A0A3Q0KUM9_SCHMA Loading...

Smp_200440

AlphaFold DB , UniProt , Accession A0A3Q0KUM9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 153 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	43.5	Very low	237 Å²	237	154 Å²	154	100%	1.167	73%	0.727	S	S	*	*				0	159.9	0	-78.6	-150.9	158.7	0	0	109.1
2	H	40.1	Very low	44.3	Very low	148 Å²	148	145.8 Å²	145.8	69%	0.685	70%	0.698	S	S	*	*			trans	91	71.8	-173.9	-62.6	-73.6	0	0	0	117	Y4	H2-Y4 HydrophobicContact CB-CD2 4Å; H2-Y4 HydrophobicContact CB-CE2 3.58Å; H2-Y4 PolarHBondContact O-N 2.95Å; H2-Y4 VanDerWaalsContact O-N 3.14Å
3	K	41.3	Very low	45.3	Very low	180 Å²	180	146.6 Å²	146.6	78%	0.783	70%	0.697	S	S	*	*			trans	-63.2	98.6	147.5	-79.5	178.1	174.6	177.3	0	107.7	Y5	K3-Y5 HydrophobicContact CB-CE2 4.34Å; K3-Y5 PolarHBondContact O-N 2.94Å
4	Y	46.5	Very low	46.2	Very low	177 Å²	177	147.6 Å²	147.6	69%	0.694	70%	0.697	S	S	*	*			trans	-72.4	96.9	166.8	-75.7	-88	0	0	0	107.7	H2 H6	H2-Y4 HydrophobicContact CB-CD2 4Å; H2-Y4 HydrophobicContact CB-CE2 3.58Å; H2-Y4 PolarHBondContact O-N 2.95Å; H2-Y4 VanDerWaalsContact O-N 3.14Å; Y4-H6 VanDerWaalsContact C-N 3.31Å; Y4-H6 PolarHBondContact O-N 2.98Å
5	Y	45.4	Very low	47.1	Very low	159 Å²	159	146.6 Å²	146.6	62%	0.624	69%	0.691	S	S	*	*			trans	-62.6	99.4	164.6	-77	-89.3	0	0	0	107.2	K3 Y7	K3-Y5 HydrophobicContact CB-CE2 4.34Å; K3-Y5 PolarHBondContact O-N 2.94Å; Y5-Y7 AromaticContact CG-CE2 3.99Å; Y5-Y7 HydrophobicContact CG-CE2 3.99Å; Y5-Y7 WeakPolarHBondContact O-CD2 3.46Å; Y5-Y7 PolarHBondContact O-N 2.83Å
6	H	41.1	Very low	48.1	Very low	170 Å²	170	144.1 Å²	144.1	79%	0.787	68%	0.683	S	S	*	*			trans	-65.6	82.6	159.5	-79.7	-84.2	0	0	0	106.8	Y4 N8	Y4-H6 VanDerWaalsContact C-N 3.31Å; Y4-H6 PolarHBondContact O-N 2.98Å; H6-N8 PolarHBondContact O-N 3.25Å
7	Y	45.3	Very low	49.2	Very low	189 Å²	189	144.4 Å²	144.4	74%	0.741	68%	0.682	S	S	*	*			trans	-61	109.2	166.7	-76.6	-81.5	0	0	0	106.6	Y5 L9	Y5-Y7 AromaticContact CG-CE2 3.99Å; Y5-Y7 HydrophobicContact CG-CE2 3.99Å; Y5-Y7 WeakPolarHBondContact O-CD2 3.46Å; Y5-Y7 PolarHBondContact O-N 2.83Å; Y7-L9 PolarHBondContact O-N 3.28Å
8	N	45.8	Very low	50.5	Low	117 Å²	117	142.6 Å²	142.6	63%	0.626	68%	0.675	S	S	*	*			trans	-46	97.7	-179.7	-80.3	-44	0	0	0	111	H6 C10 T11	H6-N8 PolarHBondContact O-N 3.25Å; N8-C10 PolarHBondContact O-N 3.39Å; N8-T11 PolarHBondContact O-N 3.36Å; N8-T11 VanDerWaalsContact O-N 3.09Å; N8-T11 PolarHBondContact O-OG1 2.8Å
9	L	44.6	Very low	51.6	Low	133 Å²	133	141.2 Å²	141.2	70%	0.696	67%	0.672	S	S	*	*	H	α-helix	trans	-54.6	-17.7	167.8	-154.1	79.7	0	0	0	111.6	Y7 S12 K13	Y7-L9 PolarHBondContact O-N 3.28Å; L9-S12 WeakPolarHBondContact O-CB 3.36Å; L9-S12 PolarHBondContact O-N 2.96Å; L9-K13 PolarHBondContact O-N 3.09Å
10	C	43.8	Very low	52.7	Low	99 Å²	99	137.1 Å²	137.1	67%	0.669	66%	0.656	S	S	*	*	H	α-helix	trans	-68.3	-30.9	177.9	-138.9	0	0	0	0	113.6	N8	N8-C10 PolarHBondContact O-N 3.39Å
11	T	47.7	Very low	53.7	Low	85 Å²	85	133.5 Å²	133.5	52%	0.521	64%	0.643	S	S	.	*	H	α-helix	trans	-72.7	-34.3	171.7	53.1	0	0	0	0	110.9	N8 K13 K14 H15	N8-T11 PolarHBondContact O-N 3.36Å; N8-T11 VanDerWaalsContact O-N 3.09Å; N8-T11 PolarHBondContact O-OG1 2.8Å; T11-K13 PolarHBondContact O-N 3.17Å; T11-K14 PolarHBondContact O-N 3.36Å; T11-H15 PolarHBondContact O-CD2 3.35Å; T11-H15 PolarHBondContact O-N 3.43Å
12	S	53.4	Low	55.6	Low	55 Å²	55	130.2 Å²	130.2	39%	0.385	62%	0.619	S	S	.	*	H	α-helix	trans	-59.6	-44.6	177.9	177.7	0	0	0	0	112.2	L9 K14 H15 L16	L9-S12 WeakPolarHBondContact O-CB 3.36Å; L9-S12 PolarHBondContact O-N 2.96Å; S12-K14 PolarHBondContact O-N 2.93Å; S12-H15 PolarHBondContact O-N 3.23Å; S12-L16 WeakPolarHBondContact O-CB 3.45Å; S12-L16 PolarHBondContact O-N 3.18Å
13	K	57.1	Low	57.1	Low	157 Å²	157	126.1 Å²	126.1	68%	0.683	61%	0.605	S	S	*	*	H	α-helix	trans	-61.3	-41.4	179.8	-75.5	-171.3	178.2	-177.7	0	113.4	L9 T11 L16 F17	L9-K13 PolarHBondContact O-N 3.09Å; T11-K13 PolarHBondContact O-N 3.17Å; K13-L16 PolarHBondContact O-N 2.91Å; K13-F17 WeakPolarHBondContact O-CB 3.47Å; K13-F17 PolarHBondContact O-N 2.94Å
14	K	57.8	Low	58.8	Low	161 Å²	161	122.2 Å²	122.2	70%	0.7	59%	0.591	S	S	*	*	H	α-helix	trans	-64.3	-43.8	176.7	-74.5	-172.4	178.4	-177.8	0	111.2	T11 S12 L16 F17 I18	T11-K14 PolarHBondContact O-N 3.36Å; S12-K14 PolarHBondContact O-N 2.93Å; K14-L16 VanDerWaalsContact C-N 3.35Å; K14-F17 PolarHBondContact O-N 2.99Å; K14-I18 WeakPolarHBondContact O-CD1 3.36Å; K14-I18 VanDerWaalsContact O-CG1 3.29Å; K14-I18 WeakPolarHBondContact O-CG1 3.42Å; K14-I18 PolarHBondContact O-N 3.25Å
15	H	59.6	Low	60.1	Low	132 Å²	132	117 Å²	117	61%	0.611	58%	0.579	S	S	*	*	H	α-helix	trans	-64.5	-39.1	175.5	-76.6	-66.8	0	0	0	112.3	T11 S12 I18 L19	T11-H15 PolarHBondContact O-CD2 3.35Å; T11-H15 PolarHBondContact O-N 3.43Å; S12-H15 PolarHBondContact O-N 3.23Å; H15-I18 PolarHBondContact O-N 2.85Å; H15-L19 VanDerWaalsContact O-CB 3.32Å; H15-L19 WeakPolarHBondContact O-CB 3.32Å; H15-L19 PolarHBondContact O-N 3.1Å
16	L	62.6	Low	61.1	Low	107 Å²	107	111 Å²	111	56%	0.56	56%	0.56	S	S	*	*	H	α-helix	trans	-61.8	-46	175.8	-134	101.4	0	0	0	110.7	S12 K13 K14 L19 T20	S12-L16 WeakPolarHBondContact O-CB 3.45Å; S12-L16 PolarHBondContact O-N 3.18Å; K13-L16 PolarHBondContact O-N 2.91Å; K14-L16 VanDerWaalsContact C-N 3.35Å; L16-L19 PolarHBondContact O-N 3.43Å; L16-T20 WeakPolarHBondContact O-CG2 3.29Å; L16-T20 PolarHBondContact O-N 2.98Å; L16-T20 PolarHBondContact O-OG1 3.44Å; L16-T20 VanDerWaalsContact O-OG1 3.1Å
17	F	67.9	Low	62.3	Low	149 Å²	149	106.8 Å²	106.8	65%	0.654	54%	0.542	S	S	*	.	H	α-helix	trans	-64.5	-42.2	179.7	-159.1	-90.6	0	0	0	112	K13 K14 L19 T20 T21	K13-F17 WeakPolarHBondContact O-CB 3.47Å; K13-F17 PolarHBondContact O-N 2.94Å; K14-F17 PolarHBondContact O-N 2.99Å; F17-L19 VanDerWaalsContact C-N 3.34Å; F17-T20 WeakPolarHBondContact CA-OG1 3.43Å; F17-T20 PolarHBondContact O-N 2.88Å; F17-T20 PolarHBondContact O-OG1 2.88Å; F17-T21 WeakPolarHBondContact O-CB 3.37Å; F17-T21 PolarHBondContact O-N 3.42Å; F17-T21 PolarHBondContact O-OG1 2.81Å
18	I	72.9	Confident	63.3	Low	111 Å²	111	102.9 Å²	102.9	57%	0.569	53%	0.534	S	S	*	.	H	α-helix	trans	-62	-44.7	174.6	-68.5	160.2	0	0	0	110.3	K14 H15 T21 Y22	K14-I18 WeakPolarHBondContact O-CD1 3.36Å; K14-I18 VanDerWaalsContact O-CG1 3.29Å; K14-I18 WeakPolarHBondContact O-CG1 3.42Å; K14-I18 PolarHBondContact O-N 3.25Å; H15-I18 PolarHBondContact O-N 2.85Å; I18-T21 PolarHBondContact O-N 3.14Å; I18-Y22 VanDerWaalsContact O-CB 3.29Å; I18-Y22 WeakPolarHBondContact O-CB 3.2Å; I18-Y22 PolarHBondContact O-N 3.34Å
19	L	69.9	Low	63.9	Low	116 Å²	116	101.2 Å²	101.2	61%	0.607	53%	0.53	S	S	*	.	H	α-helix	trans	-64.1	-45.8	179.9	-160.4	103.8	0	0	0	111.4	H15 L16 F17 Y22 V23	H15-L19 VanDerWaalsContact O-CB 3.32Å; H15-L19 WeakPolarHBondContact O-CB 3.32Å; H15-L19 PolarHBondContact O-N 3.1Å; L16-L19 PolarHBondContact O-N 3.43Å; F17-L19 VanDerWaalsContact C-N 3.34Å; L19-Y22 PolarHBondContact O-N 3.5Å; L19-V23 WeakPolarHBondContact O-CB 3.44Å; L19-V23 VanDerWaalsContact O-CG2 3.26Å; L19-V23 WeakPolarHBondContact O-CG2 3.26Å; L19-V23 PolarHBondContact O-N 2.62Å
20	T	74.1	Confident	64.6	Low	59 Å²	59	96.8 Å²	96.8	36%	0.362	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-41.5	178.9	52.9	0	0	0	0	111.4	L16 F17 Y22 V23 I24	L16-T20 WeakPolarHBondContact O-CG2 3.29Å; L16-T20 PolarHBondContact O-N 2.98Å; L16-T20 PolarHBondContact O-OG1 3.44Å; L16-T20 VanDerWaalsContact O-OG1 3.1Å; F17-T20 WeakPolarHBondContact CA-OG1 3.43Å; F17-T20 PolarHBondContact O-N 2.88Å; F17-T20 PolarHBondContact O-OG1 2.88Å; T20-Y22 VanDerWaalsContact C-N 3.34Å; T20-Y22 PolarHBondContact O-N 2.9Å; T20-V23 PolarHBondContact O-N 3.49Å; T20-I24 WeakPolarHBondContact O-CB 3.42Å; T20-I24 WeakPolarHBondContact O-CD1 3.29Å; T20-I24 WeakPolarHBondContact O-CG1 3.35Å; T20-I24 PolarHBondContact O-N 3.44Å
21	T	75	Confident	65.2	Low	63 Å²	63	97.1 Å²	97.1	39%	0.387	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-42.1	178	-46.2	0	0	0	0	110.6	F17 I18 I24 C25	F17-T21 WeakPolarHBondContact O-CB 3.37Å; F17-T21 PolarHBondContact O-N 3.42Å; F17-T21 PolarHBondContact O-OG1 2.81Å; I18-T21 PolarHBondContact O-N 3.14Å; T21-I24 PolarHBondContact O-N 3.07Å; T21-C25 WeakPolarHBondContact O-CB 3.36Å; T21-C25 PolarHBondContact O-N 3.2Å
22	Y	74.6	Confident	65.7	Low	167 Å²	167	97.5 Å²	97.5	66%	0.655	51%	0.508	S	S	*	.	H	α-helix	trans	-61.4	-46.4	175.1	-177	-98.6	0	0	0	111.7	I18 L19 T20 C25 T26	I18-Y22 VanDerWaalsContact O-CB 3.29Å; I18-Y22 WeakPolarHBondContact O-CB 3.2Å; I18-Y22 PolarHBondContact O-N 3.34Å; L19-Y22 PolarHBondContact O-N 3.5Å; T20-Y22 VanDerWaalsContact C-N 3.34Å; T20-Y22 PolarHBondContact O-N 2.9Å; Y22-C25 PolarHBondContact O-N 2.62Å; Y22-T26 WeakPolarHBondContact O-CB 3.45Å; Y22-T26 PolarHBondContact O-N 2.9Å; Y22-T26 PolarHBondContact O-OG1 3.4Å
23	V	73.1	Confident	65.7	Low	63 Å²	63	99.4 Å²	99.4	38%	0.382	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-45.8	177.8	171.4	0	0	0	0	111.2	L19 T20 T26 I27	L19-V23 WeakPolarHBondContact O-CB 3.44Å; L19-V23 VanDerWaalsContact O-CG2 3.26Å; L19-V23 WeakPolarHBondContact O-CG2 3.26Å; L19-V23 PolarHBondContact O-N 2.62Å; T20-V23 PolarHBondContact O-N 3.49Å; V23-T26 PolarHBondContact O-N 3.36Å; V23-I27 HydrophobicContact CG1-CD1 3.79Å; V23-I27 HydrophobicContact CG1-CG1 4.44Å; V23-I27 VanDerWaalsContact O-CG1 3.29Å; V23-I27 WeakPolarHBondContact O-CG1 3.18Å; V23-I27 PolarHBondContact O-N 2.89Å
24	I	77	Confident	65.4	Low	97 Å²	97	96.4 Å²	96.4	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-46.7	178.3	-67.8	164.8	0	0	0	110.9	T20 T21 T26 I27 L28	T20-I24 WeakPolarHBondContact O-CB 3.42Å; T20-I24 WeakPolarHBondContact O-CD1 3.29Å; T20-I24 WeakPolarHBondContact O-CG1 3.35Å; T20-I24 PolarHBondContact O-N 3.44Å; T21-I24 PolarHBondContact O-N 3.07Å; I24-T26 VanDerWaalsContact C-N 3.27Å; I24-T26 PolarHBondContact O-N 3.47Å; I24-I27 PolarHBondContact O-N 2.85Å; I24-L28 HydrophobicContact CG2-CD1 3.84Å; I24-L28 HydrophobicContact CG2-CG 4.31Å; I24-L28 WeakPolarHBondContact O-CB 3.47Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.25Å
25	C	72.6	Confident	64.9	Low	67 Å²	67	94.5 Å²	94.5	45%	0.453	51%	0.506	S	S	.	.	H	α-helix	trans	-59.8	-40	174.7	-82.7	0	0	0	0	111.6	T21 Y22 L28 C29	T21-C25 WeakPolarHBondContact O-CB 3.36Å; T21-C25 PolarHBondContact O-N 3.2Å; Y22-C25 PolarHBondContact O-N 2.62Å; C25-L28 PolarHBondContact O-N 2.97Å; C25-C29 VanDerWaalsContact O-CB 3.32Å; C25-C29 WeakPolarHBondContact O-CB 3.5Å; C25-C29 PolarHBondContact O-N 3.38Å; C25-C29 PolarHBondContact O-SG 2.87Å
26	T	67.8	Low	64.4	Low	35 Å²	35	92.8 Å²	92.8	22%	0.215	50%	0.502	C	S	.	.	H	α-helix	trans	-64.6	-43.5	178.2	-47	0	0	0	0	111	Y22 V23 I24 C29 I30 F132	Y22-T26 WeakPolarHBondContact O-CB 3.45Å; Y22-T26 PolarHBondContact O-N 2.9Å; Y22-T26 PolarHBondContact O-OG1 3.4Å; V23-T26 PolarHBondContact O-N 3.36Å; I24-T26 VanDerWaalsContact C-N 3.27Å; I24-T26 PolarHBondContact O-N 3.47Å; T26-C29 PolarHBondContact O-N 3.22Å; T26-I30 HydrophobicContact CG2-CD1 4.04Å; T26-I30 WeakPolarHBondContact O-CB 3.29Å; T26-I30 WeakPolarHBondContact O-CD1 3.48Å; T26-I30 WeakPolarHBondContact O-CG1 3.41Å; T26-I30 PolarHBondContact O-N 2.85Å; T26-F132 HydrophobicContact CG2-CZ 4.38Å
27	I	65.8	Low	63.7	Low	81 Å²	81	91.8 Å²	91.8	42%	0.415	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-46.6	175.9	-67.4	166.4	0	0	0	110.8	V23 I24 I30 N31	V23-I27 HydrophobicContact CG1-CD1 3.79Å; V23-I27 HydrophobicContact CG1-CG1 4.44Å; V23-I27 VanDerWaalsContact O-CG1 3.29Å; V23-I27 WeakPolarHBondContact O-CG1 3.18Å; V23-I27 PolarHBondContact O-N 2.89Å; I24-I27 PolarHBondContact O-N 2.85Å; I27-I30 PolarHBondContact O-N 2.91Å; I27-N31 WeakPolarHBondContact O-CB 3.41Å; I27-N31 VanDerWaalsContact O-CG 3.32Å; I27-N31 PolarHBondContact O-N 3.25Å
28	L	66.6	Low	62.8	Low	107 Å²	107	88 Å²	88	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-62.7	-43.6	178.6	-72.9	171.5	0	0	0	111.7	I24 C25 I30 N31 S32	I24-L28 HydrophobicContact CG2-CD1 3.84Å; I24-L28 HydrophobicContact CG2-CG 4.31Å; I24-L28 WeakPolarHBondContact O-CB 3.47Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.25Å; C25-L28 PolarHBondContact O-N 2.97Å; L28-I30 VanDerWaalsContact C-N 3.32Å; L28-I30 PolarHBondContact O-N 3.32Å; L28-N31 PolarHBondContact O-N 2.84Å; L28-S32 WeakPolarHBondContact O-CB 3.42Å; L28-S32 PolarHBondContact O-N 3.26Å; L28-S32 PolarHBondContact O-OG 3.45Å
29	C	58.5	Low	61.5	Low	81 Å²	81	85.6 Å²	85.6	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-37.6	176	-72.6	0	0	0	0	112.1	C25 T26 S32 E33	C25-C29 VanDerWaalsContact O-CB 3.32Å; C25-C29 WeakPolarHBondContact O-CB 3.5Å; C25-C29 PolarHBondContact O-N 3.38Å; C25-C29 PolarHBondContact O-SG 2.87Å; T26-C29 PolarHBondContact O-N 3.22Å; C29-S32 WeakPolarHBondContact CA-OG 3.36Å; C29-S32 PolarHBondContact O-OG 3.41Å; C29-E33 PolarHBondContact O-N 2.95Å
30	I	59	Low	60.4	Low	41 Å²	41	84.3 Å²	84.3	21%	0.21	48%	0.475	C	S	.	.	H	α-helix	trans	-66.4	-42.4	175.4	-69.9	164.3	0	0	0	110.6	T26 I27 L28 F132	T26-I30 HydrophobicContact CG2-CD1 4.04Å; T26-I30 WeakPolarHBondContact O-CB 3.29Å; T26-I30 WeakPolarHBondContact O-CD1 3.48Å; T26-I30 WeakPolarHBondContact O-CG1 3.41Å; T26-I30 PolarHBondContact O-N 2.85Å; I27-I30 PolarHBondContact O-N 2.91Å; L28-I30 VanDerWaalsContact C-N 3.32Å; L28-I30 PolarHBondContact O-N 3.32Å; I30-F132 HydrophobicContact CD1-CD1 4.4Å; I30-F132 HydrophobicContact CD1-CE1 4.3Å
31	N	56.4	Low	59.1	Low	106 Å²	106	88.1 Å²	88.1	57%	0.567	49%	0.492	S	S	*	.	H	α-helix	trans	-74.1	-26	179.8	-69.5	-12.4	0	0	0	113.1	I27 L28	I27-N31 WeakPolarHBondContact O-CB 3.41Å; I27-N31 VanDerWaalsContact O-CG 3.32Å; I27-N31 PolarHBondContact O-N 3.25Å; L28-N31 PolarHBondContact O-N 2.84Å
32	S	57.8	Low	57.7	Low	93 Å²	93	91.3 Å²	91.3	65%	0.65	51%	0.506	S	S	*	.	H	α-helix	trans	-76.9	-21.2	178.1	66.8	0	0	0	0	113.5	L28 C29 S34	L28-S32 WeakPolarHBondContact O-CB 3.42Å; L28-S32 PolarHBondContact O-N 3.26Å; L28-S32 PolarHBondContact O-OG 3.45Å; C29-S32 WeakPolarHBondContact CA-OG 3.36Å; C29-S32 PolarHBondContact O-OG 3.41Å; S32-S34 PolarHBondContact O-N 3.05Å
33	E	54.1	Low	56.7	Low	95 Å²	95	88.3 Å²	88.3	44%	0.444	50%	0.501	S	S	.	.	S	Bend	trans	-70.5	104.3	163.6	-82.8	-173.8	-151.2	0	0	106.8	C29 L35 R129	C29-E33 PolarHBondContact O-N 2.95Å; E33-L35 PolarHBondContact O-N 2.64Å; E33-L35 VanDerWaalsContact O-N 3.08Å; E33-R129 IonicContact OE1-NH2 2.94Å; E33-R129 PolarHBondContact OE1-NH2 3.32Å; E33-R129 IonicContact OE2-CZ 3.1Å; E33-R129 IonicContact OE2-NH1 2.73Å; E33-R129 PolarHBondContact OE2-NH1 3.22Å; E33-R129 IonicContact OE2-NH2 2.64Å; E33-R129 PolarHBondContact OE2-NH2 2.98Å
34	S	49.8	Very low	56.1	Low	93 Å²	93	90.9 Å²	90.9	65%	0.65	51%	0.507	S	S	*	.			trans	-47.8	121	176.9	57.5	0	0	0	0	108.8	S32 D36	S32-S34 PolarHBondContact O-N 3.05Å; S34-D36 PolarHBondContact O-N 2.73Å
35	L	48.5	Very low	55.7	Low	122 Å²	122	89.9 Å²	89.9	64%	0.639	51%	0.507	S	S	*	.			trans	-64.9	75.5	164.5	-77.8	95.3	0	0	0	107.2	E33 D37	E33-L35 PolarHBondContact O-N 2.64Å; E33-L35 VanDerWaalsContact O-N 3.08Å; L35-D37 VanDerWaalsContact CD2-OD2 3.3Å; L35-D37 WeakPolarHBondContact CD2-OD2 3.42Å; L35-D37 PolarHBondContact O-N 2.94Å
36	D	48.1	Very low	55.9	Low	96 Å²	96	87.9 Å²	87.9	51%	0.513	49%	0.494	S	S	.	.			trans	-71	69.8	151.3	-83.6	-27.2	0	0	0	106	S34 S38 S39	S34-D36 PolarHBondContact O-N 2.73Å; D36-S38 PolarHBondContact O-N 2.87Å; D36-S39 WeakPolarHBondContact O-CA 3.26Å; D36-S39 WeakPolarHBondContact O-CB 3.1Å; D36-S39 PolarHBondContact O-N 2.9Å; D36-S39 PolarHBondContact O-OG 3.08Å
37	D	47.6	Very low	56.5	Low	85 Å²	85	87.4 Å²	87.4	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-23.4	170.5	-82.2	-18.1	0	0	0	110.4	L35 S39 L40 L41	L35-D37 VanDerWaalsContact CD2-OD2 3.3Å; L35-D37 WeakPolarHBondContact CD2-OD2 3.42Å; L35-D37 PolarHBondContact O-N 2.94Å; D37-S39 PolarHBondContact O-N 3.43Å; D37-L40 WeakPolarHBondContact O-CB 3.38Å; D37-L40 PolarHBondContact O-N 2.74Å; D37-L41 PolarHBondContact O-N 2.86Å
38	S	48.9	Very low	57.2	Low	71 Å²	71	87.5 Å²	87.5	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-56	-32.5	166.4	46	0	0	0	0	112.7	D36	D36-S38 PolarHBondContact O-N 2.87Å
39	S	45.9	Very low	57.9	Low	59 Å²	59	84 Å²	84	41%	0.413	48%	0.483	S	S	.	.	H	α-helix	trans	-80.4	-18.3	175.5	77.2	0	0	0	0	113.9	D36 D37 L41	D36-S39 WeakPolarHBondContact O-CA 3.26Å; D36-S39 WeakPolarHBondContact O-CB 3.1Å; D36-S39 PolarHBondContact O-N 2.9Å; D36-S39 PolarHBondContact O-OG 3.08Å; D37-S39 PolarHBondContact O-N 3.43Å; S39-L41 VanDerWaalsContact C-N 3.34Å
40	L	47.2	Very low	59.1	Low	89 Å²	89	81.4 Å²	81.4	47%	0.466	47%	0.465	S	S	.	.	H	α-helix	trans	-73.1	-29.9	172.8	-82.1	168.5	0	0	0	111.9	D37	D37-L40 WeakPolarHBondContact O-CB 3.38Å; D37-L40 PolarHBondContact O-N 2.74Å
41	L	46	Very low	60.3	Low	139 Å²	139	82.3 Å²	82.3	73%	0.728	47%	0.469	S	S	*	.	H	α-helix	trans	-79.4	-29.9	-179.5	-96.3	160.4	0	0	0	113.9	D37 S39	D37-L41 PolarHBondContact O-N 2.86Å; S39-L41 VanDerWaalsContact C-N 3.34Å
42	I	46.9	Very low	61.5	Low	131 Å²	131	81.6 Å²	81.6	67%	0.672	47%	0.466	S	S	*	.	H	α-helix	trans	-85.6	-26.4	-166.3	-66.4	174.3	0	0	0	113.6
43	D	53.7	Low	62.5	Low	104 Å²	104	81.7 Å²	81.7	56%	0.556	46%	0.457	S	S	*	.			trans	-125.1	86.8	179.6	-62.4	-40.1	0	0	0	110.1	P45	D43-P45 VanDerWaalsContact C-N 3.32Å; D43-P45 WeakPolarHBondContact O-CD 3.34Å
44	F	60.4	Low	63.7	Low	116 Å²	116	80.2 Å²	80.2	51%	0.509	45%	0.449	S	S	.	.			trans	-80.7	89.6	143.3	-74.1	-82.9	0	0	0	105.7	C46 G47	F44-C46 PolarHBondContact O-N 2.86Å; F44-G47 PolarHBondContact O-N 3.38Å
45	P	68.7	Low	65.1	Low	76 Å²	76	77.8 Å²	77.8	49%	0.494	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.5	-177.8	24.6	-37	0	0	0	112.6	D43 Q120	D43-P45 VanDerWaalsContact C-N 3.32Å; D43-P45 WeakPolarHBondContact O-CD 3.34Å; P45-Q120 HydrophobicContact CG-CG 3.68Å; P45-Q120 VanDerWaalsContact CG-OE1 3.28Å
46	C	77.2	Confident	66.4	Low	26 Å²	26	75.1 Å²	75.1	18%	0.176	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-0.6	177.9	-52	0	0	0	0	113.5	F44 W113 C116 M117	F44-C46 PolarHBondContact O-N 2.86Å; C46-W113 VanDerWaalsContact O-CD1 3.3Å; C46-C116 WeakPolarHBondContact CA-SG 3.31Å; C46-C116 HydrophobicContact CB-CB 3.68Å; C46-C116 WeakPolarHBondContact CB-SG 3.33Å; C46-C116 WeakPolarHBondContact SG-CB 3.5Å; C46-C116 CovalentContact SG-SG 2.02Å; C46-C116 PolarHBondContact SG-SG 3.42Å; C46-M117 HydrophobicContact CB-CG 4.05Å; C46-M117 HydrophobicContact CB-SD 4.05Å; C46-M117 PolarHBondContact SG-N 3.1Å; C46-M117 VanDerWaalsContact SG-N 3.38Å
47	G	79.5	Confident	67.9	Low	25 Å²	25	77.5 Å²	77.5	26%	0.258	43%	0.426	S	S	.	.			trans	71.3	-175.9	-172.1	0	0	0	0	0	113.7	F44 W113	F44-G47 PolarHBondContact O-N 3.38Å; G47-W113 PolarHBondContact O-NE1 3.2Å
48	P	80.9	Confident	69.2	Low	83 Å²	83	75 Å²	75	54%	0.539	41%	0.412	S	S	.	.	S	Bend	trans	-63.3	153.3	175.4	28.2	-35.5	0	0	0	111.6	M53	P48-M53 HydrophobicContact CB-CG 4.03Å; P48-M53 HydrophobicContact CG-CG 3.72Å; P48-M53 HydrophobicContact CG-SD 3.71Å
49	H	81.7	Confident	70.5	Confident	33 Å²	33	75.6 Å²	75.6	15%	0.153	41%	0.406	C	S	.	.			trans	-65.5	136.3	178	-169.7	-93.6	0	0	0	110.2	I51 D52 M53 W113	H49-I51 VanDerWaalsContact CE1-CG1 3.49Å; H49-I51 WeakPolarHBondContact CE1-CG1 3.5Å; H49-I51 WeakPolarHBondContact ND1-CB 3.45Å; H49-I51 PolarHBondContact ND1-N 2.94Å; H49-I51 VanDerWaalsContact ND1-N 3.17Å; H49-I51 PolarHBondContact O-N 3.39Å; H49-D52 HydrophobicContact CB-CB 4.31Å; H49-D52 WeakPolarHBondContact CB-OD2 3.41Å; H49-D52 WeakPolarHBondContact O-CB 3.35Å; H49-D52 PolarHBondContact O-N 3.23Å; H49-M53 PolarHBondContact O-N 3.48Å; H49-W113 HydrophobicContact CB-CZ2 4.24Å; H49-W113 AromaticContact CD2-CD2 3.61Å; H49-W113 AromaticContact CD2-CE2 3.95Å; H49-W113 AromaticContact CD2-CE3 3.38Å; H49-W113 AromaticContact CD2-CH2 3.82Å; H49-W113 AromaticContact CD2-CZ3 3.5Å; H49-W113 VanDerWaalsContact CD2-CZ3 3.5Å; H49-W113 WeakPolarHBondContact CD2-CZ3 3.29Å; H49-W113 AromaticContact NE2-CE3 3.99Å
50	P	83.5	Confident	72	Confident	26 Å²	26	76.7 Å²	76.7	17%	0.169	41%	0.407	C	S	.	.	H	α-helix	trans	-58.2	-33.7	-177.7	-27.7	34.9	0	0	0	114.2	F54 I110 W113	P50-F54 WeakPolarHBondContact O-CB 3.44Å; P50-F54 PolarHBondContact O-N 3.5Å; P50-I110 HydrophobicContact CB-CG1 4.3Å; P50-W113 HydrophobicContact CG-CB 4.05Å
51	I	84	Confident	73.3	Confident	60 Å²	60	78.8 Å²	78.8	31%	0.308	41%	0.41	S	S	.	.	H	α-helix	trans	-66.2	-40.8	174.3	-61.4	178.1	0	0	0	110.5	H49 M53 F54 L55 I110	H49-I51 VanDerWaalsContact CE1-CG1 3.49Å; H49-I51 WeakPolarHBondContact CE1-CG1 3.5Å; H49-I51 WeakPolarHBondContact ND1-CB 3.45Å; H49-I51 PolarHBondContact ND1-N 2.94Å; H49-I51 VanDerWaalsContact ND1-N 3.17Å; H49-I51 PolarHBondContact O-N 3.39Å; I51-M53 VanDerWaalsContact C-N 3.33Å; I51-M53 PolarHBondContact O-N 2.83Å; I51-F54 PolarHBondContact O-N 3.29Å; I51-L55 HydrophobicContact CG2-CD1 3.77Å; I51-L55 HydrophobicContact CG2-CG 3.99Å; I51-L55 WeakPolarHBondContact O-CB 3.48Å; I51-L55 VanDerWaalsContact O-CG 3.3Å; I51-L55 WeakPolarHBondContact O-CG 3.44Å; I51-L55 PolarHBondContact O-N 2.84Å; I51-I110 HydrophobicContact CD1-CD1 3.81Å; I51-I110 HydrophobicContact CD1-CG1 4.4Å; I51-I110 HydrophobicContact CG1-CD1 3.72Å; I51-I110 HydrophobicContact CG1-CG1 4.05Å
52	D	81.1	Confident	74.5	Confident	92 Å²	92	73.4 Å²	73.4	49%	0.492	38%	0.382	S	S	.	.	H	α-helix	trans	-64.2	-44	179.8	-60.2	-13.6	0	0	0	109.8	H49 F54 L55 S56	H49-D52 HydrophobicContact CB-CB 4.31Å; H49-D52 WeakPolarHBondContact CB-OD2 3.41Å; H49-D52 WeakPolarHBondContact O-CB 3.35Å; H49-D52 PolarHBondContact O-N 3.23Å; D52-F54 VanDerWaalsContact C-N 3.31Å; D52-F54 PolarHBondContact O-N 3.48Å; D52-L55 PolarHBondContact O-N 3.11Å; D52-S56 WeakPolarHBondContact O-CB 3.35Å; D52-S56 PolarHBondContact O-N 2.85Å; D52-S56 PolarHBondContact O-OG 3.06Å; D52-S56 VanDerWaalsContact O-OG 3.08Å
53	M	78.5	Confident	75.7	Confident	95 Å²	95	74.2 Å²	74.2	47%	0.468	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-41.3	174	-67.9	-171.2	74.1	0	0	112.6	P48 H49 I51 K57	P48-M53 HydrophobicContact CB-CG 4.03Å; P48-M53 HydrophobicContact CG-CG 3.72Å; P48-M53 HydrophobicContact CG-SD 3.71Å; H49-M53 PolarHBondContact O-N 3.48Å; I51-M53 VanDerWaalsContact C-N 3.33Å; I51-M53 PolarHBondContact O-N 2.83Å; M53-K57 WeakPolarHBondContact O-CG 3.39Å; M53-K57 PolarHBondContact O-N 2.66Å
54	F	78.9	Confident	76.7	Confident	64 Å²	64	77.4 Å²	77.4	28%	0.281	39%	0.391	S	S	.	.	H	α-helix	trans	-66.2	-46.6	177.7	179.4	-86.2	0	0	0	111.2	P50 I51 D52 K57 L58 F92 I106	P50-F54 WeakPolarHBondContact O-CB 3.44Å; P50-F54 PolarHBondContact O-N 3.5Å; I51-F54 PolarHBondContact O-N 3.29Å; D52-F54 VanDerWaalsContact C-N 3.31Å; D52-F54 PolarHBondContact O-N 3.48Å; F54-K57 PolarHBondContact O-N 2.87Å; F54-L58 HydrophobicContact CE1-CB 4.42Å; F54-L58 HydrophobicContact CE1-CD2 3.8Å; F54-L58 WeakPolarHBondContact O-CB 3.3Å; F54-L58 PolarHBondContact O-N 2.97Å; F54-F92 AromaticContact CD1-CE1 3.92Å; F54-F92 HydrophobicContact CD1-CE1 3.92Å; F54-F92 AromaticContact CD1-CE2 3.96Å; F54-F92 HydrophobicContact CD1-CE2 3.96Å; F54-F92 AromaticContact CD1-CZ 3.21Å; F54-F92 HydrophobicContact CD1-CZ 3.21Å; F54-F92 AromaticContact CE1-CE1 3.66Å; F54-F92 HydrophobicContact CE1-CE1 3.66Å; F54-F92 AromaticContact CE1-CE2 3.58Å; F54-F92 HydrophobicContact CE1-CE2 3.58Å; F54-F92 AromaticContact CE1-CZ 3.1Å; F54-F92 HydrophobicContact CE1-CZ 3.1Å; F54-F92 HydrophobicContact CG-CZ 4.23Å; F54-F92 HydrophobicContact CZ-CE1 4.22Å; F54-F92 HydrophobicContact CZ-CZ 4.08Å; F54-I106 HydrophobicContact CD2-CD1 4.02Å; F54-I106 HydrophobicContact CE2-CD1 4.08Å
55	L	79.6	Confident	77.1	Confident	41 Å²	41	77.8 Å²	77.8	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-63.5	-43.2	179.3	-72.1	177.3	0	0	0	111.4	I51 D52 K57 L58 F59 L88 F92	I51-L55 HydrophobicContact CG2-CD1 3.77Å; I51-L55 HydrophobicContact CG2-CG 3.99Å; I51-L55 WeakPolarHBondContact O-CB 3.48Å; I51-L55 VanDerWaalsContact O-CG 3.3Å; I51-L55 WeakPolarHBondContact O-CG 3.44Å; I51-L55 PolarHBondContact O-N 2.84Å; D52-L55 PolarHBondContact O-N 3.11Å; L55-K57 PolarHBondContact O-N 2.9Å; L55-L58 PolarHBondContact O-N 3.36Å; L55-F59 HydrophobicContact CB-CD2 4.38Å; L55-F59 HydrophobicContact CB-CE2 4.08Å; L55-F59 WeakPolarHBondContact O-CB 3.3Å; L55-F59 WeakPolarHBondContact O-CD2 3.38Å; L55-F59 WeakPolarHBondContact O-CG 3.37Å; L55-F59 PolarHBondContact O-N 3.3Å; L55-L88 HydrophobicContact CD2-CD1 4.4Å; L55-L88 HydrophobicContact CD2-CD2 3.75Å; L55-F92 HydrophobicContact CD2-CE2 4Å; L55-F92 HydrophobicContact CD2-CZ 4.42Å
56	S	77.2	Confident	76.9	Confident	66 Å²	66	76.8 Å²	76.8	46%	0.462	38%	0.384	S	S	.	.	H	α-helix	trans	-56.5	-50.1	174.2	-65	0	0	0	0	111.2	D52 L58 F59 D60	D52-S56 WeakPolarHBondContact O-CB 3.35Å; D52-S56 PolarHBondContact O-N 2.85Å; D52-S56 PolarHBondContact O-OG 3.06Å; D52-S56 VanDerWaalsContact O-OG 3.08Å; S56-L58 VanDerWaalsContact C-N 3.29Å; S56-L58 PolarHBondContact O-N 3.24Å; S56-F59 PolarHBondContact O-N 3.45Å; S56-D60 WeakPolarHBondContact O-CB 3.41Å; S56-D60 PolarHBondContact O-N 3Å
57	K	78.3	Confident	75.8	Confident	147 Å²	147	81.4 Å²	81.4	64%	0.639	41%	0.411	S	S	*	.	H	α-helix	trans	-62.7	-36.1	177.2	-73.3	-178.9	178.3	-177.5	0	113	M53 F54 L55 Y61	M53-K57 WeakPolarHBondContact O-CG 3.39Å; M53-K57 PolarHBondContact O-N 2.66Å; F54-K57 PolarHBondContact O-N 2.87Å; L55-K57 PolarHBondContact O-N 2.9Å; K57-Y61 WeakPolarHBondContact O-CB 3.42Å; K57-Y61 PolarHBondContact O-N 3.04Å
58	L	75	Confident	74.6	Confident	31 Å²	31	85.8 Å²	85.8	16%	0.162	44%	0.435	C	S	.	.	H	α-helix	trans	-68.9	-41.8	178	-179.8	55.9	0	0	0	111	F54 L55 S56 Y61 L62 L88	F54-L58 HydrophobicContact CE1-CB 4.42Å; F54-L58 HydrophobicContact CE1-CD2 3.8Å; F54-L58 WeakPolarHBondContact O-CB 3.3Å; F54-L58 PolarHBondContact O-N 2.97Å; L55-L58 PolarHBondContact O-N 3.36Å; S56-L58 VanDerWaalsContact C-N 3.29Å; S56-L58 PolarHBondContact O-N 3.24Å; L58-Y61 PolarHBondContact O-N 3Å; L58-L62 HydrophobicContact CD1-CD1 4.38Å; L58-L62 HydrophobicContact CD1-CG 4.3Å; L58-L62 HydrophobicContact CG-CD1 4.22Å; L58-L62 WeakPolarHBondContact O-CB 3.39Å; L58-L62 VanDerWaalsContact O-CG 3.27Å; L58-L62 WeakPolarHBondContact O-CG 3.35Å; L58-L62 PolarHBondContact O-N 2.83Å; L58-L88 HydrophobicContact CD2-CD2 3.32Å; L58-L88 HydrophobicContact CG-CD2 4.07Å
59	F	76.7	Confident	73.4	Confident	85 Å²	85	87.3 Å²	87.3	37%	0.373	44%	0.438	S	S	.	.	H	α-helix	trans	-66.8	-44.3	174.3	-67	-45.5	0	0	0	111.6	L55 S56 Y61 L62 E63 I84 L88	L55-F59 HydrophobicContact CB-CD2 4.38Å; L55-F59 HydrophobicContact CB-CE2 4.08Å; L55-F59 WeakPolarHBondContact O-CB 3.3Å; L55-F59 WeakPolarHBondContact O-CD2 3.38Å; L55-F59 WeakPolarHBondContact O-CG 3.37Å; L55-F59 PolarHBondContact O-N 3.3Å; S56-F59 PolarHBondContact O-N 3.45Å; F59-Y61 PolarHBondContact O-N 3.18Å; F59-L62 HydrophobicContact CD1-CD1 4.34Å; F59-L62 PolarHBondContact O-N 3.39Å; F59-L62 VanDerWaalsContact O-N 3.1Å; F59-E63 VanDerWaalsContact O-CB 3.32Å; F59-E63 WeakPolarHBondContact O-CB 3.11Å; F59-E63 PolarHBondContact O-N 3.23Å; F59-I84 HydrophobicContact CD1-CG2 4.48Å; F59-I84 HydrophobicContact CE1-CG2 3.68Å; F59-L88 HydrophobicContact CE1-CD1 3.92Å; F59-L88 HydrophobicContact CE1-CD2 3.91Å; F59-L88 HydrophobicContact CE1-CG 4.24Å; F59-L88 HydrophobicContact CZ-CD1 3.74Å; F59-L88 HydrophobicContact CZ-CD2 4.18Å; F59-L88 HydrophobicContact CZ-CG 4.48Å
60	D	77.9	Confident	72.1	Confident	81 Å²	81	93.1 Å²	93.1	43%	0.433	47%	0.467	S	S	.	.	H	α-helix	trans	-57	-37	173.5	-65.7	-15.4	0	0	0	111.5	S56 K64	S56-D60 WeakPolarHBondContact O-CB 3.41Å; S56-D60 PolarHBondContact O-N 3Å; D60-K64 WeakPolarHBondContact O-CB 2.85Å; D60-K64 WeakPolarHBondContact O-CD 3.49Å; D60-K64 WeakPolarHBondContact O-CG 3.22Å; D60-K64 PolarHBondContact O-N 2.81Å
61	Y	74.7	Confident	70.7	Confident	134 Å²	134	100.3 Å²	100.3	53%	0.525	50%	0.503	S	S	.	.	H	α-helix	trans	-70.3	-47.4	175.7	177.3	-97.9	0	0	0	111.5	K57 L58 F59 K64 Q65	K57-Y61 WeakPolarHBondContact O-CB 3.42Å; K57-Y61 PolarHBondContact O-N 3.04Å; L58-Y61 PolarHBondContact O-N 3Å; F59-Y61 PolarHBondContact O-N 3.18Å; Y61-K64 PolarHBondContact O-N 3.34Å; Y61-Q65 HydrophobicContact CD1-CG 4.24Å; Y61-Q65 HydrophobicContact CE1-CG 3.78Å; Y61-Q65 HydrophobicContact CE2-CG 4.12Å; Y61-Q65 VanDerWaalsContact O-CG 3.31Å; Y61-Q65 WeakPolarHBondContact O-CG 3.48Å; Y61-Q65 PolarHBondContact O-N 3.15Å; Y61-Q65 VanDerWaalsContact O-N 3.08Å
62	L	70	Confident	69.2	Low	26 Å²	26	101.2 Å²	101.2	14%	0.136	51%	0.512	C	S	.	.	H	α-helix	trans	-62.4	-42.8	178.8	-72.8	173.1	0	0	0	111.5	L58 F59 K64 Q65 E66 K87	L58-L62 HydrophobicContact CD1-CD1 4.38Å; L58-L62 HydrophobicContact CD1-CG 4.3Å; L58-L62 HydrophobicContact CG-CD1 4.22Å; L58-L62 WeakPolarHBondContact O-CB 3.39Å; L58-L62 VanDerWaalsContact O-CG 3.27Å; L58-L62 WeakPolarHBondContact O-CG 3.35Å; L58-L62 PolarHBondContact O-N 2.83Å; F59-L62 HydrophobicContact CD1-CD1 4.34Å; F59-L62 PolarHBondContact O-N 3.39Å; F59-L62 VanDerWaalsContact O-N 3.1Å; L62-K64 VanDerWaalsContact C-N 3.3Å; L62-K64 PolarHBondContact O-N 3.44Å; L62-Q65 CarbonylContact O-C 3.56Å; L62-Q65 PolarHBondContact O-N 2.97Å; L62-E66 WeakPolarHBondContact O-CB 3.29Å; L62-E66 WeakPolarHBondContact O-CG 3.49Å; L62-E66 PolarHBondContact O-N 3.48Å; L62-K87 HydrophobicContact CD2-CD 4.2Å
63	E	71.7	Confident	68	Low	148 Å²	148	99 Å²	99	69%	0.692	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-37.5	176.6	-173.2	178	-168.8	0	0	111.7	F59 Q65	F59-E63 VanDerWaalsContact O-CB 3.32Å; F59-E63 WeakPolarHBondContact O-CB 3.11Å; F59-E63 PolarHBondContact O-N 3.23Å; E63-Q65 VanDerWaalsContact C-N 3.3Å; E63-Q65 PolarHBondContact O-N 2.91Å
64	K	76.3	Confident	67	Low	170 Å²	170	102.4 Å²	102.4	74%	0.739	53%	0.525	S	S	*	.	H	α-helix	trans	-70.1	-25.3	173.7	-74.2	170	-173.2	171.6	0	113.7	D60 Y61 L62	D60-K64 WeakPolarHBondContact O-CB 2.85Å; D60-K64 WeakPolarHBondContact O-CD 3.49Å; D60-K64 WeakPolarHBondContact O-CG 3.22Å; D60-K64 PolarHBondContact O-N 2.81Å; Y61-K64 PolarHBondContact O-N 3.34Å; L62-K64 VanDerWaalsContact C-N 3.3Å; L62-K64 PolarHBondContact O-N 3.44Å
65	Q	68.8	Low	66.1	Low	124 Å²	124	104.8 Å²	104.8	58%	0.579	55%	0.546	S	S	*	.	H	α-helix	trans	-90.4	-29.7	178.4	-66.5	-61.9	-54.3	0	0	112.3	Y61 L62 E63	Y61-Q65 HydrophobicContact CD1-CG 4.24Å; Y61-Q65 HydrophobicContact CE1-CG 3.78Å; Y61-Q65 HydrophobicContact CE2-CG 4.12Å; Y61-Q65 VanDerWaalsContact O-CG 3.31Å; Y61-Q65 WeakPolarHBondContact O-CG 3.48Å; Y61-Q65 PolarHBondContact O-N 3.15Å; Y61-Q65 VanDerWaalsContact O-N 3.08Å; L62-Q65 CarbonylContact O-C 3.56Å; L62-Q65 PolarHBondContact O-N 2.97Å; E63-Q65 VanDerWaalsContact C-N 3.3Å; E63-Q65 PolarHBondContact O-N 2.91Å
66	E	64.3	Low	65.2	Low	56 Å²	56	106 Å²	106	26%	0.262	55%	0.552	S	S	.	*	S	Bend	trans	-77.7	130.4	-178.8	-75.8	-176.1	178.8	0	0	110.4	L62 H80 K87	L62-E66 WeakPolarHBondContact O-CB 3.29Å; L62-E66 WeakPolarHBondContact O-CG 3.49Å; L62-E66 PolarHBondContact O-N 3.48Å; E66-H80 IonicContact OE2-CE1 3.55Å; E66-K87 IonicContact OE1-NZ 2.63Å; E66-K87 PolarHBondContact OE1-NZ 2.76Å
67	T	53.3	Low	64.6	Low	123 Å²	123	108.5 Å²	108.5	76%	0.755	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-65.3	143.8	165.1	48	0	0	0	0	108.9	I69	T67-I69 PolarHBondContact O-N 3.17Å
68	P	55.1	Low	64.1	Low	116 Å²	116	108.9 Å²	108.9	75%	0.753	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-48.2	131.9	-174.8	16.8	-30.5	0	0	0	111.7	M70	P68-M70 PolarHBondContact O-N 2.98Å
69	I	55.7	Low	63.9	Low	116 Å²	116	111.9 Å²	111.9	60%	0.595	57%	0.574	S	S	*	*			trans	-53.7	108.6	177.4	-58.4	167.3	0	0	0	106.9	T67 D71	T67-I69 PolarHBondContact O-N 3.17Å; I69-D71 PolarHBondContact O-N 3.15Å
70	M	52.9	Low	63.5	Low	155 Å²	155	110.5 Å²	110.5	76%	0.764	57%	0.568	S	S	*	*			trans	-64	128.8	168.3	-61.8	-119.3	89.9	0	0	106.3	P68 T72	P68-M70 PolarHBondContact O-N 2.98Å; M70-T72 WeakPolarHBondContact O-CB 3.35Å; M70-T72 WeakPolarHBondContact O-CG2 3.44Å; M70-T72 PolarHBondContact O-N 3.34Å; M70-T72 PolarHBondContact O-OG1 3.34Å
71	D	54	Low	63.1	Low	176 Å²	176	111.3 Å²	111.3	94%	0.941	57%	0.572	S	S	*	*			trans	-44.1	101.7	173.7	-82.1	-36.6	0	0	0	109.2	I69	I69-D71 PolarHBondContact O-N 3.15Å
72	T	53.3	Low	62.9	Low	79 Å²	79	112.3 Å²	112.3	49%	0.485	58%	0.579	S	S	.	*			trans	-124.3	144.5	-176.5	35.1	0	0	0	0	107.4	M70 D76	M70-T72 WeakPolarHBondContact O-CB 3.35Å; M70-T72 WeakPolarHBondContact O-CG2 3.44Å; M70-T72 PolarHBondContact O-N 3.34Å; M70-T72 PolarHBondContact O-OG1 3.34Å; T72-D76 VanDerWaalsContact CB-OD2 3.31Å; T72-D76 WeakPolarHBondContact CB-OD2 2.98Å; T72-D76 HydrophobicContact CG2-CB 4.48Å
73	G	56.7	Low	63	Low	45 Å²	45	116.1 Å²	116.1	46%	0.464	60%	0.597	S	S	.	*			trans	-61.5	168.2	-166.6	0	0	0	0	0	113.6	T75 D76 E77	G73-T75 PolarHBondContact O-N 3.28Å; G73-D76 WeakPolarHBondContact O-CA 3.5Å; G73-D76 WeakPolarHBondContact O-CB 3.37Å; G73-D76 PolarHBondContact O-N 3.46Å; G73-E77 PolarHBondContact O-N 3.44Å
74	E	57.2	Low	63.1	Low	167 Å²	167	111 Å²	111	78%	0.78	57%	0.574	S	S	*	*	H	α-helix	trans	-50.3	-30.1	-179.3	-71	-174.4	159.8	0	0	114.5	D76 E77 K78	E74-D76 VanDerWaalsContact C-N 3.32Å; E74-E77 PolarHBondContact O-N 3.3Å; E74-K78 PolarHBondContact O-N 3.4Å
75	T	58.9	Low	62.8	Low	115 Å²	115	109.9 Å²	109.9	71%	0.706	57%	0.566	S	S	*	*	H	α-helix	trans	-66.4	-34.8	175.3	46.6	0	0	0	0	112.6	G73 L79	G73-T75 PolarHBondContact O-N 3.28Å; T75-L79 PolarHBondContact O-N 3.35Å
76	D	62.1	Low	63	Low	65 Å²	65	105.7 Å²	105.7	35%	0.348	56%	0.556	S	S	.	*	H	α-helix	trans	-76	-32.1	177.1	-74.8	-35.1	0	0	0	111.8	T72 G73 E74 K78 L79 H80	T72-D76 VanDerWaalsContact CB-OD2 3.31Å; T72-D76 WeakPolarHBondContact CB-OD2 2.98Å; T72-D76 HydrophobicContact CG2-CB 4.48Å; G73-D76 WeakPolarHBondContact O-CA 3.5Å; G73-D76 WeakPolarHBondContact O-CB 3.37Å; G73-D76 PolarHBondContact O-N 3.46Å; E74-D76 VanDerWaalsContact C-N 3.32Å; D76-K78 PolarHBondContact O-N 2.86Å; D76-L79 CarbonylContact O-C 3.59Å; D76-L79 WeakPolarHBondContact O-CB 3.47Å; D76-L79 PolarHBondContact O-N 3.44Å; D76-L79 VanDerWaalsContact O-N 3.15Å; D76-H80 VanDerWaalsContact O-CB 3.3Å; D76-H80 WeakPolarHBondContact O-CB 3.48Å; D76-H80 PolarHBondContact O-N 3.39Å
77	E	64.3	Low	63.4	Low	120 Å²	120	107.1 Å²	107.1	56%	0.561	56%	0.561	S	S	*	*	H	α-helix	trans	-61.1	-45.8	174.8	-167.6	-172.4	176.5	0	0	111.3	G73 E74 L79 H80 I81	G73-E77 PolarHBondContact O-N 3.44Å; E74-E77 PolarHBondContact O-N 3.3Å; E77-L79 VanDerWaalsContact C-N 3.28Å; E77-L79 PolarHBondContact O-N 3.3Å; E77-H80 WeakPolarHBondContact O-CB 2.99Å; E77-H80 PolarHBondContact O-N 3.11Å; E77-I81 HydrophobicContact CG-CD1 4.27Å; E77-I81 WeakPolarHBondContact O-CG1 3.38Å; E77-I81 PolarHBondContact O-N 3.26Å
78	K	67.7	Low	64.4	Low	155 Å²	155	102.4 Å²	102.4	67%	0.674	53%	0.531	S	S	*	.	H	α-helix	trans	-61.7	-36.9	175.1	-75.4	179.6	-177.7	166.6	0	112.3	E74 D76 K82	E74-K78 PolarHBondContact O-N 3.4Å; D76-K78 PolarHBondContact O-N 2.86Å; K78-K82 WeakPolarHBondContact O-CG 3.48Å; K78-K82 PolarHBondContact O-N 3.39Å
79	L	70.7	Confident	65.3	Low	94 Å²	94	101.1 Å²	101.1	49%	0.492	52%	0.518	S	S	.	.	H	α-helix	trans	-68.3	-42.2	176	-177.3	61.9	0	0	0	110.8	T75 D76 E77 K82 M83	T75-L79 PolarHBondContact O-N 3.35Å; D76-L79 CarbonylContact O-C 3.59Å; D76-L79 WeakPolarHBondContact O-CB 3.47Å; D76-L79 PolarHBondContact O-N 3.44Å; D76-L79 VanDerWaalsContact O-N 3.15Å; E77-L79 VanDerWaalsContact C-N 3.28Å; E77-L79 PolarHBondContact O-N 3.3Å; L79-K82 WeakPolarHBondContact O-CB 3.4Å; L79-K82 PolarHBondContact O-N 3.15Å; L79-M83 HydrophobicContact CG-SD 4.36Å; L79-M83 WeakPolarHBondContact O-CG 3.44Å; L79-M83 PolarHBondContact O-N 3.48Å
80	H	68.5	Low	66.3	Low	55 Å²	55	104.6 Å²	104.6	26%	0.255	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-46.7	178.8	-175.9	72	0	0	0	111.9	E66 D76 E77 K82 M83 I84	E66-H80 IonicContact OE2-CE1 3.55Å; D76-H80 VanDerWaalsContact O-CB 3.3Å; D76-H80 WeakPolarHBondContact O-CB 3.48Å; D76-H80 PolarHBondContact O-N 3.39Å; E77-H80 WeakPolarHBondContact O-CB 2.99Å; E77-H80 PolarHBondContact O-N 3.11Å; H80-K82 VanDerWaalsContact C-N 3.29Å; H80-K82 PolarHBondContact O-N 3.42Å; H80-M83 WeakPolarHBondContact O-CB 3.38Å; H80-M83 PolarHBondContact O-N 3.47Å; H80-I84 VanDerWaalsContact NE2-CD1 3.29Å; H80-I84 WeakPolarHBondContact NE2-CD1 3.4Å; H80-I84 WeakPolarHBondContact O-CG1 3.39Å; H80-I84 PolarHBondContact O-N 2.9Å
81	I	68.5	Low	67.1	Low	98 Å²	98	99.1 Å²	99.1	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-58.3	-42.8	174.3	-66.2	168.6	0	0	0	110.7	E77 M83 I84 Y85	E77-I81 HydrophobicContact CG-CD1 4.27Å; E77-I81 WeakPolarHBondContact O-CG1 3.38Å; E77-I81 PolarHBondContact O-N 3.26Å; I81-M83 VanDerWaalsContact C-N 3.35Å; I81-M83 PolarHBondContact O-N 3.42Å; I81-I84 PolarHBondContact O-N 2.82Å; I81-Y85 WeakPolarHBondContact O-CB 3.49Å; I81-Y85 PolarHBondContact O-N 2.93Å
82	K	70.2	Confident	67.9	Low	155 Å²	155	93.7 Å²	93.7	67%	0.674	47%	0.473	S	S	*	.	H	α-helix	trans	-63.7	-39.8	175.6	-77	178	179	-178.6	0	112.1	K78 L79 H80 Y85 G86	K78-K82 WeakPolarHBondContact O-CG 3.48Å; K78-K82 PolarHBondContact O-N 3.39Å; L79-K82 WeakPolarHBondContact O-CB 3.4Å; L79-K82 PolarHBondContact O-N 3.15Å; H80-K82 VanDerWaalsContact C-N 3.29Å; H80-K82 PolarHBondContact O-N 3.42Å; K82-Y85 PolarHBondContact O-N 2.67Å; K82-G86 PolarHBondContact O-N 2.86Å
83	M	73.4	Confident	69.2	Low	106 Å²	106	94.5 Å²	94.5	52%	0.522	48%	0.477	S	S	.	.	H	α-helix	trans	-65.5	-43.7	176.5	-73.7	-179.9	66.4	0	0	111.5	L79 H80 I81 G86 K87	L79-M83 HydrophobicContact CG-SD 4.36Å; L79-M83 WeakPolarHBondContact O-CG 3.44Å; L79-M83 PolarHBondContact O-N 3.48Å; H80-M83 WeakPolarHBondContact O-CB 3.38Å; H80-M83 PolarHBondContact O-N 3.47Å; I81-M83 VanDerWaalsContact C-N 3.35Å; I81-M83 PolarHBondContact O-N 3.42Å; M83-G86 PolarHBondContact O-N 3.38Å; M83-K87 WeakPolarHBondContact O-CG 3.45Å; M83-K87 PolarHBondContact O-N 3.35Å
84	I	72.4	Confident	70.2	Confident	40 Å²	40	94.9 Å²	94.9	21%	0.205	47%	0.472	C	S	.	.	H	α-helix	trans	-59.6	-50.1	174.3	-69.6	172	0	0	0	110.1	F59 H80 I81 G86 K87 L88	F59-I84 HydrophobicContact CD1-CG2 4.48Å; F59-I84 HydrophobicContact CE1-CG2 3.68Å; H80-I84 VanDerWaalsContact NE2-CD1 3.29Å; H80-I84 WeakPolarHBondContact NE2-CD1 3.4Å; H80-I84 WeakPolarHBondContact O-CG1 3.39Å; H80-I84 PolarHBondContact O-N 2.9Å; I81-I84 PolarHBondContact O-N 2.82Å; I84-G86 VanDerWaalsContact C-N 3.27Å; I84-G86 PolarHBondContact O-N 2.02Å; I84-K87 WeakPolarHBondContact O-CB 3.38Å; I84-K87 PolarHBondContact O-N 2.85Å; I84-K87 VanDerWaalsContact O-N 3.11Å; I84-L88 HydrophobicContact CG2-CD1 4.39Å; I84-L88 WeakPolarHBondContact O-CG 3.35Å; I84-L88 PolarHBondContact O-N 3.17Å
85	Y	70	Confident	71	Confident	148 Å²	148	87.5 Å²	87.5	58%	0.58	44%	0.437	S	S	*	.	H	α-helix	trans	-58.3	-41	176.6	-179.2	-97.3	0	0	0	112	I81 K82 L88 L89	I81-Y85 WeakPolarHBondContact O-CB 3.49Å; I81-Y85 PolarHBondContact O-N 2.93Å; K82-Y85 PolarHBondContact O-N 2.67Å; Y85-L88 WeakPolarHBondContact O-CB 3.37Å; Y85-L88 PolarHBondContact O-N 3.3Å; Y85-L89 WeakPolarHBondContact O-CB 3.5Å; Y85-L89 PolarHBondContact O-N 3.22Å
86	G	74.4	Confident	71.9	Confident	35 Å²	35	84.3 Å²	84.3	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-60.6	-43.9	174.1	0	0	0	0	0	112.9	K82 M83 I84 L89 Y90	K82-G86 PolarHBondContact O-N 2.86Å; M83-G86 PolarHBondContact O-N 3.38Å; I84-G86 VanDerWaalsContact C-N 3.27Å; I84-G86 PolarHBondContact O-N 2.02Å; G86-L89 PolarHBondContact O-N 3.49Å; G86-Y90 VanDerWaalsContact O-CB 3.32Å; G86-Y90 WeakPolarHBondContact O-CB 3.12Å; G86-Y90 PolarHBondContact O-N 2.97Å
87	K	72.6	Confident	72.9	Confident	86 Å²	86	92.6 Å²	92.6	37%	0.374	45%	0.445	S	S	.	.	H	α-helix	trans	-61.8	-43.1	174.9	-71.9	178.5	-176.5	-177.7	0	111.5	L62 E66 M83 I84 Y90 A91	L62-K87 HydrophobicContact CD2-CD 4.2Å; E66-K87 IonicContact OE1-NZ 2.63Å; E66-K87 PolarHBondContact OE1-NZ 2.76Å; M83-K87 WeakPolarHBondContact O-CG 3.45Å; M83-K87 PolarHBondContact O-N 3.35Å; I84-K87 WeakPolarHBondContact O-CB 3.38Å; I84-K87 PolarHBondContact O-N 2.85Å; I84-K87 VanDerWaalsContact O-N 3.11Å; K87-Y90 PolarHBondContact O-N 2.65Å; K87-A91 WeakPolarHBondContact O-CB 3.42Å; K87-A91 PolarHBondContact O-N 2.94Å
88	L	74.6	Confident	73.7	Confident	24 Å²	24	91.1 Å²	91.1	13%	0.126	45%	0.448	C	S	.	.	H	α-helix	trans	-59.8	-51.5	174.8	-66.8	175.3	0	0	0	110.9	L55 L58 F59 I84 Y85 Y90 A91 F92	L55-L88 HydrophobicContact CD2-CD1 4.4Å; L55-L88 HydrophobicContact CD2-CD2 3.75Å; L58-L88 HydrophobicContact CD2-CD2 3.32Å; L58-L88 HydrophobicContact CG-CD2 4.07Å; F59-L88 HydrophobicContact CE1-CD1 3.92Å; F59-L88 HydrophobicContact CE1-CD2 3.91Å; F59-L88 HydrophobicContact CE1-CG 4.24Å; F59-L88 HydrophobicContact CZ-CD1 3.74Å; F59-L88 HydrophobicContact CZ-CD2 4.18Å; F59-L88 HydrophobicContact CZ-CG 4.48Å; I84-L88 HydrophobicContact CG2-CD1 4.39Å; I84-L88 WeakPolarHBondContact O-CG 3.35Å; I84-L88 PolarHBondContact O-N 3.17Å; Y85-L88 WeakPolarHBondContact O-CB 3.37Å; Y85-L88 PolarHBondContact O-N 3.3Å; L88-Y90 VanDerWaalsContact C-N 3.29Å; L88-Y90 PolarHBondContact O-N 3.33Å; L88-A91 WeakPolarHBondContact O-CB 3.42Å; L88-A91 PolarHBondContact O-N 2.86Å; L88-A91 VanDerWaalsContact O-N 3.12Å; L88-F92 VanDerWaalsContact O-CD2 3.3Å; L88-F92 WeakPolarHBondContact O-CD2 3.3Å; L88-F92 PolarHBondContact O-N 3.33Å; L88-F92 VanDerWaalsContact O-N 3.1Å
89	L	73.6	Confident	74.5	Confident	90 Å²	90	85.6 Å²	85.6	47%	0.471	43%	0.429	S	S	.	.	H	α-helix	trans	-60.4	-42.5	-179.1	-171.2	68.5	0	0	0	111	Y85 G86 A91 F92 T93	Y85-L89 WeakPolarHBondContact O-CB 3.5Å; Y85-L89 PolarHBondContact O-N 3.22Å; G86-L89 PolarHBondContact O-N 3.49Å; L89-A91 VanDerWaalsContact C-N 3.32Å; L89-A91 PolarHBondContact O-N 3.32Å; L89-F92 PolarHBondContact O-N 3.49Å; L89-T93 VanDerWaalsContact O-CB 3.28Å; L89-T93 WeakPolarHBondContact O-CB 3.46Å; L89-T93 PolarHBondContact O-N 2.92Å; L89-T93 PolarHBondContact O-OG1 3.08Å
90	Y	75.6	Confident	75.2	Confident	188 Å²	188	88.2 Å²	88.2	74%	0.737	43%	0.433	S	S	*	.	H	α-helix	trans	-65.3	-32.4	177.4	-171.9	-96.9	0	0	0	112.9	G86 K87 L88 P94	G86-Y90 VanDerWaalsContact O-CB 3.32Å; G86-Y90 WeakPolarHBondContact O-CB 3.12Å; G86-Y90 PolarHBondContact O-N 2.97Å; K87-Y90 PolarHBondContact O-N 2.65Å; L88-Y90 VanDerWaalsContact C-N 3.29Å; L88-Y90 PolarHBondContact O-N 3.33Å; Y90-P94 WeakPolarHBondContact O-CD 3.3Å; Y90-P94 VanDerWaalsContact O-CG 3.25Å; Y90-P94 WeakPolarHBondContact O-CG 3.34Å
91	A	70.1	Confident	76	Confident	40 Å²	40	93.6 Å²	93.6	33%	0.331	45%	0.452	S	S	.	.	H	α-helix	trans	-69.3	-41.8	174.8	0	0	0	0	0	112.2	K87 L88 L89	K87-A91 WeakPolarHBondContact O-CB 3.42Å; K87-A91 PolarHBondContact O-N 2.94Å; L88-A91 WeakPolarHBondContact O-CB 3.42Å; L88-A91 PolarHBondContact O-N 2.86Å; L88-A91 VanDerWaalsContact O-N 3.12Å; L89-A91 VanDerWaalsContact C-N 3.32Å; L89-A91 PolarHBondContact O-N 3.32Å
92	F	72	Confident	76.6	Confident	63 Å²	63	92.2 Å²	92.2	28%	0.276	45%	0.448	S	S	.	.	H	α-helix	trans	-83.4	-35	-175.4	-79.4	-74.7	0	0	0	114.5	F54 L55 L88 L89 M95	F54-F92 AromaticContact CD1-CE1 3.92Å; F54-F92 HydrophobicContact CD1-CE1 3.92Å; F54-F92 AromaticContact CD1-CE2 3.96Å; F54-F92 HydrophobicContact CD1-CE2 3.96Å; F54-F92 AromaticContact CD1-CZ 3.21Å; F54-F92 HydrophobicContact CD1-CZ 3.21Å; F54-F92 AromaticContact CE1-CE1 3.66Å; F54-F92 HydrophobicContact CE1-CE1 3.66Å; F54-F92 AromaticContact CE1-CE2 3.58Å; F54-F92 HydrophobicContact CE1-CE2 3.58Å; F54-F92 AromaticContact CE1-CZ 3.1Å; F54-F92 HydrophobicContact CE1-CZ 3.1Å; F54-F92 HydrophobicContact CG-CZ 4.23Å; F54-F92 HydrophobicContact CZ-CE1 4.22Å; F54-F92 HydrophobicContact CZ-CZ 4.08Å; L55-F92 HydrophobicContact CD2-CE2 4Å; L55-F92 HydrophobicContact CD2-CZ 4.42Å; L88-F92 VanDerWaalsContact O-CD2 3.3Å; L88-F92 WeakPolarHBondContact O-CD2 3.3Å; L88-F92 PolarHBondContact O-N 3.33Å; L88-F92 VanDerWaalsContact O-N 3.1Å; L89-F92 PolarHBondContact O-N 3.49Å; F92-M95 HydrophobicContact CD1-SD 4.16Å; F92-M95 WeakPolarHBondContact O-CB 3.41Å; F92-M95 PolarHBondContact O-N 2.86Å
93	T	79.5	Confident	77.2	Confident	95 Å²	95	88.2 Å²	88.2	58%	0.583	43%	0.429	S	S	*	.	S	Bend	trans	-60.9	-47.2	-173	-57.2	0	0	0	0	114	L89 M95 P96	L89-T93 VanDerWaalsContact O-CB 3.28Å; L89-T93 WeakPolarHBondContact O-CB 3.46Å; L89-T93 PolarHBondContact O-N 2.92Å; L89-T93 PolarHBondContact O-OG1 3.08Å; T93-M95 VanDerWaalsContact C-N 3.31Å; T93-P96 WeakPolarHBondContact O-CD 3.38Å
94	P	77.6	Confident	77.9	Confident	53 Å²	53	85.1 Å²	85.1	34%	0.344	42%	0.415	S	S	.	.	S	Bend	trans	-80.7	-14.4	179	33.2	-34.2	0	0	0	112.5	Y90 R97 S98	Y90-P94 WeakPolarHBondContact O-CD 3.3Å; Y90-P94 VanDerWaalsContact O-CG 3.25Å; Y90-P94 WeakPolarHBondContact O-CG 3.34Å; P94-R97 CarbonylContact O-C 3.55Å; P94-R97 WeakPolarHBondContact O-CA 3.49Å; P94-R97 WeakPolarHBondContact O-CB 3.5Å; P94-R97 PolarHBondContact O-N 3.06Å; P94-S98 PolarHBondContact O-N 2.93Å; P94-S98 PolarHBondContact O-OG 3.37Å; P94-S98 VanDerWaalsContact O-OG 3.11Å
95	M	74.8	Confident	78.5	Confident	13 Å²	13	86.3 Å²	86.3	6%	0.064	42%	0.42	C	S	.	.	H	α-helix	trans	-51.4	-40.6	-171	-159	179.1	-176.4	0	0	115.2	F92 T93 R97 S99 V102 I106	F92-M95 HydrophobicContact CD1-SD 4.16Å; F92-M95 WeakPolarHBondContact O-CB 3.41Å; F92-M95 PolarHBondContact O-N 2.86Å; T93-M95 VanDerWaalsContact C-N 3.31Å; M95-R97 PolarHBondContact O-N 3.48Å; M95-S99 VanDerWaalsContact CG-OG 3.24Å; M95-S99 WeakPolarHBondContact CG-OG 3.46Å; M95-S99 CarbonylContact O-C 3.58Å; M95-S99 PolarHBondContact O-N 2.95Å; M95-S99 PolarHBondContact O-OG 3.45Å; M95-V102 HydrophobicContact CE-CB 3.79Å; M95-V102 HydrophobicContact CE-CG1 3.29Å; M95-I106 HydrophobicContact CE-CD1 3.34Å; M95-I106 HydrophobicContact SD-CD1 3.94Å
96	P	78.4	Confident	79.1	Confident	47 Å²	47	80.4 Å²	80.4	31%	0.305	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-27.5	175.6	-19.3	30.1	0	0	0	113.4	T93 Y103	T93-P96 WeakPolarHBondContact O-CD 3.38Å; P96-Y103 HydrophobicContact CB-CD1 4.15Å; P96-Y103 HydrophobicContact CB-CD2 4.23Å; P96-Y103 HydrophobicContact CB-CE1 4.28Å; P96-Y103 HydrophobicContact CB-CE2 4.34Å; P96-Y103 HydrophobicContact CB-CG 4.12Å; P96-Y103 HydrophobicContact CG-CD1 4.48Å; P96-Y103 HydrophobicContact CG-CD2 3.73Å; P96-Y103 HydrophobicContact CG-CE1 4.43Å; P96-Y103 HydrophobicContact CG-CE2 3.66Å; P96-Y103 HydrophobicContact CG-CG 4.14Å
97	R	81.8	Confident	79.8	Confident	239 Å²	239	81.8 Å²	81.8	90%	0.902	40%	0.396	S	S	*	.	H	α-helix	trans	-96.2	-44.7	-178.7	-66	-176.5	177.2	176.7	-0.6	112.5	P94 M95	P94-R97 CarbonylContact O-C 3.55Å; P94-R97 WeakPolarHBondContact O-CA 3.49Å; P94-R97 WeakPolarHBondContact O-CB 3.5Å; P94-R97 PolarHBondContact O-N 3.06Å; M95-R97 PolarHBondContact O-N 3.48Å
98	S	82.3	Confident	80.6	Confident	89 Å²	89	85.1 Å²	85.1	62%	0.622	41%	0.406	S	S	*	.	H	α-helix	trans	-78.9	-32.8	-175.4	57.4	0	0	0	0	113	P94	P94-S98 PolarHBondContact O-N 2.93Å; P94-S98 PolarHBondContact O-OG 3.37Å; P94-S98 VanDerWaalsContact O-OG 3.11Å
99	S	83.3	Confident	81.3	Confident	39 Å²	39	86.7 Å²	86.7	27%	0.273	42%	0.419	S	S	.	.			trans	-142.8	58.3	-175.3	63.6	0	0	0	0	110.7	M95 Y101 V102 Y103	M95-S99 VanDerWaalsContact CG-OG 3.24Å; M95-S99 WeakPolarHBondContact CG-OG 3.46Å; M95-S99 CarbonylContact O-C 3.58Å; M95-S99 PolarHBondContact O-N 2.95Å; M95-S99 PolarHBondContact O-OG 3.45Å; S99-Y101 PolarHBondContact O-N 3.27Å; S99-Y101 VanDerWaalsContact O-N 3.15Å; S99-V102 PolarHBondContact O-N 3.43Å; S99-Y103 PolarHBondContact O-N 2.77Å
100	Y	85.5	Confident	82	Confident	149 Å²	149	83.3 Å²	83.3	58%	0.584	40%	0.401	S	S	*	.	H	α-helix	trans	-50	-41.5	-175.6	177.4	-107.6	0	0	0	113.6	Y103 N104	Y100-Y103 PolarHBondContact O-N 2.9Å; Y100-N104 WeakPolarHBondContact CE1-ND2 3.43Å; Y100-N104 WeakPolarHBondContact O-CB 3.34Å; Y100-N104 PolarHBondContact O-N 3.17Å; Y100-N104 PolarHBondContact OH-ND2 2.89Å
101	Y	85.9	Confident	82.8	Confident	169 Å²	169	79.1 Å²	79.1	66%	0.663	39%	0.392	S	S	*	.	H	α-helix	trans	-59.7	-48.6	177.6	-179.1	-97.3	0	0	0	112.1	S99 Y103 N104 E105	S99-Y101 PolarHBondContact O-N 3.27Å; S99-Y101 VanDerWaalsContact O-N 3.15Å; Y101-Y103 PolarHBondContact O-N 3.19Å; Y101-N104 PolarHBondContact O-N 3.47Å; Y101-E105 HydrophobicContact CD1-CG 4.42Å; Y101-E105 HydrophobicContact CE1-CG 4Å; Y101-E105 WeakPolarHBondContact O-CG 3.45Å; Y101-E105 PolarHBondContact O-N 3.18Å
102	V	80.3	Confident	83.7	Confident	68 Å²	68	79.1 Å²	79.1	41%	0.412	40%	0.396	S	S	.	.	H	α-helix	trans	-65.4	-42.2	179.9	-170.1	0	0	0	0	110.7	M95 S99 N104 E105 I106	M95-V102 HydrophobicContact CE-CB 3.79Å; M95-V102 HydrophobicContact CE-CG1 3.29Å; S99-V102 PolarHBondContact O-N 3.43Å; V102-N104 VanDerWaalsContact C-N 3.33Å; V102-N104 PolarHBondContact O-N 3.18Å; V102-E105 PolarHBondContact O-N 3.44Å; V102-I106 HydrophobicContact CG1-CD1 4.44Å; V102-I106 WeakPolarHBondContact O-CG1 3.43Å; V102-I106 PolarHBondContact O-N 3.25Å
103	Y	84.2	Confident	84.6	Confident	71 Å²	71	78.3 Å²	78.3	28%	0.278	39%	0.391	S	S	.	.	H	α-helix	trans	-57.9	-46.1	175.2	174.5	-97	0	0	0	111.8	P96 S99 Y100 Y101 E105 I106 M107	P96-Y103 HydrophobicContact CB-CD1 4.15Å; P96-Y103 HydrophobicContact CB-CD2 4.23Å; P96-Y103 HydrophobicContact CB-CE1 4.28Å; P96-Y103 HydrophobicContact CB-CE2 4.34Å; P96-Y103 HydrophobicContact CB-CG 4.12Å; P96-Y103 HydrophobicContact CG-CD1 4.48Å; P96-Y103 HydrophobicContact CG-CD2 3.73Å; P96-Y103 HydrophobicContact CG-CE1 4.43Å; P96-Y103 HydrophobicContact CG-CE2 3.66Å; P96-Y103 HydrophobicContact CG-CG 4.14Å; S99-Y103 PolarHBondContact O-N 2.77Å; Y100-Y103 PolarHBondContact O-N 2.9Å; Y101-Y103 PolarHBondContact O-N 3.19Å; Y103-E105 PolarHBondContact O-N 3.36Å; Y103-I106 PolarHBondContact O-N 2.8Å; Y103-M107 HydrophobicContact CD1-CG 4.24Å; Y103-M107 HydrophobicContact CD2-CE 4.28Å; Y103-M107 HydrophobicContact CE1-CG 3.74Å; Y103-M107 HydrophobicContact CE2-CE 3.46Å; Y103-M107 VanDerWaalsContact CE2-CE 3.46Å; Y103-M107 HydrophobicContact CE2-CG 4.1Å; Y103-M107 WeakPolarHBondContact O-CG 3.35Å; Y103-M107 PolarHBondContact O-N 3.33Å
104	N	87.1	Confident	84.9	Confident	41 Å²	41	77.3 Å²	77.3	22%	0.219	38%	0.382	C	S	.	.	H	α-helix	trans	-64.5	-39.1	178.2	-86.8	-3.2	0	0	0	112.9	Y100 Y101 V102 I106 M107 R108	Y100-N104 WeakPolarHBondContact CE1-ND2 3.43Å; Y100-N104 WeakPolarHBondContact O-CB 3.34Å; Y100-N104 PolarHBondContact O-N 3.17Å; Y100-N104 PolarHBondContact OH-ND2 2.89Å; Y101-N104 PolarHBondContact O-N 3.47Å; V102-N104 VanDerWaalsContact C-N 3.33Å; V102-N104 PolarHBondContact O-N 3.18Å; N104-I106 VanDerWaalsContact C-N 3.34Å; N104-M107 PolarHBondContact O-N 3.18Å; N104-R108 WeakPolarHBondContact O-CB 3.31Å; N104-R108 VanDerWaalsContact O-CG 3.29Å; N104-R108 WeakPolarHBondContact O-CG 3.3Å; N104-R108 PolarHBondContact O-N 3.34Å
105	E	84.3	Confident	85.4	Confident	65 Å²	65	79.9 Å²	79.9	30%	0.304	39%	0.389	S	S	.	.	H	α-helix	trans	-64	-39.1	175.1	-74	-56.7	125.1	0	0	112	Y101 V102 Y103 R108 S109	Y101-E105 HydrophobicContact CD1-CG 4.42Å; Y101-E105 HydrophobicContact CE1-CG 4Å; Y101-E105 WeakPolarHBondContact O-CG 3.45Å; Y101-E105 PolarHBondContact O-N 3.18Å; V102-E105 PolarHBondContact O-N 3.44Å; Y103-E105 PolarHBondContact O-N 3.36Å; E105-R108 PolarHBondContact O-N 2.84Å; E105-R108 IonicContact OE1-CZ 3.71Å; E105-R108 IonicContact OE1-NH1 2.72Å; E105-R108 PolarHBondContact OE1-NH1 2.8Å; E105-S109 WeakPolarHBondContact O-CB 3.46Å; E105-S109 PolarHBondContact O-N 3.18Å; E105-S109 PolarHBondContact O-OG 3.38Å
106	I	84.4	Confident	85.9	Confident	24 Å²	24	81 Å²	81	12%	0.123	40%	0.398	C	S	.	.	H	α-helix	trans	-62.4	-47.4	172.4	-69.4	174.9	0	0	0	110.5	F54 M95 V102 Y103 N104 R108 S109 I110	F54-I106 HydrophobicContact CD2-CD1 4.02Å; F54-I106 HydrophobicContact CE2-CD1 4.08Å; M95-I106 HydrophobicContact CE-CD1 3.34Å; M95-I106 HydrophobicContact SD-CD1 3.94Å; V102-I106 HydrophobicContact CG1-CD1 4.44Å; V102-I106 WeakPolarHBondContact O-CG1 3.43Å; V102-I106 PolarHBondContact O-N 3.25Å; Y103-I106 PolarHBondContact O-N 2.8Å; N104-I106 VanDerWaalsContact C-N 3.34Å; I106-R108 VanDerWaalsContact C-N 3.35Å; I106-R108 PolarHBondContact O-N 3.43Å; I106-S109 WeakPolarHBondContact O-CB 3.42Å; I106-S109 PolarHBondContact O-N 2.84Å; I106-I110 HydrophobicContact CG2-CD1 3.65Å; I106-I110 HydrophobicContact CG2-CG1 4.35Å; I106-I110 VanDerWaalsContact O-CG1 3.3Å; I106-I110 WeakPolarHBondContact O-CG1 3.43Å; I106-I110 PolarHBondContact O-N 3.46Å
107	M	88.3	Confident	86	Confident	64 Å²	64	79.6 Å²	79.6	32%	0.315	39%	0.388	S	S	.	.	H	α-helix	trans	-63.8	-39	179.8	-71.2	-61.6	147.5	0	0	112.5	Y103 N104 I110 N111	Y103-M107 HydrophobicContact CD1-CG 4.24Å; Y103-M107 HydrophobicContact CD2-CE 4.28Å; Y103-M107 HydrophobicContact CE1-CG 3.74Å; Y103-M107 HydrophobicContact CE2-CE 3.46Å; Y103-M107 VanDerWaalsContact CE2-CE 3.46Å; Y103-M107 HydrophobicContact CE2-CG 4.1Å; Y103-M107 WeakPolarHBondContact O-CG 3.35Å; Y103-M107 PolarHBondContact O-N 3.33Å; N104-M107 PolarHBondContact O-N 3.18Å; M107-I110 HydrophobicContact CE-CD1 4.15Å; M107-I110 PolarHBondContact O-N 3.26Å; M107-I110 HydrophobicContact SD-CD1 4.19Å; M107-N111 WeakPolarHBondContact O-CB 3.44Å; M107-N111 PolarHBondContact O-N 2.96Å; M107-N111 PolarHBondContact O-ND2 2.77Å
108	R	89.3	Confident	86	Confident	156 Å²	156	71.4 Å²	71.4	59%	0.589	37%	0.367	S	S	*	.	H	α-helix	trans	-61.1	-45.2	172.4	-76.6	173.2	179	174.7	-4.2	111.6	N104 E105 I106 N111 G112	N104-R108 WeakPolarHBondContact O-CB 3.31Å; N104-R108 VanDerWaalsContact O-CG 3.29Å; N104-R108 WeakPolarHBondContact O-CG 3.3Å; N104-R108 PolarHBondContact O-N 3.34Å; E105-R108 PolarHBondContact O-N 2.84Å; E105-R108 IonicContact OE1-CZ 3.71Å; E105-R108 IonicContact OE1-NH1 2.72Å; E105-R108 PolarHBondContact OE1-NH1 2.8Å; I106-R108 VanDerWaalsContact C-N 3.35Å; I106-R108 PolarHBondContact O-N 3.43Å; R108-N111 PolarHBondContact O-N 2.84Å; R108-G112 PolarHBondContact O-N 3.15Å
109	S	88.4	Confident	85.9	Confident	58 Å²	58	73.4 Å²	73.4	41%	0.406	36%	0.364	S	S	.	.	H	α-helix	trans	-61.6	-45.7	178.2	-58.2	0	0	0	0	111.3	E105 I106 N111 G112 W113	E105-S109 WeakPolarHBondContact O-CB 3.46Å; E105-S109 PolarHBondContact O-N 3.18Å; E105-S109 PolarHBondContact O-OG 3.38Å; I106-S109 WeakPolarHBondContact O-CB 3.42Å; I106-S109 PolarHBondContact O-N 2.84Å; S109-N111 PolarHBondContact O-N 3.46Å; S109-G112 PolarHBondContact O-N 3.29Å; S109-W113 WeakPolarHBondContact O-CB 3.39Å; S109-W113 PolarHBondContact O-N 2.88Å
110	I	89.8	Confident	85.5	Confident	19 Å²	19	73.9 Å²	73.9	10%	0.097	36%	0.362	C	S	.	.	H	α-helix	trans	-60.5	-46.5	176.7	-68.9	164.5	0	0	0	110.5	P50 I51 I106 M107 W113 N114	P50-I110 HydrophobicContact CB-CG1 4.3Å; I51-I110 HydrophobicContact CD1-CD1 3.81Å; I51-I110 HydrophobicContact CD1-CG1 4.4Å; I51-I110 HydrophobicContact CG1-CD1 3.72Å; I51-I110 HydrophobicContact CG1-CG1 4.05Å; I106-I110 HydrophobicContact CG2-CD1 3.65Å; I106-I110 HydrophobicContact CG2-CG1 4.35Å; I106-I110 VanDerWaalsContact O-CG1 3.3Å; I106-I110 WeakPolarHBondContact O-CG1 3.43Å; I106-I110 PolarHBondContact O-N 3.46Å; M107-I110 HydrophobicContact CE-CD1 4.15Å; M107-I110 PolarHBondContact O-N 3.26Å; M107-I110 HydrophobicContact SD-CD1 4.19Å; I110-W113 PolarHBondContact O-N 3Å; I110-N114 WeakPolarHBondContact CG2-ND2 3.45Å; I110-N114 WeakPolarHBondContact O-CB 3.35Å; I110-N114 VanDerWaalsContact O-CG 3.3Å; I110-N114 PolarHBondContact O-N 2.8Å; I110-N114 PolarHBondContact O-ND2 3.06Å
111	N	91.2	Very high	84.5	Confident	100 Å²	100	71 Å²	71	54%	0.535	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-42.4	179.5	-71.6	-22.3	0	0	0	111.9	M107 R108 S109 W113 N114 E115	M107-N111 WeakPolarHBondContact O-CB 3.44Å; M107-N111 PolarHBondContact O-N 2.96Å; M107-N111 PolarHBondContact O-ND2 2.77Å; R108-N111 PolarHBondContact O-N 2.84Å; S109-N111 PolarHBondContact O-N 3.46Å; N111-W113 VanDerWaalsContact C-N 3.35Å; N111-W113 PolarHBondContact O-N 3.36Å; N111-N114 PolarHBondContact O-N 3.23Å; N111-E115 WeakPolarHBondContact O-CB 3.45Å; N111-E115 PolarHBondContact O-N 3.47Å
112	G	89.9	Confident	83.5	Confident	40 Å²	40	71.4 Å²	71.4	41%	0.412	36%	0.362	S	S	.	.	H	α-helix	trans	-62.3	-41.4	175.6	0	0	0	0	0	112.5	R108 S109 E115 C116	R108-G112 PolarHBondContact O-N 3.15Å; S109-G112 PolarHBondContact O-N 3.29Å; G112-E115 PolarHBondContact O-N 2.86Å; G112-C116 WeakPolarHBondContact O-CB 3.4Å; G112-C116 PolarHBondContact O-N 3.33Å
113	W	89.5	Confident	82.5	Confident	45 Å²	45	70.4 Å²	70.4	17%	0.17	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-45.3	174.7	-172.3	96.6	0	0	0	111.9	C46 G47 H49 P50 S109 I110 N111 E115 C116 M117	C46-W113 VanDerWaalsContact O-CD1 3.3Å; G47-W113 PolarHBondContact O-NE1 3.2Å; H49-W113 HydrophobicContact CB-CZ2 4.24Å; H49-W113 AromaticContact CD2-CD2 3.61Å; H49-W113 AromaticContact CD2-CE2 3.95Å; H49-W113 AromaticContact CD2-CE3 3.38Å; H49-W113 AromaticContact CD2-CH2 3.82Å; H49-W113 AromaticContact CD2-CZ3 3.5Å; H49-W113 VanDerWaalsContact CD2-CZ3 3.5Å; H49-W113 WeakPolarHBondContact CD2-CZ3 3.29Å; H49-W113 AromaticContact NE2-CE3 3.99Å; P50-W113 HydrophobicContact CG-CB 4.05Å; S109-W113 WeakPolarHBondContact O-CB 3.39Å; S109-W113 PolarHBondContact O-N 2.88Å; I110-W113 PolarHBondContact O-N 3Å; N111-W113 VanDerWaalsContact C-N 3.35Å; N111-W113 PolarHBondContact O-N 3.36Å; W113-E115 VanDerWaalsContact C-N 3.33Å; W113-E115 PolarHBondContact O-N 3.33Å; W113-C116 WeakPolarHBondContact O-CB 3.41Å; W113-C116 PolarHBondContact O-N 2.86Å; W113-M117 HydrophobicContact CD2-CG 3.68Å; W113-M117 HydrophobicContact CE3-CB 4.21Å; W113-M117 HydrophobicContact CE3-CG 3.58Å; W113-M117 HydrophobicContact CH2-CB 4.41Å; W113-M117 HydrophobicContact CH2-CE 3.5Å; W113-M117 VanDerWaalsContact CH2-CE 3.5Å; W113-M117 HydrophobicContact CH2-CG 3.52Å; W113-M117 HydrophobicContact CH2-SD 4.15Å; W113-M117 HydrophobicContact CZ2-CE 3.65Å; W113-M117 HydrophobicContact CZ2-CG 3.56Å; W113-M117 HydrophobicContact CZ2-SD 3.92Å; W113-M117 HydrophobicContact CZ3-CB 4.06Å; W113-M117 HydrophobicContact CZ3-CE 4.3Å; W113-M117 HydrophobicContact CZ3-CG 3.51Å; W113-M117 WeakPolarHBondContact O-CB 3.46Å; W113-M117 WeakPolarHBondContact O-CG 3.49Å; W113-M117 PolarHBondContact O-N 3.23Å
114	N	86.9	Confident	81.5	Confident	74 Å²	74	73 Å²	73	40%	0.396	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176.7	-78.1	-29.2	0	0	0	111.8	I110 N111 M117 S118	I110-N114 WeakPolarHBondContact CG2-ND2 3.45Å; I110-N114 WeakPolarHBondContact O-CB 3.35Å; I110-N114 VanDerWaalsContact O-CG 3.3Å; I110-N114 PolarHBondContact O-N 2.8Å; I110-N114 PolarHBondContact O-ND2 3.06Å; N111-N114 PolarHBondContact O-N 3.23Å; N114-M117 PolarHBondContact O-N 3.5Å; N114-S118 WeakPolarHBondContact O-CB 3.27Å; N114-S118 PolarHBondContact O-N 2.79Å
115	E	87.1	Confident	80.4	Confident	108 Å²	108	77.6 Å²	77.6	51%	0.505	39%	0.385	S	S	.	.	H	α-helix	trans	-61.9	-47.4	175.8	-172.3	-174.9	164.3	0	0	110.6	N111 G112 W113 M117 S118 K119	N111-E115 WeakPolarHBondContact O-CB 3.45Å; N111-E115 PolarHBondContact O-N 3.47Å; G112-E115 PolarHBondContact O-N 2.86Å; W113-E115 VanDerWaalsContact C-N 3.33Å; W113-E115 PolarHBondContact O-N 3.33Å; E115-M117 VanDerWaalsContact C-N 3.33Å; E115-M117 PolarHBondContact O-N 2.91Å; E115-S118 PolarHBondContact O-N 2.83Å; E115-S118 PolarHBondContact O-OG 3.4Å; E115-K119 WeakPolarHBondContact O-CG 3.45Å; E115-K119 PolarHBondContact O-N 3.32Å; E115-K119 WeakPolarHBondContact OE1-CE 3.4Å; E115-K119 IonicContact OE1-NZ 2.65Å; E115-K119 PolarHBondContact OE1-NZ 3.11Å
116	C	85.9	Confident	79.5	Confident	36 Å²	36	79.3 Å²	79.3	24%	0.243	39%	0.389	C	S	.	.	H	α-helix	trans	-57.4	-47.5	175.8	179	0	0	0	0	111.3	C46 G112 W113 S118 K119 Q120	C46-C116 WeakPolarHBondContact CA-SG 3.31Å; C46-C116 HydrophobicContact CB-CB 3.68Å; C46-C116 WeakPolarHBondContact CB-SG 3.33Å; C46-C116 WeakPolarHBondContact SG-CB 3.5Å; C46-C116 CovalentContact SG-SG 2.02Å; C46-C116 PolarHBondContact SG-SG 3.42Å; G112-C116 WeakPolarHBondContact O-CB 3.4Å; G112-C116 PolarHBondContact O-N 3.33Å; W113-C116 WeakPolarHBondContact O-CB 3.41Å; W113-C116 PolarHBondContact O-N 2.86Å; C116-S118 VanDerWaalsContact C-N 3.32Å; C116-S118 PolarHBondContact O-N 2.84Å; C116-K119 WeakPolarHBondContact O-CB 3.47Å; C116-K119 PolarHBondContact O-N 2.93Å; C116-K119 VanDerWaalsContact O-N 3.11Å; C116-Q120 WeakPolarHBondContact O-CG 3.32Å; C116-Q120 PolarHBondContact O-N 3.36Å
117	M	81.1	Confident	78.4	Confident	18 Å²	18	81.7 Å²	81.7	9%	0.089	40%	0.401	C	S	.	.	H	α-helix	trans	-65.5	-34	-179.7	-74.1	-67.5	-83.6	0	0	112.9	C46 W113 N114 E115 K119 Q120 L123	C46-M117 HydrophobicContact CB-CG 4.05Å; C46-M117 HydrophobicContact CB-SD 4.05Å; C46-M117 PolarHBondContact SG-N 3.1Å; C46-M117 VanDerWaalsContact SG-N 3.38Å; W113-M117 HydrophobicContact CD2-CG 3.68Å; W113-M117 HydrophobicContact CE3-CB 4.21Å; W113-M117 HydrophobicContact CE3-CG 3.58Å; W113-M117 HydrophobicContact CH2-CB 4.41Å; W113-M117 HydrophobicContact CH2-CE 3.5Å; W113-M117 VanDerWaalsContact CH2-CE 3.5Å; W113-M117 HydrophobicContact CH2-CG 3.52Å; W113-M117 HydrophobicContact CH2-SD 4.15Å; W113-M117 HydrophobicContact CZ2-CE 3.65Å; W113-M117 HydrophobicContact CZ2-CG 3.56Å; W113-M117 HydrophobicContact CZ2-SD 3.92Å; W113-M117 HydrophobicContact CZ3-CB 4.06Å; W113-M117 HydrophobicContact CZ3-CE 4.3Å; W113-M117 HydrophobicContact CZ3-CG 3.51Å; W113-M117 WeakPolarHBondContact O-CB 3.46Å; W113-M117 WeakPolarHBondContact O-CG 3.49Å; W113-M117 PolarHBondContact O-N 3.23Å; N114-M117 PolarHBondContact O-N 3.5Å; E115-M117 VanDerWaalsContact C-N 3.33Å; E115-M117 PolarHBondContact O-N 2.91Å; M117-K119 PolarHBondContact O-N 2.89Å; M117-Q120 WeakPolarHBondContact O-CB 3.3Å; M117-Q120 PolarHBondContact O-N 3.23Å; M117-Q120 VanDerWaalsContact O-N 3.15Å; M117-Q120 HydrophobicContact SD-CG 4.39Å; M117-L123 HydrophobicContact CB-CD2 4.37Å; M117-L123 HydrophobicContact CE-CD1 3.68Å; M117-L123 HydrophobicContact CE-CD2 3.41Å; M117-L123 VanDerWaalsContact CE-CD2 3.41Å; M117-L123 HydrophobicContact CE-CG 4.16Å; M117-L123 HydrophobicContact SD-CD2 4.31Å
118	S	81.4	Confident	77.4	Confident	66 Å²	66	86.2 Å²	86.2	46%	0.462	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-26.8	175.4	80.6	0	0	0	0	113.1	N114 E115 C116 K124	N114-S118 WeakPolarHBondContact O-CB 3.27Å; N114-S118 PolarHBondContact O-N 2.79Å; E115-S118 PolarHBondContact O-N 2.83Å; E115-S118 PolarHBondContact O-OG 3.4Å; C116-S118 VanDerWaalsContact C-N 3.32Å; C116-S118 PolarHBondContact O-N 2.84Å; S118-K124 WeakPolarHBondContact O-CE 3.45Å; S118-K124 PolarHBondContact O-NZ 3.32Å
119	K	80.7	Confident	76.1	Confident	132 Å²	132	82.5 Å²	82.5	57%	0.574	41%	0.405	S	S	*	.	H	α-helix	trans	-83.9	-11	178.3	-66.6	173.7	-173.6	171.8	0	112.6	E115 C116 M117 P121	E115-K119 WeakPolarHBondContact O-CG 3.45Å; E115-K119 PolarHBondContact O-N 3.32Å; E115-K119 WeakPolarHBondContact OE1-CE 3.4Å; E115-K119 IonicContact OE1-NZ 2.65Å; E115-K119 PolarHBondContact OE1-NZ 3.11Å; C116-K119 WeakPolarHBondContact O-CB 3.47Å; C116-K119 PolarHBondContact O-N 2.93Å; C116-K119 VanDerWaalsContact O-N 3.11Å; M117-K119 PolarHBondContact O-N 2.89Å; K119-P121 VanDerWaalsContact O-CD 3.22Å; K119-P121 WeakPolarHBondContact O-CD 3.39Å
120	Q	73.7	Confident	74.9	Confident	48 Å²	48	85.7 Å²	85.7	22%	0.224	41%	0.408	C	S	.	.			trans	-76.3	112.6	-177.6	-62.8	-54	-28.6	0	0	112.5	P45 C116 M117 R122 L123 K124	P45-Q120 HydrophobicContact CG-CG 3.68Å; P45-Q120 VanDerWaalsContact CG-OE1 3.28Å; C116-Q120 WeakPolarHBondContact O-CG 3.32Å; C116-Q120 PolarHBondContact O-N 3.36Å; M117-Q120 WeakPolarHBondContact O-CB 3.3Å; M117-Q120 PolarHBondContact O-N 3.23Å; M117-Q120 VanDerWaalsContact O-N 3.15Å; M117-Q120 HydrophobicContact SD-CG 4.39Å; Q120-R122 PolarHBondContact O-N 3.1Å; Q120-L123 HydrophobicContact CB-CB 3.91Å; Q120-L123 PolarHBondContact O-N 3.12Å; Q120-K124 PolarHBondContact O-N 3.36Å
121	P	64.8	Low	73.7	Confident	90 Å²	90	88.8 Å²	88.8	58%	0.584	43%	0.425	S	S	*	.	H	α-helix	trans	-68.7	-34.6	-176.5	24.9	-30.9	0	0	0	112.3	K119 K124 K125	K119-P121 VanDerWaalsContact O-CD 3.22Å; K119-P121 WeakPolarHBondContact O-CD 3.39Å; P121-K124 PolarHBondContact O-N 3.35Å; P121-K125 PolarHBondContact O-N 2.93Å
122	R	64.6	Low	72.4	Confident	177 Å²	177	88 Å²	88	67%	0.668	42%	0.417	S	S	*	.	H	α-helix	trans	-64.9	-40.4	177.2	-70.1	-174.2	177.4	168.9	-0.5	111.4	Q120 K124 K125 W126	Q120-R122 PolarHBondContact O-N 3.1Å; R122-K124 PolarHBondContact O-N 2.97Å; R122-K125 WeakPolarHBondContact O-CB 3.33Å; R122-K125 PolarHBondContact O-N 3.29Å; R122-K125 VanDerWaalsContact O-N 3.15Å; R122-W126 PolarHBondContact O-N 3.46Å
123	L	60.8	Low	70.9	Confident	46 Å²	46	90.4 Å²	90.4	24%	0.241	42%	0.42	C	S	.	.	H	α-helix	trans	-66.3	-38	178.6	-152.6	87.5	0	0	0	112	M117 Q120 K125 W126 L127	M117-L123 HydrophobicContact CB-CD2 4.37Å; M117-L123 HydrophobicContact CE-CD1 3.68Å; M117-L123 HydrophobicContact CE-CD2 3.41Å; M117-L123 VanDerWaalsContact CE-CD2 3.41Å; M117-L123 HydrophobicContact CE-CG 4.16Å; M117-L123 HydrophobicContact SD-CD2 4.31Å; Q120-L123 HydrophobicContact CB-CB 3.91Å; Q120-L123 PolarHBondContact O-N 3.12Å; L123-K125 VanDerWaalsContact C-N 3.26Å; L123-K125 PolarHBondContact O-N 3.28Å; L123-W126 PolarHBondContact O-N 3.4Å; L123-W126 VanDerWaalsContact O-N 3.17Å; L123-L127 HydrophobicContact CD2-CD1 3.77Å; L123-L127 HydrophobicContact CG-CD1 4.04Å; L123-L127 WeakPolarHBondContact O-CB 3.42Å; L123-L127 PolarHBondContact O-N 3.24Å
124	K	62.9	Low	69.5	Low	126 Å²	126	93 Å²	93	55%	0.548	43%	0.434	S	S	.	.	H	α-helix	trans	-58.1	-39	173	-75.1	-179	-179.4	169.6	0	112.1	S118 Q120 P121 R122 K128	S118-K124 WeakPolarHBondContact O-CE 3.45Å; S118-K124 PolarHBondContact O-NZ 3.32Å; Q120-K124 PolarHBondContact O-N 3.36Å; P121-K124 PolarHBondContact O-N 3.35Å; R122-K124 PolarHBondContact O-N 2.97Å; K124-K128 WeakPolarHBondContact O-CB 3.29Å; K124-K128 VanDerWaalsContact O-CG 3.29Å; K124-K128 WeakPolarHBondContact O-CG 3.34Å; K124-K128 PolarHBondContact O-N 2.78Å; K124-K128 VanDerWaalsContact O-N 3.15Å
125	K	64.2	Low	68.2	Low	137 Å²	137	94.2 Å²	94.2	60%	0.596	44%	0.44	S	S	*	.	H	α-helix	trans	-67	-45.9	174.2	-69.2	-174.9	178	-174.7	0	111.3	P121 R122 L123 K128 R129	P121-K125 PolarHBondContact O-N 2.93Å; R122-K125 WeakPolarHBondContact O-CB 3.33Å; R122-K125 PolarHBondContact O-N 3.29Å; R122-K125 VanDerWaalsContact O-N 3.15Å; L123-K125 VanDerWaalsContact C-N 3.26Å; L123-K125 PolarHBondContact O-N 3.28Å; K125-K128 PolarHBondContact O-N 3.49Å; K125-R129 PolarHBondContact O-N 3.04Å
126	W	63.5	Low	66.7	Low	102 Å²	102	91.5 Å²	91.5	39%	0.386	43%	0.431	S	S	.	.	H	α-helix	trans	-65.4	-44.1	179.8	-177.7	92.4	0	0	0	113.1	R122 L123 K128 R129 R130	R122-W126 PolarHBondContact O-N 3.46Å; L123-W126 PolarHBondContact O-N 3.4Å; L123-W126 VanDerWaalsContact O-N 3.17Å; W126-K128 VanDerWaalsContact C-N 3.34Å; W126-K128 PolarHBondContact O-N 3.26Å; W126-R129 CarbonylContact O-C 3.2Å; W126-R129 WeakPolarHBondContact O-CA 3.18Å; W126-R129 WeakPolarHBondContact O-CB 3.47Å; W126-R129 PolarHBondContact O-N 2.77Å; W126-R129 VanDerWaalsContact O-N 3.11Å; W126-R130 PolarHBondContact O-N 3.01Å
127	L	62.6	Low	65	Low	73 Å²	73	94.6 Å²	94.6	38%	0.382	45%	0.445	S	S	.	.	H	α-helix	trans	-59.8	-42.9	173.9	-85.6	156	0	0	0	111.4	L123 R129 R130 N131	L123-L127 HydrophobicContact CD2-CD1 3.77Å; L123-L127 HydrophobicContact CG-CD1 4.04Å; L123-L127 WeakPolarHBondContact O-CB 3.42Å; L123-L127 PolarHBondContact O-N 3.24Å; L127-R129 VanDerWaalsContact C-N 3.34Å; L127-R129 PolarHBondContact O-N 3.1Å; L127-R130 PolarHBondContact O-N 3.29Å; L127-N131 WeakPolarHBondContact O-CB 3.4Å; L127-N131 VanDerWaalsContact O-CG 3.28Å; L127-N131 PolarHBondContact O-N 3Å
128	K	66.3	Low	63.5	Low	159 Å²	159	98.3 Å²	98.3	69%	0.691	47%	0.469	S	S	*	.	H	α-helix	trans	-59.8	-43.1	173	-80.1	-179.3	179.1	-173.3	0	111.7	K124 K125 W126 F132	K124-K128 WeakPolarHBondContact O-CB 3.29Å; K124-K128 VanDerWaalsContact O-CG 3.29Å; K124-K128 WeakPolarHBondContact O-CG 3.34Å; K124-K128 PolarHBondContact O-N 2.78Å; K124-K128 VanDerWaalsContact O-N 3.15Å; K125-K128 PolarHBondContact O-N 3.49Å; W126-K128 VanDerWaalsContact C-N 3.34Å; W126-K128 PolarHBondContact O-N 3.26Å; K128-F132 WeakPolarHBondContact O-CB 3.32Å; K128-F132 PolarHBondContact O-N 2.64Å
129	R	63.1	Low	62	Low	79 Å²	79	101.6 Å²	101.6	30%	0.298	48%	0.48	S	S	.	.	H	α-helix	trans	-62.7	-46.9	174.7	-77.5	-174.3	172.3	151.5	16.1	112.4	E33 K125 W126 L127 N131 F132 L133	E33-R129 IonicContact OE1-NH2 2.94Å; E33-R129 PolarHBondContact OE1-NH2 3.32Å; E33-R129 IonicContact OE2-CZ 3.1Å; E33-R129 IonicContact OE2-NH1 2.73Å; E33-R129 PolarHBondContact OE2-NH1 3.22Å; E33-R129 IonicContact OE2-NH2 2.64Å; E33-R129 PolarHBondContact OE2-NH2 2.98Å; K125-R129 PolarHBondContact O-N 3.04Å; W126-R129 CarbonylContact O-C 3.2Å; W126-R129 WeakPolarHBondContact O-CA 3.18Å; W126-R129 WeakPolarHBondContact O-CB 3.47Å; W126-R129 PolarHBondContact O-N 2.77Å; W126-R129 VanDerWaalsContact O-N 3.11Å; L127-R129 VanDerWaalsContact C-N 3.34Å; L127-R129 PolarHBondContact O-N 3.1Å; R129-N131 PolarHBondContact O-N 2.84Å; R129-F132 WeakPolarHBondContact O-CB 3.28Å; R129-F132 PolarHBondContact O-N 2.87Å; R129-L133 WeakPolarHBondContact O-CB 3.5Å; R129-L133 WeakPolarHBondContact O-CG 3.25Å; R129-L133 PolarHBondContact O-N 3.34Å
130	R	62.8	Low	60.4	Low	125 Å²	125	100.3 Å²	100.3	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-62.5	-44.7	179.7	-170.6	178.3	-179.7	134.6	-3.8	111.5	W126 L127 F132 L133 Q134	W126-R130 PolarHBondContact O-N 3.01Å; L127-R130 PolarHBondContact O-N 3.29Å; R130-F132 VanDerWaalsContact C-N 3.33Å; R130-F132 PolarHBondContact O-N 2.98Å; R130-L133 PolarHBondContact O-N 3.44Å; R130-Q134 WeakPolarHBondContact O-CB 3.44Å; R130-Q134 WeakPolarHBondContact O-CG 3.19Å; R130-Q134 PolarHBondContact O-N 3.23Å
131	N	64.3	Low	58.8	Low	83 Å²	83	107.9 Å²	107.9	44%	0.444	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-40	175.5	-71.4	-11.3	0	0	0	111.6	L127 R129 N135	L127-N131 WeakPolarHBondContact O-CB 3.4Å; L127-N131 VanDerWaalsContact O-CG 3.28Å; L127-N131 PolarHBondContact O-N 3Å; R129-N131 PolarHBondContact O-N 2.84Å; N131-N135 WeakPolarHBondContact O-CB 3.39Å; N131-N135 VanDerWaalsContact O-CG 3.24Å; N131-N135 PolarHBondContact O-N 2.63Å; N131-N135 PolarHBondContact O-ND2 2.72Å
132	F	64.7	Low	57.7	Low	84 Å²	84	108.3 Å²	108.3	37%	0.368	51%	0.512	S	S	.	.	H	α-helix	trans	-61.4	-48.9	173.4	-179.7	-99.1	0	0	0	111.5	T26 I30 K128 R129 R130 Q134 N135 V136	T26-F132 HydrophobicContact CG2-CZ 4.38Å; I30-F132 HydrophobicContact CD1-CD1 4.4Å; I30-F132 HydrophobicContact CD1-CE1 4.3Å; K128-F132 WeakPolarHBondContact O-CB 3.32Å; K128-F132 PolarHBondContact O-N 2.64Å; R129-F132 WeakPolarHBondContact O-CB 3.28Å; R129-F132 PolarHBondContact O-N 2.87Å; R130-F132 VanDerWaalsContact C-N 3.33Å; R130-F132 PolarHBondContact O-N 2.98Å; F132-Q134 PolarHBondContact O-N 3.43Å; F132-N135 PolarHBondContact O-N 2.88Å; F132-V136 HydrophobicContact CD1-CG2 4.09Å; F132-V136 HydrophobicContact CE1-CG2 3.72Å; F132-V136 HydrophobicContact CE2-CG2 4.21Å; F132-V136 HydrophobicContact CG-CG2 4.49Å; F132-V136 HydrophobicContact CZ-CG2 3.79Å; F132-V136 VanDerWaalsContact O-CG2 3.31Å; F132-V136 WeakPolarHBondContact O-CG2 3.24Å; F132-V136 PolarHBondContact O-N 3.28Å
133	L	56.9	Low	56.7	Low	90 Å²	90	106.1 Å²	106.1	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-38	179.3	-69.8	172.8	0	0	0	112.8	R129 R130 V136 N137	R129-L133 WeakPolarHBondContact O-CB 3.5Å; R129-L133 WeakPolarHBondContact O-CG 3.25Å; R129-L133 PolarHBondContact O-N 3.34Å; R130-L133 PolarHBondContact O-N 3.44Å; L133-V136 PolarHBondContact O-N 2.91Å; L133-N137 WeakPolarHBondContact O-CB 2.88Å; L133-N137 VanDerWaalsContact O-CG 3.32Å; L133-N137 PolarHBondContact O-N 3Å
134	Q	60.6	Low	55.8	Low	99 Å²	99	112 Å²	112	46%	0.463	55%	0.545	S	S	.	.	H	α-helix	trans	-63.8	-42	173.7	-77.3	-178.4	-16.7	0	0	111.4	R130 F132 N137 T138	R130-Q134 WeakPolarHBondContact O-CB 3.44Å; R130-Q134 WeakPolarHBondContact O-CG 3.19Å; R130-Q134 PolarHBondContact O-N 3.23Å; F132-Q134 PolarHBondContact O-N 3.43Å; Q134-N137 PolarHBondContact O-N 3.01Å; Q134-T138 PolarHBondContact O-N 3.15Å; Q134-T138 PolarHBondContact O-OG1 3.02Å; Q134-T138 VanDerWaalsContact O-OG1 3.04Å
135	N	58.9	Low	54.8	Low	101 Å²	101	112.6 Å²	112.6	54%	0.54	55%	0.554	S	S	.	*	H	α-helix	trans	-68.5	-35.4	175.8	-72.8	-15.7	0	0	0	112.8	N131 F132 T138 I139	N131-N135 WeakPolarHBondContact O-CB 3.39Å; N131-N135 VanDerWaalsContact O-CG 3.24Å; N131-N135 PolarHBondContact O-N 2.63Å; N131-N135 PolarHBondContact O-ND2 2.72Å; F132-N135 PolarHBondContact O-N 2.88Å; N135-T138 VanDerWaalsContact CA-OG1 3.3Å; N135-T138 WeakPolarHBondContact CA-OG1 3.14Å; N135-T138 PolarHBondContact O-OG1 3.25Å; N135-I139 WeakPolarHBondContact O-CD1 3.31Å; N135-I139 VanDerWaalsContact O-CG1 3.26Å; N135-I139 WeakPolarHBondContact O-CG1 3.44Å; N135-I139 PolarHBondContact O-N 3.03Å
136	V	56.8	Low	53.8	Low	51 Å²	51	111.4 Å²	111.4	31%	0.309	56%	0.558	S	S	.	*	H	α-helix	trans	-68.4	-41.9	173.6	172.8	0	0	0	0	110.2	F132 L133 T138 I139 V140	F132-V136 HydrophobicContact CD1-CG2 4.09Å; F132-V136 HydrophobicContact CE1-CG2 3.72Å; F132-V136 HydrophobicContact CE2-CG2 4.21Å; F132-V136 HydrophobicContact CG-CG2 4.49Å; F132-V136 HydrophobicContact CZ-CG2 3.79Å; F132-V136 VanDerWaalsContact O-CG2 3.31Å; F132-V136 WeakPolarHBondContact O-CG2 3.24Å; F132-V136 PolarHBondContact O-N 3.28Å; L133-V136 PolarHBondContact O-N 2.91Å; V136-T138 VanDerWaalsContact C-N 3.33Å; V136-T138 PolarHBondContact O-N 3.44Å; V136-I139 PolarHBondContact O-N 2.92Å; V136-I139 VanDerWaalsContact O-N 3.1Å; V136-V140 HydrophobicContact CG1-CG2 4.22Å; V136-V140 WeakPolarHBondContact O-CG2 3.49Å; V136-V140 PolarHBondContact O-N 3.39Å
137	N	50.2	Low	52.7	Low	100 Å²	100	114 Å²	114	54%	0.535	58%	0.579	S	S	.	*	H	α-helix	trans	-64.9	-34.2	177.5	-78.6	-17.3	0	0	0	112.8	L133 Q134 I139 V140 R141	L133-N137 WeakPolarHBondContact O-CB 2.88Å; L133-N137 VanDerWaalsContact O-CG 3.32Å; L133-N137 PolarHBondContact O-N 3Å; Q134-N137 PolarHBondContact O-N 3.01Å; N137-I139 VanDerWaalsContact C-N 3.33Å; N137-V140 PolarHBondContact O-N 3.08Å; N137-R141 WeakPolarHBondContact O-CB 3.43Å; N137-R141 PolarHBondContact O-N 3.49Å
138	T	48.5	Very low	51.5	Low	97 Å²	97	120.4 Å²	120.4	60%	0.595	60%	0.604	S	S	*	*	H	α-helix	trans	-69.7	-29.7	172.1	37.8	0	0	0	0	112.8	Q134 N135 V136 R141	Q134-T138 PolarHBondContact O-N 3.15Å; Q134-T138 PolarHBondContact O-OG1 3.02Å; Q134-T138 VanDerWaalsContact O-OG1 3.04Å; N135-T138 VanDerWaalsContact CA-OG1 3.3Å; N135-T138 WeakPolarHBondContact CA-OG1 3.14Å; N135-T138 PolarHBondContact O-OG1 3.25Å; V136-T138 VanDerWaalsContact C-N 3.33Å; V136-T138 PolarHBondContact O-N 3.44Å; T138-R141 CarbonylContact O-C 3.59Å
139	I	50.3	Low	49.9	Very low	134 Å²	134	117.1 Å²	117.1	69%	0.687	60%	0.602	S	S	*	*	H	α-helix	trans	-71.8	-40.5	172.3	-64.7	163.3	0	0	0	111	N135 V136 N137	N135-I139 WeakPolarHBondContact O-CD1 3.31Å; N135-I139 VanDerWaalsContact O-CG1 3.26Å; N135-I139 WeakPolarHBondContact O-CG1 3.44Å; N135-I139 PolarHBondContact O-N 3.03Å; V136-I139 PolarHBondContact O-N 2.92Å; V136-I139 VanDerWaalsContact O-N 3.1Å; N137-I139 VanDerWaalsContact C-N 3.33Å
140	V	47.4	Very low	48.5	Very low	106 Å²	106	118.6 Å²	118.6	64%	0.642	62%	0.62	S	S	*	*	H	α-helix	trans	-79.8	-22.7	-177.6	178.8	0	0	0	0	112.6	V136 N137 P142	V136-V140 HydrophobicContact CG1-CG2 4.22Å; V136-V140 WeakPolarHBondContact O-CG2 3.49Å; V136-V140 PolarHBondContact O-N 3.39Å; N137-V140 PolarHBondContact O-N 3.08Å; V140-P142 WeakPolarHBondContact O-CD 3.49Å
141	R	39.7	Very low	47.4	Very low	207 Å²	207	124.6 Å²	124.6	78%	0.781	64%	0.644	S	S	*	*	S	Bend	trans	-108.1	75.6	169.5	-69	-175.7	175.8	-172	-1	110	N137 T138 N143	N137-R141 WeakPolarHBondContact O-CB 3.43Å; N137-R141 PolarHBondContact O-N 3.49Å; T138-R141 CarbonylContact O-C 3.59Å; R141-N143 PolarHBondContact O-N 3.11Å
142	P	42.5	Very low	45.8	Very low	99 Å²	99	129.3 Å²	129.3	64%	0.643	66%	0.661	S	S	*	*			trans	-57.5	127.4	162.5	26.8	-30.4	0	0	0	106.7	V140 L144	V140-P142 WeakPolarHBondContact O-CD 3.49Å; P142-L144 PolarHBondContact O-N 2.84Å
143	N	43.3	Very low	44.5	Very low	130 Å²	130	137.8 Å²	137.8	70%	0.695	70%	0.701	S	S	*	*			trans	-32.2	104.9	179.5	-83.8	-46.7	0	0	0	111.9	R141 N145	R141-N143 PolarHBondContact O-N 3.11Å; N143-N145 PolarHBondContact O-N 2.85Å
144	L	42.7	Very low	43.9	Very low	170 Å²	170	140.2 Å²	140.2	89%	0.89	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	22.4	171.2	-144.2	92.6	0	0	0	112.1	P142	P142-L144 PolarHBondContact O-N 2.84Å
145	N	42.3	Very low	43	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	8.4	-173.2	-76	-12.8	0	0	0	113.2	N143	N143-N145 PolarHBondContact O-N 2.85Å
146	T	41.8	Very low	42.1	Very low	112 Å²	112	144.7 Å²	144.7	69%	0.687	74%	0.736	S	S	*	*	S	Bend	trans	-90.7	-4.3	176	45.2	0	0	0	0	115.4	K148	T146-K148 PolarHBondContact O-N 3.24Å
147	D	39.8	Very low	41.3	Very low	155 Å²	155	150.2 Å²	150.2	83%	0.829	76%	0.761	S	S	*	*			trans	-100.3	34.6	-180	-67.5	-14.2	0	0	0	113.6
148	K	37.4	Very low	40.7	Very low	208 Å²	208	153.3 Å²	153.3	90%	0.904	78%	0.775	S	S	*	*			trans	-115.6	57.6	162.5	-71.1	-170.1	-179.4	-179.1	0	110.3	T146	T146-K148 PolarHBondContact O-N 3.24Å
149	S	33.8	Very low	40.2	Very low	91 Å²	91	157.1 Å²	157.1	64%	0.636	79%	0.787	S	S	*	*			trans	-121.5	139.9	156.7	78.7	0	0	0	0	108.9
150	T	34.1	Very low	39.5	Very low	110 Å²	110	158.7 Å²	158.7	68%	0.675	79%	0.794	S	S	*	*			trans	73.7	74.2	170.4	56.7	0	0	0	0	118.4
151	Y	38.4	Very low	38.8	Very low	250 Å²	250	162.8 Å²	162.8	98%	0.98	81%	0.806	S	S	*	*				-108.8	85.8	127.1	-78.6	-82.4	0	0	0	107.6
152	K	31	Very low	38.8	Very low	183 Å²	183	159.1 Å²	159.1	80%	0.796	81%	0.808	S	S	*	*			trans	-85	105.4	154.1	-84.3	-178.4	174	179.8	0	105.6
153	H	38	Very low	38.4	Very low	262 Å²	262	164.5 Å²	164.5	100%	1.213	82%	0.823	S	S	*	*			trans	-171.1	0	137.5	-110	-62.5	0	0	0	110.1

Retrieved 153 of 153 residues in 44.8 ms (Link to these results)

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