A0A077Z363_TRITR Loading...

E3 ubiquitin-protein ligase RNF220 middle domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z363, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 149 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	39.5	Very low	70.7	Confident	238 Å²	238	103.4 Å²	103.4	100%	1.172	53%	0.527	S	S	*	.				0	132.6	0	-75.3	168.5	175.1	0	0	107.2	V3	M1-V3 PolarHBondContact O-N 3.45Å
2	R	51.3	Low	71.6	Confident	237 Å²	237	99.6 Å²	99.6	89%	0.894	52%	0.515	S	S	*	.			trans	-70.3	116	171.7	-71.1	-172.5	178.7	170.3	0.6	105.9	D4	R2-D4 PolarHBondContact O-N 3.11Å; R2-D4 VanDerWaalsContact O-N 3.14Å
3	V	55.9	Low	72.3	Confident	115 Å²	115	94.7 Å²	94.7	70%	0.697	50%	0.504	S	S	*	.			trans	-63.2	112.2	162.4	-177.1	0	0	0	0	103.4	M1 D5	M1-V3 PolarHBondContact O-N 3.45Å; V3-D5 PolarHBondContact O-N 2.82Å
4	D	70	Confident	73	Confident	130 Å²	130	95.8 Å²	95.8	70%	0.695	51%	0.505	S	S	*	.			trans	-62.3	107.3	171.3	-79.5	-50.8	0	0	0	105.6	R2 S6	R2-D4 PolarHBondContact O-N 3.11Å; R2-D4 VanDerWaalsContact O-N 3.14Å; D4-S6 PolarHBondContact O-N 2.78Å
5	D	83.4	Confident	73.9	Confident	82 Å²	82	96.3 Å²	96.3	44%	0.439	51%	0.513	S	S	.	.			trans	-72.1	51.5	178.8	-74.4	-29.5	0	0	0	109.5	V3 H17 L18	V3-D5 PolarHBondContact O-N 2.82Å; D5-H17 CarbonylContact O-C 3.53Å; D5-H17 WeakPolarHBondContact O-CA 3.36Å; D5-H17 PolarHBondContact O-ND1 3.35Å; D5-H17 VanDerWaalsContact O-ND1 3.15Å; D5-L18 HydrophobicContact CB-CD1 4.34Å; D5-L18 PolarHBondContact O-N 3.07Å
6	S	87	Confident	74.5	Confident	48 Å²	48	91.4 Å²	91.4	34%	0.336	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	148.5	179	59.5	0	0	0	0	112	D4 L16	D4-S6 PolarHBondContact O-N 2.78Å; S6-L16 CarbonylContact C-O 3.57Å; S6-L16 WeakPolarHBondContact CA-O 3.27Å; S6-L16 WeakPolarHBondContact CB-O 3.35Å
7	C	81.8	Confident	75.2	Confident	33 Å²	33	92.9 Å²	92.9	22%	0.223	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	150.1	176	63.1	0	0	0	0	109.8	V15 L16 L18 V21	C7-V15 CarbonylContact O-C 3.43Å; C7-L16 PolarHBondContact N-O 3.35Å; C7-L16 PolarHBondContact O-N 2.88Å; C7-L18 HydrophobicContact CB-CD2 4.09Å; C7-V21 WeakPolarHBondContact SG-CG2 3.37Å
8	E	82.2	Confident	75.6	Confident	137 Å²	137	91.1 Å²	91.1	64%	0.64	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	130.4	173.5	-167.3	-179.8	162.4	0	0	110.4	P10 G13 E14	E8-P10 WeakPolarHBondContact O-CD 3.49Å; E8-G13 WeakPolarHBondContact CG-O 3.22Å; E8-E14 CarbonylContact C-O 3.59Å; E8-E14 WeakPolarHBondContact CA-O 3.43Å
9	C	77.6	Confident	76.1	Confident	1 Å²	1	95.7 Å²	95.7	1%	0.007	50%	0.496	C	S	.	.			trans	-68.4	120.6	175	-178.3	0	0	0	0	109.7	I11 C12 G13 E14 L16 H24 E28	C9-I11 PolarHBondContact O-N 2.89Å; C9-I11 VanDerWaalsContact O-N 3.17Å; C9-I11 PolarHBondContact SG-N 2.83Å; C9-I11 VanDerWaalsContact SG-N 3.44Å; C9-C12 VanDerWaalsContact CB-SG 3.52Å; C9-G13 WeakPolarHBondContact O-CA 3.17Å; C9-G13 PolarHBondContact O-N 3.18Å; C9-E14 WeakPolarHBondContact CB-O 3.26Å; C9-E14 PolarHBondContact N-O 2.9Å; C9-L16 HydrophobicContact CB-CD1 3.83Å; C9-L16 HydrophobicContact CB-CG 4.27Å; C9-H24 PolarHBondContact SG-NE2 2.95Å; C9-E28 PolarHBondContact SG-OE2 2.86Å
10	P	75.8	Confident	76.6	Confident	70 Å²	70	95 Å²	95	46%	0.455	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-6.5	179	31.7	-39.2	0	0	0	113.8	E8 F25 L82	E8-P10 WeakPolarHBondContact O-CD 3.49Å; P10-F25 HydrophobicContact CG-CZ 4.33Å; P10-L82 HydrophobicContact CB-CD2 3.63Å; P10-L82 HydrophobicContact CG-CD2 3.25Å
11	I	73.7	Confident	76.8	Confident	46 Å²	46	90.8 Å²	90.8	24%	0.236	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-50.1	179.9	-59.2	-179	0	0	0	110.9	C9 F25 E28 R78 L82	C9-I11 PolarHBondContact O-N 2.89Å; C9-I11 VanDerWaalsContact O-N 3.17Å; C9-I11 PolarHBondContact SG-N 2.83Å; C9-I11 VanDerWaalsContact SG-N 3.44Å; I11-F25 HydrophobicContact CD1-CD1 3.75Å; I11-F25 HydrophobicContact CD1-CE1 3.68Å; I11-F25 HydrophobicContact CG1-CE1 4.07Å; I11-E28 WeakPolarHBondContact CB-OE1 3.09Å; I11-E28 WeakPolarHBondContact CB-OE2 3.38Å; I11-E28 VanDerWaalsContact CD1-OE2 3.26Å; I11-E28 WeakPolarHBondContact CD1-OE2 3.5Å; I11-E28 VanDerWaalsContact CG2-CD 3.49Å; I11-E28 WeakPolarHBondContact CG2-OE1 3.42Å; I11-R78 VanDerWaalsContact CG2-NH2 3.33Å; I11-R78 PolarHBondContact O-NH2 2.96Å; I11-L82 HydrophobicContact CD1-CD1 3.65Å; I11-L82 HydrophobicContact CG1-CD1 3.51Å; I11-L82 HydrophobicContact CG1-CD2 4.32Å
12	C	81.2	Confident	78.9	Confident	58 Å²	58	84.8 Å²	84.8	39%	0.392	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-12.2	-176.4	63.3	0	0	0	0	115.2	C9 E14 H24 E28	C9-C12 VanDerWaalsContact CB-SG 3.52Å; C12-E14 VanDerWaalsContact C-N 3.31Å; C12-E14 HydrophobicContact CB-CG 4.42Å; C12-E14 VanDerWaalsContact SG-CG 3.56Å; C12-H24 VanDerWaalsContact SG-CE1 3.57Å; C12-H24 PolarHBondContact SG-NE2 3.45Å; C12-E28 VanDerWaalsContact CB-OE1 3.26Å; C12-E28 WeakPolarHBondContact CB-OE1 2.7Å
13	G	81.1	Confident	80.6	Confident	36 Å²	36	80 Å²	80	37%	0.371	43%	0.432	S	S	.	.			trans	80.2	5.6	-176.8	0	0	0	0	0	114.6	E8 C9	E8-G13 WeakPolarHBondContact CG-O 3.22Å; C9-G13 WeakPolarHBondContact O-CA 3.17Å; C9-G13 PolarHBondContact O-N 3.18Å
14	E	81.3	Confident	82.1	Confident	110 Å²	110	75.8 Å²	75.8	51%	0.514	41%	0.405	S	S	.	.			trans	-73.4	137.3	178.8	-68.5	-177.6	-177.9	0	0	111.5	E8 C9 C12 L16 H24	E8-E14 CarbonylContact C-O 3.59Å; E8-E14 WeakPolarHBondContact CA-O 3.43Å; C9-E14 WeakPolarHBondContact CB-O 3.26Å; C9-E14 PolarHBondContact N-O 2.9Å; C12-E14 VanDerWaalsContact C-N 3.31Å; C12-E14 HydrophobicContact CB-CG 4.42Å; C12-E14 VanDerWaalsContact SG-CG 3.56Å; E14-L16 HydrophobicContact CB-CD2 4.21Å; E14-L16 PolarHBondContact O-N 3.32Å; E14-H24 IonicContact OE2-CE1 2.7Å; E14-H24 PolarHBondContact OE2-CE1 3.03Å; E14-H24 VanDerWaalsContact OE2-CE1 3.23Å; E14-H24 IonicContact OE2-ND1 3.51Å
15	V	86.4	Confident	82.6	Confident	104 Å²	104	71.6 Å²	71.6	63%	0.63	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.8	172.1	-179.5	0	0	0	0	108.9	C7	C7-V15 CarbonylContact O-C 3.43Å
16	L	83.8	Confident	82.8	Confident	18 Å²	18	72.8 Å²	72.8	9%	0.094	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	147.3	-177.2	-56.4	175.4	0	0	0	110.7	S6 C7 C9 E14 V21 H24	S6-L16 CarbonylContact C-O 3.57Å; S6-L16 WeakPolarHBondContact CA-O 3.27Å; S6-L16 WeakPolarHBondContact CB-O 3.35Å; C7-L16 PolarHBondContact N-O 3.35Å; C7-L16 PolarHBondContact O-N 2.88Å; C9-L16 HydrophobicContact CB-CD1 3.83Å; C9-L16 HydrophobicContact CB-CG 4.27Å; E14-L16 HydrophobicContact CB-CD2 4.21Å; E14-L16 PolarHBondContact O-N 3.32Å; L16-V21 HydrophobicContact CB-CG2 4.27Å; L16-V21 HydrophobicContact CD1-CG2 4.49Å; L16-H24 HydrophobicContact CD1-CB 3.65Å; L16-H24 VanDerWaalsContact CD1-CD2 3.41Å; L16-H24 WeakPolarHBondContact CD1-CD2 3.49Å; L16-H24 HydrophobicContact CD2-CB 4.2Å; L16-H24 WeakPolarHBondContact CD2-ND1 3.46Å
17	H	87.1	Confident	82.8	Confident	116 Å²	116	75.8 Å²	75.8	54%	0.537	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	140.2	162.3	-77.4	-62.6	0	0	0	110.8	D5 K19 N20 V21	D5-H17 CarbonylContact O-C 3.53Å; D5-H17 WeakPolarHBondContact O-CA 3.36Å; D5-H17 PolarHBondContact O-ND1 3.35Å; D5-H17 VanDerWaalsContact O-ND1 3.15Å; H17-K19 PolarHBondContact O-N 3.34Å; H17-N20 PolarHBondContact O-N 3.17Å; H17-V21 PolarHBondContact O-N 3.47Å
18	L	81.6	Confident	82.8	Confident	60 Å²	60	75.2 Å²	75.2	31%	0.314	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-52.7	-31.7	-178	-71.9	177.6	0	0	0	113.5	D5 C7 N20 V21 F89	D5-L18 HydrophobicContact CB-CD1 4.34Å; D5-L18 PolarHBondContact O-N 3.07Å; C7-L18 HydrophobicContact CB-CD2 4.09Å; L18-N20 VanDerWaalsContact C-N 3.29Å; L18-N20 PolarHBondContact O-N 2.96Å; L18-V21 HydrophobicContact CD2-CG2 4.46Å; L18-F89 HydrophobicContact CD1-CE1 4.48Å; L18-F89 HydrophobicContact CD1-CZ 4.49Å; L18-F89 HydrophobicContact CD2-CE1 3.58Å; L18-F89 HydrophobicContact CD2-CZ 3.74Å
19	K	85.5	Confident	82.8	Confident	179 Å²	179	71.1 Å²	71.1	78%	0.778	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-69.6	-23.2	177.7	-62.4	179.8	-176.8	175.1	0	114	H17	H17-K19 PolarHBondContact O-N 3.34Å
20	N	85.6	Confident	83.1	Confident	81 Å²	81	76 Å²	76	43%	0.433	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-102.4	-1.4	-175.7	-59.5	-3.8	0	0	0	112.2	H17 L18 D22 E23 H24	H17-N20 PolarHBondContact O-N 3.17Å; L18-N20 VanDerWaalsContact C-N 3.29Å; L18-N20 PolarHBondContact O-N 2.96Å; N20-D22 PolarHBondContact O-N 3.06Å; N20-E23 PolarHBondContact O-N 2.9Å; N20-H24 WeakPolarHBondContact O-CB 3.46Å; N20-H24 PolarHBondContact O-N 3.48Å
21	V	81.1	Confident	83.4	Confident	8 Å²	8	77.3 Å²	77.3	5%	0.048	39%	0.394	C	S	.	.	H	α-helix	trans	-61.4	-45.6	-174.3	172.3	0	0	0	0	111.7	C7 L16 H17 L18 H24 F25 M86	C7-V21 WeakPolarHBondContact SG-CG2 3.37Å; L16-V21 HydrophobicContact CB-CG2 4.27Å; L16-V21 HydrophobicContact CD1-CG2 4.49Å; H17-V21 PolarHBondContact O-N 3.47Å; L18-V21 HydrophobicContact CD2-CG2 4.46Å; V21-H24 PolarHBondContact O-N 2.9Å; V21-F25 HydrophobicContact CG1-CD2 3.48Å; V21-F25 VanDerWaalsContact CG1-CD2 3.48Å; V21-F25 HydrophobicContact CG1-CE2 3.31Å; V21-F25 WeakPolarHBondContact O-CD2 3.23Å; V21-F25 PolarHBondContact O-N 3.47Å; V21-M86 HydrophobicContact CG1-CE 3.7Å
22	D	82.8	Confident	83.7	Confident	111 Å²	111	77.3 Å²	77.3	59%	0.594	40%	0.396	S	S	*	.	H	α-helix	trans	-65	-42.3	-178.7	-70.9	-29.8	0	0	0	111.8	N20 F25 E26	N20-D22 PolarHBondContact O-N 3.06Å; D22-F25 PolarHBondContact O-N 3.01Å; D22-E26 WeakPolarHBondContact O-CB 3.43Å; D22-E26 PolarHBondContact O-N 3.28Å
23	E	88.3	Confident	83.8	Confident	138 Å²	138	79.5 Å²	79.5	65%	0.645	40%	0.404	S	S	*	.	H	α-helix	trans	-65	-43.1	176.9	-176.4	175.8	-167.2	0	0	111.6	N20 E26 Q27	N20-E23 PolarHBondContact O-N 2.9Å; E23-E26 PolarHBondContact O-N 2.85Å; E23-Q27 PolarHBondContact O-N 3.08Å
24	H	86.1	Confident	84	Confident	26 Å²	26	84.4 Å²	84.4	12%	0.12	42%	0.415	C	S	.	.	H	α-helix	trans	-61.1	-47.2	177.5	-176.3	90.5	0	0	0	111.6	C9 C12 E14 L16 N20 V21 E26 Q27 E28	C9-H24 PolarHBondContact SG-NE2 2.95Å; C12-H24 VanDerWaalsContact SG-CE1 3.57Å; C12-H24 PolarHBondContact SG-NE2 3.45Å; E14-H24 IonicContact OE2-CE1 2.7Å; E14-H24 PolarHBondContact OE2-CE1 3.03Å; E14-H24 VanDerWaalsContact OE2-CE1 3.23Å; E14-H24 IonicContact OE2-ND1 3.51Å; L16-H24 HydrophobicContact CD1-CB 3.65Å; L16-H24 VanDerWaalsContact CD1-CD2 3.41Å; L16-H24 WeakPolarHBondContact CD1-CD2 3.49Å; L16-H24 HydrophobicContact CD2-CB 4.2Å; L16-H24 WeakPolarHBondContact CD2-ND1 3.46Å; N20-H24 WeakPolarHBondContact O-CB 3.46Å; N20-H24 PolarHBondContact O-N 3.48Å; V21-H24 PolarHBondContact O-N 2.9Å; H24-E26 VanDerWaalsContact C-N 3.32Å; H24-E26 PolarHBondContact O-N 3.36Å; H24-Q27 PolarHBondContact O-N 3Å; H24-E28 IonicContact CD2-OE2 3.23Å; H24-E28 VanDerWaalsContact NE2-CD 3.32Å; H24-E28 IonicContact NE2-OE1 3.45Å; H24-E28 IonicContact NE2-OE2 3.82Å; H24-E28 PolarHBondContact NE2-OE2 3.06Å; H24-E28 PolarHBondContact O-N 3.29Å
25	F	82.3	Confident	84	Confident	42 Å²	42	81.8 Å²	81.8	18%	0.184	41%	0.406	C	S	.	.	H	α-helix	trans	-65.5	-35.1	177.4	-79.2	-57.2	0	0	0	112.8	P10 I11 V21 D22 Q27 E28 S29 M86	P10-F25 HydrophobicContact CG-CZ 4.33Å; I11-F25 HydrophobicContact CD1-CD1 3.75Å; I11-F25 HydrophobicContact CD1-CE1 3.68Å; I11-F25 HydrophobicContact CG1-CE1 4.07Å; V21-F25 HydrophobicContact CG1-CD2 3.48Å; V21-F25 VanDerWaalsContact CG1-CD2 3.48Å; V21-F25 HydrophobicContact CG1-CE2 3.31Å; V21-F25 WeakPolarHBondContact O-CD2 3.23Å; V21-F25 PolarHBondContact O-N 3.47Å; D22-F25 PolarHBondContact O-N 3.01Å; F25-Q27 VanDerWaalsContact C-N 3.33Å; F25-E28 PolarHBondContact O-N 2.92Å; F25-S29 WeakPolarHBondContact O-CB 3.17Å; F25-S29 PolarHBondContact O-N 2.75Å; F25-S29 PolarHBondContact O-OG 3.45Å; F25-M86 HydrophobicContact CE2-CE 4.02Å; F25-M86 HydrophobicContact CE2-CG 4.35Å; F25-M86 HydrophobicContact CE2-SD 3.75Å; F25-M86 HydrophobicContact CZ-SD 4.21Å
26	E	86.7	Confident	83.7	Confident	106 Å²	106	79.6 Å²	79.6	50%	0.495	39%	0.388	S	S	.	.	H	α-helix	trans	-63.4	-42.1	173.9	-165.4	-174.1	159.4	0	0	110.9	D22 E23 H24 S29 K30	D22-E26 WeakPolarHBondContact O-CB 3.43Å; D22-E26 PolarHBondContact O-N 3.28Å; E23-E26 PolarHBondContact O-N 2.85Å; H24-E26 VanDerWaalsContact C-N 3.32Å; H24-E26 PolarHBondContact O-N 3.36Å; E26-S29 PolarHBondContact O-N 3.41Å; E26-S29 PolarHBondContact O-OG 3.36Å; E26-K30 WeakPolarHBondContact O-CG 3.15Å; E26-K30 PolarHBondContact O-N 2.88Å; E26-K30 VanDerWaalsContact O-N 3.16Å; E26-K30 VanDerWaalsContact OE1-CE 3.32Å; E26-K30 WeakPolarHBondContact OE1-CE 3.49Å; E26-K30 IonicContact OE1-NZ 3.72Å; E26-K30 PolarHBondContact OE1-NZ 2.97Å
27	Q	87.3	Confident	83.5	Confident	111 Å²	111	81 Å²	81	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-63.6	-49.1	175.7	-175.7	175.4	-17.2	0	0	111.8	E23 H24 F25 S29 K30 E31	E23-Q27 PolarHBondContact O-N 3.08Å; H24-Q27 PolarHBondContact O-N 3Å; F25-Q27 VanDerWaalsContact C-N 3.33Å; Q27-S29 VanDerWaalsContact C-N 3.26Å; Q27-S29 PolarHBondContact O-N 2.83Å; Q27-K30 PolarHBondContact O-N 3.31Å; Q27-K30 VanDerWaalsContact O-N 3.12Å; Q27-E31 PolarHBondContact NE2-OE1 3.14Å; Q27-E31 PolarHBondContact O-N 3.31Å
28	E	80.8	Confident	83.2	Confident	22 Å²	22	83.5 Å²	83.5	10%	0.103	41%	0.407	C	S	.	.	H	α-helix	trans	-60	-37.8	178	-74.4	-164.1	118.9	0	0	111.9	C9 I11 C12 H24 F25 K30 E31 V32	C9-E28 PolarHBondContact SG-OE2 2.86Å; I11-E28 WeakPolarHBondContact CB-OE1 3.09Å; I11-E28 WeakPolarHBondContact CB-OE2 3.38Å; I11-E28 VanDerWaalsContact CD1-OE2 3.26Å; I11-E28 WeakPolarHBondContact CD1-OE2 3.5Å; I11-E28 VanDerWaalsContact CG2-CD 3.49Å; I11-E28 WeakPolarHBondContact CG2-OE1 3.42Å; C12-E28 VanDerWaalsContact CB-OE1 3.26Å; C12-E28 WeakPolarHBondContact CB-OE1 2.7Å; H24-E28 IonicContact CD2-OE2 3.23Å; H24-E28 VanDerWaalsContact NE2-CD 3.32Å; H24-E28 IonicContact NE2-OE1 3.45Å; H24-E28 IonicContact NE2-OE2 3.82Å; H24-E28 PolarHBondContact NE2-OE2 3.06Å; H24-E28 PolarHBondContact O-N 3.29Å; F25-E28 PolarHBondContact O-N 2.92Å; E28-K30 PolarHBondContact O-N 3.47Å; E28-E31 PolarHBondContact O-N 3.37Å; E28-V32 WeakPolarHBondContact O-CG2 3.38Å; E28-V32 PolarHBondContact O-N 3.41Å
29	S	82.1	Confident	83	Confident	50 Å²	50	84.3 Å²	84.3	35%	0.35	41%	0.414	S	S	.	.	H	α-helix	trans	-61.4	-43.2	175.9	76.3	0	0	0	0	112.1	F25 E26 Q27 E31 V32 D33	F25-S29 WeakPolarHBondContact O-CB 3.17Å; F25-S29 PolarHBondContact O-N 2.75Å; F25-S29 PolarHBondContact O-OG 3.45Å; E26-S29 PolarHBondContact O-N 3.41Å; E26-S29 PolarHBondContact O-OG 3.36Å; Q27-S29 VanDerWaalsContact C-N 3.26Å; Q27-S29 PolarHBondContact O-N 2.83Å; S29-E31 VanDerWaalsContact C-N 3.32Å; S29-E31 PolarHBondContact O-N 3.4Å; S29-V32 PolarHBondContact O-N 3.24Å; S29-D33 PolarHBondContact O-N 3.3Å
30	K	85.3	Confident	82.7	Confident	104 Å²	104	80.4 Å²	80.4	45%	0.452	40%	0.397	S	S	.	.	H	α-helix	trans	-65.5	-35.5	176.5	-70.5	169.7	-175.4	163.2	0	111.6	E26 Q27 E28 K34	E26-K30 WeakPolarHBondContact O-CG 3.15Å; E26-K30 PolarHBondContact O-N 2.88Å; E26-K30 VanDerWaalsContact O-N 3.16Å; E26-K30 VanDerWaalsContact OE1-CE 3.32Å; E26-K30 WeakPolarHBondContact OE1-CE 3.49Å; E26-K30 IonicContact OE1-NZ 3.72Å; E26-K30 PolarHBondContact OE1-NZ 2.97Å; Q27-K30 PolarHBondContact O-N 3.31Å; Q27-K30 VanDerWaalsContact O-N 3.12Å; E28-K30 PolarHBondContact O-N 3.47Å; K30-K34 WeakPolarHBondContact O-CB 3.47Å; K30-K34 VanDerWaalsContact O-CG 3.25Å; K30-K34 WeakPolarHBondContact O-CG 3.47Å; K30-K34 PolarHBondContact O-N 2.96Å
31	E	82.2	Confident	82.3	Confident	98 Å²	98	79.2 Å²	79.2	46%	0.458	40%	0.396	S	S	.	.	H	α-helix	trans	-70.2	-38.6	177.1	-71.1	-175.3	-171.2	0	0	112.6	Q27 E28 S29 K34 T35	Q27-E31 PolarHBondContact NE2-OE1 3.14Å; Q27-E31 PolarHBondContact O-N 3.31Å; E28-E31 PolarHBondContact O-N 3.37Å; S29-E31 VanDerWaalsContact C-N 3.32Å; S29-E31 PolarHBondContact O-N 3.4Å; E31-K34 PolarHBondContact O-N 3.24Å; E31-T35 WeakPolarHBondContact O-CB 3.36Å; E31-T35 PolarHBondContact O-N 2.98Å; E31-T35 PolarHBondContact O-OG1 2.96Å
32	V	80.3	Confident	82	Confident	46 Å²	46	82 Å²	82	28%	0.279	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-47.3	172	172.2	0	0	0	0	110.2	E28 S29 K34 T35 F36	E28-V32 WeakPolarHBondContact O-CG2 3.38Å; E28-V32 PolarHBondContact O-N 3.41Å; S29-V32 PolarHBondContact O-N 3.24Å; V32-K34 PolarHBondContact O-N 3.45Å; V32-T35 PolarHBondContact O-N 3.49Å; V32-T35 VanDerWaalsContact O-N 3.16Å; V32-F36 WeakPolarHBondContact O-CB 3.44Å; V32-F36 PolarHBondContact O-N 2.9Å
33	D	83.3	Confident	81.5	Confident	104 Å²	104	79.6 Å²	79.6	56%	0.556	40%	0.402	S	S	*	.	H	α-helix	trans	-62.7	-40.7	178.6	-74.8	-19.3	0	0	0	112.4	S29 T35 F36 A37	S29-D33 PolarHBondContact O-N 3.3Å; D33-T35 VanDerWaalsContact C-N 3.33Å; D33-T35 PolarHBondContact O-N 2.9Å; D33-F36 WeakPolarHBondContact O-CB 3.36Å; D33-F36 PolarHBondContact O-N 3.39Å; D33-A37 WeakPolarHBondContact O-CB 3.32Å; D33-A37 PolarHBondContact O-N 2.81Å
34	K	84.9	Confident	80.8	Confident	139 Å²	139	78.2 Å²	78.2	60%	0.604	40%	0.396	S	S	*	.	H	α-helix	trans	-62.3	-41.3	173.6	-76.9	172.5	-176.2	176.1	0	112	K30 E31 V32 F36 A37 R38	K30-K34 WeakPolarHBondContact O-CB 3.47Å; K30-K34 VanDerWaalsContact O-CG 3.25Å; K30-K34 WeakPolarHBondContact O-CG 3.47Å; K30-K34 PolarHBondContact O-N 2.96Å; E31-K34 PolarHBondContact O-N 3.24Å; V32-K34 PolarHBondContact O-N 3.45Å; K34-F36 VanDerWaalsContact C-N 3.35Å; K34-A37 PolarHBondContact O-N 3.45Å; K34-R38 WeakPolarHBondContact O-CG 3.49Å; K34-R38 PolarHBondContact O-N 3.27Å
35	T	80.1	Confident	79.8	Confident	54 Å²	54	83 Å²	83	33%	0.331	42%	0.418	S	S	.	.	H	α-helix	trans	-67.7	-40.6	179	-57.6	0	0	0	0	110.7	E31 V32 D33 R38 V39	E31-T35 WeakPolarHBondContact O-CB 3.36Å; E31-T35 PolarHBondContact O-N 2.98Å; E31-T35 PolarHBondContact O-OG1 2.96Å; V32-T35 PolarHBondContact O-N 3.49Å; V32-T35 VanDerWaalsContact O-N 3.16Å; D33-T35 VanDerWaalsContact C-N 3.33Å; D33-T35 PolarHBondContact O-N 2.9Å; T35-R38 PolarHBondContact O-N 3.49Å; T35-R38 PolarHBondContact OG1-NH2 2.86Å; T35-V39 WeakPolarHBondContact O-CG2 3.42Å; T35-V39 PolarHBondContact O-N 2.98Å
36	F	80	Confident	78.7	Confident	59 Å²	59	83.7 Å²	83.7	26%	0.259	43%	0.428	S	S	.	.	H	α-helix	trans	-61.9	-46	173.3	-176.7	-110.5	0	0	0	112.8	V32 D33 K34 R38 V39 K40 Y68 Y71	V32-F36 WeakPolarHBondContact O-CB 3.44Å; V32-F36 PolarHBondContact O-N 2.9Å; D33-F36 WeakPolarHBondContact O-CB 3.36Å; D33-F36 PolarHBondContact O-N 3.39Å; K34-F36 VanDerWaalsContact C-N 3.35Å; F36-R38 VanDerWaalsContact C-N 3.33Å; F36-R38 PolarHBondContact O-N 3.21Å; F36-V39 PolarHBondContact O-N 3.41Å; F36-K40 WeakPolarHBondContact O-CB 3.34Å; F36-K40 PolarHBondContact O-N 3.16Å; F36-Y68 AromaticContact CD2-CE2 3.89Å; F36-Y68 HydrophobicContact CD2-CE2 3.89Å; F36-Y68 HydrophobicContact CE1-CE2 4.37Å; F36-Y68 WeakPolarHBondContact CE1-OH 3.4Å; F36-Y68 HydrophobicContact CE2-CD2 4.11Å; F36-Y68 HydrophobicContact CE2-CE1 4.48Å; F36-Y68 AromaticContact CE2-CE2 3.13Å; F36-Y68 HydrophobicContact CE2-CE2 3.13Å; F36-Y68 AromaticContact CE2-CZ 3.41Å; F36-Y68 VanDerWaalsContact CE2-CZ 3.41Å; F36-Y68 WeakPolarHBondContact CE2-OH 3.34Å; F36-Y68 HydrophobicContact CZ-CE1 4.24Å; F36-Y68 AromaticContact CZ-CE2 3.49Å; F36-Y68 HydrophobicContact CZ-CE2 3.49Å; F36-Y68 VanDerWaalsContact CZ-CE2 3.49Å; F36-Y68 AromaticContact CZ-CZ 3.22Å; F36-Y68 WeakPolarHBondContact CZ-OH 3.25Å; F36-Y71 HydrophobicContact CD2-CD1 4.19Å; F36-Y71 AromaticContact CD2-CE1 3.66Å; F36-Y71 HydrophobicContact CD2-CE1 3.66Å; F36-Y71 HydrophobicContact CE2-CD1 4.17Å; F36-Y71 HydrophobicContact CE2-CE1 4.06Å
37	A	79.5	Confident	77.1	Confident	48 Å²	48	81.1 Å²	81.1	40%	0.397	43%	0.431	S	S	.	.	H	α-helix	trans	-59.1	-44	175.8	0	0	0	0	0	111.4	D33 K34 K40 S41	D33-A37 WeakPolarHBondContact O-CB 3.32Å; D33-A37 PolarHBondContact O-N 2.81Å; K34-A37 PolarHBondContact O-N 3.45Å; A37-K40 PolarHBondContact O-N 3.25Å; A37-S41 PolarHBondContact O-N 3.19Å; A37-S41 PolarHBondContact O-OG 3.35Å
38	R	81.3	Confident	75.4	Confident	167 Å²	167	83.8 Å²	83.8	63%	0.63	44%	0.44	S	S	*	.	H	α-helix	trans	-60.7	-45.7	175.7	-76.3	-176.9	-66.9	-168.5	1.8	112.7	K34 T35 F36 K40 S41 S42	K34-R38 WeakPolarHBondContact O-CG 3.49Å; K34-R38 PolarHBondContact O-N 3.27Å; T35-R38 PolarHBondContact O-N 3.49Å; T35-R38 PolarHBondContact OG1-NH2 2.86Å; F36-R38 VanDerWaalsContact C-N 3.33Å; F36-R38 PolarHBondContact O-N 3.21Å; R38-K40 VanDerWaalsContact C-N 3.34Å; R38-S41 PolarHBondContact O-N 2.98Å; R38-S42 WeakPolarHBondContact O-CB 3.31Å; R38-S42 PolarHBondContact O-N 3.49Å
39	V	78.8	Confident	74.1	Confident	77 Å²	77	88.8 Å²	88.8	47%	0.467	47%	0.467	S	S	.	.	H	α-helix	trans	-63.6	-42.3	177.6	171.9	0	0	0	0	110.7	T35 F36 S42 L43	T35-V39 WeakPolarHBondContact O-CG2 3.42Å; T35-V39 PolarHBondContact O-N 2.98Å; F36-V39 PolarHBondContact O-N 3.41Å; V39-S42 PolarHBondContact O-N 3.43Å; V39-L43 WeakPolarHBondContact O-CB 3.35Å; V39-L43 PolarHBondContact O-N 2.71Å
40	K	78.1	Confident	72.5	Confident	97 Å²	97	92.2 Å²	92.2	42%	0.422	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-48.4	177.1	-174.4	-177.8	173.2	-173.1	0	111.6	F36 A37 R38 S42 L43 E44	F36-K40 WeakPolarHBondContact O-CB 3.34Å; F36-K40 PolarHBondContact O-N 3.16Å; A37-K40 PolarHBondContact O-N 3.25Å; R38-K40 VanDerWaalsContact C-N 3.34Å; K40-S42 PolarHBondContact O-N 2.91Å; K40-L43 WeakPolarHBondContact O-CB 3.37Å; K40-L43 PolarHBondContact O-N 3.4Å; K40-E44 WeakPolarHBondContact CE-OE1 3.43Å; K40-E44 IonicContact NZ-OE1 3.96Å; K40-E44 WeakPolarHBondContact O-CG 3.48Å; K40-E44 PolarHBondContact O-N 2.93Å
41	S	77.1	Confident	70.7	Confident	57 Å²	57	95.4 Å²	95.4	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-41.7	177.2	-63	0	0	0	0	112.1	A37 R38 L43 E44 E45	A37-S41 PolarHBondContact O-N 3.19Å; A37-S41 PolarHBondContact O-OG 3.35Å; R38-S41 PolarHBondContact O-N 2.98Å; S41-L43 VanDerWaalsContact C-N 3.26Å; S41-L43 PolarHBondContact O-N 2.95Å; S41-E44 PolarHBondContact O-N 3.16Å; S41-E45 WeakPolarHBondContact O-CB 3.4Å; S41-E45 WeakPolarHBondContact O-CG 3.46Å; S41-E45 PolarHBondContact O-N 3.34Å
42	S	75.6	Confident	69.2	Low	66 Å²	66	96 Å²	96	46%	0.462	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-35.2	175.5	177.7	0	0	0	0	112.2	R38 V39 K40 S46	R38-S42 WeakPolarHBondContact O-CB 3.31Å; R38-S42 PolarHBondContact O-N 3.49Å; V39-S42 PolarHBondContact O-N 3.43Å; K40-S42 PolarHBondContact O-N 2.91Å; S42-S46 WeakPolarHBondContact O-CB 3.41Å; S42-S46 PolarHBondContact O-N 3.48Å; S42-S46 PolarHBondContact O-OG 2.86Å
43	L	72.5	Confident	67.5	Low	61 Å²	61	101.8 Å²	101.8	32%	0.319	53%	0.53	S	S	.	.	H	α-helix	trans	-69.8	-44.5	175.4	-179.3	62.6	0	0	0	112	V39 K40 S41 E45 S46 G47 S64	V39-L43 WeakPolarHBondContact O-CB 3.35Å; V39-L43 PolarHBondContact O-N 2.71Å; K40-L43 WeakPolarHBondContact O-CB 3.37Å; K40-L43 PolarHBondContact O-N 3.4Å; S41-L43 VanDerWaalsContact C-N 3.26Å; S41-L43 PolarHBondContact O-N 2.95Å; L43-E45 VanDerWaalsContact C-N 3.32Å; L43-E45 PolarHBondContact O-N 3.26Å; L43-S46 PolarHBondContact O-N 2.87Å; L43-G47 PolarHBondContact O-N 2.86Å; L43-S64 VanDerWaalsContact CD1-CB 3.44Å
44	E	73.6	Confident	66	Low	109 Å²	109	106.6 Å²	106.6	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-63.1	-37.1	175.7	-71.2	176.4	178.2	0	0	112	K40 S41 K48	K40-E44 WeakPolarHBondContact CE-OE1 3.43Å; K40-E44 IonicContact NZ-OE1 3.96Å; K40-E44 WeakPolarHBondContact O-CG 3.48Å; K40-E44 PolarHBondContact O-N 2.93Å; S41-E44 PolarHBondContact O-N 3.16Å; E44-K48 PolarHBondContact O-N 2.89Å
45	E	64	Low	64.1	Low	125 Å²	125	103.6 Å²	103.6	58%	0.584	55%	0.551	S	S	*	*	H	α-helix	trans	-68	-42.9	173.8	-75.2	175.3	-174.4	0	0	112	S41 L43 G47 K48 I49	S41-E45 WeakPolarHBondContact O-CB 3.4Å; S41-E45 WeakPolarHBondContact O-CG 3.46Å; S41-E45 PolarHBondContact O-N 3.34Å; L43-E45 VanDerWaalsContact C-N 3.32Å; L43-E45 PolarHBondContact O-N 3.26Å; E45-G47 VanDerWaalsContact C-N 3.29Å; E45-G47 PolarHBondContact O-N 2.85Å; E45-K48 PolarHBondContact O-N 3.46Å; E45-K48 VanDerWaalsContact O-N 3.14Å; E45-I49 WeakPolarHBondContact O-CG1 3.33Å; E45-I49 PolarHBondContact O-N 2.91Å
46	S	59.3	Low	62.8	Low	57 Å²	57	105.8 Å²	105.8	40%	0.399	56%	0.564	S	S	.	*	H	α-helix	trans	-63.1	-36.6	176.8	-57.2	0	0	0	0	111.9	S42 L43 K48 I49 E50	S42-S46 WeakPolarHBondContact O-CB 3.41Å; S42-S46 PolarHBondContact O-N 3.48Å; S42-S46 PolarHBondContact O-OG 2.86Å; L43-S46 PolarHBondContact O-N 2.87Å; S46-K48 VanDerWaalsContact C-N 3.27Å; S46-K48 PolarHBondContact O-N 2.87Å; S46-I49 PolarHBondContact O-N 3.49Å; S46-E50 PolarHBondContact O-N 3.28Å
47	G	52.8	Low	61.4	Low	53 Å²	53	107 Å²	107	55%	0.546	58%	0.579	S	S	.	*	H	α-helix	trans	-63.1	-29.8	174.8	0	0	0	0	0	113.6	L43 E45	L43-G47 PolarHBondContact O-N 2.86Å; E45-G47 VanDerWaalsContact C-N 3.29Å; E45-G47 PolarHBondContact O-N 2.85Å
48	K	53	Low	60	Low	166 Å²	166	110 Å²	110	72%	0.722	59%	0.588	S	S	*	*	H	α-helix	trans	-80.9	-27	176.7	-68.6	-177.2	-176.6	-171.7	0	113.7	E44 E45 S46	E44-K48 PolarHBondContact O-N 2.89Å; E45-K48 PolarHBondContact O-N 3.46Å; E45-K48 VanDerWaalsContact O-N 3.14Å; S46-K48 VanDerWaalsContact C-N 3.27Å; S46-K48 PolarHBondContact O-N 2.87Å
49	I	53.1	Low	58.6	Low	128 Å²	128	107.6 Å²	107.6	66%	0.656	59%	0.588	S	S	*	*	H	α-helix	trans	-78.9	-30	-179.5	-64.8	165.5	0	0	0	110.9	E45 S46	E45-I49 WeakPolarHBondContact O-CG1 3.33Å; E45-I49 PolarHBondContact O-N 2.91Å; S46-I49 PolarHBondContact O-N 3.49Å
50	E	48.2	Very low	57.1	Low	121 Å²	121	107.9 Å²	107.9	57%	0.565	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-85.1	-4.7	-177.1	-73.4	-73.6	144.2	0	0	114.5	S46 S52 K53	S46-E50 PolarHBondContact O-N 3.28Å; E50-S52 PolarHBondContact O-N 3.44Å; E50-K53 PolarHBondContact O-N 3.46Å; E50-K53 VanDerWaalsContact O-N 3.17Å
51	E	47.6	Very low	56	Low	171 Å²	171	108.7 Å²	108.7	80%	0.799	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-64.4	-3.2	175.8	-149.2	175.1	-169.4	0	0	113.2
52	S	49.8	Very low	54.9	Low	112 Å²	112	114.2 Å²	114.2	78%	0.783	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-103.4	9.5	176	-61.7	0	0	0	0	115.5	E50	E50-S52 PolarHBondContact O-N 3.44Å
53	K	46.2	Very low	54.1	Low	167 Å²	167	115.3 Å²	115.3	73%	0.726	61%	0.608	S	S	*	*			trans	-127	98.5	171	-86.2	-180	179.7	168.1	0	112.9	E50 A55	E50-K53 PolarHBondContact O-N 3.46Å; E50-K53 VanDerWaalsContact O-N 3.17Å; K53-A55 VanDerWaalsContact C-N 3.32Å; K53-A55 PolarHBondContact O-N 2.87Å
54	E	50.3	Low	53.4	Low	204 Å²	204	113.1 Å²	113.1	95%	0.953	60%	0.597	S	S	*	*			trans	-55.3	82.2	167.8	-168.6	170.7	-161.7	0	0	111.8
55	A	44.9	Very low	53	Low	77 Å²	77	111.7 Å²	111.7	64%	0.636	59%	0.593	S	S	*	*	S	Bend	trans	165.5	131.6	147.5	0	0	0	0	0	109.3	K53	K53-A55 VanDerWaalsContact C-N 3.32Å; K53-A55 PolarHBondContact O-N 2.87Å
56	T	53	Low	53.2	Low	100 Å²	100	106.9 Å²	106.9	61%	0.613	58%	0.578	S	S	*	*			trans	84	18.6	172.8	71.6	0	0	0	0	119.4	D58 D59 V60	T56-D58 PolarHBondContact O-N 3Å; T56-D59 PolarHBondContact O-N 3.28Å; T56-V60 PolarHBondContact O-N 3.02Å
57	C	50.2	Low	53.7	Low	85 Å²	85	111 Å²	111	57%	0.574	59%	0.585	S	S	*	*	H	α-helix	trans	-57.8	-40.7	177.3	-160.4	0	0	0	0	113.8	D59 V60 E61	C57-D59 VanDerWaalsContact C-N 3.34Å; C57-D59 PolarHBondContact O-N 2.87Å; C57-V60 PolarHBondContact O-N 3.31Å; C57-E61 WeakPolarHBondContact O-CB 3.36Å; C57-E61 PolarHBondContact O-N 2.99Å
58	D	51.6	Low	54.6	Low	110 Å²	110	111.5 Å²	111.5	59%	0.588	57%	0.57	S	S	*	*	H	α-helix	trans	-61.7	-35.6	-179	-84.5	-48.5	0	0	0	113.9	T56 R62	T56-D58 PolarHBondContact O-N 3Å; D58-R62 VanDerWaalsContact O-CB 3.26Å; D58-R62 WeakPolarHBondContact O-CB 3.49Å; D58-R62 VanDerWaalsContact O-CG 3.22Å; D58-R62 WeakPolarHBondContact O-CG 3.39Å; D58-R62 PolarHBondContact O-N 3.34Å
59	D	50.2	Low	55.5	Low	116 Å²	116	110 Å²	110	62%	0.62	57%	0.566	S	S	*	*	H	α-helix	trans	-77.3	-36.9	-178.9	-86.3	-38.2	0	0	0	111.7	T56 C57 N63	T56-D59 PolarHBondContact O-N 3.28Å; C57-D59 VanDerWaalsContact C-N 3.34Å; C57-D59 PolarHBondContact O-N 2.87Å; D59-N63 WeakPolarHBondContact O-CB 3.46Å; D59-N63 PolarHBondContact O-N 3.45Å
60	V	48.9	Very low	56.4	Low	83 Å²	83	109.1 Å²	109.1	50%	0.503	56%	0.561	S	S	.	*	H	α-helix	trans	-71.7	-41.8	-179.9	180	0	0	0	0	111.1	T56 C57 N63 S64	T56-V60 PolarHBondContact O-N 3.02Å; C57-V60 PolarHBondContact O-N 3.31Å; V60-N63 PolarHBondContact O-N 2.75Å; V60-S64 PolarHBondContact O-N 3.47Å; V60-S64 PolarHBondContact O-OG 3.44Å
61	E	53.3	Low	57.7	Low	115 Å²	115	107.1 Å²	107.1	54%	0.537	55%	0.549	S	S	.	.	H	α-helix	trans	-70.3	-39	178.3	-161.1	-179	-172.8	0	0	112	C57 N63 S64 N65	C57-E61 WeakPolarHBondContact O-CB 3.36Å; C57-E61 PolarHBondContact O-N 2.99Å; E61-N63 VanDerWaalsContact C-N 3.32Å; E61-N63 PolarHBondContact O-N 3.49Å; E61-S64 WeakPolarHBondContact CA-OG 3.38Å; E61-S64 PolarHBondContact O-N 3.34Å; E61-S64 PolarHBondContact O-OG 2.86Å; E61-N65 WeakPolarHBondContact O-CB 3.39Å; E61-N65 PolarHBondContact O-N 2.99Å; E61-N65 PolarHBondContact O-ND2 3.01Å
62	R	55.5	Low	58.8	Low	173 Å²	173	100.5 Å²	100.5	65%	0.653	52%	0.521	S	S	*	.	H	α-helix	trans	-62.6	-39.2	169.7	-79.1	-178.1	166.6	119.2	2.6	112.1	D58 G66	D58-R62 VanDerWaalsContact O-CB 3.26Å; D58-R62 WeakPolarHBondContact O-CB 3.49Å; D58-R62 VanDerWaalsContact O-CG 3.22Å; D58-R62 WeakPolarHBondContact O-CG 3.39Å; D58-R62 PolarHBondContact O-N 3.34Å; R62-G66 PolarHBondContact O-N 2.78Å
63	N	57.6	Low	59.9	Low	89 Å²	89	104 Å²	104	48%	0.476	52%	0.517	S	S	.	.	H	α-helix	trans	-73	-33.2	-180	-169	6	0	0	0	112.3	D59 V60 E61 R67	D59-N63 WeakPolarHBondContact O-CB 3.46Å; D59-N63 PolarHBondContact O-N 3.45Å; V60-N63 PolarHBondContact O-N 2.75Å; E61-N63 VanDerWaalsContact C-N 3.32Å; E61-N63 PolarHBondContact O-N 3.49Å; N63-R67 VanDerWaalsContact O-CB 3.27Å; N63-R67 WeakPolarHBondContact O-CB 3.21Å; N63-R67 WeakPolarHBondContact O-CG 3.33Å; N63-R67 PolarHBondContact O-N 2.97Å; N63-R67 PolarHBondContact O-NE 3.36Å; N63-R67 VanDerWaalsContact O-NE 3.08Å; N63-R67 PolarHBondContact OD1-NE 2.84Å
64	S	59.1	Low	61.3	Low	14 Å²	14	100 Å²	100	10%	0.098	51%	0.507	C	S	.	.	H	α-helix	trans	-71.5	-44.6	174.1	61.9	0	0	0	0	112	L43 V60 E61 R67 Y68	L43-S64 VanDerWaalsContact CD1-CB 3.44Å; V60-S64 PolarHBondContact O-N 3.47Å; V60-S64 PolarHBondContact O-OG 3.44Å; E61-S64 WeakPolarHBondContact CA-OG 3.38Å; E61-S64 PolarHBondContact O-N 3.34Å; E61-S64 PolarHBondContact O-OG 2.86Å; S64-R67 PolarHBondContact O-N 3.16Å; S64-Y68 WeakPolarHBondContact O-CB 3.42Å; S64-Y68 PolarHBondContact O-N 2.97Å
65	N	64.7	Low	62.7	Low	79 Å²	79	92.7 Å²	92.7	42%	0.422	47%	0.473	S	S	.	.	H	α-helix	trans	-61.9	-45.5	175	-77.7	-24.9	0	0	0	111.2	E61 R67 Y68 E69	E61-N65 WeakPolarHBondContact O-CB 3.39Å; E61-N65 PolarHBondContact O-N 2.99Å; E61-N65 PolarHBondContact O-ND2 3.01Å; N65-R67 PolarHBondContact O-N 2.96Å; N65-Y68 PolarHBondContact O-N 3.46Å; N65-E69 WeakPolarHBondContact O-CB 3.45Å; N65-E69 WeakPolarHBondContact O-CG 3.26Å; N65-E69 PolarHBondContact O-N 3.35Å
66	G	68.7	Low	64.2	Low	25 Å²	25	96.5 Å²	96.5	26%	0.258	47%	0.471	S	S	.	.	H	α-helix	trans	-61	-42.7	175.2	0	0	0	0	0	113	R62 Y68 E69 I70	R62-G66 PolarHBondContact O-N 2.78Å; G66-Y68 PolarHBondContact O-N 3.32Å; G66-E69 PolarHBondContact O-N 3.36Å; G66-I70 WeakPolarHBondContact O-CD1 3.33Å; G66-I70 VanDerWaalsContact O-CG1 3.23Å; G66-I70 WeakPolarHBondContact O-CG1 3.04Å; G66-I70 PolarHBondContact O-N 3.43Å
67	R	69.6	Low	65.2	Low	144 Å²	144	96.1 Å²	96.1	54%	0.543	47%	0.465	S	S	.	.	H	α-helix	trans	-63.8	-40.4	175.5	-78.8	-178.2	-72.8	178.5	-1.6	112.1	N63 S64 N65 I70 Y71	N63-R67 VanDerWaalsContact O-CB 3.27Å; N63-R67 WeakPolarHBondContact O-CB 3.21Å; N63-R67 WeakPolarHBondContact O-CG 3.33Å; N63-R67 PolarHBondContact O-N 2.97Å; N63-R67 PolarHBondContact O-NE 3.36Å; N63-R67 VanDerWaalsContact O-NE 3.08Å; N63-R67 PolarHBondContact OD1-NE 2.84Å; S64-R67 PolarHBondContact O-N 3.16Å; N65-R67 PolarHBondContact O-N 2.96Å; R67-I70 PolarHBondContact O-N 2.93Å; R67-Y71 WeakPolarHBondContact O-CB 3.45Å; R67-Y71 PolarHBondContact O-N 3.42Å
68	Y	71	Confident	66.5	Low	63 Å²	63	96.6 Å²	96.6	25%	0.247	46%	0.455	C	S	.	.	H	α-helix	trans	-68.2	-40.5	177	-179.4	-102.8	0	0	0	112.2	F36 S64 N65 G66 I70 Y71 C72	F36-Y68 AromaticContact CD2-CE2 3.89Å; F36-Y68 HydrophobicContact CD2-CE2 3.89Å; F36-Y68 HydrophobicContact CE1-CE2 4.37Å; F36-Y68 WeakPolarHBondContact CE1-OH 3.4Å; F36-Y68 HydrophobicContact CE2-CD2 4.11Å; F36-Y68 HydrophobicContact CE2-CE1 4.48Å; F36-Y68 AromaticContact CE2-CE2 3.13Å; F36-Y68 HydrophobicContact CE2-CE2 3.13Å; F36-Y68 AromaticContact CE2-CZ 3.41Å; F36-Y68 VanDerWaalsContact CE2-CZ 3.41Å; F36-Y68 WeakPolarHBondContact CE2-OH 3.34Å; F36-Y68 HydrophobicContact CZ-CE1 4.24Å; F36-Y68 AromaticContact CZ-CE2 3.49Å; F36-Y68 HydrophobicContact CZ-CE2 3.49Å; F36-Y68 VanDerWaalsContact CZ-CE2 3.49Å; F36-Y68 AromaticContact CZ-CZ 3.22Å; F36-Y68 WeakPolarHBondContact CZ-OH 3.25Å; S64-Y68 WeakPolarHBondContact O-CB 3.42Å; S64-Y68 PolarHBondContact O-N 2.97Å; N65-Y68 PolarHBondContact O-N 3.46Å; G66-Y68 PolarHBondContact O-N 3.32Å; Y68-I70 VanDerWaalsContact C-N 3.35Å; Y68-I70 PolarHBondContact O-N 2.94Å; Y68-Y71 PolarHBondContact O-N 3.18Å; Y68-C72 WeakPolarHBondContact O-CB 3.07Å; Y68-C72 PolarHBondContact O-N 3.02Å; Y68-C72 PolarHBondContact O-SG 2.72Å
69	E	72.6	Confident	67.8	Low	134 Å²	134	95.9 Å²	95.9	63%	0.626	45%	0.448	S	S	*	.	H	α-helix	trans	-60.7	-43.8	173.4	-77	178	-174	0	0	111.6	N65 G66 C72 R73	N65-E69 WeakPolarHBondContact O-CB 3.45Å; N65-E69 WeakPolarHBondContact O-CG 3.26Å; N65-E69 PolarHBondContact O-N 3.35Å; G66-E69 PolarHBondContact O-N 3.36Å; E69-C72 PolarHBondContact O-N 3.02Å; E69-R73 VanDerWaalsContact O-CB 3.32Å; E69-R73 WeakPolarHBondContact O-CB 3.37Å; E69-R73 PolarHBondContact O-N 3.25Å
70	I	72.6	Confident	69.1	Low	110 Å²	110	93.4 Å²	93.4	56%	0.564	43%	0.434	S	S	*	.	H	α-helix	trans	-61.9	-47.7	174.5	-67.1	164.8	0	0	0	110.2	G66 R67 Y68 C72 R73 V74	G66-I70 WeakPolarHBondContact O-CD1 3.33Å; G66-I70 VanDerWaalsContact O-CG1 3.23Å; G66-I70 WeakPolarHBondContact O-CG1 3.04Å; G66-I70 PolarHBondContact O-N 3.43Å; R67-I70 PolarHBondContact O-N 2.93Å; Y68-I70 VanDerWaalsContact C-N 3.35Å; Y68-I70 PolarHBondContact O-N 2.94Å; I70-C72 PolarHBondContact O-N 3.19Å; I70-R73 PolarHBondContact O-N 3.12Å; I70-V74 HydrophobicContact CG2-CG2 4.33Å; I70-V74 VanDerWaalsContact O-CG2 3.31Å; I70-V74 WeakPolarHBondContact O-CG2 3.49Å; I70-V74 PolarHBondContact O-N 2.69Å
71	Y	73.6	Confident	70.4	Confident	78 Å²	78	96.8 Å²	96.8	31%	0.306	44%	0.438	S	S	.	.	H	α-helix	trans	-57.4	-48.5	176.8	175.7	-90.1	0	0	0	111.7	F36 R67 Y68 R73 V74 Q75	F36-Y71 HydrophobicContact CD2-CD1 4.19Å; F36-Y71 AromaticContact CD2-CE1 3.66Å; F36-Y71 HydrophobicContact CD2-CE1 3.66Å; F36-Y71 HydrophobicContact CE2-CD1 4.17Å; F36-Y71 HydrophobicContact CE2-CE1 4.06Å; R67-Y71 WeakPolarHBondContact O-CB 3.45Å; R67-Y71 PolarHBondContact O-N 3.42Å; Y68-Y71 PolarHBondContact O-N 3.18Å; Y71-R73 VanDerWaalsContact C-N 3.3Å; Y71-R73 PolarHBondContact O-N 3.16Å; Y71-V74 PolarHBondContact O-N 3.47Å; Y71-Q75 HydrophobicContact CD1-CG 4.09Å; Y71-Q75 HydrophobicContact CD2-CG 4.49Å; Y71-Q75 HydrophobicContact CE1-CG 3.58Å; Y71-Q75 HydrophobicContact CE2-CG 4.08Å; Y71-Q75 WeakPolarHBondContact O-CB 3.26Å; Y71-Q75 WeakPolarHBondContact O-CG 3.32Å; Y71-Q75 PolarHBondContact O-N 2.83Å; Y71-Q75 PolarHBondContact OH-NE2 3.43Å
72	C	72.2	Confident	71.4	Confident	32 Å²	32	92.5 Å²	92.5	22%	0.216	42%	0.419	C	S	.	.	H	α-helix	trans	-59.7	-41.4	177.3	-70.8	0	0	0	0	111.8	Y68 E69 I70 Q75 R76	Y68-C72 WeakPolarHBondContact O-CB 3.07Å; Y68-C72 PolarHBondContact O-N 3.02Å; Y68-C72 PolarHBondContact O-SG 2.72Å; E69-C72 PolarHBondContact O-N 3.02Å; I70-C72 PolarHBondContact O-N 3.19Å; C72-Q75 PolarHBondContact O-N 2.85Å; C72-R76 WeakPolarHBondContact O-CB 3.44Å; C72-R76 PolarHBondContact O-N 3.31Å
73	R	72.6	Confident	72.4	Confident	185 Å²	185	91.3 Å²	91.3	70%	0.698	41%	0.414	S	S	*	.	H	α-helix	trans	-65.8	-44.1	177.7	-170.1	176.6	-176.5	-178.6	0.1	111.5	E69 I70 Y71 R76 N77	E69-R73 VanDerWaalsContact O-CB 3.32Å; E69-R73 WeakPolarHBondContact O-CB 3.37Å; E69-R73 PolarHBondContact O-N 3.25Å; I70-R73 PolarHBondContact O-N 3.12Å; Y71-R73 VanDerWaalsContact C-N 3.3Å; Y71-R73 PolarHBondContact O-N 3.16Å; R73-R76 PolarHBondContact O-N 3.41Å; R73-N77 WeakPolarHBondContact O-CB 3.43Å; R73-N77 PolarHBondContact O-N 3.46Å; R73-N77 PolarHBondContact O-ND2 3.5Å
74	V	74.6	Confident	73	Confident	85 Å²	85	93.7 Å²	93.7	52%	0.515	42%	0.422	S	S	.	.	H	α-helix	trans	-63.4	-44.6	176.4	172.4	0	0	0	0	110.8	I70 Y71 N77 R78	I70-V74 HydrophobicContact CG2-CG2 4.33Å; I70-V74 VanDerWaalsContact O-CG2 3.31Å; I70-V74 WeakPolarHBondContact O-CG2 3.49Å; I70-V74 PolarHBondContact O-N 2.69Å; Y71-V74 PolarHBondContact O-N 3.47Å; V74-N77 PolarHBondContact O-N 3.22Å; V74-R78 WeakPolarHBondContact O-CB 3.5Å; V74-R78 PolarHBondContact O-N 2.9Å
75	Q	80.1	Confident	73.6	Confident	49 Å²	49	97.2 Å²	97.2	23%	0.229	44%	0.437	C	S	.	.	H	α-helix	trans	-64.8	-43	177.8	-73.2	-66.5	11.7	0	0	112.6	Y71 C72 N77 R78 Q79	Y71-Q75 HydrophobicContact CD1-CG 4.09Å; Y71-Q75 HydrophobicContact CD2-CG 4.49Å; Y71-Q75 HydrophobicContact CE1-CG 3.58Å; Y71-Q75 HydrophobicContact CE2-CG 4.08Å; Y71-Q75 WeakPolarHBondContact O-CB 3.26Å; Y71-Q75 WeakPolarHBondContact O-CG 3.32Å; Y71-Q75 PolarHBondContact O-N 2.83Å; Y71-Q75 PolarHBondContact OH-NE2 3.43Å; C72-Q75 PolarHBondContact O-N 2.85Å; Q75-N77 PolarHBondContact O-N 2.91Å; Q75-R78 PolarHBondContact O-N 3.39Å; Q75-Q79 WeakPolarHBondContact O-CB 3.2Å; Q75-Q79 PolarHBondContact O-N 3.33Å
76	R	77.1	Confident	73.8	Confident	158 Å²	158	95.9 Å²	95.9	60%	0.596	43%	0.429	S	S	*	.	H	α-helix	trans	-62.7	-42.4	175.1	-178.3	177	-85.6	120	-6.7	111.5	C72 R73 R78 Q79 N80	C72-R76 WeakPolarHBondContact O-CB 3.44Å; C72-R76 PolarHBondContact O-N 3.31Å; R73-R76 PolarHBondContact O-N 3.41Å; R76-R78 VanDerWaalsContact C-N 3.35Å; R76-Q79 PolarHBondContact O-N 2.91Å; R76-N80 WeakPolarHBondContact O-CB 3.41Å; R76-N80 VanDerWaalsContact O-CG 3.26Å; R76-N80 PolarHBondContact O-N 3.01Å
77	N	74.2	Confident	73.6	Confident	92 Å²	92	96.7 Å²	96.7	49%	0.492	43%	0.433	S	S	.	.	H	α-helix	trans	-63.5	-41.2	175.9	-73.4	-14	0	0	0	111.7	R73 V74 Q75 N80 R81	R73-N77 WeakPolarHBondContact O-CB 3.43Å; R73-N77 PolarHBondContact O-N 3.46Å; R73-N77 PolarHBondContact O-ND2 3.5Å; V74-N77 PolarHBondContact O-N 3.22Å; Q75-N77 PolarHBondContact O-N 2.91Å; N77-N80 PolarHBondContact O-N 3.33Å; N77-R81 WeakPolarHBondContact O-CB 3.46Å; N77-R81 PolarHBondContact O-N 3.29Å
78	R	77.7	Confident	73.3	Confident	95 Å²	95	92.7 Å²	92.7	36%	0.358	43%	0.431	S	S	.	.	H	α-helix	trans	-60.4	-49.6	174	-173.2	179.3	-176.3	-137.1	6.2	110.6	I11 V74 Q75 R76 N80 R81 L82	I11-R78 VanDerWaalsContact CG2-NH2 3.33Å; I11-R78 PolarHBondContact O-NH2 2.96Å; V74-R78 WeakPolarHBondContact O-CB 3.5Å; V74-R78 PolarHBondContact O-N 2.9Å; Q75-R78 PolarHBondContact O-N 3.39Å; R76-R78 VanDerWaalsContact C-N 3.35Å; R78-N80 PolarHBondContact O-N 3.33Å; R78-R81 PolarHBondContact O-N 3.17Å; R78-L82 HydrophobicContact CG-CD1 4.07Å; R78-L82 WeakPolarHBondContact O-CG 3.15Å; R78-L82 PolarHBondContact O-N 2.99Å
79	Q	78	Confident	72.8	Confident	94 Å²	94	94.6 Å²	94.6	44%	0.439	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-41.3	179.1	-166	-176.9	30.7	0	0	112.4	Q75 R76 L82 R83	Q75-Q79 WeakPolarHBondContact O-CB 3.2Å; Q75-Q79 PolarHBondContact O-N 3.33Å; R76-Q79 PolarHBondContact O-N 2.91Å; Q79-L82 PolarHBondContact O-N 3.28Å; Q79-R83 WeakPolarHBondContact O-CG 3.48Å; Q79-R83 PolarHBondContact O-N 2.93Å
80	N	76.8	Confident	72.2	Confident	64 Å²	64	95.8 Å²	95.8	34%	0.342	44%	0.44	S	S	.	.	H	α-helix	trans	-63.2	-46.2	176.9	-74.2	-10.4	0	0	0	111.7	R76 N77 R78 L82 R83 E84	R76-N80 WeakPolarHBondContact O-CB 3.41Å; R76-N80 VanDerWaalsContact O-CG 3.26Å; R76-N80 PolarHBondContact O-N 3.01Å; N77-N80 PolarHBondContact O-N 3.33Å; R78-N80 PolarHBondContact O-N 3.33Å; N80-L82 VanDerWaalsContact C-N 3.27Å; N80-L82 PolarHBondContact O-N 3.47Å; N80-R83 PolarHBondContact O-N 2.93Å; N80-E84 WeakPolarHBondContact O-CG 3.48Å; N80-E84 PolarHBondContact O-N 3.44Å
81	R	76.5	Confident	71.3	Confident	154 Å²	154	98.5 Å²	98.5	58%	0.581	44%	0.444	S	S	*	.	H	α-helix	trans	-59.4	-40.5	176.6	-174.9	177.9	178.6	-179.3	0.7	111.8	N77 R78 E84 Q85	N77-R81 WeakPolarHBondContact O-CB 3.46Å; N77-R81 PolarHBondContact O-N 3.29Å; R78-R81 PolarHBondContact O-N 3.17Å; R81-E84 PolarHBondContact O-N 2.9Å; R81-Q85 WeakPolarHBondContact O-CG 3.38Å; R81-Q85 PolarHBondContact O-N 2.7Å
82	L	74.1	Confident	70.3	Confident	25 Å²	25	99 Å²	99	13%	0.131	46%	0.458	C	S	.	.	H	α-helix	trans	-66.5	-42.2	176.9	-69.2	171.8	0	0	0	112.1	P10 I11 R78 Q79 N80 E84 Q85 M86	P10-L82 HydrophobicContact CB-CD2 3.63Å; P10-L82 HydrophobicContact CG-CD2 3.25Å; I11-L82 HydrophobicContact CD1-CD1 3.65Å; I11-L82 HydrophobicContact CG1-CD1 3.51Å; I11-L82 HydrophobicContact CG1-CD2 4.32Å; R78-L82 HydrophobicContact CG-CD1 4.07Å; R78-L82 WeakPolarHBondContact O-CG 3.15Å; R78-L82 PolarHBondContact O-N 2.99Å; Q79-L82 PolarHBondContact O-N 3.28Å; N80-L82 VanDerWaalsContact C-N 3.27Å; N80-L82 PolarHBondContact O-N 3.47Å; L82-E84 VanDerWaalsContact C-N 3.34Å; L82-E84 PolarHBondContact O-N 3.43Å; L82-Q85 PolarHBondContact O-N 3.2Å; L82-M86 WeakPolarHBondContact O-CG 3.44Å; L82-M86 PolarHBondContact O-N 2.92Å
83	R	77.2	Confident	69.1	Low	149 Å²	149	102 Å²	102	56%	0.562	48%	0.479	S	S	*	.	H	α-helix	trans	-61.4	-41.7	174.1	-74.6	-178.4	-168.3	173.6	6.1	112.2	Q79 N80 M86 A87	Q79-R83 WeakPolarHBondContact O-CG 3.48Å; Q79-R83 PolarHBondContact O-N 2.93Å; N80-R83 PolarHBondContact O-N 2.93Å; R83-M86 PolarHBondContact O-N 3.21Å; R83-A87 WeakPolarHBondContact O-CB 3.2Å; R83-A87 PolarHBondContact O-N 3.17Å
84	E	71.3	Confident	68	Low	138 Å²	138	100.1 Å²	100.1	65%	0.645	48%	0.478	S	S	*	.	H	α-helix	trans	-63.5	-43.1	176.2	-74.7	173.3	-171.4	0	0	112	N80 R81 L82 M86 A87 A88	N80-E84 WeakPolarHBondContact O-CG 3.48Å; N80-E84 PolarHBondContact O-N 3.44Å; R81-E84 PolarHBondContact O-N 2.9Å; L82-E84 VanDerWaalsContact C-N 3.34Å; L82-E84 PolarHBondContact O-N 3.43Å; E84-M86 PolarHBondContact O-N 3.5Å; E84-A87 PolarHBondContact O-N 2.97Å; E84-A88 PolarHBondContact O-N 3.34Å
85	Q	71.8	Confident	66.5	Low	88 Å²	88	101.6 Å²	101.6	41%	0.411	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-41.6	175.4	-75	179.7	-19.3	0	0	112.1	R81 L82 A88 F89	R81-Q85 WeakPolarHBondContact O-CG 3.38Å; R81-Q85 PolarHBondContact O-N 2.7Å; L82-Q85 PolarHBondContact O-N 3.2Å; Q85-A88 PolarHBondContact O-N 3.5Å; Q85-F89 PolarHBondContact O-N 3.35Å
86	M	67.2	Low	64.8	Low	52 Å²	52	103.6 Å²	103.6	26%	0.256	51%	0.507	S	S	.	.	H	α-helix	trans	-65.9	-38.7	175.2	-72.7	-59.2	-66.2	0	0	112.4	V21 F25 L82 R83 E84 F89 R90	V21-M86 HydrophobicContact CG1-CE 3.7Å; F25-M86 HydrophobicContact CE2-CE 4.02Å; F25-M86 HydrophobicContact CE2-CG 4.35Å; F25-M86 HydrophobicContact CE2-SD 3.75Å; F25-M86 HydrophobicContact CZ-SD 4.21Å; L82-M86 WeakPolarHBondContact O-CG 3.44Å; L82-M86 PolarHBondContact O-N 2.92Å; R83-M86 PolarHBondContact O-N 3.21Å; E84-M86 PolarHBondContact O-N 3.5Å; M86-F89 PolarHBondContact O-N 3.15Å; M86-R90 WeakPolarHBondContact O-CG 3.43Å; M86-R90 PolarHBondContact O-N 3.35Å
87	A	65.9	Low	63.4	Low	41 Å²	41	101.6 Å²	101.6	34%	0.339	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-47.8	173.2	0	0	0	0	0	110.7	R83 E84 F89 R90 Y91	R83-A87 WeakPolarHBondContact O-CB 3.2Å; R83-A87 PolarHBondContact O-N 3.17Å; E84-A87 PolarHBondContact O-N 2.97Å; A87-F89 VanDerWaalsContact C-N 3.29Å; A87-F89 PolarHBondContact O-N 3.05Å; A87-R90 WeakPolarHBondContact O-CB 3.42Å; A87-R90 PolarHBondContact O-N 3.35Å; A87-R90 VanDerWaalsContact O-N 3.15Å; A87-Y91 WeakPolarHBondContact O-CD2 3.38Å; A87-Y91 PolarHBondContact O-N 3.29Å; A87-Y91 VanDerWaalsContact O-N 3.17Å
88	A	62.6	Low	61.8	Low	61 Å²	61	102.8 Å²	102.8	50%	0.504	53%	0.528	S	S	.	.	H	α-helix	trans	-59	-39.5	176.3	0	0	0	0	0	112.4	E84 Q85 R90 Y91 C92	E84-A88 PolarHBondContact O-N 3.34Å; Q85-A88 PolarHBondContact O-N 3.5Å; A88-R90 PolarHBondContact O-N 3.45Å; A88-Y91 PolarHBondContact O-N 2.99Å; A88-C92 WeakPolarHBondContact O-CB 3.4Å; A88-C92 PolarHBondContact O-N 3.26Å
89	F	59.6	Low	60.1	Low	103 Å²	103	107.4 Å²	107.4	45%	0.452	55%	0.554	S	S	.	*	H	α-helix	trans	-63.2	-41.4	176	-166.3	-95	0	0	0	112.3	L18 Q85 M86 A87 Y91 C92 S93	L18-F89 HydrophobicContact CD1-CE1 4.48Å; L18-F89 HydrophobicContact CD1-CZ 4.49Å; L18-F89 HydrophobicContact CD2-CE1 3.58Å; L18-F89 HydrophobicContact CD2-CZ 3.74Å; Q85-F89 PolarHBondContact O-N 3.35Å; M86-F89 PolarHBondContact O-N 3.15Å; A87-F89 VanDerWaalsContact C-N 3.29Å; A87-F89 PolarHBondContact O-N 3.05Å; F89-Y91 VanDerWaalsContact C-N 3.26Å; F89-Y91 PolarHBondContact O-N 2.91Å; F89-C92 PolarHBondContact O-N 2.75Å; F89-S93 PolarHBondContact O-N 3.17Å; F89-S93 PolarHBondContact O-OG 3.23Å
90	R	60.6	Low	58.2	Low	159 Å²	159	107.6 Å²	107.6	60%	0.6	57%	0.566	S	S	*	*	H	α-helix	trans	-63.2	-28.8	175	-71.3	179.9	-177.6	-178.5	0.8	113.4	M86 A87 A88 S93	M86-R90 WeakPolarHBondContact O-CG 3.43Å; M86-R90 PolarHBondContact O-N 3.35Å; A87-R90 WeakPolarHBondContact O-CB 3.42Å; A87-R90 PolarHBondContact O-N 3.35Å; A87-R90 VanDerWaalsContact O-N 3.15Å; A88-R90 PolarHBondContact O-N 3.45Å; R90-S93 PolarHBondContact O-OG 2.81Å
91	Y	54.5	Low	56.6	Low	167 Å²	167	109.4 Å²	109.4	66%	0.655	59%	0.59	S	S	*	*	H	α-helix	trans	-88.5	-27.1	177.2	-71.7	-70.7	0	0	0	113.3	A87 A88 F89 S93 Q94	A87-Y91 WeakPolarHBondContact O-CD2 3.38Å; A87-Y91 PolarHBondContact O-N 3.29Å; A87-Y91 VanDerWaalsContact O-N 3.17Å; A88-Y91 PolarHBondContact O-N 2.99Å; F89-Y91 VanDerWaalsContact C-N 3.26Å; F89-Y91 PolarHBondContact O-N 2.91Å; Y91-S93 VanDerWaalsContact C-N 3.32Å; Y91-S93 PolarHBondContact O-N 3.45Å; Y91-Q94 PolarHBondContact O-N 3.08Å; Y91-Q94 VanDerWaalsContact O-N 3.16Å
92	C	51.3	Low	54.7	Low	89 Å²	89	106.7 Å²	106.7	60%	0.601	59%	0.594	S	S	*	*	H	α-helix	trans	-69.1	-30	179.2	-160.9	0	0	0	0	112.6	A88 F89 Q94 V95	A88-C92 WeakPolarHBondContact O-CB 3.4Å; A88-C92 PolarHBondContact O-N 3.26Å; F89-C92 PolarHBondContact O-N 2.75Å; C92-Q94 PolarHBondContact O-N 2.87Å; C92-V95 PolarHBondContact O-N 3.41Å
93	S	48	Very low	53	Low	94 Å²	94	111.7 Å²	111.7	66%	0.657	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-11.5	173.4	47.5	0	0	0	0	114.1	F89 R90 Y91	F89-S93 PolarHBondContact O-N 3.17Å; F89-S93 PolarHBondContact O-OG 3.23Å; R90-S93 PolarHBondContact O-OG 2.81Å; Y91-S93 VanDerWaalsContact C-N 3.32Å; Y91-S93 PolarHBondContact O-N 3.45Å
94	Q	49.9	Very low	51.2	Low	145 Å²	145	111.8 Å²	111.8	68%	0.678	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-4.8	177.2	-62.5	-171.6	2	0	0	114.1	Y91 C92 S96	Y91-Q94 PolarHBondContact O-N 3.08Å; Y91-Q94 VanDerWaalsContact O-N 3.16Å; C92-Q94 PolarHBondContact O-N 2.87Å; Q94-S96 PolarHBondContact O-N 2.54Å
95	V	43.3	Very low	49.6	Very low	117 Å²	117	114.5 Å²	114.5	71%	0.709	64%	0.643	S	S	*	*			trans	-77.4	83.3	170.7	-152.9	0	0	0	0	107	C92	C92-V95 PolarHBondContact O-N 3.41Å
96	S	43.6	Very low	48.1	Very low	90 Å²	90	115.4 Å²	115.4	63%	0.629	67%	0.665	S	S	*	*			trans	-58	143.1	175.1	78.7	0	0	0	0	109	Q94 C98	Q94-S96 PolarHBondContact O-N 2.54Å; S96-C98 PolarHBondContact O-N 3.49Å
97	P	47.3	Very low	47	Very low	116 Å²	116	118.4 Å²	118.4	75%	0.753	69%	0.691	S	S	*	*			trans	-53.3	131.9	169.5	-21.7	32.3	0	0	0	108.7	E99	P97-E99 PolarHBondContact O-N 3.39Å
98	C	40.2	Very low	45.9	Very low	117 Å²	117	123.8 Å²	123.8	79%	0.791	71%	0.714	S	S	*	*			trans	-51.6	100	175.5	-138.7	0	0	0	0	109.1	S96 S100	S96-C98 PolarHBondContact O-N 3.49Å; C98-S100 PolarHBondContact O-N 2.89Å
99	E	41.9	Very low	44.7	Very low	192 Å²	192	129.2 Å²	129.2	90%	0.897	73%	0.729	S	S	*	*			trans	-71.6	82.4	161.9	-72.7	-170.9	124.9	0	0	106.9	P97	P97-E99 PolarHBondContact O-N 3.39Å
100	S	38.7	Very low	43.5	Very low	98 Å²	98	130 Å²	130	69%	0.685	75%	0.746	S	S	*	*			trans	-156.6	71.1	174.9	-67.3	0	0	0	0	110.6	C98	C98-S100 PolarHBondContact O-N 2.89Å
101	A	42.6	Very low	42.6	Very low	102 Å²	102	128.1 Å²	128.1	84%	0.843	76%	0.757	S	S	*	*			trans	-162.3	66.8	147.2	0	0	0	0	0	107.4
102	S	37.5	Very low	41.9	Very low	98 Å²	98	126.8 Å²	126.8	69%	0.685	76%	0.762	S	S	*	*			trans	-68.1	155.4	152.9	59.7	0	0	0	0	108.8
103	D	38	Very low	41.2	Very low	130 Å²	130	130.3 Å²	130.3	70%	0.695	78%	0.775	S	S	*	*			trans	87.9	96.5	157.3	-51.7	-54.1	0	0	0	118.4
104	D	39.4	Very low	41	Very low	151 Å²	151	132.9 Å²	132.9	81%	0.807	78%	0.781	S	S	*	*				89	131.5	125.2	-74.4	-48.7	0	0	0	120.3
105	K	38.9	Very low	40.5	Very low	195 Å²	195	132 Å²	132	85%	0.848	78%	0.781	S	S	*	*			trans	75.1	96.7	169.2	-82.7	-171.9	169.2	175.2	0	118.1	S107	K105-S107 PolarHBondContact O-N 3.16Å; K105-S107 VanDerWaalsContact O-N 3.14Å
106	A	39.5	Very low	40.3	Very low	107 Å²	107	132.4 Å²	132.4	88%	0.884	79%	0.788	S	S	*	*			trans	-30.6	111.3	135	0	0	0	0	0	113.1
107	S	43.4	Very low	40.4	Very low	115 Å²	115	133.9 Å²	133.9	80%	0.804	79%	0.793	S	S	*	*			trans	-155.8	115.2	147.1	-159.7	0	0	0	0	108.7	K105	K105-S107 PolarHBondContact O-N 3.16Å; K105-S107 VanDerWaalsContact O-N 3.14Å
108	N	44.2	Very low	40	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	80%	0.798	S	S	*	*			trans	8	113.9	173	-86.3	-2.5	0	0	0	120
109	Q	36.7	Very low	40.1	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	80%	0.802	S	S	*	*				15.8	130.5	126.8	-66.6	-176.6	-12.8	0	0	119
110	C	33.6	Very low	40.1	Very low	119 Å²	119	135.8 Å²	135.8	80%	0.804	80%	0.795	S	S	*	*			trans	68.1	88.5	157.1	71.3	0	0	0	0	118.6
111	S	42.2	Very low	40.1	Very low	120 Å²	120	136.4 Å²	136.4	84%	0.839	80%	0.799	S	S	*	*			trans	-136.9	123.5	138.8	-73.5	0	0	0	0	108.3
112	N	38.8	Very low	40.3	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	80%	0.801	S	S	*	*			trans	-62.1	124.5	-175.6	-68.9	-40.8	0	0	0	111.2
113	D	38	Very low	40.3	Very low	163 Å²	163	136 Å²	136	87%	0.872	79%	0.79	S	S	*	*			trans	-136.4	60.8	147.7	-78.8	-61.1	0	0	0	107.6	D115	D113-D115 VanDerWaalsContact C-N 3.32Å; D113-D115 PolarHBondContact O-N 3.28Å
114	D	42.9	Very low	40.5	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	80%	0.797	S	S	*	*			trans	-68.5	91	154.5	-89.9	-63.8	0	0	0	107.7
115	D	39.8	Very low	40.8	Very low	126 Å²	126	134.7 Å²	134.7	67%	0.674	79%	0.792	S	S	*	*			trans	-159.9	56.6	137.7	-132.2	-24.9	0	0	0	112.5	D113 T117	D113-D115 VanDerWaalsContact C-N 3.32Å; D113-D115 PolarHBondContact O-N 3.28Å; D115-T117 PolarHBondContact O-N 3.45Å; D115-T117 VanDerWaalsContact O-N 3.08Å; D115-T117 WeakPolarHBondContact OD1-CB 3.08Å; D115-T117 WeakPolarHBondContact OD1-CG2 3.41Å; D115-T117 PolarHBondContact OD1-OG1 3.49Å
116	C	39.8	Very low	40.9	Very low	126 Å²	126	134.3 Å²	134.3	85%	0.851	79%	0.79	S	S	*	*			trans	-77.9	52.6	156.7	-73.7	0	0	0	0	110.3	R118	C116-R118 PolarHBondContact O-N 3.18Å
117	T	44.2	Very low	41.2	Very low	121 Å²	121	139.5 Å²	139.5	74%	0.742	79%	0.787	S	S	*	*			trans	-71.7	67.1	158.8	34.4	0	0	0	0	109.4	D115	D115-T117 PolarHBondContact O-N 3.45Å; D115-T117 VanDerWaalsContact O-N 3.08Å; D115-T117 WeakPolarHBondContact OD1-CB 3.08Å; D115-T117 WeakPolarHBondContact OD1-CG2 3.41Å; D115-T117 PolarHBondContact OD1-OG1 3.49Å
118	R	40.2	Very low	41	Very low	229 Å²	229	138.6 Å²	138.6	86%	0.864	78%	0.781	S	S	*	*			trans	-145.3	46.6	169.6	-153.3	174.8	166.7	178.2	-4.6	112.7	C116	C116-R118 PolarHBondContact O-N 3.18Å
119	C	41.8	Very low	40.9	Very low	130 Å²	130	136.8 Å²	136.8	88%	0.878	78%	0.777	S	S	*	*	S	Bend	trans	-110.4	90	150.5	-70.4	0	0	0	0	107.1
120	S	41.3	Very low	41.2	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	77%	0.773	S	S	*	*			trans	-2.9	116	167.4	-55.8	0	0	0	0	116.3	V122	S120-V122 PolarHBondContact O-N 3.48Å
121	S	39.2	Very low	41.5	Very low	112 Å²	112	133 Å²	133	78%	0.783	77%	0.771	S	S	*	*			trans	-40.7	104.7	149.8	-176.3	0	0	0	0	108.8	G123	S121-G123 PolarHBondContact O-N 3.46Å
122	V	46.3	Very low	41.7	Very low	145 Å²	145	131.8 Å²	131.8	88%	0.879	76%	0.763	S	S	*	*			trans	-65.5	86.1	153.9	-99.4	0	0	0	0	104.3	S120 D124	S120-V122 PolarHBondContact O-N 3.48Å; V122-D124 PolarHBondContact O-N 3.43Å
123	G	38.6	Very low	41.7	Very low	45 Å²	45	133.3 Å²	133.3	46%	0.464	77%	0.765	S	S	.	*			trans	-52.5	128.5	179.9	0	0	0	0	0	108.6	S121 S125	S121-G123 PolarHBondContact O-N 3.46Å; G123-S125 PolarHBondContact O-N 3.39Å
124	D	41.6	Very low	41.6	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	76%	0.756	S	S	*	*			trans	-37.8	93.9	157.7	-82.7	-76.8	0	0	0	109	V122 K126	V122-D124 PolarHBondContact O-N 3.43Å; D124-K126 PolarHBondContact O-N 2.81Å
125	S	45	Very low	41.6	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	75%	0.749	S	S	*	*			trans	-72.7	77.9	161.8	-70.1	0	0	0	0	105	G123 W127	G123-S125 PolarHBondContact O-N 3.39Å; S125-W127 PolarHBondContact O-N 2.96Å
126	K	41.7	Very low	41.7	Very low	186 Å²	186	132.6 Å²	132.6	81%	0.809	76%	0.755	S	S	*	*			trans	-51.4	87	155.3	-107.7	-178	173	-179.7	0	106.1	D124 S128	D124-K126 PolarHBondContact O-N 2.81Å; K126-S128 PolarHBondContact O-N 2.76Å
127	W	44.8	Very low	41.7	Very low	216 Å²	216	131.4 Å²	131.4	82%	0.818	75%	0.748	S	S	*	*			trans	-72	89.6	163.1	-83.3	43.1	0	0	0	105.3	S125 P129	S125-W127 PolarHBondContact O-N 2.96Å; W127-P129 WeakPolarHBondContact O-CD 3.44Å
128	S	40	Very low	41.5	Very low	97 Å²	97	129.8 Å²	129.8	68%	0.678	75%	0.747	S	S	*	*			trans	-57.1	119.2	163.1	-64.5	0	0	0	0	106.8	K126 S130	K126-S128 PolarHBondContact O-N 2.76Å; S128-S130 PolarHBondContact O-N 3.35Å
129	P	41.6	Very low	41.5	Very low	115 Å²	115	125 Å²	125	75%	0.747	74%	0.743	S	S	*	*			trans	-60.6	113.7	173.4	22.7	-29.3	0	0	0	106.9	W127 S131	W127-P129 WeakPolarHBondContact O-CD 3.44Å; P129-S131 VanDerWaalsContact C-N 3.34Å; P129-S131 PolarHBondContact O-N 3.18Å
130	S	42.8	Very low	41.5	Very low	106 Å²	106	125.2 Å²	125.2	74%	0.741	74%	0.741	S	S	*	*			trans	-61.2	105.3	172.4	-159.2	0	0	0	0	106.3	S128 S132	S128-S130 PolarHBondContact O-N 3.35Å; S130-S132 PolarHBondContact O-N 3.43Å
131	S	40.4	Very low	41.2	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	74%	0.741	S	S	*	*			trans	-66	76	173.1	-69.2	0	0	0	0	107.6	P129 Q133	P129-S131 VanDerWaalsContact C-N 3.34Å; P129-S131 PolarHBondContact O-N 3.18Å; S131-Q133 VanDerWaalsContact C-N 3.29Å; S131-Q133 PolarHBondContact O-N 3Å
132	S	46.5	Very low	41.2	Very low	94 Å²	94	122.4 Å²	122.4	66%	0.657	74%	0.738	S	S	*	*			trans	-74	96.9	163.6	-62.4	0	0	0	0	105.7	S130 N134	S130-S132 PolarHBondContact O-N 3.43Å; S132-N134 VanDerWaalsContact C-N 3.27Å; S132-N134 PolarHBondContact O-N 2.83Å
133	Q	38.4	Very low	41.2	Very low	171 Å²	171	121.4 Å²	121.4	80%	0.799	73%	0.734	S	S	*	*			trans	-54.4	91.6	167.2	-65.6	175.4	-82.2	0	0	108.7	S131 S135	S131-Q133 VanDerWaalsContact C-N 3.29Å; S131-Q133 PolarHBondContact O-N 3Å; Q133-S135 PolarHBondContact O-N 2.86Å
134	N	37.3	Very low	41.3	Very low	126 Å²	126	126.9 Å²	126.9	67%	0.674	75%	0.748	S	S	*	*			trans	-80.3	75.7	155.8	-85.5	25.5	0	0	0	106.9	S132 Y136	S132-N134 VanDerWaalsContact C-N 3.27Å; S132-N134 PolarHBondContact O-N 2.83Å; N134-Y136 HydrophobicContact CB-CD2 4.07Å; N134-Y136 HydrophobicContact CB-CE2 4.11Å; N134-Y136 PolarHBondContact O-N 2.97Å
135	S	42.1	Very low	41	Very low	92 Å²	92	123.2 Å²	123.2	64%	0.643	75%	0.747	S	S	*	*			trans	-68.3	79.5	163	50.2	0	0	0	0	108.1	Q133 S137	Q133-S135 PolarHBondContact O-N 2.86Å; S135-S137 PolarHBondContact O-N 3.25Å
136	Y	42.5	Very low	41.3	Very low	204 Å²	204	127.2 Å²	127.2	80%	0.8	75%	0.752	S	S	*	*			trans	-75.4	80.9	156.1	-77	-84	0	0	0	107	N134 A138	N134-Y136 HydrophobicContact CB-CD2 4.07Å; N134-Y136 HydrophobicContact CB-CE2 4.11Å; N134-Y136 PolarHBondContact O-N 2.97Å; Y136-A138 PolarHBondContact O-N 2.92Å
137	S	38.9	Very low	41.1	Very low	101 Å²	101	127.9 Å²	127.9	71%	0.706	76%	0.758	S	S	*	*			trans	-64.8	81.7	153.4	-58	0	0	0	0	106.5	S135 T139	S135-S137 PolarHBondContact O-N 3.25Å; S137-T139 PolarHBondContact O-N 2.94Å
138	A	41.3	Very low	41.3	Very low	87 Å²	87	122.4 Å²	122.4	72%	0.719	76%	0.758	S	S	*	*			trans	-66.8	89.6	157	0	0	0	0	0	105.2	Y136 T140	Y136-A138 PolarHBondContact O-N 2.92Å; A138-T140 VanDerWaalsContact C-N 3.26Å; A138-T140 PolarHBondContact O-N 2.77Å
139	T	40	Very low	42	Very low	129 Å²	129	129.8 Å²	129.8	79%	0.791	79%	0.789	S	S	*	*			trans	-50.4	99.5	162.6	28.7	0	0	0	0	106.7	S137 G141	S137-T139 PolarHBondContact O-N 2.94Å; T139-G141 PolarHBondContact O-N 3.15Å
140	T	41.1	Very low	42	Very low	134 Å²	134	130.5 Å²	130.5	82%	0.822	79%	0.791	S	S	*	*			trans	-59.9	89.6	156.3	38.3	0	0	0	0	105.6	A138 A142	A138-T140 VanDerWaalsContact C-N 3.26Å; A138-T140 PolarHBondContact O-N 2.77Å; T140-A142 PolarHBondContact O-N 3.14Å
141	G	34.9	Very low	41.9	Very low	72 Å²	72	131.8 Å²	131.8	74%	0.742	79%	0.794	S	S	*	*			trans	-63.6	82.6	166.1	0	0	0	0	0	107.8	T139 P143	T139-G141 PolarHBondContact O-N 3.15Å; G141-P143 WeakPolarHBondContact O-CD 3.2Å
142	A	39.1	Very low	42	Very low	87 Å²	87	133.1 Å²	133.1	72%	0.719	80%	0.795	S	S	*	*			trans	-64	122.4	162.6	0	0	0	0	0	107.2	T140 E144	T140-A142 PolarHBondContact O-N 3.14Å; A142-E144 PolarHBondContact O-N 3.27Å; A142-E144 VanDerWaalsContact O-N 3.11Å
143	P	46.2	Very low	41.8	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	80%	0.804	S	S	*	*			trans	-69.8	111.2	169.4	27	-29.4	0	0	0	108.7	G141	G141-P143 WeakPolarHBondContact O-CD 3.2Å
144	E	41.7	Very low	42	Very low	160 Å²	160	133.1 Å²	133.1	75%	0.748	80%	0.804	S	S	*	*			trans	36.5	109.1	145.1	-58.7	-160.7	125.1	0	0	117.9	A142 K146	A142-E144 PolarHBondContact O-N 3.27Å; A142-E144 VanDerWaalsContact O-N 3.11Å; E144-K146 PolarHBondContact O-N 3.14Å
145	G	35.5	Very low	42.3	Very low	79 Å²	79	133.6 Å²	133.6	81%	0.814	81%	0.812	S	S	*	*			trans	-60.5	129.9	149.3	0	0	0	0	0	110.8
146	K	49.6	Very low	42.3	Very low	183 Å²	183	136.6 Å²	136.6	80%	0.796	83%	0.825	S	S	*	*			trans	-127.9	96.6	145.9	-71.8	-173.7	-179.1	172.2	0	107.8	E144	E144-K146 PolarHBondContact O-N 3.14Å
147	Q	38.7	Very low	42.3	Very low	200 Å²	200	131.4 Å²	131.4	94%	0.935	83%	0.826	S	S	*	*			trans	-66.3	134	154.4	-73.3	177.6	-18.9	0	0	108.3
148	A	48.9	Very low	42.5	Very low	100 Å²	100	133.9 Å²	133.9	83%	0.826	84%	0.836	S	S	*	*			trans	-149.5	120.5	140.1	0	0	0	0	0	106.8
149	L	53.5	Low	42.7	Very low	252 Å²	252	138.2 Å²	138.2	100%	1.319	85%	0.847	S	S	*	*			trans	-54.4	0	169.9	-82.1	145.7	0	0	0	111.8

Retrieved 149 of 149 residues in 108 ms (Link to these results)

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