A0A087WWS8_HUMAN Loading...

Apoptosis antagonizing transcription factor

AlphaFold DB , UniProt , Accession A0A087WWS8, Species HUMAN (Homo sapiens, Human), Gene AATF, Length 154 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	R	88.1	Confident	89.1	Confident	218 Å²	218	114.8 Å²	114.8	82%	0.823	50%	0.503	S	S	*	.				0	-69.5	0	-174.4	177.9	170.3	-119.8	0	112.3	R3 T4 L5	R1-R3 PolarHBondContact O-N 3.01Å; R1-T4 WeakPolarHBondContact O-CA 3.05Å; R1-T4 VanDerWaalsContact O-CB 3.31Å; R1-T4 WeakPolarHBondContact O-CB 3.39Å; R1-T4 PolarHBondContact O-N 3.45Å; R1-L5 HydrophobicContact CG-CD1 4.34Å; R1-L5 PolarHBondContact O-N 3.09Å; R1-L5 VanDerWaalsContact O-N 3.1Å
2	N	92.1	Very high	88.4	Confident	81 Å²	81	112.5 Å²	112.5	43%	0.433	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-42.4	-172.9	-64.8	6.8	0	0	0	113.7	T4 L5 Q6 L31	N2-T4 VanDerWaalsContact C-N 3.25Å; N2-T4 PolarHBondContact O-N 2.9Å; N2-L5 PolarHBondContact O-N 2.75Å; N2-Q6 PolarHBondContact O-N 3.22Å; N2-L31 HydrophobicContact CB-CD1 3.85Å; N2-L31 HydrophobicContact CB-CD2 3.81Å
3	R	92.8	Very high	87.3	Confident	224 Å²	224	111.9 Å²	111.9	85%	0.845	50%	0.502	S	S	*	.	H	α-helix	trans	-56.7	-38.3	173.2	-174.7	178.2	177.9	-174.1	0.4	112.9	R1 K7	R1-R3 PolarHBondContact O-N 3.01Å; R3-K7 WeakPolarHBondContact O-CB 3.38Å; R3-K7 PolarHBondContact O-N 2.88Å
4	T	92.1	Very high	85.7	Confident	78 Å²	78	114.4 Å²	114.4	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-69.7	-42.2	178.4	-47.9	0	0	0	0	111.1	R1 N2 K7 W8	R1-T4 WeakPolarHBondContact O-CA 3.05Å; R1-T4 VanDerWaalsContact O-CB 3.31Å; R1-T4 WeakPolarHBondContact O-CB 3.39Å; R1-T4 PolarHBondContact O-N 3.45Å; N2-T4 VanDerWaalsContact C-N 3.25Å; N2-T4 PolarHBondContact O-N 2.9Å; T4-K7 PolarHBondContact O-N 2.71Å; T4-W8 VanDerWaalsContact O-CD1 3.23Å; T4-W8 PolarHBondContact O-N 3.26Å
5	L	90.2	Very high	84	Confident	64 Å²	64	112.7 Å²	112.7	34%	0.335	53%	0.534	S	S	.	.	H	α-helix	trans	-61.5	-47.5	176.3	-68.9	171.6	0	0	0	111.4	R1 N2 K7 W8 H9 L31 I34	R1-L5 HydrophobicContact CG-CD1 4.34Å; R1-L5 PolarHBondContact O-N 3.09Å; R1-L5 VanDerWaalsContact O-N 3.1Å; N2-L5 PolarHBondContact O-N 2.75Å; L5-K7 PolarHBondContact O-N 2.85Å; L5-W8 PolarHBondContact O-N 3.26Å; L5-H9 WeakPolarHBondContact O-CB 3.42Å; L5-H9 PolarHBondContact O-N 3.47Å; L5-L31 HydrophobicContact CB-CD2 4.48Å; L5-L31 HydrophobicContact CD1-CD2 4.31Å; L5-I34 HydrophobicContact CD1-CD1 4.29Å
6	Q	89	Confident	82.7	Confident	49 Å²	49	108.8 Å²	108.8	23%	0.229	52%	0.523	C	S	.	.	H	α-helix	trans	-59.9	-48.3	176.7	-169.6	63.1	56.1	0	0	111.1	N2 W8 H9 D10	N2-Q6 PolarHBondContact O-N 3.22Å; Q6-W8 VanDerWaalsContact C-N 3.3Å; Q6-W8 PolarHBondContact O-N 3.02Å; Q6-H9 PolarHBondContact O-N 3.25Å; Q6-H9 VanDerWaalsContact O-N 3.15Å; Q6-D10 PolarHBondContact NE2-OD1 2.99Å; Q6-D10 PolarHBondContact O-N 3.2Å
7	K	90.3	Very high	81.1	Confident	151 Å²	151	105 Å²	105	66%	0.657	52%	0.519	S	S	*	.	H	α-helix	trans	-54.3	-43.9	177.6	-179.2	-178.1	178.2	-179	0	112.9	R3 T4 L5 K11	R3-K7 WeakPolarHBondContact O-CB 3.38Å; R3-K7 PolarHBondContact O-N 2.88Å; T4-K7 PolarHBondContact O-N 2.71Å; L5-K7 PolarHBondContact O-N 2.85Å; K7-K11 WeakPolarHBondContact O-CB 3.31Å; K7-K11 PolarHBondContact O-N 3.07Å; K7-K11 VanDerWaalsContact O-N 3.13Å
8	W	89.9	Confident	79.8	Confident	149 Å²	149	111.3 Å²	111.3	56%	0.564	54%	0.543	S	S	*	.	H	α-helix	trans	-72.7	-39.5	179.2	-81.5	110	0	0	0	112.5	T4 L5 Q6 D10 K11 T12	T4-W8 VanDerWaalsContact O-CD1 3.23Å; T4-W8 PolarHBondContact O-N 3.26Å; L5-W8 PolarHBondContact O-N 3.26Å; Q6-W8 VanDerWaalsContact C-N 3.3Å; Q6-W8 PolarHBondContact O-N 3.02Å; W8-D10 VanDerWaalsContact C-N 3.35Å; W8-K11 HydrophobicContact CE3-CD 4.23Å; W8-K11 HydrophobicContact CZ3-CD 4.11Å; W8-K11 PolarHBondContact O-N 3.36Å; W8-T12 PolarHBondContact O-N 3.29Å; W8-T12 PolarHBondContact O-OG1 3.36Å; W8-T12 VanDerWaalsContact O-OG1 3.06Å
9	H	85.3	Confident	78.4	Confident	51 Å²	51	111.6 Å²	111.6	24%	0.236	55%	0.547	C	S	.	.	H	α-helix	trans	-59	-47.4	174.2	177.7	63.6	0	0	0	111.5	L5 Q6 K11 T12 K13 I30	L5-H9 WeakPolarHBondContact O-CB 3.42Å; L5-H9 PolarHBondContact O-N 3.47Å; Q6-H9 PolarHBondContact O-N 3.25Å; Q6-H9 VanDerWaalsContact O-N 3.15Å; H9-K11 VanDerWaalsContact C-N 3.31Å; H9-K11 PolarHBondContact O-N 2.9Å; H9-T12 PolarHBondContact O-N 2.94Å; H9-K13 WeakPolarHBondContact O-CB 3.39Å; H9-K13 PolarHBondContact O-N 3.02Å; H9-I30 HydrophobicContact CB-CB 3.95Å; H9-I30 HydrophobicContact CB-CG1 4.18Å; H9-I30 HydrophobicContact CB-CG2 3.94Å
10	D	85.1	Confident	77.1	Confident	68 Å²	68	109.2 Å²	109.2	36%	0.364	55%	0.552	S	S	.	*	H	α-helix	trans	-60.5	-42.5	177.9	-60.2	-25.6	0	0	0	111.2	Q6 W8 K13 L14	Q6-D10 PolarHBondContact NE2-OD1 2.99Å; Q6-D10 PolarHBondContact O-N 3.2Å; W8-D10 VanDerWaalsContact C-N 3.35Å; D10-K13 PolarHBondContact O-N 3.34Å; D10-L14 VanDerWaalsContact O-CG 3.26Å; D10-L14 WeakPolarHBondContact O-CG 3.39Å; D10-L14 PolarHBondContact O-N 3.1Å
11	K	85.3	Confident	75.9	Confident	130 Å²	130	115.2 Å²	115.2	57%	0.565	58%	0.575	S	S	*	*	H	α-helix	trans	-63.4	-43.8	177.5	-172.3	174.3	-179.2	-177.8	0	112.3	K7 W8 H9 A15	K7-K11 WeakPolarHBondContact O-CB 3.31Å; K7-K11 PolarHBondContact O-N 3.07Å; K7-K11 VanDerWaalsContact O-N 3.13Å; W8-K11 HydrophobicContact CE3-CD 4.23Å; W8-K11 HydrophobicContact CZ3-CD 4.11Å; W8-K11 PolarHBondContact O-N 3.36Å; H9-K11 VanDerWaalsContact C-N 3.31Å; H9-K11 PolarHBondContact O-N 2.9Å; K11-A15 WeakPolarHBondContact O-CB 3.46Å; K11-A15 PolarHBondContact O-N 3.4Å
12	T	80.3	Confident	74.2	Confident	87 Å²	87	106.9 Å²	106.9	53%	0.534	56%	0.557	S	S	.	*	H	α-helix	trans	-68.3	-40.1	178.3	-58.4	0	0	0	0	111.6	W8 H9 L14 A15 S16	W8-T12 PolarHBondContact O-N 3.29Å; W8-T12 PolarHBondContact O-OG1 3.36Å; W8-T12 VanDerWaalsContact O-OG1 3.06Å; H9-T12 PolarHBondContact O-N 2.94Å; T12-L14 VanDerWaalsContact C-N 3.34Å; T12-L14 PolarHBondContact O-N 2.88Å; T12-A15 PolarHBondContact O-N 2.73Å; T12-S16 WeakPolarHBondContact O-CB 3.48Å; T12-S16 PolarHBondContact O-N 3.05Å
13	K	74.4	Confident	72.2	Confident	105 Å²	105	111.4 Å²	111.4	46%	0.457	57%	0.573	S	S	.	*	H	α-helix	trans	-59.6	-44.2	175.9	-179.8	175.7	171.5	176	0	111.8	H9 D10 S16 E27	H9-K13 WeakPolarHBondContact O-CB 3.39Å; H9-K13 PolarHBondContact O-N 3.02Å; D10-K13 PolarHBondContact O-N 3.34Å; K13-S16 PolarHBondContact O-N 3.24Å; K13-E27 WeakPolarHBondContact CE-OE2 3.46Å; K13-E27 IonicContact NZ-OE2 2.64Å; K13-E27 PolarHBondContact NZ-OE2 3.27Å
14	L	65.3	Low	70.3	Confident	147 Å²	147	103.2 Å²	103.2	77%	0.77	56%	0.558	S	S	*	*	H	α-helix	trans	-67.1	-38.5	176.4	-68.7	168.1	0	0	0	112.4	D10 T12 S16	D10-L14 VanDerWaalsContact O-CG 3.26Å; D10-L14 WeakPolarHBondContact O-CG 3.39Å; D10-L14 PolarHBondContact O-N 3.1Å; T12-L14 VanDerWaalsContact C-N 3.34Å; T12-L14 PolarHBondContact O-N 2.88Å; L14-S16 VanDerWaalsContact C-N 3.32Å; L14-S16 PolarHBondContact O-N 3.39Å
15	A	60.7	Low	68.3	Low	88 Å²	88	104.6 Å²	104.6	73%	0.727	58%	0.577	S	S	*	*	H	α-helix	trans	-71.1	-25	178	0	0	0	0	0	113.5	K11 T12 G17	K11-A15 WeakPolarHBondContact O-CB 3.46Å; K11-A15 PolarHBondContact O-N 3.4Å; T12-A15 PolarHBondContact O-N 2.73Å; A15-G17 PolarHBondContact O-N 2.93Å
16	S	62.8	Low	66.6	Low	50 Å²	50	110 Å²	110	35%	0.35	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	-9.6	-178.1	-162.4	0	0	0	0	113.9	T12 K13 L14 R112	T12-S16 WeakPolarHBondContact O-CB 3.48Å; T12-S16 PolarHBondContact O-N 3.05Å; K13-S16 PolarHBondContact O-N 3.24Å; L14-S16 VanDerWaalsContact C-N 3.32Å; L14-S16 PolarHBondContact O-N 3.39Å; S16-R112 PolarHBondContact OG-NH2 2.74Å
17	G	55.9	Low	65.5	Low	45 Å²	45	112.2 Å²	112.2	46%	0.464	61%	0.609	S	S	.	*			trans	66.2	152.7	-178.6	0	0	0	0	0	113.2	A15 L19	A15-G17 PolarHBondContact O-N 2.93Å; G17-L19 PolarHBondContact O-N 3.09Å
18	K	56.5	Low	64.8	Low	219 Å²	219	112.6 Å²	112.6	95%	0.952	61%	0.606	S	S	*	*			trans	-68.5	78.6	171.2	-84.3	-179.6	173.5	176.8	0	109.8
19	L	54	Low	64.7	Low	116 Å²	116	107.8 Å²	107.8	61%	0.607	60%	0.595	S	S	*	*			trans	-94.4	97.6	168.1	-122.9	72.5	0	0	0	108	G17	G17-L19 PolarHBondContact O-N 3.09Å
20	G	51.3	Low	64.7	Low	64 Å²	64	106.8 Å²	106.8	66%	0.66	59%	0.591	S	S	*	*			trans	101.4	129.8	170.1	0	0	0	0	0	115.5	G22	G20-G22 PolarHBondContact O-N 3.04Å
21	K	52.6	Low	64.9	Low	235 Å²	235	105.6 Å²	105.6	100%	1.022	59%	0.585	S	S	*	*	S	Bend	trans	-64.5	84.2	157	-98.7	179.4	170.8	-179.8	0	107.6
22	G	52.8	Low	65.2	Low	43 Å²	43	102.4 Å²	102.4	44%	0.443	58%	0.576	S	S	.	*	S	Bend	trans	-165.1	126	177	0	0	0	0	0	111	G20 G24	G20-G22 PolarHBondContact O-N 3.04Å; G22-G24 PolarHBondContact O-N 2.97Å
23	F	50.8	Low	65.5	Low	177 Å²	177	102.8 Å²	102.8	78%	0.776	57%	0.572	S	S	*	*	S	Bend	trans	76.6	-10.7	161.8	-54.6	-77	0	0	0	120.5	A25 F26 E27	F23-A25 PolarHBondContact O-N 3.01Å; F23-F26 PolarHBondContact O-N 3.17Å; F23-E27 PolarHBondContact O-N 3.29Å
24	G	52.9	Low	66.2	Low	52 Å²	52	100.1 Å²	100.1	54%	0.536	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-57.5	-25.7	176.2	0	0	0	0	0	115.5	G22 F26	G22-G24 PolarHBondContact O-N 2.97Å; G24-F26 VanDerWaalsContact C-N 3.34Å
25	A	48.1	Very low	67.5	Low	106 Å²	106	98.1 Å²	98.1	88%	0.876	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-79.2	-13.1	177.6	0	0	0	0	0	114.2	F23	F23-A25 PolarHBondContact O-N 3.01Å
26	F	55.3	Low	68.9	Low	177 Å²	177	99.2 Å²	99.2	78%	0.776	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-111.9	6.1	177.6	-93.8	-88.9	0	0	0	112.8	F23 G24 R28	F23-F26 PolarHBondContact O-N 3.17Å; G24-F26 VanDerWaalsContact C-N 3.34Å; F26-R28 PolarHBondContact O-N 3.35Å
27	E	65.5	Low	70.1	Confident	96 Å²	96	101.1 Å²	101.1	45%	0.449	55%	0.547	S	S	.	.			trans	-72.1	98.9	-178.4	-81.4	-177.6	-161	0	0	111	K13 F23	K13-E27 WeakPolarHBondContact CE-OE2 3.46Å; K13-E27 IonicContact NZ-OE2 2.64Å; K13-E27 PolarHBondContact NZ-OE2 3.27Å; F23-E27 PolarHBondContact O-N 3.29Å
28	R	76.8	Confident	71.8	Confident	159 Å²	159	103 Å²	103	60%	0.6	55%	0.547	S	S	*	.			trans	-64.2	152.1	167.2	-65	-176.1	-175.7	-169.7	0.9	109.5	F26 T32	F26-R28 PolarHBondContact O-N 3.35Å; R28-T32 WeakPolarHBondContact CB-OG1 3.44Å
29	S	86.2	Confident	73.6	Confident	48 Å²	48	99.8 Å²	99.8	34%	0.336	54%	0.537	S	S	.	.			trans	-54	150.3	172.5	74.5	0	0	0	0	111.3	L31 T32 Q33	S29-L31 PolarHBondContact O-N 2.77Å; S29-L31 VanDerWaalsContact O-N 3.11Å; S29-T32 PolarHBondContact N-OG1 2.94Å; S29-T32 PolarHBondContact O-N 3.4Å; S29-T32 VanDerWaalsContact O-N 3.12Å; S29-T32 PolarHBondContact O-OG1 3.33Å; S29-T32 WeakPolarHBondContact OG-CG2 3.4Å; S29-T32 PolarHBondContact OG-N 3.39Å; S29-T32 VanDerWaalsContact OG-N 3.1Å; S29-T32 PolarHBondContact OG-OG1 2.64Å; S29-Q33 PolarHBondContact O-N 3.19Å
30	I	85.9	Confident	75.4	Confident	30 Å²	30	97.7 Å²	97.7	15%	0.154	53%	0.526	C	S	.	.	H	α-helix	trans	-58.3	-30.4	177.9	-169.8	57.7	0	0	0	111.8	H9 Q33 I34	H9-I30 HydrophobicContact CB-CB 3.95Å; H9-I30 HydrophobicContact CB-CG1 4.18Å; H9-I30 HydrophobicContact CB-CG2 3.94Å; I30-Q33 PolarHBondContact O-N 3.07Å; I30-I34 HydrophobicContact CG1-CD1 4.08Å; I30-I34 WeakPolarHBondContact O-CB 3.1Å; I30-I34 WeakPolarHBondContact O-CD1 3.15Å; I30-I34 WeakPolarHBondContact O-CG1 3.44Å; I30-I34 PolarHBondContact O-N 3.48Å
31	L	90.1	Very high	77.3	Confident	44 Å²	44	100.8 Å²	100.8	23%	0.23	52%	0.521	C	S	.	.	H	α-helix	trans	-67.4	-49.3	177.6	-59.2	177.2	0	0	0	111.2	N2 L5 S29 Q33 I34 D35	N2-L31 HydrophobicContact CB-CD1 3.85Å; N2-L31 HydrophobicContact CB-CD2 3.81Å; L5-L31 HydrophobicContact CB-CD2 4.48Å; L5-L31 HydrophobicContact CD1-CD2 4.31Å; S29-L31 PolarHBondContact O-N 2.77Å; S29-L31 VanDerWaalsContact O-N 3.11Å; L31-Q33 VanDerWaalsContact C-N 3.25Å; L31-Q33 PolarHBondContact O-N 3.16Å; L31-I34 PolarHBondContact O-N 3.5Å; L31-I34 VanDerWaalsContact O-N 3.15Å; L31-D35 VanDerWaalsContact O-CG 3.25Å; L31-D35 PolarHBondContact O-N 2.96Å
32	T	90.4	Very high	79	Confident	63 Å²	63	95 Å²	95	39%	0.387	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-28.4	177.4	50	0	0	0	0	112.5	R28 S29 H36	R28-T32 WeakPolarHBondContact CB-OG1 3.44Å; S29-T32 PolarHBondContact N-OG1 2.94Å; S29-T32 PolarHBondContact O-N 3.4Å; S29-T32 VanDerWaalsContact O-N 3.12Å; S29-T32 PolarHBondContact O-OG1 3.33Å; S29-T32 WeakPolarHBondContact OG-CG2 3.4Å; S29-T32 PolarHBondContact OG-N 3.39Å; S29-T32 VanDerWaalsContact OG-N 3.1Å; S29-T32 PolarHBondContact OG-OG1 2.64Å; T32-H36 VanDerWaalsContact O-CB 3.25Å; T32-H36 WeakPolarHBondContact O-CB 3.37Å; T32-H36 PolarHBondContact O-N 3.02Å
33	Q	87.3	Confident	80.8	Confident	95 Å²	95	101.5 Å²	101.5	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-68	-45.4	170.8	-171	179.5	18.9	0	0	111.6	S29 I30 L31 H36 I37	S29-Q33 PolarHBondContact O-N 3.19Å; I30-Q33 PolarHBondContact O-N 3.07Å; L31-Q33 VanDerWaalsContact C-N 3.25Å; L31-Q33 PolarHBondContact O-N 3.16Å; Q33-H36 PolarHBondContact O-N 3.42Å; Q33-I37 HydrophobicContact CG-CD1 3.98Å; Q33-I37 WeakPolarHBondContact O-CB 3.18Å; Q33-I37 VanDerWaalsContact O-CG1 3.26Å; Q33-I37 WeakPolarHBondContact O-CG1 3.5Å; Q33-I37 PolarHBondContact O-N 3.49Å
34	I	89.6	Confident	82.6	Confident	49 Å²	49	96 Å²	96	25%	0.251	49%	0.488	S	S	.	.	H	α-helix	trans	-59.9	-48.3	175	-71.8	163.8	0	0	0	110	L5 I30 L31 H36 I37 L38	L5-I34 HydrophobicContact CD1-CD1 4.29Å; I30-I34 HydrophobicContact CG1-CD1 4.08Å; I30-I34 WeakPolarHBondContact O-CB 3.1Å; I30-I34 WeakPolarHBondContact O-CD1 3.15Å; I30-I34 WeakPolarHBondContact O-CG1 3.44Å; I30-I34 PolarHBondContact O-N 3.48Å; L31-I34 PolarHBondContact O-N 3.5Å; L31-I34 VanDerWaalsContact O-N 3.15Å; I34-H36 VanDerWaalsContact C-N 3.31Å; I34-H36 PolarHBondContact O-N 3.21Å; I34-I37 PolarHBondContact O-N 3.3Å; I34-L38 HydrophobicContact CG2-CD1 3.61Å; I34-L38 HydrophobicContact CG2-CG 4.24Å; I34-L38 WeakPolarHBondContact O-CB 3.25Å; I34-L38 VanDerWaalsContact O-CG 3.25Å; I34-L38 WeakPolarHBondContact O-CG 3.34Å; I34-L38 PolarHBondContact O-N 2.93Å
35	D	92.3	Very high	84.3	Confident	104 Å²	104	97.2 Å²	97.2	56%	0.556	48%	0.481	S	S	*	.	H	α-helix	trans	-59.6	-44.8	179.7	-67.4	-22.9	0	0	0	110.7	L31 L38 M39	L31-D35 VanDerWaalsContact O-CG 3.25Å; L31-D35 PolarHBondContact O-N 2.96Å; D35-L38 CarbonylContact O-C 3.52Å; D35-L38 PolarHBondContact O-N 3.33Å; D35-M39 WeakPolarHBondContact O-CG 3.17Å; D35-M39 PolarHBondContact O-N 2.94Å
36	H	90.1	Very high	86.2	Confident	111 Å²	111	97.3 Å²	97.3	51%	0.514	46%	0.459	S	S	.	.	H	α-helix	trans	-63.1	-43.3	177.7	-173.5	59	0	0	0	113	T32 Q33 I34 L38 M39	T32-H36 VanDerWaalsContact O-CB 3.25Å; T32-H36 WeakPolarHBondContact O-CB 3.37Å; T32-H36 PolarHBondContact O-N 3.02Å; Q33-H36 PolarHBondContact O-N 3.42Å; I34-H36 VanDerWaalsContact C-N 3.31Å; I34-H36 PolarHBondContact O-N 3.21Å; H36-L38 VanDerWaalsContact C-N 3.28Å; H36-L38 PolarHBondContact O-N 3.21Å; H36-M39 PolarHBondContact ND1-SD 3.1Å; H36-M39 VanDerWaalsContact ND1-SD 3.36Å; H36-M39 WeakPolarHBondContact O-CB 3.27Å; H36-M39 PolarHBondContact O-N 3Å
37	I	88.3	Confident	87.7	Confident	90 Å²	90	94.6 Å²	94.6	46%	0.462	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-38.8	176	-70.1	166.3	0	0	0	110.5	Q33 I34 M39 L44	Q33-I37 HydrophobicContact CG-CD1 3.98Å; Q33-I37 WeakPolarHBondContact O-CB 3.18Å; Q33-I37 VanDerWaalsContact O-CG1 3.26Å; Q33-I37 WeakPolarHBondContact O-CG1 3.5Å; Q33-I37 PolarHBondContact O-N 3.49Å; I34-I37 PolarHBondContact O-N 3.3Å; I37-M39 VanDerWaalsContact C-N 3.28Å; I37-M39 PolarHBondContact O-N 3.13Å; I37-L44 HydrophobicContact CG2-CD2 4.33Å
38	L	91.8	Very high	88.9	Confident	86 Å²	86	90.8 Å²	90.8	45%	0.45	43%	0.427	S	S	.	.	H	α-helix	trans	-79.1	-7.3	-179.9	-67.8	178.5	0	0	0	113.9	I34 D35 H36 D40 K41	I34-L38 HydrophobicContact CG2-CD1 3.61Å; I34-L38 HydrophobicContact CG2-CG 4.24Å; I34-L38 WeakPolarHBondContact O-CB 3.25Å; I34-L38 VanDerWaalsContact O-CG 3.25Å; I34-L38 WeakPolarHBondContact O-CG 3.34Å; I34-L38 PolarHBondContact O-N 2.93Å; D35-L38 CarbonylContact O-C 3.52Å; D35-L38 PolarHBondContact O-N 3.33Å; H36-L38 VanDerWaalsContact C-N 3.28Å; H36-L38 PolarHBondContact O-N 3.21Å; L38-D40 PolarHBondContact O-N 3.06Å; L38-K41 PolarHBondContact O-N 3.37Å
39	M	93.6	Very high	89.5	Confident	150 Å²	150	85 Å²	85	74%	0.739	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-34.1	175.1	-72.7	-179	70.3	0	0	111.8	D35 H36 I37	D35-M39 WeakPolarHBondContact O-CG 3.17Å; D35-M39 PolarHBondContact O-N 2.94Å; H36-M39 PolarHBondContact ND1-SD 3.1Å; H36-M39 VanDerWaalsContact ND1-SD 3.36Å; H36-M39 WeakPolarHBondContact O-CB 3.27Å; H36-M39 PolarHBondContact O-N 3Å; I37-M39 VanDerWaalsContact C-N 3.28Å; I37-M39 PolarHBondContact O-N 3.13Å
40	D	91.5	Very high	89.5	Confident	73 Å²	73	83.2 Å²	83.2	39%	0.39	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	64.9	176.5	-169	-3.6	0	0	0	110.8	L38 E42 R43 L44	L38-D40 PolarHBondContact O-N 3.06Å; D40-E42 PolarHBondContact O-N 3.22Å; D40-R43 HydrophobicContact CB-CB 4.31Å; D40-R43 PolarHBondContact O-N 2.7Å; D40-R43 WeakPolarHBondContact OD1-CB 3.33Å; D40-R43 PolarHBondContact OD1-N 3.3Å; D40-R43 WeakPolarHBondContact OD2-CB 3.43Å; D40-R43 WeakPolarHBondContact OD2-CD 3.46Å; D40-L44 PolarHBondContact O-N 3.36Å
41	K	90.9	Very high	89.2	Confident	128 Å²	128	84.1 Å²	84.1	56%	0.557	40%	0.397	S	S	*	.	H	α-helix	trans	-60.9	-35.6	178.5	-175.2	-178.6	177.2	-170.8	0	112.1	L38 L44 L45	L38-K41 PolarHBondContact O-N 3.37Å; K41-L44 WeakPolarHBondContact O-CB 3.45Å; K41-L44 PolarHBondContact O-N 3.27Å; K41-L45 HydrophobicContact CG-CD1 4.28Å; K41-L45 HydrophobicContact CG-CG 4.49Å; K41-L45 WeakPolarHBondContact O-CG 3.37Å; K41-L45 PolarHBondContact O-N 3Å
42	E	89.8	Confident	88.7	Confident	114 Å²	114	86.1 Å²	86.1	53%	0.533	40%	0.401	S	S	.	.	H	α-helix	trans	-65.6	-45.1	-176.7	-159.6	-164.6	-163.6	0	0	110.9	D40 L44 L45 R46	D40-E42 PolarHBondContact O-N 3.22Å; E42-L44 VanDerWaalsContact C-N 3.3Å; E42-L44 PolarHBondContact O-N 3.08Å; E42-L45 PolarHBondContact O-N 3.29Å; E42-R46 VanDerWaalsContact CD-CZ 3.4Å; E42-R46 VanDerWaalsContact CD-NH2 3.28Å; E42-R46 VanDerWaalsContact CG-NH1 3.35Å; E42-R46 WeakPolarHBondContact O-CG 3.43Å; E42-R46 PolarHBondContact O-N 3.27Å; E42-R46 IonicContact OE1-CZ 3.3Å; E42-R46 VanDerWaalsContact OE1-CZ 3.23Å; E42-R46 IonicContact OE1-NH1 2.78Å; E42-R46 PolarHBondContact OE1-NH1 3.27Å; E42-R46 VanDerWaalsContact OE1-NH1 3.16Å; E42-R46 IonicContact OE1-NH2 3.75Å; E42-R46 PolarHBondContact OE1-NH2 3.17Å; E42-R46 IonicContact OE2-CZ 3.94Å; E42-R46 IonicContact OE2-NH1 3.79Å; E42-R46 PolarHBondContact OE2-NH1 3.41Å; E42-R46 IonicContact OE2-NH2 2.75Å
43	R	89.1	Confident	88	Confident	180 Å²	180	86 Å²	86	68%	0.679	40%	0.402	S	S	*	.	H	α-helix	trans	-61.8	-38.6	172.4	-177.6	-178.8	172.9	-151.2	-1.2	112.3	D40 R46 R47	D40-R43 HydrophobicContact CB-CB 4.31Å; D40-R43 PolarHBondContact O-N 2.7Å; D40-R43 WeakPolarHBondContact OD1-CB 3.33Å; D40-R43 PolarHBondContact OD1-N 3.3Å; D40-R43 WeakPolarHBondContact OD2-CB 3.43Å; D40-R43 WeakPolarHBondContact OD2-CD 3.46Å; R43-R46 PolarHBondContact O-N 3.21Å; R43-R47 WeakPolarHBondContact O-CB 3.19Å; R43-R47 PolarHBondContact O-N 3.16Å
44	L	88.6	Confident	87.3	Confident	61 Å²	61	89.1 Å²	89.1	32%	0.319	43%	0.428	S	S	.	.	H	α-helix	trans	-62.8	-44.3	178.2	-166.5	69.4	0	0	0	111.3	I37 D40 K41 E42 R47 T48	I37-L44 HydrophobicContact CG2-CD2 4.33Å; D40-L44 PolarHBondContact O-N 3.36Å; K41-L44 WeakPolarHBondContact O-CB 3.45Å; K41-L44 PolarHBondContact O-N 3.27Å; E42-L44 VanDerWaalsContact C-N 3.3Å; E42-L44 PolarHBondContact O-N 3.08Å; L44-R47 PolarHBondContact O-N 3.1Å; L44-T48 PolarHBondContact O-N 3.21Å; L44-T48 PolarHBondContact O-OG1 2.92Å
45	L	89.4	Confident	86.7	Confident	78 Å²	78	91.7 Å²	91.7	41%	0.408	44%	0.435	S	S	.	.	H	α-helix	trans	-63.4	-48.7	176.1	-74.5	171.5	0	0	0	112	K41 E42 R47 T48 Q49	K41-L45 HydrophobicContact CG-CD1 4.28Å; K41-L45 HydrophobicContact CG-CG 4.49Å; K41-L45 WeakPolarHBondContact O-CG 3.37Å; K41-L45 PolarHBondContact O-N 3Å; E42-L45 PolarHBondContact O-N 3.29Å; L45-R47 PolarHBondContact O-N 3.12Å; L45-T48 PolarHBondContact O-N 3.41Å; L45-T48 VanDerWaalsContact O-N 3.1Å; L45-T48 PolarHBondContact O-OG1 2.83Å; L45-Q49 WeakPolarHBondContact O-CB 3.48Å; L45-Q49 WeakPolarHBondContact O-CG 3.34Å; L45-Q49 PolarHBondContact O-N 2.91Å
46	R	88.8	Confident	85.9	Confident	108 Å²	108	93.8 Å²	93.8	41%	0.408	44%	0.435	S	S	.	.	H	α-helix	trans	-57.2	-40.8	177.4	-73.4	-168.9	178.4	104.5	6.8	111.8	E42 R43 T48 Q49 T50 L91	E42-R46 VanDerWaalsContact CD-CZ 3.4Å; E42-R46 VanDerWaalsContact CD-NH2 3.28Å; E42-R46 VanDerWaalsContact CG-NH1 3.35Å; E42-R46 WeakPolarHBondContact O-CG 3.43Å; E42-R46 PolarHBondContact O-N 3.27Å; E42-R46 IonicContact OE1-CZ 3.3Å; E42-R46 VanDerWaalsContact OE1-CZ 3.23Å; E42-R46 IonicContact OE1-NH1 2.78Å; E42-R46 PolarHBondContact OE1-NH1 3.27Å; E42-R46 VanDerWaalsContact OE1-NH1 3.16Å; E42-R46 IonicContact OE1-NH2 3.75Å; E42-R46 PolarHBondContact OE1-NH2 3.17Å; E42-R46 IonicContact OE2-CZ 3.94Å; E42-R46 IonicContact OE2-NH1 3.79Å; E42-R46 PolarHBondContact OE2-NH1 3.41Å; E42-R46 IonicContact OE2-NH2 2.75Å; R43-R46 PolarHBondContact O-N 3.21Å; R46-T48 VanDerWaalsContact C-N 3.3Å; R46-T48 PolarHBondContact O-N 3.32Å; R46-Q49 PolarHBondContact O-N 2.92Å; R46-T50 PolarHBondContact O-N 3.22Å; R46-T50 VanDerWaalsContact O-N 3.16Å; R46-T50 PolarHBondContact O-OG1 2.81Å; R46-L91 HydrophobicContact CB-CD2 4.07Å; R46-L91 HydrophobicContact CG-CD1 4.01Å; R46-L91 HydrophobicContact CG-CD2 4.27Å
47	R	86.2	Confident	85.4	Confident	119 Å²	119	90.2 Å²	90.2	45%	0.449	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-37.9	179	-170.2	-176.8	76.5	161.5	5.3	112.6	R43 L44 L45 R52 D100	R43-R47 WeakPolarHBondContact O-CB 3.19Å; R43-R47 PolarHBondContact O-N 3.16Å; L44-R47 PolarHBondContact O-N 3.1Å; L45-R47 PolarHBondContact O-N 3.12Å; R47-R52 PolarHBondContact O-NH2 3.14Å; R47-D100 IonicContact CZ-OD2 2.88Å; R47-D100 IonicContact NE-OD2 2.71Å
48	T	89.4	Confident	84.8	Confident	16 Å²	16	93.5 Å²	93.5	10%	0.098	44%	0.439	C	S	.	.	H	α-helix	trans	-83.5	-24.6	178.5	53.9	0	0	0	0	112.8	L44 L45 R46 T50 F96 D97	L44-T48 PolarHBondContact O-N 3.21Å; L44-T48 PolarHBondContact O-OG1 2.92Å; L45-T48 PolarHBondContact O-N 3.41Å; L45-T48 VanDerWaalsContact O-N 3.1Å; L45-T48 PolarHBondContact O-OG1 2.83Å; R46-T48 VanDerWaalsContact C-N 3.3Å; R46-T48 PolarHBondContact O-N 3.32Å; T48-T50 VanDerWaalsContact C-N 3.32Å; T48-F96 HydrophobicContact CG2-CD2 4.32Å; T48-F96 HydrophobicContact CG2-CE2 3.77Å; T48-F96 HydrophobicContact CG2-CZ 4Å; T48-F96 CarbonylContact O-C 3.56Å; T48-F96 WeakPolarHBondContact O-CA 3.44Å; T48-D97 WeakPolarHBondContact O-CB 3.42Å; T48-D97 PolarHBondContact O-N 2.79Å
49	Q	89.9	Confident	84.1	Confident	38 Å²	38	93.5 Å²	93.5	18%	0.178	46%	0.459	C	S	.	.	H	α-helix	trans	-88.6	0.4	178.8	-70.9	172.2	-22.1	0	0	113.2	L45 R46 D92	L45-Q49 WeakPolarHBondContact O-CB 3.48Å; L45-Q49 WeakPolarHBondContact O-CG 3.34Å; L45-Q49 PolarHBondContact O-N 2.91Å; R46-Q49 PolarHBondContact O-N 2.92Å; Q49-D92 WeakPolarHBondContact CB-O 3.26Å; Q49-D92 PolarHBondContact O-N 3.01Å
50	T	85.8	Confident	83.3	Confident	10 Å²	10	90.1 Å²	90.1	6%	0.061	44%	0.441	C	S	.	.	B	Isolated β-bridge	trans	-80.9	123.6	179.8	-60.5	0	0	0	0	110.5	R46 T48 R52 H87 L88	R46-T50 PolarHBondContact O-N 3.22Å; R46-T50 VanDerWaalsContact O-N 3.16Å; R46-T50 PolarHBondContact O-OG1 2.81Å; T48-T50 VanDerWaalsContact C-N 3.32Å; T50-R52 HydrophobicContact CG2-CG 4.02Å; T50-R52 PolarHBondContact O-N 3.1Å; T50-R52 VanDerWaalsContact O-N 3.12Å; T50-H87 WeakPolarHBondContact CG2-O 3.39Å; T50-L88 HydrophobicContact CG2-CD2 4.32Å
51	K	81.5	Confident	82.3	Confident	50 Å²	50	92.1 Å²	92.1	22%	0.217	46%	0.458	C	S	.	.			trans	-80.9	94.5	175.9	-170.5	-179.7	177.2	-174.8	0	111.5	Y55 D90 I95	K51-Y55 WeakPolarHBondContact CE-O 3.15Å; K51-Y55 HydrophobicContact CG-CE1 4.19Å; K51-Y55 PolarHBondContact NZ-O 2.98Å; K51-D90 HydrophobicContact CB-CB 4.48Å; K51-D90 PolarHBondContact N-O 3.06Å; K51-I95 HydrophobicContact CB-CD1 4.08Å; K51-I95 HydrophobicContact CD-CD1 4.01Å; K51-I95 HydrophobicContact CG-CD1 4.07Å
52	R	77.6	Confident	81	Confident	86 Å²	86	92.3 Å²	92.3	33%	0.325	46%	0.461	S	S	.	.			trans	-83.8	-21.1	-177.2	-58	-176.9	-164.6	-177.7	8.2	114.6	R47 T50 D97 D100	R47-R52 PolarHBondContact O-NH2 3.14Å; T50-R52 HydrophobicContact CG2-CG 4.02Å; T50-R52 PolarHBondContact O-N 3.1Å; T50-R52 VanDerWaalsContact O-N 3.12Å; R52-D97 WeakPolarHBondContact CD-OD2 3.34Å; R52-D97 WeakPolarHBondContact CG-OD2 3.26Å; R52-D97 IonicContact CZ-OD2 2.94Å; R52-D97 IonicContact NE-OD2 3.85Å; R52-D97 PolarHBondContact NE-OD2 2.82Å; R52-D97 VanDerWaalsContact NE-OD2 3.17Å; R52-D100 IonicContact CZ-OD1 2.58Å; R52-D100 IonicContact CZ-OD2 2.82Å; R52-D100 VanDerWaalsContact CZ-OD2 3.3Å; R52-D100 IonicContact NH1-OD1 3.09Å; R52-D100 PolarHBondContact NH1-OD1 2.87Å; R52-D100 IonicContact NH1-OD2 2.67Å; R52-D100 PolarHBondContact NH1-OD2 3.44Å; R52-D100 IonicContact NH2-OD2 3.26Å; R52-D100 PolarHBondContact NH2-OD2 3.38Å
53	S	75.9	Confident	79.7	Confident	59 Å²	59	92.1 Å²	92.1	41%	0.413	47%	0.469	S	S	.	.	S	Bend	trans	-111	144.4	-176.2	55.6	0	0	0	0	112.7	Y55	S53-Y55 VanDerWaalsContact O-CD1 3.27Å; S53-Y55 WeakPolarHBondContact O-CD1 3.41Å; S53-Y55 PolarHBondContact O-N 2.84Å; S53-Y55 VanDerWaalsContact O-N 3.09Å; S53-Y55 WeakPolarHBondContact OG-CD1 3.27Å; S53-Y55 WeakPolarHBondContact OG-CE1 3.41Å
54	V	74.2	Confident	77.8	Confident	161 Å²	161	87.8 Å²	87.8	98%	0.976	47%	0.472	S	S	*	.			trans	-84	87.1	-177.4	-172.1	0	0	0	0	109.3
55	Y	75.2	Confident	75.8	Confident	103 Å²	103	89.5 Å²	89.5	40%	0.404	50%	0.495	S	S	.	.			trans	-133.1	156	171.6	65.2	-86.7	0	0	0	111.6	K51 S53 V57	K51-Y55 WeakPolarHBondContact CE-O 3.15Å; K51-Y55 HydrophobicContact CG-CE1 4.19Å; K51-Y55 PolarHBondContact NZ-O 2.98Å; S53-Y55 VanDerWaalsContact O-CD1 3.27Å; S53-Y55 WeakPolarHBondContact O-CD1 3.41Å; S53-Y55 PolarHBondContact O-N 2.84Å; S53-Y55 VanDerWaalsContact O-N 3.09Å; S53-Y55 WeakPolarHBondContact OG-CD1 3.27Å; S53-Y55 WeakPolarHBondContact OG-CE1 3.41Å; Y55-V57 HydrophobicContact CD2-CG2 4.32Å; Y55-V57 HydrophobicContact CE2-CG2 3.8Å
56	R	77.2	Confident	73.7	Confident	149 Å²	149	94.1 Å²	94.1	56%	0.562	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-85.3	124.1	173.7	-179	174.5	177.3	160.9	4.1	108.9	E62	R56-E62 IonicContact CZ-OE2 3.23Å; R56-E62 VanDerWaalsContact CZ-OE2 3.27Å; R56-E62 IonicContact NH1-OE1 3.09Å; R56-E62 IonicContact NH1-OE2 3.16Å; R56-E62 PolarHBondContact NH1-OE2 3.26Å; R56-E62 IonicContact NH2-OE2 3.01Å; R56-E62 PolarHBondContact NH2-OE2 3.12Å; R56-E62 VanDerWaalsContact NH2-OE2 3.09Å
57	V	78.8	Confident	71.4	Confident	36 Å²	36	94.5 Å²	94.5	22%	0.218	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-77.6	124.5	169.6	-178.3	0	0	0	0	107	Y55 K60 I95	Y55-V57 HydrophobicContact CD2-CG2 4.32Å; Y55-V57 HydrophobicContact CE2-CG2 3.8Å; V57-K60 HydrophobicContact CB-CD 4.44Å; V57-K60 HydrophobicContact CB-CG 4.29Å; V57-K60 HydrophobicContact CG1-CD 4.35Å; V57-K60 HydrophobicContact CG1-CG 4.1Å; V57-I95 HydrophobicContact CG2-CD1 4.31Å
58	L	76.8	Confident	69.4	Low	158 Å²	158	94.9 Å²	94.9	83%	0.827	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	140.4	176.8	-61.3	176.7	0	0	0	109.2	K60	L58-K60 VanDerWaalsContact C-N 3.33Å
59	G	76.3	Confident	67.1	Low	86 Å²	86	99.6 Å²	99.6	89%	0.887	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.3	-15.7	-178.4	0	0	0	0	0	115.1
60	K	75.7	Confident	64.6	Low	79 Å²	79	106.5 Å²	106.5	34%	0.343	61%	0.609	S	S	.	*	S	Bend	trans	-84	138.1	167.8	-62.3	-158	175.7	-176.9	0	110	V57 L58 E62 D92 E94	V57-K60 HydrophobicContact CB-CD 4.44Å; V57-K60 HydrophobicContact CB-CG 4.29Å; V57-K60 HydrophobicContact CG1-CD 4.35Å; V57-K60 HydrophobicContact CG1-CG 4.1Å; L58-K60 VanDerWaalsContact C-N 3.33Å; K60-E62 PolarHBondContact O-N 3.35Å; K60-D92 IonicContact NZ-OD1 3.77Å; K60-D92 PolarHBondContact NZ-OD1 3.42Å; K60-D92 IonicContact NZ-OD2 3.27Å; K60-D92 PolarHBondContact NZ-OD2 3.15Å; K60-E94 WeakPolarHBondContact CE-OE2 3.08Å; K60-E94 IonicContact NZ-OE2 2.77Å; K60-E94 PolarHBondContact NZ-OE2 3.06Å
61	P	70.5	Confident	62.4	Low	116 Å²	116	111.4 Å²	111.4	75%	0.753	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-55.3	141.1	174.3	24.1	-32.3	0	0	0	108.5	P63	P61-P63 WeakPolarHBondContact O-CD 3.47Å; P61-P63 VanDerWaalsContact O-N 3.07Å
62	E	64.3	Low	60.6	Low	131 Å²	131	116.5 Å²	116.5	61%	0.612	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-55.1	120	177	-169.4	152	175.9	0	0	107.6	R56 K60 A64	R56-E62 IonicContact CZ-OE2 3.23Å; R56-E62 VanDerWaalsContact CZ-OE2 3.27Å; R56-E62 IonicContact NH1-OE1 3.09Å; R56-E62 IonicContact NH1-OE2 3.16Å; R56-E62 PolarHBondContact NH1-OE2 3.26Å; R56-E62 IonicContact NH2-OE2 3.01Å; R56-E62 PolarHBondContact NH2-OE2 3.12Å; R56-E62 VanDerWaalsContact NH2-OE2 3.09Å; K60-E62 PolarHBondContact O-N 3.35Å; E62-A64 PolarHBondContact O-N 3.45Å
63	P	62.4	Low	58.7	Low	110 Å²	110	118.7 Å²	118.7	71%	0.714	70%	0.698	S	S	*	*			trans	-58.4	115	177.5	22.8	-31.1	0	0	0	105.9	P61 A65	P61-P63 WeakPolarHBondContact O-CD 3.47Å; P61-P63 VanDerWaalsContact O-N 3.07Å; P63-A65 PolarHBondContact O-N 3.4Å; P63-A65 VanDerWaalsContact O-N 3.07Å
64	A	48.6	Very low	57.3	Low	89 Å²	89	119.7 Å²	119.7	74%	0.736	72%	0.718	S	S	*	*			trans	-48.7	123.7	171.8	0	0	0	0	0	106	E62 Q66	E62-A64 PolarHBondContact O-N 3.45Å; A64-Q66 PolarHBondContact O-N 3.37Å
65	A	48.3	Very low	55.6	Low	97 Å²	97	120.6 Å²	120.6	80%	0.802	71%	0.712	S	S	*	*			trans	-49.1	111.7	177	0	0	0	0	0	106.8	P63	P63-A65 PolarHBondContact O-N 3.4Å; P63-A65 VanDerWaalsContact O-N 3.07Å
66	Q	44.4	Very low	53.9	Low	176 Å²	176	121 Å²	121	82%	0.822	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-58	130.5	169.3	-70.7	-163.5	-0.5	0	0	105.5	A64 V68	A64-Q66 PolarHBondContact O-N 3.37Å; Q66-V68 PolarHBondContact O-N 3.23Å
67	P	40.9	Very low	52.4	Low	116 Å²	116	122.7 Å²	122.7	75%	0.753	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-54.6	123.7	177.7	22.7	-30.7	0	0	0	106.6	P69	P67-P69 WeakPolarHBondContact O-CD 3.41Å; P67-P69 VanDerWaalsContact O-N 3.13Å
68	V	42.9	Very low	50.6	Low	126 Å²	126	128.1 Å²	128.1	76%	0.764	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-48.5	122.4	160.3	-166.3	0	0	0	0	104.3	Q66 E70	Q66-V68 PolarHBondContact O-N 3.23Å; V68-E70 PolarHBondContact O-N 3.46Å
69	P	41.7	Very low	49	Very low	116 Å²	116	127 Å²	127	75%	0.753	76%	0.761	S	S	*	*			trans	-57.2	111.3	175.9	-12.5	23.2	0	0	0	105.5	P67 S71	P67-P69 WeakPolarHBondContact O-CD 3.41Å; P67-P69 VanDerWaalsContact O-N 3.13Å; P69-S71 VanDerWaalsContact C-N 3.34Å; P69-S71 PolarHBondContact O-N 2.98Å
70	E	38.3	Very low	47.4	Very low	183 Å²	183	128.9 Å²	128.9	86%	0.855	76%	0.758	S	S	*	*			trans	-61	105.5	173.9	-143.8	171.9	-164.7	0	0	104.5	V68 L72	V68-E70 PolarHBondContact O-N 3.46Å; E70-L72 PolarHBondContact O-N 3.04Å
71	S	39.6	Very low	45.9	Very low	113 Å²	113	133.2 Å²	133.2	79%	0.79	78%	0.779	S	S	*	*			trans	-60.2	104.2	177.3	43.4	0	0	0	0	107.5	P69	P69-S71 VanDerWaalsContact C-N 3.34Å; P69-S71 PolarHBondContact O-N 2.98Å
72	L	42.1	Very low	44.8	Very low	156 Å²	156	131.5 Å²	131.5	82%	0.817	78%	0.775	S	S	*	*			trans	-59.3	138	169.4	-72.3	169.5	0	0	0	108.6	E70 G74	E70-L72 PolarHBondContact O-N 3.04Å; L72-G74 PolarHBondContact O-N 2.8Å; L72-G74 VanDerWaalsContact O-N 3.15Å
73	P	38	Very low	44.1	Very low	133 Å²	133	129.8 Å²	129.8	86%	0.864	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	107.4	-178.9	16.7	-7.5	0	0	0	109.2
74	G	46.6	Very low	43.6	Very low	80 Å²	80	128 Å²	128	83%	0.825	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.1	-2.1	167.5	0	0	0	0	0	120.3	L72	L72-G74 PolarHBondContact O-N 2.8Å; L72-G74 VanDerWaalsContact O-N 3.15Å
75	E	39.8	Very low	43.7	Very low	180 Å²	180	128.8 Å²	128.8	84%	0.841	76%	0.762	S	S	*	*	S	Bend	trans	-107.9	145.8	176.6	-91.2	-172.5	149.5	0	0	112.8	E77	E75-E77 PolarHBondContact O-N 2.88Å
76	P	39.8	Very low	44	Very low	112 Å²	112	126.4 Å²	126.4	73%	0.727	74%	0.742	S	S	*	*			trans	-60.8	133	-174.6	25.7	-33.4	0	0	0	110.8	I78	P76-I78 PolarHBondContact O-N 3.15Å
77	E	43.8	Very low	44.5	Very low	184 Å²	184	121.5 Å²	121.5	86%	0.86	72%	0.719	S	S	*	*			trans	-54.1	87.9	-176.1	-165.1	178.1	-165.9	0	0	112.4	E75 L79	E75-E77 PolarHBondContact O-N 2.88Å; E77-L79 PolarHBondContact O-N 3.26Å
78	I	42.4	Very low	45.3	Very low	149 Å²	149	120.1 Å²	120.1	76%	0.764	71%	0.705	S	S	*	*			trans	-82.3	103	162.1	-51.6	170	0	0	0	105.4	P76	P76-I78 PolarHBondContact O-N 3.15Å
79	L	42.8	Very low	46	Very low	135 Å²	135	122.7 Å²	122.7	71%	0.707	71%	0.706	S	S	*	*			trans	-31.6	129	170.7	-72.5	158.8	0	0	0	110.4	E77 Q81	E77-L79 PolarHBondContact O-N 3.26Å; L79-Q81 VanDerWaalsContact C-N 3.33Å; L79-Q81 PolarHBondContact O-N 3.11Å
80	P	42.3	Very low	47.2	Very low	125 Å²	125	122 Å²	122	81%	0.812	70%	0.696	S	S	*	*			trans	-60.1	103.3	174.8	24.1	-31.3	0	0	0	106.9	A82	P80-A82 PolarHBondContact O-N 2.95Å
81	Q	45.3	Very low	49.1	Very low	170 Å²	170	117 Å²	117	79%	0.794	68%	0.675	S	S	*	*			trans	-59.9	95.6	163.6	-68.8	-175.6	10.8	0	0	104	L79 P83	L79-Q81 VanDerWaalsContact C-N 3.33Å; L79-Q81 PolarHBondContact O-N 3.11Å; Q81-P83 WeakPolarHBondContact O-CD 3.25Å
82	A	46.1	Very low	51.1	Low	81 Å²	81	113 Å²	113	67%	0.669	65%	0.645	S	S	*	*			trans	-47.2	114.3	165.3	0	0	0	0	0	104.1	P80 A84	P80-A82 PolarHBondContact O-N 2.95Å; A82-A84 PolarHBondContact O-N 2.92Å
83	P	50.5	Low	53.2	Low	94 Å²	94	113.6 Å²	113.6	61%	0.61	64%	0.643	S	S	*	*			trans	-73.3	87.1	-174.9	29.6	-32.8	0	0	0	104.5	Q81 N85 A86	Q81-P83 WeakPolarHBondContact O-CD 3.25Å; P83-N85 PolarHBondContact O-N 3.47Å; P83-A86 HydrophobicContact CB-CB 3.71Å; P83-A86 HydrophobicContact CG-CB 3.56Å; P83-A86 PolarHBondContact O-N 2.89Å
84	A	52.6	Low	55.4	Low	74 Å²	74	114.6 Å²	114.6	61%	0.612	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-11.4	178.8	0	0	0	0	0	111	A82 H87	A82-A84 PolarHBondContact O-N 2.92Å; A84-H87 PolarHBondContact O-CE1 3.39Å; A84-H87 PolarHBondContact O-ND1 2.94Å
85	N	49.4	Very low	57.2	Low	104 Å²	104	111.7 Å²	111.7	56%	0.556	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	5.7	-179.7	-62.4	-46.4	0	0	0	114.5	P83 H87 L88	P83-N85 PolarHBondContact O-N 3.47Å; N85-H87 VanDerWaalsContact C-N 3.3Å; N85-H87 PolarHBondContact O-N 3.26Å; N85-L88 HydrophobicContact CB-CD1 3.81Å; N85-L88 HydrophobicContact CB-CG 4.39Å; N85-L88 WeakPolarHBondContact O-CB 3.33Å; N85-L88 PolarHBondContact O-N 3.05Å; N85-L88 VanDerWaalsContact O-N 3.14Å; N85-L88 VanDerWaalsContact OD1-CD1 3.23Å; N85-L88 WeakPolarHBondContact OD1-CD1 3.34Å
86	A	54.8	Low	59.6	Low	48 Å²	48	110.1 Å²	110.1	40%	0.397	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-62.1	-39.8	178.3	0	0	0	0	0	111.9	P83 L88 K89	P83-A86 HydrophobicContact CB-CB 3.71Å; P83-A86 HydrophobicContact CG-CB 3.56Å; P83-A86 PolarHBondContact O-N 2.89Å; A86-L88 PolarHBondContact O-N 3.43Å; A86-K89 WeakPolarHBondContact O-CB 3.08Å; A86-K89 PolarHBondContact O-N 2.88Å; A86-K89 VanDerWaalsContact O-N 3.08Å
87	H	55.8	Low	61.9	Low	72 Å²	72	105.8 Å²	105.8	33%	0.333	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-64.8	-19.4	177	74.6	-82.4	0	0	0	113.5	T50 A84 N85 K89 D90	T50-H87 WeakPolarHBondContact CG2-O 3.39Å; A84-H87 PolarHBondContact O-CE1 3.39Å; A84-H87 PolarHBondContact O-ND1 2.94Å; N85-H87 VanDerWaalsContact C-N 3.3Å; N85-H87 PolarHBondContact O-N 3.26Å; H87-K89 PolarHBondContact O-N 3.25Å; H87-D90 PolarHBondContact O-N 3.24Å
88	L	56.9	Low	64.1	Low	88 Å²	88	99.8 Å²	99.8	46%	0.461	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-71	-9.9	174.9	-62	177.9	0	0	0	112.7	T50 N85 A86	T50-L88 HydrophobicContact CG2-CD2 4.32Å; N85-L88 HydrophobicContact CB-CD1 3.81Å; N85-L88 HydrophobicContact CB-CG 4.39Å; N85-L88 WeakPolarHBondContact O-CB 3.33Å; N85-L88 PolarHBondContact O-N 3.05Å; N85-L88 VanDerWaalsContact O-N 3.14Å; N85-L88 VanDerWaalsContact OD1-CD1 3.23Å; N85-L88 WeakPolarHBondContact OD1-CD1 3.34Å; A86-L88 PolarHBondContact O-N 3.43Å
89	K	57.9	Low	66.1	Low	179 Å²	179	95.9 Å²	95.9	78%	0.778	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-97.3	-14.7	177.5	-61.1	-174.2	178.4	-177	0	113.3	A86 H87 L91	A86-K89 WeakPolarHBondContact O-CB 3.08Å; A86-K89 PolarHBondContact O-N 2.88Å; A86-K89 VanDerWaalsContact O-N 3.08Å; H87-K89 PolarHBondContact O-N 3.25Å; K89-L91 VanDerWaalsContact C-N 3.27Å; K89-L91 PolarHBondContact O-N 2.93Å
90	D	67.6	Low	68.1	Low	101 Å²	101	92 Å²	92	54%	0.54	50%	0.498	S	S	.	.			trans	-84.8	74.6	175.6	-83.3	-6.5	0	0	0	109.5	K51 H87	K51-D90 HydrophobicContact CB-CB 4.48Å; K51-D90 PolarHBondContact N-O 3.06Å; H87-D90 PolarHBondContact O-N 3.24Å
91	L	76.7	Confident	70.1	Confident	80 Å²	80	91.5 Å²	91.5	42%	0.419	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-80.8	119.6	167.4	-63.7	178.2	0	0	0	108.5	R46 K89	R46-L91 HydrophobicContact CB-CD2 4.07Å; R46-L91 HydrophobicContact CG-CD1 4.01Å; R46-L91 HydrophobicContact CG-CD2 4.27Å; K89-L91 VanDerWaalsContact C-N 3.27Å; K89-L91 PolarHBondContact O-N 2.93Å
92	D	82.6	Confident	72.1	Confident	29 Å²	29	89.8 Å²	89.8	16%	0.155	47%	0.47	C	S	.	.			trans	-123.9	111.7	176.5	-169.6	-12.5	0	0	0	108.7	Q49 K60 E94 I95	Q49-D92 WeakPolarHBondContact CB-O 3.26Å; Q49-D92 PolarHBondContact O-N 3.01Å; K60-D92 IonicContact NZ-OD1 3.77Å; K60-D92 PolarHBondContact NZ-OD1 3.42Å; K60-D92 IonicContact NZ-OD2 3.27Å; K60-D92 PolarHBondContact NZ-OD2 3.15Å; D92-E94 PolarHBondContact O-N 3.49Å; D92-E94 PolarHBondContact OD1-N 3.46Å; D92-I95 HydrophobicContact CB-CB 4.1Å; D92-I95 HydrophobicContact CB-CD1 3.65Å; D92-I95 HydrophobicContact CB-CG1 3.78Å; D92-I95 PolarHBondContact O-N 2.78Å; D92-I95 WeakPolarHBondContact OD2-CD1 3.5Å
93	E	84.7	Confident	74	Confident	168 Å²	168	89.7 Å²	89.7	79%	0.785	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.1	-176.1	-63.8	-175.8	178.4	0	0	113.1	I95	E93-I95 VanDerWaalsContact C-N 3.29Å
94	E	84.9	Confident	75.5	Confident	154 Å²	154	90.7 Å²	90.7	72%	0.72	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.7	177.6	-59.7	-178.3	139.6	0	0	112.7	K60 D92	K60-E94 WeakPolarHBondContact CE-OE2 3.08Å; K60-E94 IonicContact NZ-OE2 2.77Å; K60-E94 PolarHBondContact NZ-OE2 3.06Å; D92-E94 PolarHBondContact O-N 3.49Å; D92-E94 PolarHBondContact OD1-N 3.46Å
95	I	85.6	Confident	77	Confident	18 Å²	18	91 Å²	91	9%	0.092	44%	0.443	C	S	.	.			trans	-95.6	138.9	179.6	-64.6	-179.2	0	0	0	110.2	K51 V57 D92 E93	K51-I95 HydrophobicContact CB-CD1 4.08Å; K51-I95 HydrophobicContact CD-CD1 4.01Å; K51-I95 HydrophobicContact CG-CD1 4.07Å; V57-I95 HydrophobicContact CG2-CD1 4.31Å; D92-I95 HydrophobicContact CB-CB 4.1Å; D92-I95 HydrophobicContact CB-CD1 3.65Å; D92-I95 HydrophobicContact CB-CG1 3.78Å; D92-I95 PolarHBondContact O-N 2.78Å; D92-I95 WeakPolarHBondContact OD2-CD1 3.5Å; E93-I95 VanDerWaalsContact C-N 3.29Å
96	F	89.8	Confident	78.5	Confident	148 Å²	148	89.1 Å²	89.1	65%	0.649	43%	0.433	S	S	*	.			trans	-128.3	103.9	168	-167.5	-94.6	0	0	0	109.8	T48 D98	T48-F96 HydrophobicContact CG2-CD2 4.32Å; T48-F96 HydrophobicContact CG2-CE2 3.77Å; T48-F96 HydrophobicContact CG2-CZ 4Å; T48-F96 CarbonylContact O-C 3.56Å; T48-F96 WeakPolarHBondContact O-CA 3.44Å; F96-D98 HydrophobicContact CD1-CB 4.24Å; F96-D98 HydrophobicContact CE1-CB 3.96Å
97	D	87.8	Confident	79.7	Confident	21 Å²	21	93 Å²	93	11%	0.112	44%	0.437	C	S	.	.			trans	-92.1	107.2	177.2	-178.5	12.6	0	0	0	110.4	T48 R52 D99	T48-D97 WeakPolarHBondContact O-CB 3.42Å; T48-D97 PolarHBondContact O-N 2.79Å; R52-D97 WeakPolarHBondContact CD-OD2 3.34Å; R52-D97 WeakPolarHBondContact CG-OD2 3.26Å; R52-D97 IonicContact CZ-OD2 2.94Å; R52-D97 IonicContact NE-OD2 3.85Å; R52-D97 PolarHBondContact NE-OD2 2.82Å; R52-D97 VanDerWaalsContact NE-OD2 3.17Å; D97-D99 VanDerWaalsContact OD1-CB 3.27Å; D97-D99 WeakPolarHBondContact OD1-CB 3.11Å; D97-D99 PolarHBondContact OD1-N 2.94Å; D97-D99 VanDerWaalsContact OD1-N 3.1Å
98	D	89.8	Confident	80.8	Confident	57 Å²	57	92.9 Å²	92.9	31%	0.305	44%	0.436	S	S	.	.			trans	-105	15.3	177.3	61.9	-6.7	0	0	0	113.3	F96 D100 F101 Y102	F96-D98 HydrophobicContact CD1-CB 4.24Å; F96-D98 HydrophobicContact CE1-CB 3.96Å; D98-D100 VanDerWaalsContact C-N 3.3Å; D98-D100 PolarHBondContact O-N 3.29Å; D98-F101 WeakPolarHBondContact O-CB 3.48Å; D98-F101 PolarHBondContact O-N 2.93Å; D98-Y102 HydrophobicContact CB-CE2 4.26Å; D98-Y102 WeakPolarHBondContact O-CD2 3.23Å; D98-Y102 PolarHBondContact O-N 3.09Å; D98-Y102 WeakPolarHBondContact OD1-CE2 3.34Å; D98-Y102 WeakPolarHBondContact OD2-CE2 3.34Å; D98-Y102 PolarHBondContact OD2-OH 3.26Å
99	D	84.8	Confident	81.9	Confident	67 Å²	67	93.7 Å²	93.7	36%	0.358	44%	0.441	S	S	.	.	H	α-helix	trans	-56.1	-43.1	179.6	-84.4	-9	0	0	0	111.9	D97 F101 Y102 H103	D97-D99 VanDerWaalsContact OD1-CB 3.27Å; D97-D99 WeakPolarHBondContact OD1-CB 3.11Å; D97-D99 PolarHBondContact OD1-N 2.94Å; D97-D99 VanDerWaalsContact OD1-N 3.1Å; D99-F101 PolarHBondContact O-N 3.39Å; D99-Y102 PolarHBondContact O-N 2.93Å; D99-H103 WeakPolarHBondContact O-CB 3.42Å; D99-H103 PolarHBondContact O-N 2.89Å; D99-H103 PolarHBondContact O-ND1 2.82Å
100	D	83.3	Confident	82.8	Confident	55 Å²	55	86.8 Å²	86.8	29%	0.294	41%	0.412	S	S	.	.	H	α-helix	trans	-60	-35.5	178.4	-72.7	-24.1	0	0	0	112.2	R47 R52 D98 Q104	R47-D100 IonicContact CZ-OD2 2.88Å; R47-D100 IonicContact NE-OD2 2.71Å; R52-D100 IonicContact CZ-OD1 2.58Å; R52-D100 IonicContact CZ-OD2 2.82Å; R52-D100 VanDerWaalsContact CZ-OD2 3.3Å; R52-D100 IonicContact NH1-OD1 3.09Å; R52-D100 PolarHBondContact NH1-OD1 2.87Å; R52-D100 IonicContact NH1-OD2 2.67Å; R52-D100 PolarHBondContact NH1-OD2 3.44Å; R52-D100 IonicContact NH2-OD2 3.26Å; R52-D100 PolarHBondContact NH2-OD2 3.38Å; D98-D100 VanDerWaalsContact C-N 3.3Å; D98-D100 PolarHBondContact O-N 3.29Å; D100-Q104 PolarHBondContact O-N 2.67Å
101	F	85.8	Confident	83.2	Confident	114 Å²	114	86.6 Å²	86.6	50%	0.5	41%	0.408	S	S	.	.	H	α-helix	trans	-68.5	-47.4	179.4	171.3	-104.7	0	0	0	110.8	D98 D99 H103 Q104 L105	D98-F101 WeakPolarHBondContact O-CB 3.48Å; D98-F101 PolarHBondContact O-N 2.93Å; D99-F101 PolarHBondContact O-N 3.39Å; F101-H103 VanDerWaalsContact C-N 3.31Å; F101-H103 PolarHBondContact O-N 3.05Å; F101-Q104 WeakPolarHBondContact O-CB 3.36Å; F101-Q104 PolarHBondContact O-N 3.46Å; F101-L105 HydrophobicContact CD1-CD1 4.16Å; F101-L105 HydrophobicContact CE1-CD1 3.49Å; F101-L105 VanDerWaalsContact CE1-CD1 3.49Å; F101-L105 HydrophobicContact CE1-CG 4.3Å; F101-L105 HydrophobicContact CE2-CD1 4.29Å; F101-L105 HydrophobicContact CE2-CG 4.32Å; F101-L105 HydrophobicContact CZ-CD1 3.58Å; F101-L105 HydrophobicContact CZ-CD2 4.39Å; F101-L105 HydrophobicContact CZ-CG 4.09Å; F101-L105 PolarHBondContact O-N 3.15Å
102	Y	87.5	Confident	83.1	Confident	133 Å²	133	88.2 Å²	88.2	52%	0.522	41%	0.409	S	S	.	.	H	α-helix	trans	-65.6	-35	176	-68.8	-65	0	0	0	112.6	D98 D99 Q104 L105 L106	D98-Y102 HydrophobicContact CB-CE2 4.26Å; D98-Y102 WeakPolarHBondContact O-CD2 3.23Å; D98-Y102 PolarHBondContact O-N 3.09Å; D98-Y102 WeakPolarHBondContact OD1-CE2 3.34Å; D98-Y102 WeakPolarHBondContact OD2-CE2 3.34Å; D98-Y102 PolarHBondContact OD2-OH 3.26Å; D99-Y102 PolarHBondContact O-N 2.93Å; Y102-Q104 VanDerWaalsContact C-N 3.32Å; Y102-Q104 PolarHBondContact O-N 3.19Å; Y102-L105 HydrophobicContact CD1-CD1 4.44Å; Y102-L105 PolarHBondContact O-N 2.93Å; Y102-L106 VanDerWaalsContact O-CB 3.3Å; Y102-L106 WeakPolarHBondContact O-CB 3.49Å; Y102-L106 PolarHBondContact O-N 2.93Å
103	H	84.6	Confident	82.7	Confident	80 Å²	80	94.8 Å²	94.8	37%	0.37	44%	0.436	S	S	.	.	H	α-helix	trans	-61.3	-40.4	172.9	-76.3	117.5	0	0	0	112.4	D99 F101 R107 I139	D99-H103 WeakPolarHBondContact O-CB 3.42Å; D99-H103 PolarHBondContact O-N 2.89Å; D99-H103 PolarHBondContact O-ND1 2.82Å; F101-H103 VanDerWaalsContact C-N 3.31Å; F101-H103 PolarHBondContact O-N 3.05Å; H103-R107 WeakPolarHBondContact O-CB 3.49Å; H103-R107 PolarHBondContact O-N 3.23Å; H103-I139 WeakPolarHBondContact NE2-CD1 3.31Å
104	Q	82.5	Confident	81.9	Confident	115 Å²	115	88.4 Å²	88.4	54%	0.537	41%	0.408	S	S	.	.	H	α-helix	trans	-65	-47.6	176	-177.9	62.8	22	0	0	111.7	D100 F101 Y102 L106 R107 E108	D100-Q104 PolarHBondContact O-N 2.67Å; F101-Q104 WeakPolarHBondContact O-CB 3.36Å; F101-Q104 PolarHBondContact O-N 3.46Å; Y102-Q104 VanDerWaalsContact C-N 3.32Å; Y102-Q104 PolarHBondContact O-N 3.19Å; Q104-L106 VanDerWaalsContact C-N 3.29Å; Q104-L106 PolarHBondContact O-N 3.31Å; Q104-R107 PolarHBondContact O-N 2.94Å; Q104-E108 WeakPolarHBondContact O-CB 3.3Å; Q104-E108 PolarHBondContact O-N 3.43Å
105	L	83.8	Confident	80.9	Confident	80 Å²	80	84.2 Å²	84.2	42%	0.419	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-41	177.6	-70.3	179.4	0	0	0	112	F101 Y102 E108 L109	F101-L105 HydrophobicContact CD1-CD1 4.16Å; F101-L105 HydrophobicContact CE1-CD1 3.49Å; F101-L105 VanDerWaalsContact CE1-CD1 3.49Å; F101-L105 HydrophobicContact CE1-CG 4.3Å; F101-L105 HydrophobicContact CE2-CD1 4.29Å; F101-L105 HydrophobicContact CE2-CG 4.32Å; F101-L105 HydrophobicContact CZ-CD1 3.58Å; F101-L105 HydrophobicContact CZ-CD2 4.39Å; F101-L105 HydrophobicContact CZ-CG 4.09Å; F101-L105 PolarHBondContact O-N 3.15Å; Y102-L105 HydrophobicContact CD1-CD1 4.44Å; Y102-L105 PolarHBondContact O-N 2.93Å; L105-E108 PolarHBondContact O-N 3.26Å; L105-L109 WeakPolarHBondContact O-CB 3.17Å; L105-L109 PolarHBondContact O-N 3.23Å
106	L	81.4	Confident	79.8	Confident	65 Å²	65	88.1 Å²	88.1	34%	0.34	43%	0.425	S	S	.	.	H	α-helix	trans	-67.3	-41.6	178	-178.3	57	0	0	0	111.9	Y102 Q104 E108 L109 I110 L135	Y102-L106 VanDerWaalsContact O-CB 3.3Å; Y102-L106 WeakPolarHBondContact O-CB 3.49Å; Y102-L106 PolarHBondContact O-N 2.93Å; Q104-L106 VanDerWaalsContact C-N 3.29Å; Q104-L106 PolarHBondContact O-N 3.31Å; L106-E108 VanDerWaalsContact C-N 3.34Å; L106-L109 HydrophobicContact CD1-CD2 4.45Å; L106-L109 PolarHBondContact O-N 2.58Å; L106-I110 HydrophobicContact CD1-CD1 4.26Å; L106-I110 HydrophobicContact CD1-CG1 4.39Å; L106-I110 HydrophobicContact CG-CD1 4.11Å; L106-I110 VanDerWaalsContact O-CG1 3.28Å; L106-I110 WeakPolarHBondContact O-CG1 3.28Å; L106-I110 PolarHBondContact O-N 3.44Å; L106-L135 HydrophobicContact CD2-CD2 3.37Å; L106-L135 HydrophobicContact CG-CD2 4.38Å
107	R	79.1	Confident	78.4	Confident	130 Å²	130	85.5 Å²	85.5	49%	0.491	42%	0.417	S	S	.	.	H	α-helix	trans	-59.1	-47.8	174.5	-178	-178.4	177.5	122.8	4.1	110.8	H103 Q104 L109 I110 E111	H103-R107 WeakPolarHBondContact O-CB 3.49Å; H103-R107 PolarHBondContact O-N 3.23Å; Q104-R107 PolarHBondContact O-N 2.94Å; R107-L109 VanDerWaalsContact C-N 3.34Å; R107-L109 PolarHBondContact O-N 2.8Å; R107-I110 PolarHBondContact O-N 3.17Å; R107-E111 WeakPolarHBondContact O-CB 3.45Å; R107-E111 PolarHBondContact O-N 3.19Å
108	E	79.4	Confident	77	Confident	68 Å²	68	89.7 Å²	89.7	32%	0.318	44%	0.439	S	S	.	.	H	α-helix	trans	-61.8	-41.7	177.4	-173.4	-177.1	167.4	0	0	111.6	Q104 L105 L106 I110 E111 R112	Q104-E108 WeakPolarHBondContact O-CB 3.3Å; Q104-E108 PolarHBondContact O-N 3.43Å; L105-E108 PolarHBondContact O-N 3.26Å; L106-E108 VanDerWaalsContact C-N 3.34Å; E108-I110 PolarHBondContact O-N 2.91Å; E108-E111 PolarHBondContact O-N 3.36Å; E108-R112 WeakPolarHBondContact O-CB 3.06Å; E108-R112 VanDerWaalsContact O-CG 3.26Å; E108-R112 WeakPolarHBondContact O-CG 2.96Å; E108-R112 PolarHBondContact O-N 2.95Å; E108-R112 IonicContact OE1-CZ 3.99Å; E108-R112 VanDerWaalsContact OE1-CZ 3.26Å; E108-R112 IonicContact OE1-NE 3.65Å; E108-R112 PolarHBondContact OE1-NE 3.32Å; E108-R112 VanDerWaalsContact OE1-NE 3.09Å; E108-R112 IonicContact OE1-NH2 3.72Å; E108-R112 PolarHBondContact OE1-NH2 3.48Å
109	L	80.9	Confident	75.6	Confident	106 Å²	106	93 Å²	93	56%	0.555	46%	0.464	S	S	*	.	H	α-helix	trans	-61.4	-44.4	175.9	178.7	64.9	0	0	0	112	L105 L106 R107 K113	L105-L109 WeakPolarHBondContact O-CB 3.17Å; L105-L109 PolarHBondContact O-N 3.23Å; L106-L109 HydrophobicContact CD1-CD2 4.45Å; L106-L109 PolarHBondContact O-N 2.58Å; R107-L109 VanDerWaalsContact C-N 3.34Å; R107-L109 PolarHBondContact O-N 2.8Å; L109-K113 WeakPolarHBondContact O-CB 3.5Å; L109-K113 PolarHBondContact O-N 2.88Å; L109-K113 VanDerWaalsContact O-N 3.08Å
110	I	77.1	Confident	74.5	Confident	34 Å²	34	96.3 Å²	96.3	17%	0.174	48%	0.482	C	S	.	.	H	α-helix	trans	-62.1	-49.2	176.6	-69.5	166.1	0	0	0	109.5	L106 R107 E108 R112 K113 T114 Q128	L106-I110 HydrophobicContact CD1-CD1 4.26Å; L106-I110 HydrophobicContact CD1-CG1 4.39Å; L106-I110 HydrophobicContact CG-CD1 4.11Å; L106-I110 VanDerWaalsContact O-CG1 3.28Å; L106-I110 WeakPolarHBondContact O-CG1 3.28Å; L106-I110 PolarHBondContact O-N 3.44Å; R107-I110 PolarHBondContact O-N 3.17Å; E108-I110 PolarHBondContact O-N 2.91Å; I110-R112 PolarHBondContact O-N 3.09Å; I110-K113 PolarHBondContact O-N 3.34Å; I110-K113 VanDerWaalsContact O-N 3.14Å; I110-T114 HydrophobicContact CG2-CG2 4.35Å; I110-T114 WeakPolarHBondContact O-CG2 3.48Å; I110-T114 PolarHBondContact O-N 3.24Å; I110-T114 PolarHBondContact O-OG1 2.64Å; I110-Q128 HydrophobicContact CG2-CG 3.93Å
111	E	76.3	Confident	73.6	Confident	96 Å²	96	97.2 Å²	97.2	45%	0.449	49%	0.486	S	S	.	.	H	α-helix	trans	-56.1	-49.4	179	-174.1	164.4	-158.2	0	0	111.3	R107 E108 K113 T114 S115	R107-E111 WeakPolarHBondContact O-CB 3.45Å; R107-E111 PolarHBondContact O-N 3.19Å; E108-E111 PolarHBondContact O-N 3.36Å; E111-K113 VanDerWaalsContact C-N 3.33Å; E111-K113 PolarHBondContact O-N 3.49Å; E111-T114 WeakPolarHBondContact CA-OG1 3.34Å; E111-T114 PolarHBondContact O-N 3.29Å; E111-T114 VanDerWaalsContact O-N 3.14Å; E111-T114 PolarHBondContact O-OG1 2.75Å; E111-T114 VanDerWaalsContact O-OG1 3.05Å; E111-S115 WeakPolarHBondContact O-CB 3.39Å; E111-S115 PolarHBondContact O-N 3.37Å; E111-S115 PolarHBondContact O-OG 3.33Å
112	R	74.3	Confident	72.5	Confident	115 Å²	115	99.6 Å²	99.6	43%	0.434	50%	0.499	S	S	.	.	H	α-helix	trans	-56.5	-42.9	175.2	-72.6	170.7	179.6	-125.6	-1.4	112.9	S16 E108 I110 T114	S16-R112 PolarHBondContact OG-NH2 2.74Å; E108-R112 WeakPolarHBondContact O-CB 3.06Å; E108-R112 VanDerWaalsContact O-CG 3.26Å; E108-R112 WeakPolarHBondContact O-CG 2.96Å; E108-R112 PolarHBondContact O-N 2.95Å; E108-R112 IonicContact OE1-CZ 3.99Å; E108-R112 VanDerWaalsContact OE1-CZ 3.26Å; E108-R112 IonicContact OE1-NE 3.65Å; E108-R112 PolarHBondContact OE1-NE 3.32Å; E108-R112 VanDerWaalsContact OE1-NE 3.09Å; E108-R112 IonicContact OE1-NH2 3.72Å; E108-R112 PolarHBondContact OE1-NH2 3.48Å; I110-R112 PolarHBondContact O-N 3.09Å; R112-T114 VanDerWaalsContact C-N 3.34Å
113	K	72.7	Confident	71.6	Confident	167 Å²	167	97.1 Å²	97.1	73%	0.726	50%	0.498	S	S	*	.	H	α-helix	trans	-71.5	-29.3	-179.7	-170.7	175.9	-179	-178.1	0	112.6	L109 I110 E111 S116	L109-K113 WeakPolarHBondContact O-CB 3.5Å; L109-K113 PolarHBondContact O-N 2.88Å; L109-K113 VanDerWaalsContact O-N 3.08Å; I110-K113 PolarHBondContact O-N 3.34Å; I110-K113 VanDerWaalsContact O-N 3.14Å; E111-K113 VanDerWaalsContact C-N 3.33Å; E111-K113 PolarHBondContact O-N 3.49Å; K113-S116 PolarHBondContact O-OG 2.9Å; K113-S116 VanDerWaalsContact O-OG 3.08Å
114	T	67.7	Low	70.6	Confident	34 Å²	34	94 Å²	94	21%	0.209	49%	0.485	C	S	.	.	H	α-helix	trans	-89.4	-27.7	179.6	53	0	0	0	0	113	I110 E111 R112 S116 L117	I110-T114 HydrophobicContact CG2-CG2 4.35Å; I110-T114 WeakPolarHBondContact O-CG2 3.48Å; I110-T114 PolarHBondContact O-N 3.24Å; I110-T114 PolarHBondContact O-OG1 2.64Å; E111-T114 WeakPolarHBondContact CA-OG1 3.34Å; E111-T114 PolarHBondContact O-N 3.29Å; E111-T114 VanDerWaalsContact O-N 3.14Å; E111-T114 PolarHBondContact O-OG1 2.75Å; E111-T114 VanDerWaalsContact O-OG1 3.05Å; R112-T114 VanDerWaalsContact C-N 3.34Å; T114-S116 PolarHBondContact O-N 3.14Å; T114-L117 WeakPolarHBondContact O-CB 3.26Å; T114-L117 PolarHBondContact O-N 2.76Å
115	S	65.5	Low	69.7	Low	66 Å²	66	94 Å²	94	46%	0.462	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.1	177.1	-64.7	0	0	0	0	114	E111	E111-S115 WeakPolarHBondContact O-CB 3.39Å; E111-S115 PolarHBondContact O-N 3.37Å; E111-S115 PolarHBondContact O-OG 3.33Å
116	S	61.6	Low	69	Low	99 Å²	99	92.3 Å²	92.3	69%	0.692	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.5	171.4	62.2	0	0	0	0	113.7	K113 T114	K113-S116 PolarHBondContact O-OG 2.9Å; K113-S116 VanDerWaalsContact O-OG 3.08Å; T114-S116 PolarHBondContact O-N 3.14Å
117	L	60.1	Low	68.6	Low	94 Å²	94	97.6 Å²	97.6	49%	0.492	50%	0.504	S	S	.	.	S	Bend	trans	-96.3	151.7	174.3	-61.1	165.6	0	0	0	109.3	T114 P119	T114-L117 WeakPolarHBondContact O-CB 3.26Å; T114-L117 PolarHBondContact O-N 2.76Å; L117-P119 WeakPolarHBondContact O-CD 3.49Å
118	D	59.5	Low	68	Low	109 Å²	109	93.1 Å²	93.1	58%	0.583	49%	0.488	S	S	*	.			trans	-51.1	120.8	-175.9	-172.3	-13.8	0	0	0	111.5	N120 D121	D118-N120 PolarHBondContact O-N 3.08Å; D118-N120 PolarHBondContact OD1-N 2.98Å; D118-D121 WeakPolarHBondContact O-CB 3.45Å; D118-D121 PolarHBondContact O-N 3.45Å
119	P	59.4	Low	67.5	Low	125 Å²	125	97.8 Å²	97.8	81%	0.812	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-18	178.2	-25.5	33.9	0	0	0	114.9	L117 D121	L117-P119 WeakPolarHBondContact O-CD 3.49Å; P119-D121 VanDerWaalsContact C-N 3.32Å
120	N	61.9	Low	67.3	Low	138 Å²	138	96.9 Å²	96.9	74%	0.738	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-6.6	178.1	-159	41.8	0	0	0	113.5	D118 Q122	D118-N120 PolarHBondContact O-N 3.08Å; D118-N120 PolarHBondContact OD1-N 2.98Å; N120-Q122 PolarHBondContact O-N 3.25Å; N120-Q122 VanDerWaalsContact O-N 3.08Å
121	D	64.3	Low	67	Low	73 Å²	73	97 Å²	97	39%	0.39	51%	0.505	S	S	.	.			trans	-83.9	85.8	-179.1	-164.6	4.4	0	0	0	111.2	D118 P119 V123 A124	D118-D121 WeakPolarHBondContact O-CB 3.45Å; D118-D121 PolarHBondContact O-N 3.45Å; P119-D121 VanDerWaalsContact C-N 3.32Å; D121-V123 PolarHBondContact O-N 2.93Å; D121-V123 VanDerWaalsContact OD1-CB 3.27Å; D121-V123 WeakPolarHBondContact OD1-CB 3.45Å; D121-V123 PolarHBondContact OD1-N 3.02Å; D121-A124 HydrophobicContact CB-CB 4.08Å; D121-A124 VanDerWaalsContact O-CB 3.31Å; D121-A124 WeakPolarHBondContact O-CB 3.33Å; D121-A124 PolarHBondContact O-N 3.27Å
122	Q	62.8	Low	66.8	Low	164 Å²	164	94.1 Å²	94.1	77%	0.766	49%	0.492	S	S	*	.	H	α-helix	trans	-49.6	-27.4	172.3	-72.3	-82.6	0.4	0	0	112.5	N120 G126	N120-Q122 PolarHBondContact O-N 3.25Å; N120-Q122 VanDerWaalsContact O-N 3.08Å; Q122-G126 PolarHBondContact O-N 3.08Å
123	V	68.4	Low	66.8	Low	81 Å²	81	91.9 Å²	91.9	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-71.4	-32.9	177.4	-171.7	0	0	0	0	111.4	D121 G126 R127	D121-V123 PolarHBondContact O-N 2.93Å; D121-V123 VanDerWaalsContact OD1-CB 3.27Å; D121-V123 WeakPolarHBondContact OD1-CB 3.45Å; D121-V123 PolarHBondContact OD1-N 3.02Å; V123-G126 PolarHBondContact O-N 3.39Å; V123-R127 VanDerWaalsContact O-CG 3.27Å; V123-R127 WeakPolarHBondContact O-CG 3.48Å; V123-R127 PolarHBondContact O-N 2.88Å
124	A	63.7	Low	66.7	Low	14 Å²	14	89.7 Å²	89.7	12%	0.116	48%	0.477	C	S	.	.	H	α-helix	trans	-66.5	-40.7	177.4	0	0	0	0	0	112.1	D121 R127 Q128	D121-A124 HydrophobicContact CB-CB 4.08Å; D121-A124 VanDerWaalsContact O-CB 3.31Å; D121-A124 WeakPolarHBondContact O-CB 3.33Å; D121-A124 PolarHBondContact O-N 3.27Å; A124-R127 PolarHBondContact O-N 3.33Å; A124-Q128 PolarHBondContact O-N 3.06Å
125	M	63.8	Low	66.5	Low	117 Å²	117	91.2 Å²	91.2	58%	0.576	48%	0.483	S	S	*	.	H	α-helix	trans	-63.8	-42.6	173.2	-73.7	-67.8	-170.3	0	0	112	R127 Q128 W129	M125-R127 VanDerWaalsContact C-N 3.33Å; M125-R127 PolarHBondContact O-N 2.97Å; M125-Q128 WeakPolarHBondContact O-CB 3.41Å; M125-Q128 PolarHBondContact O-N 3.36Å; M125-Q128 PolarHBondContact SD-OE1 3.13Å; M125-W129 PolarHBondContact O-N 3.24Å
126	G	69.7	Low	66.5	Low	43 Å²	43	94.6 Å²	94.6	44%	0.443	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-39.7	174.3	0	0	0	0	0	112.9	Q122 V123 W129 L130	Q122-G126 PolarHBondContact O-N 3.08Å; V123-G126 PolarHBondContact O-N 3.39Å; G126-W129 PolarHBondContact O-N 2.96Å; G126-L130 WeakPolarHBondContact O-CB 3.39Å; G126-L130 PolarHBondContact O-N 3.35Å
127	R	71.8	Confident	66.5	Low	177 Å²	177	93.7 Å²	93.7	67%	0.668	48%	0.48	S	S	*	.	H	α-helix	trans	-65	-38.3	173.8	-71.2	170.9	-172.3	-86	-0.4	112.1	V123 A124 M125 L130 A131	V123-R127 VanDerWaalsContact O-CG 3.27Å; V123-R127 WeakPolarHBondContact O-CG 3.48Å; V123-R127 PolarHBondContact O-N 2.88Å; A124-R127 PolarHBondContact O-N 3.33Å; M125-R127 VanDerWaalsContact C-N 3.33Å; M125-R127 PolarHBondContact O-N 2.97Å; R127-L130 PolarHBondContact O-N 3.09Å; R127-A131 WeakPolarHBondContact O-CB 3.37Å; R127-A131 PolarHBondContact O-N 3.28Å
128	Q	67.9	Low	66.7	Low	35 Å²	35	96 Å²	96	16%	0.164	49%	0.486	C	S	.	.	H	α-helix	trans	-62.7	-49.5	176.1	-172.1	-174.8	14.1	0	0	111.3	I110 A124 M125 L130 A131 I132	I110-Q128 HydrophobicContact CG2-CG 3.93Å; A124-Q128 PolarHBondContact O-N 3.06Å; M125-Q128 WeakPolarHBondContact O-CB 3.41Å; M125-Q128 PolarHBondContact O-N 3.36Å; M125-Q128 PolarHBondContact SD-OE1 3.13Å; Q128-L130 VanDerWaalsContact C-N 3.32Å; Q128-L130 PolarHBondContact O-N 2.97Å; Q128-A131 PolarHBondContact O-N 3.22Å; Q128-I132 HydrophobicContact CG-CD1 4.12Å; Q128-I132 WeakPolarHBondContact O-CG1 3.35Å; Q128-I132 PolarHBondContact O-N 3.32Å
129	W	68.7	Low	66.8	Low	166 Å²	166	94.6 Å²	94.6	63%	0.629	48%	0.478	S	S	*	.	H	α-helix	trans	-62.3	-40.8	178.5	-168.7	88.4	0	0	0	111.7	M125 G126 I132 Q133	M125-W129 PolarHBondContact O-N 3.24Å; G126-W129 PolarHBondContact O-N 2.96Å; W129-I132 PolarHBondContact O-N 2.85Å; W129-Q133 HydrophobicContact CD2-CG 3.86Å; W129-Q133 HydrophobicContact CE3-CG 3.76Å; W129-Q133 HydrophobicContact CH2-CG 3.79Å; W129-Q133 HydrophobicContact CZ2-CG 3.88Å; W129-Q133 VanDerWaalsContact CZ2-NE2 3.34Å; W129-Q133 HydrophobicContact CZ3-CG 3.73Å; W129-Q133 WeakPolarHBondContact O-CB 3.39Å; W129-Q133 VanDerWaalsContact O-CG 3.31Å; W129-Q133 WeakPolarHBondContact O-CG 2.99Å; W129-Q133 PolarHBondContact O-N 2.81Å
130	L	75.3	Confident	66.9	Low	87 Å²	87	96.4 Å²	96.4	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-66.9	-36.8	177.1	-160.8	72.4	0	0	0	112.7	G126 R127 Q128 K134	G126-L130 WeakPolarHBondContact O-CB 3.39Å; G126-L130 PolarHBondContact O-N 3.35Å; R127-L130 PolarHBondContact O-N 3.09Å; Q128-L130 VanDerWaalsContact C-N 3.32Å; Q128-L130 PolarHBondContact O-N 2.97Å; L130-K134 WeakPolarHBondContact O-CB 3.36Å; L130-K134 WeakPolarHBondContact O-CG 3.4Å; L130-K134 PolarHBondContact O-N 3.05Å
131	A	71.9	Confident	67	Low	37 Å²	37	97 Å²	97	31%	0.306	47%	0.471	S	S	.	.	H	α-helix	trans	-63.3	-49	172.8	0	0	0	0	0	110.6	R127 Q128 Q133 K134 L135	R127-A131 WeakPolarHBondContact O-CB 3.37Å; R127-A131 PolarHBondContact O-N 3.28Å; Q128-A131 PolarHBondContact O-N 3.22Å; A131-Q133 VanDerWaalsContact C-N 3.33Å; A131-Q133 PolarHBondContact O-N 3.05Å; A131-K134 PolarHBondContact O-N 3.05Å; A131-L135 WeakPolarHBondContact O-CD1 3.44Å; A131-L135 PolarHBondContact O-N 2.91Å; A131-L135 VanDerWaalsContact O-N 3.09Å
132	I	71.5	Confident	66.8	Low	36 Å²	36	103.7 Å²	103.7	19%	0.185	50%	0.496	C	S	.	.	H	α-helix	trans	-58.3	-45.1	177.3	-67.7	167.9	0	0	0	111	Q128 W129 L135 R136	Q128-I132 HydrophobicContact CG-CD1 4.12Å; Q128-I132 WeakPolarHBondContact O-CG1 3.35Å; Q128-I132 PolarHBondContact O-N 3.32Å; W129-I132 PolarHBondContact O-N 2.85Å; I132-L135 PolarHBondContact O-N 3.25Å; I132-R136 WeakPolarHBondContact O-CG 3.39Å; I132-R136 PolarHBondContact O-N 2.94Å
133	Q	74.9	Confident	66.9	Low	67 Å²	67	100.8 Å²	100.8	31%	0.313	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-45	177.7	-75.7	-66.1	-17.2	0	0	112.8	W129 A131 L135 R136 S137	W129-Q133 HydrophobicContact CD2-CG 3.86Å; W129-Q133 HydrophobicContact CE3-CG 3.76Å; W129-Q133 HydrophobicContact CH2-CG 3.79Å; W129-Q133 HydrophobicContact CZ2-CG 3.88Å; W129-Q133 VanDerWaalsContact CZ2-NE2 3.34Å; W129-Q133 HydrophobicContact CZ3-CG 3.73Å; W129-Q133 WeakPolarHBondContact O-CB 3.39Å; W129-Q133 VanDerWaalsContact O-CG 3.31Å; W129-Q133 WeakPolarHBondContact O-CG 2.99Å; W129-Q133 PolarHBondContact O-N 2.81Å; A131-Q133 VanDerWaalsContact C-N 3.33Å; A131-Q133 PolarHBondContact O-N 3.05Å; Q133-L135 PolarHBondContact O-N 3.14Å; Q133-R136 PolarHBondContact O-N 2.99Å; Q133-S137 PolarHBondContact O-N 3.47Å; Q133-S137 VanDerWaalsContact O-N 3.13Å; Q133-S137 PolarHBondContact O-OG 3.26Å
134	K	71	Confident	66.9	Low	122 Å²	122	100.7 Å²	100.7	53%	0.53	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-23.4	176.4	-78.7	179.1	179.3	177.8	0	113.5	L130 A131 S137 K138	L130-K134 WeakPolarHBondContact O-CB 3.36Å; L130-K134 WeakPolarHBondContact O-CG 3.4Å; L130-K134 PolarHBondContact O-N 3.05Å; A131-K134 PolarHBondContact O-N 3.05Å; K134-S137 PolarHBondContact O-OG 3.42Å; K134-S137 VanDerWaalsContact O-OG 3.06Å; K134-K138 WeakPolarHBondContact O-CD 3.44Å; K134-K138 WeakPolarHBondContact O-CG 3.47Å
135	L	62.3	Low	67.3	Low	65 Å²	65	110.1 Å²	110.1	34%	0.34	52%	0.519	S	S	.	.	H	α-helix	trans	-83.6	-42	175.2	-89.3	85.3	0	0	0	111.7	L106 A131 I132 Q133 S137 K138 I139	L106-L135 HydrophobicContact CD2-CD2 3.37Å; L106-L135 HydrophobicContact CG-CD2 4.38Å; A131-L135 WeakPolarHBondContact O-CD1 3.44Å; A131-L135 PolarHBondContact O-N 2.91Å; A131-L135 VanDerWaalsContact O-N 3.09Å; I132-L135 PolarHBondContact O-N 3.25Å; Q133-L135 PolarHBondContact O-N 3.14Å; L135-S137 PolarHBondContact O-N 3.49Å; L135-K138 WeakPolarHBondContact O-CB 3.31Å; L135-K138 PolarHBondContact O-N 3.19Å; L135-I139 PolarHBondContact O-N 3.49Å
136	R	65.8	Low	67.6	Low	137 Å²	137	111.3 Å²	111.3	52%	0.517	52%	0.521	S	S	.	.	H	α-helix	trans	-55.1	-38.3	173.9	-71.9	175.9	178.3	-157.6	-2.7	112.3	I132 Q133 K138	I132-R136 WeakPolarHBondContact O-CG 3.39Å; I132-R136 PolarHBondContact O-N 2.94Å; Q133-R136 PolarHBondContact O-N 2.99Å; R136-K138 VanDerWaalsContact C-N 3.32Å; R136-K138 PolarHBondContact O-N 2.92Å
137	S	62.1	Low	67.8	Low	81 Å²	81	112 Å²	112	57%	0.566	52%	0.523	S	S	*	.	H	α-helix	trans	-72.7	-19	176.6	60.8	0	0	0	0	114.6	Q133 K134 L135	Q133-S137 PolarHBondContact O-N 3.47Å; Q133-S137 VanDerWaalsContact O-N 3.13Å; Q133-S137 PolarHBondContact O-OG 3.26Å; K134-S137 PolarHBondContact O-OG 3.42Å; K134-S137 VanDerWaalsContact O-OG 3.06Å; L135-S137 PolarHBondContact O-N 3.49Å
138	K	63.3	Low	67.8	Low	142 Å²	142	108.5 Å²	108.5	62%	0.617	53%	0.525	S	S	*	.	H	α-helix	trans	-85.3	-26	176.7	-73.3	172.4	-177	-177.7	0	113.2	K134 L135 R136 H140 K141	K134-K138 WeakPolarHBondContact O-CD 3.44Å; K134-K138 WeakPolarHBondContact O-CG 3.47Å; L135-K138 WeakPolarHBondContact O-CB 3.31Å; L135-K138 PolarHBondContact O-N 3.19Å; R136-K138 VanDerWaalsContact C-N 3.32Å; R136-K138 PolarHBondContact O-N 2.92Å; K138-H140 VanDerWaalsContact C-N 3.25Å; K138-H140 PolarHBondContact O-N 3.01Å; K138-K141 PolarHBondContact O-N 3.02Å; K138-K141 VanDerWaalsContact O-N 3.17Å
139	I	62.7	Low	68.1	Low	79 Å²	79	114.8 Å²	114.8	41%	0.405	55%	0.552	S	S	.	*	H	α-helix	trans	-57.5	-39.2	-179.8	-68.3	165.6	0	0	0	111.5	H103 L135	H103-I139 WeakPolarHBondContact NE2-CD1 3.31Å; L135-I139 PolarHBondContact O-N 3.49Å
140	H	60.5	Low	68.2	Low	164 Å²	164	110.2 Å²	110.2	76%	0.759	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	5.1	-178.2	-62.8	-72.9	0	0	0	114	K138 K142	K138-H140 VanDerWaalsContact C-N 3.25Å; K138-H140 PolarHBondContact O-N 3.01Å; H140-K142 PolarHBondContact O-N 3.02Å
141	K	63.6	Low	68.3	Low	151 Å²	151	114.2 Å²	114.2	66%	0.657	57%	0.565	S	S	*	*			trans	-79.6	110.9	-176.7	-166.4	170.6	-177.4	175	0	109.9	K138 V143	K138-K141 PolarHBondContact O-N 3.02Å; K138-K141 VanDerWaalsContact O-N 3.17Å; K141-V143 HydrophobicContact CG-CG2 4.49Å; K141-V143 PolarHBondContact O-N 2.99Å
142	K	60.9	Low	68.4	Low	212 Å²	212	118.8 Å²	118.8	92%	0.922	58%	0.578	S	S	*	*			trans	-65.9	101.7	171.2	-167.3	173.3	-176.1	177.8	0	109.3	H140	H140-K142 PolarHBondContact O-N 3.02Å
143	V	65.4	Low	68.5	Low	103 Å²	103	125.2 Å²	125.2	62%	0.624	61%	0.612	S	S	*	*			trans	-92.7	129.7	178.3	-178.9	0	0	0	0	109.9	K141 R145	K141-V143 HydrophobicContact CG-CG2 4.49Å; K141-V143 PolarHBondContact O-N 2.99Å; V143-R145 PolarHBondContact O-N 2.86Å
144	D	68.9	Low	68.2	Low	80 Å²	80	137.1 Å²	137.1	43%	0.428	65%	0.654	S	S	.	*			trans	-69.8	96.6	170.6	-174.9	-9.3	0	0	0	110.1	K146 A147 K152	D144-K146 PolarHBondContact O-N 3.01Å; D144-K146 WeakPolarHBondContact OD1-CB 3.27Å; D144-K146 PolarHBondContact OD1-N 3.44Å; D144-A147 HydrophobicContact CB-CB 4.18Å; D144-A147 PolarHBondContact O-N 3.32Å; D144-A147 PolarHBondContact OD1-N 2.97Å; D144-K152 IonicContact OD2-NZ 3.17Å
145	R	71.7	Confident	68.1	Low	212 Å²	212	137.9 Å²	137.9	80%	0.8	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-13.5	179.8	-59.7	177.3	112.4	169.4	3.3	113.2	V143	V143-R145 PolarHBondContact O-N 2.86Å
146	K	70.6	Confident	68.4	Low	142 Å²	142	141.7 Å²	141.7	62%	0.617	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-25.7	175.5	-79	-177.8	157	-177.5	0	111.8	D144 R151	D144-K146 PolarHBondContact O-N 3.01Å; D144-K146 WeakPolarHBondContact OD1-CB 3.27Å; D144-K146 PolarHBondContact OD1-N 3.44Å; K146-R151 HydrophobicContact CB-CB 4.48Å; K146-R151 WeakPolarHBondContact O-CB 3.27Å; K146-R151 PolarHBondContact O-N 3.04Å
147	A	73.3	Confident	68.6	Low	57 Å²	57	141.9 Å²	141.9	47%	0.471	69%	0.686	S	S	.	*	G	3₁₀ helix	trans	-71.4	-32.6	179.5	0	0	0	0	0	113.8	D144 K149	D144-A147 HydrophobicContact CB-CB 4.18Å; D144-A147 PolarHBondContact O-N 3.32Å; D144-A147 PolarHBondContact OD1-N 2.97Å; A147-K149 PolarHBondContact O-N 3.39Å
148	S	71.1	Confident	68.9	Low	103 Å²	103	145.5 Å²	145.5	72%	0.72	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-73.4	-0	-167.3	100.8	0	0	0	0	115.9
149	K	75.1	Confident	69.3	Low	168 Å²	168	145.8 Å²	145.8	73%	0.73	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-150	29.2	-176.8	-145.4	171.4	-174.4	178.6	0	113.8	A147 R151	A147-K149 PolarHBondContact O-N 3.39Å; K149-R151 PolarHBondContact O-N 3.25Å
150	G	71.2	Confident	69.7	Low	69 Å²	69	150.2 Å²	150.2	71%	0.711	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.5	17.7	178.2	0	0	0	0	0	114.9	K152	G150-K152 PolarHBondContact O-N 3.08Å
151	R	75.8	Confident	70.4	Confident	171 Å²	171	149.2 Å²	149.2	65%	0.645	71%	0.714	S	S	*	*			trans	-80.3	8.3	177.9	-69.7	-174.3	-83	-162.9	-5	113.4	K146 K149	K146-R151 HydrophobicContact CB-CB 4.48Å; K146-R151 WeakPolarHBondContact O-CB 3.27Å; K146-R151 PolarHBondContact O-N 3.04Å; K149-R151 PolarHBondContact O-N 3.25Å
152	K	75.6	Confident	70.9	Confident	133 Å²	133	149.1 Å²	149.1	58%	0.578	72%	0.719	S	S	*	*	S	Bend	trans	-110.1	113.7	173.5	-170.8	170.5	-175.3	169.9	0	107	D144 G150 R154	D144-K152 IonicContact OD2-NZ 3.17Å; G150-K152 PolarHBondContact O-N 3.08Å; K152-R154 PolarHBondContact O-N 3.25Å
153	L	72.3	Confident	71.7	Confident	172 Å²	172	143.8 Å²	143.8	90%	0.901	70%	0.702	S	S	*	*			trans	-59.4	134.7	168.7	-100	110.3	0	0	0	108.3
154	R	69.9	Low	72.3	Confident	316 Å²	316	147.5 Å²	147.5	100%	1.192	71%	0.709	S	S	*	*			trans	-87.8	0	172.3	-78.6	-172.5	175.3	136.3	-2.8	109.8	K152	K152-R154 PolarHBondContact O-N 3.25Å

Retrieved 154 of 154 residues in 93.3 ms (Link to these results)

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