A0A0D9RL41_CHLSB Loading...

Polyglutamine-binding protein 1

AlphaFold DB , UniProt , Accession A0A0D9RL41, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene PQBP1, Length 265 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	66.9	Low	80.7	Confident	226 Å²	226	103 Å²	103	100%	1.113	56%	0.562	S	S	*	*				0	123.9	0	-64.1	-124.9	-71.8	0	0	107.6
2	P	78.2	Confident	80.9	Confident	128 Å²	128	98.2 Å²	98.2	83%	0.831	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-62.3	139.2	177.2	26.5	-32.4	0	0	0	110
3	L	79.9	Confident	80.9	Confident	86 Å²	86	105.1 Å²	105.1	45%	0.45	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-71.4	142.9	179	-67.7	174.7	0	0	0	110	Q8 L11 L17	L3-Q8 HydrophobicContact CB-CG 3.67Å; L3-Q8 HydrophobicContact CD1-CG 4.48Å; L3-Q8 PolarHBondContact O-NE2 3.05Å; L3-L11 HydrophobicContact CD1-CD1 4.15Å; L3-L17 HydrophobicContact CD1-CD1 4.49Å
4	P	84.2	Confident	81.1	Confident	80 Å²	80	112.1 Å²	112.1	52%	0.519	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-58.4	140.2	171.8	-21.9	31.6	0	0	0	111.6	A6 L7 Q8	P4-A6 PolarHBondContact O-N 3.13Å; P4-A6 VanDerWaalsContact O-N 3.16Å; P4-L7 HydrophobicContact CG-CD1 4.24Å; P4-L7 WeakPolarHBondContact O-CA 3.19Å; P4-L7 WeakPolarHBondContact O-CB 2.91Å; P4-L7 PolarHBondContact O-N 3.31Å; P4-Q8 PolarHBondContact O-N 3.35Å
5	V	81.4	Confident	80.8	Confident	107 Å²	107	107.9 Å²	107.9	65%	0.648	58%	0.576	S	S	*	*	H	α-helix	trans	-53.1	-39.9	-176.9	178.4	0	0	0	0	112.5	L7 Q8 T9	V5-L7 VanDerWaalsContact C-N 3.28Å; V5-L7 PolarHBondContact O-N 3.04Å; V5-Q8 PolarHBondContact O-N 3.23Å; V5-T9 WeakPolarHBondContact O-CG2 3.34Å; V5-T9 PolarHBondContact O-N 3.34Å; V5-T9 PolarHBondContact O-OG1 3.19Å; V5-T9 VanDerWaalsContact O-OG1 3.08Å
6	A	79.6	Confident	80.9	Confident	62 Å²	62	108.1 Å²	108.1	51%	0.512	58%	0.576	S	S	.	*	H	α-helix	trans	-64.8	-29.3	177.4	0	0	0	0	0	113.7	P4 T9 R10	P4-A6 PolarHBondContact O-N 3.13Å; P4-A6 VanDerWaalsContact O-N 3.16Å; A6-T9 PolarHBondContact O-OG1 3.49Å; A6-T9 VanDerWaalsContact O-OG1 3.05Å; A6-R10 WeakPolarHBondContact O-CG 3.45Å
7	L	82.2	Confident	80.4	Confident	87 Å²	87	104.9 Å²	104.9	46%	0.455	56%	0.559	S	S	.	*	H	α-helix	trans	-81.3	-39.2	174.1	-84.8	169.7	0	0	0	111.3	P4 V5 T9 R10 L11	P4-L7 HydrophobicContact CG-CD1 4.24Å; P4-L7 WeakPolarHBondContact O-CA 3.19Å; P4-L7 WeakPolarHBondContact O-CB 2.91Å; P4-L7 PolarHBondContact O-N 3.31Å; V5-L7 VanDerWaalsContact C-N 3.28Å; V5-L7 PolarHBondContact O-N 3.04Å; L7-T9 PolarHBondContact O-N 3.01Å; L7-R10 PolarHBondContact O-N 3.04Å; L7-L11 WeakPolarHBondContact O-CB 3.41Å; L7-L11 VanDerWaalsContact O-CG 3.23Å; L7-L11 WeakPolarHBondContact O-CG 3.12Å; L7-L11 PolarHBondContact O-N 3.04Å
8	Q	85.1	Confident	79.5	Confident	65 Å²	65	109.1 Å²	109.1	30%	0.304	57%	0.571	S	S	.	*	H	α-helix	trans	-58.5	-48.2	176.1	-70.6	175.1	-31.1	0	0	111.7	L3 P4 V5 R10 L11 A12 L17	L3-Q8 HydrophobicContact CB-CG 3.67Å; L3-Q8 HydrophobicContact CD1-CG 4.48Å; L3-Q8 PolarHBondContact O-NE2 3.05Å; P4-Q8 PolarHBondContact O-N 3.35Å; V5-Q8 PolarHBondContact O-N 3.23Å; Q8-R10 PolarHBondContact O-N 3.2Å; Q8-L11 PolarHBondContact O-N 3.24Å; Q8-A12 VanDerWaalsContact O-CB 3.3Å; Q8-A12 WeakPolarHBondContact O-CB 3.25Å; Q8-A12 PolarHBondContact O-N 3.21Å; Q8-L17 HydrophobicContact CG-CD1 4.42Å
9	T	81.1	Confident	78.3	Confident	73 Å²	73	112.2 Å²	112.2	45%	0.448	58%	0.582	S	S	.	*	H	α-helix	trans	-60.3	-42.7	177.9	50.8	0	0	0	0	112.7	V5 A6 L7 K13	V5-T9 WeakPolarHBondContact O-CG2 3.34Å; V5-T9 PolarHBondContact O-N 3.34Å; V5-T9 PolarHBondContact O-OG1 3.19Å; V5-T9 VanDerWaalsContact O-OG1 3.08Å; A6-T9 PolarHBondContact O-OG1 3.49Å; A6-T9 VanDerWaalsContact O-OG1 3.05Å; L7-T9 PolarHBondContact O-N 3.01Å; T9-K13 WeakPolarHBondContact O-CB 3.28Å; T9-K13 WeakPolarHBondContact O-CG 3.47Å; T9-K13 PolarHBondContact O-N 3.48Å
10	R	83.3	Confident	77.1	Confident	170 Å²	170	113 Å²	113	64%	0.642	59%	0.586	S	S	*	*	H	α-helix	trans	-67.3	-38	177	-76.2	177.5	177.9	169.6	0.8	112.6	A6 L7 Q8 R14	A6-R10 WeakPolarHBondContact O-CG 3.45Å; L7-R10 PolarHBondContact O-N 3.04Å; Q8-R10 PolarHBondContact O-N 3.2Å; R10-R14 WeakPolarHBondContact O-CG 3.35Å; R10-R14 PolarHBondContact O-N 2.93Å
11	L	86	Confident	75.9	Confident	49 Å²	49	116.3 Å²	116.3	26%	0.257	60%	0.599	S	S	.	*	H	α-helix	trans	-72.4	-38	177.3	-69.4	173.7	0	0	0	111.9	L3 L7 Q8 R14 G15 I16 L17	L3-L11 HydrophobicContact CD1-CD1 4.15Å; L7-L11 WeakPolarHBondContact O-CB 3.41Å; L7-L11 VanDerWaalsContact O-CG 3.23Å; L7-L11 WeakPolarHBondContact O-CG 3.12Å; L7-L11 PolarHBondContact O-N 3.04Å; Q8-L11 PolarHBondContact O-N 3.24Å; L11-R14 CarbonylContact O-C 3.54Å; L11-R14 PolarHBondContact O-N 3.45Å; L11-G15 PolarHBondContact O-N 3.25Å; L11-I16 HydrophobicContact CB-CB 4.4Å; L11-I16 HydrophobicContact CD2-CB 4.39Å; L11-I16 HydrophobicContact CD2-CD1 3.73Å; L11-I16 HydrophobicContact CD2-CG2 4.35Å; L11-I16 WeakPolarHBondContact O-CB 3.41Å; L11-I16 PolarHBondContact O-N 3.45Å; L11-L17 HydrophobicContact CB-CB 4.46Å; L11-L17 HydrophobicContact CB-CD1 4.41Å
12	A	82.3	Confident	75.2	Confident	45 Å²	45	110.5 Å²	110.5	37%	0.372	58%	0.578	S	S	.	*	H	α-helix	trans	-63.6	-47.5	173	0	0	0	0	0	111.4	Q8 R14 G15 L17	Q8-A12 VanDerWaalsContact O-CB 3.3Å; Q8-A12 WeakPolarHBondContact O-CB 3.25Å; Q8-A12 PolarHBondContact O-N 3.21Å; A12-R14 PolarHBondContact O-N 3.35Å; A12-R14 VanDerWaalsContact O-N 3.1Å; A12-G15 WeakPolarHBondContact O-CA 3.26Å; A12-G15 PolarHBondContact O-N 2.91Å; A12-L17 HydrophobicContact CB-CB 4.45Å
13	K	81.3	Confident	73.7	Confident	188 Å²	188	111.8 Å²	111.8	82%	0.817	57%	0.573	S	S	*	*	H	α-helix	trans	-58.4	-24.8	173.9	-80.3	-177.9	173.1	-179.6	0	113.8	T9	T9-K13 WeakPolarHBondContact O-CB 3.28Å; T9-K13 WeakPolarHBondContact O-CG 3.47Å; T9-K13 PolarHBondContact O-N 3.48Å
14	R	83.4	Confident	72.4	Confident	203 Å²	203	112.3 Å²	112.3	77%	0.766	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	5.4	175.8	-71.3	-177.4	171.9	172.8	-1.7	113.3	R10 L11 A12 I16	R10-R14 WeakPolarHBondContact O-CG 3.35Å; R10-R14 PolarHBondContact O-N 2.93Å; L11-R14 CarbonylContact O-C 3.54Å; L11-R14 PolarHBondContact O-N 3.45Å; A12-R14 PolarHBondContact O-N 3.35Å; A12-R14 VanDerWaalsContact O-N 3.1Å; R14-I16 HydrophobicContact CB-CD1 3.96Å; R14-I16 HydrophobicContact CB-CG1 4.17Å; R14-I16 PolarHBondContact O-N 2.81Å
15	G	77.3	Confident	70.6	Confident	49 Å²	49	117.1 Å²	117.1	51%	0.505	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	69.8	14	178.9	0	0	0	0	0	114.6	L11 A12	L11-G15 PolarHBondContact O-N 3.25Å; A12-G15 WeakPolarHBondContact O-CA 3.26Å; A12-G15 PolarHBondContact O-N 2.91Å
16	I	81.8	Confident	68.8	Low	112 Å²	112	119.4 Å²	119.4	57%	0.574	60%	0.601	S	S	*	*			trans	-82.5	-34.9	-177.1	-61.9	168.1	0	0	0	110.5	L11 R14	L11-I16 HydrophobicContact CB-CB 4.4Å; L11-I16 HydrophobicContact CD2-CB 4.39Å; L11-I16 HydrophobicContact CD2-CD1 3.73Å; L11-I16 HydrophobicContact CD2-CG2 4.35Å; L11-I16 WeakPolarHBondContact O-CB 3.41Å; L11-I16 PolarHBondContact O-N 3.45Å; R14-I16 HydrophobicContact CB-CD1 3.96Å; R14-I16 HydrophobicContact CB-CG1 4.17Å; R14-I16 PolarHBondContact O-N 2.81Å
17	L	73.4	Confident	67.4	Low	54 Å²	54	124.7 Å²	124.7	28%	0.283	62%	0.615	S	S	.	*			trans	-100.7	108	177.9	-132	158.2	0	0	0	107.9	L3 Q8 L11 A12 L20	L3-L17 HydrophobicContact CD1-CD1 4.49Å; Q8-L17 HydrophobicContact CG-CD1 4.42Å; L11-L17 HydrophobicContact CB-CB 4.46Å; L11-L17 HydrophobicContact CB-CD1 4.41Å; A12-L17 HydrophobicContact CB-CB 4.45Å; L17-L20 HydrophobicContact CD2-CD1 4.24Å
18	K	63.5	Low	65.7	Low	179 Å²	179	127.3 Å²	127.3	78%	0.778	63%	0.628	S	S	*	*			trans	-90.5	-3.7	-168.5	-71.9	-175	176.8	-178.5	0	115.9
19	H	56.4	Low	63.7	Low	168 Å²	168	131.1 Å²	131.1	78%	0.778	65%	0.649	S	S	*	*	S	Bend	trans	-148.4	94.8	-179.9	-74.9	-72	0	0	0	109.7
20	L	55.2	Low	62	Low	128 Å²	128	130.5 Å²	130.5	67%	0.67	65%	0.651	S	S	*	*			trans	178.2	70.6	157.6	-94.6	139.5	0	0	0	103.4	L17 P22	L17-L20 HydrophobicContact CD2-CD1 4.24Å; L20-P22 VanDerWaalsContact C-CD 3.49Å; L20-P22 WeakPolarHBondContact O-CD 3.21Å
21	E	51.5	Low	60.2	Low	184 Å²	184	129 Å²	129	86%	0.86	65%	0.651	S	S	*	*			trans	-66.5	105.9	146.7	-81.1	175.1	160.5	0	0	104	E23	E21-E23 PolarHBondContact O-N 3.04Å
22	P	51.3	Low	58.6	Low	103 Å²	103	133 Å²	133	67%	0.669	67%	0.673	S	S	*	*			trans	-59	118.9	142.7	29.3	-28.7	0	0	0	103.8	L20 P24	L20-P22 VanDerWaalsContact C-CD 3.49Å; L20-P22 WeakPolarHBondContact O-CD 3.21Å; P22-P24 VanDerWaalsContact O-N 3.08Å
23	E	46.5	Very low	57.2	Low	155 Å²	155	139.8 Å²	139.8	72%	0.724	69%	0.69	S	S	*	*			trans	-35.2	123.5	152.4	-74.8	-79.7	143.3	0	0	105.7	E21 E25	E21-E23 PolarHBondContact O-N 3.04Å; E23-E25 PolarHBondContact O-N 2.89Å
24	P	53.2	Low	55.9	Low	97 Å²	97	138.3 Å²	138.3	63%	0.63	69%	0.691	S	S	*	*			trans	-59.6	99.7	161.2	27.7	-28.4	0	0	0	102.9	P22 E26	P22-P24 VanDerWaalsContact O-N 3.08Å; P24-E26 PolarHBondContact O-N 3.37Å
25	E	46.6	Very low	54.6	Low	181 Å²	181	135.6 Å²	135.6	85%	0.846	69%	0.692	S	S	*	*			trans	-53.8	92.2	145.5	-74.7	177.7	-175	0	0	102.1	E23 E27	E23-E25 PolarHBondContact O-N 2.89Å; E25-E27 PolarHBondContact O-N 3.45Å
26	E	43.8	Very low	53.7	Low	156 Å²	156	139.4 Å²	139.4	73%	0.729	70%	0.701	S	S	*	*			trans	-49.4	99.5	163.1	-67.2	-178.3	164.8	0	0	102.1	P24 I28	P24-E26 PolarHBondContact O-N 3.37Å; E26-I28 PolarHBondContact O-N 3.22Å
27	E	50.2	Low	52.6	Low	173 Å²	173	137.6 Å²	137.6	81%	0.808	70%	0.696	S	S	*	*			trans	-55.6	95.2	157.9	-77.8	-179.3	172.3	0	0	102.9	E25 I29	E25-E27 PolarHBondContact O-N 3.45Å; E27-I29 PolarHBondContact O-N 3.25Å
28	I	46.9	Very low	51.8	Low	141 Å²	141	135.9 Å²	135.9	72%	0.723	69%	0.688	S	S	*	*			trans	-60.6	88	164.2	-62.7	161.5	0	0	0	102.1	E26 A30	E26-I28 PolarHBondContact O-N 3.22Å; I28-A30 HydrophobicContact CG2-CB 3.9Å; I28-A30 PolarHBondContact O-N 3.2Å
29	I	42.5	Very low	51.8	Low	145 Å²	145	132.2 Å²	132.2	74%	0.744	68%	0.677	S	S	*	*			trans	-66.6	68.8	152.9	-51.1	162.3	0	0	0	103.3	E27 E31	E27-I29 PolarHBondContact O-N 3.25Å; I29-E31 PolarHBondContact O-N 2.84Å
30	A	45.1	Very low	52	Low	60 Å²	60	129.7 Å²	129.7	50%	0.496	66%	0.661	S	S	.	*			trans	-58.1	100.7	146.9	0	0	0	0	0	101.8	I28 D32	I28-A30 HydrophobicContact CG2-CB 3.9Å; I28-A30 PolarHBondContact O-N 3.2Å; A30-D32 PolarHBondContact O-N 3.42Å
31	E	46.3	Very low	52.2	Low	139 Å²	139	129.8 Å²	129.8	65%	0.65	66%	0.658	S	S	*	*				-29.2	87.8	128.6	-88.5	179.7	159.1	0	0	107.8	I29 Y33	I29-E31 PolarHBondContact O-N 2.84Å; E31-Y33 HydrophobicContact CB-CD2 3.62Å; E31-Y33 HydrophobicContact CB-CE2 4.37Å; E31-Y33 HydrophobicContact CB-CG 4.46Å; E31-Y33 HydrophobicContact CG-CD2 3.61Å; E31-Y33 HydrophobicContact CG-CE2 3.84Å; E31-Y33 PolarHBondContact O-N 2.9Å
32	D	52.6	Low	52.6	Low	132 Å²	132	123 Å²	123	71%	0.706	63%	0.634	S	S	*	*			trans	-62.7	59.3	154.6	39	-7.7	0	0	0	107.5	A30 D34	A30-D32 PolarHBondContact O-N 3.42Å; D32-D34 PolarHBondContact O-N 2.86Å; D32-D34 VanDerWaalsContact O-N 3.14Å
33	Y	51.6	Low	53.3	Low	189 Å²	189	118.7 Å²	118.7	74%	0.741	61%	0.606	S	S	*	*			trans	-79.6	28.8	170	-107.2	-96.6	0	0	0	111.1	E31	E31-Y33 HydrophobicContact CB-CD2 3.62Å; E31-Y33 HydrophobicContact CB-CE2 4.37Å; E31-Y33 HydrophobicContact CB-CG 4.46Å; E31-Y33 HydrophobicContact CG-CD2 3.61Å; E31-Y33 HydrophobicContact CG-CE2 3.84Å; E31-Y33 PolarHBondContact O-N 2.9Å
34	D	55.3	Low	53.9	Low	156 Å²	156	119.5 Å²	119.5	83%	0.834	60%	0.602	S	S	*	*			trans	-120.2	40.3	165.3	-71.8	-31.4	0	0	0	108.9	D32 D36	D32-D34 PolarHBondContact O-N 2.86Å; D32-D34 VanDerWaalsContact O-N 3.14Å; D34-D36 PolarHBondContact O-N 3.28Å
35	D	56	Low	54.4	Low	146 Å²	146	122 Å²	122	78%	0.781	61%	0.609	S	S	*	*			trans	-69.2	67.6	157.5	-108.4	-21.3	0	0	0	107.8	P37	D35-P37 WeakPolarHBondContact O-CD 3.5Å
36	D	57.5	Low	55.6	Low	130 Å²	130	118.3 Å²	118.3	70%	0.695	59%	0.592	S	S	*	*			trans	-67.9	108.2	154.3	-105.9	-32.4	0	0	0	104.8	D34 V38	D34-D36 PolarHBondContact O-N 3.28Å; D36-V38 PolarHBondContact O-N 3.1Å
37	P	59.3	Low	57.4	Low	74 Å²	74	113.4 Å²	113.4	48%	0.481	58%	0.584	S	S	.	*	S	Bend	trans	-70.9	13.2	-174.5	31.2	-35.2	0	0	0	112.4	D35 F56	D35-P37 WeakPolarHBondContact O-CD 3.5Å; P37-F56 VanDerWaalsContact O-CD2 3.25Å; P37-F56 WeakPolarHBondContact O-CD2 3.4Å
38	V	56.8	Low	59	Low	17 Å²	17	106.2 Å²	106.2	10%	0.103	55%	0.551	C	S	.	*			trans	-132.8	88.8	-170.9	-163.9	0	0	0	0	109.2	D36 Y40 V55	D36-V38 PolarHBondContact O-N 3.1Å; V38-Y40 HydrophobicContact CB-CD2 4.11Å; V38-Y40 HydrophobicContact CB-CE1 4.3Å; V38-Y40 HydrophobicContact CB-CE2 3.65Å; V38-Y40 HydrophobicContact CG1-CD1 3.64Å; V38-Y40 HydrophobicContact CG1-CD2 3.85Å; V38-Y40 HydrophobicContact CG1-CE1 3.37Å; V38-Y40 HydrophobicContact CG1-CE2 3.59Å; V38-Y40 HydrophobicContact CG1-CG 3.87Å; V38-Y40 WeakPolarHBondContact O-CD2 3.47Å; V38-Y40 PolarHBondContact O-N 2.96Å; V38-V55 HydrophobicContact CG2-CG1 4.09Å
39	D	63.4	Low	60.8	Low	102 Å²	102	101.1 Å²	101.1	55%	0.545	53%	0.527	S	S	.	.			trans	-74.2	82	166.2	-170.3	-15	0	0	0	109.3	E41 A42 T43	D39-E41 PolarHBondContact O-N 3.37Å; D39-E41 PolarHBondContact OD1-N 3.14Å; D39-A42 HydrophobicContact CB-CB 3.92Å; D39-A42 PolarHBondContact O-N 3.3Å; D39-A42 PolarHBondContact OD1-N 2.91Å; D39-A42 VanDerWaalsContact OD2-CB 3.29Å; D39-A42 WeakPolarHBondContact OD2-CB 3.49Å; D39-T43 WeakPolarHBondContact O-CG2 3.36Å; D39-T43 PolarHBondContact O-N 3.26Å; D39-T43 VanDerWaalsContact O-N 3.08Å; D39-T43 PolarHBondContact O-OG1 3.26Å
40	Y	60.8	Low	62.9	Low	115 Å²	115	99.7 Å²	99.7	45%	0.451	53%	0.526	S	S	.	.	H	α-helix	trans	-56.8	-29	-178.6	-68.8	-80.3	0	0	0	112.8	V38 T43 R44 Y53	V38-Y40 HydrophobicContact CB-CD2 4.11Å; V38-Y40 HydrophobicContact CB-CE1 4.3Å; V38-Y40 HydrophobicContact CB-CE2 3.65Å; V38-Y40 HydrophobicContact CG1-CD1 3.64Å; V38-Y40 HydrophobicContact CG1-CD2 3.85Å; V38-Y40 HydrophobicContact CG1-CE1 3.37Å; V38-Y40 HydrophobicContact CG1-CE2 3.59Å; V38-Y40 HydrophobicContact CG1-CG 3.87Å; V38-Y40 WeakPolarHBondContact O-CD2 3.47Å; V38-Y40 PolarHBondContact O-N 2.96Å; Y40-T43 PolarHBondContact O-OG1 2.9Å; Y40-T43 VanDerWaalsContact O-OG1 3.09Å; Y40-R44 PolarHBondContact O-N 2.95Å; Y40-Y53 HydrophobicContact CD1-CD1 4.25Å
41	E	58.6	Low	64.9	Low	130 Å²	130	98.5 Å²	98.5	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-78.5	-41.9	178.5	-71.5	-64.9	151	0	0	111.6	D39 T43 R44 L45	D39-E41 PolarHBondContact O-N 3.37Å; D39-E41 PolarHBondContact OD1-N 3.14Å; E41-T43 VanDerWaalsContact C-N 3.31Å; E41-T43 PolarHBondContact O-N 3.36Å; E41-R44 PolarHBondContact O-N 2.98Å; E41-L45 WeakPolarHBondContact O-CG 3.43Å; E41-L45 PolarHBondContact O-N 3.49Å
42	A	60.7	Low	67.1	Low	43 Å²	43	93.3 Å²	93.3	36%	0.355	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-36.1	174.9	0	0	0	0	0	112.7	D39 L45	D39-A42 HydrophobicContact CB-CB 3.92Å; D39-A42 PolarHBondContact O-N 3.3Å; D39-A42 PolarHBondContact OD1-N 2.91Å; D39-A42 VanDerWaalsContact OD2-CB 3.29Å; D39-A42 WeakPolarHBondContact OD2-CB 3.49Å; A42-L45 PolarHBondContact O-N 3.15Å
43	T	65.1	Low	68.8	Low	11 Å²	11	90.1 Å²	90.1	7%	0.067	47%	0.467	C	S	.	.	H	α-helix	trans	-71	-31.7	179.1	61.1	0	0	0	0	112.6	D39 Y40 E41 L45 E46 L48 K54	D39-T43 WeakPolarHBondContact O-CG2 3.36Å; D39-T43 PolarHBondContact O-N 3.26Å; D39-T43 VanDerWaalsContact O-N 3.08Å; D39-T43 PolarHBondContact O-OG1 3.26Å; Y40-T43 PolarHBondContact O-OG1 2.9Å; Y40-T43 VanDerWaalsContact O-OG1 3.09Å; E41-T43 VanDerWaalsContact C-N 3.31Å; E41-T43 PolarHBondContact O-N 3.36Å; T43-L45 PolarHBondContact O-N 3.41Å; T43-E46 PolarHBondContact O-N 2.99Å; T43-L48 WeakPolarHBondContact O-CD1 3.47Å; T43-K54 HydrophobicContact CG2-CB 3.6Å; T43-K54 HydrophobicContact CG2-CD 4.19Å; T43-K54 HydrophobicContact CG2-CG 4.15Å; T43-K54 WeakPolarHBondContact CG2-O 3.41Å
44	R	60.6	Low	70.7	Confident	172 Å²	172	82.7 Å²	82.7	65%	0.649	44%	0.439	S	S	*	.	H	α-helix	trans	-64.1	-27.4	172.2	-166.8	176.7	-172.2	170.2	3.8	112.7	Y40 E41	Y40-R44 PolarHBondContact O-N 2.95Å; E41-R44 PolarHBondContact O-N 2.98Å
45	L	63.1	Low	72.4	Confident	149 Å²	149	75.8 Å²	75.8	78%	0.78	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-9.9	179.9	-66.5	169.3	0	0	0	113.8	E41 A42 T43 G47	E41-L45 WeakPolarHBondContact O-CG 3.43Å; E41-L45 PolarHBondContact O-N 3.49Å; A42-L45 PolarHBondContact O-N 3.15Å; T43-L45 PolarHBondContact O-N 3.41Å; L45-G47 PolarHBondContact O-N 3.04Å; L45-G47 VanDerWaalsContact O-N 3.08Å
46	E	71.1	Confident	73.9	Confident	105 Å²	105	72.3 Å²	72.3	49%	0.491	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	7.7	175.7	-88.6	-170.4	166.8	0	0	113.9	T43 L48 K54	T43-E46 PolarHBondContact O-N 2.99Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 3.2Å; E46-K54 VanDerWaalsContact CD-NZ 3.34Å; E46-K54 IonicContact OE1-NZ 3.78Å; E46-K54 PolarHBondContact OE1-NZ 3.08Å; E46-K54 WeakPolarHBondContact OE2-CD 3.33Å; E46-K54 IonicContact OE2-NZ 3.87Å; E46-K54 PolarHBondContact OE2-NZ 3.44Å; E46-K54 VanDerWaalsContact OE2-NZ 3.1Å
47	G	81.6	Confident	75.2	Confident	53 Å²	53	67.9 Å²	67.9	55%	0.546	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	25.9	-179.7	0	0	0	0	0	112.9	L45 H79	L45-G47 PolarHBondContact O-N 3.04Å; L45-G47 VanDerWaalsContact O-N 3.08Å; G47-H79 PolarHBondContact O-CE1 3.07Å
48	L	83.8	Confident	76.5	Confident	22 Å²	22	70.2 Å²	70.2	12%	0.115	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-64	151.5	173.4	-78.2	163.8	0	0	0	111.2	T43 E46 W52 K54 Y65 P78	T43-L48 WeakPolarHBondContact O-CD1 3.47Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 3.2Å; L48-W52 HydrophobicContact CB-CB 4.22Å; L48-W52 HydrophobicContact CD2-CB 4.45Å; L48-K54 HydrophobicContact CD1-CB 4.19Å; L48-Y65 HydrophobicContact CD1-CD1 4.05Å; L48-Y65 HydrophobicContact CD1-CE1 4.11Å; L48-Y65 HydrophobicContact CD2-CD1 3.57Å; L48-Y65 HydrophobicContact CD2-CE1 3.72Å; L48-Y65 HydrophobicContact CG-CD1 4.49Å; L48-Y65 HydrophobicContact CG-CE1 4.47Å; L48-P78 HydrophobicContact CD2-CG 4.14Å
49	P	85.8	Confident	77.7	Confident	34 Å²	34	74.2 Å²	74.2	22%	0.221	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-62.9	161.3	176.7	-11.9	26.2	0	0	0	110.8	S51 W52 P78 H79	P49-S51 PolarHBondContact O-N 3.16Å; P49-W52 HydrophobicContact CB-CG 4.49Å; P49-W52 HydrophobicContact CG-CG 4.41Å; P49-W52 WeakPolarHBondContact O-CB 3.45Å; P49-W52 PolarHBondContact O-N 2.92Å; P49-W52 VanDerWaalsContact O-N 3.11Å; P49-P78 HydrophobicContact CG-CB 3.79Å; P49-P78 HydrophobicContact CG-CG 4.28Å; P49-H79 WeakPolarHBondContact CD-CE1 3.25Å
50	P	85.8	Confident	78.7	Confident	114 Å²	114	72.4 Å²	72.4	74%	0.74	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	137.3	179.2	-26.1	34.3	0	0	0	112.1	W52	P50-W52 PolarHBondContact O-N 3.4Å
51	S	88.3	Confident	79.8	Confident	35 Å²	35	69.3 Å²	69.3	25%	0.245	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	12.2	178.1	-44.7	0	0	0	0	115.4	P49 N67 A68 D69	P49-S51 PolarHBondContact O-N 3.16Å; S51-N67 CarbonylContact O-C 3.59Å; S51-N67 WeakPolarHBondContact O-CA 3.43Å; S51-A68 PolarHBondContact O-N 3.46Å; S51-D69 WeakPolarHBondContact CB-OD2 3.32Å; S51-D69 PolarHBondContact OG-OD2 3.17Å
52	W	90.9	Very high	81.1	Confident	30 Å²	30	68 Å²	68	11%	0.114	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	134.6	168.7	-73.4	84.6	0	0	0	111.6	L48 P49 P50 W66 N67 P78 V85	L48-W52 HydrophobicContact CB-CB 4.22Å; L48-W52 HydrophobicContact CD2-CB 4.45Å; P49-W52 HydrophobicContact CB-CG 4.49Å; P49-W52 HydrophobicContact CG-CG 4.41Å; P49-W52 WeakPolarHBondContact O-CB 3.45Å; P49-W52 PolarHBondContact O-N 2.92Å; P49-W52 VanDerWaalsContact O-N 3.11Å; P50-W52 PolarHBondContact O-N 3.4Å; W52-W66 CarbonylContact C-O 3.59Å; W52-W66 WeakPolarHBondContact CA-O 3.46Å; W52-N67 VanDerWaalsContact CD1-ND2 3.26Å; W52-N67 HydrophobicContact CD2-CB 3.86Å; W52-N67 HydrophobicContact CE3-CB 4.1Å; W52-N67 HydrophobicContact CG-CB 4.37Å; W52-N67 HydrophobicContact CH2-CB 4.34Å; W52-N67 HydrophobicContact CZ2-CB 4.09Å; W52-N67 HydrophobicContact CZ3-CB 4.34Å; W52-N67 PolarHBondContact NE1-ND2 3.04Å; W52-P78 HydrophobicContact CB-CG 4.33Å; W52-P78 HydrophobicContact CD2-CB 4.19Å; W52-P78 HydrophobicContact CD2-CG 3.3Å; W52-P78 HydrophobicContact CE3-CG 3.34Å; W52-P78 HydrophobicContact CG-CG 3.8Å; W52-P78 HydrophobicContact CH2-CG 4.04Å; W52-P78 HydrophobicContact CZ2-CB 4.29Å; W52-P78 HydrophobicContact CZ2-CG 4.04Å; W52-P78 HydrophobicContact CZ3-CG 3.71Å; W52-V85 HydrophobicContact CH2-CB 4.44Å; W52-V85 HydrophobicContact CH2-CG1 3.81Å; W52-V85 HydrophobicContact CH2-CG2 3.76Å; W52-V85 HydrophobicContact CZ2-CG1 4.3Å; W52-V85 HydrophobicContact CZ2-CG2 4.21Å
53	Y	90	Very high	82.6	Confident	65 Å²	65	68 Å²	68	26%	0.255	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	144.2	-179.1	-59.8	-89	0	0	0	109.2	Y40 Y65 W66 A68	Y40-Y53 HydrophobicContact CD1-CD1 4.25Å; Y53-Y65 CarbonylContact O-C 3.52Å; Y53-Y65 VanDerWaalsContact O-CA 3.3Å; Y53-Y65 WeakPolarHBondContact O-CA 3.23Å; Y53-W66 PolarHBondContact N-O 3.16Å; Y53-W66 PolarHBondContact O-N 2.83Å; Y53-A68 HydrophobicContact CD2-CB 3.98Å; Y53-A68 HydrophobicContact CE2-CB 3.58Å
54	K	91.1	Very high	83.9	Confident	33 Å²	33	70.5 Å²	70.5	14%	0.143	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.2	170.6	172.5	-176.8	-178.4	-177.9	0	107.8	T43 E46 L48 P63 Y64 Y65	T43-K54 HydrophobicContact CG2-CB 3.6Å; T43-K54 HydrophobicContact CG2-CD 4.19Å; T43-K54 HydrophobicContact CG2-CG 4.15Å; T43-K54 WeakPolarHBondContact CG2-O 3.41Å; E46-K54 VanDerWaalsContact CD-NZ 3.34Å; E46-K54 IonicContact OE1-NZ 3.78Å; E46-K54 PolarHBondContact OE1-NZ 3.08Å; E46-K54 WeakPolarHBondContact OE2-CD 3.33Å; E46-K54 IonicContact OE2-NZ 3.87Å; E46-K54 PolarHBondContact OE2-NZ 3.44Å; E46-K54 VanDerWaalsContact OE2-NZ 3.1Å; L48-K54 HydrophobicContact CD1-CB 4.19Å; K54-P63 HydrophobicContact CD-CB 4.31Å; K54-P63 HydrophobicContact CG-CB 3.84Å; K54-Y64 CarbonylContact C-O 3.58Å; K54-Y64 WeakPolarHBondContact CA-O 3.48Å; K54-Y65 HydrophobicContact CB-CD1 4.01Å; K54-Y65 HydrophobicContact CB-CE1 3.9Å; K54-Y65 HydrophobicContact CD-CE1 4.19Å; K54-Y65 HydrophobicContact CG-CE1 4.13Å
55	V	89.6	Confident	85.4	Confident	11 Å²	11	63.7 Å²	63.7	7%	0.067	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.8	-174.1	-174.9	0	0	0	0	107.4	V38 P63 Y64 W66	V38-V55 HydrophobicContact CG2-CG1 4.09Å; V55-P63 CarbonylContact O-C 3.55Å; V55-P63 WeakPolarHBondContact O-CA 3.38Å; V55-Y64 HydrophobicContact CB-CD1 4.24Å; V55-Y64 HydrophobicContact CB-CE1 3.7Å; V55-Y64 HydrophobicContact CB-CE2 4.01Å; V55-Y64 HydrophobicContact CG1-CE1 3.64Å; V55-Y64 HydrophobicContact CG1-CE2 4.43Å; V55-Y64 VanDerWaalsContact CG1-OH 3.31Å; V55-Y64 WeakPolarHBondContact CG1-OH 3.37Å; V55-Y64 PolarHBondContact N-O 2.85Å; V55-Y64 WeakPolarHBondContact O-CD1 3.3Å; V55-Y64 PolarHBondContact O-N 3.34Å; V55-Y64 VanDerWaalsContact O-O 3.09Å; V55-W66 HydrophobicContact CG2-CB 4.37Å; V55-W66 HydrophobicContact CG2-CE3 4.39Å
56	F	89.1	Confident	86.8	Confident	74 Å²	74	60.1 Å²	60.1	33%	0.325	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.4	176.3	-70.2	-88.7	0	0	0	109.9	P37 P58 G61 P63	P37-F56 VanDerWaalsContact O-CD2 3.25Å; P37-F56 WeakPolarHBondContact O-CD2 3.4Å; F56-P58 WeakPolarHBondContact O-CD 3.38Å; F56-G61 WeakPolarHBondContact CD1-O 3.37Å; F56-P63 HydrophobicContact CD1-CB 3.96Å; F56-P63 HydrophobicContact CD1-CG 4.46Å; F56-P63 HydrophobicContact CE1-CB 3.7Å; F56-P63 HydrophobicContact CE1-CG 3.98Å; F56-P63 HydrophobicContact CZ-CB 4.14Å
57	D	83.8	Confident	87.9	Confident	37 Å²	37	55.8 Å²	55.8	20%	0.198	33%	0.331	C	S	.	.			trans	-73.8	119.4	175.4	177.6	-6.1	0	0	0	109.4	S59 C60 G61 L62 Y64	D57-S59 PolarHBondContact O-N 3.01Å; D57-S59 VanDerWaalsContact O-N 3.07Å; D57-S59 WeakPolarHBondContact OD1-CB 3.36Å; D57-S59 PolarHBondContact OD1-N 3.11Å; D57-S59 PolarHBondContact OD1-OG 3.36Å; D57-S59 PolarHBondContact OD2-OG 2.99Å; D57-C60 PolarHBondContact O-N 2.94Å; D57-G61 WeakPolarHBondContact O-CA 3.45Å; D57-G61 PolarHBondContact O-N 3.25Å; D57-L62 PolarHBondContact N-O 3.31Å; D57-Y64 HydrophobicContact CB-CD1 4.01Å; D57-Y64 HydrophobicContact CB-CE1 4.1Å
58	P	85.9	Confident	88.3	Confident	123 Å²	123	55.2 Å²	55.2	80%	0.799	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.5	-179.6	-24.2	34.5	0	0	0	114.1	F56	F56-P58 WeakPolarHBondContact O-CD 3.38Å
59	S	82	Confident	88.6	Confident	100 Å²	100	60.1 Å²	60.1	70%	0.699	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-26.1	-177.2	70.8	0	0	0	0	113.5	D57	D57-S59 PolarHBondContact O-N 3.01Å; D57-S59 VanDerWaalsContact O-N 3.07Å; D57-S59 WeakPolarHBondContact OD1-CB 3.36Å; D57-S59 PolarHBondContact OD1-N 3.11Å; D57-S59 PolarHBondContact OD1-OG 3.36Å; D57-S59 PolarHBondContact OD2-OG 2.99Å
60	C	84.8	Confident	88.9	Confident	64 Å²	64	61.9 Å²	61.9	43%	0.432	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.2	-8.7	-175.7	61.5	0	0	0	0	114.5	D57 L62	D57-C60 PolarHBondContact O-N 2.94Å; C60-L62 HydrophobicContact CB-CD1 4.45Å; C60-L62 HydrophobicContact CB-CG 4.44Å; C60-L62 PolarHBondContact O-N 2.93Å; C60-L62 VanDerWaalsContact O-N 3.15Å
61	G	83.7	Confident	89.1	Confident	50 Å²	50	58.2 Å²	58.2	52%	0.515	33%	0.332	S	S	.	.			trans	64.6	10.2	-176.5	0	0	0	0	0	113.9	F56 D57	F56-G61 WeakPolarHBondContact CD1-O 3.37Å; D57-G61 WeakPolarHBondContact O-CA 3.45Å; D57-G61 PolarHBondContact O-N 3.25Å
62	L	86.9	Confident	89.3	Confident	104 Å²	104	59.1 Å²	59.1	55%	0.545	33%	0.333	S	S	.	.			trans	-89.9	141.4	178.6	-67.2	172.6	0	0	0	110.3	D57 C60	D57-L62 PolarHBondContact N-O 3.31Å; C60-L62 HydrophobicContact CB-CD1 4.45Å; C60-L62 HydrophobicContact CB-CG 4.44Å; C60-L62 PolarHBondContact O-N 2.93Å; C60-L62 VanDerWaalsContact O-N 3.15Å
63	P	91.5	Very high	89.4	Confident	41 Å²	41	59 Å²	59	27%	0.266	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	139.3	174.8	28.8	-31.6	0	0	0	110.7	K54 V55 F56	K54-P63 HydrophobicContact CD-CB 4.31Å; K54-P63 HydrophobicContact CG-CB 3.84Å; V55-P63 CarbonylContact O-C 3.55Å; V55-P63 WeakPolarHBondContact O-CA 3.38Å; F56-P63 HydrophobicContact CD1-CB 3.96Å; F56-P63 HydrophobicContact CD1-CG 4.46Å; F56-P63 HydrophobicContact CE1-CB 3.7Å; F56-P63 HydrophobicContact CE1-CG 3.98Å; F56-P63 HydrophobicContact CZ-CB 4.14Å
64	Y	91.6	Very high	89.6	Confident	65 Å²	65	56.1 Å²	56.1	26%	0.255	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	159.4	163.7	71.7	-85.5	0	0	0	109.2	K54 V55 D57 W66 V73	K54-Y64 CarbonylContact C-O 3.58Å; K54-Y64 WeakPolarHBondContact CA-O 3.48Å; V55-Y64 HydrophobicContact CB-CD1 4.24Å; V55-Y64 HydrophobicContact CB-CE1 3.7Å; V55-Y64 HydrophobicContact CB-CE2 4.01Å; V55-Y64 HydrophobicContact CG1-CE1 3.64Å; V55-Y64 HydrophobicContact CG1-CE2 4.43Å; V55-Y64 VanDerWaalsContact CG1-OH 3.31Å; V55-Y64 WeakPolarHBondContact CG1-OH 3.37Å; V55-Y64 PolarHBondContact N-O 2.85Å; V55-Y64 WeakPolarHBondContact O-CD1 3.3Å; V55-Y64 PolarHBondContact O-N 3.34Å; V55-Y64 VanDerWaalsContact O-O 3.09Å; D57-Y64 HydrophobicContact CB-CD1 4.01Å; D57-Y64 HydrophobicContact CB-CE1 4.1Å; Y64-W66 HydrophobicContact CD2-CB 4.42Å; Y64-W66 HydrophobicContact CE2-CB 4.02Å; Y64-V73 HydrophobicContact CE2-CG1 4.45Å
65	Y	92.6	Very high	89.7	Confident	29 Å²	29	62.5 Å²	62.5	11%	0.114	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.6	-177.8	-60.2	-94	0	0	0	109.2	L48 Y53 K54 V73 S74 L76	L48-Y65 HydrophobicContact CD1-CD1 4.05Å; L48-Y65 HydrophobicContact CD1-CE1 4.11Å; L48-Y65 HydrophobicContact CD2-CD1 3.57Å; L48-Y65 HydrophobicContact CD2-CE1 3.72Å; L48-Y65 HydrophobicContact CG-CD1 4.49Å; L48-Y65 HydrophobicContact CG-CE1 4.47Å; Y53-Y65 CarbonylContact O-C 3.52Å; Y53-Y65 VanDerWaalsContact O-CA 3.3Å; Y53-Y65 WeakPolarHBondContact O-CA 3.23Å; K54-Y65 HydrophobicContact CB-CD1 4.01Å; K54-Y65 HydrophobicContact CB-CE1 3.9Å; K54-Y65 HydrophobicContact CD-CE1 4.19Å; K54-Y65 HydrophobicContact CG-CE1 4.13Å; Y65-V73 CarbonylContact O-C 3.51Å; Y65-V73 VanDerWaalsContact O-CA 3.28Å; Y65-V73 WeakPolarHBondContact O-CA 3.48Å; Y65-S74 PolarHBondContact N-O 3.43Å; Y65-S74 PolarHBondContact O-N 2.9Å; Y65-L76 WeakPolarHBondContact CD2-O 3.41Å
66	W	93.6	Very high	89.8	Confident	73 Å²	73	65.5 Å²	65.5	28%	0.277	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.5	-178	171.7	51.9	0	0	0	110.6	W52 Y53 V55 Y64 A68 D71 L72 V73	W52-W66 CarbonylContact C-O 3.59Å; W52-W66 WeakPolarHBondContact CA-O 3.46Å; Y53-W66 PolarHBondContact N-O 3.16Å; Y53-W66 PolarHBondContact O-N 2.83Å; V55-W66 HydrophobicContact CG2-CB 4.37Å; V55-W66 HydrophobicContact CG2-CE3 4.39Å; Y64-W66 HydrophobicContact CD2-CB 4.42Å; Y64-W66 HydrophobicContact CE2-CB 4.02Å; W66-A68 HydrophobicContact CH2-CB 4.24Å; W66-A68 HydrophobicContact CZ2-CB 4.34Å; W66-A68 HydrophobicContact CZ3-CB 4.49Å; W66-D71 PolarHBondContact NE1-OD1 3.4Å; W66-L72 WeakPolarHBondContact CA-O 3.39Å; W66-V73 HydrophobicContact CB-CG1 4.38Å; W66-V73 HydrophobicContact CG-CG1 4.41Å
67	N	92.8	Very high	89.8	Confident	14 Å²	14	62.9 Å²	62.9	8%	0.075	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114.8	172.5	-174	-70.4	0	0	0	110.2	S51 W52 D69 T70 D71 L72	S51-N67 CarbonylContact O-C 3.59Å; S51-N67 WeakPolarHBondContact O-CA 3.43Å; W52-N67 VanDerWaalsContact CD1-ND2 3.26Å; W52-N67 HydrophobicContact CD2-CB 3.86Å; W52-N67 HydrophobicContact CE3-CB 4.1Å; W52-N67 HydrophobicContact CG-CB 4.37Å; W52-N67 HydrophobicContact CH2-CB 4.34Å; W52-N67 HydrophobicContact CZ2-CB 4.09Å; W52-N67 HydrophobicContact CZ3-CB 4.34Å; W52-N67 PolarHBondContact NE1-ND2 3.04Å; N67-D69 VanDerWaalsContact C-N 3.34Å; N67-D69 PolarHBondContact O-N 3.11Å; N67-D69 PolarHBondContact OD1-N 3.02Å; N67-D69 VanDerWaalsContact OD1-N 3.11Å; N67-T70 WeakPolarHBondContact CB-OG1 2.95Å; N67-T70 PolarHBondContact OD1-N 3.3Å; N67-T70 PolarHBondContact OD1-OG1 3.38Å; N67-D71 WeakPolarHBondContact O-CA 3.46Å; N67-D71 PolarHBondContact O-N 2.87Å; N67-L72 HydrophobicContact CB-CB 4.39Å; N67-L72 PolarHBondContact N-O 3.38Å
68	A	90.3	Very high	89.9	Confident	41 Å²	41	62.8 Å²	62.8	34%	0.339	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-29.6	-174.7	0	0	0	0	0	113.9	S51 Y53 W66	S51-A68 PolarHBondContact O-N 3.46Å; Y53-A68 HydrophobicContact CD2-CB 3.98Å; Y53-A68 HydrophobicContact CE2-CB 3.58Å; W66-A68 HydrophobicContact CH2-CB 4.24Å; W66-A68 HydrophobicContact CZ2-CB 4.34Å; W66-A68 HydrophobicContact CZ3-CB 4.49Å
69	D	91.4	Very high	89.9	Confident	125 Å²	125	62.8 Å²	62.8	67%	0.668	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-40.1	-176.8	-66.7	-21.4	0	0	0	112.1	S51 N67	S51-D69 WeakPolarHBondContact CB-OD2 3.32Å; S51-D69 PolarHBondContact OG-OD2 3.17Å; N67-D69 VanDerWaalsContact C-N 3.34Å; N67-D69 PolarHBondContact O-N 3.11Å; N67-D69 PolarHBondContact OD1-N 3.02Å; N67-D69 VanDerWaalsContact OD1-N 3.11Å
70	T	90.2	Very high	90.1	Very high	71 Å²	71	61.4 Å²	61.4	44%	0.436	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-12.2	-174.2	57	0	0	0	0	113.1	N67 L72	N67-T70 WeakPolarHBondContact CB-OG1 2.95Å; N67-T70 PolarHBondContact OD1-N 3.3Å; N67-T70 PolarHBondContact OD1-OG1 3.38Å; T70-L72 PolarHBondContact O-N 3.34Å; T70-L72 WeakPolarHBondContact OG1-CD1 3.39Å; T70-L72 WeakPolarHBondContact OG1-CG 3.39Å
71	D	90.8	Very high	90.4	Very high	38 Å²	38	64.4 Å²	64.4	20%	0.203	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	32.8	-171.7	-160.5	41.8	0	0	0	113.2	W66 N67 S88 K91	W66-D71 PolarHBondContact NE1-OD1 3.4Å; N67-D71 WeakPolarHBondContact O-CA 3.46Å; N67-D71 PolarHBondContact O-N 2.87Å; D71-S88 PolarHBondContact O-N 3.05Å; D71-S88 PolarHBondContact OD2-OG 3.08Å; D71-K91 HydrophobicContact CB-CD 4.27Å; D71-K91 WeakPolarHBondContact OD2-CD 3.46Å; D71-K91 WeakPolarHBondContact OD2-CE 3.29Å; D71-K91 IonicContact OD2-NZ 2.99Å; D71-K91 PolarHBondContact OD2-NZ 3.43Å
72	L	92.6	Very high	90.7	Very high	53 Å²	53	68 Å²	68	28%	0.277	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	147.5	173.4	-64.6	174.8	0	0	0	109.8	W66 N67 T70 V85 T86 K87	W66-L72 WeakPolarHBondContact CA-O 3.39Å; N67-L72 HydrophobicContact CB-CB 4.39Å; N67-L72 PolarHBondContact N-O 3.38Å; T70-L72 PolarHBondContact O-N 3.34Å; T70-L72 WeakPolarHBondContact OG1-CD1 3.39Å; T70-L72 WeakPolarHBondContact OG1-CG 3.39Å; L72-V85 HydrophobicContact CB-CG1 3.5Å; L72-V85 HydrophobicContact CD1-CG1 3.71Å; L72-V85 HydrophobicContact CD2-CG1 4.39Å; L72-V85 HydrophobicContact CG-CG1 4.06Å; L72-T86 CarbonylContact C-O 3.47Å; L72-T86 WeakPolarHBondContact CA-O 3.46Å; L72-K87 HydrophobicContact CD2-CG 4.34Å
73	V	94	Very high	90.9	Very high	29 Å²	29	64.4 Å²	64.4	18%	0.176	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145	-178.8	-63.2	0	0	0	0	110.8	Y64 Y65 W66 T86	Y64-V73 HydrophobicContact CE2-CG1 4.45Å; Y65-V73 CarbonylContact O-C 3.51Å; Y65-V73 VanDerWaalsContact O-CA 3.28Å; Y65-V73 WeakPolarHBondContact O-CA 3.48Å; W66-V73 HydrophobicContact CB-CG1 4.38Å; W66-V73 HydrophobicContact CG-CG1 4.41Å; V73-T86 PolarHBondContact N-O 3.14Å; V73-T86 PolarHBondContact O-N 3.49Å; V73-T86 PolarHBondContact O-OG1 3.01Å
74	S	93.3	Very high	90.9	Very high	3 Å²	3	67.2 Å²	67.2	2%	0.021	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	148	173.8	-174.9	0	0	0	0	110.3	Y65 L76 S83 V84	Y65-S74 PolarHBondContact N-O 3.43Å; Y65-S74 PolarHBondContact O-N 2.9Å; S74-L76 WeakPolarHBondContact CB-O 3.3Å; S74-L76 PolarHBondContact OG-N 3.12Å; S74-L76 PolarHBondContact OG-O 3.47Å; S74-L76 VanDerWaalsContact OG-O 3.1Å; S74-S83 PolarHBondContact OG-OG 3.01Å; S74-V84 PolarHBondContact OG-O 3.24Å
75	W	92.8	Very high	90.9	Very high	167 Å²	167	67.2 Å²	67.2	63%	0.633	36%	0.362	S	S	*	.	S	Bend	trans	-82.6	-16.8	174.6	-66.9	109.4	0	0	0	113.2
76	L	91.7	Very high	90.9	Very high	74 Å²	74	68.8 Å²	68.8	39%	0.387	38%	0.375	S	S	.	.	S	Bend	trans	-117.6	161.7	178.8	-63.3	178.3	0	0	0	110.2	Y65 S74 D80 N82 S83	Y65-L76 WeakPolarHBondContact CD2-O 3.41Å; S74-L76 WeakPolarHBondContact CB-O 3.3Å; S74-L76 PolarHBondContact OG-N 3.12Å; S74-L76 PolarHBondContact OG-O 3.47Å; S74-L76 VanDerWaalsContact OG-O 3.1Å; L76-D80 HydrophobicContact CB-CB 4.12Å; L76-N82 HydrophobicContact CD1-CB 3.84Å; L76-S83 PolarHBondContact O-OG 3.06Å; L76-S83 VanDerWaalsContact O-OG 3.13Å
77	S	88.8	Confident	90.9	Very high	19 Å²	19	71.7 Å²	71.7	13%	0.133	39%	0.39	C	S	.	.			trans	-58.3	143.1	178.4	-177.1	0	0	0	0	109	H79 D80 S83	S77-H79 PolarHBondContact O-N 3.41Å; S77-D80 WeakPolarHBondContact CB-OD2 3.41Å; S77-D80 PolarHBondContact N-OD2 2.99Å; S77-D80 WeakPolarHBondContact O-CB 3.17Å; S77-D80 PolarHBondContact O-N 3.45Å; S77-S83 WeakPolarHBondContact O-CB 3.19Å; S77-S83 PolarHBondContact O-OG 2.7Å
78	P	87.2	Confident	90.7	Very high	35 Å²	35	71.6 Å²	71.6	23%	0.227	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.6	174.1	-25.7	35	0	0	0	114	L48 P49 W52	L48-P78 HydrophobicContact CD2-CG 4.14Å; P49-P78 HydrophobicContact CG-CB 3.79Å; P49-P78 HydrophobicContact CG-CG 4.28Å; W52-P78 HydrophobicContact CB-CG 4.33Å; W52-P78 HydrophobicContact CD2-CB 4.19Å; W52-P78 HydrophobicContact CD2-CG 3.3Å; W52-P78 HydrophobicContact CE3-CG 3.34Å; W52-P78 HydrophobicContact CG-CG 3.8Å; W52-P78 HydrophobicContact CH2-CG 4.04Å; W52-P78 HydrophobicContact CZ2-CB 4.29Å; W52-P78 HydrophobicContact CZ2-CG 4.04Å; W52-P78 HydrophobicContact CZ3-CG 3.71Å
79	H	85.6	Confident	90.5	Very high	124 Å²	124	72.6 Å²	72.6	57%	0.574	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.9	175.3	-67	102.1	0	0	0	113.7	G47 P49 S77	G47-H79 PolarHBondContact O-CE1 3.07Å; P49-H79 WeakPolarHBondContact CD-CE1 3.25Å; S77-H79 PolarHBondContact O-N 3.41Å
80	D	86.7	Confident	90.1	Very high	71 Å²	71	74.8 Å²	74.8	38%	0.38	40%	0.402	S	S	.	.	S	Bend	trans	-75.6	135.5	179.7	-69.9	-46.8	0	0	0	110.6	L76 S77 N82 S83	L76-D80 HydrophobicContact CB-CB 4.12Å; S77-D80 WeakPolarHBondContact CB-OD2 3.41Å; S77-D80 PolarHBondContact N-OD2 2.99Å; S77-D80 WeakPolarHBondContact O-CB 3.17Å; S77-D80 PolarHBondContact O-N 3.45Å; D80-N82 PolarHBondContact O-N 3.47Å; D80-N82 VanDerWaalsContact O-N 3.11Å; D80-S83 WeakPolarHBondContact O-CB 3.31Å; D80-S83 PolarHBondContact O-N 3.33Å
81	P	90.9	Very high	89.8	Confident	127 Å²	127	76.3 Å²	76.3	83%	0.825	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.3	-178.4	26.1	-34.9	0	0	0	113.4
82	N	90.2	Very high	89.2	Confident	125 Å²	125	78.4 Å²	78.4	67%	0.668	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	8.1	178.6	-63.9	-30.9	0	0	0	112.7	L76 D80 V84	L76-N82 HydrophobicContact CD1-CB 3.84Å; D80-N82 PolarHBondContact O-N 3.47Å; D80-N82 VanDerWaalsContact O-N 3.11Å; N82-V84 PolarHBondContact O-N 2.73Å
83	S	90.8	Very high	88.5	Confident	28 Å²	28	85 Å²	85	20%	0.196	43%	0.434	C	S	.	.			trans	-68.7	117.9	-178	-162.3	0	0	0	0	111	S74 L76 S77 D80	S74-S83 PolarHBondContact OG-OG 3.01Å; L76-S83 PolarHBondContact O-OG 3.06Å; L76-S83 VanDerWaalsContact O-OG 3.13Å; S77-S83 WeakPolarHBondContact O-CB 3.19Å; S77-S83 PolarHBondContact O-OG 2.7Å; D80-S83 WeakPolarHBondContact O-CB 3.31Å; D80-S83 PolarHBondContact O-N 3.33Å
84	V	91.4	Very high	87.6	Confident	101 Å²	101	86.9 Å²	86.9	61%	0.612	45%	0.449	S	S	*	.			trans	-105.1	103.7	177.3	-175.4	0	0	0	0	108.9	S74 N82 T86	S74-V84 PolarHBondContact OG-O 3.24Å; N82-V84 PolarHBondContact O-N 2.73Å; V84-T86 HydrophobicContact CG1-CG2 3.97Å
85	V	91.5	Very high	86.6	Confident	64 Å²	64	89.6 Å²	89.6	39%	0.388	47%	0.468	S	S	.	.			trans	-82.2	120.6	179.4	-175.6	0	0	0	0	109.9	W52 L72	W52-V85 HydrophobicContact CH2-CB 4.44Å; W52-V85 HydrophobicContact CH2-CG1 3.81Å; W52-V85 HydrophobicContact CH2-CG2 3.76Å; W52-V85 HydrophobicContact CZ2-CG1 4.3Å; W52-V85 HydrophobicContact CZ2-CG2 4.21Å; L72-V85 HydrophobicContact CB-CG1 3.5Å; L72-V85 HydrophobicContact CD1-CG1 3.71Å; L72-V85 HydrophobicContact CD2-CG1 4.39Å; L72-V85 HydrophobicContact CG-CG1 4.06Å
86	T	93.1	Very high	85.3	Confident	63 Å²	63	86.9 Å²	86.9	39%	0.387	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	166.1	-177.6	60.5	0	0	0	0	111.4	L72 V73 V84	L72-T86 CarbonylContact C-O 3.47Å; L72-T86 WeakPolarHBondContact CA-O 3.46Å; V73-T86 PolarHBondContact N-O 3.14Å; V73-T86 PolarHBondContact O-N 3.49Å; V73-T86 PolarHBondContact O-OG1 3.01Å; V84-T86 HydrophobicContact CG1-CG2 3.97Å
87	K	92.1	Very high	84	Confident	134 Å²	134	86.1 Å²	86.1	58%	0.583	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	145.1	172.1	-69.2	178.4	178.8	177.6	0	109.9	L72 A89 L92	L72-K87 HydrophobicContact CD2-CG 4.34Å; K87-A89 PolarHBondContact O-N 3.28Å; K87-L92 HydrophobicContact CB-CD2 4.22Å; K87-L92 HydrophobicContact CB-CG 4.16Å; K87-L92 HydrophobicContact CD-CD2 4.4Å
88	S	90	Very high	82.6	Confident	12 Å²	12	90.5 Å²	90.5	8%	0.084	49%	0.492	C	S	.	.			trans	-52.1	140.3	174	69	0	0	0	0	111.7	D71 K90 K91 L92	D71-S88 PolarHBondContact O-N 3.05Å; D71-S88 PolarHBondContact OD2-OG 3.08Å; S88-K90 PolarHBondContact O-N 3.33Å; S88-K90 VanDerWaalsContact O-N 3.1Å; S88-K91 PolarHBondContact O-N 3.03Å; S88-K91 WeakPolarHBondContact OG-CG 3.49Å; S88-L92 PolarHBondContact O-N 3.18Å; S88-L92 VanDerWaalsContact O-N 3.14Å
89	A	84.7	Confident	81.2	Confident	61 Å²	61	91.6 Å²	91.6	50%	0.504	50%	0.504	S	S	.	.	H	α-helix	trans	-57.6	-28.8	-179.6	0	0	0	0	0	112.4	K87 R93	K87-A89 PolarHBondContact O-N 3.28Å; A89-R93 WeakPolarHBondContact O-CG 3.42Å; A89-R93 PolarHBondContact O-N 3.45Å
90	K	84.1	Confident	79.9	Confident	171 Å²	171	92.4 Å²	92.4	74%	0.743	51%	0.508	S	S	*	.	H	α-helix	trans	-63.2	-47	174.4	-172.8	174.3	-179.6	178	0	111.7	S88 R93 S94	S88-K90 PolarHBondContact O-N 3.33Å; S88-K90 VanDerWaalsContact O-N 3.1Å; K90-R93 PolarHBondContact O-N 3.03Å; K90-S94 PolarHBondContact O-N 3.32Å; K90-S94 PolarHBondContact O-OG 3.49Å
91	K	83	Confident	78.6	Confident	103 Å²	103	93.9 Å²	93.9	45%	0.448	51%	0.513	S	S	.	.	H	α-helix	trans	-66.9	-37.3	178	-75.7	-177.6	173.4	179.1	0	112.7	D71 S88 R93 S94 S95	D71-K91 HydrophobicContact CB-CD 4.27Å; D71-K91 WeakPolarHBondContact OD2-CD 3.46Å; D71-K91 WeakPolarHBondContact OD2-CE 3.29Å; D71-K91 IonicContact OD2-NZ 2.99Å; D71-K91 PolarHBondContact OD2-NZ 3.43Å; S88-K91 PolarHBondContact O-N 3.03Å; S88-K91 WeakPolarHBondContact OG-CG 3.49Å; K91-R93 VanDerWaalsContact C-N 3.34Å; K91-R93 PolarHBondContact O-N 3.27Å; K91-S94 PolarHBondContact O-N 3.22Å; K91-S95 PolarHBondContact O-N 3.45Å; K91-S95 PolarHBondContact O-OG 2.87Å
92	L	78.9	Confident	76.9	Confident	82 Å²	82	96.2 Å²	96.2	43%	0.429	51%	0.51	S	S	.	.	H	α-helix	trans	-64	-37	176.4	-71.7	175.3	0	0	0	112.7	K87 S88 S95 N96	K87-L92 HydrophobicContact CB-CD2 4.22Å; K87-L92 HydrophobicContact CB-CG 4.16Å; K87-L92 HydrophobicContact CD-CD2 4.4Å; S88-L92 PolarHBondContact O-N 3.18Å; S88-L92 VanDerWaalsContact O-N 3.14Å; L92-S95 PolarHBondContact O-OG 2.8Å; L92-N96 PolarHBondContact O-N 2.88Å; L92-N96 PolarHBondContact O-OD1 2.75Å
93	R	77.9	Confident	75.2	Confident	192 Å²	192	96.5 Å²	96.5	73%	0.725	51%	0.511	S	S	*	.	H	α-helix	trans	-65.7	-42.5	176.3	-71.3	176.8	-156.4	-122.6	6.2	112.2	A89 K90 K91 N96 A97	A89-R93 WeakPolarHBondContact O-CG 3.42Å; A89-R93 PolarHBondContact O-N 3.45Å; K90-R93 PolarHBondContact O-N 3.03Å; K91-R93 VanDerWaalsContact C-N 3.34Å; K91-R93 PolarHBondContact O-N 3.27Å; R93-N96 PolarHBondContact O-N 3.3Å; R93-A97 WeakPolarHBondContact O-CB 3.3Å; R93-A97 PolarHBondContact O-N 2.7Å
94	S	75.4	Confident	73.5	Confident	68 Å²	68	101.4 Å²	101.4	48%	0.476	54%	0.535	S	S	.	.	H	α-helix	trans	-60.7	-47.5	177.3	-61.8	0	0	0	0	112.1	K90 K91 N96 A97 D98	K90-S94 PolarHBondContact O-N 3.32Å; K90-S94 PolarHBondContact O-OG 3.49Å; K91-S94 PolarHBondContact O-N 3.22Å; S94-N96 VanDerWaalsContact C-N 3.29Å; S94-N96 PolarHBondContact O-N 3.37Å; S94-A97 PolarHBondContact O-N 2.85Å; S94-D98 PolarHBondContact O-N 2.85Å; S94-D98 VanDerWaalsContact O-N 3.15Å
95	S	72.1	Confident	71.7	Confident	61 Å²	61	105.5 Å²	105.5	43%	0.427	54%	0.539	S	S	.	.	H	α-helix	trans	-63.9	-32.5	-179.8	55.1	0	0	0	0	113.9	K91 L92 A99	K91-S95 PolarHBondContact O-N 3.45Å; K91-S95 PolarHBondContact O-OG 2.87Å; L92-S95 PolarHBondContact O-OG 2.8Å; S95-A99 PolarHBondContact O-N 3.29Å
96	N	65	Low	69.8	Low	109 Å²	109	107.1 Å²	107.1	58%	0.583	55%	0.553	S	S	*	*	H	α-helix	trans	-75.9	-36.1	177.1	-77.7	26.8	0	0	0	111.9	L92 R93 S94 A99 E100	L92-N96 PolarHBondContact O-N 2.88Å; L92-N96 PolarHBondContact O-OD1 2.75Å; R93-N96 PolarHBondContact O-N 3.3Å; S94-N96 VanDerWaalsContact C-N 3.29Å; S94-N96 PolarHBondContact O-N 3.37Å; N96-A99 PolarHBondContact O-N 3.43Å; N96-E100 VanDerWaalsContact O-CG 3.32Å; N96-E100 WeakPolarHBondContact O-CG 3.25Å; N96-E100 PolarHBondContact O-N 3Å; N96-E100 VanDerWaalsContact O-N 3.13Å
97	A	63.9	Low	67.8	Low	58 Å²	58	111.9 Å²	111.9	48%	0.479	57%	0.571	S	S	.	*	H	α-helix	trans	-64	-41.6	176.8	0	0	0	0	0	112.3	R93 S94 A99 E100 E101	R93-A97 WeakPolarHBondContact O-CB 3.3Å; R93-A97 PolarHBondContact O-N 2.7Å; S94-A97 PolarHBondContact O-N 2.85Å; A97-A99 VanDerWaalsContact C-N 3.25Å; A97-A99 PolarHBondContact O-N 2.77Å; A97-E100 PolarHBondContact O-N 3.16Å; A97-E101 PolarHBondContact O-N 2.86Å; A97-E101 VanDerWaalsContact O-N 3.11Å
98	D	59.2	Low	65.8	Low	111 Å²	111	110.7 Å²	110.7	59%	0.594	57%	0.571	S	S	*	*	H	α-helix	trans	-65.9	-27.8	176.5	-67.8	-38.5	0	0	0	112.7	S94	S94-D98 PolarHBondContact O-N 2.85Å; S94-D98 VanDerWaalsContact O-N 3.15Å
99	A	58.6	Low	63.9	Low	58 Å²	58	119.8 Å²	119.8	48%	0.479	61%	0.609	S	S	.	*	H	α-helix	trans	-75.6	-37	175.9	0	0	0	0	0	112.3	S95 N96 A97	S95-A99 PolarHBondContact O-N 3.29Å; N96-A99 PolarHBondContact O-N 3.43Å; A97-A99 VanDerWaalsContact C-N 3.25Å; A97-A99 PolarHBondContact O-N 2.77Å
100	E	58.3	Low	62.1	Low	142 Å²	142	122 Å²	122	66%	0.664	62%	0.621	S	S	*	*	H	α-helix	trans	-71.2	-40.8	178.7	-67.8	-98.8	140.2	0	0	111.9	N96 A97 K102 L103 D104	N96-E100 VanDerWaalsContact O-CG 3.32Å; N96-E100 WeakPolarHBondContact O-CG 3.25Å; N96-E100 PolarHBondContact O-N 3Å; N96-E100 VanDerWaalsContact O-N 3.13Å; A97-E100 PolarHBondContact O-N 3.16Å; E100-K102 PolarHBondContact O-N 3.3Å; E100-K102 VanDerWaalsContact O-N 3.15Å; E100-L103 PolarHBondContact O-N 3.15Å; E100-L103 VanDerWaalsContact O-N 3.09Å; E100-D104 PolarHBondContact O-N 2.81Å
101	E	58.8	Low	60.4	Low	102 Å²	102	121.2 Å²	121.2	48%	0.477	63%	0.625	S	S	.	*	H	α-helix	trans	-61.3	-27.3	178.5	-168	-175.3	165.4	0	0	112.6	A97 L103 R105	A97-E101 PolarHBondContact O-N 2.86Å; A97-E101 VanDerWaalsContact O-N 3.11Å; E101-L103 VanDerWaalsContact C-N 3.35Å; E101-R105 IonicContact OE1-CZ 3.74Å; E101-R105 IonicContact OE1-NH1 3.59Å; E101-R105 PolarHBondContact OE1-NH1 2.77Å; E101-R105 IonicContact OE1-NH2 3.18Å
102	K	55.3	Low	58.8	Low	176 Å²	176	126.4 Å²	126.4	77%	0.765	64%	0.642	S	S	*	*	H	α-helix	trans	-77	-20.5	-180	-151.9	178.4	-177.2	-171.5	0	113.2	E100	E100-K102 PolarHBondContact O-N 3.3Å; E100-K102 VanDerWaalsContact O-N 3.15Å
103	L	54.8	Low	57	Low	130 Å²	130	126 Å²	126	68%	0.681	66%	0.657	S	S	*	*	H	α-helix	trans	-85.8	-35.4	177.9	-71.3	167.8	0	0	0	111.9	E100 E101 S106	E100-L103 PolarHBondContact O-N 3.15Å; E100-L103 VanDerWaalsContact O-N 3.09Å; E101-L103 VanDerWaalsContact C-N 3.35Å; L103-S106 PolarHBondContact O-N 2.62Å
104	D	54.5	Low	55.5	Low	131 Å²	131	125.4 Å²	125.4	70%	0.701	66%	0.662	S	S	*	*	H	α-helix	trans	-70.9	-34.1	179.8	-104.1	-17.7	0	0	0	113.6	E100 S106 H107	E100-D104 PolarHBondContact O-N 2.81Å; D104-S106 PolarHBondContact O-N 3.43Å; D104-S106 VanDerWaalsContact O-N 3.14Å; D104-H107 PolarHBondContact O-N 2.87Å
105	R	55.5	Low	54.1	Low	187 Å²	187	129 Å²	129	71%	0.706	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-13.1	179	-102.9	-171.6	-172.8	105	2.9	114.7	E101	E101-R105 IonicContact OE1-CZ 3.74Å; E101-R105 IonicContact OE1-NH1 3.59Å; E101-R105 PolarHBondContact OE1-NH1 2.77Å; E101-R105 IonicContact OE1-NH2 3.18Å
106	S	51	Low	52.9	Low	98 Å²	98	135.4 Å²	135.4	69%	0.685	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-12.9	178.6	-175	0	0	0	0	113.4	L103 D104	L103-S106 PolarHBondContact O-N 2.62Å; D104-S106 PolarHBondContact O-N 3.43Å; D104-S106 VanDerWaalsContact O-N 3.14Å
107	H	50.8	Low	51.6	Low	163 Å²	163	135 Å²	135	76%	0.755	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-13.5	-170.6	-130	74.8	0	0	0	115.1	D104 K109	D104-H107 PolarHBondContact O-N 2.87Å; H107-K109 PolarHBondContact O-N 3.42Å
108	D	49.4	Very low	50.8	Low	110 Å²	110	139.4 Å²	139.4	59%	0.588	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	38.2	-177.6	-171.5	19.9	0	0	0	114.1	R112	D108-R112 IonicContact OD1-NH1 2.79Å; D108-R112 PolarHBondContact OD1-NH1 3.45Å; D108-R112 IonicContact OD2-NH1 3.43Å
109	K	50.3	Low	50.1	Low	203 Å²	203	145.7 Å²	145.7	88%	0.883	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.4	8.4	177.8	-88.2	-159.7	178.2	-178.7	0	117.4	H107	H107-K109 PolarHBondContact O-N 3.42Å
110	S	48.1	Very low	49.3	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	74%	0.741	S	S	*	*	S	Bend	trans	-116.5	6.1	-176.7	55.2	0	0	0	0	117.5
111	D	48.5	Very low	48.7	Very low	154 Å²	154	148.6 Å²	148.6	82%	0.824	75%	0.753	S	S	*	*			trans	-151	43.8	-175.6	-136.2	-4	0	0	0	118.4
112	R	49	Very low	47.9	Very low	212 Å²	212	152.4 Å²	152.4	80%	0.8	77%	0.771	S	S	*	*			trans	-105.8	69	162.3	-79.1	-172.6	179.2	101.2	-2.2	110.7	D108	D108-R112 IonicContact OD1-NH1 2.79Å; D108-R112 PolarHBondContact OD1-NH1 3.45Å; D108-R112 IonicContact OD2-NH1 3.43Å
113	G	40.6	Very low	47.6	Very low	74 Å²	74	153.3 Å²	153.3	76%	0.763	78%	0.775	S	S	*	*			trans	-66.5	125.5	162.2	0	0	0	0	0	110.8
114	H	47.2	Very low	47.3	Very low	178 Å²	178	152.5 Å²	152.5	82%	0.824	78%	0.777	S	S	*	*			trans	-86.7	117.3	-172.8	-174.9	-47.5	0	0	0	110.2
115	D	45.5	Very low	46.9	Very low	145 Å²	145	153.7 Å²	153.7	78%	0.775	78%	0.783	S	S	*	*			trans	-146	107.7	159.7	-167.3	41.7	0	0	0	111.3
116	K	46.3	Very low	46.3	Very low	194 Å²	194	156 Å²	156	84%	0.843	79%	0.792	S	S	*	*			trans	-143	111.5	164.8	-77	-164.1	179.2	-179.7	0	107.8
117	S	38.9	Very low	46	Very low	101 Å²	101	155.2 Å²	155.2	71%	0.706	80%	0.799	S	S	*	*			trans	-125.1	109.9	148.4	52.8	0	0	0	0	106
118	D	46.7	Very low	45.6	Very low	150 Å²	150	155.9 Å²	155.9	80%	0.802	80%	0.803	S	S	*	*				72	106.5	81.3	-154.9	8.3	0	0	0	112.1
119	R	43	Very low	45.7	Very low	244 Å²	244	156.9 Å²	156.9	92%	0.921	81%	0.808	S	S	*	*			trans	-175.9	99.5	155.5	-105.8	173.8	-168.4	118.7	0.7	109.9
120	G	43.4	Very low	45.3	Very low	62 Å²	62	155.1 Å²	155.1	64%	0.639	80%	0.8	S	S	*	*			trans	-69.4	162.6	165.5	0	0	0	0	0	112.5
121	H	44.1	Very low	44.8	Very low	198 Å²	198	154.9 Å²	154.9	92%	0.917	80%	0.799	S	S	*	*			trans	-153.4	127.4	154.6	-119.4	-74.9	0	0	0	111.2
122	E	42.7	Very low	44.8	Very low	183 Å²	183	154.6 Å²	154.6	86%	0.855	80%	0.797	S	S	*	*			trans	-79.4	153.4	-171.7	-61.9	173.7	138.8	0	0	112.8
123	K	48.8	Very low	44.5	Very low	195 Å²	195	156.2 Å²	156.2	85%	0.848	80%	0.803	S	S	*	*			trans	-66	162.9	165.8	-65	-175.1	176.7	-177.8	0	110.6
124	P	49.7	Very low	44.4	Very low	112 Å²	112	156.5 Å²	156.5	73%	0.727	81%	0.806	S	S	*	*				-140.7	151	120.7	30.5	-14.1	0	0	0	115.6
125	D	46.2	Very low	44.3	Very low	156 Å²	156	156.4 Å²	156.4	83%	0.834	81%	0.806	S	S	*	*			trans	-55.8	140.5	165	-70.9	-63.4	0	0	0	112.9
126	R	42.1	Very low	44.3	Very low	237 Å²	237	154.8 Å²	154.8	89%	0.894	80%	0.797	S	S	*	*			trans	-135.1	104.8	160.7	-96.3	-173.5	172.5	91.7	-1	109.6
127	G	44.9	Very low	44.4	Very low	81 Å²	81	155 Å²	155	84%	0.835	80%	0.798	S	S	*	*			trans	-68.5	151.4	165.7	0	0	0	0	0	111.8
128	H	42.7	Very low	44.6	Very low	177 Å²	177	154.7 Å²	154.7	82%	0.819	80%	0.796	S	S	*	*			trans	-127.7	106.8	168.6	-162.3	2.3	0	0	0	109.9
129	D	50.7	Low	44.6	Very low	130 Å²	130	152.5 Å²	152.5	70%	0.695	78%	0.784	S	S	*	*			trans	-69.6	134.5	161.1	167.5	54.9	0	0	0	110.4
130	K	42.8	Very low	44.9	Very low	166 Å²	166	152 Å²	152	72%	0.722	78%	0.782	S	S	*	*			trans	175.1	118.7	133.6	-95.3	169.2	-169.3	-176.6	0	116.1
131	S	37	Very low	45	Very low	104 Å²	104	155.9 Å²	155.9	73%	0.727	79%	0.788	S	S	*	*			trans	64.3	128.5	130.5	67.3	0	0	0	0	124.6
132	D	47.8	Very low	45.2	Very low	147 Å²	147	154.1 Å²	154.1	79%	0.786	77%	0.773	S	S	*	*			trans	-42.1	137.7	157.6	-62.8	-62.9	0	0	0	117.1
133	R	42.9	Very low	45.4	Very low	246 Å²	246	152.4 Å²	152.4	93%	0.928	77%	0.765	S	S	*	*				169.9	109.8	126.9	-95.9	177.6	-176.4	96.7	-2.9	113.2
134	G	38.9	Very low	45.5	Very low	80 Å²	80	152.6 Å²	152.6	83%	0.825	76%	0.761	S	S	*	*			trans	84.1	147.7	136.5	0	0	0	0	0	120.4
135	H	44.4	Very low	45.6	Very low	177 Å²	177	149 Å²	149	82%	0.819	74%	0.744	S	S	*	*			trans	91.7	89.5	163	-129.7	1.4	0	0	0	116.5
136	D	45.6	Very low	45.6	Very low	110 Å²	110	147.9 Å²	147.9	59%	0.588	73%	0.729	S	S	*	*				70.9	88.2	91	-149.9	-104.4	0	0	0	115.4	S138	D136-S138 PolarHBondContact O-N 2.86Å
137	K	48.2	Very low	46.3	Very low	200 Å²	200	141.7 Å²	141.7	87%	0.87	71%	0.713	S	S	*	*	S	Bend	trans	60.1	13.5	132.6	-68.8	179.7	-179.9	166.5	0	122.5
138	S	45	Very low	46.9	Very low	94 Å²	94	143.9 Å²	143.9	66%	0.657	70%	0.7	S	S	*	*			trans	-116.2	1.1	171.3	61.4	0	0	0	0	117.9	D136	D136-S138 PolarHBondContact O-N 2.86Å
139	D	45.7	Very low	47.7	Very low	103 Å²	103	139.9 Å²	139.9	55%	0.551	69%	0.688	S	S	*	*	S	Bend	trans	-90.4	-13.5	-171.2	-74	-35.8	0	0	0	116.5	D141 R142 E143	D139-D141 VanDerWaalsContact C-N 3.32Å; D139-D141 PolarHBondContact O-N 3.03Å; D139-R142 PolarHBondContact O-N 2.79Å; D139-E143 PolarHBondContact O-N 3.36Å; D139-E143 VanDerWaalsContact O-N 3.13Å
140	R	49.1	Very low	48.1	Very low	233 Å²	233	138.1 Å²	138.1	88%	0.879	68%	0.679	S	S	*	*	H	α-helix	trans	-65.7	-29.8	-178.1	-97.8	-175.8	-173.3	157.4	3.1	114.4
141	D	46.5	Very low	49.2	Very low	144 Å²	144	137.2 Å²	137.2	77%	0.77	67%	0.671	S	S	*	*	H	α-helix	trans	-86.8	-20.9	177.4	-91.1	-36.2	0	0	0	112.9	D139	D139-D141 VanDerWaalsContact C-N 3.32Å; D139-D141 PolarHBondContact O-N 3.03Å
142	R	48.3	Very low	50.4	Low	162 Å²	162	136.6 Å²	136.6	61%	0.611	66%	0.656	S	S	*	*	H	α-helix	trans	-78.8	-46.2	177.4	-130.1	-171	-173.8	101.9	4.5	111.5	D139 R144 G145 Y146	D139-R142 PolarHBondContact O-N 2.79Å; R142-R144 VanDerWaalsContact C-N 3.3Å; R142-R144 PolarHBondContact O-N 3.33Å; R142-G145 PolarHBondContact O-N 2.86Å; R142-Y146 HydrophobicContact CB-CE2 3.87Å; R142-Y146 WeakPolarHBondContact CD-OH 3.48Å; R142-Y146 HydrophobicContact CG-CE2 3.53Å; R142-Y146 PolarHBondContact NE-OH 3.31Å; R142-Y146 WeakPolarHBondContact O-CD2 3.49Å; R142-Y146 WeakPolarHBondContact O-CE2 3.42Å; R142-Y146 PolarHBondContact O-N 2.86Å
143	E	46.8	Very low	51.2	Low	147 Å²	147	136.5 Å²	136.5	69%	0.687	65%	0.645	S	S	*	*	H	α-helix	trans	-59.3	-38.4	177.5	-81.1	-154.8	158.6	0	0	113.1	D139 G145 Y146 D147	D139-E143 PolarHBondContact O-N 3.36Å; D139-E143 VanDerWaalsContact O-N 3.13Å; E143-G145 PolarHBondContact O-N 3.3Å; E143-Y146 PolarHBondContact O-N 3.14Å; E143-D147 WeakPolarHBondContact O-CB 3.42Å; E143-D147 PolarHBondContact O-N 3.18Å
144	R	51.2	Low	52.1	Low	198 Å²	198	130.8 Å²	130.8	75%	0.747	63%	0.629	S	S	*	*	H	α-helix	trans	-62.6	-26	177.2	-157.1	175.8	-159.7	-166.9	4.7	113.2	R142 K148	R142-R144 VanDerWaalsContact C-N 3.3Å; R142-R144 PolarHBondContact O-N 3.33Å; R144-K148 WeakPolarHBondContact O-CB 3.15Å; R144-K148 PolarHBondContact O-N 2.8Å
145	G	50.3	Low	53.2	Low	36 Å²	36	134.1 Å²	134.1	37%	0.371	62%	0.616	S	S	.	*	H	α-helix	trans	-75.6	-44.2	175.1	0	0	0	0	0	112.7	R142 E143 K148 V149	R142-G145 PolarHBondContact O-N 2.86Å; E143-G145 PolarHBondContact O-N 3.3Å; G145-K148 PolarHBondContact O-N 3.11Å; G145-V149 VanDerWaalsContact O-CG2 3.25Å; G145-V149 WeakPolarHBondContact O-CG2 3.47Å; G145-V149 PolarHBondContact O-N 2.75Å
146	Y	46.7	Very low	54.1	Low	133 Å²	133	130.1 Å²	130.1	52%	0.522	60%	0.601	S	S	.	*	H	α-helix	trans	-69.8	-41.1	-179.3	-56.1	-66.5	0	0	0	112	R142 E143 K148 V149 D150	R142-Y146 HydrophobicContact CB-CE2 3.87Å; R142-Y146 WeakPolarHBondContact CD-OH 3.48Å; R142-Y146 HydrophobicContact CG-CE2 3.53Å; R142-Y146 PolarHBondContact NE-OH 3.31Å; R142-Y146 WeakPolarHBondContact O-CD2 3.49Å; R142-Y146 WeakPolarHBondContact O-CE2 3.42Å; R142-Y146 PolarHBondContact O-N 2.86Å; E143-Y146 PolarHBondContact O-N 3.14Å; Y146-K148 VanDerWaalsContact C-N 3.28Å; Y146-K148 PolarHBondContact O-N 2.87Å; Y146-V149 PolarHBondContact O-N 2.83Å; Y146-D150 PolarHBondContact O-N 3.08Å
147	D	56.5	Low	55.1	Low	107 Å²	107	129.9 Å²	129.9	57%	0.572	59%	0.592	S	S	*	*	H	α-helix	trans	-64.5	-33	178.5	-142.4	-10.3	0	0	0	111.9	E143 R151	E143-D147 WeakPolarHBondContact O-CB 3.42Å; E143-D147 PolarHBondContact O-N 3.18Å; D147-R151 WeakPolarHBondContact O-CB 3.35Å; D147-R151 PolarHBondContact O-N 3.31Å
148	K	58.2	Low	55.6	Low	128 Å²	128	125.9 Å²	125.9	56%	0.557	58%	0.576	S	S	*	*	H	α-helix	trans	-71.9	-42.4	175.4	-170.1	-179.9	179.7	-167.7	0	112	R144 G145 Y146 R151 E152	R144-K148 WeakPolarHBondContact O-CB 3.15Å; R144-K148 PolarHBondContact O-N 2.8Å; G145-K148 PolarHBondContact O-N 3.11Å; Y146-K148 VanDerWaalsContact C-N 3.28Å; Y146-K148 PolarHBondContact O-N 2.87Å; K148-R151 PolarHBondContact O-N 3.46Å; K148-E152 VanDerWaalsContact CE-OE1 3.26Å; K148-E152 WeakPolarHBondContact CE-OE1 3.37Å; K148-E152 WeakPolarHBondContact O-CB 3.34Å; K148-E152 WeakPolarHBondContact O-CG 3.38Å; K148-E152 PolarHBondContact O-N 3.13Å
149	V	58.8	Low	56.4	Low	93 Å²	93	128.7 Å²	128.7	56%	0.564	57%	0.572	S	S	*	*	H	α-helix	trans	-70.3	-39.1	-179.4	-178.6	0	0	0	0	110.6	G145 Y146 E152 R153	G145-V149 VanDerWaalsContact O-CG2 3.25Å; G145-V149 WeakPolarHBondContact O-CG2 3.47Å; G145-V149 PolarHBondContact O-N 2.75Å; Y146-V149 PolarHBondContact O-N 2.83Å; V149-E152 PolarHBondContact O-N 3.15Å; V149-R153 VanDerWaalsContact O-CB 3.28Å; V149-R153 WeakPolarHBondContact O-CB 3.47Å; V149-R153 PolarHBondContact O-N 3.15Å
150	D	60.5	Low	57.1	Low	93 Å²	93	128.5 Å²	128.5	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-68.1	-38.7	174.2	-90.6	-33.3	0	0	0	112.2	Y146 R153 E154	Y146-D150 PolarHBondContact O-N 3.08Å; D150-R153 CarbonylContact O-C 3.56Å; D150-R153 PolarHBondContact O-N 2.82Å; D150-E154 PolarHBondContact O-N 2.7Å
151	R	63.8	Low	57.7	Low	147 Å²	147	125.5 Å²	125.5	56%	0.555	56%	0.56	S	S	*	*	H	α-helix	trans	-66.7	-36.3	174.4	-164.4	-178.9	-148	101.5	2.7	113.1	D147 K148 R155	D147-R151 WeakPolarHBondContact O-CB 3.35Å; D147-R151 PolarHBondContact O-N 3.31Å; K148-R151 PolarHBondContact O-N 3.46Å; R151-R155 WeakPolarHBondContact O-CG 3.31Å; R151-R155 PolarHBondContact O-N 2.67Å
152	E	62.4	Low	58.2	Low	91 Å²	91	124.2 Å²	124.2	43%	0.425	55%	0.553	S	S	.	*	H	α-helix	trans	-67.7	-40.5	172.3	-77.3	178.4	-174.2	0	0	110.7	K148 V149 E154 R155 D156	K148-E152 VanDerWaalsContact CE-OE1 3.26Å; K148-E152 WeakPolarHBondContact CE-OE1 3.37Å; K148-E152 WeakPolarHBondContact O-CB 3.34Å; K148-E152 WeakPolarHBondContact O-CG 3.38Å; K148-E152 PolarHBondContact O-N 3.13Å; V149-E152 PolarHBondContact O-N 3.15Å; E152-E154 VanDerWaalsContact C-N 3.35Å; E152-E154 PolarHBondContact O-N 2.99Å; E152-R155 PolarHBondContact O-N 3.41Å; E152-D156 PolarHBondContact O-N 2.88Å
153	R	65.8	Low	58.7	Low	145 Å²	145	123.6 Å²	123.6	55%	0.547	55%	0.551	S	S	.	*	H	α-helix	trans	-67.9	-31.2	176.1	-154.2	180	-169.7	-161.4	3.4	113.1	V149 D150 R157	V149-R153 VanDerWaalsContact O-CB 3.28Å; V149-R153 WeakPolarHBondContact O-CB 3.47Å; V149-R153 PolarHBondContact O-N 3.15Å; D150-R153 CarbonylContact O-C 3.56Å; D150-R153 PolarHBondContact O-N 2.82Å; R153-R157 WeakPolarHBondContact O-CG 3.14Å; R153-R157 PolarHBondContact O-N 3.1Å; R153-R157 PolarHBondContact O-NH1 2.94Å
154	E	60.8	Low	59.1	Low	126 Å²	126	118.5 Å²	118.5	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-70.2	-43.7	170.1	-81	-166.8	156.5	0	0	112	D150 E152 D156 R157 E158	D150-E154 PolarHBondContact O-N 2.7Å; E152-E154 VanDerWaalsContact C-N 3.35Å; E152-E154 PolarHBondContact O-N 2.99Å; E154-D156 VanDerWaalsContact C-N 3.32Å; E154-D156 PolarHBondContact O-N 3.31Å; E154-R157 PolarHBondContact O-N 3.15Å; E154-E158 PolarHBondContact O-N 3.24Å
155	R	63.7	Low	59.3	Low	149 Å²	149	118 Å²	118	56%	0.562	54%	0.537	S	S	*	.	H	α-helix	trans	-61.6	-38.5	174.8	-80.5	-179.8	-173.5	166.4	1.9	113.1	R151 E152 E158 R159	R151-R155 WeakPolarHBondContact O-CG 3.31Å; R151-R155 PolarHBondContact O-N 2.67Å; E152-R155 PolarHBondContact O-N 3.41Å; R155-E158 PolarHBondContact O-N 2.91Å; R155-R159 WeakPolarHBondContact O-CB 3.25Å; R155-R159 PolarHBondContact O-N 2.76Å
156	D	63.1	Low	59.7	Low	93 Å²	93	122.3 Å²	122.3	50%	0.497	55%	0.552	S	S	.	*	H	α-helix	trans	-67	-39.6	176.4	-74.8	-20.5	0	0	0	111	E152 E154 R159 D160	E152-D156 PolarHBondContact O-N 2.88Å; E154-D156 VanDerWaalsContact C-N 3.32Å; E154-D156 PolarHBondContact O-N 3.31Å; D156-R159 PolarHBondContact O-N 3.19Å; D156-D160 WeakPolarHBondContact O-CB 3.36Å; D156-D160 PolarHBondContact O-N 2.89Å
157	R	64.9	Low	60.2	Low	105 Å²	105	123.1 Å²	123.1	40%	0.396	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-36.7	173.4	-71.9	174.9	-169.3	121.6	-12.5	113.1	R153 E154 R161	R153-R157 WeakPolarHBondContact O-CG 3.14Å; R153-R157 PolarHBondContact O-N 3.1Å; R153-R157 PolarHBondContact O-NH1 2.94Å; E154-R157 PolarHBondContact O-N 3.15Å; R157-R161 WeakPolarHBondContact O-CG 3.29Å; R157-R161 PolarHBondContact O-N 3.17Å
158	E	60.4	Low	60.3	Low	116 Å²	116	120.9 Å²	120.9	54%	0.542	55%	0.554	S	S	.	*	H	α-helix	trans	-65.2	-45.1	172.5	-82	-177.3	160	0	0	111.2	E154 R155 D160 R161 D162	E154-E158 PolarHBondContact O-N 3.24Å; R155-E158 PolarHBondContact O-N 2.91Å; E158-D160 VanDerWaalsContact C-N 3.29Å; E158-D160 PolarHBondContact O-N 2.75Å; E158-R161 WeakPolarHBondContact O-CB 3.49Å; E158-R161 PolarHBondContact O-N 3.36Å; E158-R161 VanDerWaalsContact O-N 3.14Å; E158-D162 PolarHBondContact O-N 2.93Å
159	R	60.8	Low	60.3	Low	153 Å²	153	119.7 Å²	119.7	58%	0.577	55%	0.554	S	S	*	*	H	α-helix	trans	-63.6	-34.6	178	-168.1	179.4	-73.5	-167.8	-4.5	112.6	R155 D156 R163	R155-R159 WeakPolarHBondContact O-CB 3.25Å; R155-R159 PolarHBondContact O-N 2.76Å; D156-R159 PolarHBondContact O-N 3.19Å; R159-R163 PolarHBondContact O-N 2.93Å; R159-R163 VanDerWaalsContact O-N 3.17Å
160	D	60.7	Low	60.3	Low	100 Å²	100	124.2 Å²	124.2	54%	0.535	56%	0.561	S	S	.	*	H	α-helix	trans	-76.5	-30.2	174.8	-73.9	-19.4	0	0	0	112.8	D156 E158 R163 G164	D156-D160 WeakPolarHBondContact O-CB 3.36Å; D156-D160 PolarHBondContact O-N 2.89Å; E158-D160 VanDerWaalsContact C-N 3.29Å; E158-D160 PolarHBondContact O-N 2.75Å; D160-R163 IonicContact OD1-NH1 3.1Å; D160-R163 PolarHBondContact OD1-NH1 3.27Å; D160-G164 PolarHBondContact O-N 3.07Å; D160-G164 VanDerWaalsContact O-N 3.11Å
161	R	60.6	Low	60.3	Low	170 Å²	170	123.7 Å²	123.7	64%	0.642	56%	0.556	S	S	*	*	H	α-helix	trans	-65.9	-44.7	169	-82.2	-177.4	-170.5	134.3	-0.1	112	R157 E158 R163 G164 Y165	R157-R161 WeakPolarHBondContact O-CG 3.29Å; R157-R161 PolarHBondContact O-N 3.17Å; E158-R161 WeakPolarHBondContact O-CB 3.49Å; E158-R161 PolarHBondContact O-N 3.36Å; E158-R161 VanDerWaalsContact O-N 3.14Å; R161-R163 VanDerWaalsContact C-N 3.34Å; R161-R163 PolarHBondContact O-N 2.79Å; R161-G164 WeakPolarHBondContact O-CA 3.38Å; R161-G164 PolarHBondContact O-N 2.73Å; R161-Y165 PolarHBondContact O-N 2.77Å; R161-Y165 VanDerWaalsContact O-N 3.16Å
162	D	57.8	Low	60	Low	116 Å²	116	120.7 Å²	120.7	62%	0.62	55%	0.548	S	S	*	.	H	α-helix	trans	-63.3	-39.5	177.8	-83.8	-10.1	0	0	0	111.8	E158 G164 Y165 D166	E158-D162 PolarHBondContact O-N 2.93Å; D162-G164 VanDerWaalsContact C-N 3.27Å; D162-G164 PolarHBondContact O-N 3.09Å; D162-Y165 PolarHBondContact O-N 3.36Å; D162-D166 PolarHBondContact O-N 3.18Å
163	R	58.4	Low	59.9	Low	150 Å²	150	117.7 Å²	117.7	57%	0.566	54%	0.541	S	S	*	.	H	α-helix	trans	-64.1	-30.2	171.1	-79.8	-174	-167.5	116	-0.5	113.8	R159 D160 R161 K167	R159-R163 PolarHBondContact O-N 2.93Å; R159-R163 VanDerWaalsContact O-N 3.17Å; D160-R163 IonicContact OD1-NH1 3.1Å; D160-R163 PolarHBondContact OD1-NH1 3.27Å; R161-R163 VanDerWaalsContact C-N 3.34Å; R161-R163 PolarHBondContact O-N 2.79Å; R163-K167 PolarHBondContact O-N 3.47Å
164	G	56.2	Low	59.7	Low	40 Å²	40	115.8 Å²	115.8	41%	0.412	54%	0.537	S	S	.	.	H	α-helix	trans	-67.7	-39.1	177	0	0	0	0	0	112.5	D160 R161 D162 K167 A168	D160-G164 PolarHBondContact O-N 3.07Å; D160-G164 VanDerWaalsContact O-N 3.11Å; R161-G164 WeakPolarHBondContact O-CA 3.38Å; R161-G164 PolarHBondContact O-N 2.73Å; D162-G164 VanDerWaalsContact C-N 3.27Å; D162-G164 PolarHBondContact O-N 3.09Å; G164-K167 PolarHBondContact O-N 3.4Å; G164-A168 PolarHBondContact O-N 3.08Å
165	Y	54.6	Low	59.7	Low	187 Å²	187	115.9 Å²	115.9	73%	0.733	54%	0.537	S	S	*	.	H	α-helix	trans	-66	-44.4	176	-93.4	-88.4	0	0	0	112.3	R161 D162 K167 A168 D169	R161-Y165 PolarHBondContact O-N 2.77Å; R161-Y165 VanDerWaalsContact O-N 3.16Å; D162-Y165 PolarHBondContact O-N 3.36Å; Y165-K167 VanDerWaalsContact C-N 3.27Å; Y165-K167 PolarHBondContact O-N 3.22Å; Y165-A168 PolarHBondContact O-N 3.02Å; Y165-D169 PolarHBondContact O-N 3.44Å
166	D	58.1	Low	59.6	Low	126 Å²	126	116.1 Å²	116.1	67%	0.674	54%	0.538	S	S	*	.	H	α-helix	trans	-61.7	-32.8	177.3	-110.8	-40.1	0	0	0	113.1	D162 R170	D162-D166 PolarHBondContact O-N 3.18Å; D166-R170 WeakPolarHBondContact O-CB 2.94Å; D166-R170 PolarHBondContact O-N 3.25Å; D166-R170 VanDerWaalsContact O-N 3.15Å
167	K	57.6	Low	59.4	Low	150 Å²	150	121.4 Å²	121.4	65%	0.652	55%	0.551	S	S	*	*	H	α-helix	trans	-75.2	-39.7	178	-169.7	176.1	-179.2	-176.8	0	112.1	R163 G164 Y165 E171	R163-K167 PolarHBondContact O-N 3.47Å; G164-K167 PolarHBondContact O-N 3.4Å; Y165-K167 VanDerWaalsContact C-N 3.27Å; Y165-K167 PolarHBondContact O-N 3.22Å; K167-E171 WeakPolarHBondContact O-CG 3.41Å; K167-E171 PolarHBondContact O-N 3.14Å
168	A	58.4	Low	59	Low	60 Å²	60	120.7 Å²	120.7	50%	0.496	55%	0.552	S	S	.	*	H	α-helix	trans	-65.9	-45.3	177.4	0	0	0	0	0	111.2	G164 Y165 R170 E171 E172	G164-A168 PolarHBondContact O-N 3.08Å; Y165-A168 PolarHBondContact O-N 3.02Å; A168-R170 VanDerWaalsContact C-N 3.32Å; A168-R170 PolarHBondContact O-N 3.46Å; A168-E171 PolarHBondContact O-N 3.15Å; A168-E172 VanDerWaalsContact O-CB 3.3Å; A168-E172 WeakPolarHBondContact O-CB 3.05Å; A168-E172 PolarHBondContact O-N 3.09Å
169	D	59.3	Low	58.9	Low	104 Å²	104	120.7 Å²	120.7	56%	0.556	55%	0.552	S	S	*	*	H	α-helix	trans	-67	-34.7	178.7	-155.5	-6.9	0	0	0	111.6	Y165 G173	Y165-D169 PolarHBondContact O-N 3.44Å; D169-G173 PolarHBondContact O-N 3.15Å
170	R	58.9	Low	58.8	Low	187 Å²	187	122.5 Å²	122.5	71%	0.706	56%	0.559	S	S	*	*	H	α-helix	trans	-71.4	-33.9	174.9	-171.9	164.5	-171.7	168	1.7	113.9	D166 A168 K174	D166-R170 WeakPolarHBondContact O-CB 2.94Å; D166-R170 PolarHBondContact O-N 3.25Å; D166-R170 VanDerWaalsContact O-N 3.15Å; A168-R170 VanDerWaalsContact C-N 3.32Å; A168-R170 PolarHBondContact O-N 3.46Å; R170-K174 VanDerWaalsContact O-CG 3.29Å; R170-K174 WeakPolarHBondContact O-CG 3.38Å; R170-K174 PolarHBondContact O-N 3.31Å
171	E	59.1	Low	58.7	Low	82 Å²	82	126.1 Å²	126.1	38%	0.383	57%	0.565	S	S	.	*	H	α-helix	trans	-74.9	-42.8	173.4	-73.6	-65.5	128.9	0	0	110.6	K167 A168 G173 K174 E175	K167-E171 WeakPolarHBondContact O-CG 3.41Å; K167-E171 PolarHBondContact O-N 3.14Å; A168-E171 PolarHBondContact O-N 3.15Å; E171-G173 VanDerWaalsContact C-N 3.31Å; E171-G173 PolarHBondContact O-N 3.11Å; E171-K174 WeakPolarHBondContact O-CB 3.08Å; E171-K174 PolarHBondContact O-N 3.28Å; E171-K174 IonicContact OE1-NZ 2.75Å; E171-K174 PolarHBondContact OE1-NZ 3.47Å; E171-E175 WeakPolarHBondContact O-CG 3.44Å; E171-E175 PolarHBondContact O-N 3.35Å
172	E	58.2	Low	58.6	Low	85 Å²	85	123.4 Å²	123.4	40%	0.397	56%	0.559	S	S	.	*	H	α-helix	trans	-61.8	-38.8	175.5	-170.7	174.3	-165.6	0	0	111.7	A168 K174 E175 R176	A168-E172 VanDerWaalsContact O-CB 3.3Å; A168-E172 WeakPolarHBondContact O-CB 3.05Å; A168-E172 PolarHBondContact O-N 3.09Å; E172-K174 VanDerWaalsContact C-N 3.34Å; E172-K174 PolarHBondContact O-N 3.49Å; E172-E175 PolarHBondContact O-N 3.26Å; E172-R176 HydrophobicContact CG-CG 4.44Å; E172-R176 VanDerWaalsContact O-CB 3.31Å; E172-R176 WeakPolarHBondContact O-CB 3.46Å; E172-R176 WeakPolarHBondContact O-CG 3.38Å; E172-R176 PolarHBondContact O-N 3.21Å; E172-R176 IonicContact OE1-CZ 3.02Å; E172-R176 VanDerWaalsContact OE1-CZ 3.25Å; E172-R176 IonicContact OE1-NE 3.72Å; E172-R176 PolarHBondContact OE1-NE 3.39Å; E172-R176 IonicContact OE1-NH2 3.25Å; E172-R176 PolarHBondContact OE1-NH2 3.4Å; E172-R176 IonicContact OE2-NH2 2.62Å
173	G	61.5	Low	58.5	Low	27 Å²	27	125.3 Å²	125.3	28%	0.278	57%	0.565	S	S	.	*	H	α-helix	trans	-65.6	-31.1	173	0	0	0	0	0	114.1	D169 E171 R177	D169-G173 PolarHBondContact O-N 3.15Å; E171-G173 VanDerWaalsContact C-N 3.31Å; E171-G173 PolarHBondContact O-N 3.11Å; G173-R177 WeakPolarHBondContact O-CB 3.43Å; G173-R177 VanDerWaalsContact O-CG 3.25Å; G173-R177 WeakPolarHBondContact O-CG 3.49Å; G173-R177 PolarHBondContact O-N 3.2Å
174	K	60.1	Low	58.6	Low	106 Å²	106	124.8 Å²	124.8	46%	0.461	57%	0.572	S	S	.	*	H	α-helix	trans	-76.7	-41.5	174	-73.1	170.1	-169.9	168.1	0	111.5	R170 E171 E172 R177 H178	R170-K174 VanDerWaalsContact O-CG 3.29Å; R170-K174 WeakPolarHBondContact O-CG 3.38Å; R170-K174 PolarHBondContact O-N 3.31Å; E171-K174 WeakPolarHBondContact O-CB 3.08Å; E171-K174 PolarHBondContact O-N 3.28Å; E171-K174 IonicContact OE1-NZ 2.75Å; E171-K174 PolarHBondContact OE1-NZ 3.47Å; E172-K174 VanDerWaalsContact C-N 3.34Å; E172-K174 PolarHBondContact O-N 3.49Å; K174-R177 PolarHBondContact O-N 3.49Å; K174-H178 WeakPolarHBondContact O-CB 3.32Å; K174-H178 PolarHBondContact O-N 3.23Å
175	E	60.7	Low	58.5	Low	128 Å²	128	124.8 Å²	124.8	60%	0.598	57%	0.568	S	S	*	*	H	α-helix	trans	-63.7	-46.7	177	-74.2	-179.5	172.1	0	0	110.8	E171 E172 R177 H178 H179	E171-E175 WeakPolarHBondContact O-CG 3.44Å; E171-E175 PolarHBondContact O-N 3.35Å; E172-E175 PolarHBondContact O-N 3.26Å; E175-R177 VanDerWaalsContact C-N 3.28Å; E175-R177 PolarHBondContact O-N 3.05Å; E175-H178 PolarHBondContact O-N 3.4Å; E175-H178 VanDerWaalsContact O-N 3.08Å; E175-H179 WeakPolarHBondContact O-CB 3.22Å; E175-H179 PolarHBondContact O-N 3.48Å
176	R	61.3	Low	58.6	Low	154 Å²	154	122 Å²	122	58%	0.581	57%	0.574	S	S	*	*	H	α-helix	trans	-59.4	-36.8	174.8	-72.2	172.7	-180	177.1	0.4	112.7	E172 R180	E172-R176 HydrophobicContact CG-CG 4.44Å; E172-R176 VanDerWaalsContact O-CB 3.31Å; E172-R176 WeakPolarHBondContact O-CB 3.46Å; E172-R176 WeakPolarHBondContact O-CG 3.38Å; E172-R176 PolarHBondContact O-N 3.21Å; E172-R176 IonicContact OE1-CZ 3.02Å; E172-R176 VanDerWaalsContact OE1-CZ 3.25Å; E172-R176 IonicContact OE1-NE 3.72Å; E172-R176 PolarHBondContact OE1-NE 3.39Å; E172-R176 IonicContact OE1-NH2 3.25Å; E172-R176 PolarHBondContact OE1-NH2 3.4Å; E172-R176 IonicContact OE2-NH2 2.62Å; R176-R180 VanDerWaalsContact O-CB 3.3Å; R176-R180 WeakPolarHBondContact O-CB 3.48Å; R176-R180 PolarHBondContact O-N 3.35Å; R176-R180 VanDerWaalsContact O-N 3.11Å
177	R	59.6	Low	58.3	Low	204 Å²	204	125.3 Å²	125.3	77%	0.77	58%	0.578	S	S	*	*	H	α-helix	trans	-71.7	-36.6	174.4	-76.4	177.7	-172.1	-169.8	3.7	112.5	G173 K174 E175 R181	G173-R177 WeakPolarHBondContact O-CB 3.43Å; G173-R177 VanDerWaalsContact O-CG 3.25Å; G173-R177 WeakPolarHBondContact O-CG 3.49Å; G173-R177 PolarHBondContact O-N 3.2Å; K174-R177 PolarHBondContact O-N 3.49Å; E175-R177 VanDerWaalsContact C-N 3.28Å; E175-R177 PolarHBondContact O-N 3.05Å; R177-R181 WeakPolarHBondContact O-CB 3.44Å; R177-R181 PolarHBondContact O-N 3.34Å
178	H	56.9	Low	58.1	Low	90 Å²	90	123.6 Å²	123.6	42%	0.417	58%	0.582	S	S	.	*	H	α-helix	trans	-69.4	-46.3	177.1	-166	-86.2	0	0	0	111.2	K174 E175 R181 E182	K174-H178 WeakPolarHBondContact O-CB 3.32Å; K174-H178 PolarHBondContact O-N 3.23Å; E175-H178 PolarHBondContact O-N 3.4Å; E175-H178 VanDerWaalsContact O-N 3.08Å; H178-R181 WeakPolarHBondContact O-CB 3.3Å; H178-R181 PolarHBondContact O-N 3.3Å; H178-R181 VanDerWaalsContact O-N 3.15Å; H178-E182 IonicContact CE1-OE1 3.9Å; H178-E182 PolarHBondContact CE1-OE1 3Å; H178-E182 IonicContact CE1-OE2 4Å; H178-E182 PolarHBondContact CE1-OE2 3.1Å; H178-E182 IonicContact ND1-OE1 3.1Å; H178-E182 IonicContact ND1-OE2 3.13Å; H178-E182 PolarHBondContact ND1-OE2 2.74Å; H178-E182 PolarHBondContact O-N 3.04Å
179	H	57.4	Low	57.9	Low	116 Å²	116	128.9 Å²	128.9	54%	0.537	59%	0.594	S	S	.	*	H	α-helix	trans	-64.5	-43.3	179.6	-133.8	-78.7	0	0	0	111.8	E175 R181 E182 E183	E175-H179 WeakPolarHBondContact O-CB 3.22Å; E175-H179 PolarHBondContact O-N 3.48Å; H179-R181 PolarHBondContact O-N 2.79Å; H179-E182 PolarHBondContact O-N 3.48Å; H179-E183 IonicContact CE1-OE1 3.68Å; H179-E183 IonicContact ND1-OE1 2.67Å; H179-E183 PolarHBondContact O-N 2.8Å
180	R	59.3	Low	57.6	Low	191 Å²	191	128 Å²	128	72%	0.721	60%	0.595	S	S	*	*	H	α-helix	trans	-60.8	-35.6	174.1	-172.6	-176.5	-71.6	-131.7	0.4	112	R176 L184	R176-R180 VanDerWaalsContact O-CB 3.3Å; R176-R180 WeakPolarHBondContact O-CB 3.48Å; R176-R180 PolarHBondContact O-N 3.35Å; R176-R180 VanDerWaalsContact O-N 3.11Å; R180-L184 HydrophobicContact CG-CD1 4.11Å; R180-L184 WeakPolarHBondContact O-CB 3.46Å; R180-L184 WeakPolarHBondContact O-CD1 3.38Å; R180-L184 PolarHBondContact O-N 2.75Å
181	R	58.1	Low	57.5	Low	176 Å²	176	128.3 Å²	128.3	66%	0.664	60%	0.602	S	S	*	*	H	α-helix	trans	-74.9	-29.8	178.1	-176.1	173.2	-174.5	-107	6	112.8	R177 H178 H179	R177-R181 WeakPolarHBondContact O-CB 3.44Å; R177-R181 PolarHBondContact O-N 3.34Å; H178-R181 WeakPolarHBondContact O-CB 3.3Å; H178-R181 PolarHBondContact O-N 3.3Å; H178-R181 VanDerWaalsContact O-N 3.15Å; H179-R181 PolarHBondContact O-N 2.79Å
182	E	58.8	Low	57.3	Low	112 Å²	112	133.2 Å²	133.2	52%	0.523	62%	0.622	S	S	.	*	H	α-helix	trans	-82.4	-38	177.2	-80.6	-177.5	151.3	0	0	112.9	H178 H179 L184 A185	H178-E182 IonicContact CE1-OE1 3.9Å; H178-E182 PolarHBondContact CE1-OE1 3Å; H178-E182 IonicContact CE1-OE2 4Å; H178-E182 PolarHBondContact CE1-OE2 3.1Å; H178-E182 IonicContact ND1-OE1 3.1Å; H178-E182 IonicContact ND1-OE2 3.13Å; H178-E182 PolarHBondContact ND1-OE2 2.74Å; H178-E182 PolarHBondContact O-N 3.04Å; H179-E182 PolarHBondContact O-N 3.48Å; E182-L184 PolarHBondContact O-N 3.15Å; E182-A185 PolarHBondContact O-N 2.87Å
183	E	56.6	Low	57.1	Low	156 Å²	156	132.6 Å²	132.6	73%	0.729	63%	0.632	S	S	*	*	H	α-helix	trans	-71.6	-27.4	177.4	-75.5	-154.5	169.4	0	0	114.1	H179 A185	H179-E183 IonicContact CE1-OE1 3.68Å; H179-E183 IonicContact ND1-OE1 2.67Å; H179-E183 PolarHBondContact O-N 2.8Å; E183-A185 VanDerWaalsContact C-N 3.27Å; E183-A185 PolarHBondContact O-N 3.01Å
184	L	59.8	Low	56.9	Low	139 Å²	139	138.1 Å²	138.1	73%	0.728	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-6.4	174.3	-81.9	164.2	0	0	0	113.6	R180 E182 P186	R180-L184 HydrophobicContact CG-CD1 4.11Å; R180-L184 WeakPolarHBondContact O-CB 3.46Å; R180-L184 WeakPolarHBondContact O-CD1 3.38Å; R180-L184 PolarHBondContact O-N 2.75Å; E182-L184 PolarHBondContact O-N 3.15Å; L184-P186 WeakPolarHBondContact O-CD 3.41Å
185	A	53.5	Low	56.6	Low	40 Å²	40	138.6 Å²	138.6	33%	0.331	68%	0.676	S	S	.	*			trans	-96.5	114.1	-177.6	0	0	0	0	0	110.1	E182 E183 Y187	E182-A185 PolarHBondContact O-N 2.87Å; E183-A185 VanDerWaalsContact C-N 3.27Å; E183-A185 PolarHBondContact O-N 3.01Å; A185-Y187 PolarHBondContact O-N 3.05Å
186	P	58.5	Low	56.3	Low	130 Å²	130	140 Å²	140	84%	0.844	68%	0.676	S	S	*	*	S	Bend	trans	-66.9	4.7	-177.3	-21.8	34.3	0	0	0	115.8	L184	L184-P186 WeakPolarHBondContact O-CD 3.41Å
187	Y	50.2	Low	56.2	Low	195 Å²	195	139.9 Å²	139.9	77%	0.765	68%	0.68	S	S	*	*	S	Bend	trans	-149.8	140.8	-177.4	-120.4	-95.7	0	0	0	112.6	A185 K189	A185-Y187 PolarHBondContact O-N 3.05Å; Y187-K189 PolarHBondContact O-N 2.79Å
188	P	54.9	Low	56.2	Low	113 Å²	113	135.9 Å²	135.9	73%	0.734	67%	0.674	S	S	*	*			trans	-68.5	119.3	179	27.2	-34.3	0	0	0	111	S190	P188-S190 PolarHBondContact O-N 2.77Å
189	K	53.8	Low	56.5	Low	172 Å²	172	140.7 Å²	140.7	75%	0.748	70%	0.696	S	S	*	*			trans	-75.4	96.7	172.1	-72	-167.9	177.7	-177.7	0	110	Y187 K191	Y187-K189 PolarHBondContact O-N 2.79Å; K189-K191 PolarHBondContact O-N 3.38Å
190	S	53.2	Low	56.9	Low	84 Å²	84	141.8 Å²	141.8	59%	0.587	70%	0.702	S	S	*	*			trans	-58.1	117.7	164.2	58.1	0	0	0	0	109.5	P188 K192	P188-S190 PolarHBondContact O-N 2.77Å; S190-K192 PolarHBondContact O-N 3.26Å
191	K	55.7	Low	57.5	Low	195 Å²	195	135.8 Å²	135.8	85%	0.848	68%	0.684	S	S	*	*	S	Bend	trans	-69	53	174.8	-76.7	178.6	175.1	164.8	0	112.7	K189	K189-K191 PolarHBondContact O-N 3.38Å
192	K	55.6	Low	58.4	Low	184 Å²	184	131.9 Å²	131.9	80%	0.8	68%	0.676	S	S	*	*			trans	-151.9	48.1	177.6	-145.2	99.9	177.4	-173.7	0	112.7	S190	S190-K192 PolarHBondContact O-N 3.26Å
193	A	54.3	Low	59.5	Low	73 Å²	73	130.5 Å²	130.5	60%	0.603	68%	0.677	S	S	*	*			trans	-106.3	30.7	-173.1	0	0	0	0	0	114.6
194	V	56.6	Low	60.5	Low	143 Å²	143	130.5 Å²	130.5	87%	0.867	68%	0.678	S	S	*	*	S	Bend	trans	-85.1	-23.9	171.9	-178.3	0	0	0	0	111.3
195	S	54.6	Low	61.4	Low	115 Å²	115	126.8 Å²	126.8	80%	0.804	66%	0.659	S	S	*	*	S	Bend	trans	-100	-9.7	-171	-166.6	0	0	0	0	115.9
196	R	54.4	Low	62.6	Low	158 Å²	158	129.5 Å²	129.5	60%	0.596	67%	0.673	S	S	*	*	S	Bend	trans	-97.3	1.8	-178.2	-67	-167.6	-176.5	176.4	-0.6	114.5	D198 E199 E200	R196-D198 PolarHBondContact O-N 3.32Å; R196-E199 PolarHBondContact O-N 3.09Å; R196-E200 WeakPolarHBondContact CD-OE2 3.36Å; R196-E200 IonicContact NH1-OE2 3.43Å; R196-E200 PolarHBondContact O-N 3.27Å
197	K	58.3	Low	63.3	Low	151 Å²	151	125.4 Å²	125.4	66%	0.657	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-12.4	-167.3	-158.3	170.4	179.8	-176	0	114.4	R214	K197-R214 PolarHBondContact O-NH2 3.41Å
198	D	60.5	Low	64.6	Low	121 Å²	121	118.1 Å²	118.1	65%	0.647	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-11.4	178.8	-77.2	-38.9	0	0	0	114.6	R196 R214	R196-D198 PolarHBondContact O-N 3.32Å; D198-R214 IonicContact OD1-CZ 3.27Å; D198-R214 VanDerWaalsContact OD1-CZ 3.27Å; D198-R214 IonicContact OD1-NH1 2.83Å; D198-R214 PolarHBondContact OD1-NH1 3.43Å; D198-R214 IonicContact OD1-NH2 2.75Å; D198-R214 PolarHBondContact OD1-NH2 3.2Å
199	E	62.8	Low	65.4	Low	191 Å²	191	121.1 Å²	121.1	89%	0.893	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	-2.7	-170.4	-119.9	157.9	178.1	0	0	114.7	R196	R196-E199 PolarHBondContact O-N 3.09Å
200	E	66.5	Low	66.5	Low	139 Å²	139	115.7 Å²	115.7	65%	0.65	61%	0.607	S	S	*	*			trans	-127.5	48.1	-177.6	-155.9	168.7	-154.1	0	0	110	R196	R196-E200 WeakPolarHBondContact CD-OE2 3.36Å; R196-E200 IonicContact NH1-OE2 3.43Å; R196-E200 PolarHBondContact O-N 3.27Å
201	L	70.6	Confident	67.4	Low	65 Å²	65	119.8 Å²	119.8	34%	0.34	62%	0.623	S	S	.	*			trans	-79.7	130.3	170.9	-71.4	166.1	0	0	0	108.5	P203	L201-P203 WeakPolarHBondContact O-CD 3.47Å
202	D	78.3	Confident	68.3	Low	94 Å²	94	112.9 Å²	112.9	50%	0.503	60%	0.602	S	S	.	*			trans	-60.5	123.1	176.6	179.5	-8.9	0	0	0	108.6	M204 D205 S208	D202-M204 PolarHBondContact O-N 3.47Å; D202-M204 WeakPolarHBondContact OD1-CB 3.09Å; D202-M204 PolarHBondContact OD1-N 2.78Å; D202-D205 HydrophobicContact CB-CB 4.02Å; D202-D205 WeakPolarHBondContact O-CB 3.16Å; D202-D205 PolarHBondContact O-N 3.18Å; D202-S208 WeakPolarHBondContact O-CB 3.28Å
203	P	80.4	Confident	68.9	Low	83 Å²	83	110.1 Å²	110.1	54%	0.539	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	5.4	176.7	28.4	-35.6	0	0	0	113.5	L201 Y209	L201-P203 WeakPolarHBondContact O-CD 3.47Å; P203-Y209 WeakPolarHBondContact O-CE2 3.3Å; P203-Y209 PolarHBondContact O-OH 3.05Å
204	M	78.4	Confident	69.7	Low	155 Å²	155	113.9 Å²	113.9	76%	0.764	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	-0.8	168.3	-71.1	-61.4	-47.4	0	0	113.4	D202	D202-M204 PolarHBondContact O-N 3.47Å; D202-M204 WeakPolarHBondContact OD1-CB 3.09Å; D202-M204 PolarHBondContact OD1-N 2.78Å
205	D	78.3	Confident	70.7	Confident	61 Å²	61	109 Å²	109	33%	0.326	58%	0.58	S	S	.	*			trans	-79.6	126.3	176.6	-173	-27	0	0	0	109.9	D202 S207 S208	D202-D205 HydrophobicContact CB-CB 4.02Å; D202-D205 WeakPolarHBondContact O-CB 3.16Å; D202-D205 PolarHBondContact O-N 3.18Å; D205-S207 PolarHBondContact O-N 3.26Å; D205-S207 VanDerWaalsContact O-N 3.13Å; D205-S207 WeakPolarHBondContact OD1-CB 3.42Å; D205-S207 PolarHBondContact OD1-N 2.88Å; D205-S207 PolarHBondContact OD1-OG 3.44Å; D205-S207 PolarHBondContact OD2-OG 3.25Å; D205-S207 VanDerWaalsContact OD2-OG 3.08Å; D205-S208 WeakPolarHBondContact O-CA 3.2Å; D205-S208 WeakPolarHBondContact O-CB 3.41Å; D205-S208 PolarHBondContact O-N 3.13Å
206	P	78.1	Confident	71.8	Confident	97 Å²	97	107.5 Å²	107.5	63%	0.63	57%	0.566	S	S	*	*	H	α-helix	trans	-57.5	-26.2	176.4	23.3	-34.5	0	0	0	113.2	S208 Y209 S210	P206-S208 PolarHBondContact O-N 2.98Å; P206-Y209 PolarHBondContact O-N 3.14Å; P206-S210 WeakPolarHBondContact O-CB 3.12Å; P206-S210 PolarHBondContact O-N 3.41Å; P206-S210 PolarHBondContact O-OG 3.35Å
207	S	74.7	Confident	72.6	Confident	44 Å²	44	111.7 Å²	111.7	31%	0.308	58%	0.582	S	S	.	*	H	α-helix	trans	-70.9	-15.6	172.6	69.6	0	0	0	0	113.8	D205	D205-S207 PolarHBondContact O-N 3.26Å; D205-S207 VanDerWaalsContact O-N 3.13Å; D205-S207 WeakPolarHBondContact OD1-CB 3.42Å; D205-S207 PolarHBondContact OD1-N 2.88Å; D205-S207 PolarHBondContact OD1-OG 3.44Å; D205-S207 PolarHBondContact OD2-OG 3.25Å; D205-S207 VanDerWaalsContact OD2-OG 3.08Å
208	S	77.3	Confident	73.2	Confident	43 Å²	43	108.4 Å²	108.4	30%	0.301	58%	0.578	S	S	.	*	H	α-helix	trans	-79.7	-21.5	172.7	-163.5	0	0	0	0	113.3	D202 D205 P206	D202-S208 WeakPolarHBondContact O-CB 3.28Å; D205-S208 WeakPolarHBondContact O-CA 3.2Å; D205-S208 WeakPolarHBondContact O-CB 3.41Å; D205-S208 PolarHBondContact O-N 3.13Å; P206-S208 PolarHBondContact O-N 2.98Å
209	Y	71.1	Confident	74	Confident	175 Å²	175	106.7 Å²	106.7	69%	0.686	57%	0.572	S	S	*	*	H	α-helix	trans	-116.1	-13.9	179.4	-63.1	-70	0	0	0	114.6	P203 P206	P203-Y209 WeakPolarHBondContact O-CE2 3.3Å; P203-Y209 PolarHBondContact O-OH 3.05Å; P206-Y209 PolarHBondContact O-N 3.14Å
210	S	76.4	Confident	74.3	Confident	58 Å²	58	101.7 Å²	101.7	41%	0.406	57%	0.572	S	S	.	*	S	Bend	trans	-94.4	143.6	179.1	61	0	0	0	0	111.9	P206 A212	P206-S210 WeakPolarHBondContact O-CB 3.12Å; P206-S210 PolarHBondContact O-N 3.41Å; P206-S210 PolarHBondContact O-OG 3.35Å; S210-A212 PolarHBondContact O-N 3.43Å; S210-A212 WeakPolarHBondContact OG-CB 3.44Å
211	D	72.6	Confident	74.8	Confident	171 Å²	171	100.2 Å²	100.2	91%	0.914	57%	0.568	S	S	*	*			trans	-74.2	29.4	168.1	-164.8	24.2	0	0	0	111.6
212	A	75.2	Confident	74.8	Confident	49 Å²	49	101.3 Å²	101.3	41%	0.405	58%	0.579	S	S	.	*			trans	-65.8	128.6	178	0	0	0	0	0	108.2	S210 R214	S210-A212 PolarHBondContact O-N 3.43Å; S210-A212 WeakPolarHBondContact OG-CB 3.44Å; A212-R214 PolarHBondContact O-N 2.8Å
213	P	68.2	Low	74.5	Confident	127 Å²	127	104.4 Å²	104.4	83%	0.825	59%	0.588	S	S	*	*			trans	-58.1	112.5	-178.6	20.8	-31.2	0	0	0	109.9	G215	P213-G215 VanDerWaalsContact C-N 3.31Å; P213-G215 PolarHBondContact O-N 2.82Å
214	R	70.9	Confident	73.7	Confident	152 Å²	152	112 Å²	112	57%	0.574	61%	0.606	S	S	*	*			trans	-74.1	82.7	-178	-66	173	68.3	-141.8	-2.2	109.7	K197 D198 A212	K197-R214 PolarHBondContact O-NH2 3.41Å; D198-R214 IonicContact OD1-CZ 3.27Å; D198-R214 VanDerWaalsContact OD1-CZ 3.27Å; D198-R214 IonicContact OD1-NH1 2.83Å; D198-R214 PolarHBondContact OD1-NH1 3.43Å; D198-R214 IonicContact OD1-NH2 2.75Å; D198-R214 PolarHBondContact OD1-NH2 3.2Å; A212-R214 PolarHBondContact O-N 2.8Å
215	G	76.3	Confident	72.9	Confident	41 Å²	41	111.1 Å²	111.1	42%	0.423	60%	0.604	S	S	.	*			trans	-117.8	157	-178.9	0	0	0	0	0	114	P213 T219	P213-G215 VanDerWaalsContact C-N 3.31Å; P213-G215 PolarHBondContact O-N 2.82Å; G215-T219 VanDerWaalsContact CA-CG2 3.49Å; G215-T219 VanDerWaalsContact CA-OG1 3.3Å; G215-T219 WeakPolarHBondContact CA-OG1 3.21Å
216	T	78.8	Confident	72.2	Confident	82 Å²	82	112.5 Å²	112.5	50%	0.503	61%	0.609	S	S	.	*			trans	-69.2	158.9	163.8	56.1	0	0	0	0	109.7	S218 T219	T216-S218 PolarHBondContact O-N 2.85Å; T216-S218 PolarHBondContact OG1-OG 2.97Å; T216-T219 WeakPolarHBondContact O-CB 3.49Å; T216-T219 WeakPolarHBondContact O-CG2 3.38Å; T216-T219 PolarHBondContact O-N 3.11Å; T216-T219 PolarHBondContact O-OG1 3.33Å
217	W	70.1	Confident	71.2	Confident	246 Å²	246	111.9 Å²	111.9	93%	0.932	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.9	-25.9	176.7	-166.5	-73.1	0	0	0	115.1	L221	W217-L221 WeakPolarHBondContact O-CD1 3.38Å
218	S	72.6	Confident	70.3	Confident	82 Å²	82	119 Å²	119	57%	0.573	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-4.3	175.6	51.2	0	0	0	0	116.1	T216 G220 L221	T216-S218 PolarHBondContact O-N 2.85Å; T216-S218 PolarHBondContact OG1-OG 2.97Å; S218-G220 PolarHBondContact O-N 2.84Å; S218-L221 PolarHBondContact O-N 2.57Å
219	T	75.8	Confident	69.4	Low	86 Å²	86	121.3 Å²	121.3	53%	0.528	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	116.8	177.6	55.4	0	0	0	0	109.3	G215 T216	G215-T219 VanDerWaalsContact CA-CG2 3.49Å; G215-T219 VanDerWaalsContact CA-OG1 3.3Å; G215-T219 WeakPolarHBondContact CA-OG1 3.21Å; T216-T219 WeakPolarHBondContact O-CB 3.49Å; T216-T219 WeakPolarHBondContact O-CG2 3.38Å; T216-T219 PolarHBondContact O-N 3.11Å; T216-T219 PolarHBondContact O-OG1 3.33Å
220	G	70.5	Confident	68.9	Low	86 Å²	86	116.8 Å²	116.8	89%	0.887	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.7	-7.1	-176.7	0	0	0	0	0	114.6	S218	S218-G220 PolarHBondContact O-N 2.84Å
221	L	76.6	Confident	68.2	Low	107 Å²	107	116.7 Å²	116.7	56%	0.56	66%	0.659	S	S	*	*	S	Bend	trans	-79.6	136.4	167.7	-83.1	106.1	0	0	0	110.6	W217 S218 K223	W217-L221 WeakPolarHBondContact O-CD1 3.38Å; S218-L221 PolarHBondContact O-N 2.57Å; L221-K223 PolarHBondContact O-N 3.4Å
222	P	69.3	Low	67.5	Low	89 Å²	89	114.3 Å²	114.3	58%	0.578	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-58.3	133.7	174.8	23.9	-32.1	0	0	0	109.1	E226	P222-E226 HydrophobicContact CB-CB 4.33Å
223	K	73	Confident	67	Low	159 Å²	159	118 Å²	118	69%	0.691	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-61.5	146.8	178.3	-71.4	174.5	-177.1	168.8	0	107.9	L221 N225 E226	L221-K223 PolarHBondContact O-N 3.4Å; K223-N225 PolarHBondContact O-N 2.83Å; K223-E226 PolarHBondContact N-OE2 3.03Å; K223-E226 WeakPolarHBondContact O-CB 3.19Å; K223-E226 PolarHBondContact O-N 2.81Å
224	R	63.8	Low	66.6	Low	243 Å²	243	118.2 Å²	118.2	92%	0.917	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	-14.4	-177.4	-74.6	-179.9	166.3	-129.6	-2.1	115.2
225	N	61.8	Low	65.8	Low	135 Å²	135	113.4 Å²	113.4	72%	0.722	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-11.6	178.4	-60	-24.4	0	0	0	114.3	K223	K223-N225 PolarHBondContact O-N 2.83Å
226	E	62.5	Low	64.7	Low	91 Å²	91	116.9 Å²	116.9	43%	0.425	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.9	-35.9	176.5	-104.6	157	179.4	0	0	111.9	P222 K223 K228 T229	P222-E226 HydrophobicContact CB-CB 4.33Å; K223-E226 PolarHBondContact N-OE2 3.03Å; K223-E226 WeakPolarHBondContact O-CB 3.19Å; K223-E226 PolarHBondContact O-N 2.81Å; E226-K228 PolarHBondContact O-N 2.83Å; E226-K228 VanDerWaalsContact O-N 3.15Å; E226-T229 CarbonylContact O-C 3.56Å; E226-T229 PolarHBondContact O-N 2.81Å; E226-T229 VanDerWaalsContact O-N 3.15Å; E226-T229 PolarHBondContact O-OG1 2.77Å
227	A	57.6	Low	64	Low	84 Å²	84	115.3 Å²	115.3	69%	0.694	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-11.9	-179.7	0	0	0	0	0	114.8
228	K	55.8	Low	63.6	Low	192 Å²	192	109.9 Å²	109.9	84%	0.835	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-23.6	174.5	-95.4	174.3	173.8	174.6	0	112.8	E226	E226-K228 PolarHBondContact O-N 2.83Å; E226-K228 VanDerWaalsContact O-N 3.15Å
229	T	59	Low	62.7	Low	92 Å²	92	110.5 Å²	110.5	56%	0.564	67%	0.674	S	S	*	*	S	Bend	trans	-93	92.1	166.5	41.3	0	0	0	0	106.1	E226 A231	E226-T229 CarbonylContact O-C 3.56Å; E226-T229 PolarHBondContact O-N 2.81Å; E226-T229 VanDerWaalsContact O-N 3.15Å; E226-T229 PolarHBondContact O-OG1 2.77Å; T229-A231 PolarHBondContact O-N 3.37Å
230	G	59.8	Low	61.9	Low	80 Å²	80	116.6 Å²	116.6	83%	0.825	69%	0.693	S	S	*	*			trans	-67.8	53.3	176.3	0	0	0	0	0	112.7
231	A	62	Low	61.6	Low	57 Å²	57	116.9 Å²	116.9	47%	0.471	67%	0.672	S	S	.	*			trans	-122.1	122.6	-179.2	0	0	0	0	0	107.7	T229 T233	T229-A231 PolarHBondContact O-N 3.37Å; A231-T233 PolarHBondContact O-N 3.2Å
232	D	59.3	Low	61	Low	121 Å²	121	119.6 Å²	119.6	65%	0.647	68%	0.681	S	S	*	*			trans	-65.5	119.2	175.3	-61.8	-42.2	0	0	0	109.2	T234	D232-T234 PolarHBondContact O-N 3.11Å
233	T	64.4	Low	61.2	Low	125 Å²	125	125.8 Å²	125.8	77%	0.767	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-2.3	179.3	52.8	0	0	0	0	113.4	A231	A231-T233 PolarHBondContact O-N 3.2Å
234	T	59.3	Low	61.5	Low	133 Å²	133	124.1 Å²	124.1	82%	0.816	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-14.7	-175.4	-49.6	0	0	0	0	113.3	D232	D232-T234 PolarHBondContact O-N 3.11Å
235	A	53.9	Low	62.3	Low	50 Å²	50	122 Å²	122	41%	0.413	69%	0.692	S	S	.	*			trans	-100.6	106.4	-176.1	0	0	0	0	0	112.1	G237 L239	A235-G237 PolarHBondContact O-N 3.41Å; A235-L239 HydrophobicContact CB-CD2 3.81Å
236	A	53.1	Low	63.3	Low	115 Å²	115	119.6 Å²	119.6	95%	0.95	68%	0.683	S	S	*	*			trans	-78.8	100.6	170.5	0	0	0	0	0	110.3
237	G	65.1	Low	64.4	Low	49 Å²	49	118.7 Å²	118.7	51%	0.505	69%	0.687	S	S	.	*	S	Bend	trans	165.2	161.9	170.9	0	0	0	0	0	113	A235 L239	A235-G237 PolarHBondContact O-N 3.41Å; G237-L239 PolarHBondContact O-N 3.26Å
238	P	60.5	Low	65.9	Low	131 Å²	131	119.8 Å²	119.8	85%	0.851	69%	0.687	S	S	*	*			trans	-68.6	83.3	170.6	-1.5	16.8	0	0	0	108.5	F240	P238-F240 PolarHBondContact O-N 3.1Å; P238-F240 VanDerWaalsContact O-N 3.09Å
239	L	54.8	Low	67.8	Low	96 Å²	96	112.4 Å²	112.4	50%	0.503	67%	0.666	S	S	.	*			trans	-74.6	101.9	-177.7	-151.4	62.9	0	0	0	106.7	A235 G237 Q241	A235-L239 HydrophobicContact CB-CD2 3.81Å; G237-L239 PolarHBondContact O-N 3.26Å; L239-Q241 HydrophobicContact CB-CG 4.01Å; L239-Q241 HydrophobicContact CD2-CG 3.56Å; L239-Q241 HydrophobicContact CG-CG 3.45Å; L239-Q241 VanDerWaalsContact CG-CG 3.45Å; L239-Q241 PolarHBondContact O-N 3.3Å
240	F	58.2	Low	69.3	Low	213 Å²	213	109.6 Å²	109.6	93%	0.934	65%	0.652	S	S	*	*			trans	-66.5	65.9	166.3	-99.2	-96.1	0	0	0	108.6	P238 Q242	P238-F240 PolarHBondContact O-N 3.1Å; P238-F240 VanDerWaalsContact O-N 3.09Å; F240-Q242 PolarHBondContact O-N 2.75Å
241	Q	64.2	Low	70.6	Confident	93 Å²	93	108.6 Å²	108.6	44%	0.435	63%	0.63	S	S	.	*			trans	-76.9	122.1	168.9	-61.9	-169.8	-43.4	0	0	107	L239 R243	L239-Q241 HydrophobicContact CB-CG 4.01Å; L239-Q241 HydrophobicContact CD2-CG 3.56Å; L239-Q241 HydrophobicContact CG-CG 3.45Å; L239-Q241 VanDerWaalsContact CG-CG 3.45Å; L239-Q241 PolarHBondContact O-N 3.3Å; Q241-R243 PolarHBondContact O-N 3.08Å
242	Q	64.6	Low	72	Confident	163 Å²	163	111.8 Å²	111.8	76%	0.762	64%	0.638	S	S	*	*			trans	-54	102.1	173.4	-170.9	172.1	4.1	0	0	108.1	F240	F240-Q242 PolarHBondContact O-N 2.75Å
243	R	73.8	Confident	73.6	Confident	220 Å²	220	113.6 Å²	113.6	83%	0.83	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-58.5	131.3	178.5	-73.6	177.7	158.7	-134.9	-3.4	107.8	Q241 Y245	Q241-R243 PolarHBondContact O-N 3.08Å; R243-Y245 PolarHBondContact O-N 2.89Å
244	P	78.1	Confident	74.8	Confident	124 Å²	124	110 Å²	110	81%	0.805	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-53.2	133.1	173.6	-22.9	31.4	0	0	0	109.4
245	Y	80.3	Confident	76.3	Confident	199 Å²	199	108.6 Å²	108.6	78%	0.78	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-55.9	141.8	175.4	-70	-77.2	0	0	0	109.7	R243 S247	R243-Y245 PolarHBondContact O-N 2.89Å; Y245-S247 PolarHBondContact O-N 2.93Å
246	P	83.9	Confident	77.9	Confident	83 Å²	83	108.1 Å²	108.1	54%	0.539	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-55.8	140.8	175.7	22.6	-32.2	0	0	0	110	A250 V251	P246-A250 HydrophobicContact CB-CB 4.29Å; P246-V251 HydrophobicContact CB-CG2 4.02Å; P246-V251 HydrophobicContact CG-CG2 3.71Å
247	S	84.4	Confident	79.5	Confident	72 Å²	72	108.4 Å²	108.4	50%	0.503	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-58.2	148.5	177.1	62.8	0	0	0	0	110.6	Y245 G249 A250 V251	Y245-S247 PolarHBondContact O-N 2.93Å; S247-G249 PolarHBondContact O-N 3.36Å; S247-A250 WeakPolarHBondContact O-CA 3.34Å; S247-A250 WeakPolarHBondContact O-CB 3.37Å; S247-A250 PolarHBondContact O-N 2.88Å; S247-V251 PolarHBondContact O-N 3Å
248	P	90.5	Very high	80.6	Confident	108 Å²	108	108.3 Å²	108.3	70%	0.701	58%	0.579	S	S	*	*	H	α-helix	trans	-51.3	-37.4	-177.9	-29.4	35.2	0	0	0	113.6	A250 V251 L252	P248-A250 PolarHBondContact O-N 3.44Å; P248-V251 PolarHBondContact O-N 3.13Å; P248-L252 WeakPolarHBondContact O-CG 3.19Å; P248-L252 PolarHBondContact O-N 2.78Å; P248-L252 VanDerWaalsContact O-N 3.07Å
249	G	93.9	Very high	81.7	Confident	37 Å²	37	104.8 Å²	104.8	38%	0.381	56%	0.558	S	S	.	*	H	α-helix	trans	-68	-30.9	176.1	0	0	0	0	0	114.6	S247 R253	S247-G249 PolarHBondContact O-N 3.36Å; G249-R253 PolarHBondContact O-N 3.34Å; G249-R253 VanDerWaalsContact O-N 3.12Å
250	A	90.5	Very high	83	Confident	33 Å²	33	108.3 Å²	108.3	27%	0.273	56%	0.564	S	S	.	*	H	α-helix	trans	-70.2	-39.1	174.4	0	0	0	0	0	111.6	P246 S247 P248 R253 A254	P246-A250 HydrophobicContact CB-CB 4.29Å; S247-A250 WeakPolarHBondContact O-CA 3.34Å; S247-A250 WeakPolarHBondContact O-CB 3.37Å; S247-A250 PolarHBondContact O-N 2.88Å; P248-A250 PolarHBondContact O-N 3.44Å; A250-R253 PolarHBondContact O-N 3.1Å; A250-A254 PolarHBondContact O-N 3.03Å
251	V	88.9	Confident	83.9	Confident	59 Å²	59	102.1 Å²	102.1	36%	0.358	54%	0.544	S	S	.	.	H	α-helix	trans	-63.8	-44.4	174.9	-179.5	0	0	0	0	111	P246 S247 P248 R253 A254 N255	P246-V251 HydrophobicContact CB-CG2 4.02Å; P246-V251 HydrophobicContact CG-CG2 3.71Å; S247-V251 PolarHBondContact O-N 3Å; P248-V251 PolarHBondContact O-N 3.13Å; V251-R253 PolarHBondContact O-N 2.91Å; V251-A254 PolarHBondContact O-N 3.46Å; V251-N255 PolarHBondContact O-N 3.37Å
252	L	90.8	Very high	84.4	Confident	123 Å²	123	105.7 Å²	105.7	64%	0.644	56%	0.558	S	S	*	*	H	α-helix	trans	-61.9	-41	177.2	-69.6	173.9	0	0	0	112.4	P248 N255 A256	P248-L252 WeakPolarHBondContact O-CG 3.19Å; P248-L252 PolarHBondContact O-N 2.78Å; P248-L252 VanDerWaalsContact O-N 3.07Å; L252-N255 PolarHBondContact O-N 3.19Å; L252-A256 WeakPolarHBondContact O-CB 3.44Å; L252-A256 PolarHBondContact O-N 2.75Å
253	R	93.3	Very high	84.5	Confident	159 Å²	159	105.7 Å²	105.7	60%	0.6	56%	0.558	S	S	*	*	H	α-helix	trans	-64	-46.1	174.6	-80	-169.3	-65.3	-120.2	-1.7	112.4	G249 A250 V251 N255 A256 E257	G249-R253 PolarHBondContact O-N 3.34Å; G249-R253 VanDerWaalsContact O-N 3.12Å; A250-R253 PolarHBondContact O-N 3.1Å; V251-R253 PolarHBondContact O-N 2.91Å; R253-N255 VanDerWaalsContact C-N 3.3Å; R253-N255 PolarHBondContact O-N 3.04Å; R253-A256 WeakPolarHBondContact O-CB 3.2Å; R253-A256 PolarHBondContact O-N 2.91Å; R253-A256 VanDerWaalsContact O-N 3.14Å; R253-E257 WeakPolarHBondContact O-CG 3.18Å; R253-E257 PolarHBondContact O-N 3.08Å
254	A	89.2	Confident	84	Confident	51 Å²	51	103.2 Å²	103.2	42%	0.421	56%	0.556	S	S	.	*	H	α-helix	trans	-60.3	-39.9	177.9	0	0	0	0	0	112.1	A250 V251 E257 A258	A250-A254 PolarHBondContact O-N 3.03Å; V251-A254 PolarHBondContact O-N 3.46Å; A254-E257 PolarHBondContact O-N 2.76Å; A254-A258 WeakPolarHBondContact O-CB 3.14Å; A254-A258 PolarHBondContact O-N 2.83Å
255	N	90	Very high	82.7	Confident	102 Å²	102	107.1 Å²	107.1	55%	0.545	57%	0.57	S	S	.	*	H	α-helix	trans	-68.5	-36.7	175.5	-70.6	-12.5	0	0	0	112.4	V251 L252 R253 S259	V251-N255 PolarHBondContact O-N 3.37Å; L252-N255 PolarHBondContact O-N 3.19Å; R253-N255 VanDerWaalsContact C-N 3.3Å; R253-N255 PolarHBondContact O-N 3.04Å; N255-S259 WeakPolarHBondContact O-CB 3.44Å; N255-S259 PolarHBondContact O-N 2.94Å; N255-S259 PolarHBondContact O-OG 2.89Å
256	A	88.8	Confident	82.8	Confident	41 Å²	41	102.5 Å²	102.5	34%	0.339	56%	0.559	S	S	.	*	H	α-helix	trans	-66.7	-38.1	174.4	0	0	0	0	0	112	L252 R253 S259 R260	L252-A256 WeakPolarHBondContact O-CB 3.44Å; L252-A256 PolarHBondContact O-N 2.75Å; R253-A256 WeakPolarHBondContact O-CB 3.2Å; R253-A256 PolarHBondContact O-N 2.91Å; R253-A256 VanDerWaalsContact O-N 3.14Å; A256-S259 WeakPolarHBondContact CA-OG 3.45Å; A256-S259 PolarHBondContact O-OG 2.83Å; A256-R260 VanDerWaalsContact O-CG 3.25Å; A256-R260 WeakPolarHBondContact O-CG 3.36Å; A256-R260 PolarHBondContact O-N 3.04Å; A256-R260 VanDerWaalsContact O-N 3.16Å
257	E	86.4	Confident	82.8	Confident	120 Å²	120	103.5 Å²	103.5	56%	0.561	56%	0.56	S	S	*	*	H	α-helix	trans	-69.1	-45.4	174.9	-72.5	169.3	-168.7	0	0	111.4	R253 A254 S259 R260 T261	R253-E257 WeakPolarHBondContact O-CG 3.18Å; R253-E257 PolarHBondContact O-N 3.08Å; A254-E257 PolarHBondContact O-N 2.76Å; E257-S259 VanDerWaalsContact C-N 3.26Å; E257-S259 PolarHBondContact O-N 2.65Å; E257-R260 WeakPolarHBondContact O-CB 3.44Å; E257-R260 PolarHBondContact O-N 3.26Å; E257-R260 VanDerWaalsContact O-N 3.08Å; E257-T261 PolarHBondContact O-N 2.87Å; E257-T261 PolarHBondContact O-OG1 2.81Å
258	A	86.8	Confident	82.7	Confident	47 Å²	47	105.3 Å²	105.3	39%	0.388	56%	0.563	S	S	.	*	H	α-helix	trans	-64.8	-27.7	177.7	0	0	0	0	0	113.6	A254 T261 K262	A254-A258 WeakPolarHBondContact O-CB 3.14Å; A254-A258 PolarHBondContact O-N 2.83Å; A258-T261 PolarHBondContact O-OG1 3.13Å; A258-T261 VanDerWaalsContact O-OG1 3.11Å; A258-K262 WeakPolarHBondContact O-CG 3.48Å; A258-K262 PolarHBondContact O-N 3.4Å
259	S	83.8	Confident	82.2	Confident	58 Å²	58	105.1 Å²	105.1	41%	0.406	56%	0.555	S	S	.	*	H	α-helix	trans	-77.8	-31.2	172.4	48.7	0	0	0	0	112.5	N255 A256 E257 Q263	N255-S259 WeakPolarHBondContact O-CB 3.44Å; N255-S259 PolarHBondContact O-N 2.94Å; N255-S259 PolarHBondContact O-OG 2.89Å; A256-S259 WeakPolarHBondContact CA-OG 3.45Å; A256-S259 PolarHBondContact O-OG 2.83Å; E257-S259 VanDerWaalsContact C-N 3.26Å; E257-S259 PolarHBondContact O-N 2.65Å; S259-Q263 WeakPolarHBondContact O-CG 3.09Å; S259-Q263 PolarHBondContact O-N 2.93Å
260	R	83.3	Confident	81.5	Confident	170 Å²	170	109.4 Å²	109.4	64%	0.642	57%	0.566	S	S	*	*	H	α-helix	trans	-69.1	-42	173.1	-72.8	169.7	-177.3	-161.6	-0.2	112.2	A256 E257 K262 Q263 Q264	A256-R260 VanDerWaalsContact O-CG 3.25Å; A256-R260 WeakPolarHBondContact O-CG 3.36Å; A256-R260 PolarHBondContact O-N 3.04Å; A256-R260 VanDerWaalsContact O-N 3.16Å; E257-R260 WeakPolarHBondContact O-CB 3.44Å; E257-R260 PolarHBondContact O-N 3.26Å; E257-R260 VanDerWaalsContact O-N 3.08Å; R260-K262 VanDerWaalsContact C-N 3.34Å; R260-Q263 PolarHBondContact O-N 3.01Å; R260-Q263 VanDerWaalsContact O-N 3.15Å; R260-Q264 PolarHBondContact O-N 3.11Å
261	T	77	Confident	80.9	Confident	82 Å²	82	114.5 Å²	114.5	50%	0.503	59%	0.586	S	S	.	*	H	α-helix	trans	-65.8	-38.5	177.8	56.1	0	0	0	0	111.6	E257 A258 Q263 Q264 D265	E257-T261 PolarHBondContact O-N 2.87Å; E257-T261 PolarHBondContact O-OG1 2.81Å; A258-T261 PolarHBondContact O-OG1 3.13Å; A258-T261 VanDerWaalsContact O-OG1 3.11Å; T261-Q263 PolarHBondContact O-N 2.88Å; T261-Q264 PolarHBondContact O-N 2.96Å; T261-D265 PolarHBondContact O-N 3.32Å
262	K	74.3	Confident	80.3	Confident	169 Å²	169	118.4 Å²	118.4	74%	0.735	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-15.6	172.5	-80.7	-179.4	176.7	-176.1	0	115.3	A258 R260	A258-K262 WeakPolarHBondContact O-CG 3.48Å; A258-K262 PolarHBondContact O-N 3.4Å; R260-K262 VanDerWaalsContact C-N 3.34Å
263	Q	67.3	Low	79.5	Confident	162 Å²	162	118.1 Å²	118.1	76%	0.757	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-8.2	174.5	-72.6	175.9	5.1	0	0	112.4	S259 R260 T261	S259-Q263 WeakPolarHBondContact O-CG 3.09Å; S259-Q263 PolarHBondContact O-N 2.93Å; R260-Q263 PolarHBondContact O-N 3.01Å; R260-Q263 VanDerWaalsContact O-N 3.15Å; T261-Q263 PolarHBondContact O-N 2.88Å
264	Q	62.4	Low	78.4	Confident	169 Å²	169	114.7 Å²	114.7	79%	0.79	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-8.1	-178.3	-70.3	-175.8	-15.3	0	0	113.5	R260 T261	R260-Q264 PolarHBondContact O-N 3.11Å; T261-Q264 PolarHBondContact O-N 2.96Å
265	D	51.2	Low	77.4	Confident	205 Å²	205	120.5 Å²	120.5	100%	1.096	62%	0.615	S	S	*	*			trans	-98.8	0	164.7	-80.5	-36.8	0	0	0	110.3	T261	T261-D265 PolarHBondContact O-N 3.32Å

Retrieved 265 of 265 residues in 120.3 ms (Link to these results)

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