174.9	-178.4	0	0	108.9
115	N	31.1	Very low	29.4	Very low	146 Å²	146	140.5 Å²	140.5	78%	0.781	76%	0.761	S	S	*	*			trans	91.2	29.1	165	-49.3	-51.8	0	0	0	120.2	K117	N115-K117 PolarHBondContact O-N 3.05Å
116	D	31.2	Very low	30.2	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	76%	0.761	S	S	*	*			trans	-66.1	90.2	167.8	-73.4	-37.6	0	0	0	112.6	K118	D116-K118 VanDerWaalsContact C-N 3.28Å; D116-K118 PolarHBondContact O-N 3.3Å
117	K	34.2	Very low	30.6	Very low	193 Å²	193	137.9 Å²	137.9	84%	0.839	75%	0.754	S	S	*	*			trans	-66.2	94.6	152.8	-72.8	179.5	-177.7	173.3	0	107.1	N115 C119	N115-K117 PolarHBondContact O-N 3.05Å; K117-C119 PolarHBondContact O-N 3.28Å
118	K	31.6	Very low	31.3	Very low	189 Å²	189	138.5 Å²	138.5	82%	0.822	75%	0.753	S	S	*	*			trans	-22.3	92.6	168.4	-77.4	175.2	170.6	179.4	0	113.1	D116 I120	D116-K118 VanDerWaalsContact C-N 3.28Å; D116-K118 PolarHBondContact O-N 3.3Å; K118-I120 HydrophobicContact CB-CG1 4.4Å; K118-I120 PolarHBondContact O-N 2.97Å
119	C	29.2	Very low	32	Very low	117 Å²	117	139.8 Å²	139.8	79%	0.791	76%	0.756	S	S	*	*			trans	-74.1	99.4	153.6	-90.9	0	0	0	0	105.6	K117 T121	K117-C119 PolarHBondContact O-N 3.28Å; C119-T121 PolarHBondContact O-N 3.35Å
120	I	31.1	Very low	32.5	Very low	151 Å²	151	136.1 Å²	136.1	77%	0.774	74%	0.742	S	S	*	*			trans	-70.7	87.1	170.2	-58.8	173.1	0	0	0	105.9	K118 G122	K118-I120 HydrophobicContact CB-CG1 4.4Å; K118-I120 PolarHBondContact O-N 2.97Å; I120-G122 PolarHBondContact O-N 3.01Å
121	T	32.6	Very low	33	Very low	133 Å²	133	132.4 Å²	132.4	82%	0.816	73%	0.727	S	S	*	*			trans	-80.2	63.4	167.6	-37.4	0	0	0	0	107.5	C119	C119-T121 PolarHBondContact O-N 3.35Å
122	G	28.3	Very low	33.4	Very low	34 Å²	34	131.1 Å²	131.1	35%	0.351	73%	0.728	S	S	.	*			trans	-65.5	149.7	166.8	0	0	0	0	0	108.8	I120 I124	I120-G122 PolarHBondContact O-N 3.01Å; G122-I124 PolarHBondContact O-N 3.48Å
123	P	33.1	Very low	33.8	Very low	122 Å²	122	129.9 Å²	129.9	79%	0.792	72%	0.722	S	S	*	*			trans	-53.3	118.7	170.4	22.5	-31.1	0	0	0	107.7	N125	P123-N125 VanDerWaalsContact C-N 3.26Å; P123-N125 PolarHBondContact O-N 3.48Å
124	I	39.7	Very low	34	Very low	143 Å²	143	129.2 Å²	129.2	73%	0.733	72%	0.715	S	S	*	*			trans	-63.7	100.6	171.1	-60.3	170.3	0	0	0	103.9	G122 D126	G122-I124 PolarHBondContact O-N 3.48Å; I124-D126 PolarHBondContact O-N 2.82Å
125	N	33.8	Very low	34.1	Very low	143 Å²	143	126.6 Å²	126.6	77%	0.765	71%	0.705	S	S	*	*			trans	-58.5	109.8	165.5	-95.5	-36.7	0	0	0	105	P123 G127	P123-N125 VanDerWaalsContact C-N 3.26Å; P123-N125 PolarHBondContact O-N 3.48Å; N125-G127 PolarHBondContact O-N 2.89Å
126	D	42.4	Very low	34.4	Very low	152 Å²	152	127.2 Å²	127.2	81%	0.813	70%	0.701	S	S	*	*			trans	-64.2	24.1	163.6	-69	-35.3	0	0	0	111.6	I124 K128	I124-D126 PolarHBondContact O-N 2.82Å; D126-K128 VanDerWaalsContact C-N 3.28Å; D126-K128 PolarHBondContact O-N 3.46Å
127	G	35.6	Very low	34.5	Very low	61 Å²	61	124.3 Å²	124.3	63%	0.629	69%	0.692	S	S	*	*	S	Bend	trans	-65.9	89.7	174.1	0	0	0	0	0	108.7	N125 L129	N125-G127 PolarHBondContact O-N 2.89Å; G127-L129 PolarHBondContact O-N 3.36Å
128	K	39.5	Very low	34.5	Very low	195 Å²	195	122.6 Å²	122.6	85%	0.848	69%	0.687	S	S	*	*			trans	36.1	70.2	164.1	-69.3	-176.2	177.4	-177.2	0	112.6	D126 P130	D126-K128 VanDerWaalsContact C-N 3.28Å; D126-K128 PolarHBondContact O-N 3.46Å; K128-P130 WeakPolarHBondContact O-CD 3.47Å; K128-P130 VanDerWaalsContact O-N 3.1Å
129	L	40.7	Very low	34.5	Very low	153 Å²	153	121.8 Å²	121.8	80%	0.801	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-52.7	121	154.4	-83.9	161.9	0	0	0	106.2	G127 S131	G127-L129 PolarHBondContact O-N 3.36Å; L129-S131 PolarHBondContact O-N 3.43Å; L129-S131 VanDerWaalsContact O-N 3.11Å
130	P	32.6	Very low	34.7	Very low	89 Å²	89	123.1 Å²	123.1	58%	0.578	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-55.3	124.9	179.7	19.7	-29.4	0	0	0	107.6	K128	K128-P130 WeakPolarHBondContact O-CD 3.47Å; K128-P130 VanDerWaalsContact O-N 3.1Å
131	S	33.6	Very low	34.8	Very low	67 Å²	67	124 Å²	124	47%	0.469	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-59.3	148.1	177.5	69.6	0	0	0	0	108.2	L129 E133 T134	L129-S131 PolarHBondContact O-N 3.43Å; L129-S131 VanDerWaalsContact O-N 3.11Å; S131-E133 PolarHBondContact O-N 2.95Å; S131-T134 PolarHBondContact O-N 3.33Å; S131-T134 PolarHBondContact O-OG1 2.88Å
132	A	35.6	Very low	34.7	Very low	81 Å²	81	126 Å²	126	67%	0.669	68%	0.679	S	S	*	*	H	α-helix	trans	-55.6	-18.7	-179.1	0	0	0	0	0	113.2
133	E	33.1	Very low	34.8	Very low	164 Å²	164	127.9 Å²	127.9	77%	0.766	69%	0.691	S	S	*	*	H	α-helix	trans	-68.1	-32.6	172.2	-83	-177.9	152.2	0	0	113.6	S131 I135 K136	S131-E133 PolarHBondContact O-N 2.95Å; E133-I135 VanDerWaalsContact C-N 3.29Å; E133-I135 PolarHBondContact O-N 3Å; E133-K136 PolarHBondContact O-N 3.5Å
134	T	33.2	Very low	34.5	Very low	68 Å²	68	127.4 Å²	127.4	42%	0.417	69%	0.69	S	S	.	*	H	α-helix	trans	-69.4	-30	179.3	-31.2	0	0	0	0	111.9	S131 K136 S137	S131-T134 PolarHBondContact O-N 3.33Å; S131-T134 PolarHBondContact O-OG1 2.88Å; T134-K136 PolarHBondContact O-N 3.22Å; T134-S137 PolarHBondContact O-N 3.41Å
135	I	33.6	Very low	34.1	Very low	109 Å²	109	130.5 Å²	130.5	56%	0.559	70%	0.698	S	S	*	*	H	α-helix	trans	-64.7	-25.5	178.1	-54.1	177.7	0	0	0	111.3	E133	E133-I135 VanDerWaalsContact C-N 3.29Å; E133-I135 PolarHBondContact O-N 3Å
136	K	37.6	Very low	34	Very low	159 Å²	159	128.9 Å²	128.9	69%	0.691	70%	0.697	S	S	*	*	H	α-helix	trans	-76.9	-28.7	177.4	-77	-173.9	176.7	179.4	0	113.9	E133 T134 H140	E133-K136 PolarHBondContact O-N 3.5Å; T134-K136 PolarHBondContact O-N 3.22Å; K136-H140 PolarHBondContact O-ND1 3.23Å
137	S	33.3	Very low	33.5	Very low	87 Å²	87	127.4 Å²	127.4	61%	0.608	69%	0.694	S	S	*	*	H	α-helix	trans	-82.1	-36.1	-176	-168.4	0	0	0	0	113.2	T134 F139 H140	T134-S137 PolarHBondContact O-N 3.41Å; S137-F139 VanDerWaalsContact C-N 3.29Å; S137-F139 PolarHBondContact O-N 3.22Å; S137-H140 PolarHBondContact O-N 3.37Å
138	E	34.6	Very low	33.3	Very low	158 Å²	158	130.4 Å²	130.4	74%	0.738	70%	0.702	S	S	*	*	H	α-helix	trans	-71.8	-25.6	-179.6	-77.2	-176.3	168.8	0	0	112.6	H140	E138-H140 VanDerWaalsContact C-N 3.35Å; E138-H140 PolarHBondContact O-N 3.49Å
139	F	32.5	Very low	33	Very low	171 Å²	171	128.1 Å²	128.1	75%	0.75	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-80.5	-8.9	178.8	-116	-91.8	0	0	0	115.1	S137	S137-F139 VanDerWaalsContact C-N 3.29Å; S137-F139 PolarHBondContact O-N 3.22Å
140	H	32.2	Very low	32.6	Very low	145 Å²	145	126 Å²	126	67%	0.671	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-85.5	-9.4	-178.5	-85.6	67.8	0	0	0	114.7	K136 S137 E138	K136-H140 PolarHBondContact O-ND1 3.23Å; S137-H140 PolarHBondContact O-N 3.37Å; E138-H140 VanDerWaalsContact C-N 3.35Å; E138-H140 PolarHBondContact O-N 3.49Å
141	Q	32.6	Very low	32.6	Very low	169 Å²	169	128.5 Å²	128.5	79%	0.79	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-83.8	-11.6	-178.5	-73.3	-161.6	-12.4	0	0	115.1
142	H	31.6	Very low	32.5	Very low	175 Å²	175	128.1 Å²	128.1	81%	0.81	72%	0.718	S	S	*	*	S	Bend	trans	-110.4	-3.4	-175.8	-68.6	-63	0	0	0	115.8
143	A	30.5	Very low	32.4	Very low	74 Å²	74	131.8 Å²	131.8	61%	0.612	73%	0.727	S	S	*	*	S	Bend	trans	-92.4	-8.7	-174.8	0	0	0	0	0	115.4
144	C	26.5	Very low	32.4	Very low	113 Å²	113	132.3 Å²	132.3	76%	0.764	73%	0.729	S	S	*	*	S	Bend	trans	-107.9	45.8	-170.1	-66.9	0	0	0	0	114.5
145	K	30.9	Very low	32.3	Very low	208 Å²	208	136.3 Å²	136.3	90%	0.904	75%	0.748	S	S	*	*			trans	-149.3	68.3	163.9	-70	-168.7	-176.8	175.4	0	111.5
146	S	32.5	Very low	32.3	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	76%	0.76	S	S	*	*			trans	-135.7	94.5	160.1	27.6	0	0	0	0	107.6
147	T	30.5	Very low	31.7	Very low	121 Å²	121	132.4 Å²	132.4	74%	0.742	76%	0.76	S	S	*	*			trans	-49.2	143.5	166.7	15	0	0	0	0	110.4	N149	T147-N149 PolarHBondContact O-N 3.3Å
148	P	33.1	Very low	31.4	Very low	124 Å²	124	134.5 Å²	134.5	81%	0.805	77%	0.769	S	S	*	*			trans	-74.2	110.3	-175.7	27.9	-28	0	0	0	109.4
149	N	32.1	Very low	31.1	Very low	147 Å²	147	133.3 Å²	133.3	79%	0.786	77%	0.773	S	S	*	*			trans	-82.1	139.9	169.4	-73.2	-38	0	0	0	110	T147	T147-N149 PolarHBondContact O-N 3.3Å
150	P	32.8	Very low	31.1	Very low	110 Å²	110	129.4 Å²	129.4	71%	0.714	76%	0.764	S	S	*	*			trans	-71	164.6	-176	28.4	-33.8	0	0	0	113.5	G152	P150-G152 PolarHBondContact O-N 3.34Å
151	P	33.3	Very low	31	Very low	140 Å²	140	127.7 Å²	127.7	91%	0.909	77%	0.768	S	S	*	*			trans	-80.7	112.9	-165.4	32.4	-30.6	0	0	0	110.4
152	G	31	Very low	30.8	Very low	60 Å²	60	128.4 Å²	128.4	62%	0.619	77%	0.769	S	S	*	*			trans	-143	112.2	174	0	0	0	0	0	109.7	P150	P150-G152 PolarHBondContact O-N 3.34Å
153	D	32.1	Very low	30.5	Very low	158 Å²	158	129.4 Å²	129.4	85%	0.845	77%	0.774	S	S	*	*			trans	62	97.9	147.3	-52.1	-22.6	0	0	0	119.3
154	E	33.3	Very low	30.3	Very low	175 Å²	175	133.3 Å²	133.3	82%	0.818	78%	0.782	S	S	*	*				33.7	124.4	129.7	-53.3	-162	162.1	0	0	119.9
155	N	32.3	Very low	30.3	Very low	152 Å²	152	135.1 Å²	135.1	81%	0.813	78%	0.783	S	S	*	*			trans	78	62.8	153.4	-58.2	-28.4	0	0	0	118.9
156	S	33	Very low	30.1	Very low	118 Å²	118	133 Å²	133	83%	0.825	78%	0.78	S	S	*	*			trans	-157.8	72.7	133.9	53.8	0	0	0	0	110	V158	S156-V158 VanDerWaalsContact C-N 3.32Å; S156-V158 PolarHBondContact O-N 2.85Å
157	G	24.6	Very low	29.8	Very low	67 Å²	67	133.3 Å²	133.3	69%	0.691	78%	0.782	S	S	*	*			trans	-61.8	91.7	175.9	0	0	0	0	0	111.1	T159	G157-T159 VanDerWaalsContact C-N 3.29Å; G157-T159 PolarHBondContact O-N 2.81Å
158	V	27.9	Very low	29.9	Very low	131 Å²	131	134.1 Å²	134.1	79%	0.794	78%	0.778	S	S	*	*			trans	34.5	58.1	131.3	-164	0	0	0	0	113.7	S156 T160	S156-V158 VanDerWaalsContact C-N 3.32Å; S156-V158 PolarHBondContact O-N 2.85Å; V158-T160 PolarHBondContact O-N 3.27Å
159	T	28.9	Very low	29.8	Very low	133 Å²	133	134 Å²	134	82%	0.816	78%	0.775	S	S	*	*			trans	-80.3	72	160.4	28.8	0	0	0	0	108.9	G157 S161	G157-T159 VanDerWaalsContact C-N 3.29Å; G157-T159 PolarHBondContact O-N 2.81Å; T159-S161 PolarHBondContact O-N 3.11Å
160	T	31.2	Very low	29.6	Very low	90 Å²	90	135.6 Å²	135.6	55%	0.552	78%	0.779	S	S	*	*			trans	45.4	78.7	130.4	29.4	0	0	0	0	116.7	V158 F162	V158-T160 PolarHBondContact O-N 3.27Å; T160-F162 PolarHBondContact O-N 2.83Å
161	S	30.5	Very low	29.9	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	78%	0.775	S	S	*	*	S	Bend		44.1	11.3	121.2	76.8	0	0	0	0	121.9	T159	T159-S161 PolarHBondContact O-N 3.11Å
162	F	27.5	Very low	30.3	Very low	185 Å²	185	138.5 Å²	138.5	81%	0.811	77%	0.772	S	S	*	*			trans	-114.6	9.4	179.3	-72.1	-74.7	0	0	0	114.2	T160	T160-F162 PolarHBondContact O-N 2.83Å
163	Q	25.6	Very low	30.9	Very low	196 Å²	196	144.1 Å²	144.1	92%	0.916	78%	0.782	S	S	*	*			trans	-103.6	5.7	-174.2	-81.4	-172.6	23.1	0	0	116.7
164	I	26.2	Very low	31.6	Very low	155 Å²	155	141.6 Å²	141.6	80%	0.795	77%	0.772	S	S	*	*			trans	-111.9	138.8	-177.5	-52.9	178.1	0	0	0	109.2
165	I	26.4	Very low	32.3	Very low	152 Å²	152	135.4 Å²	135.4	78%	0.779	75%	0.745	S	S	*	*	S	Bend	trans	93.6	50.1	-178.9	-36.2	158.5	0	0	0	115.2
166	I	27.5	Very low	33.4	Very low	162 Å²	162	134.3 Å²	134.3	83%	0.831	74%	0.739	S	S	*	*			trans	-138.2	69.8	138.5	-48.4	178.2	0	0	0	107.1	E168	I166-E168 VanDerWaalsContact C-N 3.33Å; I166-E168 PolarHBondContact O-N 3.36Å
167	S	26.5	Very low	34.5	Very low	116 Å²	116	137.3 Å²	137.3	81%	0.811	74%	0.737	S	S	*	*			trans	-73.4	96	168.2	-60	0	0	0	0	107.8	T169	S167-T169 PolarHBondContact O-N 3.3Å
168	E	32.6	Very low	35.9	Very low	138 Å²	138	139 Å²	139	65%	0.645	73%	0.73	S	S	*	*			trans	-57.9	114.2	-175.9	-157.3	167.2	-148.1	0	0	111.4	I166 N175	I166-E168 VanDerWaalsContact C-N 3.33Å; I166-E168 PolarHBondContact O-N 3.36Å; E168-N175 PolarHBondContact OE1-ND2 2.97Å
169	T	30.8	Very low	37.4	Very low	122 Å²	122	134.6 Å²	134.6	75%	0.748	71%	0.707	S	S	*	*			trans	-79.8	133.7	169.2	51.8	0	0	0	0	109.7	S167 N171	S167-T169 PolarHBondContact O-N 3.3Å; T169-N171 PolarHBondContact O-N 2.92Å
170	M	28.8	Very low	39.4	Very low	179 Å²	179	131.9 Å²	131.9	88%	0.882	69%	0.694	S	S	*	*	S	Bend	trans	-55.3	102.9	-170.7	-66	163.3	54.4	0	0	113.2
171	N	38.1	Very low	41.1	Very low	114 Å²	114	130.2 Å²	130.2	61%	0.61	69%	0.689	S	S	*	*			trans	-146.8	79.3	158.6	-89.8	-39.5	0	0	0	109.2	T169 E173 V174 N175	T169-N171 PolarHBondContact O-N 2.92Å; N171-E173 PolarHBondContact O-N 2.95Å; N171-V174 PolarHBondContact O-N 2.84Å; N171-N175 PolarHBondContact O-N 3.17Å
172	K	41.2	Very low	42.9	Very low	198 Å²	198	129.1 Å²	129.1	86%	0.861	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.9	-22.7	-172.2	-81.9	-179.5	173.7	177.6	0	114.9
173	E	44.2	Very low	45.3	Very low	178 Å²	178	127.8 Å²	127.8	83%	0.832	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-36.6	-171.2	-157.8	161.3	-166.3	0	0	114.1	N171 N175	N171-E173 PolarHBondContact O-N 2.95Å; E173-N175 PolarHBondContact O-N 3.42Å
174	V	47	Very low	47.9	Very low	104 Å²	104	125 Å²	125	63%	0.63	66%	0.656	S	S	*	*	H	α-helix	trans	-67.5	-30.2	172.1	-174.5	0	0	0	0	110.5	N171 N176 K177 L178	N171-V174 PolarHBondContact O-N 2.84Å; V174-N176 PolarHBondContact O-N 3.16Å; V174-K177 PolarHBondContact O-N 3.38Å; V174-L178 PolarHBondContact O-N 3.01Å; V174-L178 VanDerWaalsContact O-N 3.15Å
175	N	48.3	Very low	50.3	Low	46 Å²	46	126.6 Å²	126.6	25%	0.246	65%	0.652	C	S	.	*	H	α-helix	trans	-66.4	-31.6	-175.8	-117.1	-8.6	0	0	0	113.9	E168 N171 E173 L178 A179	E168-N175 PolarHBondContact OE1-ND2 2.97Å; N171-N175 PolarHBondContact O-N 3.17Å; E173-N175 PolarHBondContact O-N 3.42Å; N175-L178 PolarHBondContact O-N 3.47Å; N175-A179 WeakPolarHBondContact O-CA 3.41Å; N175-A179 WeakPolarHBondContact O-CB 3.35Å; N175-A179 PolarHBondContact O-N 2.95Å
176	N	54.4	Low	52.6	Low	129 Å²	129	129 Å²	129	69%	0.69	65%	0.652	S	S	*	*	H	α-helix	trans	-68.3	-40.8	-179.7	-91.6	-12.1	0	0	0	112.6	V174 S180	V174-N176 PolarHBondContact O-N 3.16Å; N176-S180 WeakPolarHBondContact O-CB 3.3Å; N176-S180 PolarHBondContact O-N 2.94Å
177	K	56.9	Low	54.9	Low	180 Å²	180	130.1 Å²	130.1	78%	0.783	65%	0.646	S	S	*	*	H	α-helix	trans	-69.4	-43.7	175.4	-78.5	-174.7	179.9	177.6	0	111.2	V174 S180 A181	V174-K177 PolarHBondContact O-N 3.38Å; K177-S180 PolarHBondContact O-N 3.27Å; K177-A181 WeakPolarHBondContact O-CB 3.4Å; K177-A181 PolarHBondContact O-N 3.46Å
178	L	53.9	Low	57.5	Low	102 Å²	102	129.4 Å²	129.4	53%	0.534	63%	0.629	S	S	.	*	H	α-helix	trans	-65.8	-46.8	178.9	-169	69.6	0	0	0	111.3	V174 N175 S180 A181 V182	V174-L178 PolarHBondContact O-N 3.01Å; V174-L178 VanDerWaalsContact O-N 3.15Å; N175-L178 PolarHBondContact O-N 3.47Å; L178-S180 VanDerWaalsContact C-N 3.3Å; L178-S180 PolarHBondContact O-N 3.31Å; L178-A181 PolarHBondContact O-N 3.1Å; L178-V182 HydrophobicContact CG-CG2 4.43Å; L178-V182 WeakPolarHBondContact O-CB 3.42Å; L178-V182 VanDerWaalsContact O-CG2 3.23Å; L178-V182 WeakPolarHBondContact O-CG2 3.29Å; L178-V182 PolarHBondContact O-N 3Å
179	A	58.6	Low	59.4	Low	39 Å²	39	128.6 Å²	128.6	32%	0.322	63%	0.629	S	S	.	*	H	α-helix	trans	-61.7	-37.7	175.9	0	0	0	0	0	111.7	N175 K183	N175-A179 WeakPolarHBondContact O-CA 3.41Å; N175-A179 WeakPolarHBondContact O-CB 3.35Å; N175-A179 PolarHBondContact O-N 2.95Å; A179-K183 VanDerWaalsContact O-CB 3.29Å; A179-K183 WeakPolarHBondContact O-CB 3.34Å; A179-K183 VanDerWaalsContact O-CG 3.23Å; A179-K183 WeakPolarHBondContact O-CG 3.44Å; A179-K183 PolarHBondContact O-N 2.85Å
180	S	70.9	Confident	61.4	Low	76 Å²	76	128.1 Å²	128.1	53%	0.531	62%	0.621	S	S	.	*	H	α-helix	trans	-64.5	-46.3	173.4	-176.4	0	0	0	0	111.7	N176 K177 L178 V182 K183 K184	N176-S180 WeakPolarHBondContact O-CB 3.3Å; N176-S180 PolarHBondContact O-N 2.94Å; K177-S180 PolarHBondContact O-N 3.27Å; L178-S180 VanDerWaalsContact C-N 3.3Å; L178-S180 PolarHBondContact O-N 3.31Å; S180-V182 PolarHBondContact O-N 3.13Å; S180-K183 PolarHBondContact O-N 2.97Å; S180-K184 WeakPolarHBondContact O-CB 3.42Å; S180-K184 PolarHBondContact O-N 2.9Å
181	A	67.1	Low	63.8	Low	55 Å²	55	124.1 Å²	124.1	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-63	-40.6	176.7	0	0	0	0	0	112.2	K177 L178 K184 R185	K177-A181 WeakPolarHBondContact O-CB 3.4Å; K177-A181 PolarHBondContact O-N 3.46Å; L178-A181 PolarHBondContact O-N 3.1Å; A181-K184 PolarHBondContact O-N 2.86Å; A181-R185 WeakPolarHBondContact O-CB 3.27Å; A181-R185 PolarHBondContact O-N 3.29Å
182	V	69.1	Low	65.3	Low	86 Å²	86	121.5 Å²	121.5	52%	0.521	60%	0.596	S	S	.	*	H	α-helix	trans	-66.5	-44.4	176	171.7	0	0	0	0	110.8	L178 S180 K184 R185 R186	L178-V182 HydrophobicContact CG-CG2 4.43Å; L178-V182 WeakPolarHBondContact O-CB 3.42Å; L178-V182 VanDerWaalsContact O-CG2 3.23Å; L178-V182 WeakPolarHBondContact O-CG2 3.29Å; L178-V182 PolarHBondContact O-N 3Å; S180-V182 PolarHBondContact O-N 3.13Å; V182-K184 VanDerWaalsContact C-N 3.34Å; V182-K184 PolarHBondContact O-N 3.18Å; V182-R185 PolarHBondContact O-N 3.02Å; V182-R186 VanDerWaalsContact O-CB 3.32Å; V182-R186 WeakPolarHBondContact O-CB 3.4Å; V182-R186 PolarHBondContact O-N 3Å
183	K	76.5	Confident	66.6	Low	157 Å²	157	119 Å²	119	68%	0.683	58%	0.583	S	S	*	*	H	α-helix	trans	-59.3	-44.5	173.9	-79	177	-177.7	-179.1	0	111.5	A179 S180 R186 R187	A179-K183 VanDerWaalsContact O-CB 3.29Å; A179-K183 WeakPolarHBondContact O-CB 3.34Å; A179-K183 VanDerWaalsContact O-CG 3.23Å; A179-K183 WeakPolarHBondContact O-CG 3.44Å; A179-K183 PolarHBondContact O-N 2.85Å; S180-K183 PolarHBondContact O-N 2.97Å; K183-R186 PolarHBondContact O-N 3.15Å; K183-R187 PolarHBondContact O-N 3.47Å
184	K	80.9	Confident	67.8	Low	137 Å²	137	116.2 Å²	116.2	60%	0.596	57%	0.57	S	S	*	*	H	α-helix	trans	-60.4	-51.5	176	-178.6	177.1	174.6	178.4	0	111.1	S180 A181 V182 R186 R187 E188	S180-K184 WeakPolarHBondContact O-CB 3.42Å; S180-K184 PolarHBondContact O-N 2.9Å; A181-K184 PolarHBondContact O-N 2.86Å; V182-K184 VanDerWaalsContact C-N 3.34Å; V182-K184 PolarHBondContact O-N 3.18Å; K184-R186 VanDerWaalsContact C-N 3.33Å; K184-R186 PolarHBondContact O-N 3.04Å; K184-R187 PolarHBondContact O-N 3.38Å; K184-R187 VanDerWaalsContact O-N 3.15Å; K184-E188 WeakPolarHBondContact CE-OE1 3.03Å; K184-E188 WeakPolarHBondContact O-CG 3.14Å; K184-E188 PolarHBondContact O-N 3.47Å
185	R	76.5	Confident	69	Low	188 Å²	188	119.3 Å²	119.3	71%	0.709	58%	0.575	S	S	*	*	H	α-helix	trans	-59.6	-41.7	178.3	-173.1	174.3	-175.3	168.7	1.3	112.2	A181 V182 R187 E188 L189	A181-R185 WeakPolarHBondContact O-CB 3.27Å; A181-R185 PolarHBondContact O-N 3.29Å; V182-R185 PolarHBondContact O-N 3.02Å; R185-R187 VanDerWaalsContact C-N 3.33Å; R185-R187 PolarHBondContact O-N 3.43Å; R185-E188 PolarHBondContact O-N 2.86Å; R185-L189 WeakPolarHBondContact O-CB 3.48Å; R185-L189 PolarHBondContact O-N 2.85Å
186	R	74.3	Confident	69.8	Low	203 Å²	203	120.8 Å²	120.8	77%	0.766	59%	0.593	S	S	*	*	H	α-helix	trans	-62.2	-40.4	176.9	-174.1	175.5	179.6	164.5	0.1	111.7	V182 K183 K184 L189 L190	V182-R186 VanDerWaalsContact O-CB 3.32Å; V182-R186 WeakPolarHBondContact O-CB 3.4Å; V182-R186 PolarHBondContact O-N 3Å; K183-R186 PolarHBondContact O-N 3.15Å; K184-R186 VanDerWaalsContact C-N 3.33Å; K184-R186 PolarHBondContact O-N 3.04Å; R186-L189 PolarHBondContact O-N 2.78Å; R186-L190 WeakPolarHBondContact O-CB 3.48Å; R186-L190 PolarHBondContact O-N 2.97Å
187	R	76.3	Confident	70.4	Confident	186 Å²	186	117.2 Å²	117.2	70%	0.702	57%	0.573	S	S	*	*	H	α-helix	trans	-67.4	-43.7	176.7	-169.5	175.9	-176.7	175	1.2	111.9	K183 K184 R185 L189 L190 I191	K183-R187 PolarHBondContact O-N 3.47Å; K184-R187 PolarHBondContact O-N 3.38Å; K184-R187 VanDerWaalsContact O-N 3.15Å; R185-R187 VanDerWaalsContact C-N 3.33Å; R185-R187 PolarHBondContact O-N 3.43Å; R187-L189 VanDerWaalsContact C-N 3.31Å; R187-L189 PolarHBondContact O-N 2.85Å; R187-L190 PolarHBondContact O-N 3.36Å; R187-I191 HydrophobicContact CG-CD1 4.16Å; R187-I191 WeakPolarHBondContact O-CG1 3.45Å; R187-I191 PolarHBondContact O-N 2.82Å
188	E	81.5	Confident	70.7	Confident	100 Å²	100	114.4 Å²	114.4	47%	0.467	56%	0.563	S	S	.	*	H	α-helix	trans	-59.3	-43	174.7	-71.9	170.7	-177.3	0	0	111.4	K184 R185 I191 A192	K184-E188 WeakPolarHBondContact CE-OE1 3.03Å; K184-E188 WeakPolarHBondContact O-CG 3.14Å; K184-E188 PolarHBondContact O-N 3.47Å; R185-E188 PolarHBondContact O-N 2.86Å; E188-I191 PolarHBondContact O-N 3.22Å; E188-A192 WeakPolarHBondContact O-CB 3.48Å; E188-A192 PolarHBondContact O-N 3.37Å
189	L	71.9	Confident	70.6	Confident	121 Å²	121	113.9 Å²	113.9	63%	0.634	57%	0.565	S	S	*	*	H	α-helix	trans	-64.2	-41	177.2	-145.7	92.1	0	0	0	112.1	R185 R186 R187 A192 Y193	R185-L189 WeakPolarHBondContact O-CB 3.48Å; R185-L189 PolarHBondContact O-N 2.85Å; R186-L189 PolarHBondContact O-N 2.78Å; R187-L189 VanDerWaalsContact C-N 3.31Å; R187-L189 PolarHBondContact O-N 2.85Å; L189-A192 PolarHBondContact O-N 2.87Å; L189-Y193 VanDerWaalsContact O-CB 3.31Å; L189-Y193 WeakPolarHBondContact O-CB 3.13Å; L189-Y193 PolarHBondContact O-N 3.3Å
190	L	73.8	Confident	70.7	Confident	113 Å²	113	117 Å²	117	59%	0.592	58%	0.576	S	S	*	*	H	α-helix	trans	-64.9	-42.4	178	-172.9	68	0	0	0	111.6	R186 R187 Y193 E194	R186-L190 WeakPolarHBondContact O-CB 3.48Å; R186-L190 PolarHBondContact O-N 2.97Å; R187-L190 PolarHBondContact O-N 3.36Å; L190-Y193 WeakPolarHBondContact O-CB 3.31Å; L190-Y193 PolarHBondContact O-N 2.85Å; L190-E194 WeakPolarHBondContact O-CB 3.36Å; L190-E194 PolarHBondContact O-N 3.19Å
191	I	77.9	Confident	70.2	Confident	94 Å²	94	119.7 Å²	119.7	48%	0.482	59%	0.589	S	S	.	*	H	α-helix	trans	-64.8	-44.1	176.3	-67.6	165.4	0	0	0	110.7	R187 E188 Y193 E194 K195	R187-I191 HydrophobicContact CG-CD1 4.16Å; R187-I191 WeakPolarHBondContact O-CG1 3.45Å; R187-I191 PolarHBondContact O-N 2.82Å; E188-I191 PolarHBondContact O-N 3.22Å; I191-Y193 VanDerWaalsContact C-N 3.3Å; I191-Y193 PolarHBondContact O-N 2.91Å; I191-E194 PolarHBondContact O-N 3.11Å; I191-K195 WeakPolarHBondContact O-CB 3.39Å; I191-K195 PolarHBondContact O-N 2.89Å
192	A	70.1	Confident	69.8	Low	59 Å²	59	121.2 Å²	121.2	49%	0.488	60%	0.596	S	S	.	*	H	α-helix	trans	-61.8	-41.6	176.8	0	0	0	0	0	111.3	E188 L189 K195 A196	E188-A192 WeakPolarHBondContact O-CB 3.48Å; E188-A192 PolarHBondContact O-N 3.37Å; L189-A192 PolarHBondContact O-N 2.87Å; A192-K195 PolarHBondContact O-N 3.41Å; A192-A196 VanDerWaalsContact O-CB 3.25Å; A192-A196 WeakPolarHBondContact O-CB 3.4Å; A192-A196 PolarHBondContact O-N 2.8Å
193	Y	68.2	Low	69.8	Low	146 Å²	146	123.4 Å²	123.4	57%	0.573	60%	0.604	S	S	*	*	H	α-helix	trans	-62	-49	174.1	177.9	-97.1	0	0	0	111.8	L189 L190 I191 K195 A196 M197	L189-Y193 VanDerWaalsContact O-CB 3.31Å; L189-Y193 WeakPolarHBondContact O-CB 3.13Å; L189-Y193 PolarHBondContact O-N 3.3Å; L190-Y193 WeakPolarHBondContact O-CB 3.31Å; L190-Y193 PolarHBondContact O-N 2.85Å; I191-Y193 VanDerWaalsContact C-N 3.3Å; I191-Y193 PolarHBondContact O-N 2.91Å; Y193-K195 VanDerWaalsContact C-N 3.34Å; Y193-K195 PolarHBondContact O-N 2.95Å; Y193-A196 CarbonylContact O-C 3.57Å; Y193-A196 PolarHBondContact O-N 3.15Å; Y193-M197 HydrophobicContact CD1-CG 4.18Å; Y193-M197 HydrophobicContact CD2-CG 4.37Å; Y193-M197 HydrophobicContact CE1-CG 3.83Å; Y193-M197 HydrophobicContact CE1-SD 4.47Å; Y193-M197 HydrophobicContact CE2-CG 4.03Å; Y193-M197 HydrophobicContact CE2-SD 4.17Å; Y193-M197 HydrophobicContact CG-CG 4.44Å; Y193-M197 WeakPolarHBondContact O-CB 3.16Å; Y193-M197 WeakPolarHBondContact O-CG 3.29Å; Y193-M197 PolarHBondContact O-N 3.47Å
194	E	69.6	Low	69.6	Low	120 Å²	120	123.7 Å²	123.7	56%	0.561	61%	0.613	S	S	*	*	H	α-helix	trans	-61.2	-42.1	178.7	-172.4	176.5	-176.1	0	0	111.8	L190 I191 M197 Q198	L190-E194 WeakPolarHBondContact O-CB 3.36Å; L190-E194 PolarHBondContact O-N 3.19Å; I191-E194 PolarHBondContact O-N 3.11Å; E194-M197 CarbonylContact O-C 3.59Å; E194-M197 PolarHBondContact O-N 3.33Å; E194-M197 VanDerWaalsContact O-N 3.15Å; E194-Q198 PolarHBondContact O-N 3.46Å; E194-Q198 VanDerWaalsContact O-N 3.16Å
195	K	71.8	Confident	69.1	Low	169 Å²	169	120 Å²	120	74%	0.735	60%	0.601	S	S	*	*	H	α-helix	trans	-65.5	-41.2	175.4	-171.5	177.5	179.9	-178.8	0	112.1	I191 A192 Y193 M197 Q198	I191-K195 WeakPolarHBondContact O-CB 3.39Å; I191-K195 PolarHBondContact O-N 2.89Å; A192-K195 PolarHBondContact O-N 3.41Å; Y193-K195 VanDerWaalsContact C-N 3.34Å; Y193-K195 PolarHBondContact O-N 2.95Å; K195-M197 PolarHBondContact O-N 3.38Å; K195-Q198 WeakPolarHBondContact O-CB 3.32Å; K195-Q198 PolarHBondContact O-N 2.85Å
196	A	65.7	Low	68.9	Low	76 Å²	76	113.2 Å²	113.2	63%	0.628	59%	0.586	S	S	*	*	H	α-helix	trans	-68	-20.4	174.6	0	0	0	0	0	112.6	A192 Y193	A192-A196 VanDerWaalsContact O-CB 3.25Å; A192-A196 WeakPolarHBondContact O-CB 3.4Å; A192-A196 PolarHBondContact O-N 2.8Å; Y193-A196 CarbonylContact O-C 3.57Å; Y193-A196 PolarHBondContact O-N 3.15Å
197	M	67	Low	68.9	Low	55 Å²	55	108.1 Å²	108.1	27%	0.271	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.5	-5.9	176.4	-66.6	-84.3	58.7	0	0	114.5	Y193 E194 K195	Y193-M197 HydrophobicContact CD1-CG 4.18Å; Y193-M197 HydrophobicContact CD2-CG 4.37Å; Y193-M197 HydrophobicContact CE1-CG 3.83Å; Y193-M197 HydrophobicContact CE1-SD 4.47Å; Y193-M197 HydrophobicContact CE2-CG 4.03Å; Y193-M197 HydrophobicContact CE2-SD 4.17Å; Y193-M197 HydrophobicContact CG-CG 4.44Å; Y193-M197 WeakPolarHBondContact O-CB 3.16Å; Y193-M197 WeakPolarHBondContact O-CG 3.29Å; Y193-M197 PolarHBondContact O-N 3.47Å; E194-M197 CarbonylContact O-C 3.59Å; E194-M197 PolarHBondContact O-N 3.33Å; E194-M197 VanDerWaalsContact O-N 3.15Å; K195-M197 PolarHBondContact O-N 3.38Å
198	Q	62.5	Low	69	Low	121 Å²	121	106.2 Å²	106.2	57%	0.565	58%	0.578	S	S	*	*	S	Bend	trans	-62.8	130.6	167.3	-68.7	-66.5	-26.4	0	0	108.7	E194 K195 I200	E194-Q198 PolarHBondContact O-N 3.46Å; E194-Q198 VanDerWaalsContact O-N 3.16Å; K195-Q198 WeakPolarHBondContact O-CB 3.32Å; K195-Q198 PolarHBondContact O-N 2.85Å; Q198-I200 PolarHBondContact O-N 3.46Å
199	P	53.1	Low	68.6	Low	91 Å²	91	108 Å²	108	59%	0.591	58%	0.581	S	S	*	*			trans	-59.6	136.3	177.6	24.7	-32.2	0	0	0	109.4	T201	P199-T201 PolarHBondContact O-N 3.4Å
200	I	59.5	Low	68.7	Low	105 Å²	105	107.2 Å²	107.2	54%	0.538	57%	0.574	S	S	.	*			trans	-65.2	103.5	169.2	-57.6	173.4	0	0	0	106.4	I51 Q198 S202 I203	I51-I200 HydrophobicContact CD1-CD1 4.45Å; I51-I200 HydrophobicContact CG2-CD1 4.48Å; Q198-I200 PolarHBondContact O-N 3.46Å; I200-S202 VanDerWaalsContact CG2-O 3.29Å; I200-S202 WeakPolarHBondContact CG2-O 3.23Å; I200-I203 HydrophobicContact CG2-CD1 4.46Å; I200-I203 HydrophobicContact CG2-CG1 3.68Å
201	T	61.1	Low	68.7	Low	132 Å²	132	107.8 Å²	107.8	81%	0.81	58%	0.577	S	S	*	*			trans	-84.1	-21	-178.1	48.7	0	0	0	0	112.6	P199	P199-T201 PolarHBondContact O-N 3.4Å
202	S	58.5	Low	68.5	Low	87 Å²	87	109 Å²	109	61%	0.608	58%	0.58	S	S	*	*			trans	-145.9	136.2	178.7	56.8	0	0	0	0	110.1	I200	I200-S202 VanDerWaalsContact CG2-O 3.29Å; I200-S202 WeakPolarHBondContact CG2-O 3.23Å
203	I	68.4	Low	68.4	Low	132 Å²	132	110.1 Å²	110.1	68%	0.677	58%	0.577	S	S	*	*			trans	-114	122.4	166.9	-61.7	172	0	0	0	105.3	I200 V205	I200-I203 HydrophobicContact CG2-CD1 4.46Å; I200-I203 HydrophobicContact CG2-CG1 3.68Å; I203-V205 HydrophobicContact CG2-CG2 4.17Å; I203-V205 PolarHBondContact O-N 2.73Å; I203-V205 VanDerWaalsContact O-N 3.13Å
204	D	73	Confident	68.7	Low	163 Å²	163	108.1 Å²	108.1	87%	0.872	58%	0.576	S	S	*	*			trans	-71.4	106.6	170.1	-72.5	-28.7	0	0	0	108
205	V	71	Confident	68.9	Low	59 Å²	59	105.7 Å²	105.7	36%	0.358	57%	0.572	S	S	.	*			trans	-94.1	124.9	175.3	-178.4	0	0	0	0	107.4	I203 E210 L213	I203-V205 HydrophobicContact CG2-CG2 4.17Å; I203-V205 PolarHBondContact O-N 2.73Å; I203-V205 VanDerWaalsContact O-N 3.13Å; V205-E210 HydrophobicContact CG1-CB 4.15Å; V205-L213 HydrophobicContact CG1-CD1 3.92Å; V205-L213 HydrophobicContact CG2-CD1 4.41Å
206	A	71.1	Confident	68.8	Low	46 Å²	46	104 Å²	104	38%	0.38	57%	0.571	S	S	.	*			trans	-59.3	141.7	173.7	0	0	0	0	0	109.7	E208 Y209 E210	A206-E208 PolarHBondContact O-N 3.22Å; A206-Y209 HydrophobicContact CB-CD2 3.96Å; A206-Y209 HydrophobicContact CB-CE2 4.41Å; A206-Y209 PolarHBondContact O-N 3.26Å; A206-E210 PolarHBondContact O-N 2.72Å; A206-E210 VanDerWaalsContact O-N 3.16Å
207	P	75	Confident	69.1	Low	95 Å²	95	108.8 Å²	108.8	62%	0.617	58%	0.578	S	S	*	*	H	α-helix	trans	-54	-32.2	-172.7	-26.7	33.1	0	0	0	113.9	Y209 E210 I211	P207-Y209 VanDerWaalsContact C-N 3.31Å; P207-Y209 PolarHBondContact O-N 3.21Å; P207-E210 PolarHBondContact O-N 3.5Å; P207-I211 PolarHBondContact O-N 2.8Å
208	E	79.1	Confident	68.5	Low	146 Å²	146	116.9 Å²	116.9	68%	0.682	62%	0.615	S	S	*	*	H	α-helix	trans	-62.6	-34.9	178.6	-59	174.7	-151.2	0	0	113.1	A206	A206-E208 PolarHBondContact O-N 3.22Å
209	Y	73	Confident	68.8	Low	137 Å²	137	116.7 Å²	116.7	54%	0.537	62%	0.617	S	S	.	*	H	α-helix	trans	-88.1	-26.3	177.3	-60.8	-57.8	0	0	0	112.3	A206 P207 I211 Q212 L213	A206-Y209 HydrophobicContact CB-CD2 3.96Å; A206-Y209 HydrophobicContact CB-CE2 4.41Å; A206-Y209 PolarHBondContact O-N 3.26Å; P207-Y209 VanDerWaalsContact C-N 3.31Å; P207-Y209 PolarHBondContact O-N 3.21Å; Y209-I211 VanDerWaalsContact C-N 3.32Å; Y209-I211 PolarHBondContact O-N 3.4Å; Y209-Q212 PolarHBondContact O-N 3.5Å; Y209-L213 WeakPolarHBondContact O-CB 3.41Å; Y209-L213 PolarHBondContact O-N 2.89Å
210	E	72.7	Confident	69.6	Low	105 Å²	105	118.1 Å²	118.1	49%	0.491	62%	0.619	S	S	.	*	H	α-helix	trans	-60.6	-44	176.9	-169.7	178	-171.5	0	0	111	V205 A206 P207 Q212 L213 L214	V205-E210 HydrophobicContact CG1-CB 4.15Å; A206-E210 PolarHBondContact O-N 2.72Å; A206-E210 VanDerWaalsContact O-N 3.16Å; P207-E210 PolarHBondContact O-N 3.5Å; E210-Q212 VanDerWaalsContact C-N 3.34Å; E210-Q212 PolarHBondContact O-N 3.38Å; E210-L213 PolarHBondContact O-N 2.98Å; E210-L214 HydrophobicContact CG-CD1 4.26Å; E210-L214 WeakPolarHBondContact O-CB 3.37Å; E210-L214 WeakPolarHBondContact O-CG 2.97Å; E210-L214 PolarHBondContact O-N 2.84Å
211	I	74.5	Confident	70.2	Confident	126 Å²	126	118.8 Å²	118.8	65%	0.646	62%	0.623	S	S	*	*	H	α-helix	trans	-60.8	-43.3	175.6	-61.9	169.6	0	0	0	111	P207 Y209 L214 S215	P207-I211 PolarHBondContact O-N 2.8Å; Y209-I211 VanDerWaalsContact C-N 3.32Å; Y209-I211 PolarHBondContact O-N 3.4Å; I211-L214 PolarHBondContact O-N 3.38Å; I211-S215 PolarHBondContact O-N 3.44Å
212	Q	73.9	Confident	70.7	Confident	118 Å²	118	118 Å²	118	55%	0.551	61%	0.612	S	S	*	*	H	α-helix	trans	-65.9	-42.2	178.4	-67.7	179.7	27	0	0	111.6	Y209 E210 S215 L216	Y209-Q212 PolarHBondContact O-N 3.5Å; E210-Q212 VanDerWaalsContact C-N 3.34Å; E210-Q212 PolarHBondContact O-N 3.38Å; Q212-S215 PolarHBondContact O-N 3.42Å; Q212-S215 PolarHBondContact O-OG 2.98Å; Q212-L216 PolarHBondContact O-N 2.7Å
213	L	68.3	Low	71.5	Confident	83 Å²	83	119.9 Å²	119.9	44%	0.435	61%	0.613	S	S	.	*	H	α-helix	trans	-63.7	-44.1	176.8	-82.5	162.5	0	0	0	111.8	V205 Y209 E210 S215 L216 F217	V205-L213 HydrophobicContact CG1-CD1 3.92Å; V205-L213 HydrophobicContact CG2-CD1 4.41Å; Y209-L213 WeakPolarHBondContact O-CB 3.41Å; Y209-L213 PolarHBondContact O-N 2.89Å; E210-L213 PolarHBondContact O-N 2.98Å; L213-S215 VanDerWaalsContact C-N 3.26Å; L213-S215 PolarHBondContact O-N 3.03Å; L213-L216 HydrophobicContact CD2-CD1 4.49Å; L213-L216 WeakPolarHBondContact O-CB 3.23Å; L213-L216 PolarHBondContact O-N 3.34Å; L213-L216 VanDerWaalsContact O-N 3.15Å; L213-F217 VanDerWaalsContact O-CD2 3.25Å; L213-F217 WeakPolarHBondContact O-CD2 3.42Å
214	L	73.2	Confident	71.7	Confident	105 Å²	105	119.1 Å²	119.1	55%	0.55	61%	0.608	S	S	.	*	H	α-helix	trans	-62.9	-33.6	176.7	-72.6	172.1	0	0	0	112.3	E210 I211 L216 F217	E210-L214 HydrophobicContact CG-CD1 4.26Å; E210-L214 WeakPolarHBondContact O-CB 3.37Å; E210-L214 WeakPolarHBondContact O-CG 2.97Å; E210-L214 PolarHBondContact O-N 2.84Å; I211-L214 PolarHBondContact O-N 3.38Å; L214-L216 PolarHBondContact O-N 3.18Å; L214-F217 PolarHBondContact O-N 3.45Å
215	S	74.7	Confident	71.6	Confident	68 Å²	68	116 Å²	116	48%	0.476	59%	0.589	S	S	.	*	H	α-helix	trans	-66.1	-24.3	176.5	77.3	0	0	0	0	113.7	I211 Q212 L213 F217 Q218	I211-S215 PolarHBondContact O-N 3.44Å; Q212-S215 PolarHBondContact O-N 3.42Å; Q212-S215 PolarHBondContact O-OG 2.98Å; L213-S215 VanDerWaalsContact C-N 3.26Å; L213-S215 PolarHBondContact O-N 3.03Å; S215-F217 VanDerWaalsContact C-N 3.27Å; S215-F217 PolarHBondContact O-N 3.32Å; S215-Q218 PolarHBondContact O-N 3.05Å
216	L	70.5	Confident	71.6	Confident	134 Å²	134	120.4 Å²	120.4	70%	0.702	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-15.7	176.7	-65.6	171.1	0	0	0	113.3	Q212 L213 L214	Q212-L216 PolarHBondContact O-N 2.7Å; L213-L216 HydrophobicContact CD2-CD1 4.49Å; L213-L216 WeakPolarHBondContact O-CB 3.23Å; L213-L216 PolarHBondContact O-N 3.34Å; L213-L216 VanDerWaalsContact O-N 3.15Å; L214-L216 PolarHBondContact O-N 3.18Å
217	F	70.3	Confident	71.7	Confident	176 Å²	176	126.6 Å²	126.6	77%	0.772	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	4.6	178	-65.7	-77.6	0	0	0	113.5	L213 L214 S215	L213-F217 VanDerWaalsContact O-CD2 3.25Å; L213-F217 WeakPolarHBondContact O-CD2 3.42Å; L214-F217 PolarHBondContact O-N 3.45Å; S215-F217 VanDerWaalsContact C-N 3.27Å; S215-F217 PolarHBondContact O-N 3.32Å
218	Q	54.5	Low	71.4	Confident	226 Å²	226	129.5 Å²	129.5	100%	1.056	63%	0.627	S	S	*	*			trans	-91.6	0	169.5	-69.3	-173	2.9	0	0	110.6	S215	S215-Q218 PolarHBondContact O-N 3.05Å

Retrieved 218 of 218 residues in 70.4 ms (Link to these results)

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