A0A3Q0KGE6_SCHMA Loading...

Transmembrane protein 221

AlphaFold DB , UniProt , Accession A0A3Q0KGE6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 160 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	34.5	Very low	45	Very low	241 Å²	241	113.1 Å²	113.1	100%	1.187	69%	0.694	S	S	*	*				0	116.7	0	-84.9	145.8	106.9	0	0	107.2
2	G	44.7	Very low	44.9	Very low	72 Å²	72	118.5 Å²	118.5	74%	0.742	70%	0.701	S	S	*	*			trans	-68.7	140.2	-171.4	0	0	0	0	0	112	S4	G2-S4 VanDerWaalsContact C-N 3.32Å; G2-S4 PolarHBondContact O-N 2.68Å
3	N	42.1	Very low	44.8	Very low	148 Å²	148	114.4 Å²	114.4	79%	0.791	70%	0.699	S	S	*	*			trans	-64	87.9	173.7	-79.3	7.7	0	0	0	110	G5	N3-G5 PolarHBondContact O-N 2.97Å
4	S	51.1	Low	45.3	Very low	109 Å²	109	112.4 Å²	112.4	76%	0.762	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	17.7	168.2	52	0	0	0	0	112.8	G2	G2-S4 VanDerWaalsContact C-N 3.32Å; G2-S4 PolarHBondContact O-N 2.68Å
5	G	43.7	Very low	45.6	Very low	48 Å²	48	117.2 Å²	117.2	50%	0.495	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.2	-12.3	-174.2	0	0	0	0	0	116	N3	N3-G5 PolarHBondContact O-N 2.97Å
6	T	49.8	Very low	46.4	Very low	86 Å²	86	112.1 Å²	112.1	53%	0.528	66%	0.664	S	S	.	*	H	α-helix	trans	-85.6	-35.8	-172.9	49.4	0	0	0	0	113.4	L8 D10	T6-L8 PolarHBondContact O-N 2.8Å; T6-D10 PolarHBondContact O-N 3.29Å
7	C	50.7	Low	47	Very low	86 Å²	86	109.6 Å²	109.6	58%	0.581	65%	0.652	S	S	*	*	H	α-helix	trans	-72.2	-27.9	-174.7	-55.8	0	0	0	0	114.2	C11	C7-C11 WeakPolarHBondContact O-CB 3.33Å; C7-C11 PolarHBondContact O-N 3.04Å
8	L	41.5	Very low	47.7	Very low	112 Å²	112	106.7 Å²	106.7	59%	0.586	63%	0.631	S	S	*	*	H	α-helix	trans	-77.3	-39.9	-179.8	-78.7	170.6	0	0	0	112.2	T6 D10 C11 F12	T6-L8 PolarHBondContact O-N 2.8Å; L8-D10 VanDerWaalsContact C-N 3.33Å; L8-D10 PolarHBondContact O-N 3.04Å; L8-C11 PolarHBondContact O-N 2.79Å; L8-F12 WeakPolarHBondContact O-CD2 3.38Å; L8-F12 PolarHBondContact O-N 2.88Å; L8-F12 VanDerWaalsContact O-N 3.16Å
9	N	42.1	Very low	48.5	Very low	129 Å²	129	107.5 Å²	107.5	69%	0.69	63%	0.625	S	S	*	*	H	α-helix	trans	-68.7	-32.7	178	-80.9	3.4	0	0	0	112.2	C11	N9-C11 VanDerWaalsContact C-N 3.34Å
10	D	49.7	Very low	49.5	Very low	118 Å²	118	105.1 Å²	105.1	63%	0.631	61%	0.612	S	S	*	*	H	α-helix	trans	-71.1	-28.9	171.9	-73.4	-27.4	0	0	0	112.5	T6 L8 V14	T6-D10 PolarHBondContact O-N 3.29Å; L8-D10 VanDerWaalsContact C-N 3.33Å; L8-D10 PolarHBondContact O-N 3.04Å; D10-V14 VanDerWaalsContact O-CG2 3.28Å; D10-V14 WeakPolarHBondContact O-CG2 3.08Å
11	C	44.8	Very low	50.5	Low	95 Å²	95	105.7 Å²	105.7	64%	0.642	61%	0.612	S	S	*	*	H	α-helix	trans	-77.2	-31	179.1	-102.4	0	0	0	0	114.2	C7 L8 N9	C7-C11 WeakPolarHBondContact O-CB 3.33Å; C7-C11 PolarHBondContact O-N 3.04Å; L8-C11 PolarHBondContact O-N 2.79Å; N9-C11 VanDerWaalsContact C-N 3.34Å
12	F	44.1	Very low	52.3	Low	178 Å²	178	98.8 Å²	98.8	78%	0.781	58%	0.576	S	S	*	*	H	α-helix	trans	-78.8	-27.9	-179.3	-85.9	-73.1	0	0	0	113.5	L8	L8-F12 WeakPolarHBondContact O-CD2 3.38Å; L8-F12 PolarHBondContact O-N 2.88Å; L8-F12 VanDerWaalsContact O-N 3.16Å
13	G	44	Very low	53.7	Low	65 Å²	65	97.6 Å²	97.6	67%	0.67	56%	0.558	S	S	*	*	H	α-helix	trans	-82.4	-22.3	178.1	0	0	0	0	0	114.1	Y15	G13-Y15 PolarHBondContact O-N 2.82Å
14	V	51.1	Low	55.4	Low	86 Å²	86	95.2 Å²	95.2	52%	0.521	55%	0.545	S	S	.	.	S	Bend	trans	-99.4	94.1	-179.5	-176.2	0	0	0	0	107.3	D10 A16	D10-V14 VanDerWaalsContact O-CG2 3.28Å; D10-V14 WeakPolarHBondContact O-CG2 3.08Å; V14-A16 PolarHBondContact O-N 3.26Å
15	Y	49.8	Very low	56.4	Low	185 Å²	185	91.3 Å²	91.3	73%	0.725	52%	0.517	S	S	*	.			trans	-43.1	115.8	153.5	-87.2	-92.4	0	0	0	106.1	G13 V20	G13-Y15 PolarHBondContact O-N 2.82Å; Y15-V20 HydrophobicContact CG-CG2 4.31Å; Y15-V20 WeakPolarHBondContact O-CG2 3.35Å
16	A	59.4	Low	58	Low	35 Å²	35	93.7 Å²	93.7	29%	0.289	51%	0.514	S	S	.	.			trans	-41.6	123.8	-173.5	0	0	0	0	0	108.1	V14 E18 K19 V20	V14-A16 PolarHBondContact O-N 3.26Å; A16-E18 HydrophobicContact CB-CG 3.74Å; A16-E18 CarbonylContact O-C 3.58Å; A16-E18 PolarHBondContact O-N 3.4Å; A16-K19 HydrophobicContact CB-CG 4.42Å; A16-K19 WeakPolarHBondContact O-CB 3.35Å; A16-K19 PolarHBondContact O-N 3.37Å; A16-V20 PolarHBondContact O-N 3.19Å
17	P	56.9	Low	59.3	Low	71 Å²	71	93.3 Å²	93.3	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-55.2	-28.2	-164.9	18.9	-32.2	0	0	0	111.7	K19 V20 L21	P17-K19 PolarHBondContact O-N 3.07Å; P17-V20 PolarHBondContact O-N 3.49Å; P17-L21 VanDerWaalsContact O-CB 3.28Å; P17-L21 WeakPolarHBondContact O-CB 3.49Å; P17-L21 WeakPolarHBondContact O-CD1 3.43Å; P17-L21 VanDerWaalsContact O-CG 3.3Å; P17-L21 WeakPolarHBondContact O-CG 3.42Å; P17-L21 PolarHBondContact O-N 3.44Å
18	E	59.1	Low	60.7	Low	57 Å²	57	93 Å²	93	27%	0.266	51%	0.51	S	S	.	.	H	α-helix	trans	-51.7	-45.1	168.9	62.8	-177.9	-166.4	0	0	114.2	A16 F22 R85	A16-E18 HydrophobicContact CB-CG 3.74Å; A16-E18 CarbonylContact O-C 3.58Å; A16-E18 PolarHBondContact O-N 3.4Å; E18-F22 WeakPolarHBondContact O-CB 3.38Å; E18-F22 PolarHBondContact O-N 3.02Å; E18-R85 IonicContact OE1-NH1 3.31Å; E18-R85 PolarHBondContact OE1-NH1 3.26Å
19	K	63.1	Low	62.5	Low	122 Å²	122	88.9 Å²	88.9	53%	0.53	49%	0.489	S	S	.	.	H	α-helix	trans	-73.1	-38.6	-178.8	-63.6	-174.4	-179	179.1	0	111.2	A16 P17 A23	A16-K19 HydrophobicContact CB-CG 4.42Å; A16-K19 WeakPolarHBondContact O-CB 3.35Å; A16-K19 PolarHBondContact O-N 3.37Å; P17-K19 PolarHBondContact O-N 3.07Å; K19-A23 VanDerWaalsContact O-CB 3.27Å; K19-A23 WeakPolarHBondContact O-CB 3.43Å; K19-A23 PolarHBondContact O-N 2.9Å
20	V	68.6	Low	64.3	Low	59 Å²	59	86.6 Å²	86.6	36%	0.358	48%	0.477	S	S	.	.	H	α-helix	trans	-68.5	-47.6	178	-177.7	0	0	0	0	110.1	Y15 A16 P17 F22 A23 I24	Y15-V20 HydrophobicContact CG-CG2 4.31Å; Y15-V20 WeakPolarHBondContact O-CG2 3.35Å; A16-V20 PolarHBondContact O-N 3.19Å; P17-V20 PolarHBondContact O-N 3.49Å; V20-F22 VanDerWaalsContact C-N 3.31Å; V20-F22 PolarHBondContact O-N 3.28Å; V20-A23 PolarHBondContact O-N 3.48Å; V20-I24 HydrophobicContact CG1-CD1 3.62Å; V20-I24 HydrophobicContact CG1-CG1 4.23Å; V20-I24 WeakPolarHBondContact O-CB 3.24Å; V20-I24 VanDerWaalsContact O-CG1 3.28Å; V20-I24 WeakPolarHBondContact O-CG1 3.43Å; V20-I24 PolarHBondContact O-N 2.96Å
21	L	70.6	Confident	65.8	Low	118 Å²	118	86.2 Å²	86.2	62%	0.618	47%	0.474	S	S	*	.	H	α-helix	trans	-59.7	-43	175.3	-77	163.9	0	0	0	111.3	P17 S25	P17-L21 VanDerWaalsContact O-CB 3.28Å; P17-L21 WeakPolarHBondContact O-CB 3.49Å; P17-L21 WeakPolarHBondContact O-CD1 3.43Å; P17-L21 VanDerWaalsContact O-CG 3.3Å; P17-L21 WeakPolarHBondContact O-CG 3.42Å; P17-L21 PolarHBondContact O-N 3.44Å; L21-S25 WeakPolarHBondContact O-CB 3.48Å; L21-S25 PolarHBondContact O-N 3.1Å
22	F	72.2	Confident	67.5	Low	96 Å²	96	83 Å²	83	42%	0.421	46%	0.457	S	S	.	.	H	α-helix	trans	-61.1	-47.3	174.4	-174.7	-93.2	0	0	0	111.8	E18 V20 S25 F26 I74 V78	E18-F22 WeakPolarHBondContact O-CB 3.38Å; E18-F22 PolarHBondContact O-N 3.02Å; V20-F22 VanDerWaalsContact C-N 3.31Å; V20-F22 PolarHBondContact O-N 3.28Å; F22-S25 PolarHBondContact O-N 3.14Å; F22-F26 VanDerWaalsContact O-CB 3.27Å; F22-F26 WeakPolarHBondContact O-CB 3.34Å; F22-F26 PolarHBondContact O-N 3.49Å; F22-I74 HydrophobicContact CD2-CG2 3.45Å; F22-I74 VanDerWaalsContact CD2-CG2 3.45Å; F22-I74 HydrophobicContact CE2-CG2 3.74Å; F22-V78 HydrophobicContact CD2-CG2 4.07Å
23	A	74.3	Confident	69.2	Low	46 Å²	46	79.6 Å²	79.6	38%	0.38	44%	0.442	S	S	.	.	H	α-helix	trans	-64	-47.6	180	0	0	0	0	0	112.1	K19 V20 S25 F26 C27	K19-A23 VanDerWaalsContact O-CB 3.27Å; K19-A23 WeakPolarHBondContact O-CB 3.43Å; K19-A23 PolarHBondContact O-N 2.9Å; V20-A23 PolarHBondContact O-N 3.48Å; A23-S25 VanDerWaalsContact C-N 3.32Å; A23-S25 PolarHBondContact O-N 2.88Å; A23-F26 PolarHBondContact O-N 2.8Å; A23-C27 WeakPolarHBondContact O-CB 3.44Å; A23-C27 PolarHBondContact O-N 3.32Å; A23-C27 PolarHBondContact O-SG 2.99Å
24	I	76.1	Confident	70.9	Confident	99 Å²	99	80.8 Å²	80.8	51%	0.508	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-42.9	176.8	-66	171	0	0	0	110.1	V20 F26 C27 T28	V20-I24 HydrophobicContact CG1-CD1 3.62Å; V20-I24 HydrophobicContact CG1-CG1 4.23Å; V20-I24 WeakPolarHBondContact O-CB 3.24Å; V20-I24 VanDerWaalsContact O-CG1 3.28Å; V20-I24 WeakPolarHBondContact O-CG1 3.43Å; V20-I24 PolarHBondContact O-N 2.96Å; I24-F26 VanDerWaalsContact C-N 3.33Å; I24-F26 PolarHBondContact O-N 3.37Å; I24-C27 PolarHBondContact O-N 3.44Å; I24-T28 HydrophobicContact CG2-CG2 4.35Å; I24-T28 WeakPolarHBondContact O-CB 3.11Å; I24-T28 VanDerWaalsContact O-CG2 3.32Å; I24-T28 WeakPolarHBondContact O-CG2 3.3Å; I24-T28 PolarHBondContact O-N 3.47Å; I24-T28 PolarHBondContact O-OG1 3.3Å
25	S	72.5	Confident	72.3	Confident	26 Å²	26	81.8 Å²	81.8	18%	0.182	44%	0.438	C	S	.	.	H	α-helix	trans	-64.3	-39.2	177.1	-169.7	0	0	0	0	112.1	L21 F22 A23 T28 V29 I74	L21-S25 WeakPolarHBondContact O-CB 3.48Å; L21-S25 PolarHBondContact O-N 3.1Å; F22-S25 PolarHBondContact O-N 3.14Å; A23-S25 VanDerWaalsContact C-N 3.32Å; A23-S25 PolarHBondContact O-N 2.88Å; S25-T28 VanDerWaalsContact CA-OG1 3.31Å; S25-T28 WeakPolarHBondContact CA-OG1 3.29Å; S25-T28 PolarHBondContact O-OG1 2.77Å; S25-V29 VanDerWaalsContact O-CG2 3.25Å; S25-V29 WeakPolarHBondContact O-CG2 3.49Å; S25-V29 PolarHBondContact O-N 3.33Å; S25-V29 VanDerWaalsContact O-N 3.07Å; S25-I74 WeakPolarHBondContact OG-CD1 3.27Å
26	F	78.7	Confident	73.7	Confident	98 Å²	98	75.6 Å²	75.6	43%	0.43	42%	0.417	S	S	.	.	H	α-helix	trans	-66.2	-45.4	175.7	-179	-104	0	0	0	111.2	F22 A23 I24 T28 V29 L30	F22-F26 VanDerWaalsContact O-CB 3.27Å; F22-F26 WeakPolarHBondContact O-CB 3.34Å; F22-F26 PolarHBondContact O-N 3.49Å; A23-F26 PolarHBondContact O-N 2.8Å; I24-F26 VanDerWaalsContact C-N 3.33Å; I24-F26 PolarHBondContact O-N 3.37Å; F26-T28 PolarHBondContact O-N 3.49Å; F26-V29 PolarHBondContact O-N 3.43Å; F26-L30 HydrophobicContact CD1-CD1 3.78Å; F26-L30 HydrophobicContact CD1-CG 4.38Å; F26-L30 HydrophobicContact CE1-CD1 3.27Å; F26-L30 HydrophobicContact CE1-CG 4.06Å; F26-L30 HydrophobicContact CE2-CD1 4.48Å; F26-L30 HydrophobicContact CE2-CG 4.48Å; F26-L30 HydrophobicContact CZ-CD1 3.68Å; F26-L30 HydrophobicContact CZ-CD2 4.33Å; F26-L30 HydrophobicContact CZ-CG 4.11Å; F26-L30 WeakPolarHBondContact O-CG 3.45Å; F26-L30 PolarHBondContact O-N 2.92Å
27	C	76.5	Confident	74.7	Confident	79 Å²	79	77.6 Å²	77.6	53%	0.534	42%	0.422	S	S	.	.	H	α-helix	trans	-60.9	-41.6	176.5	-70.6	0	0	0	0	112.4	A23 I24 L30 L31	A23-C27 WeakPolarHBondContact O-CB 3.44Å; A23-C27 PolarHBondContact O-N 3.32Å; A23-C27 PolarHBondContact O-SG 2.99Å; I24-C27 PolarHBondContact O-N 3.44Å; C27-L30 PolarHBondContact O-N 2.79Å; C27-L31 WeakPolarHBondContact O-CB 3.39Å; C27-L31 PolarHBondContact O-N 2.83Å
28	T	79.3	Confident	75.6	Confident	79 Å²	79	76.4 Å²	76.4	49%	0.485	42%	0.415	S	S	.	.	H	α-helix	trans	-68.3	-38.6	178.1	48.1	0	0	0	0	112.2	I24 S25 F26 L31 G32	I24-T28 HydrophobicContact CG2-CG2 4.35Å; I24-T28 WeakPolarHBondContact O-CB 3.11Å; I24-T28 VanDerWaalsContact O-CG2 3.32Å; I24-T28 WeakPolarHBondContact O-CG2 3.3Å; I24-T28 PolarHBondContact O-N 3.47Å; I24-T28 PolarHBondContact O-OG1 3.3Å; S25-T28 VanDerWaalsContact CA-OG1 3.31Å; S25-T28 WeakPolarHBondContact CA-OG1 3.29Å; S25-T28 PolarHBondContact O-OG1 2.77Å; F26-T28 PolarHBondContact O-N 3.49Å; T28-L31 PolarHBondContact O-N 2.87Å; T28-G32 PolarHBondContact O-N 3.39Å
29	V	79.8	Confident	76.4	Confident	25 Å²	25	75.5 Å²	75.5	15%	0.152	42%	0.421	C	S	.	.	H	α-helix	trans	-62.6	-46	172.4	170.2	0	0	0	0	111.1	S25 F26 L31 G32 F33 C67 L70	S25-V29 VanDerWaalsContact O-CG2 3.25Å; S25-V29 WeakPolarHBondContact O-CG2 3.49Å; S25-V29 PolarHBondContact O-N 3.33Å; S25-V29 VanDerWaalsContact O-N 3.07Å; F26-V29 PolarHBondContact O-N 3.43Å; V29-L31 PolarHBondContact O-N 3.33Å; V29-G32 PolarHBondContact O-N 3.46Å; V29-F33 WeakPolarHBondContact O-CB 3.16Å; V29-F33 PolarHBondContact O-N 2.79Å; V29-C67 HydrophobicContact CG1-CB 4.41Å; V29-L70 HydrophobicContact CG2-CD2 3.33Å
30	L	79.9	Confident	77	Confident	81 Å²	81	71.4 Å²	71.4	42%	0.424	41%	0.406	S	S	.	.	H	α-helix	trans	-61.3	-44.1	176.3	-74.4	-179.4	0	0	0	111.8	F26 C27 G32 F33 V34	F26-L30 HydrophobicContact CD1-CD1 3.78Å; F26-L30 HydrophobicContact CD1-CG 4.38Å; F26-L30 HydrophobicContact CE1-CD1 3.27Å; F26-L30 HydrophobicContact CE1-CG 4.06Å; F26-L30 HydrophobicContact CE2-CD1 4.48Å; F26-L30 HydrophobicContact CE2-CG 4.48Å; F26-L30 HydrophobicContact CZ-CD1 3.68Å; F26-L30 HydrophobicContact CZ-CD2 4.33Å; F26-L30 HydrophobicContact CZ-CG 4.11Å; F26-L30 WeakPolarHBondContact O-CG 3.45Å; F26-L30 PolarHBondContact O-N 2.92Å; C27-L30 PolarHBondContact O-N 2.79Å; L30-G32 VanDerWaalsContact C-N 3.35Å; L30-G32 PolarHBondContact O-N 2.87Å; L30-F33 WeakPolarHBondContact O-CB 3.2Å; L30-F33 PolarHBondContact O-N 3.04Å; L30-V34 WeakPolarHBondContact O-CG2 3.43Å; L30-V34 PolarHBondContact O-N 3.34Å
31	L	80.5	Confident	77.2	Confident	111 Å²	111	71.4 Å²	71.4	58%	0.581	41%	0.408	S	S	*	.	H	α-helix	trans	-61.7	-44.4	177	-168.6	77.6	0	0	0	111.1	C27 T28 V29 F33 V34 L35	C27-L31 WeakPolarHBondContact O-CB 3.39Å; C27-L31 PolarHBondContact O-N 2.83Å; T28-L31 PolarHBondContact O-N 2.87Å; V29-L31 PolarHBondContact O-N 3.33Å; L31-F33 VanDerWaalsContact C-N 3.31Å; L31-F33 PolarHBondContact O-N 2.94Å; L31-V34 PolarHBondContact O-N 3.37Å; L31-L35 HydrophobicContact CG-CD1 4.48Å; L31-L35 WeakPolarHBondContact O-CG 3.36Å; L31-L35 PolarHBondContact O-N 2.7Å
32	G	80.5	Confident	77.3	Confident	27 Å²	27	71.3 Å²	71.3	28%	0.278	41%	0.407	S	S	.	.	H	α-helix	trans	-59.2	-42	174.8	0	0	0	0	0	112.2	T28 V29 L30 L35 I36	T28-G32 PolarHBondContact O-N 3.39Å; V29-G32 PolarHBondContact O-N 3.46Å; L30-G32 VanDerWaalsContact C-N 3.35Å; L30-G32 PolarHBondContact O-N 2.87Å; G32-L35 PolarHBondContact O-N 3.43Å; G32-I36 WeakPolarHBondContact O-CD1 3.36Å; G32-I36 VanDerWaalsContact O-CG1 3.28Å; G32-I36 WeakPolarHBondContact O-CG1 3.21Å; G32-I36 PolarHBondContact O-N 3.2Å
33	F	80.1	Confident	77.2	Confident	107 Å²	107	67.7 Å²	67.7	47%	0.469	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-44.6	176.7	-170.6	-107.8	0	0	0	112.4	V29 L30 L31 L35 I36 I37	V29-F33 WeakPolarHBondContact O-CB 3.16Å; V29-F33 PolarHBondContact O-N 2.79Å; L30-F33 WeakPolarHBondContact O-CB 3.2Å; L30-F33 PolarHBondContact O-N 3.04Å; L31-F33 VanDerWaalsContact C-N 3.31Å; L31-F33 PolarHBondContact O-N 2.94Å; F33-L35 VanDerWaalsContact C-N 3.32Å; F33-L35 PolarHBondContact O-N 3.03Å; F33-I36 PolarHBondContact O-N 3.5Å; F33-I37 HydrophobicContact CD1-CD1 3.63Å; F33-I37 HydrophobicContact CE1-CD1 3.22Å; F33-I37 HydrophobicContact CE1-CG1 4.29Å; F33-I37 HydrophobicContact CE2-CD1 4.46Å; F33-I37 HydrophobicContact CG-CD1 4.41Å; F33-I37 HydrophobicContact CZ-CD1 3.69Å; F33-I37 HydrophobicContact CZ-CG1 4.43Å; F33-I37 WeakPolarHBondContact O-CG1 3.3Å; F33-I37 PolarHBondContact O-N 2.93Å
34	V	79.9	Confident	76.8	Confident	89 Å²	89	70.9 Å²	70.9	54%	0.539	40%	0.402	S	S	.	.	H	α-helix	trans	-61.1	-42.3	174.9	172.2	0	0	0	0	110.9	L30 L31 I36 I37 S38	L30-V34 WeakPolarHBondContact O-CG2 3.43Å; L30-V34 PolarHBondContact O-N 3.34Å; L31-V34 PolarHBondContact O-N 3.37Å; V34-I36 PolarHBondContact O-N 3.23Å; V34-I37 PolarHBondContact O-N 3.31Å; V34-S38 WeakPolarHBondContact O-CB 3.4Å; V34-S38 PolarHBondContact O-N 3.27Å; V34-S38 PolarHBondContact O-OG 2.82Å
35	L	80.8	Confident	76.4	Confident	107 Å²	107	73.1 Å²	73.1	56%	0.56	41%	0.414	S	S	*	.	H	α-helix	trans	-62.8	-42.7	177.6	-74	172.4	0	0	0	111.9	L31 G32 F33 S38 G39	L31-L35 HydrophobicContact CG-CD1 4.48Å; L31-L35 WeakPolarHBondContact O-CG 3.36Å; L31-L35 PolarHBondContact O-N 2.7Å; G32-L35 PolarHBondContact O-N 3.43Å; F33-L35 VanDerWaalsContact C-N 3.32Å; F33-L35 PolarHBondContact O-N 3.03Å; L35-S38 WeakPolarHBondContact CA-OG 3.32Å; L35-S38 PolarHBondContact O-N 2.86Å; L35-S38 PolarHBondContact O-OG 2.87Å; L35-G39 PolarHBondContact O-N 3.07Å
36	I	79.5	Confident	76	Confident	56 Å²	56	75 Å²	75	29%	0.287	43%	0.427	S	S	.	.	H	α-helix	trans	-61.7	-48.6	176.2	-67.1	157.3	0	0	0	110.5	G32 F33 V34 S38 G39 V40 V60 A63	G32-I36 WeakPolarHBondContact O-CD1 3.36Å; G32-I36 VanDerWaalsContact O-CG1 3.28Å; G32-I36 WeakPolarHBondContact O-CG1 3.21Å; G32-I36 PolarHBondContact O-N 3.2Å; F33-I36 PolarHBondContact O-N 3.5Å; V34-I36 PolarHBondContact O-N 3.23Å; I36-S38 VanDerWaalsContact C-N 3.33Å; I36-S38 PolarHBondContact O-N 3.15Å; I36-G39 PolarHBondContact O-N 2.97Å; I36-V40 WeakPolarHBondContact O-CG2 3.48Å; I36-V40 PolarHBondContact O-N 2.93Å; I36-V60 HydrophobicContact CG2-CG2 4.38Å; I36-A63 HydrophobicContact CD1-CB 3.4Å; I36-A63 HydrophobicContact CG1-CB 4.43Å
37	I	79.3	Confident	75.2	Confident	77 Å²	77	79.7 Å²	79.7	40%	0.395	45%	0.45	S	S	.	.	H	α-helix	trans	-59.6	-47.4	177.6	-68.9	172	0	0	0	110.1	F33 V34 G39 V40 C41	F33-I37 HydrophobicContact CD1-CD1 3.63Å; F33-I37 HydrophobicContact CE1-CD1 3.22Å; F33-I37 HydrophobicContact CE1-CG1 4.29Å; F33-I37 HydrophobicContact CE2-CD1 4.46Å; F33-I37 HydrophobicContact CG-CD1 4.41Å; F33-I37 HydrophobicContact CZ-CD1 3.69Å; F33-I37 HydrophobicContact CZ-CG1 4.43Å; F33-I37 WeakPolarHBondContact O-CG1 3.3Å; F33-I37 PolarHBondContact O-N 2.93Å; V34-I37 PolarHBondContact O-N 3.31Å; I37-G39 VanDerWaalsContact C-N 3.3Å; I37-G39 PolarHBondContact O-N 3.39Å; I37-V40 PolarHBondContact O-N 2.89Å; I37-C41 WeakPolarHBondContact O-CB 3.37Å; I37-C41 PolarHBondContact O-N 2.81Å; I37-C41 PolarHBondContact O-SG 2.68Å
38	S	77.1	Confident	74.3	Confident	46 Å²	46	78 Å²	78	32%	0.322	45%	0.446	S	S	.	.	H	α-helix	trans	-60.4	-40.8	179.2	73.9	0	0	0	0	111.8	V34 L35 I36 C41 I42	V34-S38 WeakPolarHBondContact O-CB 3.4Å; V34-S38 PolarHBondContact O-N 3.27Å; V34-S38 PolarHBondContact O-OG 2.82Å; L35-S38 WeakPolarHBondContact CA-OG 3.32Å; L35-S38 PolarHBondContact O-N 2.86Å; L35-S38 PolarHBondContact O-OG 2.87Å; I36-S38 VanDerWaalsContact C-N 3.33Å; I36-S38 PolarHBondContact O-N 3.15Å; S38-C41 PolarHBondContact O-N 3.42Å; S38-I42 WeakPolarHBondContact O-CB 3.49Å; S38-I42 WeakPolarHBondContact O-CD1 3.36Å; S38-I42 WeakPolarHBondContact O-CG1 3.24Å; S38-I42 PolarHBondContact O-N 3.31Å
39	G	75.3	Confident	73.1	Confident	38 Å²	38	77.9 Å²	77.9	39%	0.392	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-40.4	176.4	0	0	0	0	0	112.3	L35 I36 I37 A43	L35-G39 PolarHBondContact O-N 3.07Å; I36-G39 PolarHBondContact O-N 2.97Å; I37-G39 VanDerWaalsContact C-N 3.3Å; I37-G39 PolarHBondContact O-N 3.39Å; G39-A43 VanDerWaalsContact O-CB 3.25Å; G39-A43 WeakPolarHBondContact O-CB 3.36Å; G39-A43 PolarHBondContact O-N 3.28Å
40	V	74.8	Confident	72.1	Confident	35 Å²	35	85 Å²	85	21%	0.212	47%	0.474	C	S	.	.	H	α-helix	trans	-65.5	-44.9	173.9	174.1	0	0	0	0	110.9	I36 I37 I42 A43 Q44 V60	I36-V40 WeakPolarHBondContact O-CG2 3.48Å; I36-V40 PolarHBondContact O-N 2.93Å; I37-V40 PolarHBondContact O-N 2.89Å; V40-I42 PolarHBondContact O-N 3.43Å; V40-A43 PolarHBondContact O-N 2.78Å; V40-Q44 WeakPolarHBondContact O-CG 3.43Å; V40-Q44 PolarHBondContact O-N 3.26Å; V40-V60 HydrophobicContact CG2-CG2 4.17Å
41	C	73.5	Confident	70.8	Confident	60 Å²	60	84.8 Å²	84.8	41%	0.405	48%	0.483	S	S	.	.	H	α-helix	trans	-62.6	-43	177.8	-67.9	0	0	0	0	112	I37 S38 Q44 L45	I37-C41 WeakPolarHBondContact O-CB 3.37Å; I37-C41 PolarHBondContact O-N 2.81Å; I37-C41 PolarHBondContact O-SG 2.68Å; S38-C41 PolarHBondContact O-N 3.42Å; C41-Q44 PolarHBondContact O-N 3.3Å; C41-L45 PolarHBondContact O-N 3.48Å
42	I	73.6	Confident	69.6	Low	115 Å²	115	84.4 Å²	84.4	59%	0.59	48%	0.478	S	S	*	.	H	α-helix	trans	-64.1	-43.3	176.2	-67.6	163.7	0	0	0	110.4	S38 V40 Q44 L45 S46	S38-I42 WeakPolarHBondContact O-CB 3.49Å; S38-I42 WeakPolarHBondContact O-CD1 3.36Å; S38-I42 WeakPolarHBondContact O-CG1 3.24Å; S38-I42 PolarHBondContact O-N 3.31Å; V40-I42 PolarHBondContact O-N 3.43Å; I42-Q44 VanDerWaalsContact C-N 3.26Å; I42-Q44 PolarHBondContact O-N 3.48Å; I42-L45 PolarHBondContact O-N 3.4Å; I42-S46 PolarHBondContact O-N 3.16Å; I42-S46 PolarHBondContact O-OG 2.97Å
43	A	68.6	Low	68.4	Low	20 Å²	20	87 Å²	87	17%	0.165	49%	0.485	C	S	.	.	H	α-helix	trans	-67.1	-25	178.3	0	0	0	0	0	113.5	G39 V40	G39-A43 VanDerWaalsContact O-CB 3.25Å; G39-A43 WeakPolarHBondContact O-CB 3.36Å; G39-A43 PolarHBondContact O-N 3.28Å; V40-A43 PolarHBondContact O-N 2.78Å
44	Q	67	Low	67.3	Low	113 Å²	113	85.7 Å²	85.7	53%	0.528	49%	0.49	S	S	.	.	H	α-helix	trans	-80.9	-32.2	171.6	-72.7	179.1	8.5	0	0	112.3	V40 C41 I42	V40-Q44 WeakPolarHBondContact O-CG 3.43Å; V40-Q44 PolarHBondContact O-N 3.26Å; C41-Q44 PolarHBondContact O-N 3.3Å; I42-Q44 VanDerWaalsContact C-N 3.26Å; I42-Q44 PolarHBondContact O-N 3.48Å
45	L	68	Low	66.3	Low	147 Å²	147	86.9 Å²	86.9	77%	0.77	49%	0.492	S	S	*	.	H	α-helix	trans	-73	-36.2	177.5	-115.8	87.7	0	0	0	112.6	C41 I42 E47	C41-L45 PolarHBondContact O-N 3.48Å; I42-L45 PolarHBondContact O-N 3.4Å; L45-E47 PolarHBondContact O-N 3.35Å
46	S	63.7	Low	65.4	Low	64 Å²	64	83 Å²	83	45%	0.448	47%	0.474	S	S	.	.	S	Bend	trans	-73.4	116.5	169.7	56.9	0	0	0	0	107.9	I42 G48	I42-S46 PolarHBondContact O-N 3.16Å; I42-S46 PolarHBondContact O-OG 2.97Å; S46-G48 PolarHBondContact O-N 2.87Å
47	E	61.2	Low	64.7	Low	197 Å²	197	89.6 Å²	89.6	92%	0.921	50%	0.497	S	S	*	.	S	Bend	trans	-60.4	13.5	-170.8	-64	171.7	151.3	0	0	115.6	L45 L49	L45-E47 PolarHBondContact O-N 3.35Å; E47-L49 PolarHBondContact O-N 3.11Å
48	G	58.4	Low	64	Low	44 Å²	44	88.3 Å²	88.3	45%	0.454	50%	0.497	S	S	.	.			trans	-83.6	40	173	0	0	0	0	0	114.3	S46 H50 A51	S46-G48 PolarHBondContact O-N 2.87Å; G48-H50 PolarHBondContact O-N 3.17Å; G48-A51 PolarHBondContact O-N 3.2Å
49	L	54.3	Low	63.5	Low	77 Å²	77	88.5 Å²	88.5	40%	0.403	50%	0.502	S	S	.	.	H	α-helix	trans	-51.4	-35.2	-169.6	-159.4	74.2	0	0	0	113.4	E47 L53	E47-L49 PolarHBondContact O-N 3.11Å; L49-L53 HydrophobicContact CG-CD1 3.98Å; L49-L53 HydrophobicContact CG-CG 4.5Å; L49-L53 WeakPolarHBondContact O-CB 3.41Å; L49-L53 WeakPolarHBondContact O-CD1 3.45Å; L49-L53 WeakPolarHBondContact O-CG 3.5Å
50	H	57.5	Low	63.3	Low	174 Å²	174	90 Å²	90	81%	0.806	50%	0.503	S	S	*	.	H	α-helix	trans	-80.5	-28.1	-170.5	-66.4	-63	0	0	0	115.6	G48	G48-H50 PolarHBondContact O-N 3.17Å
51	A	54.3	Low	63.1	Low	76 Å²	76	91.7 Å²	91.7	63%	0.628	52%	0.515	S	S	*	.	H	α-helix	trans	-89.4	-30.3	-177.8	0	0	0	0	0	112.7	G48 S54	G48-A51 PolarHBondContact O-N 3.2Å; A51-S54 PolarHBondContact O-OG 3.5Å
52	H	54.6	Low	63.2	Low	103 Å²	103	94.6 Å²	94.6	48%	0.477	53%	0.525	S	S	.	.	H	α-helix	trans	-91.5	-14.7	-175.4	-95.6	-87.2	0	0	0	114.8	S54 S56	H52-S54 VanDerWaalsContact C-N 3.33Å; H52-S54 PolarHBondContact O-N 2.9Å; H52-S56 PolarHBondContact O-N 2.87Å; H52-S56 VanDerWaalsContact O-N 3.13Å; H52-S56 PolarHBondContact O-OG 3.46Å
53	L	54.1	Low	63.2	Low	81 Å²	81	90.6 Å²	90.6	42%	0.424	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-34.6	178.6	-85.5	171.2	0	0	0	112.8	L49 S56 Y57	L49-L53 HydrophobicContact CG-CD1 3.98Å; L49-L53 HydrophobicContact CG-CG 4.5Å; L49-L53 WeakPolarHBondContact O-CB 3.41Å; L49-L53 WeakPolarHBondContact O-CD1 3.45Å; L49-L53 WeakPolarHBondContact O-CG 3.5Å; L53-S56 WeakPolarHBondContact CA-OG 3.42Å; L53-S56 PolarHBondContact O-OG 3.29Å; L53-Y57 WeakPolarHBondContact O-CB 3.26Å; L53-Y57 PolarHBondContact O-N 2.74Å
54	S	57.8	Low	63.6	Low	81 Å²	81	96.1 Å²	96.1	57%	0.566	53%	0.529	S	S	*	.	H	α-helix	trans	-67.9	-42.9	-179.3	59.9	0	0	0	0	112.7	A51 H52 A58	A51-S54 PolarHBondContact O-OG 3.5Å; H52-S54 VanDerWaalsContact C-N 3.33Å; H52-S54 PolarHBondContact O-N 2.9Å; S54-A58 PolarHBondContact O-N 3.48Å
55	I	58.4	Low	64	Low	114 Å²	114	93.2 Å²	93.2	59%	0.585	53%	0.525	S	S	*	.	H	α-helix	trans	-71.5	-45.6	-179.8	-67.7	167.5	0	0	0	110.7	Y57 A58 A59	I55-Y57 VanDerWaalsContact C-N 3.34Å; I55-Y57 PolarHBondContact O-N 2.96Å; I55-A58 PolarHBondContact O-N 2.85Å; I55-A59 VanDerWaalsContact O-CB 3.32Å; I55-A59 WeakPolarHBondContact O-CB 3.43Å; I55-A59 PolarHBondContact O-N 3.22Å
56	S	62.6	Low	64.4	Low	26 Å²	26	87.9 Å²	87.9	18%	0.182	51%	0.506	C	S	.	.	H	α-helix	trans	-63.9	-40.2	178.3	53.9	0	0	0	0	111.6	H52 L53 A58 A59 V60	H52-S56 PolarHBondContact O-N 2.87Å; H52-S56 VanDerWaalsContact O-N 3.13Å; H52-S56 PolarHBondContact O-OG 3.46Å; L53-S56 WeakPolarHBondContact CA-OG 3.42Å; L53-S56 PolarHBondContact O-OG 3.29Å; S56-A58 VanDerWaalsContact C-N 3.32Å; S56-A58 PolarHBondContact O-N 2.98Å; S56-A59 PolarHBondContact O-N 3.12Å; S56-V60 VanDerWaalsContact O-CG2 3.22Å; S56-V60 WeakPolarHBondContact O-CG2 3.47Å; S56-V60 PolarHBondContact O-N 3.37Å; S56-V60 VanDerWaalsContact O-N 3.1Å
57	Y	63.9	Low	65.1	Low	194 Å²	194	86.3 Å²	86.3	76%	0.761	49%	0.494	S	S	*	.	H	α-helix	trans	-65.2	-32.9	178	-167.9	-96.9	0	0	0	113.3	L53 I55 P61	L53-Y57 WeakPolarHBondContact O-CB 3.26Å; L53-Y57 PolarHBondContact O-N 2.74Å; I55-Y57 VanDerWaalsContact C-N 3.34Å; I55-Y57 PolarHBondContact O-N 2.96Å; Y57-P61 WeakPolarHBondContact O-CD 3.44Å; Y57-P61 VanDerWaalsContact O-CG 3.31Å; Y57-P61 WeakPolarHBondContact O-CG 3.28Å
58	A	65	Low	65.8	Low	49 Å²	49	79.6 Å²	79.6	41%	0.405	47%	0.466	S	S	.	.	H	α-helix	trans	-79.7	-35.4	174.8	0	0	0	0	0	112.8	S54 I55 S56 P61 I62	S54-A58 PolarHBondContact O-N 3.48Å; I55-A58 PolarHBondContact O-N 2.85Å; S56-A58 VanDerWaalsContact C-N 3.32Å; S56-A58 PolarHBondContact O-N 2.98Å; A58-P61 VanDerWaalsContact O-CD 3.29Å; A58-P61 WeakPolarHBondContact O-CD 3.26Å; A58-P61 WeakPolarHBondContact O-CG 3.33Å; A58-I62 WeakPolarHBondContact O-CD1 3.49Å; A58-I62 VanDerWaalsContact O-CG1 3.28Å; A58-I62 WeakPolarHBondContact O-CG1 3.34Å; A58-I62 PolarHBondContact O-N 2.95Å
59	A	67.1	Low	66.7	Low	50 Å²	50	81.7 Å²	81.7	41%	0.413	47%	0.471	S	S	.	.	H	α-helix	trans	-68.7	-38.4	-178.4	0	0	0	0	0	112.6	I55 S56 I62 A63	I55-A59 VanDerWaalsContact O-CB 3.32Å; I55-A59 WeakPolarHBondContact O-CB 3.43Å; I55-A59 PolarHBondContact O-N 3.22Å; S56-A59 PolarHBondContact O-N 3.12Å; A59-I62 PolarHBondContact O-N 3.45Å; A59-A63 VanDerWaalsContact O-CB 3.28Å; A59-A63 WeakPolarHBondContact O-CB 3.44Å; A59-A63 PolarHBondContact O-N 3.16Å
60	V	70.5	Confident	67.9	Low	69 Å²	69	81.8 Å²	81.8	42%	0.418	47%	0.471	S	S	.	.	H	α-helix	trans	-57.2	-53.4	-179.9	170.9	0	0	0	0	113.2	I36 V40 S56 A63 F64	I36-V60 HydrophobicContact CG2-CG2 4.38Å; V40-V60 HydrophobicContact CG2-CG2 4.17Å; S56-V60 VanDerWaalsContact O-CG2 3.22Å; S56-V60 WeakPolarHBondContact O-CG2 3.47Å; S56-V60 PolarHBondContact O-N 3.37Å; S56-V60 VanDerWaalsContact O-N 3.1Å; V60-A63 PolarHBondContact O-N 3.28Å; V60-F64 WeakPolarHBondContact O-CB 3.34Å; V60-F64 PolarHBondContact O-N 3.47Å
61	P	71	Confident	68.8	Low	71 Å²	71	77.2 Å²	77.2	46%	0.461	45%	0.452	S	S	.	.	H	α-helix	trans	-68.5	-34.4	179.4	25.3	-33.6	0	0	0	112.7	Y57 A58 F64 A65	Y57-P61 WeakPolarHBondContact O-CD 3.44Å; Y57-P61 VanDerWaalsContact O-CG 3.31Å; Y57-P61 WeakPolarHBondContact O-CG 3.28Å; A58-P61 VanDerWaalsContact O-CD 3.29Å; A58-P61 WeakPolarHBondContact O-CD 3.26Å; A58-P61 WeakPolarHBondContact O-CG 3.33Å; P61-F64 PolarHBondContact O-N 2.93Å; P61-A65 WeakPolarHBondContact O-CB 3.49Å; P61-A65 PolarHBondContact O-N 3.38Å
62	I	76.8	Confident	69.8	Low	122 Å²	122	77.7 Å²	77.7	63%	0.626	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-46.9	176.6	-67.2	169.8	0	0	0	110.1	A58 A59 F64 A65 G66	A58-I62 WeakPolarHBondContact O-CD1 3.49Å; A58-I62 VanDerWaalsContact O-CG1 3.28Å; A58-I62 WeakPolarHBondContact O-CG1 3.34Å; A58-I62 PolarHBondContact O-N 2.95Å; A59-I62 PolarHBondContact O-N 3.45Å; I62-F64 VanDerWaalsContact C-N 3.34Å; I62-F64 PolarHBondContact O-N 3.24Å; I62-A65 PolarHBondContact O-N 2.94Å; I62-G66 PolarHBondContact O-N 3.2Å
63	A	73.4	Confident	70.8	Confident	30 Å²	30	75 Å²	75	25%	0.248	44%	0.439	C	S	.	.	H	α-helix	trans	-64.2	-41.2	177.3	0	0	0	0	0	111.5	I36 A59 V60 A65 G66 C67	I36-A63 HydrophobicContact CD1-CB 3.4Å; I36-A63 HydrophobicContact CG1-CB 4.43Å; A59-A63 VanDerWaalsContact O-CB 3.28Å; A59-A63 WeakPolarHBondContact O-CB 3.44Å; A59-A63 PolarHBondContact O-N 3.16Å; V60-A63 PolarHBondContact O-N 3.28Å; A63-A65 PolarHBondContact O-N 2.83Å; A63-G66 PolarHBondContact O-N 3.08Å; A63-C67 PolarHBondContact O-N 3.39Å; A63-C67 PolarHBondContact O-SG 3.16Å
64	F	75.9	Confident	71.8	Confident	136 Å²	136	72.3 Å²	72.3	60%	0.596	43%	0.425	S	S	*	.	H	α-helix	trans	-60.3	-46.2	174.7	-177.4	-100.6	0	0	0	112	V60 P61 I62 G66 C67 V68	V60-F64 WeakPolarHBondContact O-CB 3.34Å; V60-F64 PolarHBondContact O-N 3.47Å; P61-F64 PolarHBondContact O-N 2.93Å; I62-F64 VanDerWaalsContact C-N 3.34Å; I62-F64 PolarHBondContact O-N 3.24Å; F64-G66 VanDerWaalsContact C-N 3.33Å; F64-G66 PolarHBondContact O-N 3.26Å; F64-C67 PolarHBondContact O-N 3.35Å; F64-V68 HydrophobicContact CD1-CG2 4.19Å; F64-V68 HydrophobicContact CE1-CG2 3.8Å; F64-V68 HydrophobicContact CE2-CG2 4.27Å; F64-V68 HydrophobicContact CZ-CG2 3.84Å; F64-V68 WeakPolarHBondContact O-CG2 3.48Å; F64-V68 PolarHBondContact O-N 2.94Å
65	A	76.5	Confident	72.6	Confident	52 Å²	52	75.8 Å²	75.8	43%	0.43	43%	0.43	S	S	.	.	H	α-helix	trans	-61.8	-40.8	175.6	0	0	0	0	0	111.8	P61 I62 A63 V68 T69	P61-A65 WeakPolarHBondContact O-CB 3.49Å; P61-A65 PolarHBondContact O-N 3.38Å; I62-A65 PolarHBondContact O-N 2.94Å; A63-A65 PolarHBondContact O-N 2.83Å; A65-V68 PolarHBondContact O-N 2.78Å; A65-T69 WeakPolarHBondContact O-CB 3.3Å; A65-T69 WeakPolarHBondContact O-CG2 3.28Å; A65-T69 PolarHBondContact O-N 3.08Å; A65-T69 PolarHBondContact O-OG1 2.91Å
66	G	76.2	Confident	73.4	Confident	36 Å²	36	78.6 Å²	78.6	37%	0.371	43%	0.433	S	S	.	.	H	α-helix	trans	-59.7	-45.3	172.8	0	0	0	0	0	112.4	I62 A63 F64 T69 L70	I62-G66 PolarHBondContact O-N 3.2Å; A63-G66 PolarHBondContact O-N 3.08Å; F64-G66 VanDerWaalsContact C-N 3.33Å; F64-G66 PolarHBondContact O-N 3.26Å; G66-T69 WeakPolarHBondContact CA-OG1 3.33Å; G66-T69 PolarHBondContact O-OG1 3.45Å; G66-L70 VanDerWaalsContact O-CB 3.27Å; G66-L70 WeakPolarHBondContact O-CB 3.27Å; G66-L70 PolarHBondContact O-N 2.85Å
67	C	77.5	Confident	73.9	Confident	30 Å²	30	82.7 Å²	82.7	20%	0.203	45%	0.452	C	S	.	.	H	α-helix	trans	-63.6	-44.6	176.5	-69.4	0	0	0	0	112.1	V29 A63 F64 L70 L71	V29-C67 HydrophobicContact CG1-CB 4.41Å; A63-C67 PolarHBondContact O-N 3.39Å; A63-C67 PolarHBondContact O-SG 3.16Å; F64-C67 PolarHBondContact O-N 3.35Å; C67-L70 PolarHBondContact O-N 3.37Å; C67-L71 WeakPolarHBondContact O-CB 3.24Å; C67-L71 VanDerWaalsContact O-CG 3.29Å; C67-L71 WeakPolarHBondContact O-CG 3.4Å; C67-L71 PolarHBondContact O-N 2.91Å
68	V	76.9	Confident	74.3	Confident	56 Å²	56	76 Å²	76	34%	0.339	43%	0.431	S	S	.	.	H	α-helix	trans	-64.5	-44.9	179.5	172.6	0	0	0	0	111.1	F64 A65 L70 L71 I72	F64-V68 HydrophobicContact CD1-CG2 4.19Å; F64-V68 HydrophobicContact CE1-CG2 3.8Å; F64-V68 HydrophobicContact CE2-CG2 4.27Å; F64-V68 HydrophobicContact CZ-CG2 3.84Å; F64-V68 WeakPolarHBondContact O-CG2 3.48Å; F64-V68 PolarHBondContact O-N 2.94Å; A65-V68 PolarHBondContact O-N 2.78Å; V68-L70 PolarHBondContact O-N 3.18Å; V68-L71 PolarHBondContact O-N 2.71Å; V68-I72 HydrophobicContact CG1-CD1 3.8Å; V68-I72 WeakPolarHBondContact O-CD1 3.47Å; V68-I72 VanDerWaalsContact O-CG1 3.24Å; V68-I72 WeakPolarHBondContact O-CG1 3.46Å; V68-I72 PolarHBondContact O-N 2.82Å
69	T	77.2	Confident	74.3	Confident	89 Å²	89	75.7 Å²	75.7	55%	0.546	43%	0.426	S	S	.	.	H	α-helix	trans	-64.3	-40	178	50.9	0	0	0	0	112.2	A65 G66 I72 A73	A65-T69 WeakPolarHBondContact O-CB 3.3Å; A65-T69 WeakPolarHBondContact O-CG2 3.28Å; A65-T69 PolarHBondContact O-N 3.08Å; A65-T69 PolarHBondContact O-OG1 2.91Å; G66-T69 WeakPolarHBondContact CA-OG1 3.33Å; G66-T69 PolarHBondContact O-OG1 3.45Å; T69-I72 PolarHBondContact O-N 3.2Å; T69-A73 WeakPolarHBondContact O-CB 3.34Å; T69-A73 PolarHBondContact O-N 3.41Å
70	L	77.9	Confident	74.1	Confident	79 Å²	79	77.2 Å²	77.2	41%	0.414	43%	0.43	S	S	.	.	H	α-helix	trans	-65	-44.4	175.3	-169.9	124	0	0	0	111.6	V29 G66 C67 V68 I72 A73 I74	V29-L70 HydrophobicContact CG2-CD2 3.33Å; G66-L70 VanDerWaalsContact O-CB 3.27Å; G66-L70 WeakPolarHBondContact O-CB 3.27Å; G66-L70 PolarHBondContact O-N 2.85Å; C67-L70 PolarHBondContact O-N 3.37Å; V68-L70 PolarHBondContact O-N 3.18Å; L70-I72 VanDerWaalsContact C-N 3.34Å; L70-I72 PolarHBondContact O-N 3.48Å; L70-A73 PolarHBondContact O-N 3.05Å; L70-I74 HydrophobicContact CD2-CD1 3.53Å; L70-I74 HydrophobicContact CG-CD1 4.06Å; L70-I74 WeakPolarHBondContact O-CD1 3.21Å; L70-I74 WeakPolarHBondContact O-CG1 3.21Å; L70-I74 PolarHBondContact O-N 3.42Å
71	L	77.6	Confident	73.7	Confident	77 Å²	77	75.7 Å²	75.7	40%	0.403	42%	0.423	S	S	.	.	H	α-helix	trans	-59.5	-42.4	174.4	-75.2	173.1	0	0	0	112.2	C67 V68 I74 F75	C67-L71 WeakPolarHBondContact O-CB 3.24Å; C67-L71 VanDerWaalsContact O-CG 3.29Å; C67-L71 WeakPolarHBondContact O-CG 3.4Å; C67-L71 PolarHBondContact O-N 2.91Å; V68-L71 PolarHBondContact O-N 2.71Å; L71-I74 PolarHBondContact O-N 3.31Å; L71-F75 WeakPolarHBondContact O-CB 3.11Å; L71-F75 PolarHBondContact O-N 2.83Å
72	I	74.9	Confident	73.1	Confident	87 Å²	87	80 Å²	80	45%	0.446	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-42.8	176.1	-67.1	163.8	0	0	0	110.8	V68 T69 L70 F75 R76	V68-I72 HydrophobicContact CG1-CD1 3.8Å; V68-I72 WeakPolarHBondContact O-CD1 3.47Å; V68-I72 VanDerWaalsContact O-CG1 3.24Å; V68-I72 WeakPolarHBondContact O-CG1 3.46Å; V68-I72 PolarHBondContact O-N 2.82Å; T69-I72 PolarHBondContact O-N 3.2Å; L70-I72 VanDerWaalsContact C-N 3.34Å; L70-I72 PolarHBondContact O-N 3.48Å; I72-F75 PolarHBondContact O-N 3.36Å; I72-R76 WeakPolarHBondContact O-CG 3.45Å; I72-R76 PolarHBondContact O-N 3.13Å
73	A	76.4	Confident	72.2	Confident	47 Å²	47	82.7 Å²	82.7	39%	0.388	43%	0.432	S	S	.	.	H	α-helix	trans	-61.7	-45	177.8	0	0	0	0	0	111.3	T69 L70 R76 I77	T69-A73 WeakPolarHBondContact O-CB 3.34Å; T69-A73 PolarHBondContact O-N 3.41Å; L70-A73 PolarHBondContact O-N 3.05Å; A73-R76 PolarHBondContact O-N 2.78Å; A73-I77 VanDerWaalsContact O-CG1 3.26Å; A73-I77 WeakPolarHBondContact O-CG1 3.33Å; A73-I77 PolarHBondContact O-N 3.3Å
74	I	75.3	Confident	71.3	Confident	24 Å²	24	84.9 Å²	84.9	12%	0.123	44%	0.439	C	S	.	.	H	α-helix	trans	-61.6	-47.6	175.6	-65	157.5	0	0	0	110.5	F22 S25 L70 L71 R76 I77 V78	F22-I74 HydrophobicContact CD2-CG2 3.45Å; F22-I74 VanDerWaalsContact CD2-CG2 3.45Å; F22-I74 HydrophobicContact CE2-CG2 3.74Å; S25-I74 WeakPolarHBondContact OG-CD1 3.27Å; L70-I74 HydrophobicContact CD2-CD1 3.53Å; L70-I74 HydrophobicContact CG-CD1 4.06Å; L70-I74 WeakPolarHBondContact O-CD1 3.21Å; L70-I74 WeakPolarHBondContact O-CG1 3.21Å; L70-I74 PolarHBondContact O-N 3.42Å; L71-I74 PolarHBondContact O-N 3.31Å; I74-R76 VanDerWaalsContact C-N 3.27Å; I74-R76 PolarHBondContact O-N 3.34Å; I74-I77 PolarHBondContact O-N 3.21Å; I74-I77 VanDerWaalsContact O-N 3.16Å; I74-V78 HydrophobicContact CG2-CG2 4.17Å; I74-V78 WeakPolarHBondContact O-CB 3Å; I74-V78 WeakPolarHBondContact O-CG2 3.43Å; I74-V78 PolarHBondContact O-N 2.72Å
75	F	73.9	Confident	70.2	Confident	153 Å²	153	86 Å²	86	67%	0.671	44%	0.439	S	S	*	.	H	α-helix	trans	-60	-40.6	179.1	-173.4	-95.9	0	0	0	111.5	L71 I72 S79	L71-F75 WeakPolarHBondContact O-CB 3.11Å; L71-F75 PolarHBondContact O-N 2.83Å; I72-F75 PolarHBondContact O-N 3.36Å; F75-S79 VanDerWaalsContact O-CB 3.26Å; F75-S79 WeakPolarHBondContact O-CB 3.25Å; F75-S79 PolarHBondContact O-N 2.91Å; F75-S79 PolarHBondContact O-OG 3.44Å
76	R	74.3	Confident	69.2	Low	174 Å²	174	89.3 Å²	89.3	66%	0.657	45%	0.446	S	S	*	.	H	α-helix	trans	-61.7	-49.3	173.5	-76.7	-174.4	-178.5	-154.4	2.2	111.5	I72 A73 I74 V78 S79 T80	I72-R76 WeakPolarHBondContact O-CG 3.45Å; I72-R76 PolarHBondContact O-N 3.13Å; A73-R76 PolarHBondContact O-N 2.78Å; I74-R76 VanDerWaalsContact C-N 3.27Å; I74-R76 PolarHBondContact O-N 3.34Å; R76-V78 PolarHBondContact O-N 3.18Å; R76-S79 WeakPolarHBondContact CA-OG 3.27Å; R76-S79 PolarHBondContact O-N 3.5Å; R76-S79 PolarHBondContact O-OG 2.91Å; R76-T80 PolarHBondContact O-N 3.44Å; R76-T80 PolarHBondContact O-OG1 2.9Å; R76-T80 VanDerWaalsContact O-OG1 3.12Å
77	I	74.4	Confident	68.2	Low	112 Å²	112	93.4 Å²	93.4	57%	0.574	46%	0.457	S	S	*	.	H	α-helix	trans	-57.7	-49.9	178.3	-67.2	162.5	0	0	0	110.4	A73 I74 S79 T80 S81	A73-I77 VanDerWaalsContact O-CG1 3.26Å; A73-I77 WeakPolarHBondContact O-CG1 3.33Å; A73-I77 PolarHBondContact O-N 3.3Å; I74-I77 PolarHBondContact O-N 3.21Å; I74-I77 VanDerWaalsContact O-N 3.16Å; I77-S79 VanDerWaalsContact C-N 3.33Å; I77-S79 PolarHBondContact O-N 2.92Å; I77-T80 PolarHBondContact O-N 2.88Å; I77-S81 PolarHBondContact O-N 2.85Å; I77-S81 PolarHBondContact O-OG 3.35Å; I77-S81 VanDerWaalsContact O-OG 3.05Å
78	V	71.8	Confident	67.1	Low	52 Å²	52	98.6 Å²	98.6	32%	0.315	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-40.1	178.2	174.1	0	0	0	0	111.5	F22 I74 R76 T80 S81 R82	F22-V78 HydrophobicContact CD2-CG2 4.07Å; I74-V78 HydrophobicContact CG2-CG2 4.17Å; I74-V78 WeakPolarHBondContact O-CB 3Å; I74-V78 WeakPolarHBondContact O-CG2 3.43Å; I74-V78 PolarHBondContact O-N 2.72Å; R76-V78 PolarHBondContact O-N 3.18Å; V78-T80 VanDerWaalsContact C-N 3.33Å; V78-T80 PolarHBondContact O-N 3.16Å; V78-S81 PolarHBondContact O-N 3.42Å; V78-R82 WeakPolarHBondContact O-CB 3.29Å; V78-R82 PolarHBondContact O-N 3.33Å
79	S	65.5	Low	65.8	Low	43 Å²	43	98.2 Å²	98.2	30%	0.301	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-38.1	176.7	74.9	0	0	0	0	112.2	F75 R76 I77 R82 R83	F75-S79 VanDerWaalsContact O-CB 3.26Å; F75-S79 WeakPolarHBondContact O-CB 3.25Å; F75-S79 PolarHBondContact O-N 2.91Å; F75-S79 PolarHBondContact O-OG 3.44Å; R76-S79 WeakPolarHBondContact CA-OG 3.27Å; R76-S79 PolarHBondContact O-N 3.5Å; R76-S79 PolarHBondContact O-OG 2.91Å; I77-S79 VanDerWaalsContact C-N 3.33Å; I77-S79 PolarHBondContact O-N 2.92Å; S79-R82 PolarHBondContact O-N 3.49Å; S79-R83 WeakPolarHBondContact O-CG 3.32Å; S79-R83 PolarHBondContact O-N 2.98Å
80	T	62.6	Low	64.8	Low	82 Å²	82	97.6 Å²	97.6	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-69.7	-43.1	176.1	-61	0	0	0	0	110.4	R76 I77 V78 R82 R83 L84	R76-T80 PolarHBondContact O-N 3.44Å; R76-T80 PolarHBondContact O-OG1 2.9Å; R76-T80 VanDerWaalsContact O-OG1 3.12Å; I77-T80 PolarHBondContact O-N 2.88Å; V78-T80 VanDerWaalsContact C-N 3.33Å; V78-T80 PolarHBondContact O-N 3.16Å; T80-R82 VanDerWaalsContact C-N 3.33Å; T80-R82 PolarHBondContact O-N 2.96Å; T80-R83 PolarHBondContact O-N 2.91Å; T80-L84 HydrophobicContact CG2-CD1 4.5Å; T80-L84 WeakPolarHBondContact O-CG 3.28Å; T80-L84 PolarHBondContact O-N 3.34Å
81	S	62.1	Low	63.6	Low	37 Å²	37	100.1 Å²	100.1	26%	0.259	49%	0.488	S	S	.	.	H	α-helix	trans	-60.8	-40.1	172.5	-59.2	0	0	0	0	112.3	I77 V78 L84 R85	I77-S81 PolarHBondContact O-N 2.85Å; I77-S81 PolarHBondContact O-OG 3.35Å; I77-S81 VanDerWaalsContact O-OG 3.05Å; V78-S81 PolarHBondContact O-N 3.42Å; S81-L84 WeakPolarHBondContact O-CB 3.47Å; S81-L84 PolarHBondContact O-N 2.93Å; S81-R85 WeakPolarHBondContact O-CB 3.31Å; S81-R85 PolarHBondContact O-N 3.38Å
82	R	58.6	Low	62.3	Low	162 Å²	162	100.3 Å²	100.3	61%	0.611	50%	0.495	S	S	*	.	H	α-helix	trans	-65.1	-42.6	175.2	-175.9	178.3	167.6	169.5	2.3	111.4	V78 S79 T80 L84 R85 E86	V78-R82 WeakPolarHBondContact O-CB 3.29Å; V78-R82 PolarHBondContact O-N 3.33Å; S79-R82 PolarHBondContact O-N 3.49Å; T80-R82 VanDerWaalsContact C-N 3.33Å; T80-R82 PolarHBondContact O-N 2.96Å; R82-L84 VanDerWaalsContact C-N 3.31Å; R82-L84 PolarHBondContact O-N 2.9Å; R82-R85 CarbonylContact O-C 3.55Å; R82-R85 WeakPolarHBondContact O-CB 3.45Å; R82-R85 PolarHBondContact O-N 3.42Å; R82-R85 VanDerWaalsContact O-N 3.16Å; R82-E86 HydrophobicContact CG-CG 4.43Å; R82-E86 IonicContact CZ-OE1 3.52Å; R82-E86 IonicContact NE-OE1 2.83Å; R82-E86 PolarHBondContact NE-OE1 3.38Å; R82-E86 IonicContact NH2-OE1 3.38Å; R82-E86 PolarHBondContact NH2-OE1 2.88Å; R82-E86 WeakPolarHBondContact O-CB 3.39Å; R82-E86 WeakPolarHBondContact O-CG 3.33Å; R82-E86 PolarHBondContact O-N 2.82Å
83	R	57.6	Low	61.3	Low	178 Å²	178	100.3 Å²	100.3	67%	0.672	49%	0.493	S	S	*	.	H	α-helix	trans	-62	-38.9	173.8	-76.4	-175.9	179.5	-168.1	0.7	112.1	S79 T80 R85 E86 M87	S79-R83 WeakPolarHBondContact O-CG 3.32Å; S79-R83 PolarHBondContact O-N 2.98Å; T80-R83 PolarHBondContact O-N 2.91Å; R83-R85 VanDerWaalsContact C-N 3.3Å; R83-R85 PolarHBondContact O-N 3.49Å; R83-E86 PolarHBondContact O-N 3.42Å; R83-M87 WeakPolarHBondContact O-CG 3.33Å; R83-M87 PolarHBondContact O-N 3.2Å
84	L	55	Low	60.4	Low	77 Å²	77	102.4 Å²	102.4	40%	0.403	49%	0.494	S	S	.	.	H	α-helix	trans	-61	-41.4	173.2	-71.6	165.2	0	0	0	111.3	T80 S81 R82 M87	T80-L84 HydrophobicContact CG2-CD1 4.5Å; T80-L84 WeakPolarHBondContact O-CG 3.28Å; T80-L84 PolarHBondContact O-N 3.34Å; S81-L84 WeakPolarHBondContact O-CB 3.47Å; S81-L84 PolarHBondContact O-N 2.93Å; R82-L84 VanDerWaalsContact C-N 3.31Å; R82-L84 PolarHBondContact O-N 2.9Å; L84-M87 HydrophobicContact CD2-CE 4.01Å; L84-M87 PolarHBondContact O-N 2.94Å
85	R	52.8	Low	59.5	Low	159 Å²	159	106.4 Å²	106.4	60%	0.6	51%	0.512	S	S	*	.	H	α-helix	trans	-70.8	-35.9	176.5	-171	172.7	156.4	-162.7	-9.7	113.3	E18 S81 R82 R83 M87 N88	E18-R85 IonicContact OE1-NH1 3.31Å; E18-R85 PolarHBondContact OE1-NH1 3.26Å; S81-R85 WeakPolarHBondContact O-CB 3.31Å; S81-R85 PolarHBondContact O-N 3.38Å; R82-R85 CarbonylContact O-C 3.55Å; R82-R85 WeakPolarHBondContact O-CB 3.45Å; R82-R85 PolarHBondContact O-N 3.42Å; R82-R85 VanDerWaalsContact O-N 3.16Å; R83-R85 VanDerWaalsContact C-N 3.3Å; R83-R85 PolarHBondContact O-N 3.49Å; R85-M87 VanDerWaalsContact C-N 3.25Å; R85-M87 PolarHBondContact O-N 3.43Å; R85-N88 PolarHBondContact O-N 2.86Å; R85-N88 VanDerWaalsContact O-N 3.11Å
86	E	55.6	Low	58.7	Low	122 Å²	122	105.3 Å²	105.3	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-67.5	-26.5	172.5	-75.8	174.2	-172.9	0	0	111.9	R82 R83 N88	R82-E86 HydrophobicContact CG-CG 4.43Å; R82-E86 IonicContact CZ-OE1 3.52Å; R82-E86 IonicContact NE-OE1 2.83Å; R82-E86 PolarHBondContact NE-OE1 3.38Å; R82-E86 IonicContact NH2-OE1 3.38Å; R82-E86 PolarHBondContact NH2-OE1 2.88Å; R82-E86 WeakPolarHBondContact O-CB 3.39Å; R82-E86 WeakPolarHBondContact O-CG 3.33Å; R82-E86 PolarHBondContact O-N 2.82Å; R83-E86 PolarHBondContact O-N 3.42Å; E86-N88 PolarHBondContact O-N 3.4Å; E86-N88 VanDerWaalsContact O-N 3.17Å
87	M	54.8	Low	58	Low	121 Å²	121	101.7 Å²	101.7	60%	0.596	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	9.7	169.6	-72.9	-173.6	-73.5	0	0	113.7	R83 L84 R85 L89	R83-M87 WeakPolarHBondContact O-CG 3.33Å; R83-M87 PolarHBondContact O-N 3.2Å; L84-M87 HydrophobicContact CD2-CE 4.01Å; L84-M87 PolarHBondContact O-N 2.94Å; R85-M87 VanDerWaalsContact C-N 3.25Å; R85-M87 PolarHBondContact O-N 3.43Å; M87-L89 PolarHBondContact O-N 2.94Å
88	N	53.7	Low	57.1	Low	139 Å²	139	103.4 Å²	103.4	74%	0.743	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	10.9	176	-99.5	-14	0	0	0	115.4	R85 E86 T90	R85-N88 PolarHBondContact O-N 2.86Å; R85-N88 VanDerWaalsContact O-N 3.11Å; E86-N88 PolarHBondContact O-N 3.4Å; E86-N88 VanDerWaalsContact O-N 3.17Å; N88-T90 VanDerWaalsContact C-N 3.26Å; N88-T90 PolarHBondContact O-N 3.36Å
89	L	50.1	Low	56.3	Low	48 Å²	48	104.8 Å²	104.8	25%	0.251	50%	0.502	S	S	.	.			trans	-75.7	90.6	166.7	-64.5	171.7	0	0	0	105.6	M87 L91 E93 F94	M87-L89 PolarHBondContact O-N 2.94Å; L89-L91 PolarHBondContact O-N 3.44Å; L89-E93 HydrophobicContact CD2-CB 4.28Å; L89-F94 HydrophobicContact CB-CB 4.39Å; L89-F94 HydrophobicContact CD1-CD2 4.38Å
90	T	55.9	Low	55.9	Low	76 Å²	76	108.2 Å²	108.2	47%	0.466	51%	0.514	S	S	.	.			trans	-51.5	143.4	162.4	68.2	0	0	0	0	106.9	N88 C92 E93 F94	N88-T90 VanDerWaalsContact C-N 3.26Å; N88-T90 PolarHBondContact O-N 3.36Å; T90-C92 CarbonylContact O-C 3.53Å; T90-C92 PolarHBondContact O-N 2.91Å; T90-E93 WeakPolarHBondContact O-CA 3.41Å; T90-E93 WeakPolarHBondContact O-CB 3.35Å; T90-E93 PolarHBondContact O-N 2.89Å; T90-E93 PolarHBondContact OG1-N 3.24Å; T90-E93 PolarHBondContact OG1-OE2 3.34Å; T90-F94 PolarHBondContact O-N 2.84Å
91	L	52.5	Low	55.4	Low	132 Å²	132	109.8 Å²	109.8	69%	0.691	52%	0.515	S	S	*	.	H	α-helix	trans	-53.5	-30.4	-175.8	-151	148.3	0	0	0	111.3	L89 F94 E95	L89-L91 PolarHBondContact O-N 3.44Å; L91-F94 PolarHBondContact O-N 3.22Å; L91-E95 WeakPolarHBondContact O-CB 3.28Å; L91-E95 PolarHBondContact O-N 2.91Å
92	C	50.8	Low	54.8	Low	82 Å²	82	112.4 Å²	112.4	55%	0.554	52%	0.523	S	S	*	.	H	α-helix	trans	-65.2	-42.9	168.4	-70.5	0	0	0	0	114.6	T90 F94 E95 K96	T90-C92 CarbonylContact O-C 3.53Å; T90-C92 PolarHBondContact O-N 2.91Å; C92-F94 VanDerWaalsContact C-N 3.34Å; C92-E95 PolarHBondContact O-N 3.47Å; C92-K96 WeakPolarHBondContact O-CB 3.29Å; C92-K96 PolarHBondContact O-N 3.07Å
93	E	54.4	Low	54.4	Low	86 Å²	86	107.3 Å²	107.3	40%	0.402	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-41.2	173.9	-129.5	82.6	-143.5	0	0	111.1	L89 T90 K96 Q97	L89-E93 HydrophobicContact CD2-CB 4.28Å; T90-E93 WeakPolarHBondContact O-CA 3.41Å; T90-E93 WeakPolarHBondContact O-CB 3.35Å; T90-E93 PolarHBondContact O-N 2.89Å; T90-E93 PolarHBondContact OG1-N 3.24Å; T90-E93 PolarHBondContact OG1-OE2 3.34Å; E93-K96 PolarHBondContact O-N 3.5Å; E93-Q97 WeakPolarHBondContact O-CB 3.34Å; E93-Q97 VanDerWaalsContact O-CG 3.32Å; E93-Q97 WeakPolarHBondContact O-CG 3.28Å; E93-Q97 PolarHBondContact O-N 3.46Å
94	F	57.4	Low	54.1	Low	92 Å²	92	103.6 Å²	103.6	40%	0.404	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-46.2	175.9	-178	-95.8	0	0	0	111.1	L89 T90 L91 C92 K96 Q97 W98	L89-F94 HydrophobicContact CB-CB 4.39Å; L89-F94 HydrophobicContact CD1-CD2 4.38Å; T90-F94 PolarHBondContact O-N 2.84Å; L91-F94 PolarHBondContact O-N 3.22Å; C92-F94 VanDerWaalsContact C-N 3.34Å; F94-K96 VanDerWaalsContact C-N 3.31Å; F94-K96 PolarHBondContact O-N 2.9Å; F94-Q97 PolarHBondContact O-N 2.87Å; F94-W98 HydrophobicContact CE1-CE3 4.34Å; F94-W98 AromaticContact CZ-CE3 3.87Å; F94-W98 HydrophobicContact CZ-CE3 3.87Å; F94-W98 HydrophobicContact CZ-CZ3 4.42Å; F94-W98 VanDerWaalsContact O-CB 3.24Å; F94-W98 WeakPolarHBondContact O-CB 2.86Å; F94-W98 PolarHBondContact O-N 3.36Å
95	E	56.3	Low	54	Low	107 Å²	107	102.9 Å²	102.9	50%	0.5	51%	0.507	S	S	.	.	H	α-helix	trans	-59.5	-42.5	174.8	-176.4	-179.7	172.2	0	0	111.5	L91 C92 W98 N99	L91-E95 WeakPolarHBondContact O-CB 3.28Å; L91-E95 PolarHBondContact O-N 2.91Å; C92-E95 PolarHBondContact O-N 3.47Å; E95-W98 PolarHBondContact O-N 2.82Å; E95-N99 VanDerWaalsContact O-CB 3.3Å; E95-N99 WeakPolarHBondContact O-CB 3.31Å; E95-N99 VanDerWaalsContact O-CG 3.24Å; E95-N99 PolarHBondContact O-N 3.19Å; E95-N99 PolarHBondContact O-ND2 3.24Å
96	K	57.2	Low	53.8	Low	131 Å²	131	102.5 Å²	102.5	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-64.3	-44	176.1	-173.7	-179.7	176.3	-173	0	111.7	C92 E93 F94 Q100	C92-K96 WeakPolarHBondContact O-CB 3.29Å; C92-K96 PolarHBondContact O-N 3.07Å; E93-K96 PolarHBondContact O-N 3.5Å; F94-K96 VanDerWaalsContact C-N 3.31Å; F94-K96 PolarHBondContact O-N 2.9Å; K96-Q100 WeakPolarHBondContact O-CB 3.39Å; K96-Q100 PolarHBondContact O-N 2.85Å
97	Q	58.5	Low	53.6	Low	98 Å²	98	102.3 Å²	102.3	46%	0.458	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-41.9	176.6	-77.5	-176.1	-2.3	0	0	111.6	E93 F94 Q100 E101	E93-Q97 WeakPolarHBondContact O-CB 3.34Å; E93-Q97 VanDerWaalsContact O-CG 3.32Å; E93-Q97 WeakPolarHBondContact O-CG 3.28Å; E93-Q97 PolarHBondContact O-N 3.46Å; F94-Q97 PolarHBondContact O-N 2.87Å; Q97-Q100 PolarHBondContact O-N 2.86Å; Q97-E101 WeakPolarHBondContact O-CB 3.47Å; Q97-E101 PolarHBondContact O-N 3.42Å
98	W	56.7	Low	53.5	Low	147 Å²	147	102 Å²	102	56%	0.557	51%	0.509	S	S	*	.	H	α-helix	trans	-62.6	-48.8	177.4	-171.3	-91.6	0	0	0	111.7	F94 E95 Q100 E101 E102	F94-W98 HydrophobicContact CE1-CE3 4.34Å; F94-W98 AromaticContact CZ-CE3 3.87Å; F94-W98 HydrophobicContact CZ-CE3 3.87Å; F94-W98 HydrophobicContact CZ-CZ3 4.42Å; F94-W98 VanDerWaalsContact O-CB 3.24Å; F94-W98 WeakPolarHBondContact O-CB 2.86Å; F94-W98 PolarHBondContact O-N 3.36Å; E95-W98 PolarHBondContact O-N 2.82Å; W98-Q100 VanDerWaalsContact C-N 3.28Å; W98-Q100 PolarHBondContact O-N 3.5Å; W98-E101 PolarHBondContact O-N 3.27Å; W98-E102 PolarHBondContact O-N 2.88Å
99	N	53.4	Low	53.3	Low	81 Å²	81	100.3 Å²	100.3	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-34	176.1	-72.1	-22.9	0	0	0	112	E95 S103	E95-N99 VanDerWaalsContact O-CB 3.3Å; E95-N99 WeakPolarHBondContact O-CB 3.31Å; E95-N99 VanDerWaalsContact O-CG 3.24Å; E95-N99 PolarHBondContact O-N 3.19Å; E95-N99 PolarHBondContact O-ND2 3.24Å; N99-S103 PolarHBondContact O-N 3.47Å; N99-S103 VanDerWaalsContact O-N 3.07Å
100	Q	57.9	Low	53.3	Low	116 Å²	116	99.5 Å²	99.5	54%	0.542	50%	0.501	S	S	.	.	H	α-helix	trans	-72.5	-39	177.1	-166.5	171.8	8.4	0	0	111.7	K96 Q97 W98 E102 S103 L104	K96-Q100 WeakPolarHBondContact O-CB 3.39Å; K96-Q100 PolarHBondContact O-N 2.85Å; Q97-Q100 PolarHBondContact O-N 2.86Å; W98-Q100 VanDerWaalsContact C-N 3.28Å; W98-Q100 PolarHBondContact O-N 3.5Å; Q100-E102 VanDerWaalsContact C-N 3.33Å; Q100-S103 PolarHBondContact O-N 2.91Å; Q100-S103 PolarHBondContact O-OG 3.4Å; Q100-L104 WeakPolarHBondContact O-CB 3.47Å; Q100-L104 PolarHBondContact O-N 2.89Å
101	E	51.7	Low	53.1	Low	115 Å²	115	101.3 Å²	101.3	54%	0.537	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-37.9	173.9	-165.2	171	-168.7	0	0	111.2	Q97 W98 S103 L104 S105	Q97-E101 WeakPolarHBondContact O-CB 3.47Å; Q97-E101 PolarHBondContact O-N 3.42Å; W98-E101 PolarHBondContact O-N 3.27Å; E101-S103 PolarHBondContact O-N 2.94Å; E101-L104 PolarHBondContact O-N 3.49Å; E101-S105 WeakPolarHBondContact O-CB 3.35Å; E101-S105 PolarHBondContact O-N 3.31Å
102	E	49.7	Very low	53.1	Low	91 Å²	91	97.4 Å²	97.4	43%	0.425	49%	0.494	S	S	.	.	H	α-helix	trans	-60.6	-47.2	172.1	-141.4	178.1	-174.7	0	0	110.6	W98 Q100 L104 S105 Y106	W98-E102 PolarHBondContact O-N 2.88Å; Q100-E102 VanDerWaalsContact C-N 3.33Å; E102-L104 VanDerWaalsContact C-N 3.29Å; E102-L104 PolarHBondContact O-N 3.49Å; E102-S105 PolarHBondContact O-N 3.33Å; E102-S105 PolarHBondContact O-OG 3.41Å; E102-Y106 HydrophobicContact CG-CD2 4.47Å; E102-Y106 HydrophobicContact CG-CE2 4.09Å; E102-Y106 WeakPolarHBondContact O-CD2 3.32Å; E102-Y106 PolarHBondContact O-N 3.44Å
103	S	51.3	Low	52.9	Low	55 Å²	55	101 Å²	101	39%	0.385	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-33.9	176.4	80.6	0	0	0	0	113.5	N99 Q100 E101 N107	N99-S103 PolarHBondContact O-N 3.47Å; N99-S103 VanDerWaalsContact O-N 3.07Å; Q100-S103 PolarHBondContact O-N 2.91Å; Q100-S103 PolarHBondContact O-OG 3.4Å; E101-S103 PolarHBondContact O-N 2.94Å; S103-N107 WeakPolarHBondContact O-CB 3.34Å; S103-N107 PolarHBondContact O-N 2.92Å; S103-N107 PolarHBondContact O-ND2 2.92Å
104	L	50.4	Low	52.7	Low	101 Å²	101	101.7 Å²	101.7	53%	0.529	50%	0.504	S	S	.	.	H	α-helix	trans	-75.1	-35.4	179.2	-155.5	147.9	0	0	0	110.3	Q100 E101 E102 N107 L108	Q100-L104 WeakPolarHBondContact O-CB 3.47Å; Q100-L104 PolarHBondContact O-N 2.89Å; E101-L104 PolarHBondContact O-N 3.49Å; E102-L104 VanDerWaalsContact C-N 3.29Å; E102-L104 PolarHBondContact O-N 3.49Å; L104-N107 PolarHBondContact O-N 3.22Å; L104-L108 HydrophobicContact CD2-CD1 3.48Å; L104-L108 VanDerWaalsContact CD2-CD1 3.48Å; L104-L108 WeakPolarHBondContact O-CB 3.35Å; L104-L108 PolarHBondContact O-N 3.43Å
105	S	53	Low	52.5	Low	62 Å²	62	100 Å²	100	43%	0.434	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-40.9	173.1	76.8	0	0	0	0	112.6	E101 E102 L108 Q109	E101-S105 WeakPolarHBondContact O-CB 3.35Å; E101-S105 PolarHBondContact O-N 3.31Å; E102-S105 PolarHBondContact O-N 3.33Å; E102-S105 PolarHBondContact O-OG 3.41Å; S105-L108 PolarHBondContact O-N 2.92Å; S105-Q109 VanDerWaalsContact O-CB 3.29Å; S105-Q109 WeakPolarHBondContact O-CB 3.11Å; S105-Q109 PolarHBondContact O-N 3.41Å
106	Y	49	Very low	52.2	Low	151 Å²	151	102.7 Å²	102.7	59%	0.592	52%	0.517	S	S	*	.	H	α-helix	trans	-65.7	-40.6	173.3	-81.5	-75	0	0	0	112	E102 Q109 G110	E102-Y106 HydrophobicContact CG-CD2 4.47Å; E102-Y106 HydrophobicContact CG-CE2 4.09Å; E102-Y106 WeakPolarHBondContact O-CD2 3.32Å; E102-Y106 PolarHBondContact O-N 3.44Å; Y106-Q109 PolarHBondContact O-N 3.49Å; Y106-G110 PolarHBondContact O-N 2.87Å
107	N	51	Low	51.7	Low	117 Å²	117	99.9 Å²	99.9	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-68.7	-39.2	176.1	-80	-52.4	0	0	0	112.2	S103 L104 G110 N111	S103-N107 WeakPolarHBondContact O-CB 3.34Å; S103-N107 PolarHBondContact O-N 2.92Å; S103-N107 PolarHBondContact O-ND2 2.92Å; L104-N107 PolarHBondContact O-N 3.22Å; N107-G110 PolarHBondContact O-N 2.93Å; N107-N111 VanDerWaalsContact O-CB 3.3Å; N107-N111 WeakPolarHBondContact O-CB 3.28Å; N107-N111 PolarHBondContact O-N 3.32Å
108	L	52.6	Low	51.3	Low	114 Å²	114	103 Å²	103	60%	0.597	53%	0.526	S	S	*	.	H	α-helix	trans	-66.7	-39.5	174.5	-114.9	92.6	0	0	0	111.4	L104 S105 N111 A112	L104-L108 HydrophobicContact CD2-CD1 3.48Å; L104-L108 VanDerWaalsContact CD2-CD1 3.48Å; L104-L108 WeakPolarHBondContact O-CB 3.35Å; L104-L108 PolarHBondContact O-N 3.43Å; S105-L108 PolarHBondContact O-N 2.92Å; L108-N111 PolarHBondContact O-N 3.48Å; L108-A112 VanDerWaalsContact O-CB 3.24Å; L108-A112 WeakPolarHBondContact O-CB 3.44Å; L108-A112 PolarHBondContact O-N 2.98Å
109	Q	50.7	Low	50.9	Low	104 Å²	104	101.7 Å²	101.7	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-45	174.7	-173.8	164.2	38.2	0	0	110.5	S105 Y106 N111 A112 Y113	S105-Q109 VanDerWaalsContact O-CB 3.29Å; S105-Q109 WeakPolarHBondContact O-CB 3.11Å; S105-Q109 PolarHBondContact O-N 3.41Å; Y106-Q109 PolarHBondContact O-N 3.49Å; Q109-N111 VanDerWaalsContact C-N 3.33Å; Q109-N111 PolarHBondContact O-N 3.24Å; Q109-A112 PolarHBondContact O-N 3.1Å; Q109-Y113 HydrophobicContact CG-CD2 3.73Å; Q109-Y113 HydrophobicContact CG-CE2 3.52Å; Q109-Y113 WeakPolarHBondContact O-CD2 3.22Å; Q109-Y113 PolarHBondContact O-N 3.36Å
110	G	48.3	Very low	50.2	Low	32 Å²	32	104.6 Å²	104.6	33%	0.33	55%	0.55	S	S	.	.	H	α-helix	trans	-60.1	-39.5	173	0	0	0	0	0	113	Y106 N107 Y113 N114	Y106-G110 PolarHBondContact O-N 2.87Å; N107-G110 PolarHBondContact O-N 2.93Å; G110-Y113 PolarHBondContact O-N 3.3Å; G110-N114 WeakPolarHBondContact O-CB 3.38Å; G110-N114 PolarHBondContact O-N 2.99Å; G110-N114 PolarHBondContact O-ND2 3.31Å
111	N	52	Low	49.5	Very low	114 Å²	114	107 Å²	107	61%	0.61	56%	0.559	S	S	*	*	H	α-helix	trans	-74.5	-33.1	177.9	-135.2	26.5	0	0	0	112.3	N107 L108 Q109 N114 A115	N107-N111 VanDerWaalsContact O-CB 3.3Å; N107-N111 WeakPolarHBondContact O-CB 3.28Å; N107-N111 PolarHBondContact O-N 3.32Å; L108-N111 PolarHBondContact O-N 3.48Å; Q109-N111 VanDerWaalsContact C-N 3.33Å; Q109-N111 PolarHBondContact O-N 3.24Å; N111-N114 PolarHBondContact O-N 3.39Å; N111-A115 WeakPolarHBondContact O-CB 3.49Å; N111-A115 PolarHBondContact O-N 3.49Å
112	A	52.2	Low	49	Very low	50 Å²	50	105.3 Å²	105.3	41%	0.413	56%	0.559	S	S	.	*	H	α-helix	trans	-69.3	-38.8	172.6	0	0	0	0	0	111.4	L108 Q109 N114 A115 F116	L108-A112 VanDerWaalsContact O-CB 3.24Å; L108-A112 WeakPolarHBondContact O-CB 3.44Å; L108-A112 PolarHBondContact O-N 2.98Å; Q109-A112 PolarHBondContact O-N 3.1Å; A112-N114 VanDerWaalsContact C-N 3.35Å; A112-A115 PolarHBondContact O-N 3Å; A112-F116 PolarHBondContact O-N 3.46Å
113	Y	46.8	Very low	49	Very low	157 Å²	157	105.9 Å²	105.9	62%	0.616	57%	0.571	S	S	*	*	H	α-helix	trans	-63.9	-39.7	170.4	-84.3	-69.1	0	0	0	111.7	Q109 G110 F116 S117	Q109-Y113 HydrophobicContact CG-CD2 3.73Å; Q109-Y113 HydrophobicContact CG-CE2 3.52Å; Q109-Y113 WeakPolarHBondContact O-CD2 3.22Å; Q109-Y113 PolarHBondContact O-N 3.36Å; G110-Y113 PolarHBondContact O-N 3.3Å; Y113-F116 PolarHBondContact O-N 3.32Å; Y113-S117 WeakPolarHBondContact O-CB 3.42Å; Y113-S117 PolarHBondContact O-N 3.3Å; Y113-S117 PolarHBondContact O-OG 3.42Å
114	N	51.4	Low	48.8	Very low	101 Å²	101	109.2 Å²	109.2	54%	0.54	59%	0.585	S	S	.	*	H	α-helix	trans	-68.4	-34.8	174.1	-72.4	-21	0	0	0	112.7	G110 N111 A112 S117 F118	G110-N114 WeakPolarHBondContact O-CB 3.38Å; G110-N114 PolarHBondContact O-N 2.99Å; G110-N114 PolarHBondContact O-ND2 3.31Å; N111-N114 PolarHBondContact O-N 3.39Å; A112-N114 VanDerWaalsContact C-N 3.35Å; N114-S117 WeakPolarHBondContact CA-OG 3.33Å; N114-S117 PolarHBondContact O-N 3.46Å; N114-S117 PolarHBondContact O-OG 3.19Å; N114-F118 WeakPolarHBondContact O-CB 3.34Å; N114-F118 PolarHBondContact O-N 2.83Å
115	A	52.2	Low	48.3	Very low	56 Å²	56	112 Å²	112	46%	0.463	60%	0.6	S	S	.	*	H	α-helix	trans	-69.6	-40.6	175.1	0	0	0	0	0	111.6	N111 A112 F118 V119	N111-A115 WeakPolarHBondContact O-CB 3.49Å; N111-A115 PolarHBondContact O-N 3.49Å; A112-A115 PolarHBondContact O-N 3Å; A115-F118 PolarHBondContact O-N 3.13Å; A115-V119 WeakPolarHBondContact O-CG2 3.25Å; A115-V119 PolarHBondContact O-N 3.32Å; A115-V119 VanDerWaalsContact O-N 3.1Å
116	F	49.6	Very low	47.6	Very low	163 Å²	163	117.9 Å²	117.9	72%	0.715	62%	0.618	S	S	*	*	H	α-helix	trans	-68	-35.2	173.2	-98.7	-83.9	0	0	0	112.5	A112 Y113 F118 V119 N120	A112-F116 PolarHBondContact O-N 3.46Å; Y113-F116 PolarHBondContact O-N 3.32Å; F116-F118 VanDerWaalsContact C-N 3.3Å; F116-F118 PolarHBondContact O-N 2.91Å; F116-V119 PolarHBondContact O-N 2.83Å; F116-N120 PolarHBondContact O-N 3.3Å
117	S	48.5	Very low	47.1	Very low	73 Å²	73	114.9 Å²	114.9	51%	0.51	62%	0.619	S	S	.	*	H	α-helix	trans	-69.9	-28.1	174.5	76.5	0	0	0	0	112.5	Y113 N114 N120	Y113-S117 WeakPolarHBondContact O-CB 3.42Å; Y113-S117 PolarHBondContact O-N 3.3Å; Y113-S117 PolarHBondContact O-OG 3.42Å; N114-S117 WeakPolarHBondContact CA-OG 3.33Å; N114-S117 PolarHBondContact O-N 3.46Å; N114-S117 PolarHBondContact O-OG 3.19Å; S117-N120 PolarHBondContact O-N 3.5Å
118	F	49.1	Very low	47	Very low	163 Å²	163	114.3 Å²	114.3	72%	0.715	62%	0.622	S	S	*	*	H	α-helix	trans	-71.2	-39.2	172.3	-157.2	-92.3	0	0	0	112.3	N114 A115 F116 N120 K121	N114-F118 WeakPolarHBondContact O-CB 3.34Å; N114-F118 PolarHBondContact O-N 2.83Å; A115-F118 PolarHBondContact O-N 3.13Å; F116-F118 VanDerWaalsContact C-N 3.3Å; F116-F118 PolarHBondContact O-N 2.91Å; F118-N120 VanDerWaalsContact C-N 3.28Å; F118-N120 PolarHBondContact O-N 3.18Å; F118-K121 PolarHBondContact O-N 2.93Å
119	V	49.1	Very low	46.5	Very low	119 Å²	119	116 Å²	116	72%	0.721	63%	0.631	S	S	*	*	H	α-helix	trans	-67.6	-29	174.7	173.2	0	0	0	0	111.8	A115 F116 K121	A115-V119 WeakPolarHBondContact O-CG2 3.25Å; A115-V119 PolarHBondContact O-N 3.32Å; A115-V119 VanDerWaalsContact O-N 3.1Å; F116-V119 PolarHBondContact O-N 2.83Å; V119-K121 VanDerWaalsContact C-N 3.26Å; V119-K121 PolarHBondContact O-N 2.95Å
120	N	38.8	Very low	46	Very low	143 Å²	143	116.2 Å²	116.2	77%	0.765	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	6.6	177.1	-152.4	36.3	0	0	0	114.1	F116 S117 F118 S122	F116-N120 PolarHBondContact O-N 3.3Å; S117-N120 PolarHBondContact O-N 3.5Å; F118-N120 VanDerWaalsContact C-N 3.28Å; F118-N120 PolarHBondContact O-N 3.18Å; N120-S122 PolarHBondContact O-N 2.95Å
121	K	42.1	Very low	45.7	Very low	167 Å²	167	123 Å²	123	73%	0.726	67%	0.672	S	S	*	*	S	Bend	trans	-77.2	103.7	165.9	-126.5	-176.4	-175.9	-178.2	0	107.9	F118 V119	F118-K121 PolarHBondContact O-N 2.93Å; V119-K121 VanDerWaalsContact C-N 3.26Å; V119-K121 PolarHBondContact O-N 2.95Å
122	S	41.5	Very low	45	Very low	79 Å²	79	122.9 Å²	122.9	55%	0.552	68%	0.68	S	S	*	*			trans	-37.6	134.6	172.8	-161.7	0	0	0	0	111.6	N120 D124	N120-S122 PolarHBondContact O-N 2.95Å; S122-D124 PolarHBondContact O-N 3.24Å; S122-D124 PolarHBondContact OG-OD2 2.84Å
123	P	50	Low	44.4	Very low	102 Å²	102	127.3 Å²	127.3	66%	0.662	70%	0.697	S	S	*	*	S	Bend	trans	-70.5	21.7	-179.5	28.9	-33.7	0	0	0	114.8	N125	P123-N125 VanDerWaalsContact C-N 3.3Å; P123-N125 PolarHBondContact O-N 3.37Å
124	D	47.2	Very low	43.9	Very low	126 Å²	126	129 Å²	129	67%	0.674	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	10.4	-173.9	-67	-46.2	0	0	0	115.3	S122	S122-D124 PolarHBondContact O-N 3.24Å; S122-D124 PolarHBondContact OG-OD2 2.84Å
125	N	39.3	Very low	43.1	Very low	160 Å²	160	131.5 Å²	131.5	86%	0.856	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.7	54.8	169.9	-85.2	-44.3	0	0	0	111.4	P123 S127	P123-N125 VanDerWaalsContact C-N 3.3Å; P123-N125 PolarHBondContact O-N 3.37Å; N125-S127 VanDerWaalsContact C-N 3.25Å; N125-S127 PolarHBondContact O-N 2.86Å
126	F	37.4	Very low	42.5	Very low	185 Å²	185	134 Å²	134	81%	0.811	72%	0.723	S	S	*	*			trans	-67.8	91.8	152.1	-102.4	-90.3	0	0	0	108.1	P128	F126-P128 WeakPolarHBondContact O-CD 3.46Å
127	S	40.5	Very low	41.8	Very low	87 Å²	87	131.1 Å²	131.1	61%	0.608	72%	0.715	S	S	*	*			trans	-88.8	109	160.1	-168.9	0	0	0	0	107.2	N125 N129	N125-S127 VanDerWaalsContact C-N 3.25Å; N125-S127 PolarHBondContact O-N 2.86Å; S127-N129 PolarHBondContact O-N 3.45Å
128	P	48.2	Very low	41.3	Very low	105 Å²	105	135.5 Å²	135.5	68%	0.682	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	5.4	-173.7	25.2	-32.8	0	0	0	114.8	F126	F126-P128 WeakPolarHBondContact O-CD 3.46Å
129	N	42.3	Very low	40.6	Very low	149 Å²	149	135.2 Å²	135.2	80%	0.797	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	14.7	-168.5	-69.1	0.9	0	0	0	115.5	S127	S127-N129 PolarHBondContact O-N 3.45Å
130	S	40.6	Very low	40.3	Very low	109 Å²	109	135 Å²	135	76%	0.762	73%	0.733	S	S	*	*			trans	-122.3	47.2	170.2	79.9	0	0	0	0	112.6
131	L	41.9	Very low	40.4	Very low	176 Å²	176	135.2 Å²	135.2	92%	0.921	73%	0.733	S	S	*	*			trans	-98.1	65.2	167.2	-149	104.5	0	0	0	109.3
132	S	37.1	Very low	40.3	Very low	110 Å²	110	132.2 Å²	132.2	77%	0.769	73%	0.73	S	S	*	*	S	Bend	trans	-137.1	102.4	166.4	-165.8	0	0	0	0	109.5
133	D	38	Very low	40.6	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	73%	0.732	S	S	*	*			trans	74	43	138.4	-134.5	7	0	0	0	119.4
134	K	37.1	Very low	40.2	Very low	193 Å²	193	134 Å²	134	84%	0.839	74%	0.735	S	S	*	*			trans	-106.9	82.8	143.8	-95.1	-172	176.3	179.2	0	109.5	V136	K134-V136 PolarHBondContact O-N 3.34Å
135	K	34.7	Very low	39.9	Very low	154 Å²	154	134.5 Å²	134.5	67%	0.67	74%	0.738	S	S	*	*			trans	-59.7	81.2	162.5	-163.2	-176	-171	-131.9	0	108.9	D137	K135-D137 WeakPolarHBondContact CD-OD2 3.44Å; K135-D137 WeakPolarHBondContact CE-OD1 3.49Å; K135-D137 WeakPolarHBondContact CE-OD2 3.34Å; K135-D137 WeakPolarHBondContact CG-OD1 3.19Å; K135-D137 IonicContact NZ-OD1 3.7Å; K135-D137 IonicContact NZ-OD2 2.68Å; K135-D137 PolarHBondContact NZ-OD2 2.82Å; K135-D137 PolarHBondContact O-N 2.77Å
136	V	39.8	Very low	40.2	Very low	108 Å²	108	135.6 Å²	135.6	66%	0.655	73%	0.732	S	S	*	*			trans	-77.2	82.1	165.4	-178.2	0	0	0	0	105.5	K134 H138	K134-V136 PolarHBondContact O-N 3.34Å; V136-H138 HydrophobicContact CG1-CB 4.23Å; V136-H138 PolarHBondContact O-N 3.26Å
137	D	34.8	Very low	40.3	Very low	102 Å²	102	135.2 Å²	135.2	55%	0.545	73%	0.732	S	S	.	*			trans	-70	66	168.5	-76.2	-29.9	0	0	0	109	K135	K135-D137 WeakPolarHBondContact CD-OD2 3.44Å; K135-D137 WeakPolarHBondContact CE-OD1 3.49Å; K135-D137 WeakPolarHBondContact CE-OD2 3.34Å; K135-D137 WeakPolarHBondContact CG-OD1 3.19Å; K135-D137 IonicContact NZ-OD1 3.7Å; K135-D137 IonicContact NZ-OD2 2.68Å; K135-D137 PolarHBondContact NZ-OD2 2.82Å; K135-D137 PolarHBondContact O-N 2.77Å
138	H	38.2	Very low	40.4	Very low	165 Å²	165	139.2 Å²	139.2	76%	0.764	74%	0.741	S	S	*	*			trans	-115.4	72.7	159.5	-67.5	-25.3	0	0	0	106.7	V136	V136-H138 HydrophobicContact CG1-CB 4.23Å; V136-H138 PolarHBondContact O-N 3.26Å
139	L	34.3	Very low	40.1	Very low	157 Å²	157	145.6 Å²	145.6	82%	0.822	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-55	125.4	164.3	-132.5	76.7	0	0	0	107.3	I141	L139-I141 PolarHBondContact O-N 3.33Å
140	P	43.4	Very low	40.4	Very low	114 Å²	114	145.1 Å²	145.1	74%	0.74	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-68.7	122.4	-173.7	25.3	-31.7	0	0	0	109.8	P142	P140-P142 WeakPolarHBondContact O-CD 3.18Å
141	I	40.9	Very low	40.6	Very low	149 Å²	149	145.5 Å²	145.5	76%	0.764	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-61.9	119.5	171.2	-61.8	168	0	0	0	107	L139 V143	L139-I141 PolarHBondContact O-N 3.33Å; I141-V143 WeakPolarHBondContact O-CG2 3.05Å; I141-V143 PolarHBondContact O-N 3.37Å; I141-V143 VanDerWaalsContact O-N 3.14Å
142	P	40	Very low	40.4	Very low	103 Å²	103	145.9 Å²	145.9	67%	0.669	75%	0.747	S	S	*	*			trans	-65.9	115.3	-179.2	24.1	-30.9	0	0	0	110	P140 T144	P140-P142 WeakPolarHBondContact O-CD 3.18Å; P142-T144 VanDerWaalsContact C-N 3.33Å; P142-T144 PolarHBondContact O-N 3.37Å
143	V	46.9	Very low	41	Very low	100 Å²	100	145.7 Å²	145.7	61%	0.606	74%	0.744	S	S	*	*			trans	-82.9	74.1	-175.1	-154	0	0	0	0	109.6	I141 N145 Y146	I141-V143 WeakPolarHBondContact O-CG2 3.05Å; I141-V143 PolarHBondContact O-N 3.37Å; I141-V143 VanDerWaalsContact O-N 3.14Å; V143-N145 PolarHBondContact O-N 3.05Å; V143-Y146 HydrophobicContact CB-CE2 3.97Å; V143-Y146 HydrophobicContact CG1-CE2 3.99Å
144	T	42.1	Very low	41.4	Very low	118 Å²	118	144.7 Å²	144.7	72%	0.724	75%	0.745	S	S	*	*			trans	-90.3	72.9	178.3	56.6	0	0	0	0	111.4	P142	P142-T144 VanDerWaalsContact C-N 3.33Å; P142-T144 PolarHBondContact O-N 3.37Å
145	N	41.3	Very low	41.9	Very low	137 Å²	137	147 Å²	147	73%	0.733	75%	0.748	S	S	*	*			trans	-178.1	81.9	150.8	-114.1	-76.1	0	0	0	112.6	V143	V143-N145 PolarHBondContact O-N 3.05Å
146	Y	45.2	Very low	42.2	Very low	184 Å²	184	150.9 Å²	150.9	72%	0.722	76%	0.759	S	S	*	*			trans	-92.9	9	172.6	-79.3	-79.6	0	0	0	114.3	V143	V143-Y146 HydrophobicContact CB-CE2 3.97Å; V143-Y146 HydrophobicContact CG1-CE2 3.99Å
147	H	38	Very low	42.1	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.815	76%	0.764	S	S	*	*			trans	-93.7	-2	-171.1	-69.8	-52.7	0	0	0	116.2	R149	H147-R149 PolarHBondContact O-N 3.31Å; H147-R149 VanDerWaalsContact O-N 3.15Å
148	Q	44.4	Very low	42.6	Very low	171 Å²	171	150.8 Å²	150.8	80%	0.799	77%	0.772	S	S	*	*			trans	-91	79.7	171.3	-150.1	145.3	-4.2	0	0	109.3	L150	Q148-L150 PolarHBondContact O-N 3.27Å
149	R	40.1	Very low	42.7	Very low	239 Å²	239	150.8 Å²	150.8	90%	0.902	78%	0.776	S	S	*	*			trans	-53.9	100.2	168.7	-74.9	-172.4	-175.8	-170	2.5	108.6	H147	H147-R149 PolarHBondContact O-N 3.31Å; H147-R149 VanDerWaalsContact O-N 3.15Å
150	L	49.6	Very low	43.8	Very low	140 Å²	140	157 Å²	157	73%	0.733	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67.7	142.6	164.8	-78.2	147.6	0	0	0	108.7	Q148	Q148-L150 PolarHBondContact O-N 3.27Å
151	P	44.3	Very low	43.8	Very low	117 Å²	117	159.1 Å²	159.1	76%	0.76	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-63.7	137.3	-169.3	23.9	-32.1	0	0	0	111.7
152	M	39	Very low	44	Very low	183 Å²	183	159.6 Å²	159.6	90%	0.901	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-53.4	127.8	178.9	-120.9	179.8	168	0	0	110.7
153	P	48.4	Very low	44.2	Very low	106 Å²	106	162.8 Å²	162.8	69%	0.688	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66.1	147.3	175.2	25.4	-31.9	0	0	0	110.7	R155	P153-R155 PolarHBondContact O-N 2.98Å
154	P	46.7	Very low	44	Very low	122 Å²	122	166.5 Å²	166.5	79%	0.792	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-63.5	121.5	-178.9	24.5	-31.6	0	0	0	110.1	R156	P154-R156 PolarHBondContact O-N 3.17Å; P154-R156 VanDerWaalsContact O-N 3.08Å
155	R	47.4	Very low	44.1	Very low	242 Å²	242	169.5 Å²	169.5	91%	0.913	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-54.5	116.5	168.3	-88	-174.6	174.3	176.4	-1.7	108.1	P153 A157	P153-R155 PolarHBondContact O-N 2.98Å; R155-A157 PolarHBondContact O-N 2.98Å
156	R	42.1	Very low	44.3	Very low	235 Å²	235	171.7 Å²	171.7	89%	0.887	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-59.4	122.2	164.7	-72.5	-171.5	-175.9	-168.8	3.2	107.3	P154 V158	P154-R156 PolarHBondContact O-N 3.17Å; P154-R156 VanDerWaalsContact O-N 3.08Å; R156-V158 PolarHBondContact O-N 3.17Å; R156-V158 VanDerWaalsContact O-N 3.08Å
157	A	37.1	Very low	44.3	Very low	93 Å²	93	170.8 Å²	170.8	77%	0.769	83%	0.832	S	S	*	*			trans	-62	111.5	168.9	0	0	0	0	0	107.4	R155 L159	R155-A157 PolarHBondContact O-N 2.98Å; A157-L159 PolarHBondContact O-N 2.68Å; A157-L159 VanDerWaalsContact O-N 3.13Å
158	V	44.5	Very low	44.7	Very low	116 Å²	116	170.4 Å²	170.4	70%	0.703	83%	0.833	S	S	*	*			trans	-73.3	101	167.8	-178.9	0	0	0	0	105.5	R156 Y160	R156-V158 PolarHBondContact O-N 3.17Å; R156-V158 VanDerWaalsContact O-N 3.08Å; V158-Y160 PolarHBondContact O-N 3.33Å
159	L	41	Very low	44.8	Very low	164 Å²	164	170.3 Å²	170.3	86%	0.859	84%	0.836	S	S	*	*			trans	-72.9	110.9	160	-84	154.3	0	0	0	105.9	A157	A157-L159 PolarHBondContact O-N 2.68Å; A157-L159 VanDerWaalsContact O-N 3.13Å
160	Y	57.2	Low	45.2	Very low	287 Å²	287	164.1 Å²	164.1	100%	1.125	83%	0.83	S	S	*	*			trans	-59.5	0	166.5	-80.2	-89.1	0	0	0	110.7	V158	V158-Y160 PolarHBondContact O-N 3.33Å

Retrieved 160 of 160 residues in 57.4 ms (Link to these results)

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