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Isocitrate dehydrogenase [NAD] subunit, mitochondrial

Plays a structural role to facilitate the assembly and ensure the full activity of the enzyme catalyzing the decarboxylation of isocitrate (ICT) into alpha-ketoglutarate. The heterodimer composed of the alpha (IDH3A) and beta (IDH3B) subunits and the heterodimer composed of the alpha (IDH3A) and gamma (IDH3G) subunits, have considerable basal activity but the full activity of the heterotetramer (containing two subunits of IDH3A, one of IDH3B and one of IDH3G) requires the assembly and cooperative function of both heterodimers.

AlphaFold DB , UniProt , Accession A0A087X2E5, Species HUMAN (Homo sapiens, Human), Gene IDH3B, Length 376 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	33.1	Very low	242 Å²	242	135.3 Å²	135.3	100%	1.192	77%	0.769	S	S	*	*				0	97.3	0	-65.2	-172.4	-177.5	0	0	106.2
2	A	34.4	Very low	32.9	Very low	103 Å²	103	143.9 Å²	143.9	85%	0.851	78%	0.78	S	S	*	*				49.2	130.5	92.2	0	0	0	0	0	111.7
3	A	35	Very low	32.6	Very low	84 Å²	84	139.8 Å²	139.8	69%	0.694	78%	0.778	S	S	*	*			cis	-163	165	1.5	0	0	0	0	0	104.4
4	L	32.4	Very low	32.7	Very low	170 Å²	170	142 Å²	142	89%	0.89	79%	0.786	S	S	*	*				177.1	136.6	91.8	-92.3	157.8	0	0	0	110.1
5	S	34.8	Very low	32.4	Very low	116 Å²	116	141.6 Å²	141.6	81%	0.811	79%	0.788	S	S	*	*			trans	-85.8	157.6	172	51	0	0	0	0	113
6	G	33.4	Very low	32.2	Very low	59 Å²	59	139.4 Å²	139.4	61%	0.608	79%	0.785	S	S	*	*			trans	160.3	126	134.6	0	0	0	0	0	114.6
7	V	35.3	Very low	32	Very low	131 Å²	131	137.3 Å²	137.3	79%	0.794	79%	0.79	S	S	*	*				108	129.7	87.9	154.8	0	0	0	0	106.7
8	R	33.3	Very low	31.7	Very low	186 Å²	186	134.2 Å²	134.2	70%	0.702	79%	0.792	S	S	*	*			cis	-177.7	152.8	21.6	-113.4	173.3	166.7	-154.5	-11.3	111.2
9	W	29.1	Very low	31.8	Very low	180 Å²	180	135.5 Å²	135.5	68%	0.682	80%	0.795	S	S	*	*			trans	66.9	156.8	135.5	-65.4	144.7	0	0	0	122.3
10	L	31.5	Very low	32.3	Very low	113 Å²	113	134.8 Å²	134.8	59%	0.592	80%	0.795	S	S	*	*			cis	-164.7	126.1	-2.3	-105.7	155.2	0	0	0	109.7
11	T	30.4	Very low	32.1	Very low	104 Å²	104	132 Å²	132	64%	0.638	80%	0.795	S	S	*	*				44.8	137.4	126.5	60.9	0	0	0	0	126.6
12	R	31.2	Very low	31.9	Very low	239 Å²	239	124.9 Å²	124.9	90%	0.902	77%	0.774	S	S	*	*				72.3	150.5	125.6	-82.8	-178.4	169.9	-170.8	-2.9	118.5
13	A	29.4	Very low	31.7	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	78%	0.781	S	S	*	*			cis	-166.8	166.5	4.8	0	0	0	0	0	110.4
14	L	33	Very low	31.5	Very low	170 Å²	170	140.2 Å²	140.2	89%	0.89	79%	0.792	S	S	*	*			trans	-64.7	152.9	168.4	-72.5	105.9	0	0	0	115
15	V	29	Very low	31.3	Very low	136 Å²	136	135.7 Å²	135.7	82%	0.824	79%	0.787	S	S	*	*			trans	-162.2	113.7	140.4	177.3	0	0	0	0	106.3
16	S	28.6	Very low	31.1	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	79%	0.792	S	S	*	*				78.3	117.9	77.5	156.4	0	0	0	0	117.9
17	A	29.7	Very low	30.8	Very low	104 Å²	104	140.3 Å²	140.3	86%	0.86	80%	0.795	S	S	*	*			trans	78.3	134.5	138.9	0	0	0	0	0	123.3
18	G	26.8	Very low	30.5	Very low	81 Å²	81	140 Å²	140	84%	0.835	79%	0.794	S	S	*	*			trans	138	102.7	147.6	0	0	0	0	0	117.6
19	N	32.8	Very low	30.5	Very low	159 Å²	159	136.7 Å²	136.7	85%	0.85	80%	0.799	S	S	*	*			trans	-90	167.7	156.9	-140.6	9.4	0	0	0	107.7
20	P	41.6	Very low	31	Very low	122 Å²	122	133.2 Å²	133.2	79%	0.792	81%	0.808	S	S	*	*			cis	-146.4	-176.5	27.9	39.2	-16	0	0	0	116
21	G	27.8	Very low	30.9	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	82%	0.818	S	S	*	*			trans	152.2	112.8	157.6	0	0	0	0	0	116.8
22	A	29.8	Very low	31	Very low	91 Å²	91	132.1 Å²	132.1	75%	0.752	83%	0.826	S	S	*	*			trans	-80.5	146.1	-171.4	0	0	0	0	0	115.4
23	W	30.2	Very low	31.2	Very low	261 Å²	261	130.4 Å²	130.4	99%	0.989	83%	0.828	S	S	*	*			trans	-136.1	132.5	147.9	-86.6	74.7	0	0	0	110.3
24	R	31	Very low	31.1	Very low	249 Å²	249	130.6 Å²	130.6	94%	0.94	83%	0.829	S	S	*	*			trans	-81.5	148.4	-177.1	-72.3	175.7	172.6	-140.8	-1	111.4
25	G	29.3	Very low	31.1	Very low	75 Å²	75	127.1 Å²	127.1	77%	0.773	83%	0.825	S	S	*	*			trans	-177.6	112.9	160.8	0	0	0	0	0	112.2
26	L	29.6	Very low	31	Very low	175 Å²	175	126.4 Å²	126.4	92%	0.916	83%	0.826	S	S	*	*			trans	-59.6	157.7	178.1	-62.3	121.6	0	0	0	111.4
27	S	28.1	Very low	31.1	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	83%	0.832	S	S	*	*			cis	-170.3	156.3	24	36.9	0	0	0	0	111
28	T	29.3	Very low	31.2	Very low	126 Å²	126	132.8 Å²	132.8	77%	0.773	83%	0.83	S	S	*	*			trans	79.3	126.1	145	48.3	0	0	0	0	123.2
29	S	31.3	Very low	31.4	Very low	115 Å²	115	136.7 Å²	136.7	80%	0.804	83%	0.826	S	S	*	*			trans	76.1	111.2	149.5	51	0	0	0	0	119.6
30	A	40.3	Very low	31.4	Very low	107 Å²	107	133.9 Å²	133.9	88%	0.884	83%	0.825	S	S	*	*			trans	-52.9	130.3	166.7	0	0	0	0	0	112.7
31	A	30.1	Very low	31.1	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	83%	0.826	S	S	*	*			trans	-146.2	93.3	154	0	0	0	0	0	106.9	H33	A31-H33 PolarHBondContact O-N 2.93Å
32	A	31.9	Very low	31.7	Very low	99 Å²	99	137 Å²	137	82%	0.818	81%	0.812	S	S	*	*			trans	-65.8	119.5	169	0	0	0	0	0	108.1	A34	A32-A34 PolarHBondContact O-N 3.47Å
33	H	34.5	Very low	32.3	Very low	203 Å²	203	138.2 Å²	138.2	94%	0.94	81%	0.809	S	S	*	*			trans	-61.8	97.3	163.6	-88.3	-27.9	0	0	0	109.4	A31	A31-H33 PolarHBondContact O-N 2.93Å
34	A	29.3	Very low	33.2	Very low	94 Å²	94	133.2 Å²	133.2	78%	0.777	79%	0.79	S	S	*	*			trans	-99.4	110.5	159.4	0	0	0	0	0	107.7	A32 S36	A32-A34 PolarHBondContact O-N 3.47Å; A34-S36 PolarHBondContact O-N 2.96Å
35	A	31.5	Very low	34.3	Very low	97 Å²	97	126 Å²	126	80%	0.802	77%	0.774	S	S	*	*			trans	-57.4	131.2	171.8	0	0	0	0	0	110	R37	A35-R37 PolarHBondContact O-N 3.33Å
36	S	27.6	Very low	35.5	Very low	121 Å²	121	131.9 Å²	131.9	85%	0.846	78%	0.781	S	S	*	*			trans	-65.3	99.8	176.1	61.3	0	0	0	0	110.5	A34	A34-S36 PolarHBondContact O-N 2.96Å
37	R	30.8	Very low	37.5	Very low	227 Å²	227	126.7 Å²	126.7	86%	0.857	77%	0.77	S	S	*	*			trans	-85.1	100.8	151.5	-84.7	-179.2	175	178	-1.9	106.8	A35 Q39	A35-R37 PolarHBondContact O-N 3.33Å; R37-Q39 PolarHBondContact O-N 2.88Å
38	S	30.5	Very low	40.1	Very low	118 Å²	118	123.7 Å²	123.7	83%	0.825	75%	0.749	S	S	*	*			trans	-70.3	84.6	162.8	56.5	0	0	0	0	108.1	A40	S38-A40 PolarHBondContact O-N 3.02Å
39	Q	31.7	Very low	43.2	Very low	162 Å²	162	121.6 Å²	121.6	76%	0.757	73%	0.73	S	S	*	*			trans	-73.1	106	153.8	-79.4	-179.2	-23.7	0	0	105.4	R37 E41	R37-Q39 PolarHBondContact O-N 2.88Å; Q39-E41 VanDerWaalsContact C-N 3.33Å; Q39-E41 PolarHBondContact O-N 3.25Å
40	A	32.8	Very low	46.3	Very low	100 Å²	100	118.3 Å²	118.3	83%	0.826	71%	0.706	S	S	*	*			trans	-64	104	161.2	0	0	0	0	0	105.7	S38 D42	S38-A40 PolarHBondContact O-N 3.02Å; A40-D42 PolarHBondContact O-N 3.34Å
41	E	34.7	Very low	49	Very low	172 Å²	172	113.2 Å²	113.2	80%	0.804	66%	0.663	S	S	*	*			trans	-62.5	120.3	165.8	-76.6	-178.6	151.4	0	0	107.1	Q39 V43	Q39-E41 VanDerWaalsContact C-N 3.33Å; Q39-E41 PolarHBondContact O-N 3.25Å; E41-V43 PolarHBondContact O-N 2.73Å
42	D	41.6	Very low	52.2	Low	94 Å²	94	108.7 Å²	108.7	50%	0.503	63%	0.626	S	S	.	*			trans	-65.8	94.3	175.7	-152	23.9	0	0	0	107.1	A40 R44 Q81	A40-D42 PolarHBondContact O-N 3.34Å; D42-R44 VanDerWaalsContact C-N 3.29Å; D42-R44 PolarHBondContact O-N 2.98Å; D42-Q81 PolarHBondContact OD2-NE2 2.79Å; D42-Q81 VanDerWaalsContact OD2-NE2 3.13Å
43	V	42.8	Very low	55.4	Low	115 Å²	115	104 Å²	104	70%	0.697	59%	0.587	S	S	*	*			trans	-71	89	-179.1	-178.9	0	0	0	0	107.8	E41 V45	E41-V43 PolarHBondContact O-N 2.73Å; V43-V45 PolarHBondContact O-N 2.87Å; V43-V45 VanDerWaalsContact O-N 3.08Å
44	R	49.1	Very low	58.3	Low	156 Å²	156	94.3 Å²	94.3	59%	0.589	54%	0.542	S	S	*	.			trans	-58.8	114.1	173.1	-67.2	-177.1	179.9	-174.4	-2.8	108.7	D42 E46 E106	D42-R44 VanDerWaalsContact C-N 3.29Å; D42-R44 PolarHBondContact O-N 2.98Å; R44-E46 PolarHBondContact O-N 2.83Å; R44-E106 IonicContact NH2-OE1 3.62Å; R44-E106 PolarHBondContact NH2-OE1 3.43Å
45	V	53.3	Low	61.4	Low	98 Å²	98	90 Å²	90	59%	0.594	51%	0.506	S	S	*	.			trans	-67	119.1	171.9	-177.7	0	0	0	0	107.6	V43 G47 S48	V43-V45 PolarHBondContact O-N 2.87Å; V43-V45 VanDerWaalsContact O-N 3.08Å; V45-G47 PolarHBondContact O-N 2.96Å; V45-G47 VanDerWaalsContact O-N 3.11Å; V45-S48 WeakPolarHBondContact O-CB 3.49Å; V45-S48 PolarHBondContact O-N 3.29Å
46	E	53.6	Low	64.3	Low	198 Å²	198	86 Å²	86	93%	0.925	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	120.2	176.5	-77.3	-173.6	155	0	0	110.1	R44	R44-E46 PolarHBondContact O-N 2.83Å
47	G	71.5	Confident	67.2	Low	67 Å²	67	80.7 Å²	80.7	69%	0.691	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	4	-178.9	0	0	0	0	0	116.3	V45	V45-G47 PolarHBondContact O-N 2.96Å; V45-G47 VanDerWaalsContact O-N 3.11Å
48	S	84.1	Confident	70	Confident	33 Å²	33	70.9 Å²	70.9	23%	0.231	41%	0.406	C	S	.	.			trans	-92.1	142.9	173.1	-169.4	0	0	0	0	112.6	V45 E79	V45-S48 WeakPolarHBondContact O-CB 3.49Å; V45-S48 PolarHBondContact O-N 3.29Å; S48-E79 WeakPolarHBondContact OG-CB 3.36Å; S48-E79 PolarHBondContact OG-N 3.43Å
49	F	93.2	Very high	72.8	Confident	82 Å²	82	65.7 Å²	65.7	36%	0.36	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115.7	173.8	-68.4	-90.5	0	0	0	110.1	P77 V78 E79 L336 L338	F49-P77 WeakPolarHBondContact CD2-O 3.33Å; F49-P77 PolarHBondContact N-O 3.43Å; F49-V78 HydrophobicContact CB-CG2 4.3Å; F49-V78 WeakPolarHBondContact O-CA 3.42Å; F49-E79 PolarHBondContact O-N 2.83Å; F49-L336 HydrophobicContact CB-CD1 4.29Å; F49-L336 HydrophobicContact CD1-CD2 4.2Å; F49-L338 HydrophobicContact CD2-CD1 3.93Å; F49-L338 HydrophobicContact CD2-CD2 4.45Å; F49-L338 HydrophobicContact CE2-CD1 4.17Å; F49-L338 HydrophobicContact CE2-CD2 3.88Å; F49-L338 HydrophobicContact CE2-CG 4.27Å
50	P	96.2	Very high	75.7	Confident	46 Å²	46	58.2 Å²	58.2	30%	0.299	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132	175.4	31	-34.5	0	0	0	110.1	E79 N107	P50-E79 WeakPolarHBondContact CA-O 3.46Å; P50-N107 WeakPolarHBondContact CB-OD1 3.45Å
51	V	97.9	Very high	78.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.9	178.9	172.9	0	0	0	0	109.2	M53 V78 E79 F80 Q81 V109 I111 M332 L336	V51-M53 PolarHBondContact O-N 2.87Å; V51-V78 HydrophobicContact CB-CG1 4.02Å; V51-V78 HydrophobicContact CG2-CG1 3.75Å; V51-E79 PolarHBondContact N-O 3.09Å; V51-F80 HydrophobicContact CB-CD1 3.99Å; V51-F80 HydrophobicContact CB-CE1 4.17Å; V51-F80 HydrophobicContact CG1-CD1 3.98Å; V51-F80 HydrophobicContact CG1-CE1 3.93Å; V51-F80 WeakPolarHBondContact O-CA 3.34Å; V51-Q81 PolarHBondContact O-N 3.32Å; V51-V109 HydrophobicContact CG1-CG1 4.42Å; V51-V109 HydrophobicContact CG2-CG1 4.34Å; V51-I111 HydrophobicContact CG1-CG2 4.39Å; V51-M332 HydrophobicContact CG1-CE 4.31Å; V51-M332 HydrophobicContact CG1-SD 3.61Å; V51-M332 HydrophobicContact CG2-CE 4.35Å; V51-M332 HydrophobicContact CG2-SD 4.28Å; V51-L336 HydrophobicContact CG2-CD1 3.99Å
52	T	98.3	Very high	81.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	122.9	173.4	-54.7	0	0	0	0	109.8	S103 M104 N107 V109 A110 I111	T52-S103 WeakPolarHBondContact CG2-OG 3.26Å; T52-S103 VanDerWaalsContact OG1-C 3.27Å; T52-S103 PolarHBondContact OG1-O 3.18Å; T52-S103 PolarHBondContact OG1-OG 3.4Å; T52-M104 HydrophobicContact CG2-CE 4.15Å; T52-M104 HydrophobicContact CG2-CG 3.76Å; T52-M104 PolarHBondContact OG1-N 3.4Å; T52-N107 PolarHBondContact OG1-ND2 2.91Å; T52-V109 PolarHBondContact N-O 3.26Å; T52-V109 VanDerWaalsContact N-O 3.14Å; T52-A110 HydrophobicContact CG2-CB 4.48Å; T52-A110 CarbonylContact O-C 3.43Å; T52-A110 WeakPolarHBondContact O-CA 3.31Å; T52-A110 WeakPolarHBondContact O-CB 3.18Å; T52-I111 PolarHBondContact O-N 3.36Å
53	M	98.1	Very high	83.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.4	174.1	177.4	174.9	-80.4	0	0	109.8	V51 P55 M64 K68 F80 Q81 E82 H83 I111	V51-M53 PolarHBondContact O-N 2.87Å; M53-P55 HydrophobicContact CG-CG 4.4Å; M53-M64 HydrophobicContact CE-CB 4.32Å; M53-M64 HydrophobicContact CE-SD 4.04Å; M53-M64 HydrophobicContact CG-CG 4.27Å; M53-M64 HydrophobicContact CG-SD 4.33Å; M53-M64 HydrophobicContact SD-CB 3.87Å; M53-M64 HydrophobicContact SD-CG 4.18Å; M53-M64 HydrophobicContact SD-SD 4.4Å; M53-K68 HydrophobicContact CE-CD 4.47Å; M53-K68 HydrophobicContact CE-CG 4.02Å; M53-K68 HydrophobicContact SD-CD 4.01Å; M53-K68 HydrophobicContact SD-CG 4.2Å; M53-F80 HydrophobicContact CB-CB 4.07Å; M53-F80 HydrophobicContact CB-CD1 4Å; M53-F80 HydrophobicContact CB-CG 4.31Å; M53-F80 HydrophobicContact CE-CB 4.27Å; M53-F80 HydrophobicContact CE-CD1 3.53Å; M53-F80 HydrophobicContact CE-CD2 3.7Å; M53-F80 HydrophobicContact CE-CE1 3.6Å; M53-F80 HydrophobicContact CE-CE2 3.76Å; M53-F80 HydrophobicContact CE-CG 3.56Å; M53-F80 HydrophobicContact CE-CZ 3.71Å; M53-F80 HydrophobicContact SD-CB 4.32Å; M53-F80 HydrophobicContact SD-CD1 4.49Å; M53-F80 HydrophobicContact SD-CG 4.25Å; M53-Q81 PolarHBondContact N-O 3.25Å; M53-E82 HydrophobicContact CB-CG 4.02Å; M53-E82 HydrophobicContact CG-CG 4.12Å; M53-E82 WeakPolarHBondContact O-CA 3.43Å; M53-E82 HydrophobicContact SD-CG 3.88Å; M53-H83 PolarHBondContact O-N 2.93Å; M53-I111 WeakPolarHBondContact CA-O 3.09Å; M53-I111 HydrophobicContact CB-CG2 4.08Å; M53-I111 HydrophobicContact CE-CG2 3.83Å; M53-I111 HydrophobicContact CG-CG2 4.07Å
54	L	96	Very high	86.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	98.9	173.6	-175	59.6	0	0	0	109.3	G56 H83 L85 V100 M104 I111 I112 G113 I115	L54-G56 PolarHBondContact O-N 2.83Å; L54-G56 VanDerWaalsContact O-N 3.16Å; L54-H83 HydrophobicContact CD1-CB 4.45Å; L54-H83 WeakPolarHBondContact CD1-O 3.32Å; L54-L85 HydrophobicContact CD1-CB 3.78Å; L54-L85 HydrophobicContact CD2-CB 4.28Å; L54-V100 HydrophobicContact CD2-CG1 4.28Å; L54-M104 HydrophobicContact CB-CE 4.5Å; L54-M104 HydrophobicContact CD2-CE 4.44Å; L54-I111 PolarHBondContact N-O 2.9Å; L54-I112 HydrophobicContact CB-CB 4.21Å; L54-I112 HydrophobicContact CB-CG2 3.85Å; L54-I112 HydrophobicContact CD2-CG2 4.42Å; L54-I112 CarbonylContact O-C 3.52Å; L54-I112 WeakPolarHBondContact O-CA 3.45Å; L54-G113 PolarHBondContact O-N 3.21Å; L54-I115 HydrophobicContact CD2-CD1 3.84Å; L54-I115 HydrophobicContact CD2-CG1 4.28Å
55	P	94.1	Very high	88.6	Confident	4 Å²	4	39 Å²	39	3%	0.026	23%	0.231	C	C	.	.			trans	-61.5	-26.9	-175.1	-25.9	36.2	0	0	0	114.9	M53 G60 P61 M64 H83 G113	M53-P55 HydrophobicContact CG-CG 4.4Å; P55-G60 CarbonylContact O-C 3.3Å; P55-G60 VanDerWaalsContact O-C 3.3Å; P55-G60 WeakPolarHBondContact O-CA 3.29Å; P55-P61 HydrophobicContact CB-CB 4.42Å; P55-P61 HydrophobicContact CB-CG 4.17Å; P55-M64 HydrophobicContact CB-CB 4.38Å; P55-M64 HydrophobicContact CB-CG 4.05Å; P55-M64 HydrophobicContact CG-CG 4.4Å; P55-H83 WeakPolarHBondContact CD-O 3.44Å; P55-G113 WeakPolarHBondContact O-CA 3.4Å
56	G	91.3	Very high	90.6	Very high	13 Å²	13	35.8 Å²	35.8	13%	0.134	22%	0.215	C	C	.	.			trans	68.4	-155.1	-178.6	0	0	0	0	0	112.8	L54	L54-G56 PolarHBondContact O-N 2.83Å; L54-G56 VanDerWaalsContact O-N 3.16Å
57	D	90	Very high	92.7	Very high	9 Å²	9	26.3 Å²	26.3	5%	0.048	17%	0.17	C	C	.	.	S	Bend	trans	-106.2	173	-173.9	-65.7	-57.3	0	0	0	112.5	V59 G60 S86 K114 H116	D57-V59 PolarHBondContact O-N 3.3Å; D57-G60 PolarHBondContact O-N 3.15Å; D57-G60 VanDerWaalsContact O-N 3.12Å; D57-S86 WeakPolarHBondContact OD1-CB 3.44Å; D57-S86 PolarHBondContact OD1-OG 2.92Å; D57-K114 WeakPolarHBondContact CB-O 3.44Å; D57-K114 PolarHBondContact N-O 3.09Å; D57-H116 HydrophobicContact CB-CB 3.89Å; D57-H116 PolarHBondContact OD2-N 3.38Å
58	G	89.3	Confident	93.9	Very high	22 Å²	22	25.8 Å²	25.8	23%	0.227	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	-129.7	175.4	0	0	0	0	0	111.5	G60 P61 P310 V315	G58-G60 PolarHBondContact O-N 2.63Å; G58-P61 WeakPolarHBondContact O-CD 3.41Å; G58-P310 VanDerWaalsContact CA-O 3.3Å; G58-P310 WeakPolarHBondContact CA-O 3.37Å; G58-V315 WeakPolarHBondContact O-CG2 3.29Å
59	V	89.4	Confident	94.5	Very high	9 Å²	9	28.9 Å²	28.9	6%	0.055	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.2	178.4	-59.7	0	0	0	0	113.1	D57 E62 L63 P310 F311 A314 V315 A320	D57-V59 PolarHBondContact O-N 3.3Å; V59-E62 HydrophobicContact CB-CG 3.89Å; V59-E62 WeakPolarHBondContact CB-OE1 3.43Å; V59-E62 WeakPolarHBondContact CG1-OE1 3.29Å; V59-E62 WeakPolarHBondContact O-CG 3.3Å; V59-E62 PolarHBondContact O-N 2.96Å; V59-E62 VanDerWaalsContact O-N 3.16Å; V59-L63 HydrophobicContact CG2-CD1 4.02Å; V59-L63 HydrophobicContact CG2-CG 4.27Å; V59-L63 WeakPolarHBondContact O-CG 3.35Å; V59-L63 PolarHBondContact O-N 3.46Å; V59-L63 VanDerWaalsContact O-N 3.07Å; V59-P310 PolarHBondContact N-O 3.23Å; V59-F311 HydrophobicContact CG1-CB 4.16Å; V59-F311 HydrophobicContact CG1-CD1 4.12Å; V59-F311 HydrophobicContact CG1-CG 4.49Å; V59-F311 WeakPolarHBondContact CG1-O 3.42Å; V59-F311 HydrophobicContact CG2-CB 4.02Å; V59-A314 HydrophobicContact CG1-CB 3.82Å; V59-V315 HydrophobicContact CG1-CG2 4.45Å; V59-A320 HydrophobicContact CB-CB 3.79Å; V59-A320 HydrophobicContact CG1-CB 3.9Å; V59-A320 HydrophobicContact CG2-CB 4.02Å
60	G	92.1	Very high	94.7	Very high	5 Å²	5	27.4 Å²	27.4	5%	0.052	16%	0.157	C	C	.	.	H	α-helix	trans	-49.9	-48.8	-178.6	0	0	0	0	0	114.8	P55 D57 G58 E62 L63 M64	P55-G60 CarbonylContact O-C 3.3Å; P55-G60 VanDerWaalsContact O-C 3.3Å; P55-G60 WeakPolarHBondContact O-CA 3.29Å; D57-G60 PolarHBondContact O-N 3.15Å; D57-G60 VanDerWaalsContact O-N 3.12Å; G58-G60 PolarHBondContact O-N 2.63Å; G60-E62 PolarHBondContact O-N 2.87Å; G60-L63 PolarHBondContact O-N 3.26Å; G60-M64 WeakPolarHBondContact O-CG 3.38Å; G60-M64 PolarHBondContact O-N 3.09Å
61	P	93.2	Very high	94.8	Very high	66 Å²	66	25.5 Å²	25.5	43%	0.429	14%	0.144	S	C	.	.	H	α-helix	trans	-58.6	-41.7	176.5	-27.8	36.6	0	0	0	115.2	P55 G58 H65	P55-P61 HydrophobicContact CB-CB 4.42Å; P55-P61 HydrophobicContact CB-CG 4.17Å; G58-P61 WeakPolarHBondContact O-CD 3.41Å; P61-H65 WeakPolarHBondContact O-CB 3.34Å; P61-H65 PolarHBondContact O-N 2.91Å
62	E	92.5	Very high	94.7	Very high	45 Å²	45	33.2 Å²	33.2	21%	0.21	18%	0.178	C	C	.	.	H	α-helix	trans	-69	-37.3	177.3	56.5	177.5	-147.2	0	0	111.6	V59 G60 H65 A66 A320	V59-E62 HydrophobicContact CB-CG 3.89Å; V59-E62 WeakPolarHBondContact CB-OE1 3.43Å; V59-E62 WeakPolarHBondContact CG1-OE1 3.29Å; V59-E62 WeakPolarHBondContact O-CG 3.3Å; V59-E62 PolarHBondContact O-N 2.96Å; V59-E62 VanDerWaalsContact O-N 3.16Å; G60-E62 PolarHBondContact O-N 2.87Å; E62-H65 PolarHBondContact O-N 3.33Å; E62-A66 PolarHBondContact O-N 2.95Å; E62-A320 WeakPolarHBondContact OE1-CB 3.29Å
63	L	93.9	Very high	94.7	Very high	17 Å²	17	37.5 Å²	37.5	9%	0.089	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-45.1	175.8	-62.3	-170.4	0	0	0	111.9	V59 G60 H65 A66 V67 A320 P322 M325	V59-L63 HydrophobicContact CG2-CD1 4.02Å; V59-L63 HydrophobicContact CG2-CG 4.27Å; V59-L63 WeakPolarHBondContact O-CG 3.35Å; V59-L63 PolarHBondContact O-N 3.46Å; V59-L63 VanDerWaalsContact O-N 3.07Å; G60-L63 PolarHBondContact O-N 3.26Å; L63-H65 VanDerWaalsContact C-N 3.33Å; L63-H65 PolarHBondContact O-N 3.35Å; L63-A66 WeakPolarHBondContact O-CB 3.35Å; L63-A66 PolarHBondContact O-N 3.3Å; L63-V67 WeakPolarHBondContact O-CG2 3.5Å; L63-V67 PolarHBondContact O-N 3.37Å; L63-A320 HydrophobicContact CD2-CB 3.77Å; L63-P322 HydrophobicContact CD2-CB 4.01Å; L63-M325 HydrophobicContact CB-CB 4.28Å; L63-M325 HydrophobicContact CB-CG 4.34Å; L63-M325 HydrophobicContact CD1-CB 4.44Å
64	M	95.7	Very high	94.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-36.9	176.8	-70.5	-49.2	178.9	0	0	112.3	M53 P55 G60 A66 V67 K68 I111 M325	M53-M64 HydrophobicContact CE-CB 4.32Å; M53-M64 HydrophobicContact CE-SD 4.04Å; M53-M64 HydrophobicContact CG-CG 4.27Å; M53-M64 HydrophobicContact CG-SD 4.33Å; M53-M64 HydrophobicContact SD-CB 3.87Å; M53-M64 HydrophobicContact SD-CG 4.18Å; M53-M64 HydrophobicContact SD-SD 4.4Å; P55-M64 HydrophobicContact CB-CB 4.38Å; P55-M64 HydrophobicContact CB-CG 4.05Å; P55-M64 HydrophobicContact CG-CG 4.4Å; G60-M64 WeakPolarHBondContact O-CG 3.38Å; G60-M64 PolarHBondContact O-N 3.09Å; M64-A66 VanDerWaalsContact C-N 3.31Å; M64-A66 PolarHBondContact O-N 3.41Å; M64-V67 WeakPolarHBondContact O-CB 3.25Å; M64-V67 PolarHBondContact O-N 2.91Å; M64-K68 WeakPolarHBondContact O-CG 3.41Å; M64-K68 PolarHBondContact O-N 3.44Å; M64-I111 HydrophobicContact CE-CG1 4.03Å; M64-I111 HydrophobicContact SD-CD1 4.32Å; M64-I111 HydrophobicContact SD-CG1 4.3Å; M64-I111 HydrophobicContact SD-CG2 4.36Å; M64-M325 HydrophobicContact CE-CE 3.51Å; M64-M325 HydrophobicContact CE-SD 3.69Å; M64-M325 HydrophobicContact SD-CE 4.28Å; M64-M325 HydrophobicContact SD-CG 4.13Å; M64-M325 HydrophobicContact SD-SD 4Å
65	H	96	Very high	94.5	Very high	105 Å²	105	42.2 Å²	42.2	49%	0.486	25%	0.253	S	S	.	.	H	α-helix	trans	-59.3	-44	172.1	-176.3	-82.3	0	0	0	111.4	P61 E62 L63 V67 K68 E69	P61-H65 WeakPolarHBondContact O-CB 3.34Å; P61-H65 PolarHBondContact O-N 2.91Å; E62-H65 PolarHBondContact O-N 3.33Å; L63-H65 VanDerWaalsContact C-N 3.33Å; L63-H65 PolarHBondContact O-N 3.35Å; H65-V67 VanDerWaalsContact C-N 3.32Å; H65-V67 PolarHBondContact O-N 3.39Å; H65-K68 PolarHBondContact O-N 2.88Å; H65-E69 PolarHBondContact O-N 3.13Å
66	A	95.8	Very high	94.6	Very high	29 Å²	29	42.8 Å²	42.8	24%	0.24	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-39.1	174.8	0	0	0	0	0	112.4	E62 L63 M64 E69 V70 P322	E62-A66 PolarHBondContact O-N 2.95Å; L63-A66 WeakPolarHBondContact O-CB 3.35Å; L63-A66 PolarHBondContact O-N 3.3Å; M64-A66 VanDerWaalsContact C-N 3.31Å; M64-A66 PolarHBondContact O-N 3.41Å; A66-E69 PolarHBondContact O-N 2.95Å; A66-V70 WeakPolarHBondContact O-CG2 3.39Å; A66-V70 PolarHBondContact O-N 3.04Å; A66-V70 VanDerWaalsContact O-N 3.08Å; A66-P322 HydrophobicContact CB-CB 4.14Å
67	V	97.5	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-48.3	173.4	178.3	0	0	0	0	111.1	L63 M64 H65 E69 V70 F71 F80 M325 L326 A329	L63-V67 WeakPolarHBondContact O-CG2 3.5Å; L63-V67 PolarHBondContact O-N 3.37Å; M64-V67 WeakPolarHBondContact O-CB 3.25Å; M64-V67 PolarHBondContact O-N 2.91Å; H65-V67 VanDerWaalsContact C-N 3.32Å; H65-V67 PolarHBondContact O-N 3.39Å; V67-E69 PolarHBondContact O-N 3.41Å; V67-V70 PolarHBondContact O-N 3.05Å; V67-F71 HydrophobicContact CG1-CD2 3.75Å; V67-F71 HydrophobicContact CG1-CE2 3.68Å; V67-F71 HydrophobicContact CG1-CG 4.35Å; V67-F71 HydrophobicContact CG1-CZ 4.2Å; V67-F71 WeakPolarHBondContact O-CB 3.38Å; V67-F71 VanDerWaalsContact O-CD2 3.25Å; V67-F71 WeakPolarHBondContact O-CD2 3.13Å; V67-F71 PolarHBondContact O-N 3.35Å; V67-F80 HydrophobicContact CG1-CE2 4.45Å; V67-F80 HydrophobicContact CG1-CZ 4.15Å; V67-M325 HydrophobicContact CG2-CB 4.41Å; V67-M325 HydrophobicContact CG2-CG 3.64Å; V67-L326 HydrophobicContact CG2-CD2 4.09Å; V67-A329 HydrophobicContact CG1-CB 3.83Å; V67-A329 HydrophobicContact CG2-CB 4.43Å
68	K	97.3	Very high	95.2	Very high	55 Å²	55	44.6 Å²	44.6	24%	0.239	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-44.4	179.6	-69.4	-174.7	-60.2	-170.7	0	112.2	M53 M64 H65 F71 K72 F80 E82	M53-K68 HydrophobicContact CE-CD 4.47Å; M53-K68 HydrophobicContact CE-CG 4.02Å; M53-K68 HydrophobicContact SD-CD 4.01Å; M53-K68 HydrophobicContact SD-CG 4.2Å; M64-K68 WeakPolarHBondContact O-CG 3.41Å; M64-K68 PolarHBondContact O-N 3.44Å; H65-K68 PolarHBondContact O-N 2.88Å; K68-F71 PolarHBondContact O-N 3.49Å; K68-K72 WeakPolarHBondContact O-CB 3.32Å; K68-K72 PolarHBondContact O-N 3.02Å; K68-F80 HydrophobicContact CG-CD2 3.9Å; K68-F80 HydrophobicContact CG-CE2 4.2Å; K68-E82 VanDerWaalsContact CD-OE1 3.27Å; K68-E82 WeakPolarHBondContact CD-OE1 3.26Å; K68-E82 IonicContact NZ-OE1 2.61Å; K68-E82 PolarHBondContact NZ-OE1 3.29Å; K68-E82 IonicContact NZ-OE2 2.81Å; K68-E82 PolarHBondContact NZ-OE2 3.3Å
69	E	97.4	Very high	95.5	Very high	99 Å²	99	46 Å²	46	46%	0.463	27%	0.266	S	S	.	.	H	α-helix	trans	-63.3	-43.1	178	-74.2	-65	104.7	0	0	112.1	H65 A66 V67 K72 A73	H65-E69 PolarHBondContact O-N 3.13Å; A66-E69 PolarHBondContact O-N 2.95Å; V67-E69 PolarHBondContact O-N 3.41Å; E69-K72 PolarHBondContact O-N 3.49Å; E69-A73 WeakPolarHBondContact O-CB 3.1Å; E69-A73 PolarHBondContact O-N 2.84Å
70	V	97.3	Very high	95.9	Very high	50 Å²	50	47.3 Å²	47.3	30%	0.303	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-42.2	175.8	171.8	0	0	0	0	111.2	A66 V67 A73 A74 L326 I345	A66-V70 WeakPolarHBondContact O-CG2 3.39Å; A66-V70 PolarHBondContact O-N 3.04Å; A66-V70 VanDerWaalsContact O-N 3.08Å; V67-V70 PolarHBondContact O-N 3.05Å; V70-A73 PolarHBondContact O-N 3.35Å; V70-A74 VanDerWaalsContact O-CB 3.29Å; V70-A74 WeakPolarHBondContact O-CB 3.31Å; V70-A74 PolarHBondContact O-N 3.45Å; V70-L326 HydrophobicContact CB-CD2 4.03Å; V70-L326 HydrophobicContact CG1-CD2 4.21Å; V70-L326 HydrophobicContact CG2-CD2 3.9Å; V70-I345 HydrophobicContact CG1-CD1 4.14Å; V70-I345 HydrophobicContact CG1-CG1 4.11Å; V70-I345 HydrophobicContact CG1-CG2 4.09Å
71	F	97.3	Very high	96.1	Very high	6 Å²	6	48.6 Å²	48.6	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-41.5	179.5	-88.2	-135	0	0	0	111.8	V67 K68 A74 A75 V76 V78 F80 A329 M332 L333 I345	V67-F71 HydrophobicContact CG1-CD2 3.75Å; V67-F71 HydrophobicContact CG1-CE2 3.68Å; V67-F71 HydrophobicContact CG1-CG 4.35Å; V67-F71 HydrophobicContact CG1-CZ 4.2Å; V67-F71 WeakPolarHBondContact O-CB 3.38Å; V67-F71 VanDerWaalsContact O-CD2 3.25Å; V67-F71 WeakPolarHBondContact O-CD2 3.13Å; V67-F71 PolarHBondContact O-N 3.35Å; K68-F71 PolarHBondContact O-N 3.49Å; F71-A74 CarbonylContact O-C 3.57Å; F71-A74 PolarHBondContact O-N 3.29Å; F71-A75 PolarHBondContact O-N 3.09Å; F71-A75 VanDerWaalsContact O-N 3.09Å; F71-V76 HydrophobicContact CB-CB 4.17Å; F71-V76 HydrophobicContact CB-CG2 4.21Å; F71-V76 HydrophobicContact CD1-CB 3.83Å; F71-V76 HydrophobicContact CD1-CG1 3.66Å; F71-V76 HydrophobicContact CD1-CG2 4.16Å; F71-V76 HydrophobicContact CD2-CG2 4.42Å; F71-V76 HydrophobicContact CE1-CB 4.44Å; F71-V76 HydrophobicContact CE1-CG1 3.82Å; F71-V76 HydrophobicContact CG-CB 4.08Å; F71-V76 HydrophobicContact CG-CG1 4.35Å; F71-V76 HydrophobicContact CG-CG2 4.02Å; F71-V76 PolarHBondContact O-N 3.03Å; F71-V78 HydrophobicContact CD1-CB 4.13Å; F71-V78 HydrophobicContact CD1-CG1 4.36Å; F71-V78 HydrophobicContact CE1-CB 4.18Å; F71-V78 HydrophobicContact CE1-CG1 4.26Å; F71-V78 HydrophobicContact CE1-CG2 4.31Å; F71-F80 HydrophobicContact CB-CE2 4.41Å; F71-F80 AromaticContact CD1-CE2 3.63Å; F71-F80 HydrophobicContact CD1-CE2 3.63Å; F71-F80 AromaticContact CD1-CZ 3.58Å; F71-F80 HydrophobicContact CD1-CZ 3.58Å; F71-F80 HydrophobicContact CE1-CE2 4.13Å; F71-F80 AromaticContact CE1-CZ 3.57Å; F71-F80 HydrophobicContact CE1-CZ 3.57Å; F71-F80 HydrophobicContact CG-CE2 4.11Å; F71-F80 HydrophobicContact CG-CZ 4.31Å; F71-F80 HydrophobicContact CZ-CZ 4.3Å; F71-A329 HydrophobicContact CE2-CB 3.78Å; F71-A329 HydrophobicContact CZ-CB 3.81Å; F71-M332 HydrophobicContact CE1-CE 3.83Å; F71-M332 HydrophobicContact CZ-CE 3.99Å; F71-L333 HydrophobicContact CE1-CD1 4.22Å; F71-L333 HydrophobicContact CE1-CD2 3.85Å; F71-L333 HydrophobicContact CE1-CG 4.2Å; F71-L333 HydrophobicContact CE2-CD1 4.18Å; F71-L333 HydrophobicContact CZ-CD1 3.68Å; F71-L333 HydrophobicContact CZ-CD2 4.02Å; F71-L333 HydrophobicContact CZ-CG 3.84Å; F71-I345 HydrophobicContact CD2-CD1 3.9Å; F71-I345 HydrophobicContact CE2-CD1 3.71Å
72	K	96.7	Very high	96.3	Very high	162 Å²	162	49.3 Å²	49.3	70%	0.704	27%	0.273	S	S	*	.	H	α-helix	trans	-62.6	-46.6	174.2	-176.4	179.6	178.8	-177.4	0	111.5	K68 E69 A74 A75	K68-K72 WeakPolarHBondContact O-CB 3.32Å; K68-K72 PolarHBondContact O-N 3.02Å; E69-K72 PolarHBondContact O-N 3.49Å; K72-A74 VanDerWaalsContact C-N 3.3Å; K72-A74 PolarHBondContact O-N 3.09Å; K72-A75 PolarHBondContact O-N 2.75Å
73	A	97.2	Very high	96.3	Very high	90 Å²	90	49.5 Å²	49.5	74%	0.744	27%	0.274	S	S	*	.	H	α-helix	trans	-64.9	-33.9	178.7	0	0	0	0	0	112.9	E69 V70 A75	E69-A73 WeakPolarHBondContact O-CB 3.1Å; E69-A73 PolarHBondContact O-N 2.84Å; V70-A73 PolarHBondContact O-N 3.35Å; A73-A75 VanDerWaalsContact C-N 3.31Å
74	A	95.7	Very high	96.1	Very high	21 Å²	21	54.6 Å²	54.6	17%	0.174	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	5.8	178	0	0	0	0	0	113.9	V70 F71 K72 V76 H341 M344 I345	V70-A74 VanDerWaalsContact O-CB 3.29Å; V70-A74 WeakPolarHBondContact O-CB 3.31Å; V70-A74 PolarHBondContact O-N 3.45Å; F71-A74 CarbonylContact O-C 3.57Å; F71-A74 PolarHBondContact O-N 3.29Å; K72-A74 VanDerWaalsContact C-N 3.3Å; K72-A74 PolarHBondContact O-N 3.09Å; A74-V76 HydrophobicContact CB-CG2 3.94Å; A74-V76 PolarHBondContact O-N 3.5Å; A74-H341 PolarHBondContact O-ND1 2.9Å; A74-M344 HydrophobicContact CB-SD 4.18Å; A74-I345 HydrophobicContact CB-CG1 4.45Å
75	A	95.6	Very high	95.7	Very high	79 Å²	79	54.7 Å²	54.7	65%	0.653	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	46.1	-178.2	0	0	0	0	0	112.9	F71 K72 A73 H341	F71-A75 PolarHBondContact O-N 3.09Å; F71-A75 VanDerWaalsContact O-N 3.09Å; K72-A75 PolarHBondContact O-N 2.75Å; A73-A75 VanDerWaalsContact C-N 3.31Å; A75-H341 PolarHBondContact O-CE1 3.25Å
76	V	96.5	Very high	95	Very high	16 Å²	16	49.9 Å²	49.9	10%	0.097	28%	0.276	C	S	.	.			trans	-72.7	131.5	-179.7	-178.7	0	0	0	0	109.4	F71 A74 V78 L333 H341 I345	F71-V76 HydrophobicContact CB-CB 4.17Å; F71-V76 HydrophobicContact CB-CG2 4.21Å; F71-V76 HydrophobicContact CD1-CB 3.83Å; F71-V76 HydrophobicContact CD1-CG1 3.66Å; F71-V76 HydrophobicContact CD1-CG2 4.16Å; F71-V76 HydrophobicContact CD2-CG2 4.42Å; F71-V76 HydrophobicContact CE1-CB 4.44Å; F71-V76 HydrophobicContact CE1-CG1 3.82Å; F71-V76 HydrophobicContact CG-CB 4.08Å; F71-V76 HydrophobicContact CG-CG1 4.35Å; F71-V76 HydrophobicContact CG-CG2 4.02Å; F71-V76 PolarHBondContact O-N 3.03Å; A74-V76 HydrophobicContact CB-CG2 3.94Å; A74-V76 PolarHBondContact O-N 3.5Å; V76-V78 HydrophobicContact CG1-CB 4.01Å; V76-V78 HydrophobicContact CG1-CG2 3.76Å; V76-V78 PolarHBondContact O-N 3.41Å; V76-L333 HydrophobicContact CG1-CD1 4.2Å; V76-L333 HydrophobicContact CG1-CD2 3.51Å; V76-L333 HydrophobicContact CG2-CD1 4.5Å; V76-H341 HydrophobicContact CG2-CB 4.2Å; V76-I345 HydrophobicContact CG2-CD1 4.05Å
77	P	95.9	Very high	94.1	Very high	41 Å²	41	49.8 Å²	49.8	27%	0.266	27%	0.27	S	S	.	.			trans	-79.1	56	179.5	34.5	-37.4	0	0	0	111.4	F49 L338 H341	F49-P77 WeakPolarHBondContact CD2-O 3.33Å; F49-P77 PolarHBondContact N-O 3.43Å; P77-L338 HydrophobicContact CG-CD1 4Å; P77-L338 HydrophobicContact CG-CD2 3.99Å; P77-H341 WeakPolarHBondContact CD-NE2 3.46Å
78	V	96.4	Very high	92.9	Very high	18 Å²	18	53.6 Å²	53.6	11%	0.109	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.7	178.4	167.2	0	0	0	0	109.1	F49 V51 F71 V76 F80 M332 L333 L336 L338	F49-V78 HydrophobicContact CB-CG2 4.3Å; F49-V78 WeakPolarHBondContact O-CA 3.42Å; V51-V78 HydrophobicContact CB-CG1 4.02Å; V51-V78 HydrophobicContact CG2-CG1 3.75Å; F71-V78 HydrophobicContact CD1-CB 4.13Å; F71-V78 HydrophobicContact CD1-CG1 4.36Å; F71-V78 HydrophobicContact CE1-CB 4.18Å; F71-V78 HydrophobicContact CE1-CG1 4.26Å; F71-V78 HydrophobicContact CE1-CG2 4.31Å; V76-V78 HydrophobicContact CG1-CB 4.01Å; V76-V78 HydrophobicContact CG1-CG2 3.76Å; V76-V78 PolarHBondContact O-N 3.41Å; V78-F80 HydrophobicContact CG1-CD1 4.02Å; V78-F80 HydrophobicContact CG1-CD2 4.48Å; V78-F80 HydrophobicContact CG1-CE1 3.72Å; V78-F80 HydrophobicContact CG1-CE2 4.21Å; V78-F80 HydrophobicContact CG1-CG 4.42Å; V78-F80 HydrophobicContact CG1-CZ 3.83Å; V78-M332 HydrophobicContact CG1-CE 4.47Å; V78-L333 HydrophobicContact CG2-CD2 3.79Å; V78-L336 HydrophobicContact CG2-CD1 4.13Å; V78-L338 HydrophobicContact CG2-CD1 4.18Å
79	E	96.3	Very high	91.4	Very high	53 Å²	53	57.3 Å²	57.3	25%	0.248	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.8	174.4	-180	168.7	-161.9	0	0	109.3	S48 F49 P50 V51	S48-E79 WeakPolarHBondContact OG-CB 3.36Å; S48-E79 PolarHBondContact OG-N 3.43Å; F49-E79 PolarHBondContact O-N 2.83Å; P50-E79 WeakPolarHBondContact CA-O 3.46Å; V51-E79 PolarHBondContact N-O 3.09Å
80	F	97.5	Very high	89.8	Confident	35 Å²	35	59.2 Å²	59.2	15%	0.154	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.5	-179.5	-68.9	-62	0	0	0	111	V51 M53 V67 K68 F71 V78 E82 I111 M332	V51-F80 HydrophobicContact CB-CD1 3.99Å; V51-F80 HydrophobicContact CB-CE1 4.17Å; V51-F80 HydrophobicContact CG1-CD1 3.98Å; V51-F80 HydrophobicContact CG1-CE1 3.93Å; V51-F80 WeakPolarHBondContact O-CA 3.34Å; M53-F80 HydrophobicContact CB-CB 4.07Å; M53-F80 HydrophobicContact CB-CD1 4Å; M53-F80 HydrophobicContact CB-CG 4.31Å; M53-F80 HydrophobicContact CE-CB 4.27Å; M53-F80 HydrophobicContact CE-CD1 3.53Å; M53-F80 HydrophobicContact CE-CD2 3.7Å; M53-F80 HydrophobicContact CE-CE1 3.6Å; M53-F80 HydrophobicContact CE-CE2 3.76Å; M53-F80 HydrophobicContact CE-CG 3.56Å; M53-F80 HydrophobicContact CE-CZ 3.71Å; M53-F80 HydrophobicContact SD-CB 4.32Å; M53-F80 HydrophobicContact SD-CD1 4.49Å; M53-F80 HydrophobicContact SD-CG 4.25Å; V67-F80 HydrophobicContact CG1-CE2 4.45Å; V67-F80 HydrophobicContact CG1-CZ 4.15Å; K68-F80 HydrophobicContact CG-CD2 3.9Å; K68-F80 HydrophobicContact CG-CE2 4.2Å; F71-F80 HydrophobicContact CB-CE2 4.41Å; F71-F80 AromaticContact CD1-CE2 3.63Å; F71-F80 HydrophobicContact CD1-CE2 3.63Å; F71-F80 AromaticContact CD1-CZ 3.58Å; F71-F80 HydrophobicContact CD1-CZ 3.58Å; F71-F80 HydrophobicContact CE1-CE2 4.13Å; F71-F80 AromaticContact CE1-CZ 3.57Å; F71-F80 HydrophobicContact CE1-CZ 3.57Å; F71-F80 HydrophobicContact CG-CE2 4.11Å; F71-F80 HydrophobicContact CG-CZ 4.31Å; F71-F80 HydrophobicContact CZ-CZ 4.3Å; V78-F80 HydrophobicContact CG1-CD1 4.02Å; V78-F80 HydrophobicContact CG1-CD2 4.48Å; V78-F80 HydrophobicContact CG1-CE1 3.72Å; V78-F80 HydrophobicContact CG1-CE2 4.21Å; V78-F80 HydrophobicContact CG1-CG 4.42Å; V78-F80 HydrophobicContact CG1-CZ 3.83Å; F80-E82 PolarHBondContact O-N 2.93Å; F80-I111 HydrophobicContact CD1-CG2 4.33Å; F80-I111 HydrophobicContact CE1-CG2 3.9Å; F80-M332 HydrophobicContact CE1-CE 4.05Å; F80-M332 HydrophobicContact CZ-CE 4.27Å
81	Q	96.9	Very high	88.2	Confident	32 Å²	32	61.1 Å²	61.1	15%	0.15	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	98.2	167.1	-70.5	-177.9	-11.4	0	0	108.6	D42 V51 M53 H83 N107	D42-Q81 PolarHBondContact OD2-NE2 2.79Å; D42-Q81 VanDerWaalsContact OD2-NE2 3.13Å; V51-Q81 PolarHBondContact O-N 3.32Å; M53-Q81 PolarHBondContact N-O 3.25Å; Q81-H83 PolarHBondContact O-CD2 3.1Å; Q81-N107 PolarHBondContact OE1-ND2 3.36Å
82	E	96.3	Very high	86.7	Confident	82 Å²	82	61.9 Å²	61.9	38%	0.383	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.8	-176.5	-71.7	-178.5	-117.6	0	0	111.8	M53 K68 F80	M53-E82 HydrophobicContact CB-CG 4.02Å; M53-E82 HydrophobicContact CG-CG 4.12Å; M53-E82 WeakPolarHBondContact O-CA 3.43Å; M53-E82 HydrophobicContact SD-CG 3.88Å; K68-E82 VanDerWaalsContact CD-OE1 3.27Å; K68-E82 WeakPolarHBondContact CD-OE1 3.26Å; K68-E82 IonicContact NZ-OE1 2.61Å; K68-E82 PolarHBondContact NZ-OE1 3.29Å; K68-E82 IonicContact NZ-OE2 2.81Å; K68-E82 PolarHBondContact NZ-OE2 3.3Å; F80-E82 PolarHBondContact O-N 2.93Å
83	H	94.1	Very high	86	Confident	48 Å²	48	56.2 Å²	56.2	22%	0.222	32%	0.32	C	S	.	.			trans	-123.4	157.5	171	-62.6	-93.6	0	0	0	110.3	M53 L54 P55 Q81 V100 S103	M53-H83 PolarHBondContact O-N 2.93Å; L54-H83 HydrophobicContact CD1-CB 4.45Å; L54-H83 WeakPolarHBondContact CD1-O 3.32Å; P55-H83 WeakPolarHBondContact CD-O 3.44Å; Q81-H83 PolarHBondContact O-CD2 3.1Å; H83-V100 HydrophobicContact CB-CG2 3.75Å; H83-S103 WeakPolarHBondContact NE2-CB 3.42Å; H83-S103 PolarHBondContact NE2-OG 3.39Å
84	H	89.1	Confident	85.3	Confident	124 Å²	124	55.5 Å²	55.5	57%	0.574	30%	0.301	S	S	*	.			trans	-121.3	125.8	178.4	-64.2	-62.9	0	0	0	111.3
85	L	86.3	Confident	84.9	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	32%	0.323	C	S	.	.			trans	-141	121.6	175	-170.4	64	0	0	0	108.3	L54 A92 K96 L97 V100 I115 Y128	L54-L85 HydrophobicContact CD1-CB 3.78Å; L54-L85 HydrophobicContact CD2-CB 4.28Å; L85-A92 HydrophobicContact CD1-CB 3.89Å; L85-K96 HydrophobicContact CD1-CB 4.25Å; L85-L97 HydrophobicContact CD2-CD1 4.01Å; L85-V100 HydrophobicContact CB-CG2 4.49Å; L85-I115 HydrophobicContact CD2-CD1 3.96Å; L85-I115 HydrophobicContact CG-CD1 4.42Å; L85-Y128 HydrophobicContact CD1-CD1 4.15Å; L85-Y128 HydrophobicContact CD2-CD1 4.35Å
86	S	82.9	Confident	84.6	Confident	4 Å²	4	60.1 Å²	60.1	3%	0.028	31%	0.305	C	S	.	.			trans	-148	128.5	-176.8	173.3	0	0	0	0	110.3	D57 V88 Q89 M91 A92	D57-S86 WeakPolarHBondContact OD1-CB 3.44Å; D57-S86 PolarHBondContact OD1-OG 2.92Å; S86-V88 PolarHBondContact OG-N 2.9Å; S86-Q89 PolarHBondContact OG-N 2.88Å; S86-Q89 VanDerWaalsContact OG-N 3.12Å; S86-M91 PolarHBondContact O-N 2.82Å; S86-A92 WeakPolarHBondContact O-CB 3.35Å; S86-A92 PolarHBondContact O-N 3.29Å
87	E	75.9	Confident	84.3	Confident	26 Å²	26	59.3 Å²	59.3	12%	0.121	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-21.8	173.7	-60.2	-175.8	-159.8	0	0	112.7	I115 H116 P118 S127 Y128	E87-I115 HydrophobicContact CG-CG2 4.15Å; E87-H116 WeakPolarHBondContact CB-O 3.37Å; E87-P118 HydrophobicContact CB-CG 4.47Å; E87-P118 WeakPolarHBondContact OE2-CD 3.39Å; E87-S127 WeakPolarHBondContact OE1-CB 3.48Å; E87-Y128 HydrophobicContact CG-CD2 3.45Å; E87-Y128 VanDerWaalsContact CG-CD2 3.45Å; E87-Y128 HydrophobicContact CG-CE2 4.17Å; E87-Y128 HydrophobicContact CG-CG 4.21Å; E87-Y128 WeakPolarHBondContact OE1-CB 3.21Å; E87-Y128 WeakPolarHBondContact OE1-CD2 3.46Å; E87-Y128 PolarHBondContact OE1-N 3Å
88	V	72.3	Confident	84.2	Confident	81 Å²	81	60.8 Å²	60.8	49%	0.491	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-37.5	-175.3	-177.9	0	0	0	0	111.2	S86 N90 H116	S86-V88 PolarHBondContact OG-N 2.9Å; V88-N90 PolarHBondContact O-N 3.37Å; V88-H116 HydrophobicContact CG2-CB 3.71Å; V88-H116 WeakPolarHBondContact CG2-CD2 3.31Å
89	Q	65.4	Low	84.1	Confident	132 Å²	132	64.6 Å²	64.6	62%	0.617	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	9.3	-178.8	-62.5	180	-16.7	0	0	112.8	S86 M91	S86-Q89 PolarHBondContact OG-N 2.88Å; S86-Q89 VanDerWaalsContact OG-N 3.12Å; Q89-M91 HydrophobicContact CB-CB 4.35Å; Q89-M91 HydrophobicContact CB-CG 3.91Å; Q89-M91 HydrophobicContact CB-SD 4.44Å; Q89-M91 WeakPolarHBondContact O-CG 3.49Å; Q89-M91 PolarHBondContact O-N 3.1Å
90	N	63.8	Low	84	Confident	139 Å²	139	62.1 Å²	62.1	74%	0.743	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	26	-170	-73.4	-17.6	0	0	0	113	V88	V88-N90 PolarHBondContact O-N 3.37Å
91	M	63.8	Low	83.9	Confident	90 Å²	90	60.5 Å²	60.5	44%	0.443	30%	0.301	S	S	.	.			trans	-90.5	-14.5	179.9	-73.6	-163.8	129.2	0	0	111.6	S86 Q89 K96	S86-M91 PolarHBondContact O-N 2.82Å; Q89-M91 HydrophobicContact CB-CB 4.35Å; Q89-M91 HydrophobicContact CB-CG 3.91Å; Q89-M91 HydrophobicContact CB-SD 4.44Å; Q89-M91 WeakPolarHBondContact O-CG 3.49Å; Q89-M91 PolarHBondContact O-N 3.1Å; M91-K96 WeakPolarHBondContact O-CD 3.34Å; M91-K96 WeakPolarHBondContact O-CE 3.49Å; M91-K96 PolarHBondContact O-NZ 3.22Å
92	A	66.8	Low	83.9	Confident	23 Å²	23	62.1 Å²	62.1	19%	0.19	32%	0.316	C	S	.	.			trans	-72.6	130.6	177.2	0	0	0	0	0	111.6	L85 S86 Y128	L85-A92 HydrophobicContact CD1-CB 3.89Å; S86-A92 WeakPolarHBondContact O-CB 3.35Å; S86-A92 PolarHBondContact O-N 3.29Å; A92-Y128 HydrophobicContact CB-CD1 4.28Å; A92-Y128 HydrophobicContact CB-CD2 4.04Å; A92-Y128 HydrophobicContact CB-CE1 3.92Å; A92-Y128 HydrophobicContact CB-CE2 3.61Å; A92-Y128 HydrophobicContact CB-CG 4.33Å
93	S	80.9	Confident	83.9	Confident	42 Å²	42	58.6 Å²	58.6	29%	0.294	30%	0.301	S	S	.	.			trans	-138.4	160.9	169.4	67.8	0	0	0	0	108.5	E95 K96 L97	S93-E95 PolarHBondContact O-N 3.49Å; S93-K96 PolarHBondContact O-N 3.05Å; S93-K96 PolarHBondContact OG-N 2.98Å; S93-L97 PolarHBondContact O-N 2.84Å
94	E	84	Confident	84	Confident	75 Å²	75	56.4 Å²	56.4	35%	0.35	29%	0.291	S	S	.	.	H	α-helix	trans	-58.3	-39.1	175.2	-165.1	60.8	-164.7	0	0	111.9	K96 L97 E98 R131 K135	E94-K96 PolarHBondContact O-N 3.46Å; E94-L97 WeakPolarHBondContact O-CB 3.41Å; E94-L97 PolarHBondContact O-N 3.49Å; E94-E98 WeakPolarHBondContact O-CG 3.36Å; E94-E98 PolarHBondContact O-N 3.08Å; E94-R131 IonicContact OE1-NH2 2.84Å; E94-R131 PolarHBondContact OE1-NH2 3.31Å; E94-R131 IonicContact OE2-CZ 3.48Å; E94-R131 IonicContact OE2-NH1 2.79Å; E94-R131 PolarHBondContact OE2-NH1 2.91Å; E94-R131 IonicContact OE2-NH2 3.72Å; E94-R131 PolarHBondContact OE2-NH2 3.09Å; E94-K135 IonicContact OE1-NZ 3.79Å; E94-K135 PolarHBondContact OE1-NZ 2.65Å
95	E	87.3	Confident	84.4	Confident	135 Å²	135	54.9 Å²	54.9	63%	0.631	28%	0.283	S	S	*	.	H	α-helix	trans	-58.9	-45.7	177.3	-173.2	-175.8	175.2	0	0	111.9	S93 E98 Q99	S93-E95 PolarHBondContact O-N 3.49Å; E95-E98 PolarHBondContact O-N 2.96Å; E95-Q99 WeakPolarHBondContact O-CG 3.45Å; E95-Q99 PolarHBondContact O-N 3.02Å
96	K	88.1	Confident	84.9	Confident	62 Å²	62	60.3 Å²	60.3	27%	0.27	31%	0.308	S	S	.	.	H	α-helix	trans	-68.2	-37.1	177.5	-76.7	173.8	178.1	-176.7	0	112.5	L85 M91 S93 E94 E98 Q99 V100	L85-K96 HydrophobicContact CD1-CB 4.25Å; M91-K96 WeakPolarHBondContact O-CD 3.34Å; M91-K96 WeakPolarHBondContact O-CE 3.49Å; M91-K96 PolarHBondContact O-NZ 3.22Å; S93-K96 PolarHBondContact O-N 3.05Å; S93-K96 PolarHBondContact OG-N 2.98Å; E94-K96 PolarHBondContact O-N 3.46Å; K96-E98 VanDerWaalsContact C-N 3.31Å; K96-E98 PolarHBondContact O-N 3.07Å; K96-Q99 PolarHBondContact O-N 2.97Å; K96-V100 WeakPolarHBondContact O-CG2 3.3Å; K96-V100 PolarHBondContact O-N 3.09Å
97	L	90.6	Very high	85.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-44.8	173.1	176.4	61.4	0	0	0	110.6	L85 S93 E94 V100 L101 Y128 R131 L132	L85-L97 HydrophobicContact CD2-CD1 4.01Å; S93-L97 PolarHBondContact O-N 2.84Å; E94-L97 WeakPolarHBondContact O-CB 3.41Å; E94-L97 PolarHBondContact O-N 3.49Å; L97-V100 PolarHBondContact O-N 3.27Å; L97-L101 HydrophobicContact CD1-CD1 4.11Å; L97-L101 HydrophobicContact CD1-CG 4.31Å; L97-L101 HydrophobicContact CG-CD1 3.89Å; L97-L101 WeakPolarHBondContact O-CB 3.4Å; L97-L101 WeakPolarHBondContact O-CD1 3.3Å; L97-L101 VanDerWaalsContact O-CG 3.23Å; L97-L101 WeakPolarHBondContact O-CG 3.35Å; L97-L101 PolarHBondContact O-N 3.43Å; L97-Y128 HydrophobicContact CB-CD1 4.05Å; L97-Y128 HydrophobicContact CB-CE1 4.11Å; L97-Y128 HydrophobicContact CD1-CD1 4.3Å; L97-Y128 HydrophobicContact CD2-CD1 3.92Å; L97-Y128 HydrophobicContact CD2-CE1 4.23Å; L97-Y128 HydrophobicContact CG-CD1 4.3Å; L97-R131 HydrophobicContact CD2-CB 4.21Å; L97-L132 HydrophobicContact CD1-CB 4.29Å; L97-L132 HydrophobicContact CD1-CD1 3.96Å
98	E	92.9	Very high	86.5	Confident	72 Å²	72	65.4 Å²	65.4	34%	0.336	33%	0.33	S	S	.	.	H	α-helix	trans	-65.7	-36.7	176.5	-71.2	-57	147.2	0	0	113	E94 E95 K96 L101 S102 K135	E94-E98 WeakPolarHBondContact O-CG 3.36Å; E94-E98 PolarHBondContact O-N 3.08Å; E95-E98 PolarHBondContact O-N 2.96Å; K96-E98 VanDerWaalsContact C-N 3.31Å; K96-E98 PolarHBondContact O-N 3.07Å; E98-L101 PolarHBondContact O-N 2.95Å; E98-S102 WeakPolarHBondContact O-CB 3.33Å; E98-S102 PolarHBondContact O-N 3.47Å; E98-S102 PolarHBondContact O-OG 2.86Å; E98-K135 IonicContact OE1-NZ 2.74Å; E98-K135 PolarHBondContact OE1-NZ 3.11Å
99	Q	94.1	Very high	87.8	Confident	97 Å²	97	62 Å²	62	45%	0.453	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-47.8	173	-72.8	171.8	-0.1	0	0	111.6	E95 K96 S102 S103	E95-Q99 WeakPolarHBondContact O-CG 3.45Å; E95-Q99 PolarHBondContact O-N 3.02Å; K96-Q99 PolarHBondContact O-N 2.97Å; Q99-S102 PolarHBondContact O-N 3.37Å; Q99-S103 PolarHBondContact O-N 2.96Å
100	V	94.8	Very high	89.3	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-45.5	176.9	173.4	0	0	0	0	110.8	L54 H83 L85 K96 L97 S102 S103 M104 L132	L54-V100 HydrophobicContact CD2-CG1 4.28Å; H83-V100 HydrophobicContact CB-CG2 3.75Å; L85-V100 HydrophobicContact CB-CG2 4.49Å; K96-V100 WeakPolarHBondContact O-CG2 3.3Å; K96-V100 PolarHBondContact O-N 3.09Å; L97-V100 PolarHBondContact O-N 3.27Å; V100-S102 VanDerWaalsContact C-N 3.31Å; V100-S102 PolarHBondContact O-N 3.25Å; V100-S103 PolarHBondContact O-N 2.87Å; V100-M104 HydrophobicContact CG1-CE 3.68Å; V100-M104 HydrophobicContact CG1-CG 4.42Å; V100-M104 HydrophobicContact CG1-SD 4.15Å; V100-M104 WeakPolarHBondContact O-CG 3.25Å; V100-M104 PolarHBondContact O-N 2.93Å; V100-L132 HydrophobicContact CG1-CD1 4.01Å
101	L	95.6	Very high	91	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-39.9	177.5	-75.7	164.8	0	0	0	112.4	L97 E98 M104 K105 L132 K135 L136	L97-L101 HydrophobicContact CD1-CD1 4.11Å; L97-L101 HydrophobicContact CD1-CG 4.31Å; L97-L101 HydrophobicContact CG-CD1 3.89Å; L97-L101 WeakPolarHBondContact O-CB 3.4Å; L97-L101 WeakPolarHBondContact O-CD1 3.3Å; L97-L101 VanDerWaalsContact O-CG 3.23Å; L97-L101 WeakPolarHBondContact O-CG 3.35Å; L97-L101 PolarHBondContact O-N 3.43Å; E98-L101 PolarHBondContact O-N 2.95Å; L101-M104 PolarHBondContact O-N 2.94Å; L101-K105 WeakPolarHBondContact O-CB 3.34Å; L101-K105 WeakPolarHBondContact O-CG 3.47Å; L101-K105 PolarHBondContact O-N 2.99Å; L101-L132 HydrophobicContact CD2-CD1 3.6Å; L101-L132 HydrophobicContact CD2-CG 4.46Å; L101-L132 HydrophobicContact CG-CD1 3.93Å; L101-K135 HydrophobicContact CD1-CB 4.07Å; L101-K135 HydrophobicContact CD1-CD 3.34Å; L101-K135 HydrophobicContact CD1-CG 4.35Å; L101-K135 HydrophobicContact CD2-CB 3.91Å; L101-L136 HydrophobicContact CD2-CD1 4.08Å; L101-L136 HydrophobicContact CD2-CD2 3.83Å; L101-L136 HydrophobicContact CD2-CG 3.61Å
102	S	96.3	Very high	92.5	Very high	66 Å²	66	45 Å²	45	46%	0.462	22%	0.224	S	C	.	.	H	α-helix	trans	-63.7	-45.4	178.1	-59.6	0	0	0	0	110.9	E98 Q99 V100 K105 E106	E98-S102 WeakPolarHBondContact O-CB 3.33Å; E98-S102 PolarHBondContact O-N 3.47Å; E98-S102 PolarHBondContact O-OG 2.86Å; Q99-S102 PolarHBondContact O-N 3.37Å; V100-S102 VanDerWaalsContact C-N 3.31Å; V100-S102 PolarHBondContact O-N 3.25Å; S102-K105 PolarHBondContact O-N 3.08Å; S102-E106 PolarHBondContact O-N 3.42Å
103	S	96.7	Very high	93.8	Very high	8 Å²	8	44 Å²	44	6%	0.056	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-47	174.1	176.8	0	0	0	0	112	T52 H83 Q99 V100 K105 E106 N107	T52-S103 WeakPolarHBondContact CG2-OG 3.26Å; T52-S103 VanDerWaalsContact OG1-C 3.27Å; T52-S103 PolarHBondContact OG1-O 3.18Å; T52-S103 PolarHBondContact OG1-OG 3.4Å; H83-S103 WeakPolarHBondContact NE2-CB 3.42Å; H83-S103 PolarHBondContact NE2-OG 3.39Å; Q99-S103 PolarHBondContact O-N 2.96Å; V100-S103 PolarHBondContact O-N 2.87Å; S103-K105 VanDerWaalsContact C-N 3.31Å; S103-K105 PolarHBondContact O-N 2.95Å; S103-E106 PolarHBondContact O-N 2.82Å; S103-N107 WeakPolarHBondContact O-CB 3.22Å; S103-N107 PolarHBondContact O-N 3.26Å; S103-N107 PolarHBondContact O-ND2 3.22Å; S103-N107 PolarHBondContact OG-ND2 2.86Å
104	M	96.8	Very high	94.2	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-35.1	178.1	-69.4	-173.8	176.5	0	0	112.7	T52 L54 V100 L101 K108 A110 I112 L132 L136	T52-M104 HydrophobicContact CG2-CE 4.15Å; T52-M104 HydrophobicContact CG2-CG 3.76Å; T52-M104 PolarHBondContact OG1-N 3.4Å; L54-M104 HydrophobicContact CB-CE 4.5Å; L54-M104 HydrophobicContact CD2-CE 4.44Å; V100-M104 HydrophobicContact CG1-CE 3.68Å; V100-M104 HydrophobicContact CG1-CG 4.42Å; V100-M104 HydrophobicContact CG1-SD 4.15Å; V100-M104 WeakPolarHBondContact O-CG 3.25Å; V100-M104 PolarHBondContact O-N 2.93Å; L101-M104 PolarHBondContact O-N 2.94Å; M104-K108 WeakPolarHBondContact O-CA 3.45Å; M104-K108 PolarHBondContact O-N 2.91Å; M104-A110 HydrophobicContact CE-CB 3.82Å; M104-A110 HydrophobicContact CG-CB 3.96Å; M104-A110 HydrophobicContact SD-CB 4.18Å; M104-I112 HydrophobicContact CE-CG2 3.62Å; M104-L132 HydrophobicContact CE-CD1 4.49Å; M104-L132 HydrophobicContact CE-CD2 4.06Å; M104-L132 HydrophobicContact SD-CD1 3.94Å; M104-L132 HydrophobicContact SD-CD2 4.13Å; M104-L132 HydrophobicContact SD-CG 4.31Å; M104-L136 HydrophobicContact CB-CD1 4.15Å; M104-L136 HydrophobicContact CB-CD2 4.41Å; M104-L136 HydrophobicContact SD-CD1 3.59Å; M104-L136 VanDerWaalsContact SD-CD1 3.59Å
105	K	96.4	Very high	94.5	Very high	92 Å²	92	40.3 Å²	40.3	40%	0.4	19%	0.194	S	C	.	.	H	α-helix	trans	-70.2	-38.4	175.9	-74.6	170.8	-179.1	175.8	0	112.2	L101 S102 S103 L136 Y300	L101-K105 WeakPolarHBondContact O-CB 3.34Å; L101-K105 WeakPolarHBondContact O-CG 3.47Å; L101-K105 PolarHBondContact O-N 2.99Å; S102-K105 PolarHBondContact O-N 3.08Å; S103-K105 VanDerWaalsContact C-N 3.31Å; S103-K105 PolarHBondContact O-N 2.95Å; K105-L136 HydrophobicContact CG-CD2 4Å; K105-Y300 HydrophobicContact CB-CE1 4.39Å; K105-Y300 HydrophobicContact CG-CE1 4.26Å
106	E	96.8	Very high	94.4	Very high	118 Å²	118	37 Å²	37	55%	0.551	18%	0.179	S	C	*	.	H	α-helix	trans	-68.7	-51.3	177.3	-174.5	174.8	175.8	0	0	111.4	R44 S102 S103	R44-E106 IonicContact NH2-OE1 3.62Å; R44-E106 PolarHBondContact NH2-OE1 3.43Å; S102-E106 PolarHBondContact O-N 3.42Å; S103-E106 PolarHBondContact O-N 2.82Å
107	N	96.6	Very high	94	Very high	16 Å²	16	36.7 Å²	36.7	9%	0.086	18%	0.182	C	C	.	.	H	α-helix	trans	-80	-23.2	-174.6	-64.4	-26.4	0	0	0	113.3	P50 T52 Q81 S103 V109	P50-N107 WeakPolarHBondContact CB-OD1 3.45Å; T52-N107 PolarHBondContact OG1-ND2 2.91Å; Q81-N107 PolarHBondContact OE1-ND2 3.36Å; S103-N107 WeakPolarHBondContact O-CB 3.22Å; S103-N107 PolarHBondContact O-N 3.26Å; S103-N107 PolarHBondContact O-ND2 3.22Å; S103-N107 PolarHBondContact OG-ND2 2.86Å; N107-V109 PolarHBondContact O-N 2.92Å
108	K	97.5	Very high	93.2	Very high	120 Å²	120	38.1 Å²	38.1	52%	0.522	19%	0.191	S	C	.	.	S	Bend	trans	63.3	-15.9	-176.9	-52.6	177.9	-178.2	-180	0	116.4	M104 Y300 A301	M104-K108 WeakPolarHBondContact O-CA 3.45Å; M104-K108 PolarHBondContact O-N 2.91Å; K108-Y300 HydrophobicContact CB-CD1 4.3Å; K108-Y300 HydrophobicContact CG-CD1 4.38Å; K108-Y300 VanDerWaalsContact O-CA 3.3Å; K108-Y300 WeakPolarHBondContact O-CA 3.15Å; K108-A301 PolarHBondContact O-N 2.75Å
109	V	97.9	Very high	92.3	Very high	9 Å²	9	44.1 Å²	44.1	6%	0.055	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.9	178.5	-179.4	0	0	0	0	109.4	V51 T52 N107 A301 F303 M332 L336	V51-V109 HydrophobicContact CG1-CG1 4.42Å; V51-V109 HydrophobicContact CG2-CG1 4.34Å; T52-V109 PolarHBondContact N-O 3.26Å; T52-V109 VanDerWaalsContact N-O 3.14Å; N107-V109 PolarHBondContact O-N 2.92Å; V109-A301 WeakPolarHBondContact CA-O 3.32Å; V109-F303 HydrophobicContact CG1-CD2 4.22Å; V109-F303 HydrophobicContact CG1-CE2 4Å; V109-M332 HydrophobicContact CG1-CG 3.59Å; V109-M332 HydrophobicContact CG1-SD 4.1Å; V109-L336 HydrophobicContact CB-CD2 4.32Å; V109-L336 HydrophobicContact CG1-CD2 4.43Å; V109-L336 HydrophobicContact CG2-CD2 3.82Å
110	A	98.2	Very high	91.2	Very high	2 Å²	2	46.8 Å²	46.8	2%	0.017	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.7	176.2	0	0	0	0	0	112.5	T52 M104 I112 A301 V302 F303	T52-A110 HydrophobicContact CG2-CB 4.48Å; T52-A110 CarbonylContact O-C 3.43Å; T52-A110 WeakPolarHBondContact O-CA 3.31Å; T52-A110 WeakPolarHBondContact O-CB 3.18Å; M104-A110 HydrophobicContact CE-CB 3.82Å; M104-A110 HydrophobicContact CG-CB 3.96Å; M104-A110 HydrophobicContact SD-CB 4.18Å; A110-I112 HydrophobicContact CB-CG2 4.43Å; A110-A301 PolarHBondContact N-O 3.24Å; A110-V302 HydrophobicContact CB-CG2 4.19Å; A110-V302 CarbonylContact O-C 3.59Å; A110-V302 WeakPolarHBondContact O-CA 3.2Å; A110-F303 PolarHBondContact O-N 3.45Å
111	I	97.9	Very high	89.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.3	167.3	-166.8	173	0	0	0	109.1	V51 T52 M53 L54 M64 F80 F303 M325 A329 M332	V51-I111 HydrophobicContact CG1-CG2 4.39Å; T52-I111 PolarHBondContact O-N 3.36Å; M53-I111 WeakPolarHBondContact CA-O 3.09Å; M53-I111 HydrophobicContact CB-CG2 4.08Å; M53-I111 HydrophobicContact CE-CG2 3.83Å; M53-I111 HydrophobicContact CG-CG2 4.07Å; L54-I111 PolarHBondContact N-O 2.9Å; M64-I111 HydrophobicContact CE-CG1 4.03Å; M64-I111 HydrophobicContact SD-CD1 4.32Å; M64-I111 HydrophobicContact SD-CG1 4.3Å; M64-I111 HydrophobicContact SD-CG2 4.36Å; F80-I111 HydrophobicContact CD1-CG2 4.33Å; F80-I111 HydrophobicContact CE1-CG2 3.9Å; I111-F303 CarbonylContact C-O 3.5Å; I111-F303 WeakPolarHBondContact CA-O 3.36Å; I111-F303 HydrophobicContact CG1-CB 4.33Å; I111-M325 HydrophobicContact CD1-SD 3.86Å; I111-M325 HydrophobicContact CG1-SD 3.96Å; I111-A329 HydrophobicContact CD1-CB 3.75Å; I111-M332 HydrophobicContact CB-SD 4.05Å
112	I	95.9	Very high	88.4	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.1	-172.7	72.2	170.3	0	0	0	111.9	L54 M104 A110 V302 F303 E304	L54-I112 HydrophobicContact CB-CB 4.21Å; L54-I112 HydrophobicContact CB-CG2 3.85Å; L54-I112 HydrophobicContact CD2-CG2 4.42Å; L54-I112 CarbonylContact O-C 3.52Å; L54-I112 WeakPolarHBondContact O-CA 3.45Å; M104-I112 HydrophobicContact CE-CG2 3.62Å; A110-I112 HydrophobicContact CB-CG2 4.43Å; I112-V302 HydrophobicContact CB-CG1 4.35Å; I112-V302 HydrophobicContact CD1-CG1 3.67Å; I112-V302 HydrophobicContact CG1-CG1 3.67Å; I112-V302 HydrophobicContact CG2-CG1 3.78Å; I112-F303 PolarHBondContact N-O 3.28Å; I112-E304 HydrophobicContact CD1-CB 4.49Å; I112-E304 HydrophobicContact CG1-CB 3.77Å
113	G	93.6	Very high	86.9	Confident	4 Å²	4	59.7 Å²	59.7	4%	0.041	29%	0.293	C	S	.	.			trans	-88.2	177.2	163.7	0	0	0	0	0	111	L54 P55 I115	L54-G113 PolarHBondContact O-N 3.21Å; P55-G113 WeakPolarHBondContact O-CA 3.4Å; G113-I115 PolarHBondContact O-N 3.1Å
114	K	91.1	Very high	85.8	Confident	38 Å²	38	65.3 Å²	65.3	17%	0.165	32%	0.318	C	S	.	.			trans	-76.2	116	-177.9	179.8	51	176.3	142.7	0	110.7	D57 H116 R308 P310	D57-K114 WeakPolarHBondContact CB-O 3.44Å; D57-K114 PolarHBondContact N-O 3.09Å; K114-H116 PolarHBondContact O-N 3.25Å; K114-R308 HydrophobicContact CD-CB 4.1Å; K114-P310 HydrophobicContact CB-CB 4.43Å; K114-P310 HydrophobicContact CG-CB 4.09Å; K114-P310 HydrophobicContact CG-CG 4.48Å
115	I	89	Confident	84.8	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.334	C	S	.	.			trans	-74.7	118.6	162.5	-50.6	170.9	0	0	0	107.6	L54 L85 E87 G113 D129	L54-I115 HydrophobicContact CD2-CD1 3.84Å; L54-I115 HydrophobicContact CD2-CG1 4.28Å; L85-I115 HydrophobicContact CD2-CD1 3.96Å; L85-I115 HydrophobicContact CG-CD1 4.42Å; E87-I115 HydrophobicContact CG-CG2 4.15Å; G113-I115 PolarHBondContact O-N 3.1Å; I115-D129 HydrophobicContact CB-CB 4.39Å; I115-D129 HydrophobicContact CD1-CB 4.44Å
116	H	84.5	Confident	84	Confident	66 Å²	66	64.8 Å²	64.8	31%	0.306	32%	0.321	S	S	.	.			trans	-74.5	134.4	179.2	-179.4	87	0	0	0	109.8	D57 E87 V88 K114 P310	D57-H116 HydrophobicContact CB-CB 3.89Å; D57-H116 PolarHBondContact OD2-N 3.38Å; E87-H116 WeakPolarHBondContact CB-O 3.37Å; V88-H116 HydrophobicContact CG2-CB 3.71Å; V88-H116 WeakPolarHBondContact CG2-CD2 3.31Å; K114-H116 PolarHBondContact O-N 3.25Å; H116-P310 HydrophobicContact CB-CB 4.49Å
117	T	80.9	Confident	83.4	Confident	55 Å²	55	59.6 Å²	59.6	34%	0.337	30%	0.298	S	S	.	.			trans	-107.9	118.6	175.1	-56.1	0	0	0	0	108	S127	T117-S127 VanDerWaalsContact CG2-CB 3.48Å; T117-S127 WeakPolarHBondContact OG1-CB 3.46Å; T117-S127 PolarHBondContact OG1-OG 3.27Å
118	P	74.5	Confident	83	Confident	30 Å²	30	60.7 Å²	60.7	20%	0.195	30%	0.301	C	S	.	.			trans	-58.1	143.5	174.9	-22.4	33.4	0	0	0	111.5	E87 E120	E87-P118 HydrophobicContact CB-CG 4.47Å; E87-P118 WeakPolarHBondContact OE2-CD 3.39Å; P118-E120 VanDerWaalsContact C-N 3.26Å; P118-E120 PolarHBondContact O-N 2.95Å
119	M	73.4	Confident	82.6	Confident	199 Å²	199	55.5 Å²	55.5	98%	0.98	28%	0.279	S	S	*	.	S	Bend	trans	-74.2	-19.7	175.4	-68.9	-175	-76.9	0	0	112.9
120	E	70.1	Confident	82.1	Confident	152 Å²	152	56.5 Å²	56.5	71%	0.71	28%	0.284	S	S	*	.	S	Bend	trans	-76.4	132.1	179.3	-66.4	175.6	-178.8	0	0	111	P118 K122	P118-E120 VanDerWaalsContact C-N 3.26Å; P118-E120 PolarHBondContact O-N 2.95Å; E120-K122 PolarHBondContact O-N 2.82Å
121	Y	68.3	Low	81.8	Confident	157 Å²	157	58 Å²	58	62%	0.616	29%	0.289	S	S	*	.			trans	-69.9	113	174.4	-179.7	-114.5	0	0	0	110.6	G123 L125	Y121-G123 PolarHBondContact OH-O 2.79Å; Y121-L125 HydrophobicContact CD2-CD2 3.77Å; Y121-L125 HydrophobicContact CE2-CD2 3.43Å; Y121-L125 VanDerWaalsContact CE2-CD2 3.43Å; Y121-L125 HydrophobicContact CE2-CG 3.77Å
122	K	63.8	Low	81.5	Confident	135 Å²	135	58 Å²	58	59%	0.587	29%	0.289	S	S	*	.			trans	-104.1	18.7	-179.9	-65.7	-175.6	-179.9	-178.6	0	113.7	E120	E120-K122 PolarHBondContact O-N 2.82Å
123	G	65.6	Low	81.3	Confident	48 Å²	48	58.3 Å²	58.3	50%	0.495	29%	0.29	S	S	.	.	S	Bend	trans	98.4	-15.6	178.4	0	0	0	0	0	115.3	Y121	Y121-G123 PolarHBondContact OH-O 2.79Å
124	E	73.9	Confident	81.2	Confident	125 Å²	125	63.2 Å²	63.2	58%	0.584	31%	0.307	S	S	*	.			trans	-116.2	129.6	168.6	-70.5	-173.5	-173.5	0	0	109.9	R131	E124-R131 IonicContact OE2-CZ 2.87Å; E124-R131 IonicContact OE2-NH1 3.75Å; E124-R131 PolarHBondContact OE2-NH1 3.4Å
125	L	75.6	Confident	81.4	Confident	68 Å²	68	65.1 Å²	65.1	36%	0.356	32%	0.316	S	S	.	.	S	Bend	trans	-79.9	-18.9	178.5	-68.2	171.5	0	0	0	113.2	Y121 S173 E175	Y121-L125 HydrophobicContact CD2-CD2 3.77Å; Y121-L125 HydrophobicContact CE2-CD2 3.43Å; Y121-L125 VanDerWaalsContact CE2-CD2 3.43Å; Y121-L125 HydrophobicContact CE2-CG 3.77Å; L125-S173 VanDerWaalsContact CD1-O 3.23Å; L125-S173 WeakPolarHBondContact CD1-O 3.29Å; L125-S173 PolarHBondContact O-OG 2.68Å; L125-E175 HydrophobicContact CD1-CB 3.96Å; L125-E175 HydrophobicContact CD1-CG 4.45Å
126	A	78.5	Confident	81.7	Confident	16 Å²	16	65.3 Å²	65.3	13%	0.132	32%	0.316	C	S	.	.	S	Bend	trans	-104.1	121.2	-175.9	0	0	0	0	0	111.2	R131	A126-R131 HydrophobicContact CB-CG 4.04Å
127	S	85.6	Confident	82.3	Confident	10 Å²	10	65 Å²	65	7%	0.07	32%	0.317	C	S	.	.			trans	-68.2	161.6	175.8	72	0	0	0	0	112.8	E87 T117 D129 M130 R131	E87-S127 WeakPolarHBondContact OE1-CB 3.48Å; T117-S127 VanDerWaalsContact CG2-CB 3.48Å; T117-S127 WeakPolarHBondContact OG1-CB 3.46Å; T117-S127 PolarHBondContact OG1-OG 3.27Å; S127-D129 VanDerWaalsContact C-N 3.27Å; S127-D129 PolarHBondContact O-N 2.53Å; S127-M130 WeakPolarHBondContact O-CB 3.34Å; S127-M130 PolarHBondContact O-N 2.82Å; S127-M130 VanDerWaalsContact O-N 3.14Å; S127-M130 VanDerWaalsContact OG-CG 3.29Å; S127-M130 WeakPolarHBondContact OG-CG 3.14Å; S127-M130 PolarHBondContact OG-N 2.81Å; S127-R131 WeakPolarHBondContact O-CB 3.2Å; S127-R131 WeakPolarHBondContact O-CG 3.38Å; S127-R131 PolarHBondContact O-N 2.97Å
128	Y	87.8	Confident	83.1	Confident	39 Å²	39	62.4 Å²	62.4	15%	0.153	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-36.4	174	-78.3	-94.5	0	0	0	111.9	L85 E87 A92 L97 R131 L132	L85-Y128 HydrophobicContact CD1-CD1 4.15Å; L85-Y128 HydrophobicContact CD2-CD1 4.35Å; E87-Y128 HydrophobicContact CG-CD2 3.45Å; E87-Y128 VanDerWaalsContact CG-CD2 3.45Å; E87-Y128 HydrophobicContact CG-CE2 4.17Å; E87-Y128 HydrophobicContact CG-CG 4.21Å; E87-Y128 WeakPolarHBondContact OE1-CB 3.21Å; E87-Y128 WeakPolarHBondContact OE1-CD2 3.46Å; E87-Y128 PolarHBondContact OE1-N 3Å; A92-Y128 HydrophobicContact CB-CD1 4.28Å; A92-Y128 HydrophobicContact CB-CD2 4.04Å; A92-Y128 HydrophobicContact CB-CE1 3.92Å; A92-Y128 HydrophobicContact CB-CE2 3.61Å; A92-Y128 HydrophobicContact CB-CG 4.33Å; L97-Y128 HydrophobicContact CB-CD1 4.05Å; L97-Y128 HydrophobicContact CB-CE1 4.11Å; L97-Y128 HydrophobicContact CD1-CD1 4.3Å; L97-Y128 HydrophobicContact CD2-CD1 3.92Å; L97-Y128 HydrophobicContact CD2-CE1 4.23Å; L97-Y128 HydrophobicContact CG-CD1 4.3Å; Y128-R131 PolarHBondContact O-N 2.68Å; Y128-L132 VanDerWaalsContact O-CB 3.24Å; Y128-L132 WeakPolarHBondContact O-CB 3.44Å; Y128-L132 PolarHBondContact O-N 3.34Å
129	D	87.8	Confident	84.1	Confident	11 Å²	11	62.1 Å²	62.1	6%	0.059	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-45.3	173.1	-179	76.2	0	0	0	111.4	I115 S127 R131 L132 R133	I115-D129 HydrophobicContact CB-CB 4.39Å; I115-D129 HydrophobicContact CD1-CB 4.44Å; S127-D129 VanDerWaalsContact C-N 3.27Å; S127-D129 PolarHBondContact O-N 2.53Å; D129-R131 PolarHBondContact O-N 3.47Å; D129-L132 PolarHBondContact O-N 3.01Å; D129-R133 VanDerWaalsContact CG-NE 3.33Å; D129-R133 VanDerWaalsContact O-CG 3.28Å; D129-R133 WeakPolarHBondContact O-CG 2.89Å; D129-R133 PolarHBondContact O-N 2.95Å; D129-R133 IonicContact OD1-CZ 3.39Å; D129-R133 IonicContact OD1-NE 2.56Å; D129-R133 PolarHBondContact OD1-NE 3.14Å; D129-R133 IonicContact OD1-NH2 2.81Å; D129-R133 PolarHBondContact OD1-NH2 3.14Å; D129-R133 IonicContact OD2-CZ 2.82Å; D129-R133 IonicContact OD2-NE 3.68Å; D129-R133 PolarHBondContact OD2-NE 3.48Å; D129-R133 IonicContact OD2-NH2 3.53Å
130	M	88.6	Confident	85.3	Confident	30 Å²	30	52.6 Å²	52.6	15%	0.148	25%	0.25	C	S	.	.	H	α-helix	trans	-65.8	-39.6	176.4	-69.7	173.8	64.4	0	0	112.3	S127 R134 Y171 S173	S127-M130 WeakPolarHBondContact O-CB 3.34Å; S127-M130 PolarHBondContact O-N 2.82Å; S127-M130 VanDerWaalsContact O-N 3.14Å; S127-M130 VanDerWaalsContact OG-CG 3.29Å; S127-M130 WeakPolarHBondContact OG-CG 3.14Å; S127-M130 PolarHBondContact OG-N 2.81Å; M130-R134 WeakPolarHBondContact O-CB 3.11Å; M130-R134 WeakPolarHBondContact O-CG 3.48Å; M130-R134 PolarHBondContact O-N 2.87Å; M130-Y171 HydrophobicContact CE-CD1 3.98Å; M130-Y171 HydrophobicContact CE-CG 4.45Å; M130-Y171 WeakPolarHBondContact CE-O 3.49Å; M130-Y171 HydrophobicContact SD-CD1 4.11Å; M130-S173 WeakPolarHBondContact CE-OG 3.32Å
131	R	90.7	Very high	86.6	Confident	34 Å²	34	45.4 Å²	45.4	13%	0.128	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-42.5	178.8	-68.1	170.8	69	-172.9	-4.7	111.3	E94 L97 E124 A126 S127 Y128 D129 R134 K135	E94-R131 IonicContact OE1-NH2 2.84Å; E94-R131 PolarHBondContact OE1-NH2 3.31Å; E94-R131 IonicContact OE2-CZ 3.48Å; E94-R131 IonicContact OE2-NH1 2.79Å; E94-R131 PolarHBondContact OE2-NH1 2.91Å; E94-R131 IonicContact OE2-NH2 3.72Å; E94-R131 PolarHBondContact OE2-NH2 3.09Å; L97-R131 HydrophobicContact CD2-CB 4.21Å; E124-R131 IonicContact OE2-CZ 2.87Å; E124-R131 IonicContact OE2-NH1 3.75Å; E124-R131 PolarHBondContact OE2-NH1 3.4Å; A126-R131 HydrophobicContact CB-CG 4.04Å; S127-R131 WeakPolarHBondContact O-CB 3.2Å; S127-R131 WeakPolarHBondContact O-CG 3.38Å; S127-R131 PolarHBondContact O-N 2.97Å; Y128-R131 PolarHBondContact O-N 2.68Å; D129-R131 PolarHBondContact O-N 3.47Å; R131-R134 PolarHBondContact O-N 3.28Å; R131-K135 WeakPolarHBondContact O-CB 3.43Å; R131-K135 WeakPolarHBondContact O-CG 3.36Å; R131-K135 PolarHBondContact O-N 2.69Å
132	L	92.4	Very high	88	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-57.1	-52.5	174.1	-174.2	80.3	0	0	0	110.7	L97 V100 L101 M104 Y128 D129 R134 K135 L136	L97-L132 HydrophobicContact CD1-CB 4.29Å; L97-L132 HydrophobicContact CD1-CD1 3.96Å; V100-L132 HydrophobicContact CG1-CD1 4.01Å; L101-L132 HydrophobicContact CD2-CD1 3.6Å; L101-L132 HydrophobicContact CD2-CG 4.46Å; L101-L132 HydrophobicContact CG-CD1 3.93Å; M104-L132 HydrophobicContact CE-CD1 4.49Å; M104-L132 HydrophobicContact CE-CD2 4.06Å; M104-L132 HydrophobicContact SD-CD1 3.94Å; M104-L132 HydrophobicContact SD-CD2 4.13Å; M104-L132 HydrophobicContact SD-CG 4.31Å; Y128-L132 VanDerWaalsContact O-CB 3.24Å; Y128-L132 WeakPolarHBondContact O-CB 3.44Å; Y128-L132 PolarHBondContact O-N 3.34Å; D129-L132 PolarHBondContact O-N 3.01Å; L132-R134 PolarHBondContact O-N 2.74Å; L132-K135 PolarHBondContact O-N 2.79Å; L132-L136 HydrophobicContact CD1-CD1 4.37Å; L132-L136 HydrophobicContact CG-CD1 4.23Å; L132-L136 PolarHBondContact O-N 2.98Å; L132-L136 VanDerWaalsContact O-N 3.09Å
133	R	92.5	Very high	89.6	Confident	7 Å²	7	31.7 Å²	31.7	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-60.7	-41.1	179.8	-68.7	168.4	-168.8	-75.3	-8.4	112.9	D129 D137 L138 Q166 S295 E304 R308	D129-R133 VanDerWaalsContact CG-NE 3.33Å; D129-R133 VanDerWaalsContact O-CG 3.28Å; D129-R133 WeakPolarHBondContact O-CG 2.89Å; D129-R133 PolarHBondContact O-N 2.95Å; D129-R133 IonicContact OD1-CZ 3.39Å; D129-R133 IonicContact OD1-NE 2.56Å; D129-R133 PolarHBondContact OD1-NE 3.14Å; D129-R133 IonicContact OD1-NH2 2.81Å; D129-R133 PolarHBondContact OD1-NH2 3.14Å; D129-R133 IonicContact OD2-CZ 2.82Å; D129-R133 IonicContact OD2-NE 3.68Å; D129-R133 PolarHBondContact OD2-NE 3.48Å; D129-R133 IonicContact OD2-NH2 3.53Å; R133-D137 PolarHBondContact O-N 2.98Å; R133-D137 VanDerWaalsContact O-N 3.1Å; R133-L138 HydrophobicContact CB-CB 4.43Å; R133-L138 HydrophobicContact CG-CD1 4.22Å; R133-L138 PolarHBondContact O-N 2.89Å; R133-Q166 VanDerWaalsContact NH1-CD 3.3Å; R133-S295 PolarHBondContact NH1-OG 2.81Å; R133-S295 VanDerWaalsContact NH1-OG 3.11Å; R133-E304 IonicContact CZ-OE1 2.88Å; R133-E304 IonicContact CZ-OE2 2.85Å; R133-E304 IonicContact NH1-OE1 3.25Å; R133-E304 PolarHBondContact NH1-OE1 3.29Å; R133-E304 IonicContact NH1-OE2 2.79Å; R133-E304 IonicContact NH2-OE1 3.33Å; R133-E304 PolarHBondContact NH2-OE1 3.16Å; R133-E304 IonicContact NH2-OE2 3.56Å; R133-E304 PolarHBondContact NH2-OE2 3.41Å; R133-R308 VanDerWaalsContact CZ-CZ 3.5Å
134	R	91.8	Very high	91.1	Very high	107 Å²	107	31.6 Å²	31.6	40%	0.404	15%	0.147	S	C	.	.	H	α-helix	trans	-69	-44.1	177.2	-74.5	-173.3	-64.1	166.6	1.9	112.5	M130 R131 L132 L136 D137	M130-R134 WeakPolarHBondContact O-CB 3.11Å; M130-R134 WeakPolarHBondContact O-CG 3.48Å; M130-R134 PolarHBondContact O-N 2.87Å; R131-R134 PolarHBondContact O-N 3.28Å; L132-R134 PolarHBondContact O-N 2.74Å; R134-L136 PolarHBondContact O-N 3.45Å; R134-D137 PolarHBondContact O-N 3.43Å; R134-D137 VanDerWaalsContact O-N 3.09Å
135	K	94.3	Very high	92.1	Very high	79 Å²	79	25.7 Å²	25.7	34%	0.343	12%	0.119	S	C	.	.	H	α-helix	trans	-66.7	-24.9	180	-75.7	-177.7	176.3	-175.6	0	113	E94 E98 L101 R131 L132	E94-K135 IonicContact OE1-NZ 3.79Å; E94-K135 PolarHBondContact OE1-NZ 2.65Å; E98-K135 IonicContact OE1-NZ 2.74Å; E98-K135 PolarHBondContact OE1-NZ 3.11Å; L101-K135 HydrophobicContact CD1-CB 4.07Å; L101-K135 HydrophobicContact CD1-CD 3.34Å; L101-K135 HydrophobicContact CD1-CG 4.35Å; L101-K135 HydrophobicContact CD2-CB 3.91Å; R131-K135 WeakPolarHBondContact O-CB 3.43Å; R131-K135 WeakPolarHBondContact O-CG 3.36Å; R131-K135 PolarHBondContact O-N 2.69Å; L132-K135 PolarHBondContact O-N 2.79Å
136	L	95.7	Very high	93.1	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-2.4	173.2	-65.8	173.6	0	0	0	113.7	L101 M104 K105 L132 R134 L138 S297 Y300	L101-L136 HydrophobicContact CD2-CD1 4.08Å; L101-L136 HydrophobicContact CD2-CD2 3.83Å; L101-L136 HydrophobicContact CD2-CG 3.61Å; M104-L136 HydrophobicContact CB-CD1 4.15Å; M104-L136 HydrophobicContact CB-CD2 4.41Å; M104-L136 HydrophobicContact SD-CD1 3.59Å; M104-L136 VanDerWaalsContact SD-CD1 3.59Å; K105-L136 HydrophobicContact CG-CD2 4Å; L132-L136 HydrophobicContact CD1-CD1 4.37Å; L132-L136 HydrophobicContact CG-CD1 4.23Å; L132-L136 PolarHBondContact O-N 2.98Å; L132-L136 VanDerWaalsContact O-N 3.09Å; R134-L136 PolarHBondContact O-N 3.45Å; L136-L138 HydrophobicContact CB-CD1 4.26Å; L136-L138 HydrophobicContact CB-CG 3.86Å; L136-L138 HydrophobicContact CD1-CD1 4.17Å; L136-L138 PolarHBondContact O-N 3.28Å; L136-S297 VanDerWaalsContact O-CB 3.32Å; L136-S297 WeakPolarHBondContact O-CB 3.4Å; L136-S297 PolarHBondContact O-OG 3.15Å; L136-Y300 HydrophobicContact CB-CD2 4.18Å; L136-Y300 HydrophobicContact CD2-CD2 4.05Å; L136-Y300 HydrophobicContact CD2-CE2 4.11Å; L136-Y300 WeakPolarHBondContact O-CD2 2.98Å
137	D	96.6	Very high	93.8	Very high	59 Å²	59	27.4 Å²	27.4	32%	0.316	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	45.3	-171.5	-166.1	37.2	0	0	0	113	R133 R134 F139 R196 S297	R133-D137 PolarHBondContact O-N 2.98Å; R133-D137 VanDerWaalsContact O-N 3.1Å; R134-D137 PolarHBondContact O-N 3.43Å; R134-D137 VanDerWaalsContact O-N 3.09Å; D137-F139 PolarHBondContact O-N 3.5Å; D137-R196 VanDerWaalsContact CG-NH1 3.29Å; D137-R196 IonicContact OD1-CZ 3.97Å; D137-R196 IonicContact OD1-NH1 2.73Å; D137-R196 PolarHBondContact OD1-NH1 3.43Å; D137-R196 IonicContact OD1-NH2 3.67Å; D137-R196 PolarHBondContact OD1-NH2 3.27Å; D137-R196 IonicContact OD2-CZ 2.92Å; D137-R196 IonicContact OD2-NH1 3.97Å; D137-R196 PolarHBondContact OD2-NH1 2.92Å; D137-R196 IonicContact OD2-NH2 2.84Å; D137-S297 VanDerWaalsContact O-CB 3.31Å; D137-S297 WeakPolarHBondContact O-CB 3.34Å; D137-S297 PolarHBondContact O-OG 2.78Å
138	L	96.9	Very high	94.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.125	C	C	.	.			trans	-71.4	78.8	174.2	-66.5	171.9	0	0	0	109.4	R133 L136 Q166 Y296 V302	R133-L138 HydrophobicContact CB-CB 4.43Å; R133-L138 HydrophobicContact CG-CD1 4.22Å; R133-L138 PolarHBondContact O-N 2.89Å; L136-L138 HydrophobicContact CB-CD1 4.26Å; L136-L138 HydrophobicContact CB-CG 3.86Å; L136-L138 HydrophobicContact CD1-CD1 4.17Å; L136-L138 PolarHBondContact O-N 3.28Å; L138-Q166 WeakPolarHBondContact O-CB 3.33Å; L138-Q166 PolarHBondContact O-NE2 2.86Å; L138-Q166 VanDerWaalsContact O-NE2 3.07Å; L138-Y296 CarbonylContact C-O 3.59Å; L138-Y296 WeakPolarHBondContact CA-O 3.46Å; L138-V302 HydrophobicContact CD1-CB 4.06Å; L138-V302 HydrophobicContact CD1-CG2 3.61Å; L138-V302 HydrophobicContact CD2-CB 4.42Å; L138-V302 HydrophobicContact CD2-CG2 3.88Å; L138-V302 HydrophobicContact CG-CG2 4.42Å
139	F	97.4	Very high	94	Very high	24 Å²	24	29 Å²	29	11%	0.105	14%	0.137	C	C	.	.			trans	-81	-29.6	-166.9	75.1	-92.9	0	0	0	115.2	D137 Q166 T167 R196 I197 F200 Y296	D137-F139 PolarHBondContact O-N 3.5Å; F139-Q166 PolarHBondContact O-N 2.61Å; F139-T167 HydrophobicContact CB-CG2 4Å; F139-R196 HydrophobicContact CD2-CG 3.9Å; F139-R196 HydrophobicContact CE2-CG 4.17Å; F139-R196 HydrophobicContact CG-CG 4.49Å; F139-I197 HydrophobicContact CD2-CD1 4.26Å; F139-I197 HydrophobicContact CE2-CD1 4.5Å; F139-F200 HydrophobicContact CE2-CB 3.94Å; F139-F200 HydrophobicContact CE2-CD2 4.13Å; F139-F200 HydrophobicContact CE2-CG 4.15Å; F139-F200 HydrophobicContact CZ-CB 4.41Å; F139-F200 AromaticContact CZ-CD2 3.94Å; F139-F200 HydrophobicContact CZ-CD2 3.94Å; F139-F200 HydrophobicContact CZ-CG 4.41Å; F139-Y296 PolarHBondContact N-O 3.23Å
140	A	97.9	Very high	93.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.2	-177.5	0	0	0	0	0	110.2	I197 F200 S295 Y296	A140-I197 HydrophobicContact CB-CD1 3.52Å; A140-F200 HydrophobicContact CB-CD1 3.69Å; A140-F200 HydrophobicContact CB-CD2 4.09Å; A140-F200 HydrophobicContact CB-CE1 3.73Å; A140-F200 HydrophobicContact CB-CE2 4.1Å; A140-F200 HydrophobicContact CB-CG 3.89Å; A140-F200 HydrophobicContact CB-CZ 3.93Å; A140-S295 CarbonylContact O-C 3.47Å; A140-S295 WeakPolarHBondContact O-CA 3.19Å; A140-Y296 PolarHBondContact N-O 3.24Å; A140-Y296 PolarHBondContact O-N 3.02Å
141	N	97.6	Very high	93.6	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	132.4	166.4	175.9	-122.4	0	0	0	109.7	I163 R164 E294 S295 R308	N141-I163 CarbonylContact O-C 3.56Å; N141-I163 VanDerWaalsContact O-CA 3.29Å; N141-I163 WeakPolarHBondContact O-CA 3.43Å; N141-R164 HydrophobicContact CB-CB 4.22Å; N141-R164 PolarHBondContact N-O 3.16Å; N141-R164 PolarHBondContact O-N 2.99Å; N141-E294 CarbonylContact C-O 3.56Å; N141-E294 VanDerWaalsContact CA-O 3.31Å; N141-E294 WeakPolarHBondContact CA-O 3.46Å; N141-E294 PolarHBondContact ND2-O 3.04Å; N141-S295 PolarHBondContact ND2-OG 2.91Å; N141-R308 VanDerWaalsContact CG-NH2 3.29Å; N141-R308 PolarHBondContact ND2-NH2 3.21Å; N141-R308 VanDerWaalsContact ND2-NH2 3.11Å
142	V	98.1	Very high	93.3	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.6	-178.6	-175.4	0	0	0	0	108.2	V161 I162 I163 F200 Y204 E294 Y296	V142-V161 HydrophobicContact CG1-CG1 3.66Å; V142-I162 CarbonylContact C-O 3.52Å; V142-I162 WeakPolarHBondContact CA-O 3.47Å; V142-I163 HydrophobicContact CG2-CG1 4.34Å; V142-F200 HydrophobicContact CG2-CE1 3.52Å; V142-F200 HydrophobicContact CG2-CZ 3.86Å; V142-Y204 HydrophobicContact CG1-CE2 3.84Å; V142-E294 HydrophobicContact CB-CB 4.37Å; V142-E294 PolarHBondContact N-O 3.45Å; V142-E294 PolarHBondContact O-N 3.19Å; V142-Y296 HydrophobicContact CB-CE2 4.31Å; V142-Y296 HydrophobicContact CG2-CD2 3.88Å; V142-Y296 HydrophobicContact CG2-CE2 3.92Å
143	V	97.6	Very high	93.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	115.8	177.1	-179	0	0	0	0	108.1	V145 V161 I162 D278 V291	V143-V145 HydrophobicContact CG1-CG2 3.95Å; V143-V161 WeakPolarHBondContact O-CA 3.34Å; V143-I162 HydrophobicContact CB-CB 4.39Å; V143-I162 PolarHBondContact N-O 2.74Å; V143-I162 PolarHBondContact O-N 3.06Å; V143-D278 WeakPolarHBondContact CG2-OD1 3.35Å; V143-V291 HydrophobicContact CG1-CG1 3.36Å
144	H	95.8	Very high	93.2	Very high	47 Å²	47	48.7 Å²	48.7	22%	0.218	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	102.9	178.8	-171.3	-174.9	0	0	0	109.7	K146 D159	H144-K146 PolarHBondContact O-N 2.84Å; H144-D159 IonicContact CD2-OD1 2.76Å; H144-D159 IonicContact CE1-OD1 3.48Å; H144-D159 IonicContact NE2-OD1 3.2Å; H144-D159 PolarHBondContact NE2-OD1 2.86Å
145	V	96.2	Very high	93.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	96.2	-178.8	-177.8	0	0	0	0	108.8	V143 L160 I162 A281 V285 V291	V143-V145 HydrophobicContact CG1-CG2 3.95Å; V145-L160 HydrophobicContact CB-CD1 3.88Å; V145-L160 HydrophobicContact CB-CG 4Å; V145-L160 HydrophobicContact CG1-CD1 4.48Å; V145-L160 HydrophobicContact CG1-CG 4.4Å; V145-L160 HydrophobicContact CG2-CD1 4.16Å; V145-L160 PolarHBondContact N-O 2.94Å; V145-L160 PolarHBondContact O-N 2.9Å; V145-I162 HydrophobicContact CG2-CD1 3.85Å; V145-A281 HydrophobicContact CB-CB 4.39Å; V145-A281 HydrophobicContact CG1-CB 4.01Å; V145-A281 WeakPolarHBondContact CG1-O 3.31Å; V145-A281 HydrophobicContact CG2-CB 3.81Å; V145-V285 HydrophobicContact CG1-CB 4.32Å; V145-V285 HydrophobicContact CG1-CG1 3.55Å; V145-V285 HydrophobicContact CG1-CG2 3.77Å; V145-V291 HydrophobicContact CG2-CG1 4.25Å
146	K	95.5	Very high	93.1	Very high	101 Å²	101	42.8 Å²	42.8	44%	0.439	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131	-178.5	-173	168.7	-175.7	132.3	0	111.3	H144 L148 L158 D159	H144-K146 PolarHBondContact O-N 2.84Å; K146-L148 PolarHBondContact O-N 3.4Å; K146-L158 CarbonylContact C-O 3.49Å; K146-L158 VanDerWaalsContact CA-O 3.29Å; K146-L158 WeakPolarHBondContact CA-O 3.41Å; K146-D159 IonicContact NZ-OD2 3.96Å; K146-D159 PolarHBondContact NZ-OD2 2.82Å
147	S	94.2	Very high	93.1	Very high	20 Å²	20	49.6 Å²	49.6	14%	0.14	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-62.2	127.3	171	-64.8	0	0	0	0	110	N157 L158	S147-N157 PolarHBondContact OG-N 2.89Å; S147-L158 PolarHBondContact N-O 2.93Å; S147-L158 PolarHBondContact OG-N 2.84Å
148	L	90.9	Very high	93.1	Very high	18 Å²	18	47 Å²	47	9%	0.094	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-93.5	137.5	178.6	-66.1	-179.7	0	0	0	111.1	K146 G150 Y151 V290 T323 L327 I353	K146-L148 PolarHBondContact O-N 3.4Å; L148-G150 PolarHBondContact O-N 3.13Å; L148-Y151 HydrophobicContact CB-CD2 4Å; L148-Y151 HydrophobicContact CD1-CD2 4.47Å; L148-Y151 HydrophobicContact CD1-CE2 4.47Å; L148-Y151 PolarHBondContact O-N 3.43Å; L148-V290 HydrophobicContact CD1-CB 3.93Å; L148-V290 HydrophobicContact CD1-CG1 4.41Å; L148-T323 HydrophobicContact CD1-CG2 3.82Å; L148-L327 HydrophobicContact CD1-CD1 4.01Å; L148-L327 HydrophobicContact CD2-CD1 4.33Å; L148-I353 HydrophobicContact CD1-CD1 3.87Å
149	P	85.9	Confident	93.1	Very high	65 Å²	65	49.4 Å²	49.4	42%	0.422	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	121	179	27.3	-33.6	0	0	0	110.5	K350 I353 K354	P149-K350 HydrophobicContact CG-CB 4.32Å; P149-I353 WeakPolarHBondContact O-CG2 3.22Å; P149-K354 PolarHBondContact O-N 3.23Å
150	G	84.4	Confident	93.1	Very high	47 Å²	47	48.3 Å²	48.3	49%	0.485	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	112	-21.4	-178.1	0	0	0	0	0	113.8	L148	L148-G150 PolarHBondContact O-N 3.13Å
151	Y	82.9	Confident	93.1	Very high	30 Å²	30	48.3 Å²	48.3	12%	0.118	25%	0.247	C	C	.	.			trans	-87.1	115.9	166.1	-77.3	-77.8	0	0	0	109.8	L148 V290 N321 I353 I358	L148-Y151 HydrophobicContact CB-CD2 4Å; L148-Y151 HydrophobicContact CD1-CD2 4.47Å; L148-Y151 HydrophobicContact CD1-CE2 4.47Å; L148-Y151 PolarHBondContact O-N 3.43Å; Y151-V290 HydrophobicContact CD2-CG1 4.28Å; Y151-V290 HydrophobicContact CE1-CG1 4.3Å; Y151-V290 HydrophobicContact CE2-CG1 3.53Å; Y151-V290 WeakPolarHBondContact OH-CG1 3.48Å; Y151-N321 PolarHBondContact OH-ND2 3.34Å; Y151-I353 HydrophobicContact CD2-CG2 3.52Å; Y151-I353 HydrophobicContact CE2-CD1 4.09Å; Y151-I353 HydrophobicContact CE2-CG1 4.2Å; Y151-I353 HydrophobicContact CE2-CG2 3.59Å; Y151-I358 HydrophobicContact CD2-CD1 4.49Å; Y151-I358 HydrophobicContact CE1-CD1 4.25Å; Y151-I358 HydrophobicContact CE2-CD1 3.98Å; Y151-I358 WeakPolarHBondContact OH-CG2 3.46Å
152	M	84.5	Confident	93.2	Very high	161 Å²	161	48.3 Å²	48.3	79%	0.793	25%	0.247	S	C	*	.			trans	-93.1	114.8	170.7	-65	-59.1	-60.5	0	0	108.6
153	T	90.4	Very high	93.2	Very high	35 Å²	35	48.2 Å²	48.2	22%	0.215	25%	0.246	C	C	.	.			trans	-121.3	-179.3	173.2	72.1	0	0	0	0	110.1	H155 N156 L284	T153-H155 PolarHBondContact O-N 3.04Å; T153-H155 PolarHBondContact OG1-N 3.22Å; T153-H155 PolarHBondContact OG1-O 2.51Å; T153-N156 PolarHBondContact N-OD1 2.82Å; T153-N156 PolarHBondContact O-ND2 2.76Å; T153-N156 PolarHBondContact O-OD1 2.92Å; T153-L284 WeakPolarHBondContact CB-O 3.48Å; T153-L284 PolarHBondContact OG1-O 3.31Å
154	R	91.9	Very high	93.2	Very high	221 Å²	221	48.4 Å²	48.4	83%	0.834	25%	0.247	S	C	*	.	S	Bend	trans	-60.4	-35	176.4	-173.7	178.9	-178.9	102.2	1.2	112.3
155	H	93.6	Very high	93.2	Very high	18 Å²	18	46.3 Å²	46.3	8%	0.083	24%	0.237	C	C	.	.	S	Bend	trans	-122	120	-179.5	-57.7	-82.3	0	0	0	109.6	T153 L158 V258 P261	T153-H155 PolarHBondContact O-N 3.04Å; T153-H155 PolarHBondContact OG1-N 3.22Å; T153-H155 PolarHBondContact OG1-O 2.51Å; H155-L158 HydrophobicContact CB-CD1 3.71Å; H155-L158 HydrophobicContact CB-CD2 4.21Å; H155-L158 HydrophobicContact CB-CG 4.08Å; H155-V258 PolarHBondContact CE1-O 3.27Å; H155-V258 PolarHBondContact NE2-O 3.19Å; H155-V258 VanDerWaalsContact NE2-O 3.09Å; H155-P261 HydrophobicContact CB-CG 4.08Å
156	N	92.3	Very high	93.1	Very high	45 Å²	45	46.9 Å²	46.9	24%	0.241	24%	0.24	C	C	.	.			trans	-115.6	153.6	-173.2	-61.3	-74.9	0	0	0	110.1	T153 L158 Y262	T153-N156 PolarHBondContact N-OD1 2.82Å; T153-N156 PolarHBondContact O-ND2 2.76Å; T153-N156 PolarHBondContact O-OD1 2.92Å; N156-L158 VanDerWaalsContact C-N 3.32Å; N156-Y262 PolarHBondContact N-OH 2.56Å; N156-Y262 WeakPolarHBondContact O-CE1 3.29Å; N156-Y262 PolarHBondContact O-OH 2.7Å
157	N	93.9	Very high	93	Very high	145 Å²	145	42.4 Å²	42.4	78%	0.775	22%	0.221	S	C	*	.	S	Bend	trans	62.5	35.8	-175.9	-48.1	-47.5	0	0	0	113.6	S147	S147-N157 PolarHBondContact OG-N 2.89Å
158	L	96.5	Very high	93.1	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	22%	0.216	C	C	.	.			trans	-76.2	142.5	169.2	-60.4	-175.6	0	0	0	110.7	K146 S147 H155 N156 P261 Y262 L284 V285	K146-L158 CarbonylContact C-O 3.49Å; K146-L158 VanDerWaalsContact CA-O 3.29Å; K146-L158 WeakPolarHBondContact CA-O 3.41Å; S147-L158 PolarHBondContact N-O 2.93Å; S147-L158 PolarHBondContact OG-N 2.84Å; H155-L158 HydrophobicContact CB-CD1 3.71Å; H155-L158 HydrophobicContact CB-CD2 4.21Å; H155-L158 HydrophobicContact CB-CG 4.08Å; N156-L158 VanDerWaalsContact C-N 3.32Å; L158-P261 HydrophobicContact CD1-CB 4.2Å; L158-P261 HydrophobicContact CD1-CG 4.09Å; L158-P261 HydrophobicContact CD2-CB 3.82Å; L158-P261 HydrophobicContact CD2-CG 3.64Å; L158-Y262 HydrophobicContact CD2-CD1 3.66Å; L158-Y262 HydrophobicContact CD2-CE1 3.45Å; L158-Y262 VanDerWaalsContact CD2-CE1 3.45Å; L158-Y262 HydrophobicContact CD2-CG 4.28Å; L158-Y262 HydrophobicContact CG-CE1 4.5Å; L158-L284 HydrophobicContact CD1-CB 3.83Å; L158-L284 HydrophobicContact CD1-CD1 4.33Å; L158-V285 HydrophobicContact CB-CG1 4.1Å; L158-V285 HydrophobicContact CD1-CG1 4.01Å
159	D	97.3	Very high	93.2	Very high	53 Å²	53	41 Å²	41	28%	0.283	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	80.6	175.5	-165	-23.6	0	0	0	109.8	H144 K146 R210	H144-D159 IonicContact CD2-OD1 2.76Å; H144-D159 IonicContact CE1-OD1 3.48Å; H144-D159 IonicContact NE2-OD1 3.2Å; H144-D159 PolarHBondContact NE2-OD1 2.86Å; K146-D159 IonicContact NZ-OD2 3.96Å; K146-D159 PolarHBondContact NZ-OD2 2.82Å; D159-R210 PolarHBondContact O-NH1 3.17Å; D159-R210 VanDerWaalsContact O-NH1 3.14Å; D159-R210 IonicContact OD1-CZ 3.43Å; D159-R210 IonicContact OD1-NH1 2.63Å; D159-R210 PolarHBondContact OD1-NH1 3.13Å; D159-R210 IonicContact OD1-NH2 3.42Å; D159-R210 PolarHBondContact OD1-NH2 2.88Å; D159-R210 IonicContact OD2-NH2 3.67Å
160	L	97.6	Very high	93.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	155.5	178.5	66.9	95.2	0	0	0	110.9	V145 I162 L257 F264 D265 L267 A281	V145-L160 HydrophobicContact CB-CD1 3.88Å; V145-L160 HydrophobicContact CB-CG 4Å; V145-L160 HydrophobicContact CG1-CD1 4.48Å; V145-L160 HydrophobicContact CG1-CG 4.4Å; V145-L160 HydrophobicContact CG2-CD1 4.16Å; V145-L160 PolarHBondContact N-O 2.94Å; V145-L160 PolarHBondContact O-N 2.9Å; L160-I162 HydrophobicContact CD1-CD1 4.05Å; L160-I162 HydrophobicContact CD1-CG1 3.83Å; L160-L257 HydrophobicContact CD2-CD2 4.08Å; L160-F264 HydrophobicContact CB-CB 4.32Å; L160-F264 HydrophobicContact CD2-CB 4.49Å; L160-D265 CarbonylContact C-O 3.54Å; L160-D265 WeakPolarHBondContact CA-O 3.48Å; L160-L267 HydrophobicContact CB-CD1 4.46Å; L160-L267 HydrophobicContact CD1-CD1 3.82Å; L160-A281 HydrophobicContact CD1-CB 4.45Å
161	V	98.4	Very high	93.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130	-179.1	-178.2	0	0	0	0	109.4	V142 V143 I163 Y204 D265 V266 L267	V142-V161 HydrophobicContact CG1-CG1 3.66Å; V143-V161 WeakPolarHBondContact O-CA 3.34Å; V161-I163 HydrophobicContact CG1-CG1 4.1Å; V161-Y204 HydrophobicContact CB-CE1 4.18Å; V161-Y204 HydrophobicContact CG1-CD1 4.45Å; V161-Y204 HydrophobicContact CG1-CE1 3.72Å; V161-Y204 HydrophobicContact CG2-CE1 4Å; V161-D265 PolarHBondContact N-O 3.2Å; V161-V266 HydrophobicContact CB-CG2 4.42Å; V161-V266 CarbonylContact O-C 3.56Å; V161-V266 WeakPolarHBondContact O-CA 3.33Å; V161-L267 PolarHBondContact O-N 3.25Å
162	I	98.4	Very high	93.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.1	175.4	-59.7	156.3	0	0	0	108.1	V142 V143 V145 L160 L267 M269 I277 D278 A281	V142-I162 CarbonylContact C-O 3.52Å; V142-I162 WeakPolarHBondContact CA-O 3.47Å; V143-I162 HydrophobicContact CB-CB 4.39Å; V143-I162 PolarHBondContact N-O 2.74Å; V143-I162 PolarHBondContact O-N 3.06Å; V145-I162 HydrophobicContact CG2-CD1 3.85Å; L160-I162 HydrophobicContact CD1-CD1 4.05Å; L160-I162 HydrophobicContact CD1-CG1 3.83Å; I162-L267 HydrophobicContact CG1-CD1 4.21Å; I162-M269 HydrophobicContact CG2-CE 3.85Å; I162-M269 HydrophobicContact CG2-SD 4.35Å; I162-I277 HydrophobicContact CD1-CG2 3.71Å; I162-I277 HydrophobicContact CG1-CG2 4Å; I162-I277 HydrophobicContact CG2-CG2 4.45Å; I162-D278 WeakPolarHBondContact CB-OD1 3.26Å; I162-D278 WeakPolarHBondContact CG2-OD1 3.41Å; I162-A281 HydrophobicContact CD1-CB 3.62Å
163	I	98.6	Very high	93.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.4	177.1	-60.3	-177.9	0	0	0	108.1	N141 V142 V161 I197 F200 A201 Y204 V266 L267 V268 M269	N141-I163 CarbonylContact O-C 3.56Å; N141-I163 VanDerWaalsContact O-CA 3.29Å; N141-I163 WeakPolarHBondContact O-CA 3.43Å; V142-I163 HydrophobicContact CG2-CG1 4.34Å; V161-I163 HydrophobicContact CG1-CG1 4.1Å; I163-I197 HydrophobicContact CG2-CD1 3.64Å; I163-I197 HydrophobicContact CG2-CG1 4.17Å; I163-F200 HydrophobicContact CD1-CD1 4.32Å; I163-F200 HydrophobicContact CD1-CE1 4.29Å; I163-F200 HydrophobicContact CG2-CD1 3.9Å; I163-F200 HydrophobicContact CG2-CE1 4.26Å; I163-A201 HydrophobicContact CB-CB 4.42Å; I163-A201 HydrophobicContact CD1-CB 3.82Å; I163-A201 HydrophobicContact CG2-CB 4.22Å; I163-Y204 HydrophobicContact CD1-CD1 4.01Å; I163-Y204 HydrophobicContact CD1-CG 3.92Å; I163-V266 HydrophobicContact CD1-CG1 3.66Å; I163-V266 HydrophobicContact CG1-CG1 4.16Å; I163-L267 PolarHBondContact N-O 3.01Å; I163-V268 HydrophobicContact CG2-CG2 4.4Å; I163-V268 VanDerWaalsContact O-CA 3.3Å; I163-V268 WeakPolarHBondContact O-CA 3.41Å; I163-M269 PolarHBondContact O-N 2.83Å
164	R	97.5	Very high	93.7	Very high	5 Å²	5	36.6 Å²	36.6	2%	0.019	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.7	-172.5	166.3	-175.7	177.7	179.1	3.3	110.4	N141 N271 N275 D278	N141-R164 HydrophobicContact CB-CB 4.22Å; N141-R164 PolarHBondContact N-O 3.16Å; N141-R164 PolarHBondContact O-N 2.99Å; R164-N271 PolarHBondContact NE-O 2.93Å; R164-N271 PolarHBondContact NE-OD1 3.05Å; R164-N271 PolarHBondContact NH2-O 3.21Å; R164-N271 PolarHBondContact NH2-OD1 3.15Å; R164-N275 VanDerWaalsContact NH1-CA 3.32Å; R164-N275 VanDerWaalsContact NH1-CB 3.3Å; R164-N275 PolarHBondContact NH1-OD1 3.04Å; R164-D278 IonicContact NH1-OD2 3.51Å
165	E	97.3	Very high	93.7	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.019	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.6	164.2	-161.1	-65.7	128.1	0	0	109.2	T167 E168 I197 M269 N271	E165-T167 VanDerWaalsContact CD-N 3.3Å; E165-T167 WeakPolarHBondContact OE1-CA 3.34Å; E165-T167 WeakPolarHBondContact OE1-CB 3.3Å; E165-T167 PolarHBondContact OE1-N 3.01Å; E165-T167 PolarHBondContact OE1-OG1 2.81Å; E165-T167 PolarHBondContact OE2-N 3.14Å; E165-E168 PolarHBondContact OE1-N 2.74Å; E165-E168 WeakPolarHBondContact OE2-CG 3.18Å; E165-E168 PolarHBondContact OE2-N 2.78Å; E165-I197 HydrophobicContact CB-CB 4.36Å; E165-I197 HydrophobicContact CB-CG1 4.1Å; E165-I197 HydrophobicContact CB-CG2 4.16Å; E165-I197 HydrophobicContact CG-CB 4.31Å; E165-I197 HydrophobicContact CG-CG2 4.12Å; E165-M269 PolarHBondContact N-O 2.89Å; E165-N271 WeakPolarHBondContact O-CA 3.43Å; E165-N271 WeakPolarHBondContact O-CB 3.37Å; E165-N271 PolarHBondContact O-OD1 3.23Å
166	Q	93.5	Very high	93.6	Very high	11 Å²	11	34 Å²	34	5%	0.051	17%	0.172	C	C	.	.			trans	-121.4	-0.1	-169.8	-174.4	166.2	-95.9	0	0	115	R133 L138 F139 N271 S295 R308	R133-Q166 VanDerWaalsContact NH1-CD 3.3Å; L138-Q166 WeakPolarHBondContact O-CB 3.33Å; L138-Q166 PolarHBondContact O-NE2 2.86Å; L138-Q166 VanDerWaalsContact O-NE2 3.07Å; F139-Q166 PolarHBondContact O-N 2.61Å; Q166-N271 PolarHBondContact O-ND2 2.94Å; Q166-S295 PolarHBondContact NE2-OG 3.23Å; Q166-R308 VanDerWaalsContact OE1-NH1 3.11Å
167	T	93.7	Very high	93.7	Very high	8 Å²	8	37.3 Å²	37.3	5%	0.049	19%	0.186	C	C	.	.	S	Bend	trans	-114.6	-9	-168.6	65.2	0	0	0	0	115.1	F139 E165 K193 R196	F139-T167 HydrophobicContact CB-CG2 4Å; E165-T167 VanDerWaalsContact CD-N 3.3Å; E165-T167 WeakPolarHBondContact OE1-CA 3.34Å; E165-T167 WeakPolarHBondContact OE1-CB 3.3Å; E165-T167 PolarHBondContact OE1-N 3.01Å; E165-T167 PolarHBondContact OE1-OG1 2.81Å; E165-T167 PolarHBondContact OE2-N 3.14Å; T167-K193 PolarHBondContact O-NZ 2.93Å; T167-K193 WeakPolarHBondContact OG1-CD 3.39Å; T167-K193 WeakPolarHBondContact OG1-CE 3.37Å; T167-K193 PolarHBondContact OG1-NZ 2.84Å; T167-R196 PolarHBondContact OG1-NH2 3.33Å
168	E	94.6	Very high	93.8	Very high	7 Å²	7	33.3 Å²	33.3	3%	0.033	17%	0.17	C	C	.	.	S	Bend	trans	-142.9	-156.4	176.3	65	175.5	-164.3	0	0	111.7	E165 V189 T190 K193 N271	E165-E168 PolarHBondContact OE1-N 2.74Å; E165-E168 WeakPolarHBondContact OE2-CG 3.18Å; E165-E168 PolarHBondContact OE2-N 2.78Å; E168-V189 WeakPolarHBondContact OE1-CA 3.42Å; E168-T190 VanDerWaalsContact CD-N 3.31Å; E168-T190 PolarHBondContact OE1-N 2.94Å; E168-T190 PolarHBondContact OE1-OG1 3.18Å; E168-T190 WeakPolarHBondContact OE2-CB 3.43Å; E168-T190 VanDerWaalsContact OE2-CG2 3.31Å; E168-T190 WeakPolarHBondContact OE2-CG2 3.41Å; E168-T190 PolarHBondContact OE2-N 3.44Å; E168-T190 VanDerWaalsContact OE2-N 3.14Å; E168-T190 PolarHBondContact OE2-OG1 2.78Å; E168-K193 HydrophobicContact CB-CD 4Å; E168-K193 VanDerWaalsContact CD-CD 3.47Å; E168-K193 HydrophobicContact CG-CB 4.23Å; E168-K193 HydrophobicContact CG-CD 3.78Å; E168-K193 WeakPolarHBondContact OE1-CB 3.39Å; E168-K193 WeakPolarHBondContact OE2-CD 3.4Å; E168-N271 VanDerWaalsContact O-CB 3.23Å; E168-N271 WeakPolarHBondContact O-CB 3.38Å; E168-N271 PolarHBondContact O-ND2 2.9Å
169	G	93.8	Very high	93.8	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.021	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	82.4	-142.9	-175.3	0	0	0	0	0	111.7	Y171 S172 I188	G169-Y171 PolarHBondContact O-N 3.11Å; G169-S172 WeakPolarHBondContact O-CB 3.31Å; G169-S172 PolarHBondContact O-N 3.07Å; G169-S172 PolarHBondContact O-OG 3.37Å; G169-I188 WeakPolarHBondContact CA-O 3.11Å; G169-I188 PolarHBondContact N-O 2.75Å; G169-I188 PolarHBondContact O-N 3.45Å
170	E	91.6	Very high	93.7	Very high	55 Å²	55	45 Å²	45	26%	0.257	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-65.7	-21.6	178.8	-58.7	85.9	171	0	0	111.7	S172 K187 L272	E170-S172 PolarHBondContact O-N 2.91Å; E170-K187 HydrophobicContact CG-CB 4.44Å; E170-K187 HydrophobicContact CG-CD 4.25Å; E170-K187 HydrophobicContact CG-CG 4.25Å; E170-K187 VanDerWaalsContact OE1-CD 3.28Å; E170-K187 WeakPolarHBondContact OE1-CD 3.41Å; E170-K187 VanDerWaalsContact OE1-CE 3.22Å; E170-K187 WeakPolarHBondContact OE1-CE 3.04Å; E170-K187 IonicContact OE1-NZ 3.3Å; E170-K187 PolarHBondContact OE1-NZ 3.35Å; E170-L272 HydrophobicContact CB-CB 4.21Å; E170-L272 HydrophobicContact CB-CD2 4.27Å; E170-L272 HydrophobicContact CG-CB 4.05Å; E170-L272 HydrophobicContact CG-CD2 3.75Å; E170-L272 WeakPolarHBondContact OE2-CB 3.36Å
171	Y	85.9	Confident	93.6	Very high	62 Å²	62	48.1 Å²	48.1	24%	0.243	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-82.8	13.7	175.6	-70.9	-97.7	0	0	0	113.5	M130 G169 S173 N271 L272 N275	M130-Y171 HydrophobicContact CE-CD1 3.98Å; M130-Y171 HydrophobicContact CE-CG 4.45Å; M130-Y171 WeakPolarHBondContact CE-O 3.49Å; M130-Y171 HydrophobicContact SD-CD1 4.11Å; G169-Y171 PolarHBondContact O-N 3.11Å; Y171-S173 PolarHBondContact O-N 3.22Å; Y171-N271 WeakPolarHBondContact CB-ND2 3.27Å; Y171-N271 HydrophobicContact CD2-CB 3.95Å; Y171-N271 WeakPolarHBondContact CD2-OD1 3.39Å; Y171-L272 HydrophobicContact CE2-CB 4.36Å; Y171-L272 HydrophobicContact CE2-CD1 4.23Å; Y171-N275 PolarHBondContact OH-ND2 3.35Å
172	S	86.6	Confident	93.5	Very high	19 Å²	19	51.6 Å²	51.6	13%	0.133	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-70.3	-14.5	170.7	-56.9	0	0	0	0	112.2	G169 E170 L174	G169-S172 WeakPolarHBondContact O-CB 3.31Å; G169-S172 PolarHBondContact O-N 3.07Å; G169-S172 PolarHBondContact O-OG 3.37Å; E170-S172 PolarHBondContact O-N 2.91Å; S172-L174 VanDerWaalsContact C-N 3.27Å; S172-L174 PolarHBondContact O-N 3.02Å
173	S	85.8	Confident	93.3	Very high	24 Å²	24	56.3 Å²	56.3	17%	0.168	30%	0.299	C	S	.	.			trans	55.8	40.5	179.4	-64.5	0	0	0	0	112.5	L125 M130 Y171	L125-S173 VanDerWaalsContact CD1-O 3.23Å; L125-S173 WeakPolarHBondContact CD1-O 3.29Å; L125-S173 PolarHBondContact O-OG 2.68Å; M130-S173 WeakPolarHBondContact CE-OG 3.32Å; Y171-S173 PolarHBondContact O-N 3.22Å
174	L	89.7	Confident	93.1	Very high	84 Å²	84	60.1 Å²	60.1	44%	0.44	32%	0.317	S	S	.	.			trans	-106.4	89.7	178.2	-66.1	180	0	0	0	108.8	S172 L186 I188	S172-L174 VanDerWaalsContact C-N 3.27Å; S172-L174 PolarHBondContact O-N 3.02Å; L174-L186 HydrophobicContact CB-CB 3.94Å; L174-L186 HydrophobicContact CB-CD1 4.37Å; L174-L186 PolarHBondContact O-N 2.88Å; L174-I188 HydrophobicContact CD1-CD1 4.11Å; L174-I188 HydrophobicContact CD1-CG1 3.78Å
175	E	91.8	Very high	93	Very high	98 Å²	98	63.9 Å²	63.9	46%	0.458	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142	179.1	-55.8	-171.6	168.1	0	0	110.1	L125 E184 C185	L125-E175 HydrophobicContact CD1-CB 3.96Å; L125-E175 HydrophobicContact CD1-CG 4.45Å; E175-E184 VanDerWaalsContact CA-O 3.27Å; E175-E184 WeakPolarHBondContact CA-O 3.16Å; E175-C185 HydrophobicContact CG-CB 4.29Å; E175-C185 PolarHBondContact OE1-SG 3.34Å; E175-C185 VanDerWaalsContact OE1-SG 3.41Å
176	H	91.8	Very high	92.9	Very high	86 Å²	86	67.6 Å²	67.6	40%	0.398	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	155.7	174	65.7	-70.8	0	0	0	111.2	E184	H176-E184 IonicContact CE1-OE2 2.96Å; H176-E184 PolarHBondContact CE1-OE2 2.97Å; H176-E184 PolarHBondContact N-O 2.81Å; H176-E184 VanDerWaalsContact N-O 3.11Å; H176-E184 IonicContact NE2-OE2 3.43Å; H176-E184 PolarHBondContact NE2-OE2 3.13Å; H176-E184 PolarHBondContact O-N 2.95Å
177	E	94.3	Very high	93	Very high	115 Å²	115	69.4 Å²	69.4	54%	0.537	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	103	173.5	-173.8	171.7	-158.4	0	0	108.7	A179 R180 G181 V182 I183	E177-A179 WeakPolarHBondContact CG-O 3.44Å; E177-R180 VanDerWaalsContact OE1-CA 3.27Å; E177-R180 WeakPolarHBondContact OE1-CA 3.14Å; E177-G181 PolarHBondContact OE1-N 3.14Å; E177-V182 CarbonylContact C-O 3.55Å; E177-V182 VanDerWaalsContact CA-O 3.28Å; E177-V182 WeakPolarHBondContact CA-O 3.33Å; E177-I183 HydrophobicContact CB-CD1 3.62Å; E177-I183 HydrophobicContact CG-CD1 3.78Å
178	S	94.9	Very high	93.1	Very high	62 Å²	62	72.2 Å²	72.2	43%	0.434	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-29.7	-177.2	59.5	0	0	0	0	112.4	V182 E184	S178-V182 PolarHBondContact N-O 3.42Å; S178-E184 WeakPolarHBondContact CB-OE1 3.4Å; S178-E184 PolarHBondContact OG-OE1 3.44Å
179	A	96.1	Very high	93.2	Very high	54 Å²	54	73.2 Å²	73.2	45%	0.446	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	159.3	168.1	0	0	0	0	0	109.3	E177 G181 V182	E177-A179 WeakPolarHBondContact CG-O 3.44Å; A179-G181 PolarHBondContact O-N 3.18Å; A179-V182 HydrophobicContact CB-CB 4.27Å; A179-V182 HydrophobicContact CB-CG2 4.17Å; A179-V182 WeakPolarHBondContact O-CA 3.34Å; A179-V182 WeakPolarHBondContact O-CB 3.35Å; A179-V182 PolarHBondContact O-N 3.19Å
180	R	95.6	Very high	93.5	Very high	247 Å²	247	75.6 Å²	75.6	93%	0.932	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	117.3	-179.1	-175.4	179	177.4	-179.4	-0.7	111.2	E177	E177-R180 VanDerWaalsContact OE1-CA 3.27Å; E177-R180 WeakPolarHBondContact OE1-CA 3.14Å
181	G	95.5	Very high	93.8	Very high	68 Å²	68	77.1 Å²	77.1	70%	0.701	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	6	-177.1	0	0	0	0	0	115.4	E177 A179	E177-G181 PolarHBondContact OE1-N 3.14Å; A179-G181 PolarHBondContact O-N 3.18Å
182	V	96.4	Very high	94.4	Very high	72 Å²	72	77.5 Å²	77.5	44%	0.436	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	103.8	179.7	-176.3	0	0	0	0	109.1	E177 S178 A179	E177-V182 CarbonylContact C-O 3.55Å; E177-V182 VanDerWaalsContact CA-O 3.28Å; E177-V182 WeakPolarHBondContact CA-O 3.33Å; S178-V182 PolarHBondContact N-O 3.42Å; A179-V182 HydrophobicContact CB-CB 4.27Å; A179-V182 HydrophobicContact CB-CG2 4.17Å; A179-V182 WeakPolarHBondContact O-CA 3.34Å; A179-V182 WeakPolarHBondContact O-CB 3.35Å; A179-V182 PolarHBondContact O-N 3.19Å
183	I	94.8	Very high	94.9	Very high	99 Å²	99	79.3 Å²	79.3	51%	0.508	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.2	178.6	-52.5	-57.8	0	0	0	109.6	E177	E177-I183 HydrophobicContact CB-CD1 3.62Å; E177-I183 HydrophobicContact CG-CD1 3.78Å
184	E	94.9	Very high	95.5	Very high	81 Å²	81	78.2 Å²	78.2	38%	0.379	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.9	173.4	-69.1	179.4	-158.7	0	0	109.8	E175 H176 S178	E175-E184 VanDerWaalsContact CA-O 3.27Å; E175-E184 WeakPolarHBondContact CA-O 3.16Å; H176-E184 IonicContact CE1-OE2 2.96Å; H176-E184 PolarHBondContact CE1-OE2 2.97Å; H176-E184 PolarHBondContact N-O 2.81Å; H176-E184 VanDerWaalsContact N-O 3.11Å; H176-E184 IonicContact NE2-OE2 3.43Å; H176-E184 PolarHBondContact NE2-OE2 3.13Å; H176-E184 PolarHBondContact O-N 2.95Å; S178-E184 WeakPolarHBondContact CB-OE1 3.4Å; S178-E184 PolarHBondContact OG-OE1 3.44Å
185	C	94.1	Very high	96	Very high	84 Å²	84	77.5 Å²	77.5	57%	0.568	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	116.3	174.4	-58.2	0	0	0	0	109.3	E175	E175-C185 HydrophobicContact CG-CB 4.29Å; E175-C185 PolarHBondContact OE1-SG 3.34Å; E175-C185 VanDerWaalsContact OE1-SG 3.41Å
186	L	94.9	Very high	96.3	Very high	81 Å²	81	75.7 Å²	75.7	42%	0.424	41%	0.406	S	S	.	.			trans	-93.8	113.2	-176.4	-60.4	174.2	0	0	0	111	L174 I188	L174-L186 HydrophobicContact CB-CB 3.94Å; L174-L186 HydrophobicContact CB-CD1 4.37Å; L174-L186 PolarHBondContact O-N 2.88Å; L186-I188 HydrophobicContact CB-CD1 4.44Å
187	K	95.4	Very high	96.6	Very high	50 Å²	50	71.6 Å²	71.6	22%	0.217	39%	0.387	C	S	.	.			trans	-84.4	118.8	169.3	178	-178.5	179.3	159.8	0	110	E170 V189 M222 D226 Y273	E170-K187 HydrophobicContact CG-CB 4.44Å; E170-K187 HydrophobicContact CG-CD 4.25Å; E170-K187 HydrophobicContact CG-CG 4.25Å; E170-K187 VanDerWaalsContact OE1-CD 3.28Å; E170-K187 WeakPolarHBondContact OE1-CD 3.41Å; E170-K187 VanDerWaalsContact OE1-CE 3.22Å; E170-K187 WeakPolarHBondContact OE1-CE 3.04Å; E170-K187 IonicContact OE1-NZ 3.3Å; E170-K187 PolarHBondContact OE1-NZ 3.35Å; K187-V189 HydrophobicContact CD-CG2 4.34Å; K187-V189 HydrophobicContact CG-CG2 4.1Å; K187-M222 HydrophobicContact CD-SD 3.95Å; K187-D226 WeakPolarHBondContact CE-OD1 3.37Å; K187-D226 IonicContact NZ-OD1 3.7Å; K187-D226 PolarHBondContact NZ-OD1 3.33Å; K187-Y273 PolarHBondContact NZ-OH 3.39Å
188	I	96.8	Very high	96.8	Very high	66 Å²	66	66.1 Å²	66.1	34%	0.338	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-102.4	122.7	176.9	-51.8	-55.9	0	0	0	109.7	G169 L174 L186 T190	G169-I188 WeakPolarHBondContact CA-O 3.11Å; G169-I188 PolarHBondContact N-O 2.75Å; G169-I188 PolarHBondContact O-N 3.45Å; L174-I188 HydrophobicContact CD1-CD1 4.11Å; L174-I188 HydrophobicContact CD1-CG1 3.78Å; L186-I188 HydrophobicContact CB-CD1 4.44Å; I188-T190 HydrophobicContact CG2-CG2 4.19Å
189	V	97.6	Very high	97	Very high	29 Å²	29	67.6 Å²	67.6	18%	0.176	36%	0.36	C	S	.	.			trans	-126.8	129.2	173.2	-176	0	0	0	0	108.3	E168 K187 F229	E168-V189 WeakPolarHBondContact OE1-CA 3.42Å; K187-V189 HydrophobicContact CD-CG2 4.34Å; K187-V189 HydrophobicContact CG-CG2 4.1Å; V189-F229 HydrophobicContact CG1-CB 4.41Å
190	T	98.3	Very high	97.1	Very high	52 Å²	52	66.9 Å²	66.9	32%	0.319	35%	0.347	S	S	.	.			trans	-120.7	146.2	-178.5	65.4	0	0	0	0	110.9	E168 I188 A192 K193 S194	E168-T190 VanDerWaalsContact CD-N 3.31Å; E168-T190 PolarHBondContact OE1-N 2.94Å; E168-T190 PolarHBondContact OE1-OG1 3.18Å; E168-T190 WeakPolarHBondContact OE2-CB 3.43Å; E168-T190 VanDerWaalsContact OE2-CG2 3.31Å; E168-T190 WeakPolarHBondContact OE2-CG2 3.41Å; E168-T190 PolarHBondContact OE2-N 3.44Å; E168-T190 VanDerWaalsContact OE2-N 3.14Å; E168-T190 PolarHBondContact OE2-OG1 2.78Å; I188-T190 HydrophobicContact CG2-CG2 4.19Å; T190-A192 VanDerWaalsContact C-N 3.32Å; T190-A192 PolarHBondContact O-N 2.92Å; T190-K193 PolarHBondContact O-N 3.27Å; T190-K193 WeakPolarHBondContact OG1-CB 3.39Å; T190-K193 WeakPolarHBondContact OG1-CG 3.36Å; T190-K193 PolarHBondContact OG1-N 3.01Å; T190-S194 WeakPolarHBondContact O-CB 3.21Å; T190-S194 PolarHBondContact O-N 3.31Å; T190-S194 PolarHBondContact O-OG 3.07Å
191	R	98.6	Very high	97.3	Very high	86 Å²	86	55.1 Å²	55.1	33%	0.325	30%	0.302	S	S	.	.	H	α-helix	trans	-58.6	-44.2	177.6	177.3	167.5	-77.9	-88.1	3.6	111.7	K193 S194 Q195 L228 Q231 E235	R191-K193 PolarHBondContact O-N 3.29Å; R191-S194 PolarHBondContact O-N 2.78Å; R191-Q195 HydrophobicContact CG-CG 4.19Å; R191-Q195 WeakPolarHBondContact O-CB 3.23Å; R191-Q195 WeakPolarHBondContact O-CG 3.25Å; R191-Q195 PolarHBondContact O-N 3.42Å; R191-L228 HydrophobicContact CB-CD1 4.22Å; R191-L228 HydrophobicContact CB-CD2 4.43Å; R191-Q231 VanDerWaalsContact NH2-CD 3.26Å; R191-E235 IonicContact CZ-OE1 2.99Å; R191-E235 IonicContact CZ-OE2 2.65Å; R191-E235 IonicContact NH1-OE1 2.68Å; R191-E235 PolarHBondContact NH1-OE1 2.92Å; R191-E235 IonicContact NH1-OE2 3.41Å; R191-E235 PolarHBondContact NH1-OE2 2.74Å; R191-E235 IonicContact NH2-OE1 2.91Å; R191-E235 PolarHBondContact NH2-OE1 2.87Å
192	A	98.3	Very high	97.4	Very high	71 Å²	71	51.9 Å²	51.9	59%	0.587	27%	0.269	S	S	*	.	H	α-helix	trans	-60.2	-46.5	-178	0	0	0	0	0	112.3	T190 R196	T190-A192 VanDerWaalsContact C-N 3.32Å; T190-A192 PolarHBondContact O-N 2.92Å; A192-R196 PolarHBondContact O-N 2.87Å; A192-R196 VanDerWaalsContact O-N 3.09Å
193	K	98.1	Very high	97.5	Very high	56 Å²	56	51.5 Å²	51.5	24%	0.243	27%	0.265	C	S	.	.	H	α-helix	trans	-74.2	-32.4	-179.8	-68.4	177.3	161.3	-174.7	0	112.5	T167 E168 T190 R191 R196 I197	T167-K193 PolarHBondContact O-NZ 2.93Å; T167-K193 WeakPolarHBondContact OG1-CD 3.39Å; T167-K193 WeakPolarHBondContact OG1-CE 3.37Å; T167-K193 PolarHBondContact OG1-NZ 2.84Å; E168-K193 HydrophobicContact CB-CD 4Å; E168-K193 VanDerWaalsContact CD-CD 3.47Å; E168-K193 HydrophobicContact CG-CB 4.23Å; E168-K193 HydrophobicContact CG-CD 3.78Å; E168-K193 WeakPolarHBondContact OE1-CB 3.39Å; E168-K193 WeakPolarHBondContact OE2-CD 3.4Å; T190-K193 PolarHBondContact O-N 3.27Å; T190-K193 WeakPolarHBondContact OG1-CB 3.39Å; T190-K193 WeakPolarHBondContact OG1-CG 3.36Å; T190-K193 PolarHBondContact OG1-N 3.01Å; R191-K193 PolarHBondContact O-N 3.29Å; K193-R196 VanDerWaalsContact O-CG 3.26Å; K193-R196 WeakPolarHBondContact O-CG 3.42Å; K193-I197 WeakPolarHBondContact O-CG2 3.35Å; K193-I197 PolarHBondContact O-N 2.89Å
194	S	98.6	Very high	97.7	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-44.9	173	-62.7	0	0	0	0	112.5	T190 R191 I197 A198	T190-S194 WeakPolarHBondContact O-CB 3.21Å; T190-S194 PolarHBondContact O-N 3.31Å; T190-S194 PolarHBondContact O-OG 3.07Å; R191-S194 PolarHBondContact O-N 2.78Å; S194-I197 VanDerWaalsContact O-CG2 3.3Å; S194-I197 WeakPolarHBondContact O-CG2 3.37Å; S194-A198 WeakPolarHBondContact O-CB 3.33Å; S194-A198 PolarHBondContact O-N 3.06Å; S194-A198 VanDerWaalsContact O-N 3.09Å
195	Q	98.6	Very high	97.9	Very high	69 Å²	69	44.4 Å²	44.4	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-65.7	-41	177.6	-75.5	178.9	-27.2	0	0	111.8	R191 A198 K199 C232 E235	R191-Q195 HydrophobicContact CG-CG 4.19Å; R191-Q195 WeakPolarHBondContact O-CB 3.23Å; R191-Q195 WeakPolarHBondContact O-CG 3.25Å; R191-Q195 PolarHBondContact O-N 3.42Å; Q195-A198 PolarHBondContact O-N 3.29Å; Q195-K199 WeakPolarHBondContact O-CB 3.43Å; Q195-K199 PolarHBondContact O-N 3.39Å; Q195-C232 HydrophobicContact CG-CB 3.71Å; Q195-E235 PolarHBondContact NE2-OE2 2.84Å
196	R	98.4	Very high	98.1	Very high	61 Å²	61	44.2 Å²	44.2	23%	0.23	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-41	179.6	76.9	-176.7	176.7	171.4	0.7	112.7	D137 F139 T167 A192 K193 K199 F200	D137-R196 VanDerWaalsContact CG-NH1 3.29Å; D137-R196 IonicContact OD1-CZ 3.97Å; D137-R196 IonicContact OD1-NH1 2.73Å; D137-R196 PolarHBondContact OD1-NH1 3.43Å; D137-R196 IonicContact OD1-NH2 3.67Å; D137-R196 PolarHBondContact OD1-NH2 3.27Å; D137-R196 IonicContact OD2-CZ 2.92Å; D137-R196 IonicContact OD2-NH1 3.97Å; D137-R196 PolarHBondContact OD2-NH1 2.92Å; D137-R196 IonicContact OD2-NH2 2.84Å; F139-R196 HydrophobicContact CD2-CG 3.9Å; F139-R196 HydrophobicContact CE2-CG 4.17Å; F139-R196 HydrophobicContact CG-CG 4.49Å; T167-R196 PolarHBondContact OG1-NH2 3.33Å; A192-R196 PolarHBondContact O-N 2.87Å; A192-R196 VanDerWaalsContact O-N 3.09Å; K193-R196 VanDerWaalsContact O-CG 3.26Å; K193-R196 WeakPolarHBondContact O-CG 3.42Å; R196-K199 PolarHBondContact O-N 3.4Å; R196-F200 WeakPolarHBondContact O-CB 3.23Å; R196-F200 PolarHBondContact O-N 3.43Å
197	I	98.7	Very high	98.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-71.5	-38.1	179.9	-168.5	63.1	0	0	0	111.1	F139 A140 I163 E165 K193 S194 F200 A201 F229 V268	F139-I197 HydrophobicContact CD2-CD1 4.26Å; F139-I197 HydrophobicContact CE2-CD1 4.5Å; A140-I197 HydrophobicContact CB-CD1 3.52Å; I163-I197 HydrophobicContact CG2-CD1 3.64Å; I163-I197 HydrophobicContact CG2-CG1 4.17Å; E165-I197 HydrophobicContact CB-CB 4.36Å; E165-I197 HydrophobicContact CB-CG1 4.1Å; E165-I197 HydrophobicContact CB-CG2 4.16Å; E165-I197 HydrophobicContact CG-CB 4.31Å; E165-I197 HydrophobicContact CG-CG2 4.12Å; K193-I197 WeakPolarHBondContact O-CG2 3.35Å; K193-I197 PolarHBondContact O-N 2.89Å; S194-I197 VanDerWaalsContact O-CG2 3.3Å; S194-I197 WeakPolarHBondContact O-CG2 3.37Å; I197-F200 PolarHBondContact O-N 3.05Å; I197-A201 PolarHBondContact O-N 2.97Å; I197-F229 HydrophobicContact CG2-CE2 3.99Å; I197-V268 HydrophobicContact CG1-CG2 4.1Å
198	A	98.8	Very high	98.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-50.5	172.1	0	0	0	0	0	110.5	S194 Q195 F200 A201 F202 C233 V236	S194-A198 WeakPolarHBondContact O-CB 3.33Å; S194-A198 PolarHBondContact O-N 3.06Å; S194-A198 VanDerWaalsContact O-N 3.09Å; Q195-A198 PolarHBondContact O-N 3.29Å; A198-F200 VanDerWaalsContact C-N 3.33Å; A198-F200 PolarHBondContact O-N 3.33Å; A198-A201 WeakPolarHBondContact O-CB 3.37Å; A198-A201 PolarHBondContact O-N 3.37Å; A198-F202 VanDerWaalsContact O-CD2 3.29Å; A198-F202 WeakPolarHBondContact O-CD2 3.34Å; A198-F202 PolarHBondContact O-N 2.93Å; A198-F202 VanDerWaalsContact O-N 3.08Å; A198-C233 HydrophobicContact CB-CB 4.41Å; A198-V236 HydrophobicContact CB-CB 4.11Å; A198-V236 HydrophobicContact CB-CG1 4.29Å; A198-V236 HydrophobicContact CB-CG2 4.05Å
199	K	98.7	Very high	98.3	Very high	93 Å²	93	51.9 Å²	51.9	40%	0.404	27%	0.272	S	S	.	.	H	α-helix	trans	-58	-46.2	178.1	-166.7	-163.4	-179.7	-51.1	0	111.5	Q195 R196 A201 F202 D203 V236 Y240	Q195-K199 WeakPolarHBondContact O-CB 3.43Å; Q195-K199 PolarHBondContact O-N 3.39Å; R196-K199 PolarHBondContact O-N 3.4Å; K199-A201 VanDerWaalsContact C-N 3.28Å; K199-A201 PolarHBondContact O-N 3.02Å; K199-F202 PolarHBondContact O-N 2.76Å; K199-D203 IonicContact NZ-OD1 2.7Å; K199-D203 PolarHBondContact NZ-OD1 2.93Å; K199-D203 IonicContact NZ-OD2 2.63Å; K199-D203 PolarHBondContact NZ-OD2 3.29Å; K199-D203 WeakPolarHBondContact O-CB 3.45Å; K199-D203 VanDerWaalsContact O-CG 3.3Å; K199-D203 PolarHBondContact O-N 2.63Å; K199-V236 HydrophobicContact CB-CG1 4.25Å; K199-Y240 PolarHBondContact NZ-OH 2.83Å
200	F	98.8	Very high	98.3	Very high	38 Å²	38	52.5 Å²	52.5	17%	0.167	27%	0.272	C	S	.	.	H	α-helix	trans	-57.1	-41.9	176	-179.9	-83.7	0	0	0	111.8	F139 A140 V142 I163 R196 I197 A198 D203 Y204 Y296	F139-F200 HydrophobicContact CE2-CB 3.94Å; F139-F200 HydrophobicContact CE2-CD2 4.13Å; F139-F200 HydrophobicContact CE2-CG 4.15Å; F139-F200 HydrophobicContact CZ-CB 4.41Å; F139-F200 AromaticContact CZ-CD2 3.94Å; F139-F200 HydrophobicContact CZ-CD2 3.94Å; F139-F200 HydrophobicContact CZ-CG 4.41Å; A140-F200 HydrophobicContact CB-CD1 3.69Å; A140-F200 HydrophobicContact CB-CD2 4.09Å; A140-F200 HydrophobicContact CB-CE1 3.73Å; A140-F200 HydrophobicContact CB-CE2 4.1Å; A140-F200 HydrophobicContact CB-CG 3.89Å; A140-F200 HydrophobicContact CB-CZ 3.93Å; V142-F200 HydrophobicContact CG2-CE1 3.52Å; V142-F200 HydrophobicContact CG2-CZ 3.86Å; I163-F200 HydrophobicContact CD1-CD1 4.32Å; I163-F200 HydrophobicContact CD1-CE1 4.29Å; I163-F200 HydrophobicContact CG2-CD1 3.9Å; I163-F200 HydrophobicContact CG2-CE1 4.26Å; R196-F200 WeakPolarHBondContact O-CB 3.23Å; R196-F200 PolarHBondContact O-N 3.43Å; I197-F200 PolarHBondContact O-N 3.05Å; A198-F200 VanDerWaalsContact C-N 3.33Å; A198-F200 PolarHBondContact O-N 3.33Å; F200-D203 PolarHBondContact O-N 3.49Å; F200-Y204 WeakPolarHBondContact O-CB 3.48Å; F200-Y204 PolarHBondContact O-N 2.7Å; F200-Y296 HydrophobicContact CE2-CD2 4.31Å; F200-Y296 HydrophobicContact CE2-CG 4.3Å; F200-Y296 AromaticContact CZ-CD2 3.69Å; F200-Y296 HydrophobicContact CZ-CD2 3.69Å; F200-Y296 HydrophobicContact CZ-CE2 4.34Å; F200-Y296 HydrophobicContact CZ-CG 4.14Å
201	A	98.8	Very high	98.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-41.9	178.8	0	0	0	0	0	113.1	I163 I197 A198 K199 Y204 A205 V268	I163-A201 HydrophobicContact CB-CB 4.42Å; I163-A201 HydrophobicContact CD1-CB 3.82Å; I163-A201 HydrophobicContact CG2-CB 4.22Å; I197-A201 PolarHBondContact O-N 2.97Å; A198-A201 WeakPolarHBondContact O-CB 3.37Å; A198-A201 PolarHBondContact O-N 3.37Å; K199-A201 VanDerWaalsContact C-N 3.28Å; K199-A201 PolarHBondContact O-N 3.02Å; A201-Y204 PolarHBondContact O-N 2.96Å; A201-A205 WeakPolarHBondContact O-CB 3.27Å; A201-A205 PolarHBondContact O-N 2.92Å; A201-V268 HydrophobicContact CB-CB 3.76Å; A201-V268 HydrophobicContact CB-CG1 4.38Å; A201-V268 HydrophobicContact CB-CG2 3.79Å
202	F	98.8	Very high	98.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-70.7	-39.4	176	-80	-80.9	0	0	0	113	A198 K199 Y204 A205 T206 V213 V236 A237 Y240 I243 F245	A198-F202 VanDerWaalsContact O-CD2 3.29Å; A198-F202 WeakPolarHBondContact O-CD2 3.34Å; A198-F202 PolarHBondContact O-N 2.93Å; A198-F202 VanDerWaalsContact O-N 3.08Å; K199-F202 PolarHBondContact O-N 2.76Å; F202-Y204 VanDerWaalsContact C-N 3.34Å; F202-A205 PolarHBondContact O-N 3.31Å; F202-T206 WeakPolarHBondContact O-CB 3.28Å; F202-T206 PolarHBondContact O-N 2.99Å; F202-T206 PolarHBondContact O-OG1 2.84Å; F202-V213 HydrophobicContact CD1-CB 4.46Å; F202-V213 HydrophobicContact CD1-CG2 4.08Å; F202-V213 HydrophobicContact CE1-CB 4.03Å; F202-V213 HydrophobicContact CE1-CG1 4.49Å; F202-V213 HydrophobicContact CE1-CG2 4.13Å; F202-V213 HydrophobicContact CE2-CG1 4.19Å; F202-V213 HydrophobicContact CG-CG2 4.48Å; F202-V213 HydrophobicContact CZ-CB 4.09Å; F202-V213 HydrophobicContact CZ-CG1 4.12Å; F202-V236 HydrophobicContact CD2-CB 4.49Å; F202-V236 HydrophobicContact CD2-CG1 3.62Å; F202-V236 HydrophobicContact CE2-CG1 4.17Å; F202-V236 HydrophobicContact CG-CG1 4.35Å; F202-A237 HydrophobicContact CE1-CB 4.13Å; F202-A237 HydrophobicContact CE2-CB 4.05Å; F202-A237 HydrophobicContact CZ-CB 3.45Å; F202-A237 VanDerWaalsContact CZ-CB 3.45Å; F202-Y240 HydrophobicContact CB-CD1 3.89Å; F202-Y240 HydrophobicContact CB-CD2 3.51Å; F202-Y240 HydrophobicContact CB-CE1 3.91Å; F202-Y240 HydrophobicContact CB-CE2 3.56Å; F202-Y240 HydrophobicContact CB-CG 3.7Å; F202-Y240 AromaticContact CD1-CD2 3.89Å; F202-Y240 HydrophobicContact CD1-CD2 3.89Å; F202-Y240 AromaticContact CD1-CG 3.83Å; F202-Y240 HydrophobicContact CD1-CG 3.83Å; F202-Y240 HydrophobicContact CD2-CD2 4.4Å; F202-Y240 AromaticContact CG-CD2 3.7Å; F202-Y240 HydrophobicContact CG-CD2 3.7Å; F202-Y240 HydrophobicContact CG-CE2 4.14Å; F202-Y240 HydrophobicContact CG-CG 4Å; F202-I243 HydrophobicContact CD1-CB 3.97Å; F202-I243 HydrophobicContact CD1-CG1 4.32Å; F202-I243 HydrophobicContact CD1-CG2 3.8Å; F202-I243 HydrophobicContact CE1-CB 4.02Å; F202-I243 HydrophobicContact CE1-CG2 3.7Å; F202-F245 HydrophobicContact CE2-CD2 4.27Å; F202-F245 HydrophobicContact CZ-CB 4.29Å; F202-F245 AromaticContact CZ-CD2 3.57Å; F202-F245 HydrophobicContact CZ-CD2 3.57Å; F202-F245 HydrophobicContact CZ-CE2 4.23Å; F202-F245 HydrophobicContact CZ-CG 4.19Å
203	D	98.5	Very high	98.4	Very high	65 Å²	65	46 Å²	46	35%	0.348	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-45.7	172.3	-73.9	-28.3	0	0	0	110.6	K199 F200 T206 K207 Y240	K199-D203 IonicContact NZ-OD1 2.7Å; K199-D203 PolarHBondContact NZ-OD1 2.93Å; K199-D203 IonicContact NZ-OD2 2.63Å; K199-D203 PolarHBondContact NZ-OD2 3.29Å; K199-D203 WeakPolarHBondContact O-CB 3.45Å; K199-D203 VanDerWaalsContact O-CG 3.3Å; K199-D203 PolarHBondContact O-N 2.63Å; F200-D203 PolarHBondContact O-N 3.49Å; D203-T206 PolarHBondContact O-N 3.46Å; D203-K207 VanDerWaalsContact O-CB 3.29Å; D203-K207 WeakPolarHBondContact O-CB 3.4Å; D203-K207 PolarHBondContact O-N 2.9Å; D203-Y240 PolarHBondContact OD1-OH 2.92Å
204	Y	98.4	Very high	98.4	Very high	30 Å²	30	43.4 Å²	43.4	12%	0.118	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-49.8	176.6	-179.5	-80.9	0	0	0	110.8	V142 V161 I163 F200 A201 F202 T206 K207 K208 V266	V142-Y204 HydrophobicContact CG1-CE2 3.84Å; V161-Y204 HydrophobicContact CB-CE1 4.18Å; V161-Y204 HydrophobicContact CG1-CD1 4.45Å; V161-Y204 HydrophobicContact CG1-CE1 3.72Å; V161-Y204 HydrophobicContact CG2-CE1 4Å; I163-Y204 HydrophobicContact CD1-CD1 4.01Å; I163-Y204 HydrophobicContact CD1-CG 3.92Å; F200-Y204 WeakPolarHBondContact O-CB 3.48Å; F200-Y204 PolarHBondContact O-N 2.7Å; A201-Y204 PolarHBondContact O-N 2.96Å; F202-Y204 VanDerWaalsContact C-N 3.34Å; Y204-T206 VanDerWaalsContact C-N 3.31Å; Y204-T206 PolarHBondContact O-N 2.97Å; Y204-K207 PolarHBondContact O-N 3.33Å; Y204-K208 HydrophobicContact CD1-CG 4.18Å; Y204-K208 HydrophobicContact CD2-CG 4.43Å; Y204-K208 HydrophobicContact CE1-CB 4.19Å; Y204-K208 HydrophobicContact CE1-CG 3.79Å; Y204-K208 HydrophobicContact CE2-CG 4.11Å; Y204-K208 HydrophobicContact CG-CG 4.46Å; Y204-K208 WeakPolarHBondContact O-CB 3.27Å; Y204-K208 WeakPolarHBondContact O-CG 3.44Å; Y204-K208 PolarHBondContact O-N 3.44Å; Y204-V266 HydrophobicContact CD1-CG2 4.43Å
205	A	98.6	Very high	98.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57	-47.5	179.2	0	0	0	0	0	111	A201 F202 K208 G209 R210 V213 I243 V266	A201-A205 WeakPolarHBondContact O-CB 3.27Å; A201-A205 PolarHBondContact O-N 2.92Å; F202-A205 PolarHBondContact O-N 3.31Å; A205-K208 PolarHBondContact O-N 3.45Å; A205-G209 PolarHBondContact O-N 2.79Å; A205-G209 VanDerWaalsContact O-N 3.09Å; A205-R210 HydrophobicContact CB-CB 3.9Å; A205-R210 WeakPolarHBondContact O-CB 3.35Å; A205-R210 PolarHBondContact O-N 2.72Å; A205-V213 HydrophobicContact CB-CG2 3.76Å; A205-I243 HydrophobicContact CB-CD1 4.24Å; A205-V266 HydrophobicContact CB-CG2 4.13Å
206	T	98.3	Very high	98.4	Very high	80 Å²	80	40 Å²	40	49%	0.491	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-50.1	177.6	-56.6	0	0	0	0	111.7	F202 D203 Y204 K208 G209	F202-T206 WeakPolarHBondContact O-CB 3.28Å; F202-T206 PolarHBondContact O-N 2.99Å; F202-T206 PolarHBondContact O-OG1 2.84Å; D203-T206 PolarHBondContact O-N 3.46Å; Y204-T206 VanDerWaalsContact C-N 3.31Å; Y204-T206 PolarHBondContact O-N 2.97Å; T206-K208 VanDerWaalsContact C-N 3.27Å; T206-K208 PolarHBondContact O-N 3.29Å; T206-G209 PolarHBondContact O-N 2.7Å
207	K	97.3	Very high	98.4	Very high	179 Å²	179	37.8 Å²	37.8	78%	0.778	21%	0.205	S	C	*	.	H	α-helix	trans	-63.5	-32.4	-178.4	-176.7	175.5	-179.2	177.7	0	112.8	D203 Y204	D203-K207 VanDerWaalsContact O-CB 3.29Å; D203-K207 WeakPolarHBondContact O-CB 3.4Å; D203-K207 PolarHBondContact O-N 2.9Å; Y204-K207 PolarHBondContact O-N 3.33Å
208	K	97.1	Very high	98.3	Very high	108 Å²	108	39.7 Å²	39.7	47%	0.47	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	5.8	-178.4	-63.3	-62.4	-172.6	174.7	0	113.7	Y204 A205 T206 R210	Y204-K208 HydrophobicContact CD1-CG 4.18Å; Y204-K208 HydrophobicContact CD2-CG 4.43Å; Y204-K208 HydrophobicContact CE1-CB 4.19Å; Y204-K208 HydrophobicContact CE1-CG 3.79Å; Y204-K208 HydrophobicContact CE2-CG 4.11Å; Y204-K208 HydrophobicContact CG-CG 4.46Å; Y204-K208 WeakPolarHBondContact O-CB 3.27Å; Y204-K208 WeakPolarHBondContact O-CG 3.44Å; Y204-K208 PolarHBondContact O-N 3.44Å; A205-K208 PolarHBondContact O-N 3.45Å; T206-K208 VanDerWaalsContact C-N 3.27Å; T206-K208 PolarHBondContact O-N 3.29Å; K208-R210 VanDerWaalsContact C-N 3.29Å; K208-R210 HydrophobicContact CB-CG 4.01Å; K208-R210 PolarHBondContact O-N 3.49Å
209	G	97.4	Very high	98.2	Very high	71 Å²	71	40.5 Å²	40.5	73%	0.732	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.5	31.4	178.8	0	0	0	0	0	113.5	A205 T206	A205-G209 PolarHBondContact O-N 2.79Å; A205-G209 VanDerWaalsContact O-N 3.09Å; T206-G209 PolarHBondContact O-N 2.7Å
210	R	98.3	Very high	98	Very high	43 Å²	43	39.9 Å²	39.9	16%	0.162	22%	0.221	C	C	.	.			trans	-83.4	149.2	177.1	-59.7	-79.8	173	174.9	5.3	109.5	D159 A205 K208 I243 D265 V266	D159-R210 PolarHBondContact O-NH1 3.17Å; D159-R210 VanDerWaalsContact O-NH1 3.14Å; D159-R210 IonicContact OD1-CZ 3.43Å; D159-R210 IonicContact OD1-NH1 2.63Å; D159-R210 PolarHBondContact OD1-NH1 3.13Å; D159-R210 IonicContact OD1-NH2 3.42Å; D159-R210 PolarHBondContact OD1-NH2 2.88Å; D159-R210 IonicContact OD2-NH2 3.67Å; A205-R210 HydrophobicContact CB-CB 3.9Å; A205-R210 WeakPolarHBondContact O-CB 3.35Å; A205-R210 PolarHBondContact O-N 2.72Å; K208-R210 VanDerWaalsContact C-N 3.29Å; K208-R210 HydrophobicContact CB-CG 4.01Å; K208-R210 PolarHBondContact O-N 3.49Å; R210-I243 WeakPolarHBondContact O-CD1 3.29Å; R210-D265 WeakPolarHBondContact CB-OD2 3.45Å; R210-D265 WeakPolarHBondContact CD-OD1 3.24Å; R210-D265 IonicContact CZ-OD1 2.87Å; R210-D265 IonicContact NE-OD1 2.7Å; R210-D265 IonicContact NH1-OD1 2.96Å; R210-D265 PolarHBondContact NH1-OD1 3.05Å; R210-V266 HydrophobicContact CB-CG2 3.86Å; R210-V266 HydrophobicContact CG-CG2 3.8Å
211	G	98.1	Very high	97.9	Very high	43 Å²	43	43.9 Å²	43.9	44%	0.443	24%	0.243	S	C	.	.			trans	-103	-17.7	-173.1	0	0	0	0	0	114.2	K244 D265	G211-K244 PolarHBondContact O-N 2.96Å; G211-D265 PolarHBondContact N-OD2 3.44Å
212	K	98.7	Very high	97.8	Very high	30 Å²	30	46.7 Å²	46.7	13%	0.13	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	138.8	-171.5	-170.9	171.8	79.3	156.1	0	113.6	K244 E246 Q263 D265 V266	K212-K244 CarbonylContact C-O 3.56Å; K212-K244 WeakPolarHBondContact CA-O 3.34Å; K212-K244 HydrophobicContact CB-CB 4.29Å; K212-K244 HydrophobicContact CD-CD 3.98Å; K212-K244 HydrophobicContact CD-CG 4.47Å; K212-K244 HydrophobicContact CG-CB 4.07Å; K212-K244 HydrophobicContact CG-CD 4.38Å; K212-K244 HydrophobicContact CG-CG 4.37Å; K212-K244 WeakPolarHBondContact CG-O 3.48Å; K212-E246 HydrophobicContact CD-CG 4.38Å; K212-E246 WeakPolarHBondContact CD-OE2 3.36Å; K212-E246 WeakPolarHBondContact CE-OE2 3.34Å; K212-E246 IonicContact NZ-OE1 3.03Å; K212-E246 IonicContact NZ-OE2 2.75Å; K212-E246 PolarHBondContact NZ-OE2 2.88Å; K212-Q263 WeakPolarHBondContact CE-O 3.2Å; K212-Q263 PolarHBondContact NZ-O 3.02Å; K212-D265 HydrophobicContact CB-CB 4.01Å; K212-D265 PolarHBondContact N-OD2 3Å; K212-D265 VanDerWaalsContact N-OD2 3.1Å; K212-V266 WeakPolarHBondContact O-CB 3.35Å; K212-V266 PolarHBondContact O-N 3.42Å
213	V	98.8	Very high	97.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.8	171.1	174.4	0	0	0	0	109.2	F202 A205 I243 K244 F245 E246 V266 V268	F202-V213 HydrophobicContact CD1-CB 4.46Å; F202-V213 HydrophobicContact CD1-CG2 4.08Å; F202-V213 HydrophobicContact CE1-CB 4.03Å; F202-V213 HydrophobicContact CE1-CG1 4.49Å; F202-V213 HydrophobicContact CE1-CG2 4.13Å; F202-V213 HydrophobicContact CE2-CG1 4.19Å; F202-V213 HydrophobicContact CG-CG2 4.48Å; F202-V213 HydrophobicContact CZ-CB 4.09Å; F202-V213 HydrophobicContact CZ-CG1 4.12Å; A205-V213 HydrophobicContact CB-CG2 3.76Å; V213-I243 HydrophobicContact CB-CG2 4.13Å; V213-I243 HydrophobicContact CG2-CG2 3.66Å; V213-K244 PolarHBondContact N-O 2.85Å; V213-F245 WeakPolarHBondContact O-CA 3.49Å; V213-E246 PolarHBondContact O-N 3.24Å; V213-V266 CarbonylContact C-O 3.34Å; V213-V266 VanDerWaalsContact CA-O 3.32Å; V213-V266 WeakPolarHBondContact CA-O 3.34Å; V213-V266 HydrophobicContact CG2-CB 4.07Å; V213-V266 HydrophobicContact CG2-CG1 4.27Å; V213-V268 HydrophobicContact CG1-CG1 3.82Å
214	T	98.8	Very high	97.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117	176.2	-55.5	0	0	0	0	110.3	E246 M248 V266 L267 V268	T214-E246 CarbonylContact C-O 3.55Å; T214-E246 VanDerWaalsContact CA-O 3.26Å; T214-E246 WeakPolarHBondContact CA-O 3.39Å; T214-E246 HydrophobicContact CG2-CB 4.28Å; T214-M248 HydrophobicContact CG2-CB 3.91Å; T214-V266 PolarHBondContact N-O 3.07Å; T214-L267 CarbonylContact O-C 3.49Å; T214-L267 WeakPolarHBondContact O-CA 3.38Å; T214-V268 PolarHBondContact O-N 2.88Å
215	A	98.8	Very high	97.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	120.2	172.5	0	0	0	0	0	110.5	F229 L230 C233 F245 E246 T247 M248 V268	A215-F229 HydrophobicContact CB-CE1 4.32Å; A215-L230 HydrophobicContact CB-CD1 4.29Å; A215-C233 HydrophobicContact CB-CB 4.05Å; A215-F245 HydrophobicContact CB-CE2 3.73Å; A215-F245 HydrophobicContact CB-CZ 3.78Å; A215-E246 PolarHBondContact N-O 2.99Å; A215-T247 WeakPolarHBondContact O-CA 3.23Å; A215-M248 PolarHBondContact O-N 3Å; A215-V268 WeakPolarHBondContact CA-O 3.31Å; A215-V268 HydrophobicContact CB-CG1 4.13Å
216	V	98.7	Very high	97.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.1	179.8	-172.3	0	0	0	0	110.5	M248 I250 C253 L267 V268 M269 P270	V216-M248 VanDerWaalsContact CA-O 3.31Å; V216-M248 WeakPolarHBondContact CA-O 3.39Å; V216-I250 HydrophobicContact CG1-CB 3.9Å; V216-I250 HydrophobicContact CG1-CD1 3.65Å; V216-I250 HydrophobicContact CG1-CG1 4.37Å; V216-C253 HydrophobicContact CG1-CB 3.87Å; V216-C253 HydrophobicContact CG2-CB 4.45Å; V216-L267 HydrophobicContact CG2-CB 4.35Å; V216-L267 HydrophobicContact CG2-CD2 3.88Å; V216-V268 PolarHBondContact N-O 3.09Å; V216-M269 HydrophobicContact CB-CB 3.98Å; V216-M269 HydrophobicContact CB-CE 4.12Å; V216-M269 HydrophobicContact CB-SD 4.41Å; V216-M269 HydrophobicContact CG2-CE 3.85Å; V216-P270 WeakPolarHBondContact O-CD 3.35Å
217	H	98.3	Very high	97.6	Very high	13 Å²	13	55.8 Å²	55.8	6%	0.06	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	179.1	-170.7	66.9	106.6	0	0	0	112.2	A219 D226 F229 M248 I249 I250	H217-A219 WeakPolarHBondContact ND1-CB 3.28Å; H217-A219 PolarHBondContact ND1-N 2.78Å; H217-A219 VanDerWaalsContact ND1-N 3.15Å; H217-D226 HydrophobicContact CB-CB 4.38Å; H217-F229 HydrophobicContact CB-CD1 4.49Å; H217-M248 PolarHBondContact CD2-O 3.32Å; H217-M248 PolarHBondContact N-O 3.4Å; H217-M248 VanDerWaalsContact N-O 3.08Å; H217-I249 CarbonylContact O-C 3.56Å; H217-I249 WeakPolarHBondContact O-CA 3.36Å; H217-I250 PolarHBondContact O-N 3.25Å
218	K	97.5	Very high	97.6	Very high	40 Å²	40	49.2 Å²	49.2	17%	0.174	28%	0.28	C	S	.	.			trans	-136.2	43.2	170	-164.1	77.4	-170.1	-171.8	0	110.3	N220 I221 M222 D226 I250 D251	K218-N220 WeakPolarHBondContact CD-OD1 3.25Å; K218-N220 WeakPolarHBondContact CE-OD1 3.4Å; K218-N220 WeakPolarHBondContact CG-OD1 3.17Å; K218-N220 PolarHBondContact O-N 3.42Å; K218-N220 VanDerWaalsContact O-N 3.12Å; K218-N220 PolarHBondContact O-OD1 3.16Å; K218-I221 HydrophobicContact CG-CB 4.18Å; K218-I221 HydrophobicContact CG-CG1 4.16Å; K218-I221 PolarHBondContact O-N 3.4Å; K218-M222 HydrophobicContact CB-CE 3.68Å; K218-M222 HydrophobicContact CG-CE 4.1Å; K218-M222 PolarHBondContact O-N 3.34Å; K218-D226 WeakPolarHBondContact CA-OD2 3.22Å; K218-D226 PolarHBondContact N-OD2 3.21Å; K218-I250 HydrophobicContact CB-CG2 3.99Å; K218-I250 HydrophobicContact CD-CG2 3.61Å; K218-I250 HydrophobicContact CG-CG2 4.29Å; K218-D251 IonicContact NZ-OD1 2.75Å; K218-D251 PolarHBondContact NZ-OD1 3.29Å; K218-D251 IonicContact NZ-OD2 2.69Å; K218-D251 PolarHBondContact NZ-OD2 3.48Å
219	A	96.1	Very high	97.7	Very high	18 Å²	18	44.2 Å²	44.2	15%	0.149	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15	-177.1	0	0	0	0	0	113.8	H217 I221 D226 L230	H217-A219 WeakPolarHBondContact ND1-CB 3.28Å; H217-A219 PolarHBondContact ND1-N 2.78Å; H217-A219 VanDerWaalsContact ND1-N 3.15Å; A219-I221 PolarHBondContact O-N 2.89Å; A219-D226 HydrophobicContact CB-CB 4.01Å; A219-L230 HydrophobicContact CB-CD2 4.45Å
220	N	94.6	Very high	97.8	Very high	80 Å²	80	42 Å²	42	43%	0.428	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-26.8	170.3	62	-24.2	0	0	0	113	K218	K218-N220 WeakPolarHBondContact CD-OD1 3.25Å; K218-N220 WeakPolarHBondContact CE-OD1 3.4Å; K218-N220 WeakPolarHBondContact CG-OD1 3.17Å; K218-N220 PolarHBondContact O-N 3.42Å; K218-N220 VanDerWaalsContact O-N 3.12Å; K218-N220 PolarHBondContact O-OD1 3.16Å
221	I	96.8	Very high	97.8	Very high	121 Å²	121	44 Å²	44	62%	0.621	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-53.6	174.7	-57	-58.7	0	0	0	110.3	K218 A219 K223	K218-I221 HydrophobicContact CG-CB 4.18Å; K218-I221 HydrophobicContact CG-CG1 4.16Å; K218-I221 PolarHBondContact O-N 3.4Å; A219-I221 PolarHBondContact O-N 2.89Å; I221-K223 PolarHBondContact O-N 3.15Å
222	M	96.5	Very high	97.8	Very high	60 Å²	60	42 Å²	42	30%	0.296	22%	0.219	S	C	.	.			trans	-92	72.2	-179.8	-75.4	165.8	-70.1	0	0	111.4	K187 K218 L224 D226 G227 Y273	K187-M222 HydrophobicContact CD-SD 3.95Å; K218-M222 HydrophobicContact CB-CE 3.68Å; K218-M222 HydrophobicContact CG-CE 4.1Å; K218-M222 PolarHBondContact O-N 3.34Å; M222-L224 PolarHBondContact O-N 2.91Å; M222-D226 HydrophobicContact CB-CB 4.1Å; M222-D226 PolarHBondContact O-N 2.91Å; M222-D226 VanDerWaalsContact O-N 3.14Å; M222-G227 PolarHBondContact O-N 2.89Å; M222-Y273 WeakPolarHBondContact CE-OH 3.37Å
223	K	96.3	Very high	97.8	Very high	167 Å²	167	40.6 Å²	40.6	73%	0.726	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-33.9	-173.9	-61.9	-176.9	-178.4	-179.2	0	114.3	I221 G227	I221-K223 PolarHBondContact O-N 3.15Å; K223-G227 WeakPolarHBondContact O-CA 3.35Å
224	L	97.8	Very high	97.8	Very high	154 Å²	154	44.8 Å²	44.8	81%	0.806	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-56.4	-178.7	-61.3	-179.5	0	0	0	112.3	M222 L228	M222-L224 PolarHBondContact O-N 2.91Å; L224-L228 VanDerWaalsContact O-CB 3.25Å; L224-L228 WeakPolarHBondContact O-CB 3.36Å; L224-L228 PolarHBondContact O-N 2.93Å
225	G	96.9	Very high	97.8	Very high	25 Å²	25	47.7 Å²	47.7	26%	0.258	25%	0.246	S	C	.	.	H	α-helix	trans	-64.2	-59.7	-176.2	0	0	0	0	0	112.7	G227 L228 F229	G225-G227 VanDerWaalsContact C-N 3.34Å; G225-L228 PolarHBondContact O-N 2.86Å; G225-F229 PolarHBondContact O-N 3.22Å
226	D	98	Very high	97.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-75.3	-26.3	179.4	-80.5	21.5	0	0	0	112.4	K187 H217 K218 A219 M222 L228 F229 L230 Y273	K187-D226 WeakPolarHBondContact CE-OD1 3.37Å; K187-D226 IonicContact NZ-OD1 3.7Å; K187-D226 PolarHBondContact NZ-OD1 3.33Å; H217-D226 HydrophobicContact CB-CB 4.38Å; K218-D226 WeakPolarHBondContact CA-OD2 3.22Å; K218-D226 PolarHBondContact N-OD2 3.21Å; A219-D226 HydrophobicContact CB-CB 4.01Å; M222-D226 HydrophobicContact CB-CB 4.1Å; M222-D226 PolarHBondContact O-N 2.91Å; M222-D226 VanDerWaalsContact O-N 3.14Å; D226-L228 VanDerWaalsContact C-N 3.35Å; D226-F229 PolarHBondContact O-N 3.05Å; D226-L230 WeakPolarHBondContact O-CB 3.43Å; D226-L230 PolarHBondContact O-N 3.08Å; D226-Y273 VanDerWaalsContact OD2-CE2 3.23Å; D226-Y273 WeakPolarHBondContact OD2-CE2 3.34Å; D226-Y273 PolarHBondContact OD2-OH 3.44Å
227	G	98.3	Very high	97.8	Very high	20 Å²	20	48.9 Å²	48.9	21%	0.206	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-41.5	170.6	0	0	0	0	0	112.1	M222 K223 G225 L230 Q231	M222-G227 PolarHBondContact O-N 2.89Å; K223-G227 WeakPolarHBondContact O-CA 3.35Å; G225-G227 VanDerWaalsContact C-N 3.34Å; G227-L230 PolarHBondContact O-N 3.33Å; G227-Q231 WeakPolarHBondContact O-CB 3.09Å; G227-Q231 PolarHBondContact O-N 2.56Å
228	L	98.7	Very high	97.8	Very high	41 Å²	41	55.9 Å²	55.9	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-62.6	-45.6	174.2	177.8	62.7	0	0	0	111.7	R191 L224 G225 D226 L230 Q231 C232	R191-L228 HydrophobicContact CB-CD1 4.22Å; R191-L228 HydrophobicContact CB-CD2 4.43Å; L224-L228 VanDerWaalsContact O-CB 3.25Å; L224-L228 WeakPolarHBondContact O-CB 3.36Å; L224-L228 PolarHBondContact O-N 2.93Å; G225-L228 PolarHBondContact O-N 2.86Å; D226-L228 VanDerWaalsContact C-N 3.35Å; L228-L230 VanDerWaalsContact C-N 3.33Å; L228-L230 PolarHBondContact O-N 2.84Å; L228-Q231 PolarHBondContact O-N 3.39Å; L228-C232 PolarHBondContact O-N 3.01Å; L228-C232 PolarHBondContact O-SG 3.11Å
229	F	98.8	Very high	97.8	Very high	3 Å²	3	60.1 Å²	60.1	1%	0.013	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-46.4	176	170.4	-96	0	0	0	111.7	V189 I197 A215 H217 G225 D226 C232 C233 V268 P270	V189-F229 HydrophobicContact CG1-CB 4.41Å; I197-F229 HydrophobicContact CG2-CE2 3.99Å; A215-F229 HydrophobicContact CB-CE1 4.32Å; H217-F229 HydrophobicContact CB-CD1 4.49Å; G225-F229 PolarHBondContact O-N 3.22Å; D226-F229 PolarHBondContact O-N 3.05Å; F229-C232 PolarHBondContact O-N 2.85Å; F229-C233 VanDerWaalsContact CZ-SG 3.5Å; F229-C233 PolarHBondContact O-N 3.39Å; F229-C233 PolarHBondContact O-SG 3.41Å; F229-V268 HydrophobicContact CZ-CG2 4.31Å; F229-P270 HydrophobicContact CB-CG 4.41Å; F229-P270 HydrophobicContact CD1-CG 3.88Å; F229-P270 HydrophobicContact CD2-CG 4.01Å; F229-P270 HydrophobicContact CE1-CG 4.15Å; F229-P270 HydrophobicContact CE2-CG 4.26Å; F229-P270 HydrophobicContact CG-CG 3.82Å; F229-P270 HydrophobicContact CZ-CG 4.33Å
230	L	98.3	Very high	97.9	Very high	24 Å²	24	61 Å²	61	13%	0.126	31%	0.312	C	S	.	.	H	α-helix	trans	-60.9	-48.7	179.4	-172.5	64.8	0	0	0	111.7	A215 A219 D226 G227 L228 C232 C233 E234 T247	A215-L230 HydrophobicContact CB-CD1 4.29Å; A219-L230 HydrophobicContact CB-CD2 4.45Å; D226-L230 WeakPolarHBondContact O-CB 3.43Å; D226-L230 PolarHBondContact O-N 3.08Å; G227-L230 PolarHBondContact O-N 3.33Å; L228-L230 VanDerWaalsContact C-N 3.33Å; L228-L230 PolarHBondContact O-N 2.84Å; L230-C232 VanDerWaalsContact C-N 3.29Å; L230-C232 PolarHBondContact O-N 2.87Å; L230-C233 WeakPolarHBondContact O-CB 3.38Å; L230-C233 PolarHBondContact O-N 3.34Å; L230-E234 PolarHBondContact O-N 2.8Å; L230-T247 HydrophobicContact CD1-CG2 3.46Å; L230-T247 VanDerWaalsContact CD1-CG2 3.46Å
231	Q	98.6	Very high	98	Very high	86 Å²	86	62.9 Å²	62.9	40%	0.402	33%	0.328	S	S	.	.	H	α-helix	trans	-57.3	-43.2	177	-174.7	-171.2	-16	0	0	111.3	R191 G227 L228 C233 E234 E235	R191-Q231 VanDerWaalsContact NH2-CD 3.26Å; G227-Q231 WeakPolarHBondContact O-CB 3.09Å; G227-Q231 PolarHBondContact O-N 2.56Å; L228-Q231 PolarHBondContact O-N 3.39Å; Q231-C233 VanDerWaalsContact C-N 3.3Å; Q231-C233 PolarHBondContact O-N 3.48Å; Q231-E234 PolarHBondContact O-N 2.69Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.46Å; Q231-E235 PolarHBondContact NE2-OE1 2.86Å; Q231-E235 VanDerWaalsContact O-CG 3.3Å; Q231-E235 WeakPolarHBondContact O-CG 3.37Å; Q231-E235 PolarHBondContact O-N 3.12Å
232	C	98.8	Very high	98.1	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-36.8	177	-65.2	0	0	0	0	112.1	Q195 L228 F229 L230 V236	Q195-C232 HydrophobicContact CG-CB 3.71Å; L228-C232 PolarHBondContact O-N 3.01Å; L228-C232 PolarHBondContact O-SG 3.11Å; F229-C232 PolarHBondContact O-N 2.85Å; L230-C232 VanDerWaalsContact C-N 3.29Å; L230-C232 PolarHBondContact O-N 2.87Å; C232-V236 WeakPolarHBondContact O-CB 3.49Å; C232-V236 VanDerWaalsContact O-CG2 3.25Å; C232-V236 WeakPolarHBondContact O-CG2 3.38Å; C232-V236 PolarHBondContact O-N 2.76Å; C232-V236 VanDerWaalsContact O-N 3.13Å
233	C	98.8	Very high	98.2	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.8	-41.9	176	-65.2	0	0	0	0	111.8	A198 A215 F229 L230 Q231 V236 A237 F245	A198-C233 HydrophobicContact CB-CB 4.41Å; A215-C233 HydrophobicContact CB-CB 4.05Å; F229-C233 VanDerWaalsContact CZ-SG 3.5Å; F229-C233 PolarHBondContact O-N 3.39Å; F229-C233 PolarHBondContact O-SG 3.41Å; L230-C233 WeakPolarHBondContact O-CB 3.38Å; L230-C233 PolarHBondContact O-N 3.34Å; Q231-C233 VanDerWaalsContact C-N 3.3Å; Q231-C233 PolarHBondContact O-N 3.48Å; C233-V236 PolarHBondContact O-N 3.05Å; C233-A237 WeakPolarHBondContact O-CB 3.44Å; C233-A237 PolarHBondContact O-N 3.48Å; C233-F245 HydrophobicContact CB-CE2 3.92Å; C233-F245 HydrophobicContact CB-CZ 3.69Å
234	E	98.6	Very high	98.3	Very high	88 Å²	88	62.6 Å²	62.6	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-61.1	-50.1	176	-73.9	169.4	172.9	0	0	111.5	L230 Q231 V236 A237 E238 F245	L230-E234 PolarHBondContact O-N 2.8Å; Q231-E234 PolarHBondContact O-N 2.69Å; E234-V236 VanDerWaalsContact C-N 3.29Å; E234-V236 PolarHBondContact O-N 3.37Å; E234-A237 WeakPolarHBondContact O-CB 3.33Å; E234-A237 PolarHBondContact O-N 2.79Å; E234-A237 VanDerWaalsContact O-N 3.09Å; E234-E238 PolarHBondContact O-N 2.96Å; E234-F245 HydrophobicContact CB-CE1 4.42Å; E234-F245 HydrophobicContact CG-CE1 3.58Å; E234-F245 HydrophobicContact CG-CZ 4.21Å
235	E	98.7	Very high	98.3	Very high	61 Å²	61	57.6 Å²	57.6	29%	0.285	29%	0.294	S	S	.	.	H	α-helix	trans	-57.2	-41.7	176.8	-72.6	168.7	-167.6	0	0	112	R191 Q195 Q231	R191-E235 IonicContact CZ-OE1 2.99Å; R191-E235 IonicContact CZ-OE2 2.65Å; R191-E235 IonicContact NH1-OE1 2.68Å; R191-E235 PolarHBondContact NH1-OE1 2.92Å; R191-E235 IonicContact NH1-OE2 3.41Å; R191-E235 PolarHBondContact NH1-OE2 2.74Å; R191-E235 IonicContact NH2-OE1 2.91Å; R191-E235 PolarHBondContact NH2-OE1 2.87Å; Q195-E235 PolarHBondContact NE2-OE2 2.84Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.46Å; Q231-E235 PolarHBondContact NE2-OE1 2.86Å; Q231-E235 VanDerWaalsContact O-CG 3.3Å; Q231-E235 WeakPolarHBondContact O-CG 3.37Å; Q231-E235 PolarHBondContact O-N 3.12Å
236	V	98.8	Very high	98.4	Very high	11 Å²	11	58.8 Å²	58.8	7%	0.067	29%	0.292	C	S	.	.	H	α-helix	trans	-70.3	-37	177.5	171.7	0	0	0	0	111.1	A198 K199 F202 C232 C233 E234 E238 L239 Y240	A198-V236 HydrophobicContact CB-CB 4.11Å; A198-V236 HydrophobicContact CB-CG1 4.29Å; A198-V236 HydrophobicContact CB-CG2 4.05Å; K199-V236 HydrophobicContact CB-CG1 4.25Å; F202-V236 HydrophobicContact CD2-CB 4.49Å; F202-V236 HydrophobicContact CD2-CG1 3.62Å; F202-V236 HydrophobicContact CE2-CG1 4.17Å; F202-V236 HydrophobicContact CG-CG1 4.35Å; C232-V236 WeakPolarHBondContact O-CB 3.49Å; C232-V236 VanDerWaalsContact O-CG2 3.25Å; C232-V236 WeakPolarHBondContact O-CG2 3.38Å; C232-V236 PolarHBondContact O-N 2.76Å; C232-V236 VanDerWaalsContact O-N 3.13Å; C233-V236 PolarHBondContact O-N 3.05Å; E234-V236 VanDerWaalsContact C-N 3.29Å; E234-V236 PolarHBondContact O-N 3.37Å; V236-E238 PolarHBondContact O-N 3.2Å; V236-L239 WeakPolarHBondContact O-CB 3.34Å; V236-L239 PolarHBondContact O-N 3.22Å; V236-Y240 HydrophobicContact CG1-CD2 4.27Å; V236-Y240 HydrophobicContact CG1-CE2 3.82Å; V236-Y240 VanDerWaalsContact O-CD2 3.26Å; V236-Y240 WeakPolarHBondContact O-CD2 3.37Å
237	A	98.6	Very high	98.4	Very high	15 Å²	15	61.9 Å²	61.9	12%	0.124	31%	0.311	C	S	.	.	H	α-helix	trans	-58.8	-33.3	-179.3	0	0	0	0	0	112.7	F202 C233 E234 L239 Y240 F245	F202-A237 HydrophobicContact CE1-CB 4.13Å; F202-A237 HydrophobicContact CE2-CB 4.05Å; F202-A237 HydrophobicContact CZ-CB 3.45Å; F202-A237 VanDerWaalsContact CZ-CB 3.45Å; C233-A237 WeakPolarHBondContact O-CB 3.44Å; C233-A237 PolarHBondContact O-N 3.48Å; E234-A237 WeakPolarHBondContact O-CB 3.33Å; E234-A237 PolarHBondContact O-N 2.79Å; E234-A237 VanDerWaalsContact O-N 3.09Å; A237-L239 PolarHBondContact O-N 3.41Å; A237-L239 VanDerWaalsContact O-N 3.15Å; A237-Y240 CarbonylContact O-C 3.57Å; A237-Y240 PolarHBondContact O-N 3.5Å; A237-F245 HydrophobicContact CB-CB 3.83Å; A237-F245 HydrophobicContact CB-CD1 3.97Å; A237-F245 HydrophobicContact CB-CD2 4.11Å; A237-F245 HydrophobicContact CB-CG 3.69Å
238	E	98.4	Very high	98.4	Very high	159 Å²	159	61.9 Å²	61.9	74%	0.743	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.7	175.7	-64.9	-178.4	177.4	0	0	112.8	E234 V236 Y240	E234-E238 PolarHBondContact O-N 2.96Å; V236-E238 PolarHBondContact O-N 3.2Å; E238-Y240 VanDerWaalsContact C-N 3.3Å; E238-Y240 PolarHBondContact O-N 2.7Å
239	L	98.3	Very high	98.4	Very high	129 Å²	129	62.5 Å²	62.5	68%	0.675	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.3	178.4	-53	177	0	0	0	113.2	V236 A237 P241	V236-L239 WeakPolarHBondContact O-CB 3.34Å; V236-L239 PolarHBondContact O-N 3.22Å; A237-L239 PolarHBondContact O-N 3.41Å; A237-L239 VanDerWaalsContact O-N 3.15Å; L239-P241 WeakPolarHBondContact O-CD 3.18Å
240	Y	98.4	Very high	98.3	Very high	36 Å²	36	63.1 Å²	63.1	14%	0.141	31%	0.313	C	S	.	.			trans	-127.4	65	-175.5	-57.5	-96.5	0	0	0	111.9	K199 F202 D203 V236 A237 E238 K242 I243	K199-Y240 PolarHBondContact NZ-OH 2.83Å; F202-Y240 HydrophobicContact CB-CD1 3.89Å; F202-Y240 HydrophobicContact CB-CD2 3.51Å; F202-Y240 HydrophobicContact CB-CE1 3.91Å; F202-Y240 HydrophobicContact CB-CE2 3.56Å; F202-Y240 HydrophobicContact CB-CG 3.7Å; F202-Y240 AromaticContact CD1-CD2 3.89Å; F202-Y240 HydrophobicContact CD1-CD2 3.89Å; F202-Y240 AromaticContact CD1-CG 3.83Å; F202-Y240 HydrophobicContact CD1-CG 3.83Å; F202-Y240 HydrophobicContact CD2-CD2 4.4Å; F202-Y240 AromaticContact CG-CD2 3.7Å; F202-Y240 HydrophobicContact CG-CD2 3.7Å; F202-Y240 HydrophobicContact CG-CE2 4.14Å; F202-Y240 HydrophobicContact CG-CG 4Å; D203-Y240 PolarHBondContact OD1-OH 2.92Å; V236-Y240 HydrophobicContact CG1-CD2 4.27Å; V236-Y240 HydrophobicContact CG1-CE2 3.82Å; V236-Y240 VanDerWaalsContact O-CD2 3.26Å; V236-Y240 WeakPolarHBondContact O-CD2 3.37Å; A237-Y240 CarbonylContact O-C 3.57Å; A237-Y240 PolarHBondContact O-N 3.5Å; E238-Y240 VanDerWaalsContact C-N 3.3Å; E238-Y240 PolarHBondContact O-N 2.7Å; Y240-K242 PolarHBondContact O-N 3.33Å; Y240-I243 PolarHBondContact O-N 3.4Å
241	P	96.4	Very high	98.3	Very high	120 Å²	120	65.2 Å²	65.2	78%	0.779	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.2	-172.2	26.5	-36.8	0	0	0	114.9	L239	L239-P241 WeakPolarHBondContact O-CD 3.18Å
242	K	97.4	Very high	98.3	Very high	199 Å²	199	63.9 Å²	63.9	87%	0.865	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-16	176.8	-63.8	-175.3	-178.9	179.2	0	113.5	Y240	Y240-K242 PolarHBondContact O-N 3.33Å
243	I	98.6	Very high	98.3	Very high	18 Å²	18	63.9 Å²	63.9	9%	0.092	32%	0.319	C	S	.	.	S	Bend	trans	-98.2	123.5	-179.4	-57.7	-61.9	0	0	0	107.9	F202 A205 R210 V213 Y240 F245	F202-I243 HydrophobicContact CD1-CB 3.97Å; F202-I243 HydrophobicContact CD1-CG1 4.32Å; F202-I243 HydrophobicContact CD1-CG2 3.8Å; F202-I243 HydrophobicContact CE1-CB 4.02Å; F202-I243 HydrophobicContact CE1-CG2 3.7Å; A205-I243 HydrophobicContact CB-CD1 4.24Å; R210-I243 WeakPolarHBondContact O-CD1 3.29Å; V213-I243 HydrophobicContact CB-CG2 4.13Å; V213-I243 HydrophobicContact CG2-CG2 3.66Å; Y240-I243 PolarHBondContact O-N 3.4Å; I243-F245 PolarHBondContact O-N 3.33Å
244	K	98.6	Very high	98.2	Very high	125 Å²	125	65.4 Å²	65.4	54%	0.543	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	125	173.9	-173.1	-176.3	-172.3	-165.1	0	108.9	G211 K212 V213 E246	G211-K244 PolarHBondContact O-N 2.96Å; K212-K244 CarbonylContact C-O 3.56Å; K212-K244 WeakPolarHBondContact CA-O 3.34Å; K212-K244 HydrophobicContact CB-CB 4.29Å; K212-K244 HydrophobicContact CD-CD 3.98Å; K212-K244 HydrophobicContact CD-CG 4.47Å; K212-K244 HydrophobicContact CG-CB 4.07Å; K212-K244 HydrophobicContact CG-CD 4.38Å; K212-K244 HydrophobicContact CG-CG 4.37Å; K212-K244 WeakPolarHBondContact CG-O 3.48Å; V213-K244 PolarHBondContact N-O 2.85Å; K244-E246 WeakPolarHBondContact CE-OE1 2.88Å; K244-E246 IonicContact NZ-OE1 2.72Å; K244-E246 PolarHBondContact NZ-OE1 2.94Å
245	F	98.8	Very high	98.2	Very high	50 Å²	50	66.3 Å²	66.3	22%	0.219	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.4	173.5	-177.9	-114.1	0	0	0	110.8	F202 V213 A215 C233 E234 A237 I243 T247	F202-F245 HydrophobicContact CE2-CD2 4.27Å; F202-F245 HydrophobicContact CZ-CB 4.29Å; F202-F245 AromaticContact CZ-CD2 3.57Å; F202-F245 HydrophobicContact CZ-CD2 3.57Å; F202-F245 HydrophobicContact CZ-CE2 4.23Å; F202-F245 HydrophobicContact CZ-CG 4.19Å; V213-F245 WeakPolarHBondContact O-CA 3.49Å; A215-F245 HydrophobicContact CB-CE2 3.73Å; A215-F245 HydrophobicContact CB-CZ 3.78Å; C233-F245 HydrophobicContact CB-CE2 3.92Å; C233-F245 HydrophobicContact CB-CZ 3.69Å; E234-F245 HydrophobicContact CB-CE1 4.42Å; E234-F245 HydrophobicContact CG-CE1 3.58Å; E234-F245 HydrophobicContact CG-CZ 4.21Å; A237-F245 HydrophobicContact CB-CB 3.83Å; A237-F245 HydrophobicContact CB-CD1 3.97Å; A237-F245 HydrophobicContact CB-CD2 4.11Å; A237-F245 HydrophobicContact CB-CG 3.69Å; I243-F245 PolarHBondContact O-N 3.33Å; F245-T247 HydrophobicContact CD1-CG2 4.44Å; F245-T247 HydrophobicContact CE1-CG2 3.54Å; F245-T247 HydrophobicContact CZ-CG2 3.7Å
246	E	98.2	Very high	98.2	Very high	49 Å²	49	65.4 Å²	65.4	23%	0.229	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	158.3	173.7	-73.5	177	177.8	0	0	109.8	K212 V213 T214 A215 K244	K212-E246 HydrophobicContact CD-CG 4.38Å; K212-E246 WeakPolarHBondContact CD-OE2 3.36Å; K212-E246 WeakPolarHBondContact CE-OE2 3.34Å; K212-E246 IonicContact NZ-OE1 3.03Å; K212-E246 IonicContact NZ-OE2 2.75Å; K212-E246 PolarHBondContact NZ-OE2 2.88Å; V213-E246 PolarHBondContact O-N 3.24Å; T214-E246 CarbonylContact C-O 3.55Å; T214-E246 VanDerWaalsContact CA-O 3.26Å; T214-E246 WeakPolarHBondContact CA-O 3.39Å; T214-E246 HydrophobicContact CG2-CB 4.28Å; A215-E246 PolarHBondContact N-O 2.99Å; K244-E246 WeakPolarHBondContact CE-OE1 2.88Å; K244-E246 IonicContact NZ-OE1 2.72Å; K244-E246 PolarHBondContact NZ-OE1 2.94Å
247	T	98.3	Very high	98.1	Very high	65 Å²	65	64.9 Å²	64.9	40%	0.399	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.1	174.7	67.9	0	0	0	0	108.7	A215 L230 F245	A215-T247 WeakPolarHBondContact O-CA 3.23Å; L230-T247 HydrophobicContact CD1-CG2 3.46Å; L230-T247 VanDerWaalsContact CD1-CG2 3.46Å; F245-T247 HydrophobicContact CD1-CG2 4.44Å; F245-T247 HydrophobicContact CE1-CG2 3.54Å; F245-T247 HydrophobicContact CZ-CG2 3.7Å
248	M	98.5	Very high	98	Very high	21 Å²	21	67.7 Å²	67.7	10%	0.103	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	134.3	179.8	-166.4	172.5	-68.9	0	0	111.1	T214 A215 V216 H217 N252 C253 Q256 F264	T214-M248 HydrophobicContact CG2-CB 3.91Å; A215-M248 PolarHBondContact O-N 3Å; V216-M248 VanDerWaalsContact CA-O 3.31Å; V216-M248 WeakPolarHBondContact CA-O 3.39Å; H217-M248 PolarHBondContact CD2-O 3.32Å; H217-M248 PolarHBondContact N-O 3.4Å; H217-M248 VanDerWaalsContact N-O 3.08Å; M248-N252 HydrophobicContact CG-CB 4.25Å; M248-C253 HydrophobicContact CG-CB 4.09Å; M248-C253 WeakPolarHBondContact SD-CA 3.28Å; M248-C253 HydrophobicContact SD-CB 3.84Å; M248-Q256 HydrophobicContact CE-CG 4.44Å; M248-Q256 HydrophobicContact SD-CB 4.38Å; M248-Q256 HydrophobicContact SD-CG 4.22Å; M248-F264 HydrophobicContact CE-CE1 3.93Å; M248-F264 HydrophobicContact CE-CZ 4.1Å; M248-F264 HydrophobicContact SD-CE1 3.89Å; M248-F264 HydrophobicContact SD-CZ 3.83Å
249	I	98.3	Very high	97.9	Very high	53 Å²	53	66 Å²	66	27%	0.272	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	139.3	171.6	61.9	176.6	0	0	0	110.6	H217 D251 N252 C253	H217-I249 CarbonylContact O-C 3.56Å; H217-I249 WeakPolarHBondContact O-CA 3.36Å; I249-D251 VanDerWaalsContact C-N 3.28Å; I249-D251 VanDerWaalsContact CB-OD1 3.28Å; I249-D251 WeakPolarHBondContact CB-OD1 3.43Å; I249-D251 WeakPolarHBondContact CD1-OD1 3.28Å; I249-D251 WeakPolarHBondContact CG1-OD1 3.22Å; I249-D251 PolarHBondContact O-N 2.86Å; I249-N252 HydrophobicContact CD1-CB 4.37Å; I249-N252 HydrophobicContact CG1-CB 3.7Å; I249-N252 PolarHBondContact O-N 2.9Å; I249-C253 PolarHBondContact O-N 3Å
250	I	98.1	Very high	97.8	Very high	17 Å²	17	63.4 Å²	63.4	9%	0.087	32%	0.322	C	S	.	.	H	α-helix	trans	-57	-36.8	-171.5	179.6	57.7	0	0	0	113.6	V216 H217 K218 C253 C254 Y273 I277	V216-I250 HydrophobicContact CG1-CB 3.9Å; V216-I250 HydrophobicContact CG1-CD1 3.65Å; V216-I250 HydrophobicContact CG1-CG1 4.37Å; H217-I250 PolarHBondContact O-N 3.25Å; K218-I250 HydrophobicContact CB-CG2 3.99Å; K218-I250 HydrophobicContact CD-CG2 3.61Å; K218-I250 HydrophobicContact CG-CG2 4.29Å; I250-C253 WeakPolarHBondContact O-CB 3.24Å; I250-C253 PolarHBondContact O-N 3.33Å; I250-C254 PolarHBondContact O-N 3.14Å; I250-C254 PolarHBondContact O-SG 3.38Å; I250-Y273 HydrophobicContact CB-CG 4.42Å; I250-Y273 HydrophobicContact CD1-CG 4.42Å; I250-Y273 HydrophobicContact CG1-CD1 4.11Å; I250-Y273 HydrophobicContact CG1-CG 4.14Å; I250-Y273 HydrophobicContact CG2-CD1 4.5Å; I250-I277 HydrophobicContact CD1-CD1 3.5Å; I250-I277 HydrophobicContact CD1-CG1 3.51Å
251	D	97.6	Very high	97.8	Very high	67 Å²	67	61.7 Å²	61.7	36%	0.358	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-48.6	174	42.6	-37.3	0	0	0	112.5	K218 I249 C253 C254 M255	K218-D251 IonicContact NZ-OD1 2.75Å; K218-D251 PolarHBondContact NZ-OD1 3.29Å; K218-D251 IonicContact NZ-OD2 2.69Å; K218-D251 PolarHBondContact NZ-OD2 3.48Å; I249-D251 VanDerWaalsContact C-N 3.28Å; I249-D251 VanDerWaalsContact CB-OD1 3.28Å; I249-D251 WeakPolarHBondContact CB-OD1 3.43Å; I249-D251 WeakPolarHBondContact CD1-OD1 3.28Å; I249-D251 WeakPolarHBondContact CG1-OD1 3.22Å; I249-D251 PolarHBondContact O-N 2.86Å; D251-C253 VanDerWaalsContact C-N 3.33Å; D251-C254 PolarHBondContact O-N 3.18Å; D251-M255 WeakPolarHBondContact O-CG 3.33Å; D251-M255 PolarHBondContact O-N 2.88Å
252	N	98.1	Very high	97.8	Very high	58 Å²	58	62 Å²	62	31%	0.31	30%	0.302	S	S	.	.	H	α-helix	trans	-67.2	-37.4	174.6	-172.5	34.6	0	0	0	110.9	M248 I249 C254 M255 Q256	M248-N252 HydrophobicContact CG-CB 4.25Å; I249-N252 HydrophobicContact CD1-CB 4.37Å; I249-N252 HydrophobicContact CG1-CB 3.7Å; I249-N252 PolarHBondContact O-N 2.9Å; N252-C254 PolarHBondContact O-N 2.82Å; N252-M255 PolarHBondContact O-N 3.5Å; N252-M255 VanDerWaalsContact O-N 3.16Å; N252-Q256 WeakPolarHBondContact O-CB 3.29Å; N252-Q256 VanDerWaalsContact O-CG 3.27Å; N252-Q256 WeakPolarHBondContact O-CG 3.49Å; N252-Q256 PolarHBondContact O-N 3.19Å; N252-Q256 PolarHBondContact OD1-NE2 2.88Å
253	C	98.4	Very high	97.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57	-48.3	176.1	-173.2	0	0	0	0	111.8	V216 M248 I249 I250 D251 M255 Q256 L257	V216-C253 HydrophobicContact CG1-CB 3.87Å; V216-C253 HydrophobicContact CG2-CB 4.45Å; M248-C253 HydrophobicContact CG-CB 4.09Å; M248-C253 WeakPolarHBondContact SD-CA 3.28Å; M248-C253 HydrophobicContact SD-CB 3.84Å; I249-C253 PolarHBondContact O-N 3Å; I250-C253 WeakPolarHBondContact O-CB 3.24Å; I250-C253 PolarHBondContact O-N 3.33Å; D251-C253 VanDerWaalsContact C-N 3.33Å; C253-M255 PolarHBondContact O-N 2.86Å; C253-Q256 PolarHBondContact O-N 3.36Å; C253-L257 WeakPolarHBondContact O-CB 3.19Å; C253-L257 WeakPolarHBondContact O-CG 3.47Å; C253-L257 PolarHBondContact O-N 3.24Å
254	C	98.2	Very high	97.8	Very high	33 Å²	33	54.8 Å²	54.8	22%	0.223	27%	0.271	C	S	.	.	H	α-helix	trans	-58.4	-45	174.5	-69.3	0	0	0	0	112.2	I250 D251 N252 V258 I277 L280	I250-C254 PolarHBondContact O-N 3.14Å; I250-C254 PolarHBondContact O-SG 3.38Å; D251-C254 PolarHBondContact O-N 3.18Å; N252-C254 PolarHBondContact O-N 2.82Å; C254-V258 WeakPolarHBondContact O-CG2 3.12Å; C254-V258 PolarHBondContact O-N 3.02Å; C254-I277 VanDerWaalsContact SG-CD1 3.57Å; C254-L280 HydrophobicContact CB-CD1 4.03Å
255	M	97.7	Very high	97.8	Very high	106 Å²	106	50.2 Å²	50.2	52%	0.522	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-47.3	177	-70.1	179.2	63.2	0	0	111.7	D251 N252 C253 V258 Q259	D251-M255 WeakPolarHBondContact O-CG 3.33Å; D251-M255 PolarHBondContact O-N 2.88Å; N252-M255 PolarHBondContact O-N 3.5Å; N252-M255 VanDerWaalsContact O-N 3.16Å; C253-M255 PolarHBondContact O-N 2.86Å; M255-V258 PolarHBondContact O-N 3.37Å; M255-Q259 WeakPolarHBondContact O-CB 2.99Å; M255-Q259 VanDerWaalsContact O-CG 3.28Å; M255-Q259 WeakPolarHBondContact O-CG 3.49Å; M255-Q259 PolarHBondContact O-N 3.44Å
256	Q	98	Very high	97.8	Very high	43 Å²	43	47.9 Å²	47.9	20%	0.201	24%	0.242	C	C	.	.	H	α-helix	trans	-67.8	-35.5	-178.3	-70.1	-56.8	-35.8	0	0	112.5	M248 N252 C253 V258 Q259 N260 F264	M248-Q256 HydrophobicContact CE-CG 4.44Å; M248-Q256 HydrophobicContact SD-CB 4.38Å; M248-Q256 HydrophobicContact SD-CG 4.22Å; N252-Q256 WeakPolarHBondContact O-CB 3.29Å; N252-Q256 VanDerWaalsContact O-CG 3.27Å; N252-Q256 WeakPolarHBondContact O-CG 3.49Å; N252-Q256 PolarHBondContact O-N 3.19Å; N252-Q256 PolarHBondContact OD1-NE2 2.88Å; C253-Q256 PolarHBondContact O-N 3.36Å; Q256-V258 VanDerWaalsContact C-N 3.26Å; Q256-V258 PolarHBondContact O-N 3.26Å; Q256-Q259 PolarHBondContact O-N 3.18Å; Q256-N260 CarbonylContact O-C 3.08Å; Q256-N260 WeakPolarHBondContact O-CA 3.23Å; Q256-N260 PolarHBondContact O-N 3.21Å; Q256-F264 HydrophobicContact CB-CE2 3.86Å; Q256-F264 HydrophobicContact CB-CZ 3.68Å
257	L	97.4	Very high	97.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-33.1	175.2	-81.5	165.2	0	0	0	112.2	L160 C253 P261 F264 I277 L280 L284	L160-L257 HydrophobicContact CD2-CD2 4.08Å; C253-L257 WeakPolarHBondContact O-CB 3.19Å; C253-L257 WeakPolarHBondContact O-CG 3.47Å; C253-L257 PolarHBondContact O-N 3.24Å; L257-P261 VanDerWaalsContact O-CB 3.24Å; L257-P261 WeakPolarHBondContact O-CB 3.17Å; L257-P261 VanDerWaalsContact O-CD 3.29Å; L257-P261 WeakPolarHBondContact O-CD 3.3Å; L257-P261 WeakPolarHBondContact O-CG 3.46Å; L257-F264 HydrophobicContact CB-CE2 4.42Å; L257-F264 HydrophobicContact CD2-CD2 3.53Å; L257-F264 HydrophobicContact CD2-CE2 3.74Å; L257-F264 HydrophobicContact CD2-CG 4.28Å; L257-F264 HydrophobicContact CG-CD2 4.03Å; L257-F264 HydrophobicContact CG-CE2 3.68Å; L257-F264 HydrophobicContact CG-CZ 4.28Å; L257-I277 HydrophobicContact CD1-CD1 3.7Å; L257-I277 HydrophobicContact CD1-CG2 3.8Å; L257-L280 HydrophobicContact CB-CD2 3.66Å; L257-L280 HydrophobicContact CD1-CD2 4.07Å; L257-L280 HydrophobicContact CG-CD2 4.44Å; L257-L284 HydrophobicContact CB-CD1 4.4Å; L257-L284 WeakPolarHBondContact O-CD1 3.38Å
258	V	96.1	Very high	97.8	Very high	73 Å²	73	42.4 Å²	42.4	44%	0.442	21%	0.212	S	C	.	.	H	α-helix	trans	-83.9	-35.1	176.5	179.6	0	0	0	0	111.6	H155 C254 M255 Q256 L280	H155-V258 PolarHBondContact CE1-O 3.27Å; H155-V258 PolarHBondContact NE2-O 3.19Å; H155-V258 VanDerWaalsContact NE2-O 3.09Å; C254-V258 WeakPolarHBondContact O-CG2 3.12Å; C254-V258 PolarHBondContact O-N 3.02Å; M255-V258 PolarHBondContact O-N 3.37Å; Q256-V258 VanDerWaalsContact C-N 3.26Å; Q256-V258 PolarHBondContact O-N 3.26Å; V258-L280 HydrophobicContact CG2-CD2 4.33Å
259	Q	96.8	Very high	97.8	Very high	124 Å²	124	41.4 Å²	41.4	58%	0.579	21%	0.207	S	C	*	.	H	α-helix	trans	-81.9	-50.4	-176.5	-71.6	177.9	-7.8	0	0	112.9	M255 Q256	M255-Q259 WeakPolarHBondContact O-CB 2.99Å; M255-Q259 VanDerWaalsContact O-CG 3.28Å; M255-Q259 WeakPolarHBondContact O-CG 3.49Å; M255-Q259 PolarHBondContact O-N 3.44Å; Q256-Q259 PolarHBondContact O-N 3.18Å
260	N	96.9	Very high	97.8	Very high	74 Å²	74	39.2 Å²	39.2	40%	0.396	20%	0.197	S	C	.	.			trans	-146.9	73.6	-177	-177.7	24.3	0	0	0	111.3	Q256 Y262 Q263	Q256-N260 CarbonylContact O-C 3.08Å; Q256-N260 WeakPolarHBondContact O-CA 3.23Å; Q256-N260 PolarHBondContact O-N 3.21Å; N260-Y262 PolarHBondContact O-N 3.32Å; N260-Y262 WeakPolarHBondContact OD1-CD2 3.28Å; N260-Q263 WeakPolarHBondContact O-CG 3.34Å; N260-Q263 PolarHBondContact O-NE2 3.19Å
261	P	97.1	Very high	97.7	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-65.6	-18.5	-178.2	21.3	-30.6	0	0	0	114.6	H155 L158 L257 Q263 F264 L284	H155-P261 HydrophobicContact CB-CG 4.08Å; L158-P261 HydrophobicContact CD1-CB 4.2Å; L158-P261 HydrophobicContact CD1-CG 4.09Å; L158-P261 HydrophobicContact CD2-CB 3.82Å; L158-P261 HydrophobicContact CD2-CG 3.64Å; L257-P261 VanDerWaalsContact O-CB 3.24Å; L257-P261 WeakPolarHBondContact O-CB 3.17Å; L257-P261 VanDerWaalsContact O-CD 3.29Å; L257-P261 WeakPolarHBondContact O-CD 3.3Å; L257-P261 WeakPolarHBondContact O-CG 3.46Å; P261-Q263 PolarHBondContact O-N 3.43Å; P261-Q263 VanDerWaalsContact O-N 3.13Å; P261-F264 WeakPolarHBondContact O-CD2 3.16Å; P261-F264 PolarHBondContact O-N 2.96Å; P261-F264 VanDerWaalsContact O-N 3.17Å; P261-L284 HydrophobicContact CB-CD1 4.16Å
262	Y	97.6	Very high	97.6	Very high	125 Å²	125	38 Å²	38	49%	0.49	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-65.2	-15.6	-177.6	-55.4	-77.8	0	0	0	114.3	N156 L158 N260 F264	N156-Y262 PolarHBondContact N-OH 2.56Å; N156-Y262 WeakPolarHBondContact O-CE1 3.29Å; N156-Y262 PolarHBondContact O-OH 2.7Å; L158-Y262 HydrophobicContact CD2-CD1 3.66Å; L158-Y262 HydrophobicContact CD2-CE1 3.45Å; L158-Y262 VanDerWaalsContact CD2-CE1 3.45Å; L158-Y262 HydrophobicContact CD2-CG 4.28Å; L158-Y262 HydrophobicContact CG-CE1 4.5Å; N260-Y262 PolarHBondContact O-N 3.32Å; N260-Y262 WeakPolarHBondContact OD1-CD2 3.28Å; Y262-F264 VanDerWaalsContact C-N 3.26Å; Y262-F264 PolarHBondContact O-N 2.73Å
263	Q	97.1	Very high	97.5	Very high	57 Å²	57	36 Å²	36	27%	0.266	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-75	-16.1	177.5	75.1	-170.1	-76.8	0	0	112.9	K212 N260 P261	K212-Q263 WeakPolarHBondContact CE-O 3.2Å; K212-Q263 PolarHBondContact NZ-O 3.02Å; N260-Q263 WeakPolarHBondContact O-CG 3.34Å; N260-Q263 PolarHBondContact O-NE2 3.19Å; P261-Q263 PolarHBondContact O-N 3.43Å; P261-Q263 VanDerWaalsContact O-N 3.13Å
264	F	98.2	Very high	97.3	Very high	10 Å²	10	36 Å²	36	4%	0.044	18%	0.178	C	C	.	.			trans	-91.5	146	-176	-62.9	-72.7	0	0	0	111.9	L160 M248 Q256 L257 P261 Y262 L267	L160-F264 HydrophobicContact CB-CB 4.32Å; L160-F264 HydrophobicContact CD2-CB 4.49Å; M248-F264 HydrophobicContact CE-CE1 3.93Å; M248-F264 HydrophobicContact CE-CZ 4.1Å; M248-F264 HydrophobicContact SD-CE1 3.89Å; M248-F264 HydrophobicContact SD-CZ 3.83Å; Q256-F264 HydrophobicContact CB-CE2 3.86Å; Q256-F264 HydrophobicContact CB-CZ 3.68Å; L257-F264 HydrophobicContact CB-CE2 4.42Å; L257-F264 HydrophobicContact CD2-CD2 3.53Å; L257-F264 HydrophobicContact CD2-CE2 3.74Å; L257-F264 HydrophobicContact CD2-CG 4.28Å; L257-F264 HydrophobicContact CG-CD2 4.03Å; L257-F264 HydrophobicContact CG-CE2 3.68Å; L257-F264 HydrophobicContact CG-CZ 4.28Å; P261-F264 WeakPolarHBondContact O-CD2 3.16Å; P261-F264 PolarHBondContact O-N 2.96Å; P261-F264 VanDerWaalsContact O-N 3.17Å; Y262-F264 VanDerWaalsContact C-N 3.26Å; Y262-F264 PolarHBondContact O-N 2.73Å; F264-L267 HydrophobicContact CB-CD1 4.01Å; F264-L267 HydrophobicContact CD1-CD1 4.47Å; F264-L267 HydrophobicContact CD1-CD2 3.7Å; F264-L267 HydrophobicContact CD1-CG 4.13Å; F264-L267 HydrophobicContact CE1-CD2 4.03Å; F264-L267 HydrophobicContact CG-CD1 4.42Å; F264-L267 HydrophobicContact CG-CD2 4.24Å
265	D	98.4	Very high	97.1	Very high	29 Å²	29	36.6 Å²	36.6	16%	0.155	18%	0.179	C	C	.	.	S	Bend	trans	-124	-87	176.1	-167	19.8	0	0	0	108.6	L160 V161 R210 G211 K212	L160-D265 CarbonylContact C-O 3.54Å; L160-D265 WeakPolarHBondContact CA-O 3.48Å; V161-D265 PolarHBondContact N-O 3.2Å; R210-D265 WeakPolarHBondContact CB-OD2 3.45Å; R210-D265 WeakPolarHBondContact CD-OD1 3.24Å; R210-D265 IonicContact CZ-OD1 2.87Å; R210-D265 IonicContact NE-OD1 2.7Å; R210-D265 IonicContact NH1-OD1 2.96Å; R210-D265 PolarHBondContact NH1-OD1 3.05Å; G211-D265 PolarHBondContact N-OD2 3.44Å; K212-D265 HydrophobicContact CB-CB 4.01Å; K212-D265 PolarHBondContact N-OD2 3Å; K212-D265 VanDerWaalsContact N-OD2 3.1Å
266	V	98.8	Very high	97	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.5	169.5	-177.8	0	0	0	0	110	V161 I163 Y204 A205 R210 K212 V213 T214	V161-V266 HydrophobicContact CB-CG2 4.42Å; V161-V266 CarbonylContact O-C 3.56Å; V161-V266 WeakPolarHBondContact O-CA 3.33Å; I163-V266 HydrophobicContact CD1-CG1 3.66Å; I163-V266 HydrophobicContact CG1-CG1 4.16Å; Y204-V266 HydrophobicContact CD1-CG2 4.43Å; A205-V266 HydrophobicContact CB-CG2 4.13Å; R210-V266 HydrophobicContact CB-CG2 3.86Å; R210-V266 HydrophobicContact CG-CG2 3.8Å; K212-V266 WeakPolarHBondContact O-CB 3.35Å; K212-V266 PolarHBondContact O-N 3.42Å; V213-V266 CarbonylContact C-O 3.34Å; V213-V266 VanDerWaalsContact CA-O 3.32Å; V213-V266 WeakPolarHBondContact CA-O 3.34Å; V213-V266 HydrophobicContact CG2-CB 4.07Å; V213-V266 HydrophobicContact CG2-CG1 4.27Å; T214-V266 PolarHBondContact N-O 3.07Å
267	L	98.8	Very high	96.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	135	171.4	-54.7	94.9	0	0	0	109.8	L160 V161 I162 I163 T214 V216 F264 M269	L160-L267 HydrophobicContact CB-CD1 4.46Å; L160-L267 HydrophobicContact CD1-CD1 3.82Å; V161-L267 PolarHBondContact O-N 3.25Å; I162-L267 HydrophobicContact CG1-CD1 4.21Å; I163-L267 PolarHBondContact N-O 3.01Å; T214-L267 CarbonylContact O-C 3.49Å; T214-L267 WeakPolarHBondContact O-CA 3.38Å; V216-L267 HydrophobicContact CG2-CB 4.35Å; V216-L267 HydrophobicContact CG2-CD2 3.88Å; F264-L267 HydrophobicContact CB-CD1 4.01Å; F264-L267 HydrophobicContact CD1-CD1 4.47Å; F264-L267 HydrophobicContact CD1-CD2 3.7Å; F264-L267 HydrophobicContact CD1-CG 4.13Å; F264-L267 HydrophobicContact CE1-CD2 4.03Å; F264-L267 HydrophobicContact CG-CD1 4.42Å; F264-L267 HydrophobicContact CG-CD2 4.24Å; L267-M269 HydrophobicContact CB-CE 3.51Å; L267-M269 HydrophobicContact CD2-CE 4.3Å
268	V	98.8	Very high	96.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134.7	174.3	64.1	0	0	0	0	110.4	I163 I197 A201 V213 T214 A215 V216 F229	I163-V268 HydrophobicContact CG2-CG2 4.4Å; I163-V268 VanDerWaalsContact O-CA 3.3Å; I163-V268 WeakPolarHBondContact O-CA 3.41Å; I197-V268 HydrophobicContact CG1-CG2 4.1Å; A201-V268 HydrophobicContact CB-CB 3.76Å; A201-V268 HydrophobicContact CB-CG1 4.38Å; A201-V268 HydrophobicContact CB-CG2 3.79Å; V213-V268 HydrophobicContact CG1-CG1 3.82Å; T214-V268 PolarHBondContact O-N 2.88Å; A215-V268 WeakPolarHBondContact CA-O 3.31Å; A215-V268 HydrophobicContact CB-CG1 4.13Å; V216-V268 PolarHBondContact N-O 3.09Å; F229-V268 HydrophobicContact CZ-CG2 4.31Å
269	M	98.4	Very high	96.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	159.3	-174.6	63.5	-162.7	78.5	0	0	115.2	I162 I163 E165 V216 L267 G274 I277	I162-M269 HydrophobicContact CG2-CE 3.85Å; I162-M269 HydrophobicContact CG2-SD 4.35Å; I163-M269 PolarHBondContact O-N 2.83Å; E165-M269 PolarHBondContact N-O 2.89Å; V216-M269 HydrophobicContact CB-CB 3.98Å; V216-M269 HydrophobicContact CB-CE 4.12Å; V216-M269 HydrophobicContact CB-SD 4.41Å; V216-M269 HydrophobicContact CG2-CE 3.85Å; L267-M269 HydrophobicContact CB-CE 3.51Å; L267-M269 HydrophobicContact CD2-CE 4.3Å; M269-G274 VanDerWaalsContact CG-CA 3.5Å; M269-G274 WeakPolarHBondContact SD-CA 3.46Å; M269-G274 PolarHBondContact SD-N 2.82Å; M269-I277 HydrophobicContact CE-CB 4.25Å; M269-I277 HydrophobicContact CE-CG1 4.33Å; M269-I277 HydrophobicContact CE-CG2 4.08Å; M269-I277 HydrophobicContact SD-CB 3.85Å; M269-I277 HydrophobicContact SD-CG1 3.81Å; M269-I277 HydrophobicContact SD-CG2 4.35Å
270	P	97.9	Very high	96.5	Very high	7 Å²	7	28.6 Å²	28.6	5%	0.045	14%	0.14	C	C	.	.			trans	-60.1	164.3	167.8	-22.1	33.4	0	0	0	113.3	V216 F229 L272 Y273 G274	V216-P270 WeakPolarHBondContact O-CD 3.35Å; F229-P270 HydrophobicContact CB-CG 4.41Å; F229-P270 HydrophobicContact CD1-CG 3.88Å; F229-P270 HydrophobicContact CD2-CG 4.01Å; F229-P270 HydrophobicContact CE1-CG 4.15Å; F229-P270 HydrophobicContact CE2-CG 4.26Å; F229-P270 HydrophobicContact CG-CG 3.82Å; F229-P270 HydrophobicContact CZ-CG 4.33Å; P270-L272 PolarHBondContact O-N 3.37Å; P270-Y273 HydrophobicContact CB-CD2 4.26Å; P270-Y273 HydrophobicContact CB-CE2 4.35Å; P270-Y273 HydrophobicContact CG-CD2 4.13Å; P270-Y273 HydrophobicContact CG-CE2 4.16Å; P270-Y273 PolarHBondContact O-N 2.86Å; P270-G274 PolarHBondContact O-N 3.29Å
271	N	95.8	Very high	96.4	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-56	-51.4	-166.2	-159.2	-20	0	0	0	115.6	R164 E165 Q166 E168 Y171 Y273 G274 N275	R164-N271 PolarHBondContact NE-O 2.93Å; R164-N271 PolarHBondContact NE-OD1 3.05Å; R164-N271 PolarHBondContact NH2-O 3.21Å; R164-N271 PolarHBondContact NH2-OD1 3.15Å; E165-N271 WeakPolarHBondContact O-CA 3.43Å; E165-N271 WeakPolarHBondContact O-CB 3.37Å; E165-N271 PolarHBondContact O-OD1 3.23Å; Q166-N271 PolarHBondContact O-ND2 2.94Å; E168-N271 VanDerWaalsContact O-CB 3.23Å; E168-N271 WeakPolarHBondContact O-CB 3.38Å; E168-N271 PolarHBondContact O-ND2 2.9Å; Y171-N271 WeakPolarHBondContact CB-ND2 3.27Å; Y171-N271 HydrophobicContact CD2-CB 3.95Å; Y171-N271 WeakPolarHBondContact CD2-OD1 3.39Å; N271-Y273 PolarHBondContact O-N 2.85Å; N271-G274 PolarHBondContact O-N 3.16Å; N271-N275 PolarHBondContact O-N 2.94Å
272	L	95.4	Very high	96.3	Very high	57 Å²	57	25.1 Å²	25.1	30%	0.298	12%	0.122	S	C	.	.	H	α-helix	trans	-64.5	-42.8	-178.6	-179.6	62.3	0	0	0	113.3	E170 Y171 P270 G274 N275 I276	E170-L272 HydrophobicContact CB-CB 4.21Å; E170-L272 HydrophobicContact CB-CD2 4.27Å; E170-L272 HydrophobicContact CG-CB 4.05Å; E170-L272 HydrophobicContact CG-CD2 3.75Å; E170-L272 WeakPolarHBondContact OE2-CB 3.36Å; Y171-L272 HydrophobicContact CE2-CB 4.36Å; Y171-L272 HydrophobicContact CE2-CD1 4.23Å; P270-L272 PolarHBondContact O-N 3.37Å; L272-G274 VanDerWaalsContact C-N 3.31Å; L272-G274 PolarHBondContact O-N 3.43Å; L272-N275 WeakPolarHBondContact O-CB 3.29Å; L272-N275 PolarHBondContact O-N 3.43Å; L272-I276 HydrophobicContact CD1-CD1 4.43Å; L272-I276 HydrophobicContact CG-CD1 4.22Å; L272-I276 WeakPolarHBondContact O-CG1 3.47Å; L272-I276 PolarHBondContact O-N 2.97Å
273	Y	96.3	Very high	96	Very high	16 Å²	16	21.7 Å²	21.7	6%	0.063	12%	0.124	C	C	.	.	H	α-helix	trans	-67.7	-37.6	-179.4	-50.1	-31.4	0	0	0	111.2	K187 M222 D226 I250 P270 N271 N275 I276 I277	K187-Y273 PolarHBondContact NZ-OH 3.39Å; M222-Y273 WeakPolarHBondContact CE-OH 3.37Å; D226-Y273 VanDerWaalsContact OD2-CE2 3.23Å; D226-Y273 WeakPolarHBondContact OD2-CE2 3.34Å; D226-Y273 PolarHBondContact OD2-OH 3.44Å; I250-Y273 HydrophobicContact CB-CG 4.42Å; I250-Y273 HydrophobicContact CD1-CG 4.42Å; I250-Y273 HydrophobicContact CG1-CD1 4.11Å; I250-Y273 HydrophobicContact CG1-CG 4.14Å; I250-Y273 HydrophobicContact CG2-CD1 4.5Å; P270-Y273 HydrophobicContact CB-CD2 4.26Å; P270-Y273 HydrophobicContact CB-CE2 4.35Å; P270-Y273 HydrophobicContact CG-CD2 4.13Å; P270-Y273 HydrophobicContact CG-CE2 4.16Å; P270-Y273 PolarHBondContact O-N 2.86Å; N271-Y273 PolarHBondContact O-N 2.85Å; Y273-N275 VanDerWaalsContact C-N 3.32Å; Y273-N275 PolarHBondContact O-N 3.36Å; Y273-I276 PolarHBondContact O-N 3.49Å; Y273-I276 VanDerWaalsContact O-N 3.15Å; Y273-I277 WeakPolarHBondContact O-CB 3.26Å; Y273-I277 WeakPolarHBondContact O-CG1 3.44Å; Y273-I277 PolarHBondContact O-N 3.32Å
274	G	94.6	Very high	95.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-52.1	-53	172.2	0	0	0	0	0	111.1	M269 P270 N271 L272 I276 I277 D278	M269-G274 VanDerWaalsContact CG-CA 3.5Å; M269-G274 WeakPolarHBondContact SD-CA 3.46Å; M269-G274 PolarHBondContact SD-N 2.82Å; P270-G274 PolarHBondContact O-N 3.29Å; N271-G274 PolarHBondContact O-N 3.16Å; L272-G274 VanDerWaalsContact C-N 3.31Å; L272-G274 PolarHBondContact O-N 3.43Å; G274-I276 VanDerWaalsContact C-N 3.28Å; G274-I276 PolarHBondContact O-N 2.91Å; G274-I277 PolarHBondContact O-N 2.94Å; G274-D278 WeakPolarHBondContact O-CB 3.16Å; G274-D278 PolarHBondContact O-N 2.83Å
275	N	92.6	Very high	95.6	Very high	46 Å²	46	19.5 Å²	19.5	25%	0.246	12%	0.115	C	C	.	.	H	α-helix	trans	-56.7	-41	179.4	-157.9	58.7	0	0	0	113.5	R164 Y171 N271 L272 Y273 N279	R164-N275 VanDerWaalsContact NH1-CA 3.32Å; R164-N275 VanDerWaalsContact NH1-CB 3.3Å; R164-N275 PolarHBondContact NH1-OD1 3.04Å; Y171-N275 PolarHBondContact OH-ND2 3.35Å; N271-N275 PolarHBondContact O-N 2.94Å; L272-N275 WeakPolarHBondContact O-CB 3.29Å; L272-N275 PolarHBondContact O-N 3.43Å; Y273-N275 VanDerWaalsContact C-N 3.32Å; Y273-N275 PolarHBondContact O-N 3.36Å; N275-N279 PolarHBondContact O-N 3.34Å; N275-N279 PolarHBondContact O-ND2 2.91Å
276	I	95.3	Very high	95.1	Very high	78 Å²	78	18.5 Å²	18.5	40%	0.4	11%	0.112	S	C	.	.	H	α-helix	trans	-69.3	-48.4	-179.2	-65	167.2	0	0	0	110.1	L272 Y273 G274 N279 L280	L272-I276 HydrophobicContact CD1-CD1 4.43Å; L272-I276 HydrophobicContact CG-CD1 4.22Å; L272-I276 WeakPolarHBondContact O-CG1 3.47Å; L272-I276 PolarHBondContact O-N 2.97Å; Y273-I276 PolarHBondContact O-N 3.49Å; Y273-I276 VanDerWaalsContact O-N 3.15Å; G274-I276 VanDerWaalsContact C-N 3.28Å; G274-I276 PolarHBondContact O-N 2.91Å; I276-N279 PolarHBondContact O-N 3.42Å; I276-L280 WeakPolarHBondContact O-CB 3.47Å; I276-L280 PolarHBondContact O-N 3.34Å
277	I	96.5	Very high	94.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67.5	-38	-178.2	-65.7	-54.3	0	0	0	111.6	I162 I250 C254 L257 M269 Y273 G274 N279 L280 A281	I162-I277 HydrophobicContact CD1-CG2 3.71Å; I162-I277 HydrophobicContact CG1-CG2 4Å; I162-I277 HydrophobicContact CG2-CG2 4.45Å; I250-I277 HydrophobicContact CD1-CD1 3.5Å; I250-I277 HydrophobicContact CD1-CG1 3.51Å; C254-I277 VanDerWaalsContact SG-CD1 3.57Å; L257-I277 HydrophobicContact CD1-CD1 3.7Å; L257-I277 HydrophobicContact CD1-CG2 3.8Å; M269-I277 HydrophobicContact CE-CB 4.25Å; M269-I277 HydrophobicContact CE-CG1 4.33Å; M269-I277 HydrophobicContact CE-CG2 4.08Å; M269-I277 HydrophobicContact SD-CB 3.85Å; M269-I277 HydrophobicContact SD-CG1 3.81Å; M269-I277 HydrophobicContact SD-CG2 4.35Å; Y273-I277 WeakPolarHBondContact O-CB 3.26Å; Y273-I277 WeakPolarHBondContact O-CG1 3.44Å; Y273-I277 PolarHBondContact O-N 3.32Å; G274-I277 PolarHBondContact O-N 2.94Å; I277-N279 VanDerWaalsContact C-N 3.34Å; I277-N279 PolarHBondContact O-N 3.04Å; I277-L280 PolarHBondContact O-N 3.39Å; I277-A281 WeakPolarHBondContact O-CB 3.33Å; I277-A281 PolarHBondContact O-N 2.8Å
278	D	93.8	Very high	94.1	Very high	2 Å²	2	21 Å²	21	1%	0.011	13%	0.134	C	C	.	.	H	α-helix	trans	-55.7	-48.5	174.6	-71.2	-31.5	0	0	0	111.3	V143 I162 R164 G274 A282	V143-D278 WeakPolarHBondContact CG2-OD1 3.35Å; I162-D278 WeakPolarHBondContact CB-OD1 3.26Å; I162-D278 WeakPolarHBondContact CG2-OD1 3.41Å; R164-D278 IonicContact NH1-OD2 3.51Å; G274-D278 WeakPolarHBondContact O-CB 3.16Å; G274-D278 PolarHBondContact O-N 2.83Å; D278-A282 VanDerWaalsContact O-CB 3.3Å; D278-A282 WeakPolarHBondContact O-CB 3.46Å; D278-A282 PolarHBondContact O-N 3.43Å
279	N	93.2	Very high	93.7	Very high	51 Å²	51	22.1 Å²	22.1	27%	0.273	15%	0.146	S	C	.	.	H	α-helix	trans	-68.9	-42.6	180	-78.8	-79.8	0	0	0	112.3	N275 I276 I277 A282 G283 H309	N275-N279 PolarHBondContact O-N 3.34Å; N275-N279 PolarHBondContact O-ND2 2.91Å; I276-N279 PolarHBondContact O-N 3.42Å; I277-N279 VanDerWaalsContact C-N 3.34Å; I277-N279 PolarHBondContact O-N 3.04Å; N279-A282 PolarHBondContact O-N 3.48Å; N279-G283 PolarHBondContact O-N 3.2Å; N279-G283 VanDerWaalsContact O-N 3.15Å; N279-H309 PolarHBondContact OD1-NE2 3.32Å
280	L	95.4	Very high	93.3	Very high	47 Å²	47	22.3 Å²	22.3	25%	0.246	15%	0.147	C	C	.	.	H	α-helix	trans	-59.8	-50.3	176.4	-175.5	159.7	0	0	0	110.4	C254 L257 V258 I276 I277 A282 G283 L284	C254-L280 HydrophobicContact CB-CD1 4.03Å; L257-L280 HydrophobicContact CB-CD2 3.66Å; L257-L280 HydrophobicContact CD1-CD2 4.07Å; L257-L280 HydrophobicContact CG-CD2 4.44Å; V258-L280 HydrophobicContact CG2-CD2 4.33Å; I276-L280 WeakPolarHBondContact O-CB 3.47Å; I276-L280 PolarHBondContact O-N 3.34Å; I277-L280 PolarHBondContact O-N 3.39Å; L280-A282 PolarHBondContact O-N 2.92Å; L280-G283 WeakPolarHBondContact O-CA 3.48Å; L280-G283 PolarHBondContact O-N 3.49Å; L280-G283 VanDerWaalsContact O-N 3.12Å; L280-L284 HydrophobicContact CD2-CD1 4.1Å; L280-L284 HydrophobicContact CD2-CG 4.31Å; L280-L284 PolarHBondContact O-N 3.49Å
281	A	95.3	Very high	93.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-68.3	-35.2	-176.5	0	0	0	0	0	112.1	V145 L160 I162 I277 G283 L284	V145-A281 HydrophobicContact CB-CB 4.39Å; V145-A281 HydrophobicContact CG1-CB 4.01Å; V145-A281 WeakPolarHBondContact CG1-O 3.31Å; V145-A281 HydrophobicContact CG2-CB 3.81Å; L160-A281 HydrophobicContact CD1-CB 4.45Å; I162-A281 HydrophobicContact CD1-CB 3.62Å; I277-A281 WeakPolarHBondContact O-CB 3.33Å; I277-A281 PolarHBondContact O-N 2.8Å; A281-G283 VanDerWaalsContact C-N 3.28Å; A281-G283 PolarHBondContact O-N 2.89Å; A281-L284 WeakPolarHBondContact O-CB 3.33Å; A281-L284 PolarHBondContact O-N 3.02Å
282	A	93.6	Very high	93.2	Very high	2 Å²	2	22.7 Å²	22.7	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-59.2	-40.6	170.5	0	0	0	0	0	112	D278 N279 L280 L284 V285 G286 G287 V291 A307	D278-A282 VanDerWaalsContact O-CB 3.3Å; D278-A282 WeakPolarHBondContact O-CB 3.46Å; D278-A282 PolarHBondContact O-N 3.43Å; N279-A282 PolarHBondContact O-N 3.48Å; L280-A282 PolarHBondContact O-N 2.92Å; A282-L284 PolarHBondContact O-N 3.43Å; A282-V285 WeakPolarHBondContact O-CG2 3.47Å; A282-V285 PolarHBondContact O-N 3.32Å; A282-G286 PolarHBondContact O-N 3.28Å; A282-G287 VanDerWaalsContact O-CA 3.3Å; A282-G287 WeakPolarHBondContact O-CA 3.48Å; A282-G287 PolarHBondContact O-N 3.29Å; A282-V291 HydrophobicContact CB-CB 4.37Å; A282-V291 HydrophobicContact CB-CG2 3.8Å; A282-A307 HydrophobicContact CB-CB 4.19Å
283	G	92.9	Very high	93.2	Very high	52 Å²	52	20 Å²	20	54%	0.536	14%	0.135	S	C	.	.	H	α-helix	trans	-58.4	-30.8	173.4	0	0	0	0	0	114	N279 L280 A281 V285	N279-G283 PolarHBondContact O-N 3.2Å; N279-G283 VanDerWaalsContact O-N 3.15Å; L280-G283 WeakPolarHBondContact O-CA 3.48Å; L280-G283 PolarHBondContact O-N 3.49Å; L280-G283 VanDerWaalsContact O-N 3.12Å; A281-G283 VanDerWaalsContact C-N 3.28Å; A281-G283 PolarHBondContact O-N 2.89Å; G283-V285 VanDerWaalsContact C-N 3.35Å; G283-V285 PolarHBondContact O-N 2.87Å
284	L	93.4	Very high	93.3	Very high	20 Å²	20	20.2 Å²	20.2	11%	0.105	14%	0.137	C	C	.	.	H	α-helix	trans	-70.7	-28.5	179.7	-57.1	177.9	0	0	0	113.2	T153 L158 L257 P261 L280 A281 A282	T153-L284 WeakPolarHBondContact CB-O 3.48Å; T153-L284 PolarHBondContact OG1-O 3.31Å; L158-L284 HydrophobicContact CD1-CB 3.83Å; L158-L284 HydrophobicContact CD1-CD1 4.33Å; L257-L284 HydrophobicContact CB-CD1 4.4Å; L257-L284 WeakPolarHBondContact O-CD1 3.38Å; P261-L284 HydrophobicContact CB-CD1 4.16Å; L280-L284 HydrophobicContact CD2-CD1 4.1Å; L280-L284 HydrophobicContact CD2-CG 4.31Å; L280-L284 PolarHBondContact O-N 3.49Å; A281-L284 WeakPolarHBondContact O-CB 3.33Å; A281-L284 PolarHBondContact O-N 3.02Å; A282-L284 PolarHBondContact O-N 3.43Å
285	V	92.8	Very high	93.4	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-108.6	3.5	-172.3	-62.2	0	0	0	0	114.9	V145 L158 A282 G283 V290 V291	V145-V285 HydrophobicContact CG1-CB 4.32Å; V145-V285 HydrophobicContact CG1-CG1 3.55Å; V145-V285 HydrophobicContact CG1-CG2 3.77Å; L158-V285 HydrophobicContact CB-CG1 4.1Å; L158-V285 HydrophobicContact CD1-CG1 4.01Å; A282-V285 WeakPolarHBondContact O-CG2 3.47Å; A282-V285 PolarHBondContact O-N 3.32Å; G283-V285 VanDerWaalsContact C-N 3.35Å; G283-V285 PolarHBondContact O-N 2.87Å; V285-V290 HydrophobicContact CG2-CG2 4.36Å; V285-V291 HydrophobicContact CG2-CG2 3.51Å
286	G	88.1	Confident	93.6	Very high	9 Å²	9	20 Å²	20	9%	0.093	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	129.3	0.9	174.6	0	0	0	0	0	115	A282	A282-G286 PolarHBondContact O-N 3.28Å
287	G	89.4	Confident	93.7	Very high	20 Å²	20	17.2 Å²	17.2	21%	0.206	12%	0.12	C	C	.	.			trans	102.5	-174.5	175.3	0	0	0	0	0	114.1	A282 G289 V290	A282-G287 VanDerWaalsContact O-CA 3.3Å; A282-G287 WeakPolarHBondContact O-CA 3.48Å; A282-G287 PolarHBondContact O-N 3.29Å; G287-G289 VanDerWaalsContact C-N 3.26Å; G287-G289 PolarHBondContact O-N 3.08Å; G287-V290 VanDerWaalsContact O-CG2 3.3Å; G287-V290 WeakPolarHBondContact O-CG2 3.45Å; G287-V290 PolarHBondContact O-N 3.22Å
288	A	87.1	Confident	93.6	Very high	33 Å²	33	21.6 Å²	21.6	27%	0.273	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-61.1	-32	-173.4	0	0	0	0	0	114.2	V290 A307	A288-V290 PolarHBondContact O-N 2.98Å; A288-V290 VanDerWaalsContact O-N 3.15Å; A288-A307 HydrophobicContact CB-CB 3.45Å; A288-A307 VanDerWaalsContact CB-CB 3.45Å
289	G	89.3	Confident	93.7	Very high	23 Å²	23	27.6 Å²	27.6	24%	0.237	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-72.2	-2.6	-174.4	0	0	0	0	0	115.6	G287 T323 A324	G287-G289 VanDerWaalsContact C-N 3.26Å; G287-G289 PolarHBondContact O-N 3.08Å; G289-T323 WeakPolarHBondContact O-CB 3.33Å; G289-A324 VanDerWaalsContact C-CB 3.48Å; G289-A324 WeakPolarHBondContact O-CB 3.27Å; G289-A324 PolarHBondContact O-N 3.21Å
290	V	91.7	Very high	93.9	Very high	4 Å²	4	27 Å²	27	2%	0.024	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-121.7	-9.7	-176.9	-60.5	0	0	0	0	115	L148 Y151 V285 G287 A288 T323	L148-V290 HydrophobicContact CD1-CB 3.93Å; L148-V290 HydrophobicContact CD1-CG1 4.41Å; Y151-V290 HydrophobicContact CD2-CG1 4.28Å; Y151-V290 HydrophobicContact CE1-CG1 4.3Å; Y151-V290 HydrophobicContact CE2-CG1 3.53Å; Y151-V290 WeakPolarHBondContact OH-CG1 3.48Å; V285-V290 HydrophobicContact CG2-CG2 4.36Å; G287-V290 VanDerWaalsContact O-CG2 3.3Å; G287-V290 WeakPolarHBondContact O-CG2 3.45Å; G287-V290 PolarHBondContact O-N 3.22Å; A288-V290 PolarHBondContact O-N 2.98Å; A288-V290 VanDerWaalsContact O-N 3.15Å; V290-T323 HydrophobicContact CB-CG2 4.26Å; V290-T323 HydrophobicContact CG1-CG2 4.16Å
291	V	94.5	Very high	94	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.012	17%	0.168	C	C	.	.			trans	-100	119.4	-174.1	-176.3	0	0	0	0	110.6	V143 V145 A282 V285 G306 A324	V143-V291 HydrophobicContact CG1-CG1 3.36Å; V145-V291 HydrophobicContact CG2-CG1 4.25Å; A282-V291 HydrophobicContact CB-CB 4.37Å; A282-V291 HydrophobicContact CB-CG2 3.8Å; V285-V291 HydrophobicContact CG2-CG2 3.51Å; V291-G306 PolarHBondContact O-N 3.41Å; V291-A324 WeakPolarHBondContact O-CB 3.43Å
292	P	96	Very high	94.1	Very high	14 Å²	14	25 Å²	25	9%	0.091	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	153	173.7	33.4	-34.6	0	0	0	111.9	L327 S328	P292-L327 HydrophobicContact CB-CB 3.94Å; P292-L327 HydrophobicContact CG-CB 4.05Å; P292-S328 VanDerWaalsContact CA-OG 3.26Å; P292-S328 WeakPolarHBondContact CA-OG 3.46Å; P292-S328 WeakPolarHBondContact CB-OG 3.48Å
293	G	95.9	Very high	94.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.2	178.2	0	0	0	0	0	111.9	E304 S328	G293-E304 CarbonylContact C-O 3.6Å; G293-E304 WeakPolarHBondContact CA-O 3.27Å; G293-E304 PolarHBondContact N-O 2.61Å; G293-E304 PolarHBondContact O-N 2.81Å; G293-S328 PolarHBondContact N-OG 3.09Å
294	E	97	Very high	94.4	Very high	21 Å²	21	22.7 Å²	22.7	10%	0.098	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.8	-178.3	-55.2	170.3	-171.9	0	0	108.4	N141 V142 Y296 V302 F303 N331	N141-E294 CarbonylContact C-O 3.56Å; N141-E294 VanDerWaalsContact CA-O 3.31Å; N141-E294 WeakPolarHBondContact CA-O 3.46Å; N141-E294 PolarHBondContact ND2-O 3.04Å; V142-E294 HydrophobicContact CB-CB 4.37Å; V142-E294 PolarHBondContact N-O 3.45Å; V142-E294 PolarHBondContact O-N 3.19Å; E294-Y296 HydrophobicContact CB-CD2 4.33Å; E294-Y296 HydrophobicContact CB-CE2 3.55Å; E294-Y296 WeakPolarHBondContact OE2-CE2 3.11Å; E294-Y296 VanDerWaalsContact OE2-CZ 3.28Å; E294-Y296 PolarHBondContact OE2-OH 3.41Å; E294-V302 CarbonylContact C-O 3.58Å; E294-F303 HydrophobicContact CB-CD1 4.45Å; E294-F303 HydrophobicContact CB-CE1 4.39Å; E294-F303 HydrophobicContact CG-CD1 3.83Å; E294-F303 HydrophobicContact CG-CE1 3.83Å; E294-N331 WeakPolarHBondContact OE1-CB 3.36Å; E294-N331 PolarHBondContact OE1-ND2 3.38Å
295	S	97.3	Very high	94.4	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.007	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.3	176.8	-76	0	0	0	0	108.7	R133 A140 N141 Q166 V302 E304	R133-S295 PolarHBondContact NH1-OG 2.81Å; R133-S295 VanDerWaalsContact NH1-OG 3.11Å; A140-S295 CarbonylContact O-C 3.47Å; A140-S295 WeakPolarHBondContact O-CA 3.19Å; N141-S295 PolarHBondContact ND2-OG 2.91Å; Q166-S295 PolarHBondContact NE2-OG 3.23Å; S295-V302 PolarHBondContact N-O 3.36Å; S295-V302 PolarHBondContact O-N 2.78Å; S295-E304 PolarHBondContact OG-OE1 2.88Å
296	Y	97.9	Very high	94	Very high	40 Å²	40	22.8 Å²	22.8	16%	0.157	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.5	-173.8	-66.7	-75.6	0	0	0	111.6	L138 F139 A140 V142 F200 E294 A301 H335	L138-Y296 CarbonylContact C-O 3.59Å; L138-Y296 WeakPolarHBondContact CA-O 3.46Å; F139-Y296 PolarHBondContact N-O 3.23Å; A140-Y296 PolarHBondContact N-O 3.24Å; A140-Y296 PolarHBondContact O-N 3.02Å; V142-Y296 HydrophobicContact CB-CE2 4.31Å; V142-Y296 HydrophobicContact CG2-CD2 3.88Å; V142-Y296 HydrophobicContact CG2-CE2 3.92Å; F200-Y296 HydrophobicContact CE2-CD2 4.31Å; F200-Y296 HydrophobicContact CE2-CG 4.3Å; F200-Y296 AromaticContact CZ-CD2 3.69Å; F200-Y296 HydrophobicContact CZ-CD2 3.69Å; F200-Y296 HydrophobicContact CZ-CE2 4.34Å; F200-Y296 HydrophobicContact CZ-CG 4.14Å; E294-Y296 HydrophobicContact CB-CD2 4.33Å; E294-Y296 HydrophobicContact CB-CE2 3.55Å; E294-Y296 WeakPolarHBondContact OE2-CE2 3.11Å; E294-Y296 VanDerWaalsContact OE2-CZ 3.28Å; E294-Y296 PolarHBondContact OE2-OH 3.41Å; Y296-A301 HydrophobicContact CD1-CB 4.03Å; Y296-A301 HydrophobicContact CE1-CB 4.04Å; Y296-H335 AromaticContact CE1-ND1 3.95Å
297	S	96.9	Very high	93.6	Very high	19 Å²	19	22.5 Å²	22.5	13%	0.133	14%	0.142	C	C	.	.			trans	-114.2	-178.9	162.6	177.6	0	0	0	0	108.7	L136 D137 E299 Y300	L136-S297 VanDerWaalsContact O-CB 3.32Å; L136-S297 WeakPolarHBondContact O-CB 3.4Å; L136-S297 PolarHBondContact O-OG 3.15Å; D137-S297 VanDerWaalsContact O-CB 3.31Å; D137-S297 WeakPolarHBondContact O-CB 3.34Å; D137-S297 PolarHBondContact O-OG 2.78Å; S297-E299 PolarHBondContact O-N 3.41Å; S297-Y300 PolarHBondContact N-O 2.69Å
298	A	94.7	Very high	93.1	Very high	93 Å²	93	23 Å²	23	77%	0.769	14%	0.138	S	C	*	.	S	Bend	trans	-64.1	-32.3	170.6	0	0	0	0	0	112.2
299	E	94.9	Very high	92.6	Very high	128 Å²	128	24.9 Å²	24.9	60%	0.598	14%	0.141	S	C	*	.	S	Bend	trans	-116.8	-20.9	-173.8	-66.3	179.2	-160.5	0	0	114.2	S297	S297-E299 PolarHBondContact O-N 3.41Å
300	Y	97.1	Very high	91.9	Very high	39 Å²	39	25 Å²	25	15%	0.153	14%	0.138	C	C	.	.			trans	-123.7	149.5	-168.2	-43.2	-62.5	0	0	0	111.8	K105 K108 L136 S297	K105-Y300 HydrophobicContact CB-CE1 4.39Å; K105-Y300 HydrophobicContact CG-CE1 4.26Å; K108-Y300 HydrophobicContact CB-CD1 4.3Å; K108-Y300 HydrophobicContact CG-CD1 4.38Å; K108-Y300 VanDerWaalsContact O-CA 3.3Å; K108-Y300 WeakPolarHBondContact O-CA 3.15Å; L136-Y300 HydrophobicContact CB-CD2 4.18Å; L136-Y300 HydrophobicContact CD2-CD2 4.05Å; L136-Y300 HydrophobicContact CD2-CE2 4.11Å; L136-Y300 WeakPolarHBondContact O-CD2 2.98Å; S297-Y300 PolarHBondContact N-O 2.69Å
301	A	97.9	Very high	91.4	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.6	172.3	0	0	0	0	0	110.9	K108 V109 A110 Y296 F303 H335	K108-A301 PolarHBondContact O-N 2.75Å; V109-A301 WeakPolarHBondContact CA-O 3.32Å; A110-A301 PolarHBondContact N-O 3.24Å; Y296-A301 HydrophobicContact CD1-CB 4.03Å; Y296-A301 HydrophobicContact CE1-CB 4.04Å; A301-F303 HydrophobicContact CB-CE2 3.81Å; A301-F303 HydrophobicContact CB-CZ 4.15Å; A301-H335 WeakPolarHBondContact CB-NE2 3.49Å
302	V	98.1	Very high	90.5	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.018	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126	-178.4	178.9	0	0	0	0	109.9	A110 I112 L138 E294 S295	A110-V302 HydrophobicContact CB-CG2 4.19Å; A110-V302 CarbonylContact O-C 3.59Å; A110-V302 WeakPolarHBondContact O-CA 3.2Å; I112-V302 HydrophobicContact CB-CG1 4.35Å; I112-V302 HydrophobicContact CD1-CG1 3.67Å; I112-V302 HydrophobicContact CG1-CG1 3.67Å; I112-V302 HydrophobicContact CG2-CG1 3.78Å; L138-V302 HydrophobicContact CD1-CB 4.06Å; L138-V302 HydrophobicContact CD1-CG2 3.61Å; L138-V302 HydrophobicContact CD2-CB 4.42Å; L138-V302 HydrophobicContact CD2-CG2 3.88Å; L138-V302 HydrophobicContact CG-CG2 4.42Å; E294-V302 CarbonylContact C-O 3.58Å; S295-V302 PolarHBondContact N-O 3.36Å; S295-V302 PolarHBondContact O-N 2.78Å
303	F	97.9	Very high	89.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.3	-176.7	-62.6	-91	0	0	0	110.2	V109 A110 I111 I112 E294 A301 S328 N331 M332 H335	V109-F303 HydrophobicContact CG1-CD2 4.22Å; V109-F303 HydrophobicContact CG1-CE2 4Å; A110-F303 PolarHBondContact O-N 3.45Å; I111-F303 CarbonylContact C-O 3.5Å; I111-F303 WeakPolarHBondContact CA-O 3.36Å; I111-F303 HydrophobicContact CG1-CB 4.33Å; I112-F303 PolarHBondContact N-O 3.28Å; E294-F303 HydrophobicContact CB-CD1 4.45Å; E294-F303 HydrophobicContact CB-CE1 4.39Å; E294-F303 HydrophobicContact CG-CD1 3.83Å; E294-F303 HydrophobicContact CG-CE1 3.83Å; A301-F303 HydrophobicContact CB-CE2 3.81Å; A301-F303 HydrophobicContact CB-CZ 4.15Å; F303-S328 WeakPolarHBondContact CD1-O 3.4Å; F303-N331 HydrophobicContact CD1-CB 4.08Å; F303-N331 HydrophobicContact CE1-CB 4.01Å; F303-M332 HydrophobicContact CB-CB 4.19Å; F303-M332 HydrophobicContact CD1-CB 3.91Å; F303-M332 HydrophobicContact CD2-CB 3.47Å; F303-M332 VanDerWaalsContact CD2-CB 3.47Å; F303-M332 HydrophobicContact CD2-CG 3.5Å; F303-M332 HydrophobicContact CD2-SD 4.41Å; F303-M332 HydrophobicContact CE1-CB 4.22Å; F303-M332 HydrophobicContact CE2-CB 3.81Å; F303-M332 HydrophobicContact CE2-CG 3.77Å; F303-M332 HydrophobicContact CG-CB 3.55Å; F303-M332 HydrophobicContact CG-CG 4.1Å; F303-M332 HydrophobicContact CZ-CB 4.19Å; F303-H335 HydrophobicContact CE1-CB 4.43Å; F303-H335 HydrophobicContact CE2-CB 4.16Å; F303-H335 HydrophobicContact CZ-CB 3.53Å; F303-H335 AromaticContact CZ-CG 3.87Å
304	E	95.4	Very high	88.8	Confident	5 Å²	5	38.1 Å²	38.1	2%	0.023	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	177.8	-172.9	61.2	-178.7	138.2	0	0	110.8	I112 R133 G293 S295 R308 S328	I112-E304 HydrophobicContact CD1-CB 4.49Å; I112-E304 HydrophobicContact CG1-CB 3.77Å; R133-E304 IonicContact CZ-OE1 2.88Å; R133-E304 IonicContact CZ-OE2 2.85Å; R133-E304 IonicContact NH1-OE1 3.25Å; R133-E304 PolarHBondContact NH1-OE1 3.29Å; R133-E304 IonicContact NH1-OE2 2.79Å; R133-E304 IonicContact NH2-OE1 3.33Å; R133-E304 PolarHBondContact NH2-OE1 3.16Å; R133-E304 IonicContact NH2-OE2 3.56Å; R133-E304 PolarHBondContact NH2-OE2 3.41Å; G293-E304 CarbonylContact C-O 3.6Å; G293-E304 WeakPolarHBondContact CA-O 3.27Å; G293-E304 PolarHBondContact N-O 2.61Å; G293-E304 PolarHBondContact O-N 2.81Å; S295-E304 PolarHBondContact OG-OE1 2.88Å; E304-R308 IonicContact OE1-CZ 3.27Å; E304-R308 IonicContact OE1-NE 3.85Å; E304-R308 PolarHBondContact OE1-NE 2.72Å; E304-R308 IonicContact OE1-NH2 3.19Å; E304-R308 PolarHBondContact OE1-NH2 3.5Å; E304-R308 IonicContact OE2-CZ 3Å; E304-R308 IonicContact OE2-NE 3.65Å; E304-R308 PolarHBondContact OE2-NE 2.78Å; E304-R308 IonicContact OE2-NH2 3.51Å; E304-S328 WeakPolarHBondContact O-CB 3.3Å; E304-S328 PolarHBondContact O-OG 3.13Å
305	T	93.1	Very high	88.2	Confident	19 Å²	19	40.8 Å²	40.8	12%	0.117	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	141.7	170.1	59.6	0	0	0	0	110.6	A307 A324 M325	T305-A307 VanDerWaalsContact C-N 3.34Å; T305-A307 WeakPolarHBondContact CB-O 3.28Å; T305-A307 PolarHBondContact O-N 2.95Å; T305-A307 PolarHBondContact OG1-O 3.11Å; T305-A324 HydrophobicContact CG2-CB 3.8Å; T305-M325 HydrophobicContact CG2-CB 4.5Å; T305-M325 HydrophobicContact CG2-CE 3.88Å
306	G	83.8	Confident	87.5	Confident	5 Å²	5	44.1 Å²	44.1	5%	0.052	26%	0.26	C	S	.	.	S	Bend	trans	-65.4	-37.4	-178.3	0	0	0	0	0	112.7	V291	V291-G306 PolarHBondContact O-N 3.41Å
307	A	80.6	Confident	86.7	Confident	2 Å²	2	50.4 Å²	50.4	2%	0.017	28%	0.283	C	S	.	.	S	Bend	trans	-99.4	127	166.7	0	0	0	0	0	109.8	A282 A288 T305 H309	A282-A307 HydrophobicContact CB-CB 4.19Å; A288-A307 HydrophobicContact CB-CB 3.45Å; A288-A307 VanDerWaalsContact CB-CB 3.45Å; T305-A307 VanDerWaalsContact C-N 3.34Å; T305-A307 WeakPolarHBondContact CB-O 3.28Å; T305-A307 PolarHBondContact O-N 2.95Å; T305-A307 PolarHBondContact OG1-O 3.11Å; A307-H309 PolarHBondContact O-N 2.87Å
308	R	77.4	Confident	86.1	Confident	31 Å²	31	56.4 Å²	56.4	12%	0.117	31%	0.314	C	S	.	.			trans	-97.1	65.3	-166.7	-67.9	178.6	-180	144.7	8.4	112.4	K114 R133 N141 Q166 E304	K114-R308 HydrophobicContact CD-CB 4.1Å; R133-R308 VanDerWaalsContact CZ-CZ 3.5Å; N141-R308 VanDerWaalsContact CG-NH2 3.29Å; N141-R308 PolarHBondContact ND2-NH2 3.21Å; N141-R308 VanDerWaalsContact ND2-NH2 3.11Å; Q166-R308 VanDerWaalsContact OE1-NH1 3.11Å; E304-R308 IonicContact OE1-CZ 3.27Å; E304-R308 IonicContact OE1-NE 3.85Å; E304-R308 PolarHBondContact OE1-NE 2.72Å; E304-R308 IonicContact OE1-NH2 3.19Å; E304-R308 PolarHBondContact OE1-NH2 3.5Å; E304-R308 IonicContact OE2-CZ 3Å; E304-R308 IonicContact OE2-NE 3.65Å; E304-R308 PolarHBondContact OE2-NE 2.78Å; E304-R308 IonicContact OE2-NH2 3.51Å
309	H	77.4	Confident	85.5	Confident	73 Å²	73	56.1 Å²	56.1	34%	0.338	30%	0.298	S	S	.	.			trans	-107.1	131.1	178.6	-64.5	-64.6	0	0	0	111.5	N279 A307 F311	N279-H309 PolarHBondContact OD1-NE2 3.32Å; A307-H309 PolarHBondContact O-N 2.87Å; H309-F311 VanDerWaalsContact C-N 3.3Å
310	P	73.4	Confident	85.2	Confident	25 Å²	25	50.6 Å²	50.6	16%	0.162	28%	0.275	C	S	.	.			trans	-76.5	-18.5	177.5	30.3	-33.3	0	0	0	112.7	G58 V59 K114 H116 A312	G58-P310 VanDerWaalsContact CA-O 3.3Å; G58-P310 WeakPolarHBondContact CA-O 3.37Å; V59-P310 PolarHBondContact N-O 3.23Å; K114-P310 HydrophobicContact CB-CB 4.43Å; K114-P310 HydrophobicContact CG-CB 4.09Å; K114-P310 HydrophobicContact CG-CG 4.48Å; H116-P310 HydrophobicContact CB-CB 4.49Å; P310-A312 VanDerWaalsContact C-N 3.27Å; P310-A312 PolarHBondContact O-N 3.06Å
311	F	81.2	Confident	84.8	Confident	84 Å²	84	49.4 Å²	49.4	37%	0.368	27%	0.271	S	S	.	.			trans	46.8	46.4	-177.2	-162.8	-148.4	0	0	0	113.8	V59 H309 Q313 A314	V59-F311 HydrophobicContact CG1-CB 4.16Å; V59-F311 HydrophobicContact CG1-CD1 4.12Å; V59-F311 HydrophobicContact CG1-CG 4.49Å; V59-F311 WeakPolarHBondContact CG1-O 3.42Å; V59-F311 HydrophobicContact CG2-CB 4.02Å; H309-F311 VanDerWaalsContact C-N 3.3Å; F311-Q313 PolarHBondContact O-N 3.03Å; F311-A314 HydrophobicContact CD1-CB 3.31Å; F311-A314 HydrophobicContact CD2-CB 4.29Å; F311-A314 HydrophobicContact CE1-CB 3.22Å; F311-A314 HydrophobicContact CE2-CB 4.2Å; F311-A314 HydrophobicContact CG-CB 3.87Å; F311-A314 HydrophobicContact CZ-CB 3.68Å; F311-A314 PolarHBondContact O-N 3.25Å
312	A	77	Confident	84.6	Confident	64 Å²	64	51 Å²	51	53%	0.529	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-56.7	-25.3	-170.2	0	0	0	0	0	114.7	P310 A314 V315	P310-A312 VanDerWaalsContact C-N 3.27Å; P310-A312 PolarHBondContact O-N 3.06Å; A312-A314 VanDerWaalsContact C-N 3.26Å; A312-A314 PolarHBondContact O-N 3.04Å; A312-V315 WeakPolarHBondContact O-CG2 3.28Å
313	Q	78.9	Confident	84.4	Confident	147 Å²	147	51.2 Å²	51.2	69%	0.687	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-71.5	-19.1	179.3	-59.7	-179.3	14.7	0	0	113.6	F311 R317	F311-Q313 PolarHBondContact O-N 3.03Å; Q313-R317 VanDerWaalsContact O-CZ 3.28Å; Q313-R317 PolarHBondContact O-NE 3.46Å
314	A	76.8	Confident	84.2	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.008	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-94.4	-4	-178.7	0	0	0	0	0	114.1	V59 F311 A312 G316 R317 I319	V59-A314 HydrophobicContact CG1-CB 3.82Å; F311-A314 HydrophobicContact CD1-CB 3.31Å; F311-A314 HydrophobicContact CD2-CB 4.29Å; F311-A314 HydrophobicContact CE1-CB 3.22Å; F311-A314 HydrophobicContact CE2-CB 4.2Å; F311-A314 HydrophobicContact CG-CB 3.87Å; F311-A314 HydrophobicContact CZ-CB 3.68Å; F311-A314 PolarHBondContact O-N 3.25Å; A312-A314 VanDerWaalsContact C-N 3.26Å; A312-A314 PolarHBondContact O-N 3.04Å; A314-G316 PolarHBondContact O-N 2.99Å; A314-R317 WeakPolarHBondContact O-CB 3.15Å; A314-R317 PolarHBondContact O-N 3.23Å; A314-I319 HydrophobicContact CB-CD1 3.9Å; A314-I319 HydrophobicContact CB-CG1 3.69Å
315	V	83.8	Confident	84.3	Confident	76 Å²	76	51.2 Å²	51.2	46%	0.461	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	127.9	-177.7	177.1	0	0	0	0	111.1	G58 V59 A312 R317	G58-V315 WeakPolarHBondContact O-CG2 3.29Å; V59-V315 HydrophobicContact CG1-CG2 4.45Å; A312-V315 WeakPolarHBondContact O-CG2 3.28Å; V315-R317 PolarHBondContact O-N 3.15Å
316	G	82	Confident	84.4	Confident	72 Å²	72	51 Å²	51	74%	0.742	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	2.7	176.9	0	0	0	0	0	114.4	A314	A314-G316 PolarHBondContact O-N 2.99Å
317	R	82.8	Confident	85.1	Confident	172 Å²	172	51.5 Å²	51.5	65%	0.649	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-10.8	175.8	-58.1	-174.2	-178.2	-174.1	1.2	112.7	Q313 A314 V315 I319	Q313-R317 VanDerWaalsContact O-CZ 3.28Å; Q313-R317 PolarHBondContact O-NE 3.46Å; A314-R317 WeakPolarHBondContact O-CB 3.15Å; A314-R317 PolarHBondContact O-N 3.23Å; V315-R317 PolarHBondContact O-N 3.15Å; R317-I319 VanDerWaalsContact C-N 3.26Å; R317-I319 HydrophobicContact CB-CD1 4.14Å; R317-I319 HydrophobicContact CB-CG1 4.02Å; R317-I319 HydrophobicContact CB-CG2 4.2Å; R317-I319 WeakPolarHBondContact O-CG2 3.37Å; R317-I319 PolarHBondContact O-N 3.37Å
318	N	82.8	Confident	85.9	Confident	145 Å²	145	51.4 Å²	51.4	78%	0.775	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	41	-178.3	-165.4	38.2	0	0	0	112.5
319	I	84	Confident	86.8	Confident	86 Å²	86	49.9 Å²	49.9	44%	0.441	28%	0.276	S	S	.	.			trans	-115.5	-3.9	179.8	65.2	177.9	0	0	0	113	A314 R317	A314-I319 HydrophobicContact CB-CD1 3.9Å; A314-I319 HydrophobicContact CB-CG1 3.69Å; R317-I319 VanDerWaalsContact C-N 3.26Å; R317-I319 HydrophobicContact CB-CD1 4.14Å; R317-I319 HydrophobicContact CB-CG1 4.02Å; R317-I319 HydrophobicContact CB-CG2 4.2Å; R317-I319 WeakPolarHBondContact O-CG2 3.37Å; R317-I319 PolarHBondContact O-N 3.37Å
320	A	87.1	Confident	87.8	Confident	12 Å²	12	46.4 Å²	46.4	10%	0.099	26%	0.26	C	S	.	.			trans	-68.8	144	178.1	0	0	0	0	0	111.3	V59 E62 L63 P322	V59-A320 HydrophobicContact CB-CB 3.79Å; V59-A320 HydrophobicContact CG1-CB 3.9Å; V59-A320 HydrophobicContact CG2-CB 4.02Å; E62-A320 WeakPolarHBondContact OE1-CB 3.29Å; L63-A320 HydrophobicContact CD2-CB 3.77Å; A320-P322 WeakPolarHBondContact O-CD 3.5Å
321	N	89.4	Confident	89	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.08	26%	0.259	C	S	.	.			trans	-86.7	115.4	177.1	-177.3	-2.2	0	0	0	109.9	Y151 T323 A361	Y151-N321 PolarHBondContact OH-ND2 3.34Å; N321-T323 PolarHBondContact O-N 2.93Å; N321-T323 WeakPolarHBondContact OD1-CB 3.38Å; N321-T323 PolarHBondContact OD1-N 3.5Å; N321-T323 PolarHBondContact OD1-OG1 3.22Å; N321-A361 HydrophobicContact CB-CB 4.5Å
322	P	92.9	Very high	89.8	Confident	33 Å²	33	42.5 Å²	42.5	21%	0.214	24%	0.241	C	C	.	.			trans	-79.9	-0.6	-178.9	34.3	-36.9	0	0	0	114.2	L63 A66 A320 A324 M325 L326	L63-P322 HydrophobicContact CD2-CB 4.01Å; A66-P322 HydrophobicContact CB-CB 4.14Å; A320-P322 WeakPolarHBondContact O-CD 3.5Å; P322-A324 PolarHBondContact O-N 3.21Å; P322-M325 PolarHBondContact O-N 3.3Å; P322-L326 HydrophobicContact CB-CD1 3.98Å; P322-L326 HydrophobicContact CB-CG 4.33Å; P322-L326 HydrophobicContact CG-CD1 4.12Å; P322-L326 WeakPolarHBondContact O-CB 3.48Å; P322-L326 WeakPolarHBondContact O-CG 3.44Å; P322-L326 PolarHBondContact O-N 3.47Å
323	T	93.9	Very high	90.8	Very high	8 Å²	8	39.4 Å²	39.4	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-54	-53.2	-173.5	-63.5	0	0	0	0	112.6	L148 G289 V290 N321 M325 L326 L327 V349 I353	L148-T323 HydrophobicContact CD1-CG2 3.82Å; G289-T323 WeakPolarHBondContact O-CB 3.33Å; V290-T323 HydrophobicContact CB-CG2 4.26Å; V290-T323 HydrophobicContact CG1-CG2 4.16Å; N321-T323 PolarHBondContact O-N 2.93Å; N321-T323 WeakPolarHBondContact OD1-CB 3.38Å; N321-T323 PolarHBondContact OD1-N 3.5Å; N321-T323 PolarHBondContact OD1-OG1 3.22Å; T323-M325 VanDerWaalsContact C-N 3.34Å; T323-M325 PolarHBondContact O-N 3.49Å; T323-L326 PolarHBondContact O-N 3.33Å; T323-L327 HydrophobicContact CG2-CD1 3.83Å; T323-L327 HydrophobicContact CG2-CG 4.35Å; T323-L327 WeakPolarHBondContact O-CB 3.21Å; T323-L327 VanDerWaalsContact O-CG 3.29Å; T323-L327 WeakPolarHBondContact O-CG 3.33Å; T323-L327 PolarHBondContact O-N 2.81Å; T323-V349 HydrophobicContact CG2-CG1 3.95Å; T323-I353 HydrophobicContact CG2-CD1 3.67Å
324	A	94.6	Very high	91.6	Very high	2 Å²	2	36.3 Å²	36.3	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-57.3	-47.4	-179.6	0	0	0	0	0	111.7	G289 V291 T305 P322 L327 S328	G289-A324 VanDerWaalsContact C-CB 3.48Å; G289-A324 WeakPolarHBondContact O-CB 3.27Å; G289-A324 PolarHBondContact O-N 3.21Å; V291-A324 WeakPolarHBondContact O-CB 3.43Å; T305-A324 HydrophobicContact CG2-CB 3.8Å; P322-A324 PolarHBondContact O-N 3.21Å; A324-L327 PolarHBondContact O-N 3.47Å; A324-S328 PolarHBondContact O-N 3.37Å; A324-S328 PolarHBondContact O-OG 3.33Å; A324-S328 VanDerWaalsContact O-OG 3.04Å
325	M	96.4	Very high	92.6	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-67.5	-39.4	-177.8	-169.1	58.9	76.1	0	0	112.2	L63 M64 V67 I111 T305 P322 T323 S328 A329	L63-M325 HydrophobicContact CB-CB 4.28Å; L63-M325 HydrophobicContact CB-CG 4.34Å; L63-M325 HydrophobicContact CD1-CB 4.44Å; M64-M325 HydrophobicContact CE-CE 3.51Å; M64-M325 HydrophobicContact CE-SD 3.69Å; M64-M325 HydrophobicContact SD-CE 4.28Å; M64-M325 HydrophobicContact SD-CG 4.13Å; M64-M325 HydrophobicContact SD-SD 4Å; V67-M325 HydrophobicContact CG2-CB 4.41Å; V67-M325 HydrophobicContact CG2-CG 3.64Å; I111-M325 HydrophobicContact CD1-SD 3.86Å; I111-M325 HydrophobicContact CG1-SD 3.96Å; T305-M325 HydrophobicContact CG2-CB 4.5Å; T305-M325 HydrophobicContact CG2-CE 3.88Å; P322-M325 PolarHBondContact O-N 3.3Å; T323-M325 VanDerWaalsContact C-N 3.34Å; T323-M325 PolarHBondContact O-N 3.49Å; M325-S328 PolarHBondContact O-N 2.79Å; M325-A329 WeakPolarHBondContact O-CB 3.49Å; M325-A329 PolarHBondContact O-N 3.37Å
326	L	97.1	Very high	93.2	Very high	15 Å²	15	37.6 Å²	37.6	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-66	-37.2	175.5	-72.5	168.7	0	0	0	112.4	V67 V70 P322 T323 A329 S330 V349	V67-L326 HydrophobicContact CG2-CD2 4.09Å; V70-L326 HydrophobicContact CB-CD2 4.03Å; V70-L326 HydrophobicContact CG1-CD2 4.21Å; V70-L326 HydrophobicContact CG2-CD2 3.9Å; P322-L326 HydrophobicContact CB-CD1 3.98Å; P322-L326 HydrophobicContact CB-CG 4.33Å; P322-L326 HydrophobicContact CG-CD1 4.12Å; P322-L326 WeakPolarHBondContact O-CB 3.48Å; P322-L326 WeakPolarHBondContact O-CG 3.44Å; P322-L326 PolarHBondContact O-N 3.47Å; T323-L326 PolarHBondContact O-N 3.33Å; L326-A329 PolarHBondContact O-N 2.8Å; L326-S330 WeakPolarHBondContact O-CB 3.3Å; L326-S330 PolarHBondContact O-N 3.22Å; L326-S330 PolarHBondContact O-OG 3.07Å; L326-V349 HydrophobicContact CB-CG2 3.97Å; L326-V349 HydrophobicContact CD1-CG2 4.01Å
327	L	96.9	Very high	93.8	Very high	15 Å²	15	41 Å²	41	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-68.3	-40.3	174	-69.3	176.2	0	0	0	111.3	L148 P292 T323 A324 S330 N331 A346 V349	L148-L327 HydrophobicContact CD1-CD1 4.01Å; L148-L327 HydrophobicContact CD2-CD1 4.33Å; P292-L327 HydrophobicContact CB-CB 3.94Å; P292-L327 HydrophobicContact CG-CB 4.05Å; T323-L327 HydrophobicContact CG2-CD1 3.83Å; T323-L327 HydrophobicContact CG2-CG 4.35Å; T323-L327 WeakPolarHBondContact O-CB 3.21Å; T323-L327 VanDerWaalsContact O-CG 3.29Å; T323-L327 WeakPolarHBondContact O-CG 3.33Å; T323-L327 PolarHBondContact O-N 2.81Å; A324-L327 PolarHBondContact O-N 3.47Å; L327-S330 WeakPolarHBondContact O-CB 3.49Å; L327-S330 PolarHBondContact O-N 3.34Å; L327-S330 VanDerWaalsContact O-N 3.16Å; L327-N331 PolarHBondContact O-N 2.92Å; L327-A346 HydrophobicContact CD2-CB 4.41Å; L327-V349 HydrophobicContact CD2-CG1 4.24Å; L327-V349 HydrophobicContact CG-CG1 4.38Å
328	S	97.4	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.9	-42.3	173.2	-61.1	0	0	0	0	112	P292 G293 F303 E304 A324 M325 S330 N331 M332	P292-S328 VanDerWaalsContact CA-OG 3.26Å; P292-S328 WeakPolarHBondContact CA-OG 3.46Å; P292-S328 WeakPolarHBondContact CB-OG 3.48Å; G293-S328 PolarHBondContact N-OG 3.09Å; F303-S328 WeakPolarHBondContact CD1-O 3.4Å; E304-S328 WeakPolarHBondContact O-CB 3.3Å; E304-S328 PolarHBondContact O-OG 3.13Å; A324-S328 PolarHBondContact O-N 3.37Å; A324-S328 PolarHBondContact O-OG 3.33Å; A324-S328 VanDerWaalsContact O-OG 3.04Å; M325-S328 PolarHBondContact O-N 2.79Å; S328-S330 VanDerWaalsContact C-N 3.29Å; S328-S330 PolarHBondContact O-N 3.27Å; S328-N331 PolarHBondContact O-N 3.35Å; S328-N331 VanDerWaalsContact O-N 3.15Å; S328-M332 PolarHBondContact O-N 3.28Å
329	A	97.9	Very high	95.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-36.4	172.9	0	0	0	0	0	111.7	V67 F71 I111 M325 L326 M332 L333	V67-A329 HydrophobicContact CG1-CB 3.83Å; V67-A329 HydrophobicContact CG2-CB 4.43Å; F71-A329 HydrophobicContact CE2-CB 3.78Å; F71-A329 HydrophobicContact CZ-CB 3.81Å; I111-A329 HydrophobicContact CD1-CB 3.75Å; M325-A329 WeakPolarHBondContact O-CB 3.49Å; M325-A329 PolarHBondContact O-N 3.37Å; L326-A329 PolarHBondContact O-N 2.8Å; A329-M332 WeakPolarHBondContact O-CB 3.3Å; A329-M332 PolarHBondContact O-N 3.48Å; A329-L333 WeakPolarHBondContact O-CG 3.4Å; A329-L333 PolarHBondContact O-N 3.23Å
330	S	97.8	Very high	95.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-39.9	173.4	-56.6	0	0	0	0	111.5	L326 L327 S328 M332 L333 R334 S342 I345	L326-S330 WeakPolarHBondContact O-CB 3.3Å; L326-S330 PolarHBondContact O-N 3.22Å; L326-S330 PolarHBondContact O-OG 3.07Å; L327-S330 WeakPolarHBondContact O-CB 3.49Å; L327-S330 PolarHBondContact O-N 3.34Å; L327-S330 VanDerWaalsContact O-N 3.16Å; S328-S330 VanDerWaalsContact C-N 3.29Å; S328-S330 PolarHBondContact O-N 3.27Å; S330-M332 VanDerWaalsContact C-N 3.34Å; S330-L333 PolarHBondContact O-N 3.39Å; S330-R334 PolarHBondContact O-N 2.67Å; S330-R334 VanDerWaalsContact O-N 3.13Å; S330-S342 VanDerWaalsContact O-CB 3.31Å; S330-S342 WeakPolarHBondContact O-CB 3.29Å; S330-S342 PolarHBondContact O-OG 3.16Å; S330-I345 WeakPolarHBondContact OG-CG2 3.41Å
331	N	97.7	Very high	96.3	Very high	26 Å²	26	36.1 Å²	36.1	14%	0.139	17%	0.171	C	C	.	.	H	α-helix	trans	-67.2	-35.9	175.6	-69	-8.7	0	0	0	112.1	E294 F303 L327 S328 R334 H335	E294-N331 WeakPolarHBondContact OE1-CB 3.36Å; E294-N331 PolarHBondContact OE1-ND2 3.38Å; F303-N331 HydrophobicContact CD1-CB 4.08Å; F303-N331 HydrophobicContact CE1-CB 4.01Å; L327-N331 PolarHBondContact O-N 2.92Å; S328-N331 PolarHBondContact O-N 3.35Å; S328-N331 VanDerWaalsContact O-N 3.15Å; N331-R334 WeakPolarHBondContact O-CB 2.96Å; N331-R334 PolarHBondContact O-N 3.03Å; N331-R334 PolarHBondContact OD1-NH1 3.15Å; N331-H335 PolarHBondContact O-N 3.24Å
332	M	98.1	Very high	96.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.4	-46.8	171	-176	-170.8	76.5	0	0	111.7	V51 F71 V78 F80 V109 I111 F303 S328 A329 S330 R334 H335 L336	V51-M332 HydrophobicContact CG1-CE 4.31Å; V51-M332 HydrophobicContact CG1-SD 3.61Å; V51-M332 HydrophobicContact CG2-CE 4.35Å; V51-M332 HydrophobicContact CG2-SD 4.28Å; F71-M332 HydrophobicContact CE1-CE 3.83Å; F71-M332 HydrophobicContact CZ-CE 3.99Å; V78-M332 HydrophobicContact CG1-CE 4.47Å; F80-M332 HydrophobicContact CE1-CE 4.05Å; F80-M332 HydrophobicContact CZ-CE 4.27Å; V109-M332 HydrophobicContact CG1-CG 3.59Å; V109-M332 HydrophobicContact CG1-SD 4.1Å; I111-M332 HydrophobicContact CB-SD 4.05Å; F303-M332 HydrophobicContact CB-CB 4.19Å; F303-M332 HydrophobicContact CD1-CB 3.91Å; F303-M332 HydrophobicContact CD2-CB 3.47Å; F303-M332 VanDerWaalsContact CD2-CB 3.47Å; F303-M332 HydrophobicContact CD2-CG 3.5Å; F303-M332 HydrophobicContact CD2-SD 4.41Å; F303-M332 HydrophobicContact CE1-CB 4.22Å; F303-M332 HydrophobicContact CE2-CB 3.81Å; F303-M332 HydrophobicContact CE2-CG 3.77Å; F303-M332 HydrophobicContact CG-CB 3.55Å; F303-M332 HydrophobicContact CG-CG 4.1Å; F303-M332 HydrophobicContact CZ-CB 4.19Å; S328-M332 PolarHBondContact O-N 3.28Å; A329-M332 WeakPolarHBondContact O-CB 3.3Å; A329-M332 PolarHBondContact O-N 3.48Å; S330-M332 VanDerWaalsContact C-N 3.34Å; M332-R334 VanDerWaalsContact C-N 3.27Å; M332-R334 PolarHBondContact O-N 3.33Å; M332-H335 WeakPolarHBondContact O-CA 3.18Å; M332-H335 WeakPolarHBondContact O-CB 3.42Å; M332-H335 PolarHBondContact O-N 3.41Å; M332-L336 HydrophobicContact CG-CD1 4.37Å; M332-L336 WeakPolarHBondContact O-CG 3.09Å; M332-L336 PolarHBondContact O-N 3.15Å
333	L	98.1	Very high	96.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-38.6	176.6	-67.4	175.2	0	0	0	112.1	F71 V76 V78 A329 S330 H335 L336 N337 L338 H341 I345	F71-L333 HydrophobicContact CE1-CD1 4.22Å; F71-L333 HydrophobicContact CE1-CD2 3.85Å; F71-L333 HydrophobicContact CE1-CG 4.2Å; F71-L333 HydrophobicContact CE2-CD1 4.18Å; F71-L333 HydrophobicContact CZ-CD1 3.68Å; F71-L333 HydrophobicContact CZ-CD2 4.02Å; F71-L333 HydrophobicContact CZ-CG 3.84Å; V76-L333 HydrophobicContact CG1-CD1 4.2Å; V76-L333 HydrophobicContact CG1-CD2 3.51Å; V76-L333 HydrophobicContact CG2-CD1 4.5Å; V78-L333 HydrophobicContact CG2-CD2 3.79Å; A329-L333 WeakPolarHBondContact O-CG 3.4Å; A329-L333 PolarHBondContact O-N 3.23Å; S330-L333 PolarHBondContact O-N 3.39Å; L333-H335 VanDerWaalsContact C-N 3.33Å; L333-H335 PolarHBondContact O-N 3.12Å; L333-L336 CarbonylContact O-C 3.55Å; L333-L336 PolarHBondContact O-N 2.85Å; L333-N337 PolarHBondContact O-N 2.82Å; L333-L338 HydrophobicContact CB-CB 4.18Å; L333-L338 HydrophobicContact CD2-CB 4.34Å; L333-L338 HydrophobicContact CD2-CD1 3.75Å; L333-L338 WeakPolarHBondContact O-CA 3.41Å; L333-L338 WeakPolarHBondContact O-CB 3.46Å; L333-L338 PolarHBondContact O-N 3.5Å; L333-H341 HydrophobicContact CD1-CB 3.9Å; L333-I345 HydrophobicContact CD1-CD1 3.79Å
334	R	96.8	Very high	97.1	Very high	82 Å²	82	38.7 Å²	38.7	31%	0.309	19%	0.185	S	C	.	.	H	α-helix	trans	-63.1	-39.7	173.4	178.4	170.8	-57.4	104.8	7.2	112	S330 N331 M332 L336 N337 E339 S342	S330-R334 PolarHBondContact O-N 2.67Å; S330-R334 VanDerWaalsContact O-N 3.13Å; N331-R334 WeakPolarHBondContact O-CB 2.96Å; N331-R334 PolarHBondContact O-N 3.03Å; N331-R334 PolarHBondContact OD1-NH1 3.15Å; M332-R334 VanDerWaalsContact C-N 3.27Å; M332-R334 PolarHBondContact O-N 3.33Å; R334-L336 VanDerWaalsContact C-N 3.29Å; R334-L336 PolarHBondContact O-N 3.43Å; R334-N337 PolarHBondContact O-N 2.93Å; R334-N337 VanDerWaalsContact O-N 3.1Å; R334-E339 VanDerWaalsContact CG-OE2 3.31Å; R334-E339 WeakPolarHBondContact CG-OE2 3.16Å; R334-E339 IonicContact CZ-OE1 3.69Å; R334-E339 IonicContact NE-OE1 3.8Å; R334-E339 PolarHBondContact NE-OE1 3.19Å; R334-E339 IonicContact NE-OE2 2.79Å; R334-E339 PolarHBondContact NE-OE2 3.26Å; R334-E339 IonicContact NH2-OE1 3.89Å; R334-E339 PolarHBondContact NH2-OE1 3.48Å; R334-S342 PolarHBondContact NH2-OG 3.37Å; R334-S342 VanDerWaalsContact NH2-OG 3.16Å
335	H	96.6	Very high	97.2	Very high	81 Å²	81	38.9 Å²	38.9	38%	0.375	19%	0.185	S	C	.	.	H	α-helix	trans	-64.1	-34.4	175	-175.4	90	0	0	0	112.5	Y296 A301 F303 N331 M332 L333 N337	Y296-H335 AromaticContact CE1-ND1 3.95Å; A301-H335 WeakPolarHBondContact CB-NE2 3.49Å; F303-H335 HydrophobicContact CE1-CB 4.43Å; F303-H335 HydrophobicContact CE2-CB 4.16Å; F303-H335 HydrophobicContact CZ-CB 3.53Å; F303-H335 AromaticContact CZ-CG 3.87Å; N331-H335 PolarHBondContact O-N 3.24Å; M332-H335 WeakPolarHBondContact O-CA 3.18Å; M332-H335 WeakPolarHBondContact O-CB 3.42Å; M332-H335 PolarHBondContact O-N 3.41Å; L333-H335 VanDerWaalsContact C-N 3.33Å; L333-H335 PolarHBondContact O-N 3.12Å; H335-N337 PolarHBondContact O-N 3.49Å
336	L	96.3	Very high	97.2	Very high	22 Å²	22	39.1 Å²	39.1	12%	0.115	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	5.4	173.4	-65.4	171.9	0	0	0	113.8	F49 V51 V78 V109 M332 L333 R334 L338	F49-L336 HydrophobicContact CB-CD1 4.29Å; F49-L336 HydrophobicContact CD1-CD2 4.2Å; V51-L336 HydrophobicContact CG2-CD1 3.99Å; V78-L336 HydrophobicContact CG2-CD1 4.13Å; V109-L336 HydrophobicContact CB-CD2 4.32Å; V109-L336 HydrophobicContact CG1-CD2 4.43Å; V109-L336 HydrophobicContact CG2-CD2 3.82Å; M332-L336 HydrophobicContact CG-CD1 4.37Å; M332-L336 WeakPolarHBondContact O-CG 3.09Å; M332-L336 PolarHBondContact O-N 3.15Å; L333-L336 CarbonylContact O-C 3.55Å; L333-L336 PolarHBondContact O-N 2.85Å; R334-L336 VanDerWaalsContact C-N 3.29Å; R334-L336 PolarHBondContact O-N 3.43Å; L336-L338 HydrophobicContact CB-CD1 4.21Å; L336-L338 HydrophobicContact CB-CG 4.24Å; L336-L338 PolarHBondContact O-N 3.46Å
337	N	96.3	Very high	97.1	Very high	145 Å²	145	42.6 Å²	42.6	78%	0.775	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.1	22.4	-174.3	-54	-59	0	0	0	115	L333 R334 H335 E339	L333-N337 PolarHBondContact O-N 2.82Å; R334-N337 PolarHBondContact O-N 2.93Å; R334-N337 VanDerWaalsContact O-N 3.1Å; H335-N337 PolarHBondContact O-N 3.49Å; N337-E339 VanDerWaalsContact C-N 3.34Å; N337-E339 PolarHBondContact O-N 3.05Å
338	L	96.6	Very high	97	Very high	25 Å²	25	44.3 Å²	44.3	13%	0.131	22%	0.223	C	C	.	.			trans	-93	57.6	175.3	-61.3	173.6	0	0	0	111	F49 P77 V78 L333 L336 Y340 H341 S342	F49-L338 HydrophobicContact CD2-CD1 3.93Å; F49-L338 HydrophobicContact CD2-CD2 4.45Å; F49-L338 HydrophobicContact CE2-CD1 4.17Å; F49-L338 HydrophobicContact CE2-CD2 3.88Å; F49-L338 HydrophobicContact CE2-CG 4.27Å; P77-L338 HydrophobicContact CG-CD1 4Å; P77-L338 HydrophobicContact CG-CD2 3.99Å; V78-L338 HydrophobicContact CG2-CD1 4.18Å; L333-L338 HydrophobicContact CB-CB 4.18Å; L333-L338 HydrophobicContact CD2-CB 4.34Å; L333-L338 HydrophobicContact CD2-CD1 3.75Å; L333-L338 WeakPolarHBondContact O-CA 3.41Å; L333-L338 WeakPolarHBondContact O-CB 3.46Å; L333-L338 PolarHBondContact O-N 3.5Å; L336-L338 HydrophobicContact CB-CD1 4.21Å; L336-L338 HydrophobicContact CB-CG 4.24Å; L336-L338 PolarHBondContact O-N 3.46Å; L338-Y340 VanDerWaalsContact C-N 3.29Å; L338-Y340 PolarHBondContact O-N 2.79Å; L338-H341 PolarHBondContact O-N 2.98Å; L338-S342 WeakPolarHBondContact O-CB 3.4Å; L338-S342 PolarHBondContact O-N 3.07Å
339	E	96.4	Very high	96.8	Very high	88 Å²	88	45.1 Å²	45.1	41%	0.411	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-35.1	-171.3	-166.5	65.8	-135.4	0	0	113.2	R334 N337 S342 S343	R334-E339 VanDerWaalsContact CG-OE2 3.31Å; R334-E339 WeakPolarHBondContact CG-OE2 3.16Å; R334-E339 IonicContact CZ-OE1 3.69Å; R334-E339 IonicContact NE-OE1 3.8Å; R334-E339 PolarHBondContact NE-OE1 3.19Å; R334-E339 IonicContact NE-OE2 2.79Å; R334-E339 PolarHBondContact NE-OE2 3.26Å; R334-E339 IonicContact NH2-OE1 3.89Å; R334-E339 PolarHBondContact NH2-OE1 3.48Å; N337-E339 VanDerWaalsContact C-N 3.34Å; N337-E339 PolarHBondContact O-N 3.05Å; E339-S342 PolarHBondContact O-N 3.44Å; E339-S343 WeakPolarHBondContact O-CB 3.37Å; E339-S343 PolarHBondContact O-N 3.12Å; E339-S343 PolarHBondContact O-OG 3.12Å
340	Y	97.2	Very high	96.5	Very high	166 Å²	166	48.7 Å²	48.7	65%	0.651	24%	0.243	S	C	*	.	H	α-helix	trans	-60	-53.1	177	173.2	-106	0	0	0	111.7	L338 S343 M344	L338-Y340 VanDerWaalsContact C-N 3.29Å; L338-Y340 PolarHBondContact O-N 2.79Å; Y340-S343 PolarHBondContact O-N 2.79Å; Y340-M344 HydrophobicContact CD1-CE 4.07Å; Y340-M344 HydrophobicContact CE1-CE 3.21Å; Y340-M344 HydrophobicContact CE2-CE 4.03Å; Y340-M344 WeakPolarHBondContact O-CB 3.27Å; Y340-M344 PolarHBondContact O-N 3.43Å; Y340-M344 WeakPolarHBondContact OH-CE 3.1Å
341	H	97.6	Very high	96.3	Very high	33 Å²	33	56 Å²	56	15%	0.153	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-39.7	178.6	-65.5	-76.7	0	0	0	111.6	A74 A75 V76 P77 L333 L338 S343 M344 I345	A74-H341 PolarHBondContact O-ND1 2.9Å; A75-H341 PolarHBondContact O-CE1 3.25Å; V76-H341 HydrophobicContact CG2-CB 4.2Å; P77-H341 WeakPolarHBondContact CD-NE2 3.46Å; L333-H341 HydrophobicContact CD1-CB 3.9Å; L338-H341 PolarHBondContact O-N 2.98Å; H341-S343 PolarHBondContact O-N 2.82Å; H341-M344 PolarHBondContact O-N 3.31Å; H341-I345 WeakPolarHBondContact O-CG1 3.44Å; H341-I345 PolarHBondContact O-N 2.81Å
342	S	97.5	Very high	95.9	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.2	-51.4	175	-178.5	0	0	0	0	111.9	S330 R334 L338 E339 A346	S330-S342 VanDerWaalsContact O-CB 3.31Å; S330-S342 WeakPolarHBondContact O-CB 3.29Å; S330-S342 PolarHBondContact O-OG 3.16Å; R334-S342 PolarHBondContact NH2-OG 3.37Å; R334-S342 VanDerWaalsContact NH2-OG 3.16Å; L338-S342 WeakPolarHBondContact O-CB 3.4Å; L338-S342 PolarHBondContact O-N 3.07Å; E339-S342 PolarHBondContact O-N 3.44Å; S342-A346 VanDerWaalsContact O-CB 3.27Å; S342-A346 WeakPolarHBondContact O-CB 3.35Å; S342-A346 PolarHBondContact O-N 2.97Å
343	S	97.6	Very high	95.4	Very high	41 Å²	41	58.7 Å²	58.7	29%	0.287	29%	0.292	S	S	.	.	H	α-helix	trans	-66.7	-42.7	-178.4	-60.2	0	0	0	0	111.5	E339 Y340 H341 I345 A346 D347	E339-S343 WeakPolarHBondContact O-CB 3.37Å; E339-S343 PolarHBondContact O-N 3.12Å; E339-S343 PolarHBondContact O-OG 3.12Å; Y340-S343 PolarHBondContact O-N 2.79Å; H341-S343 PolarHBondContact O-N 2.82Å; S343-I345 PolarHBondContact O-N 3.45Å; S343-A346 PolarHBondContact O-N 2.51Å; S343-D347 VanDerWaalsContact O-CB 3.27Å; S343-D347 WeakPolarHBondContact O-CB 2.87Å; S343-D347 VanDerWaalsContact O-CG 3.28Å; S343-D347 PolarHBondContact O-N 3.49Å
344	M	97.4	Very high	94.8	Very high	69 Å²	69	66.3 Å²	66.3	34%	0.34	33%	0.325	S	S	.	.	H	α-helix	trans	-56.3	-50.8	177.5	-176.4	-166.8	-59.9	0	0	112	A74 Y340 H341 A348	A74-M344 HydrophobicContact CB-SD 4.18Å; Y340-M344 HydrophobicContact CD1-CE 4.07Å; Y340-M344 HydrophobicContact CE1-CE 3.21Å; Y340-M344 HydrophobicContact CE2-CE 4.03Å; Y340-M344 WeakPolarHBondContact O-CB 3.27Å; Y340-M344 PolarHBondContact O-N 3.43Å; Y340-M344 WeakPolarHBondContact OH-CE 3.1Å; H341-M344 PolarHBondContact O-N 3.31Å; M344-A348 VanDerWaalsContact O-CB 3.28Å; M344-A348 WeakPolarHBondContact O-CB 3.46Å; M344-A348 PolarHBondContact O-N 2.73Å
345	I	97.1	Very high	94	Very high	5 Å²	5	67 Å²	67	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-68	-48.1	-178.6	-65.4	173.7	0	0	0	110.3	V70 F71 A74 V76 S330 L333 H341 S343 D347 A348 V349	V70-I345 HydrophobicContact CG1-CD1 4.14Å; V70-I345 HydrophobicContact CG1-CG1 4.11Å; V70-I345 HydrophobicContact CG1-CG2 4.09Å; F71-I345 HydrophobicContact CD2-CD1 3.9Å; F71-I345 HydrophobicContact CE2-CD1 3.71Å; A74-I345 HydrophobicContact CB-CG1 4.45Å; V76-I345 HydrophobicContact CG2-CD1 4.05Å; S330-I345 WeakPolarHBondContact OG-CG2 3.41Å; L333-I345 HydrophobicContact CD1-CD1 3.79Å; H341-I345 WeakPolarHBondContact O-CG1 3.44Å; H341-I345 PolarHBondContact O-N 2.81Å; S343-I345 PolarHBondContact O-N 3.45Å; I345-D347 VanDerWaalsContact C-N 3.31Å; I345-D347 PolarHBondContact O-N 3.23Å; I345-A348 PolarHBondContact O-N 2.79Å; I345-V349 HydrophobicContact CG2-CG2 4.43Å; I345-V349 WeakPolarHBondContact O-CG2 3.3Å; I345-V349 PolarHBondContact O-N 3.05Å
346	A	96.1	Very high	92.6	Very high	8 Å²	8	66 Å²	66	7%	0.066	35%	0.349	C	S	.	.	H	α-helix	trans	-59.9	-40.5	-179	0	0	0	0	0	112.4	L327 S342 S343 K350	L327-A346 HydrophobicContact CD2-CB 4.41Å; S342-A346 VanDerWaalsContact O-CB 3.27Å; S342-A346 WeakPolarHBondContact O-CB 3.35Å; S342-A346 PolarHBondContact O-N 2.97Å; S343-A346 PolarHBondContact O-N 2.51Å; A346-K350 VanDerWaalsContact O-CG 3.28Å; A346-K350 WeakPolarHBondContact O-CG 3.45Å; A346-K350 PolarHBondContact O-N 3.42Å
347	D	95.9	Very high	90.9	Very high	89 Å²	89	72.7 Å²	72.7	48%	0.476	38%	0.377	S	S	.	.	H	α-helix	trans	-75.9	-33.9	179.7	-68.5	-18.2	0	0	0	112.3	S343 I345 K350 K351	S343-D347 VanDerWaalsContact O-CB 3.27Å; S343-D347 WeakPolarHBondContact O-CB 2.87Å; S343-D347 VanDerWaalsContact O-CG 3.28Å; S343-D347 PolarHBondContact O-N 3.49Å; I345-D347 VanDerWaalsContact C-N 3.31Å; I345-D347 PolarHBondContact O-N 3.23Å; D347-K350 PolarHBondContact O-N 2.97Å; D347-K350 IonicContact OD1-NZ 3.63Å; D347-K350 PolarHBondContact OD1-NZ 3.49Å; D347-K351 VanDerWaalsContact O-CB 3.3Å; D347-K351 WeakPolarHBondContact O-CB 3.35Å; D347-K351 PolarHBondContact O-N 3.21Å
348	A	95.3	Very high	89.1	Confident	51 Å²	51	67.8 Å²	67.8	42%	0.421	35%	0.35	S	S	.	.	H	α-helix	trans	-60.7	-45.8	170.5	0	0	0	0	0	111.4	M344 I345 K351 V352	M344-A348 VanDerWaalsContact O-CB 3.28Å; M344-A348 WeakPolarHBondContact O-CB 3.46Å; M344-A348 PolarHBondContact O-N 2.73Å; I345-A348 PolarHBondContact O-N 2.79Å; A348-K351 PolarHBondContact O-N 3.46Å; A348-V352 WeakPolarHBondContact O-CG2 3.38Å; A348-V352 PolarHBondContact O-N 2.88Å
349	V	93.7	Very high	87.1	Confident	16 Å²	16	69.9 Å²	69.9	10%	0.097	37%	0.366	C	S	.	.	H	α-helix	trans	-58.2	-51.5	175.4	170.7	0	0	0	0	110.7	T323 L326 L327 I345 K351 V352 I353	T323-V349 HydrophobicContact CG2-CG1 3.95Å; L326-V349 HydrophobicContact CB-CG2 3.97Å; L326-V349 HydrophobicContact CD1-CG2 4.01Å; L327-V349 HydrophobicContact CD2-CG1 4.24Å; L327-V349 HydrophobicContact CG-CG1 4.38Å; I345-V349 HydrophobicContact CG2-CG2 4.43Å; I345-V349 WeakPolarHBondContact O-CG2 3.3Å; I345-V349 PolarHBondContact O-N 3.05Å; V349-K351 VanDerWaalsContact C-N 3.27Å; V349-K351 PolarHBondContact O-N 3Å; V349-V352 PolarHBondContact O-N 3Å; V349-I353 HydrophobicContact CG1-CD1 3.77Å; V349-I353 VanDerWaalsContact O-CG1 3.29Å; V349-I353 WeakPolarHBondContact O-CG1 3.48Å; V349-I353 PolarHBondContact O-N 3Å
350	K	91.6	Very high	84.7	Confident	75 Å²	75	69.6 Å²	69.6	33%	0.326	37%	0.374	S	S	.	.	H	α-helix	trans	-58.8	-38	177.1	-68.4	169.2	-154.2	155.5	0	112.4	P149 A346 D347 I353 K354	P149-K350 HydrophobicContact CG-CB 4.32Å; A346-K350 VanDerWaalsContact O-CG 3.28Å; A346-K350 WeakPolarHBondContact O-CG 3.45Å; A346-K350 PolarHBondContact O-N 3.42Å; D347-K350 PolarHBondContact O-N 2.97Å; D347-K350 IonicContact OD1-NZ 3.63Å; D347-K350 PolarHBondContact OD1-NZ 3.49Å; K350-I353 PolarHBondContact O-N 2.99Å; K350-K354 WeakPolarHBondContact O-CB 3.21Å; K350-K354 PolarHBondContact O-N 3.46Å
351	K	91.9	Very high	82.1	Confident	155 Å²	155	64 Å²	64	67%	0.674	36%	0.361	S	S	*	.	H	α-helix	trans	-66.2	-43.2	178.8	-172.3	177	-178.8	179.6	0	111.6	D347 A348 V349 I353 K354 V355	D347-K351 VanDerWaalsContact O-CB 3.3Å; D347-K351 WeakPolarHBondContact O-CB 3.35Å; D347-K351 PolarHBondContact O-N 3.21Å; A348-K351 PolarHBondContact O-N 3.46Å; V349-K351 VanDerWaalsContact C-N 3.27Å; V349-K351 PolarHBondContact O-N 3Å; K351-I353 VanDerWaalsContact C-N 3.35Å; K351-K354 PolarHBondContact O-N 3.26Å; K351-V355 VanDerWaalsContact O-CG2 3.29Å; K351-V355 WeakPolarHBondContact O-CG2 3.3Å; K351-V355 PolarHBondContact O-N 3.24Å; K351-V355 VanDerWaalsContact O-N 3.15Å
352	V	90.6	Very high	79.2	Confident	78 Å²	78	65.5 Å²	65.5	47%	0.473	37%	0.373	S	S	.	.	H	α-helix	trans	-62.5	-44.2	176.1	172.6	0	0	0	0	110.8	A348 V349 K354 V355 G356 K357	A348-V352 WeakPolarHBondContact O-CG2 3.38Å; A348-V352 PolarHBondContact O-N 2.88Å; V349-V352 PolarHBondContact O-N 3Å; V352-K354 PolarHBondContact O-N 3.4Å; V352-V355 PolarHBondContact O-N 3.13Å; V352-G356 PolarHBondContact O-N 2.95Å; V352-K357 HydrophobicContact CG1-CB 4.48Å
353	I	87.3	Confident	76.1	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.021	40%	0.396	C	S	.	.	H	α-helix	trans	-58.9	-48.4	176.3	-66.2	167.2	0	0	0	110.7	L148 P149 Y151 T323 V349 K350 K351 V355 G356 I358	L148-I353 HydrophobicContact CD1-CD1 3.87Å; P149-I353 WeakPolarHBondContact O-CG2 3.22Å; Y151-I353 HydrophobicContact CD2-CG2 3.52Å; Y151-I353 HydrophobicContact CE2-CD1 4.09Å; Y151-I353 HydrophobicContact CE2-CG1 4.2Å; Y151-I353 HydrophobicContact CE2-CG2 3.59Å; T323-I353 HydrophobicContact CG2-CD1 3.67Å; V349-I353 HydrophobicContact CG1-CD1 3.77Å; V349-I353 VanDerWaalsContact O-CG1 3.29Å; V349-I353 WeakPolarHBondContact O-CG1 3.48Å; V349-I353 PolarHBondContact O-N 3Å; K350-I353 PolarHBondContact O-N 2.99Å; K351-I353 VanDerWaalsContact C-N 3.35Å; I353-V355 VanDerWaalsContact C-N 3.25Å; I353-V355 PolarHBondContact O-N 3.37Å; I353-G356 PolarHBondContact O-N 3.32Å; I353-I358 HydrophobicContact CB-CD1 3.94Å; I353-I358 HydrophobicContact CB-CG1 4.46Å; I353-I358 HydrophobicContact CG1-CD1 4.13Å; I353-I358 HydrophobicContact CG1-CG1 4.46Å; I353-I358 HydrophobicContact CG2-CD1 3.56Å
354	K	84.6	Confident	72.9	Confident	159 Å²	159	71.9 Å²	71.9	69%	0.691	42%	0.416	S	S	*	.	H	α-helix	trans	-60.8	-32.2	179.9	-172.5	177.7	-179.6	-179.5	0	113.5	P149 K350 K351 V352 G356	P149-K354 PolarHBondContact O-N 3.23Å; K350-K354 WeakPolarHBondContact O-CB 3.21Å; K350-K354 PolarHBondContact O-N 3.46Å; K351-K354 PolarHBondContact O-N 3.26Å; V352-K354 PolarHBondContact O-N 3.4Å; K354-G356 PolarHBondContact O-N 3.1Å
355	V	81.3	Confident	69.7	Low	98 Å²	98	77.6 Å²	77.6	59%	0.594	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-8.7	178.8	176.2	0	0	0	0	112	K351 V352 I353 K357	K351-V355 VanDerWaalsContact O-CG2 3.29Å; K351-V355 WeakPolarHBondContact O-CG2 3.3Å; K351-V355 PolarHBondContact O-N 3.24Å; K351-V355 VanDerWaalsContact O-N 3.15Å; V352-V355 PolarHBondContact O-N 3.13Å; I353-V355 VanDerWaalsContact C-N 3.25Å; I353-V355 PolarHBondContact O-N 3.37Å; V355-K357 VanDerWaalsContact C-N 3.3Å; V355-K357 HydrophobicContact CG1-CD 4.42Å; V355-K357 HydrophobicContact CG1-CG 4.22Å; V355-K357 PolarHBondContact O-N 3.19Å
356	G	67.6	Low	66.7	Low	58 Å²	58	83.1 Å²	83.1	60%	0.598	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	11.4	177.8	0	0	0	0	0	114.2	V352 I353 K354 I358	V352-G356 PolarHBondContact O-N 2.95Å; I353-G356 PolarHBondContact O-N 3.32Å; K354-G356 PolarHBondContact O-N 3.1Å; G356-I358 PolarHBondContact O-N 3.35Å; G356-I358 VanDerWaalsContact O-N 3.1Å
357	K	60.4	Low	63.7	Low	164 Å²	164	90.2 Å²	90.2	71%	0.713	50%	0.504	S	S	*	.			trans	-85.8	58.9	173.5	-70.7	-173.9	179.1	-173.3	0	110.5	V352 V355	V352-K357 HydrophobicContact CG1-CB 4.48Å; V355-K357 VanDerWaalsContact C-N 3.3Å; V355-K357 HydrophobicContact CG1-CD 4.42Å; V355-K357 HydrophobicContact CG1-CG 4.22Å; V355-K357 PolarHBondContact O-N 3.19Å
358	I	58.4	Low	60.3	Low	41 Å²	41	93.7 Å²	93.7	21%	0.21	52%	0.517	C	S	.	.			trans	-115.5	130.3	-176.7	-33.7	171.5	0	0	0	109.4	Y151 I353 G356 S360	Y151-I358 HydrophobicContact CD2-CD1 4.49Å; Y151-I358 HydrophobicContact CE1-CD1 4.25Å; Y151-I358 HydrophobicContact CE2-CD1 3.98Å; Y151-I358 WeakPolarHBondContact OH-CG2 3.46Å; I353-I358 HydrophobicContact CB-CD1 3.94Å; I353-I358 HydrophobicContact CB-CG1 4.46Å; I353-I358 HydrophobicContact CG1-CD1 4.13Å; I353-I358 HydrophobicContact CG1-CG1 4.46Å; I353-I358 HydrophobicContact CG2-CD1 3.56Å; G356-I358 PolarHBondContact O-N 3.35Å; G356-I358 VanDerWaalsContact O-N 3.1Å; I358-S360 PolarHBondContact O-N 3.06Å; I358-S360 VanDerWaalsContact O-N 3.13Å
359	P	53	Low	57.1	Low	69 Å²	69	96.8 Å²	96.8	45%	0.448	53%	0.533	S	S	.	.			trans	-56.2	118.4	160.5	-18	30.5	0	0	0	107.7	A361	P359-A361 PolarHBondContact O-N 3.38Å
360	S	46.4	Very low	53.8	Low	83 Å²	83	103.7 Å²	103.7	58%	0.58	57%	0.568	S	S	*	*			trans	-58.4	106.2	-175.7	51.7	0	0	0	0	110.7	I358 V362	I358-S360 PolarHBondContact O-N 3.06Å; I358-S360 VanDerWaalsContact O-N 3.13Å; S360-V362 VanDerWaalsContact CB-O 3.3Å; S360-V362 WeakPolarHBondContact CB-O 3.37Å; S360-V362 PolarHBondContact O-N 3.31Å
361	A	43.7	Very low	50.6	Low	47 Å²	47	105.5 Å²	105.5	39%	0.388	59%	0.588	S	S	.	*	S	Bend	trans	-66.7	-13.6	161	0	0	0	0	0	111.4	N321 P359	N321-A361 HydrophobicContact CB-CB 4.5Å; P359-A361 PolarHBondContact O-N 3.38Å
362	V	37.1	Very low	47.6	Very low	66 Å²	66	109 Å²	109	40%	0.4	60%	0.603	S	S	.	*	S	Bend	trans	-131.4	106.8	177.2	-173.3	0	0	0	0	106.9	S360 S364 L366	S360-V362 VanDerWaalsContact CB-O 3.3Å; S360-V362 WeakPolarHBondContact CB-O 3.37Å; S360-V362 PolarHBondContact O-N 3.31Å; V362-S364 PolarHBondContact O-N 3.18Å; V362-L366 HydrophobicContact CG1-CB 3.87Å; V362-L366 HydrophobicContact CG1-CD1 3.52Å; V362-L366 HydrophobicContact CG1-CG 4.32Å
363	P	31.5	Very low	44.4	Very low	76 Å²	76	109.1 Å²	109.1	49%	0.494	61%	0.608	S	S	.	*			trans	-50.5	138.6	172.9	-22.5	31.5	0	0	0	109.4	F365 L366	P363-F365 PolarHBondContact O-N 3.18Å; P363-L366 PolarHBondContact O-N 2.77Å
364	S	31.3	Very low	41.5	Very low	99 Å²	99	119.8 Å²	119.8	69%	0.692	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-54	-3	176.7	41.5	0	0	0	0	115.1	V362	V362-S364 PolarHBondContact O-N 3.18Å
365	F	29.9	Very low	38.6	Very low	188 Å²	188	117.1 Å²	117.1	83%	0.825	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-79.3	-10.9	174.9	-84	-87.5	0	0	0	115.3	P363 L367	P363-F365 PolarHBondContact O-N 3.18Å; F365-L367 VanDerWaalsContact C-N 3.32Å; F365-L367 PolarHBondContact O-N 3.47Å
366	L	33.2	Very low	36.1	Very low	122 Å²	122	120 Å²	120	64%	0.639	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-86.2	5.5	178.7	-83.5	161.1	0	0	0	114.7	V362 P363 H368	V362-L366 HydrophobicContact CG1-CB 3.87Å; V362-L366 HydrophobicContact CG1-CD1 3.52Å; V362-L366 HydrophobicContact CG1-CG 4.32Å; P363-L366 PolarHBondContact O-N 2.77Å; L366-H368 VanDerWaalsContact C-N 3.31Å
367	L	33.5	Very low	34.5	Very low	157 Å²	157	123.1 Å²	123.1	82%	0.822	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-82.9	-1.2	174.2	-76.8	166	0	0	0	113.9	F365	F365-L367 VanDerWaalsContact C-N 3.32Å; F365-L367 PolarHBondContact O-N 3.47Å
368	H	25	Very low	33.2	Very low	162 Å²	162	120.9 Å²	120.9	75%	0.75	67%	0.667	S	S	*	*	S	Bend	trans	-110.4	137.9	170.1	-91	-52.6	0	0	0	111.8	L366 L370	L366-H368 VanDerWaalsContact C-N 3.31Å; H368-L370 PolarHBondContact O-N 3.11Å; H368-L370 VanDerWaalsContact O-N 3.11Å
369	P	28.2	Very low	31.8	Very low	116 Å²	116	125.4 Å²	125.4	75%	0.753	69%	0.692	S	S	*	*			trans	-84.3	88.9	-172.5	33.6	-31.5	0	0	0	110.5
370	L	24.1	Very low	30.5	Very low	160 Å²	160	128.7 Å²	128.7	84%	0.838	71%	0.707	S	S	*	*			trans	-156.8	159.6	164.9	-86.8	-166.8	0	0	0	111.1	H368	H368-L370 PolarHBondContact O-N 3.11Å; H368-L370 VanDerWaalsContact O-N 3.11Å
371	P	24.6	Very low	29.5	Very low	114 Å²	114	131.6 Å²	131.6	74%	0.74	71%	0.714	S	S	*	*				-74.5	148.7	-115.5	33.7	-36.5	0	0	0	114.8	S373	P371-S373 PolarHBondContact O-N 2.97Å
372	F	28.3	Very low	28.6	Very low	229 Å²	229	137.2 Å²	137.2	100%	1.004	74%	0.736	S	S	*	*			trans	-38.6	101	167.6	-102.5	-104.2	0	0	0	112.7
373	S	23.7	Very low	28	Very low	80 Å²	80	142.3 Å²	142.3	56%	0.559	76%	0.76	S	S	*	*			trans	-157.3	135.9	155.6	-171.9	0	0	0	0	106	P371	P371-S373 PolarHBondContact O-N 2.97Å
374	W	25.3	Very low	27.7	Very low	227 Å²	227	147.4 Å²	147.4	86%	0.86	78%	0.781	S	S	*	*			trans	87	72.9	177	-42.3	104.4	0	0	0	116.7
375	A	23.3	Very low	27.4	Very low	103 Å²	103	151.4 Å²	151.4	85%	0.851	79%	0.788	S	S	*	*			trans	-130.3	105.8	144.8	0	0	0	0	0	107.3
376	I	30	Very low	27.2	Very low	159 Å²	159	148.1 Å²	148.1	82%	0.815	79%	0.785	S	S	*	*			trans	-128.3	0	161.8	-61.4	179.5	0	0	0	106.4

Retrieved 376 of 376 residues in 155.1 ms (Link to these results)

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