A0A087WZN1_HUMAN Loading...

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 A0A087WZN1, Species HUMAN (Homo sapiens, Human), Gene IDH3B, Length 387 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	42	Very low	31.5	Very low	242 Å²	242	150.7 Å²	150.7	100%	1.192	85%	0.845	S	S	*	*				0	88.9	0	-65.4	-171.1	-169.5	0	0	106.5
2	A	32.5	Very low	31.4	Very low	99 Å²	99	158.2 Å²	158.2	82%	0.818	85%	0.85	S	S	*	*				64.4	102	92.5	0	0	0	0	0	110.3
3	A	32.7	Very low	31.2	Very low	87 Å²	87	153.1 Å²	153.1	72%	0.719	84%	0.843	S	S	*	*				105	121.2	59.3	0	0	0	0	0	111.7
4	L	31.4	Very low	31	Very low	162 Å²	162	154 Å²	154	85%	0.848	85%	0.845	S	S	*	*			trans	59	118.5	132.2	-66.3	161	0	0	0	118.6
5	S	30.3	Very low	30.9	Very low	121 Å²	121	152.9 Å²	152.9	85%	0.846	84%	0.844	S	S	*	*				116.7	147.9	104.6	64.5	0	0	0	0	109.4
6	G	29.4	Very low	30.7	Very low	67 Å²	67	149.9 Å²	149.9	69%	0.691	84%	0.837	S	S	*	*			cis	-178.5	162.4	-0.1	0	0	0	0	0	111.2
7	V	30.5	Very low	30.7	Very low	139 Å²	139	146.6 Å²	146.6	84%	0.842	83%	0.834	S	S	*	*			trans	81.8	109.3	141.4	-168.3	0	0	0	0	121.9
8	R	29.1	Very low	30.5	Very low	206 Å²	206	142.3 Å²	142.3	78%	0.777	83%	0.827	S	S	*	*			trans	22.7	131.9	136.6	-71.1	176.4	162.6	-175.2	-4.8	121
9	W	27.4	Very low	30.6	Very low	253 Å²	253	142.6 Å²	142.6	96%	0.958	83%	0.825	S	S	*	*				-136.2	134.4	122.9	-84	84.6	0	0	0	110.9
10	L	31.8	Very low	30.7	Very low	143 Å²	143	141.6 Å²	141.6	75%	0.749	82%	0.823	S	S	*	*			trans	-80.2	125.8	173.6	-88.4	134.7	0	0	0	109.7
11	T	30	Very low	30.6	Very low	139 Å²	139	137.8 Å²	137.8	85%	0.853	82%	0.815	S	S	*	*			trans	-134.4	118.6	153.6	34.1	0	0	0	0	110.1	A13	T11-A13 PolarHBondContact O-N 3.13Å
12	R	29.8	Very low	30.1	Very low	240 Å²	240	130.7 Å²	130.7	91%	0.906	80%	0.795	S	S	*	*			trans	-74.4	103.2	179.3	-145.2	179.7	-173	-168.6	1.1	107.4
13	A	29.3	Very low	30.1	Very low	92 Å²	92	138.2 Å²	138.2	76%	0.76	80%	0.802	S	S	*	*			trans	-93.1	106.7	168.7	0	0	0	0	0	108.7	T11 V15	T11-A13 PolarHBondContact O-N 3.13Å; A13-V15 PolarHBondContact O-N 2.89Å; A13-V15 VanDerWaalsContact O-N 3.16Å
14	L	28.3	Very low	30	Very low	166 Å²	166	145.9 Å²	145.9	87%	0.869	81%	0.812	S	S	*	*			trans	-60.2	107.1	166.5	-87.9	133.9	0	0	0	108.8	S16	L14-S16 PolarHBondContact O-N 2.69Å
15	V	29.4	Very low	29.7	Very low	137 Å²	137	141.5 Å²	141.5	83%	0.83	81%	0.806	S	S	*	*			trans	-77.1	101.7	159.7	176.5	0	0	0	0	106.4	A13 A17	A13-V15 PolarHBondContact O-N 2.89Å; A13-V15 VanDerWaalsContact O-N 3.16Å; V15-A17 PolarHBondContact O-N 2.94Å; V15-A17 VanDerWaalsContact O-N 3.16Å
16	S	27.6	Very low	29.7	Very low	105 Å²	105	144.1 Å²	144.1	73%	0.734	81%	0.81	S	S	*	*			trans	-61	109.7	167.5	136	0	0	0	0	108.2	L14 G18	L14-S16 PolarHBondContact O-N 2.69Å; S16-G18 PolarHBondContact O-N 3.38Å
17	A	29.8	Very low	29.6	Very low	94 Å²	94	146.4 Å²	146.4	78%	0.777	82%	0.815	S	S	*	*			trans	-64.8	113.5	167.5	0	0	0	0	0	108.9	V15 N19	V15-A17 PolarHBondContact O-N 2.94Å; V15-A17 VanDerWaalsContact O-N 3.16Å; A17-N19 PolarHBondContact O-N 2.74Å
18	G	27	Very low	29.6	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	82%	0.816	S	S	*	*			trans	-67	111	169.5	0	0	0	0	0	109.7	S16 P20	S16-G18 PolarHBondContact O-N 3.38Å; G18-P20 WeakPolarHBondContact O-CD 3.31Å
19	N	32.5	Very low	29.7	Very low	148 Å²	148	142.1 Å²	142.1	79%	0.791	82%	0.817	S	S	*	*			trans	-64.8	120.9	172.2	-161.5	14.4	0	0	0	109.5	A17 G21	A17-N19 PolarHBondContact O-N 2.74Å; N19-G21 PolarHBondContact O-N 3.18Å; N19-G21 VanDerWaalsContact O-N 3.16Å
20	P	33.3	Very low	29.7	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	81%	0.813	S	S	*	*			trans	-75.7	105	167.3	2.6	13.5	0	0	0	107.9	G18	G18-P20 WeakPolarHBondContact O-CD 3.31Å
21	G	28.8	Very low	29.6	Very low	62 Å²	62	132.9 Å²	132.9	64%	0.639	82%	0.815	S	S	*	*			trans	-61.2	136.8	-177.1	0	0	0	0	0	114.1	N19	N19-G21 PolarHBondContact O-N 3.18Å; N19-G21 VanDerWaalsContact O-N 3.16Å
22	A	30.7	Very low	29.6	Very low	93 Å²	93	131 Å²	131	77%	0.769	81%	0.814	S	S	*	*			trans	52.5	88.2	134.8	0	0	0	0	0	117.6	R24	A22-R24 PolarHBondContact O-N 3.03Å
23	W	33.3	Very low	29.7	Very low	257 Å²	257	129 Å²	129	97%	0.973	81%	0.814	S	S	*	*			trans	-62.7	115.3	153	-69.1	66.7	0	0	0	108.2	G25	W23-G25 PolarHBondContact O-N 3.43Å
24	R	29.8	Very low	29.5	Very low	249 Å²	249	129 Å²	129	94%	0.94	81%	0.814	S	S	*	*			trans	-65.4	100.9	170	-80.1	-176.9	179	-125.8	1.4	108.1	A22	A22-R24 PolarHBondContact O-N 3.03Å
25	G	26.8	Very low	30	Very low	69 Å²	69	126.6 Å²	126.6	71%	0.711	82%	0.818	S	S	*	*			trans	-60.9	137.9	167.1	0	0	0	0	0	110.3	W23 S27	W23-G25 PolarHBondContact O-N 3.43Å; G25-S27 PolarHBondContact O-N 3.05Å
26	L	29.9	Very low	29.9	Very low	177 Å²	177	125 Å²	125	93%	0.927	81%	0.813	S	S	*	*			trans	-60.5	115.4	164.1	-77.5	152.6	0	0	0	107.5	T28	L26-T28 PolarHBondContact O-N 3.05Å
27	S	27.1	Very low	30.3	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	82%	0.823	S	S	*	*			trans	-60.3	120	177.5	52.1	0	0	0	0	110.5	G25 S29	G25-S27 PolarHBondContact O-N 3.05Å; S27-S29 PolarHBondContact O-N 3.2Å
28	T	29.8	Very low	30.3	Very low	141 Å²	141	132.7 Å²	132.7	87%	0.865	82%	0.823	S	S	*	*			trans	-72.2	112.2	163.6	47.9	0	0	0	0	109.3	L26	L26-T28 PolarHBondContact O-N 3.05Å
29	S	30.4	Very low	30.5	Very low	115 Å²	115	138 Å²	138	80%	0.804	83%	0.829	S	S	*	*			trans	-96.8	107.7	155.9	53.8	0	0	0	0	108.5	S27 A31	S27-S29 PolarHBondContact O-N 3.2Å; S29-A31 PolarHBondContact O-N 3.37Å
30	A	29.2	Very low	30.5	Very low	106 Å²	106	135.7 Å²	135.7	88%	0.876	83%	0.831	S	S	*	*			trans	-69.3	119	160.3	0	0	0	0	0	108
31	A	29.1	Very low	30.5	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	83%	0.833	S	S	*	*			trans	-130.9	127.3	161	0	0	0	0	0	108.2	S29	S29-A31 PolarHBondContact O-N 3.37Å
32	A	28.8	Very low	30.9	Very low	100 Å²	100	141.3 Å²	141.3	83%	0.826	83%	0.833	S	S	*	*			trans	-64.2	164.7	-169.8	0	0	0	0	0	114	A34	A32-A34 PolarHBondContact O-N 3.35Å
33	H	32.2	Very low	31.3	Very low	199 Å²	199	142.4 Å²	142.4	92%	0.921	83%	0.83	S	S	*	*			trans	-38.7	121.2	172	-77.8	-14.4	0	0	0	114.8
34	A	26.1	Very low	31.6	Very low	92 Å²	92	140.8 Å²	140.8	76%	0.76	82%	0.824	S	S	*	*			trans	-143.3	111.9	146.1	0	0	0	0	0	108.1	A32 S36	A32-A34 PolarHBondContact O-N 3.35Å; A34-S36 PolarHBondContact O-N 3.04Å
35	A	38.8	Very low	32.6	Very low	114 Å²	114	132.4 Å²	132.4	94%	0.942	80%	0.801	S	S	*	*			trans	-62.5	118.4	171.1	0	0	0	0	0	109.1
36	S	26.8	Very low	33.7	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	81%	0.812	S	S	*	*			trans	-142.9	117.9	170.6	171.8	0	0	0	0	107.9	A34 S38	A34-S36 PolarHBondContact O-N 3.04Å; S36-S38 PolarHBondContact O-N 3.47Å
37	R	35.8	Very low	35.6	Very low	250 Å²	250	132.5 Å²	132.5	94%	0.943	79%	0.79	S	S	*	*			trans	-62.8	101	169.6	-81.6	174.5	169.7	171.6	-3.9	107.8	Q39	R37-Q39 PolarHBondContact O-N 3.43Å
38	S	30	Very low	38.4	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	77%	0.771	S	S	*	*			trans	-76.2	105.7	167.9	60.3	0	0	0	0	108.8	S36 A40	S36-S38 PolarHBondContact O-N 3.47Å; S38-A40 PolarHBondContact O-N 3.22Å
39	Q	32.1	Very low	41.5	Very low	181 Å²	181	125.3 Å²	125.3	85%	0.846	74%	0.74	S	S	*	*			trans	-56.5	127.3	156	-72.9	179.4	-11.7	0	0	107.1	R37 E41	R37-Q39 PolarHBondContact O-N 3.43Å; Q39-E41 PolarHBondContact O-N 3.49Å
40	A	32.6	Very low	44.6	Very low	101 Å²	101	122.5 Å²	122.5	84%	0.835	72%	0.719	S	S	*	*			trans	-65.2	102	170.8	0	0	0	0	0	107.5	S38 D42	S38-A40 PolarHBondContact O-N 3.22Å; A40-D42 PolarHBondContact O-N 2.97Å
41	E	32.5	Very low	47.9	Very low	177 Å²	177	117.5 Å²	117.5	83%	0.827	68%	0.677	S	S	*	*			trans	-66.8	116.5	166.9	-78.2	-174.9	154.3	0	0	107.9	Q39 V43	Q39-E41 PolarHBondContact O-N 3.49Å; E41-V43 VanDerWaalsContact C-N 3.33Å; E41-V43 PolarHBondContact O-N 3.04Å
42	D	37.5	Very low	51.2	Low	123 Å²	123	113 Å²	113	66%	0.658	64%	0.64	S	S	*	*			trans	-70.2	90.2	175.9	-148.1	7.9	0	0	0	107	A40 R44	A40-D42 PolarHBondContact O-N 2.97Å; D42-R44 PolarHBondContact O-N 3.09Å
43	V	38.2	Very low	54.5	Low	116 Å²	116	108.2 Å²	108.2	70%	0.703	60%	0.6	S	S	*	*			trans	-64.5	97.6	176.5	180	0	0	0	0	107.6	E41 V45	E41-V43 VanDerWaalsContact C-N 3.33Å; E41-V43 PolarHBondContact O-N 3.04Å; V43-V45 HydrophobicContact CG1-CG2 4.22Å; V43-V45 PolarHBondContact O-N 3.36Å
44	R	40.6	Very low	57.6	Low	223 Å²	223	98.7 Å²	98.7	84%	0.842	56%	0.556	S	S	*	*			trans	-69	97.7	166	-70.8	-175.8	177.8	-175.6	-0.5	107.3	D42 E46	D42-R44 PolarHBondContact O-N 3.09Å; R44-E46 PolarHBondContact O-N 3.2Å
45	V	51.4	Low	60.9	Low	74 Å²	74	94.5 Å²	94.5	45%	0.448	52%	0.521	S	S	.	.			trans	-63.1	115.5	171.8	179.8	0	0	0	0	107.6	V43 G47 F49	V43-V45 HydrophobicContact CG1-CG2 4.22Å; V43-V45 PolarHBondContact O-N 3.36Å; V45-G47 PolarHBondContact O-N 3.46Å; V45-F49 HydrophobicContact CB-CE2 4.03Å; V45-F49 HydrophobicContact CB-CZ 4.12Å; V45-F49 HydrophobicContact CG1-CE2 4.01Å; V45-F49 HydrophobicContact CG1-CZ 3.91Å; V45-F49 HydrophobicContact CG2-CE2 4.24Å; V45-F49 HydrophobicContact CG2-CZ 3.95Å
46	E	49.8	Very low	63.5	Low	202 Å²	202	89.6 Å²	89.6	94%	0.944	48%	0.482	S	S	*	.	S	Bend	trans	-71.3	95.3	169.1	-74.6	-172.4	163.6	0	0	108.1	R44	R44-E46 PolarHBondContact O-N 3.2Å
47	G	69.6	Low	66.6	Low	46 Å²	46	84.9 Å²	84.9	47%	0.474	45%	0.449	S	S	.	.	S	Bend	trans	147.1	154.4	178.4	0	0	0	0	0	112.5	V45	V45-G47 PolarHBondContact O-N 3.46Å
48	S	84.8	Confident	69.3	Low	56 Å²	56	73.8 Å²	73.8	39%	0.392	41%	0.412	S	S	.	.			trans	-87	140.4	170.9	-166.7	0	0	0	0	109.7	P50 V78 E79	S48-P50 WeakPolarHBondContact O-CD 3.45Å; S48-V78 VanDerWaalsContact OG-C 3.3Å; S48-E79 VanDerWaalsContact OG-CB 3.26Å; S48-E79 WeakPolarHBondContact OG-CB 3.28Å; S48-E79 PolarHBondContact OG-N 3.13Å
49	F	94.3	Very high	72.4	Confident	48 Å²	48	69 Å²	69	21%	0.211	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	114.5	173.1	-71.1	-91	0	0	0	109.4	V45 V51 P77 V78 E79 L336 L338	V45-F49 HydrophobicContact CB-CE2 4.03Å; V45-F49 HydrophobicContact CB-CZ 4.12Å; V45-F49 HydrophobicContact CG1-CE2 4.01Å; V45-F49 HydrophobicContact CG1-CZ 3.91Å; V45-F49 HydrophobicContact CG2-CE2 4.24Å; V45-F49 HydrophobicContact CG2-CZ 3.95Å; F49-V51 PolarHBondContact O-N 3.24Å; F49-P77 HydrophobicContact CD2-CG 4.4Å; F49-P77 WeakPolarHBondContact CD2-O 3.22Å; F49-P77 PolarHBondContact N-O 2.96Å; F49-V78 HydrophobicContact CB-CG2 4.2Å; F49-V78 WeakPolarHBondContact O-CA 3.39Å; F49-E79 PolarHBondContact O-N 3.34Å; F49-L336 HydrophobicContact CB-CD1 4.33Å; F49-L336 HydrophobicContact CD1-CD2 4.15Å; F49-L338 HydrophobicContact CD2-CD1 3.95Å; F49-L338 HydrophobicContact CD2-CD2 4.48Å; F49-L338 HydrophobicContact CE2-CD1 4.12Å; F49-L338 HydrophobicContact CE2-CD2 3.86Å; F49-L338 HydrophobicContact CE2-CG 4.23Å
50	P	96.8	Very high	75.3	Confident	56 Å²	56	60.6 Å²	60.6	36%	0.364	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	131.1	175.4	31.1	-34.5	0	0	0	109.7	S48 E79 N107	S48-P50 WeakPolarHBondContact O-CD 3.45Å; P50-E79 WeakPolarHBondContact CA-O 3.29Å; P50-N107 WeakPolarHBondContact CB-OD1 3.48Å
51	V	98.4	Very high	78.3	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.3	178.3	172.9	0	0	0	0	109	F49 M53 V78 E79 F80 Q81 V109 I111 M332 L336	F49-V51 PolarHBondContact O-N 3.24Å; V51-M53 PolarHBondContact O-N 2.98Å; V51-V78 HydrophobicContact CB-CG1 4.02Å; V51-V78 HydrophobicContact CG2-CG1 3.76Å; V51-E79 PolarHBondContact N-O 3.46Å; V51-F80 HydrophobicContact CB-CD1 3.97Å; V51-F80 HydrophobicContact CB-CE1 4.12Å; V51-F80 HydrophobicContact CG1-CD1 3.98Å; V51-F80 HydrophobicContact CG1-CE1 3.91Å; V51-F80 WeakPolarHBondContact O-CA 3.25Å; V51-Q81 PolarHBondContact O-N 3.45Å; V51-V109 HydrophobicContact CG1-CG1 4.41Å; V51-V109 HydrophobicContact CG2-CG1 4.34Å; V51-I111 HydrophobicContact CG1-CG2 4.38Å; V51-M332 HydrophobicContact CG1-CE 4.34Å; V51-M332 HydrophobicContact CG1-SD 3.66Å; V51-M332 HydrophobicContact CG2-CE 4.43Å; V51-M332 HydrophobicContact CG2-SD 4.33Å; V51-L336 HydrophobicContact CG2-CD1 4Å
52	T	98.6	Very high	81.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	123.7	172.9	-54.1	0	0	0	0	109.5	S103 M104 N107 V109 A110 I111	T52-S103 WeakPolarHBondContact CG2-OG 3.46Å; T52-S103 VanDerWaalsContact OG1-C 3.26Å; T52-S103 PolarHBondContact OG1-O 2.96Å; T52-S103 PolarHBondContact OG1-OG 3.29Å; T52-M104 HydrophobicContact CG2-CE 4.24Å; T52-M104 HydrophobicContact CG2-CG 3.78Å; T52-M104 PolarHBondContact OG1-N 3.37Å; T52-N107 PolarHBondContact OG1-ND2 3.23Å; T52-V109 PolarHBondContact N-O 3.35Å; T52-V109 VanDerWaalsContact N-O 3.13Å; T52-A110 HydrophobicContact CG2-CB 4.5Å; T52-A110 CarbonylContact O-C 3.55Å; T52-A110 WeakPolarHBondContact O-CA 3.45Å; T52-A110 WeakPolarHBondContact O-CB 3.45Å; T52-I111 PolarHBondContact O-N 2.91Å
53	M	98.5	Very high	84.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.1	174	176.8	174.6	-81.4	0	0	109.6	V51 P55 M64 V67 K68 F80 Q81 E82 H83 I111	V51-M53 PolarHBondContact O-N 2.98Å; M53-P55 HydrophobicContact CG-CG 4.49Å; M53-M64 HydrophobicContact CE-CB 4.25Å; M53-M64 HydrophobicContact CE-CG 4.46Å; M53-M64 HydrophobicContact CE-SD 4.04Å; M53-M64 HydrophobicContact CG-CB 4.48Å; M53-M64 HydrophobicContact CG-CG 4.17Å; M53-M64 HydrophobicContact CG-SD 4.3Å; M53-M64 HydrophobicContact SD-CB 3.83Å; M53-M64 HydrophobicContact SD-CG 4.15Å; M53-M64 HydrophobicContact SD-SD 4.43Å; M53-V67 HydrophobicContact CE-CG1 4.47Å; M53-K68 HydrophobicContact CE-CD 4.46Å; M53-K68 HydrophobicContact CE-CG 4.03Å; M53-K68 HydrophobicContact SD-CD 4.02Å; M53-K68 HydrophobicContact SD-CG 4.22Å; M53-F80 HydrophobicContact CB-CB 4.02Å; M53-F80 HydrophobicContact CB-CD1 3.94Å; M53-F80 HydrophobicContact CB-CG 4.24Å; M53-F80 HydrophobicContact CE-CB 4.27Å; M53-F80 HydrophobicContact CE-CD1 3.53Å; M53-F80 HydrophobicContact CE-CD2 3.65Å; M53-F80 HydrophobicContact CE-CE1 3.6Å; M53-F80 HydrophobicContact CE-CE2 3.72Å; M53-F80 HydrophobicContact CE-CG 3.54Å; M53-F80 HydrophobicContact CE-CZ 3.68Å; M53-F80 HydrophobicContact SD-CB 4.25Å; M53-F80 HydrophobicContact SD-CD1 4.44Å; M53-F80 HydrophobicContact SD-CG 4.17Å; M53-Q81 PolarHBondContact N-O 3.12Å; M53-E82 HydrophobicContact CB-CG 4.07Å; M53-E82 HydrophobicContact CG-CG 4.18Å; M53-E82 WeakPolarHBondContact O-CA 3.24Å; M53-E82 HydrophobicContact SD-CG 3.92Å; M53-H83 PolarHBondContact O-N 2.84Å; M53-I111 WeakPolarHBondContact CA-O 3.34Å; M53-I111 HydrophobicContact CB-CG2 4.12Å; M53-I111 HydrophobicContact CE-CG2 3.85Å; M53-I111 HydrophobicContact CG-CG2 4.12Å
54	L	96.8	Very high	87	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	99.5	173.4	-174.9	58.6	0	0	0	109.2	G56 H83 L85 V100 M104 I111 I112 G113 I115	L54-G56 PolarHBondContact O-N 2.96Å; L54-G56 VanDerWaalsContact O-N 3.16Å; L54-H83 HydrophobicContact CD1-CB 4.46Å; L54-H83 WeakPolarHBondContact CD1-O 3.44Å; L54-L85 HydrophobicContact CD1-CB 3.79Å; L54-L85 HydrophobicContact CD2-CB 4.31Å; L54-V100 HydrophobicContact CD2-CG1 4.26Å; L54-M104 HydrophobicContact CD2-CE 4.4Å; L54-I111 PolarHBondContact N-O 3.35Å; L54-I112 HydrophobicContact CB-CB 4.21Å; L54-I112 HydrophobicContact CB-CG2 3.85Å; L54-I112 HydrophobicContact CD2-CG2 4.43Å; L54-I112 CarbonylContact O-C 3.5Å; L54-I112 WeakPolarHBondContact O-CA 3.3Å; L54-G113 PolarHBondContact O-N 3.45Å; L54-I115 HydrophobicContact CD2-CD1 3.79Å; L54-I115 HydrophobicContact CD2-CG1 4.22Å
55	P	95.4	Very high	89.7	Confident	4 Å²	4	35.7 Å²	35.7	3%	0.026	21%	0.21	C	C	.	.			trans	-58.8	-30.2	-177.3	-27	37.1	0	0	0	114.5	M53 G60 P61 M64 H83 G113	M53-P55 HydrophobicContact CG-CG 4.49Å; P55-G60 CarbonylContact O-C 3.54Å; P55-G60 VanDerWaalsContact O-C 3.29Å; P55-G60 WeakPolarHBondContact O-CA 3.42Å; P55-P61 HydrophobicContact CB-CB 4.35Å; P55-P61 HydrophobicContact CB-CG 4.06Å; P55-M64 HydrophobicContact CB-CB 4.47Å; P55-M64 HydrophobicContact CB-CG 4.13Å; P55-M64 HydrophobicContact CG-CG 4.42Å; P55-H83 WeakPolarHBondContact CD-O 3.4Å; P55-G113 WeakPolarHBondContact O-CA 3.23Å
56	G	92.8	Very high	91.9	Very high	11 Å²	11	32.2 Å²	32.2	11%	0.113	19%	0.189	C	C	.	.			trans	67.2	-155.6	-177.4	0	0	0	0	0	112.4	L54	L54-G56 PolarHBondContact O-N 2.96Å; L54-G56 VanDerWaalsContact O-N 3.16Å
57	D	92	Very high	94.2	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.027	14%	0.144	C	C	.	.	S	Bend	trans	-104.4	174.6	-174.4	-65.1	-63	0	0	0	112.6	V59 G60 S86 K114 H116	D57-V59 PolarHBondContact O-N 3.12Å; D57-G60 PolarHBondContact O-N 3.14Å; D57-G60 VanDerWaalsContact O-N 3.13Å; D57-S86 VanDerWaalsContact CG-OG 3.3Å; D57-S86 WeakPolarHBondContact OD1-CB 3.3Å; D57-S86 PolarHBondContact OD1-OG 3.31Å; D57-S86 PolarHBondContact OD2-OG 3.26Å; D57-K114 WeakPolarHBondContact CB-O 3.43Å; D57-K114 PolarHBondContact N-O 3.25Å; D57-H116 HydrophobicContact CB-CB 3.82Å; D57-H116 PolarHBondContact OD2-N 3.29Å
58	G	92.6	Very high	95.6	Very high	17 Å²	17	23.1 Å²	23.1	18%	0.175	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	-132.6	174.8	0	0	0	0	0	111.7	G60 P61 P310 V315	G58-G60 PolarHBondContact O-N 2.83Å; G58-P61 WeakPolarHBondContact O-CD 3.47Å; G58-P310 CarbonylContact C-O 3.57Å; G58-P310 VanDerWaalsContact CA-O 3.28Å; G58-P310 WeakPolarHBondContact CA-O 3.33Å; G58-V315 VanDerWaalsContact C-CG2 3.42Å; G58-V315 WeakPolarHBondContact O-CG2 3.47Å
59	V	94.3	Very high	96.2	Very high	9 Å²	9	24 Å²	24	6%	0.055	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-5.3	177.7	-61.9	0	0	0	0	113.5	D57 E62 L63 P310 F311 A314 A320	D57-V59 PolarHBondContact O-N 3.12Å; V59-E62 WeakPolarHBondContact O-CB 3.45Å; V59-E62 PolarHBondContact O-N 3.38Å; V59-L63 HydrophobicContact CB-CG 4.47Å; V59-L63 HydrophobicContact CG2-CD1 3.78Å; V59-L63 HydrophobicContact CG2-CG 4.18Å; V59-L63 WeakPolarHBondContact O-CG 3.37Å; V59-L63 PolarHBondContact O-N 3.08Å; V59-P310 PolarHBondContact N-O 3.48Å; V59-F311 HydrophobicContact CG1-CB 4.09Å; V59-F311 HydrophobicContact CG1-CD1 4.19Å; V59-F311 HydrophobicContact CG1-CG 4.36Å; V59-F311 HydrophobicContact CG2-CB 4.05Å; V59-A314 HydrophobicContact CG1-CB 3.63Å; V59-A320 HydrophobicContact CB-CB 3.75Å; V59-A320 HydrophobicContact CG1-CB 3.83Å; V59-A320 HydrophobicContact CG2-CB 4.2Å
60	G	94.9	Very high	96.4	Very high	4 Å²	4	21.7 Å²	21.7	4%	0.041	12%	0.121	C	C	.	.	H	α-helix	trans	-48.8	-49.9	-176.9	0	0	0	0	0	115	P55 D57 G58 E62 L63 M64	P55-G60 CarbonylContact O-C 3.54Å; P55-G60 VanDerWaalsContact O-C 3.29Å; P55-G60 WeakPolarHBondContact O-CA 3.42Å; D57-G60 PolarHBondContact O-N 3.14Å; D57-G60 VanDerWaalsContact O-N 3.13Å; G58-G60 PolarHBondContact O-N 2.83Å; G60-E62 VanDerWaalsContact C-N 3.34Å; G60-E62 PolarHBondContact O-N 3.15Å; G60-L63 PolarHBondContact O-N 2.91Å; G60-M64 WeakPolarHBondContact O-CG 3.13Å; G60-M64 PolarHBondContact O-N 3.41Å
61	P	95.2	Very high	96.5	Very high	67 Å²	67	19.4 Å²	19.4	44%	0.435	11%	0.105	S	C	.	.	H	α-helix	trans	-57.5	-40	175	-27.5	36.2	0	0	0	114.8	P55 G58 M64 H65	P55-P61 HydrophobicContact CB-CB 4.35Å; P55-P61 HydrophobicContact CB-CG 4.06Å; G58-P61 WeakPolarHBondContact O-CD 3.47Å; P61-M64 PolarHBondContact O-N 3.28Å; P61-H65 WeakPolarHBondContact O-CB 3.19Å; P61-H65 PolarHBondContact O-N 3.4Å
62	E	95.4	Very high	96.4	Very high	37 Å²	37	27.2 Å²	27.2	17%	0.173	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-40.3	177	-172.3	-176.5	136.7	0	0	111.2	V59 G60 H65 A66 N318 A320 T369	V59-E62 WeakPolarHBondContact O-CB 3.45Å; V59-E62 PolarHBondContact O-N 3.38Å; G60-E62 VanDerWaalsContact C-N 3.34Å; G60-E62 PolarHBondContact O-N 3.15Å; E62-H65 PolarHBondContact O-N 3.41Å; E62-A66 PolarHBondContact O-N 3.44Å; E62-N318 VanDerWaalsContact OE1-CA 3.31Å; E62-N318 WeakPolarHBondContact OE1-CA 3.09Å; E62-A320 WeakPolarHBondContact OE1-CB 3.26Å; E62-A320 PolarHBondContact OE1-N 2.86Å; E62-T369 HydrophobicContact CG-CG2 4.22Å; E62-T369 WeakPolarHBondContact OE1-CB 3.3Å; E62-T369 WeakPolarHBondContact OE1-CG2 3.28Å; E62-T369 PolarHBondContact OE1-OG1 3.12Å
63	L	97	Very high	96.4	Very high	14 Å²	14	29.3 Å²	29.3	7%	0.073	16%	0.156	C	C	.	.	H	α-helix	trans	-68.8	-40.9	176.9	-60.8	178.7	0	0	0	112.3	V59 G60 H65 A66 V67 A320 N321 P322 M325	V59-L63 HydrophobicContact CB-CG 4.47Å; V59-L63 HydrophobicContact CG2-CD1 3.78Å; V59-L63 HydrophobicContact CG2-CG 4.18Å; V59-L63 WeakPolarHBondContact O-CG 3.37Å; V59-L63 PolarHBondContact O-N 3.08Å; G60-L63 PolarHBondContact O-N 2.91Å; L63-H65 VanDerWaalsContact C-N 3.35Å; L63-A66 VanDerWaalsContact O-CB 3.24Å; L63-A66 WeakPolarHBondContact O-CB 3.36Å; L63-A66 PolarHBondContact O-N 3.1Å; L63-V67 PolarHBondContact O-N 3.04Å; L63-V67 VanDerWaalsContact O-N 3.08Å; L63-A320 HydrophobicContact CD2-CB 3.9Å; L63-N321 WeakPolarHBondContact CD2-O 3.21Å; L63-P322 HydrophobicContact CD2-CB 4.2Å; L63-M325 HydrophobicContact CB-CB 4.2Å; L63-M325 HydrophobicContact CB-CG 4.22Å
64	M	97.6	Very high	96.3	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-68.1	-36.3	176	-70	-47	173.9	0	0	112.1	M53 P55 G60 P61 A66 V67 K68 I111 M325	M53-M64 HydrophobicContact CE-CB 4.25Å; M53-M64 HydrophobicContact CE-CG 4.46Å; M53-M64 HydrophobicContact CE-SD 4.04Å; M53-M64 HydrophobicContact CG-CB 4.48Å; M53-M64 HydrophobicContact CG-CG 4.17Å; M53-M64 HydrophobicContact CG-SD 4.3Å; M53-M64 HydrophobicContact SD-CB 3.83Å; M53-M64 HydrophobicContact SD-CG 4.15Å; M53-M64 HydrophobicContact SD-SD 4.43Å; P55-M64 HydrophobicContact CB-CB 4.47Å; P55-M64 HydrophobicContact CB-CG 4.13Å; P55-M64 HydrophobicContact CG-CG 4.42Å; G60-M64 WeakPolarHBondContact O-CG 3.13Å; G60-M64 PolarHBondContact O-N 3.41Å; P61-M64 PolarHBondContact O-N 3.28Å; M64-A66 VanDerWaalsContact C-N 3.29Å; M64-A66 PolarHBondContact O-N 3.49Å; M64-V67 WeakPolarHBondContact O-CB 3.36Å; M64-V67 PolarHBondContact O-N 3.33Å; M64-K68 WeakPolarHBondContact O-CG 3.31Å; M64-K68 PolarHBondContact O-N 3.04Å; M64-I111 HydrophobicContact CE-CG1 4.03Å; M64-I111 HydrophobicContact SD-CD1 4.31Å; M64-I111 HydrophobicContact SD-CG1 4.24Å; M64-I111 HydrophobicContact SD-CG2 4.31Å; M64-M325 HydrophobicContact CE-CE 3.52Å; M64-M325 HydrophobicContact CE-SD 3.77Å; M64-M325 HydrophobicContact SD-CE 4.35Å; M64-M325 HydrophobicContact SD-CG 4.28Å; M64-M325 HydrophobicContact SD-SD 4.13Å
65	H	97.6	Very high	96.2	Very high	99 Å²	99	33.2 Å²	33.2	46%	0.458	19%	0.189	S	C	.	.	H	α-helix	trans	-59.1	-42.6	169.9	-178.4	-83.9	0	0	0	111.4	P61 E62 L63 V67 K68 E69	P61-H65 WeakPolarHBondContact O-CB 3.19Å; P61-H65 PolarHBondContact O-N 3.4Å; E62-H65 PolarHBondContact O-N 3.41Å; L63-H65 VanDerWaalsContact C-N 3.35Å; H65-V67 VanDerWaalsContact C-N 3.32Å; H65-V67 PolarHBondContact O-N 3.46Å; H65-K68 PolarHBondContact O-N 2.92Å; H65-E69 VanDerWaalsContact CE1-CG 3.46Å; H65-E69 WeakPolarHBondContact CE1-CG 3.48Å; H65-E69 PolarHBondContact O-N 3.42Å
66	A	97.9	Very high	96.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.3	-43.9	174.6	0	0	0	0	0	112.5	E62 L63 M64 V70 P322 I373	E62-A66 PolarHBondContact O-N 3.44Å; L63-A66 VanDerWaalsContact O-CB 3.24Å; L63-A66 WeakPolarHBondContact O-CB 3.36Å; L63-A66 PolarHBondContact O-N 3.1Å; M64-A66 VanDerWaalsContact C-N 3.29Å; M64-A66 PolarHBondContact O-N 3.49Å; A66-V70 WeakPolarHBondContact O-CG2 3.21Å; A66-V70 PolarHBondContact O-N 2.88Å; A66-V70 VanDerWaalsContact O-N 3.13Å; A66-P322 HydrophobicContact CB-CB 3.85Å; A66-I373 HydrophobicContact CB-CD1 3.46Å; A66-I373 VanDerWaalsContact CB-CD1 3.46Å; A66-I373 HydrophobicContact CB-CG1 3.7Å
67	V	98.5	Very high	96.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.3	-49.4	175.6	174.1	0	0	0	0	110.8	M53 L63 M64 H65 E69 V70 F71 F80 I111 M325 L326 A329	M53-V67 HydrophobicContact CE-CG1 4.47Å; L63-V67 PolarHBondContact O-N 3.04Å; L63-V67 VanDerWaalsContact O-N 3.08Å; M64-V67 WeakPolarHBondContact O-CB 3.36Å; M64-V67 PolarHBondContact O-N 3.33Å; H65-V67 VanDerWaalsContact C-N 3.32Å; H65-V67 PolarHBondContact O-N 3.46Å; V67-E69 PolarHBondContact O-N 3.17Å; V67-V70 PolarHBondContact O-N 3.02Å; V67-F71 HydrophobicContact CG1-CD1 3.84Å; V67-F71 HydrophobicContact CG1-CE1 3.79Å; V67-F71 HydrophobicContact CG1-CE2 4.49Å; V67-F71 HydrophobicContact CG1-CG 4.25Å; V67-F71 HydrophobicContact CG1-CZ 4.14Å; V67-F71 WeakPolarHBondContact O-CB 3.21Å; V67-F71 VanDerWaalsContact O-CD1 3.28Å; V67-F71 WeakPolarHBondContact O-CD1 3.41Å; V67-F71 PolarHBondContact O-N 2.56Å; V67-F80 HydrophobicContact CG1-CE2 4.27Å; V67-F80 HydrophobicContact CG1-CZ 3.96Å; V67-I111 HydrophobicContact CG1-CD1 4.49Å; V67-I111 HydrophobicContact CG2-CD1 4.45Å; V67-M325 HydrophobicContact CG2-CB 4.49Å; V67-M325 HydrophobicContact CG2-CG 3.65Å; V67-L326 HydrophobicContact CG2-CD2 4.18Å; V67-A329 HydrophobicContact CG1-CB 3.9Å; V67-A329 HydrophobicContact CG2-CB 4.16Å
68	K	98.4	Very high	96.7	Very high	58 Å²	58	35.9 Å²	35.9	25%	0.252	20%	0.204	S	C	.	.	H	α-helix	trans	-59	-44.4	-179.4	-69.9	-173.4	-60.7	-169.3	0	112.3	M53 M64 H65 F71 K72 F80 E82	M53-K68 HydrophobicContact CE-CD 4.46Å; M53-K68 HydrophobicContact CE-CG 4.03Å; M53-K68 HydrophobicContact SD-CD 4.02Å; M53-K68 HydrophobicContact SD-CG 4.22Å; M64-K68 WeakPolarHBondContact O-CG 3.31Å; M64-K68 PolarHBondContact O-N 3.04Å; H65-K68 PolarHBondContact O-N 2.92Å; K68-F71 PolarHBondContact O-N 3.46Å; K68-K72 VanDerWaalsContact O-CB 3.3Å; K68-K72 WeakPolarHBondContact O-CB 3.42Å; K68-K72 PolarHBondContact O-N 3.46Å; K68-F80 HydrophobicContact CD-CD2 4.46Å; K68-F80 HydrophobicContact CG-CD2 3.89Å; K68-F80 HydrophobicContact CG-CE2 4.15Å; K68-E82 WeakPolarHBondContact CD-OE1 3.43Å; K68-E82 IonicContact NZ-OE1 3.4Å; K68-E82 PolarHBondContact NZ-OE1 3.41Å; K68-E82 IonicContact NZ-OE2 3.32Å; K68-E82 PolarHBondContact NZ-OE2 3Å
69	E	98.3	Very high	96.9	Very high	74 Å²	74	40.7 Å²	40.7	35%	0.346	22%	0.222	S	C	.	.	H	α-helix	trans	-64.4	-44	178.8	-74.6	-64.9	103.9	0	0	112.4	H65 V67 A73 I373	H65-E69 VanDerWaalsContact CE1-CG 3.46Å; H65-E69 WeakPolarHBondContact CE1-CG 3.48Å; H65-E69 PolarHBondContact O-N 3.42Å; V67-E69 PolarHBondContact O-N 3.17Å; E69-A73 WeakPolarHBondContact O-CB 3.44Å; E69-A73 PolarHBondContact O-N 3.45Å; E69-I373 HydrophobicContact CB-CG2 4.14Å
70	V	98.3	Very high	97.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-40.9	176.8	174.3	0	0	0	0	111	A66 V67 A73 A74 L326 I345 I373 V376 I377	A66-V70 WeakPolarHBondContact O-CG2 3.21Å; A66-V70 PolarHBondContact O-N 2.88Å; A66-V70 VanDerWaalsContact O-N 3.13Å; V67-V70 PolarHBondContact O-N 3.02Å; V70-A73 PolarHBondContact O-N 3.28Å; V70-A74 VanDerWaalsContact O-CB 3.3Å; V70-A74 WeakPolarHBondContact O-CB 3.41Å; V70-A74 PolarHBondContact O-N 2.77Å; V70-L326 HydrophobicContact CB-CD2 3.99Å; V70-L326 HydrophobicContact CG1-CD2 4.28Å; V70-L326 HydrophobicContact CG2-CD1 4.49Å; V70-L326 HydrophobicContact CG2-CD2 3.85Å; V70-I345 HydrophobicContact CG1-CD1 4.14Å; V70-I345 HydrophobicContact CG1-CG1 4.05Å; V70-I345 HydrophobicContact CG1-CG2 3.97Å; V70-I373 HydrophobicContact CG2-CG2 4.18Å; V70-V376 HydrophobicContact CG1-CG1 4.18Å; V70-V376 HydrophobicContact CG2-CG1 4.14Å; V70-I377 HydrophobicContact CG2-CG1 4.24Å
71	F	97.8	Very high	97.2	Very high	7 Å²	7	44.7 Å²	44.7	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-41.9	178.8	-87.5	39.2	0	0	0	111.9	V67 K68 A74 A75 V76 V78 F80 A329 M332 L333 I345	V67-F71 HydrophobicContact CG1-CD1 3.84Å; V67-F71 HydrophobicContact CG1-CE1 3.79Å; V67-F71 HydrophobicContact CG1-CE2 4.49Å; V67-F71 HydrophobicContact CG1-CG 4.25Å; V67-F71 HydrophobicContact CG1-CZ 4.14Å; V67-F71 WeakPolarHBondContact O-CB 3.21Å; V67-F71 VanDerWaalsContact O-CD1 3.28Å; V67-F71 WeakPolarHBondContact O-CD1 3.41Å; V67-F71 PolarHBondContact O-N 2.56Å; K68-F71 PolarHBondContact O-N 3.46Å; F71-A74 CarbonylContact O-C 3.47Å; F71-A74 PolarHBondContact O-N 2.7Å; F71-A75 PolarHBondContact O-N 3.46Å; F71-A75 VanDerWaalsContact O-N 3.1Å; F71-V76 HydrophobicContact CB-CB 4.09Å; F71-V76 HydrophobicContact CB-CG2 4.03Å; F71-V76 HydrophobicContact CD1-CG2 4.22Å; F71-V76 HydrophobicContact CD2-CB 3.84Å; F71-V76 HydrophobicContact CD2-CG1 3.64Å; F71-V76 HydrophobicContact CD2-CG2 4.06Å; F71-V76 HydrophobicContact CE2-CB 4.47Å; F71-V76 HydrophobicContact CE2-CG1 3.84Å; F71-V76 HydrophobicContact CG-CB 4.04Å; F71-V76 HydrophobicContact CG-CG1 4.29Å; F71-V76 HydrophobicContact CG-CG2 3.85Å; F71-V76 PolarHBondContact O-N 2.79Å; F71-V78 HydrophobicContact CD2-CB 4.21Å; F71-V78 HydrophobicContact CD2-CG1 4.44Å; F71-V78 HydrophobicContact CE2-CB 4.28Å; F71-V78 HydrophobicContact CE2-CG1 4.35Å; F71-V78 HydrophobicContact CE2-CG2 4.37Å; F71-F80 AromaticContact CD2-CE2 3.7Å; F71-F80 HydrophobicContact CD2-CE2 3.7Å; F71-F80 AromaticContact CD2-CZ 3.62Å; F71-F80 HydrophobicContact CD2-CZ 3.62Å; F71-F80 HydrophobicContact CE2-CE2 4.2Å; F71-F80 AromaticContact CE2-CZ 3.62Å; F71-F80 HydrophobicContact CE2-CZ 3.62Å; F71-F80 HydrophobicContact CG-CE2 4.3Å; F71-F80 HydrophobicContact CG-CZ 4.45Å; F71-F80 HydrophobicContact CZ-CZ 4.46Å; F71-A329 HydrophobicContact CE1-CB 3.78Å; F71-A329 HydrophobicContact CZ-CB 3.78Å; F71-M332 HydrophobicContact CE2-CE 3.77Å; F71-M332 HydrophobicContact CZ-CE 3.95Å; F71-L333 HydrophobicContact CE1-CD1 4.07Å; F71-L333 HydrophobicContact CE2-CD1 4.25Å; F71-L333 HydrophobicContact CE2-CD2 3.84Å; F71-L333 HydrophobicContact CE2-CG 4.21Å; F71-L333 HydrophobicContact CZ-CD1 3.66Å; F71-L333 HydrophobicContact CZ-CD2 3.96Å; F71-L333 HydrophobicContact CZ-CG 3.8Å; F71-I345 HydrophobicContact CD1-CD1 3.75Å; F71-I345 HydrophobicContact CE1-CD1 3.65Å
72	K	97.2	Very high	97.3	Very high	165 Å²	165	45.5 Å²	45.5	72%	0.717	24%	0.236	S	C	*	.	H	α-helix	trans	-61.1	-47	174.2	-177.5	179.5	178.3	-177.6	0	111.3	K68 A74 A75	K68-K72 VanDerWaalsContact O-CB 3.3Å; K68-K72 WeakPolarHBondContact O-CB 3.42Å; K68-K72 PolarHBondContact O-N 3.46Å; K72-A74 VanDerWaalsContact C-N 3.32Å; K72-A74 PolarHBondContact O-N 3.02Å; K72-A75 PolarHBondContact O-N 3.16Å
73	A	97.4	Very high	97.3	Very high	43 Å²	43	46 Å²	46	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-65.8	-33.4	178.4	0	0	0	0	0	113.1	E69 V70 A75 I377 L380	E69-A73 WeakPolarHBondContact O-CB 3.44Å; E69-A73 PolarHBondContact O-N 3.45Å; V70-A73 PolarHBondContact O-N 3.28Å; A73-A75 VanDerWaalsContact C-N 3.3Å; A73-I377 HydrophobicContact CB-CB 4.45Å; A73-I377 HydrophobicContact CB-CD1 4.05Å; A73-I377 HydrophobicContact CB-CG1 3.89Å; A73-I377 HydrophobicContact CB-CG2 3.83Å; A73-L380 HydrophobicContact CB-CD1 3.83Å
74	A	96.4	Very high	97	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.033	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	2.1	177.3	0	0	0	0	0	113.9	V70 F71 K72 V76 M344 I345 L380	V70-A74 VanDerWaalsContact O-CB 3.3Å; V70-A74 WeakPolarHBondContact O-CB 3.41Å; V70-A74 PolarHBondContact O-N 2.77Å; F71-A74 CarbonylContact O-C 3.47Å; F71-A74 PolarHBondContact O-N 2.7Å; K72-A74 VanDerWaalsContact C-N 3.32Å; K72-A74 PolarHBondContact O-N 3.02Å; A74-V76 VanDerWaalsContact C-N 3.27Å; A74-V76 HydrophobicContact CB-CG2 3.91Å; A74-V76 PolarHBondContact O-N 3.25Å; A74-M344 HydrophobicContact CB-SD 4.18Å; A74-I345 HydrophobicContact CB-CD1 4.25Å; A74-I345 HydrophobicContact CB-CG1 4.25Å; A74-L380 HydrophobicContact CB-CD1 3.96Å; A74-L380 HydrophobicContact CB-CD2 4.32Å
75	A	95.8	Very high	96.6	Very high	79 Å²	79	50.7 Å²	50.7	65%	0.653	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	48.2	-175.6	0	0	0	0	0	112.5	F71 K72 A73 H341	F71-A75 PolarHBondContact O-N 3.46Å; F71-A75 VanDerWaalsContact O-N 3.1Å; K72-A75 PolarHBondContact O-N 3.16Å; A73-A75 VanDerWaalsContact C-N 3.3Å; A75-H341 PolarHBondContact O-NE2 2.92Å; A75-H341 VanDerWaalsContact O-NE2 3.08Å
76	V	96.6	Very high	96	Very high	17 Å²	17	46 Å²	46	10%	0.103	24%	0.239	C	C	.	.			trans	-72.7	129.8	177.7	-178.5	0	0	0	0	109.4	F71 A74 V78 L333 H341 I345	F71-V76 HydrophobicContact CB-CB 4.09Å; F71-V76 HydrophobicContact CB-CG2 4.03Å; F71-V76 HydrophobicContact CD1-CG2 4.22Å; F71-V76 HydrophobicContact CD2-CB 3.84Å; F71-V76 HydrophobicContact CD2-CG1 3.64Å; F71-V76 HydrophobicContact CD2-CG2 4.06Å; F71-V76 HydrophobicContact CE2-CB 4.47Å; F71-V76 HydrophobicContact CE2-CG1 3.84Å; F71-V76 HydrophobicContact CG-CB 4.04Å; F71-V76 HydrophobicContact CG-CG1 4.29Å; F71-V76 HydrophobicContact CG-CG2 3.85Å; F71-V76 PolarHBondContact O-N 2.79Å; A74-V76 VanDerWaalsContact C-N 3.27Å; A74-V76 HydrophobicContact CB-CG2 3.91Å; A74-V76 PolarHBondContact O-N 3.25Å; V76-V78 HydrophobicContact CG1-CB 3.91Å; V76-V78 HydrophobicContact CG1-CG2 3.67Å; V76-V78 PolarHBondContact O-N 3.36Å; V76-L333 HydrophobicContact CG1-CD1 4.25Å; V76-L333 HydrophobicContact CG1-CD2 3.49Å; V76-L333 VanDerWaalsContact CG1-CD2 3.49Å; V76-L333 HydrophobicContact CG2-CD1 4.37Å; V76-H341 HydrophobicContact CG2-CB 4.26Å; V76-I345 HydrophobicContact CG2-CD1 3.98Å
77	P	96.4	Very high	95.3	Very high	39 Å²	39	47.5 Å²	47.5	25%	0.253	25%	0.245	S	C	.	.			trans	-79.1	55.6	178.2	34.8	-37.2	0	0	0	111.2	F49 L338	F49-P77 HydrophobicContact CD2-CG 4.4Å; F49-P77 WeakPolarHBondContact CD2-O 3.22Å; F49-P77 PolarHBondContact N-O 2.96Å; P77-L338 HydrophobicContact CG-CD1 3.97Å; P77-L338 HydrophobicContact CG-CD2 3.94Å
78	V	97.3	Very high	94.3	Very high	20 Å²	20	50.7 Å²	50.7	12%	0.121	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.7	178.4	166.9	0	0	0	0	109.2	S48 F49 V51 F71 V76 F80 L333 L336 L338	S48-V78 VanDerWaalsContact OG-C 3.3Å; F49-V78 HydrophobicContact CB-CG2 4.2Å; F49-V78 WeakPolarHBondContact O-CA 3.39Å; V51-V78 HydrophobicContact CB-CG1 4.02Å; V51-V78 HydrophobicContact CG2-CG1 3.76Å; F71-V78 HydrophobicContact CD2-CB 4.21Å; F71-V78 HydrophobicContact CD2-CG1 4.44Å; F71-V78 HydrophobicContact CE2-CB 4.28Å; F71-V78 HydrophobicContact CE2-CG1 4.35Å; F71-V78 HydrophobicContact CE2-CG2 4.37Å; V76-V78 HydrophobicContact CG1-CB 3.91Å; V76-V78 HydrophobicContact CG1-CG2 3.67Å; V76-V78 PolarHBondContact O-N 3.36Å; V78-F80 HydrophobicContact CG1-CD1 4.02Å; V78-F80 HydrophobicContact CG1-CD2 4.46Å; V78-F80 HydrophobicContact CG1-CE1 3.68Å; V78-F80 HydrophobicContact CG1-CE2 4.16Å; V78-F80 HydrophobicContact CG1-CG 4.41Å; V78-F80 HydrophobicContact CG1-CZ 3.78Å; V78-L333 HydrophobicContact CG2-CD2 3.86Å; V78-L336 HydrophobicContact CG2-CD1 4.12Å; V78-L338 HydrophobicContact CG2-CD1 4.2Å
79	E	97	Very high	93	Very high	117 Å²	117	53.7 Å²	53.7	55%	0.547	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.7	173.6	-178.6	174.9	179	0	0	109.2	S48 F49 P50 V51	S48-E79 VanDerWaalsContact OG-CB 3.26Å; S48-E79 WeakPolarHBondContact OG-CB 3.28Å; S48-E79 PolarHBondContact OG-N 3.13Å; F49-E79 PolarHBondContact O-N 3.34Å; P50-E79 WeakPolarHBondContact CA-O 3.29Å; V51-E79 PolarHBondContact N-O 3.46Å
80	F	98.1	Very high	91.4	Very high	34 Å²	34	57.5 Å²	57.5	15%	0.149	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	119.6	-179.7	-68.2	-62.4	0	0	0	111.1	V51 M53 V67 K68 F71 V78 E82 I111 M332	V51-F80 HydrophobicContact CB-CD1 3.97Å; V51-F80 HydrophobicContact CB-CE1 4.12Å; V51-F80 HydrophobicContact CG1-CD1 3.98Å; V51-F80 HydrophobicContact CG1-CE1 3.91Å; V51-F80 WeakPolarHBondContact O-CA 3.25Å; M53-F80 HydrophobicContact CB-CB 4.02Å; M53-F80 HydrophobicContact CB-CD1 3.94Å; M53-F80 HydrophobicContact CB-CG 4.24Å; M53-F80 HydrophobicContact CE-CB 4.27Å; M53-F80 HydrophobicContact CE-CD1 3.53Å; M53-F80 HydrophobicContact CE-CD2 3.65Å; M53-F80 HydrophobicContact CE-CE1 3.6Å; M53-F80 HydrophobicContact CE-CE2 3.72Å; M53-F80 HydrophobicContact CE-CG 3.54Å; M53-F80 HydrophobicContact CE-CZ 3.68Å; M53-F80 HydrophobicContact SD-CB 4.25Å; M53-F80 HydrophobicContact SD-CD1 4.44Å; M53-F80 HydrophobicContact SD-CG 4.17Å; V67-F80 HydrophobicContact CG1-CE2 4.27Å; V67-F80 HydrophobicContact CG1-CZ 3.96Å; K68-F80 HydrophobicContact CD-CD2 4.46Å; K68-F80 HydrophobicContact CG-CD2 3.89Å; K68-F80 HydrophobicContact CG-CE2 4.15Å; F71-F80 AromaticContact CD2-CE2 3.7Å; F71-F80 HydrophobicContact CD2-CE2 3.7Å; F71-F80 AromaticContact CD2-CZ 3.62Å; F71-F80 HydrophobicContact CD2-CZ 3.62Å; F71-F80 HydrophobicContact CE2-CE2 4.2Å; F71-F80 AromaticContact CE2-CZ 3.62Å; F71-F80 HydrophobicContact CE2-CZ 3.62Å; F71-F80 HydrophobicContact CG-CE2 4.3Å; F71-F80 HydrophobicContact CG-CZ 4.45Å; F71-F80 HydrophobicContact CZ-CZ 4.46Å; V78-F80 HydrophobicContact CG1-CD1 4.02Å; V78-F80 HydrophobicContact CG1-CD2 4.46Å; V78-F80 HydrophobicContact CG1-CE1 3.68Å; V78-F80 HydrophobicContact CG1-CE2 4.16Å; V78-F80 HydrophobicContact CG1-CG 4.41Å; V78-F80 HydrophobicContact CG1-CZ 3.78Å; F80-E82 HydrophobicContact CB-CG 4.42Å; F80-E82 PolarHBondContact O-N 3.1Å; F80-I111 HydrophobicContact CD1-CG2 4.34Å; F80-I111 HydrophobicContact CE1-CG2 3.89Å; F80-M332 HydrophobicContact CE1-CE 4.06Å; F80-M332 HydrophobicContact CZ-CE 4.26Å
81	Q	97.5	Very high	89.7	Confident	63 Å²	63	60.6 Å²	60.6	29%	0.294	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	99.1	166.2	-67.2	-179.8	2.5	0	0	108.3	V51 M53 H83 S103 N107	V51-Q81 PolarHBondContact O-N 3.45Å; M53-Q81 PolarHBondContact N-O 3.12Å; Q81-H83 PolarHBondContact O-CD2 2.96Å; Q81-H83 VanDerWaalsContact O-CD2 3.31Å; Q81-S103 PolarHBondContact OE1-OG 3.22Å; Q81-N107 PolarHBondContact OE1-ND2 3.4Å
82	E	97.1	Very high	88.1	Confident	85 Å²	85	62.1 Å²	62.1	40%	0.397	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	122.7	-175.2	-69	-176.4	-121.6	0	0	111.8	M53 K68 F80	M53-E82 HydrophobicContact CB-CG 4.07Å; M53-E82 HydrophobicContact CG-CG 4.18Å; M53-E82 WeakPolarHBondContact O-CA 3.24Å; M53-E82 HydrophobicContact SD-CG 3.92Å; K68-E82 WeakPolarHBondContact CD-OE1 3.43Å; K68-E82 IonicContact NZ-OE1 3.4Å; K68-E82 PolarHBondContact NZ-OE1 3.41Å; K68-E82 IonicContact NZ-OE2 3.32Å; K68-E82 PolarHBondContact NZ-OE2 3Å; F80-E82 HydrophobicContact CB-CG 4.42Å; F80-E82 PolarHBondContact O-N 3.1Å
83	H	94.8	Very high	87.3	Confident	46 Å²	46	56.2 Å²	56.2	21%	0.213	31%	0.311	C	S	.	.			trans	-119.5	155.6	172	-62.7	-94	0	0	0	110.4	M53 L54 P55 Q81 V100 S103	M53-H83 PolarHBondContact O-N 2.84Å; L54-H83 HydrophobicContact CD1-CB 4.46Å; L54-H83 WeakPolarHBondContact CD1-O 3.44Å; P55-H83 WeakPolarHBondContact CD-O 3.4Å; Q81-H83 PolarHBondContact O-CD2 2.96Å; Q81-H83 VanDerWaalsContact O-CD2 3.31Å; H83-V100 HydrophobicContact CB-CG2 3.75Å; H83-S103 VanDerWaalsContact NE2-CB 3.3Å; H83-S103 WeakPolarHBondContact NE2-CB 3.48Å; H83-S103 PolarHBondContact NE2-OG 2.86Å; H83-S103 VanDerWaalsContact NE2-OG 3.15Å
84	H	90.7	Very high	86.7	Confident	110 Å²	110	57.8 Å²	57.8	51%	0.509	31%	0.311	S	S	.	.			trans	-121.8	125.2	-179.8	-66.3	80.9	0	0	0	110.5	M91	H84-M91 HydrophobicContact CB-CE 4.2Å
85	L	89.1	Confident	86.3	Confident	4 Å²	4	64 Å²	64	2%	0.021	34%	0.339	C	S	.	.			trans	-142.6	127.4	177	-171.2	64.6	0	0	0	108.7	L54 K96 L97 V100 I115 Y128	L54-L85 HydrophobicContact CD1-CB 3.79Å; L54-L85 HydrophobicContact CD2-CB 4.31Å; L85-K96 HydrophobicContact CD1-CB 4.24Å; L85-L97 HydrophobicContact CD2-CD1 4.09Å; L85-V100 HydrophobicContact CB-CG2 4.43Å; L85-I115 HydrophobicContact CD2-CD1 4.03Å; L85-Y128 HydrophobicContact CD1-CD1 3.94Å; L85-Y128 HydrophobicContact CD1-CE1 4.17Å; L85-Y128 HydrophobicContact CD2-CD1 4.04Å; L85-Y128 HydrophobicContact CG-CD1 4.28Å
86	S	85.7	Confident	86	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.014	32%	0.321	C	S	.	.			trans	-150.6	134.1	-179.6	175.1	0	0	0	0	109.6	D57 V88 Q89 A92	D57-S86 VanDerWaalsContact CG-OG 3.3Å; D57-S86 WeakPolarHBondContact OD1-CB 3.3Å; D57-S86 PolarHBondContact OD1-OG 3.31Å; D57-S86 PolarHBondContact OD2-OG 3.26Å; S86-V88 PolarHBondContact OG-N 3.36Å; S86-Q89 WeakPolarHBondContact OG-CB 3.19Å; S86-Q89 WeakPolarHBondContact OG-CG 3.41Å; S86-Q89 PolarHBondContact OG-N 3.28Å; S86-Q89 VanDerWaalsContact OG-N 3.08Å; S86-A92 WeakPolarHBondContact O-CB 3.43Å; S86-A92 PolarHBondContact O-N 3.02Å; S86-A92 VanDerWaalsContact O-N 3.11Å
87	E	82.1	Confident	85.7	Confident	31 Å²	31	62.5 Å²	62.5	15%	0.145	32%	0.316	C	S	.	.	S	Bend	trans	-83.7	-18.5	174	-66.8	-178.9	-141.8	0	0	113.1	I115 H116 P118 S127 Y128	E87-I115 HydrophobicContact CG-CG2 4.28Å; E87-H116 WeakPolarHBondContact CB-O 3.29Å; E87-P118 HydrophobicContact CB-CG 4.21Å; E87-P118 WeakPolarHBondContact OE2-CD 3.41Å; E87-S127 WeakPolarHBondContact OE1-CA 3.33Å; E87-S127 WeakPolarHBondContact OE1-CB 3.29Å; E87-Y128 HydrophobicContact CG-CD2 3.31Å; E87-Y128 HydrophobicContact CG-CE2 4Å; E87-Y128 HydrophobicContact CG-CG 3.99Å; E87-Y128 WeakPolarHBondContact OE1-CB 3.5Å; E87-Y128 PolarHBondContact OE1-N 2.49Å
88	V	78.5	Confident	85.6	Confident	66 Å²	66	64 Å²	64	40%	0.4	32%	0.32	S	S	.	.	S	Bend	trans	-106.4	-19.1	-172.7	-69.3	0	0	0	0	114	S86 N90 H116 P118	S86-V88 PolarHBondContact OG-N 3.36Å; V88-N90 VanDerWaalsContact C-N 3.29Å; V88-N90 PolarHBondContact O-N 3.46Å; V88-H116 VanDerWaalsContact CG1-CD2 3.47Å; V88-H116 WeakPolarHBondContact CG1-CD2 3.41Å; V88-H116 HydrophobicContact CG2-CB 4.09Å; V88-P118 HydrophobicContact CG1-CG 3.99Å
89	Q	71	Confident	85.4	Confident	121 Å²	121	67.7 Å²	67.7	57%	0.565	34%	0.336	S	S	*	.	S	Bend	trans	-90.6	16.6	178.3	-63.1	-178.9	-17.4	0	0	113.3	S86 M91	S86-Q89 WeakPolarHBondContact OG-CB 3.19Å; S86-Q89 WeakPolarHBondContact OG-CG 3.41Å; S86-Q89 PolarHBondContact OG-N 3.28Å; S86-Q89 VanDerWaalsContact OG-N 3.08Å; Q89-M91 HydrophobicContact CB-CG 4.07Å; Q89-M91 HydrophobicContact CB-SD 4.36Å; Q89-M91 WeakPolarHBondContact O-CG 3.48Å; Q89-M91 PolarHBondContact O-N 2.93Å
90	N	63.9	Low	85.4	Confident	154 Å²	154	62.2 Å²	62.2	82%	0.824	31%	0.31	S	S	*	.	S	Bend	trans	51.5	23.9	-172.4	-70.4	-15.1	0	0	0	113.8	V88	V88-N90 VanDerWaalsContact C-N 3.29Å; V88-N90 PolarHBondContact O-N 3.46Å
91	M	63.1	Low	85.3	Confident	66 Å²	66	60.6 Å²	60.6	33%	0.325	30%	0.303	S	S	.	.			trans	-92	-6.9	176.6	-65.5	-173.1	77	0	0	111.9	H84 Q89 S93 K96	H84-M91 HydrophobicContact CB-CE 4.2Å; Q89-M91 HydrophobicContact CB-CG 4.07Å; Q89-M91 HydrophobicContact CB-SD 4.36Å; Q89-M91 WeakPolarHBondContact O-CG 3.48Å; Q89-M91 PolarHBondContact O-N 2.93Å; M91-S93 PolarHBondContact O-N 3.27Å; M91-K96 WeakPolarHBondContact O-CD 3.28Å; M91-K96 PolarHBondContact O-NZ 2.89Å
92	A	64.7	Low	85.2	Confident	38 Å²	38	60.7 Å²	60.7	31%	0.314	31%	0.311	S	S	.	.			trans	-68.9	123.2	-179.2	0	0	0	0	0	111.8	S86 Y128	S86-A92 WeakPolarHBondContact O-CB 3.43Å; S86-A92 PolarHBondContact O-N 3.02Å; S86-A92 VanDerWaalsContact O-N 3.11Å; A92-Y128 HydrophobicContact CB-CE1 4.48Å; A92-Y128 HydrophobicContact CB-CE2 3.85Å
93	S	80.6	Confident	85.3	Confident	41 Å²	41	57 Å²	57	29%	0.287	29%	0.294	S	S	.	.			trans	-144	156.4	164.5	71.3	0	0	0	0	108.8	M91 E95 K96 L97	M91-S93 PolarHBondContact O-N 3.27Å; S93-E95 PolarHBondContact O-N 3.2Å; S93-K96 PolarHBondContact O-N 2.91Å; S93-K96 PolarHBondContact OG-N 3.16Å; S93-L97 PolarHBondContact O-N 3.27Å
94	E	85	Confident	85.4	Confident	76 Å²	76	54.9 Å²	54.9	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-62	-37.5	175.4	-165.4	60.7	-166	0	0	111.6	K96 L97 E98 R131 K135	E94-K96 VanDerWaalsContact C-N 3.34Å; E94-K96 PolarHBondContact O-N 3.15Å; E94-L97 PolarHBondContact O-N 3.17Å; E94-E98 PolarHBondContact O-N 3.43Å; E94-R131 IonicContact OE1-CZ 2.57Å; E94-R131 IonicContact OE1-NH2 3.78Å; E94-R131 PolarHBondContact OE1-NH2 3Å; E94-R131 IonicContact OE2-CZ 3.64Å; E94-R131 IonicContact OE2-NH1 3.35Å; E94-R131 PolarHBondContact OE2-NH1 3.23Å; E94-R131 IonicContact OE2-NH2 2.73Å; E94-R131 PolarHBondContact OE2-NH2 2.97Å; E94-K135 IonicContact OE1-NZ 2.61Å; E94-K135 PolarHBondContact OE1-NZ 2.69Å
95	E	87.9	Confident	85.7	Confident	135 Å²	135	53.9 Å²	53.9	63%	0.631	28%	0.279	S	S	*	.	H	α-helix	trans	-57.5	-45.4	177.4	-171.5	-173.1	171	0	0	112	S93 E98 Q99	S93-E95 PolarHBondContact O-N 3.2Å; E95-E98 PolarHBondContact O-N 3.46Å; E95-Q99 WeakPolarHBondContact O-CG 3.43Å; E95-Q99 PolarHBondContact O-N 3.29Å
96	K	89.1	Confident	86.1	Confident	64 Å²	64	60.7 Å²	60.7	28%	0.278	31%	0.311	S	S	.	.	H	α-helix	trans	-67.9	-36.9	178	-76.8	172.6	179.1	179.7	0	112.5	L85 M91 S93 E94 E98 Q99 V100	L85-K96 HydrophobicContact CD1-CB 4.24Å; M91-K96 WeakPolarHBondContact O-CD 3.28Å; M91-K96 PolarHBondContact O-NZ 2.89Å; S93-K96 PolarHBondContact O-N 2.91Å; S93-K96 PolarHBondContact OG-N 3.16Å; E94-K96 VanDerWaalsContact C-N 3.34Å; E94-K96 PolarHBondContact O-N 3.15Å; K96-E98 VanDerWaalsContact C-N 3.32Å; K96-Q99 PolarHBondContact O-N 3.21Å; K96-V100 VanDerWaalsContact O-CG2 3.3Å; K96-V100 WeakPolarHBondContact O-CG2 3.49Å; K96-V100 PolarHBondContact O-N 2.84Å
97	L	91	Very high	86.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.3	-44.2	173.2	174.6	60.4	0	0	0	110.7	L85 S93 E94 V100 L101 Y128 R131 L132	L85-L97 HydrophobicContact CD2-CD1 4.09Å; S93-L97 PolarHBondContact O-N 3.27Å; E94-L97 PolarHBondContact O-N 3.17Å; L97-V100 PolarHBondContact O-N 3.06Å; L97-L101 HydrophobicContact CD1-CD1 3.97Å; L97-L101 HydrophobicContact CD1-CG 4.15Å; L97-L101 HydrophobicContact CG-CD1 3.84Å; L97-L101 HydrophobicContact CG-CG 4.47Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 WeakPolarHBondContact O-CD1 3.26Å; L97-L101 WeakPolarHBondContact O-CG 3.28Å; L97-L101 PolarHBondContact O-N 3.3Å; L97-Y128 HydrophobicContact CB-CD1 3.92Å; L97-Y128 HydrophobicContact CB-CE1 3.81Å; L97-Y128 HydrophobicContact CD1-CD1 4.11Å; L97-Y128 HydrophobicContact CD2-CD1 3.82Å; L97-Y128 HydrophobicContact CD2-CE1 3.99Å; L97-Y128 HydrophobicContact CG-CD1 4.15Å; L97-Y128 HydrophobicContact CG-CE1 4.4Å; L97-R131 HydrophobicContact CD2-CB 4.29Å; L97-L132 HydrophobicContact CD1-CD1 4.12Å
98	E	93.4	Very high	87.4	Confident	72 Å²	72	65.7 Å²	65.7	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-65.2	-37.1	176.1	-70.8	-56.4	145.7	0	0	113	E94 E95 K96 L101 S102 K135	E94-E98 PolarHBondContact O-N 3.43Å; E95-E98 PolarHBondContact O-N 3.46Å; K96-E98 VanDerWaalsContact C-N 3.32Å; E98-L101 PolarHBondContact O-N 3.38Å; E98-S102 WeakPolarHBondContact O-CB 3.37Å; E98-S102 PolarHBondContact O-N 3.41Å; E98-S102 PolarHBondContact O-OG 2.82Å; E98-K135 IonicContact OE1-NZ 3.47Å; E98-K135 PolarHBondContact OE1-NZ 3.14Å
99	Q	94.3	Very high	88.3	Confident	96 Å²	96	63 Å²	63	45%	0.449	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-47.4	173	-72.9	171.7	3.1	0	0	111.6	E95 K96 S102 S103	E95-Q99 WeakPolarHBondContact O-CG 3.43Å; E95-Q99 PolarHBondContact O-N 3.29Å; K96-Q99 PolarHBondContact O-N 3.21Å; Q99-S102 PolarHBondContact O-N 2.8Å; Q99-S103 PolarHBondContact O-N 3.23Å
100	V	95.3	Very high	89.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-46.1	176.9	172.9	0	0	0	0	110.7	L54 H83 L85 K96 L97 S102 S103 M104 L132	L54-V100 HydrophobicContact CD2-CG1 4.26Å; H83-V100 HydrophobicContact CB-CG2 3.75Å; L85-V100 HydrophobicContact CB-CG2 4.43Å; K96-V100 VanDerWaalsContact O-CG2 3.3Å; K96-V100 WeakPolarHBondContact O-CG2 3.49Å; K96-V100 PolarHBondContact O-N 2.84Å; L97-V100 PolarHBondContact O-N 3.06Å; V100-S102 VanDerWaalsContact C-N 3.31Å; V100-S102 PolarHBondContact O-N 3.26Å; V100-S103 PolarHBondContact O-N 3.02Å; V100-M104 HydrophobicContact CG1-CE 3.72Å; V100-M104 HydrophobicContact CG1-CG 4.45Å; V100-M104 HydrophobicContact CG1-SD 4.22Å; V100-M104 WeakPolarHBondContact O-CG 3.49Å; V100-M104 PolarHBondContact O-N 3.04Å; V100-L132 HydrophobicContact CG1-CD1 3.84Å
101	L	96.1	Very high	91.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.6	-39.3	177.8	-74.4	165.1	0	0	0	112.3	L97 E98 M104 K105 L132 K135 L136	L97-L101 HydrophobicContact CD1-CD1 3.97Å; L97-L101 HydrophobicContact CD1-CG 4.15Å; L97-L101 HydrophobicContact CG-CD1 3.84Å; L97-L101 HydrophobicContact CG-CG 4.47Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 WeakPolarHBondContact O-CD1 3.26Å; L97-L101 WeakPolarHBondContact O-CG 3.28Å; L97-L101 PolarHBondContact O-N 3.3Å; E98-L101 PolarHBondContact O-N 3.38Å; L101-M104 PolarHBondContact O-N 3.28Å; L101-K105 WeakPolarHBondContact O-CB 3.19Å; L101-K105 VanDerWaalsContact O-CG 3.23Å; L101-K105 WeakPolarHBondContact O-CG 3.27Å; L101-K105 PolarHBondContact O-N 3.45Å; L101-L132 HydrophobicContact CD2-CD1 3.88Å; L101-L132 HydrophobicContact CD2-CG 4.24Å; L101-L132 HydrophobicContact CG-CD1 4.26Å; L101-K135 HydrophobicContact CD1-CB 4.18Å; L101-K135 HydrophobicContact CD1-CD 3.35Å; L101-K135 HydrophobicContact CD1-CG 4.4Å; L101-K135 HydrophobicContact CD2-CB 3.94Å; L101-L136 HydrophobicContact CD2-CD1 4.17Å; L101-L136 HydrophobicContact CD2-CD2 3.99Å; L101-L136 HydrophobicContact CD2-CG 3.74Å
102	S	96.9	Very high	92.9	Very high	66 Å²	66	46.8 Å²	46.8	46%	0.462	24%	0.235	S	C	.	.	H	α-helix	trans	-63.2	-47.4	177.5	-60.1	0	0	0	0	110.7	E98 Q99 V100 M104 K105 E106	E98-S102 WeakPolarHBondContact O-CB 3.37Å; E98-S102 PolarHBondContact O-N 3.41Å; E98-S102 PolarHBondContact O-OG 2.82Å; Q99-S102 PolarHBondContact O-N 2.8Å; V100-S102 VanDerWaalsContact C-N 3.31Å; V100-S102 PolarHBondContact O-N 3.26Å; S102-M104 PolarHBondContact O-N 3.15Å; S102-K105 PolarHBondContact O-N 3.4Å; S102-E106 WeakPolarHBondContact O-CB 3.45Å; S102-E106 PolarHBondContact O-N 3.38Å
103	S	97.4	Very high	94.4	Very high	6 Å²	6	45.1 Å²	45.1	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-44.6	174.9	178.3	0	0	0	0	112.1	T52 Q81 H83 Q99 V100 K105 E106 N107	T52-S103 WeakPolarHBondContact CG2-OG 3.46Å; T52-S103 VanDerWaalsContact OG1-C 3.26Å; T52-S103 PolarHBondContact OG1-O 2.96Å; T52-S103 PolarHBondContact OG1-OG 3.29Å; Q81-S103 PolarHBondContact OE1-OG 3.22Å; H83-S103 VanDerWaalsContact NE2-CB 3.3Å; H83-S103 WeakPolarHBondContact NE2-CB 3.48Å; H83-S103 PolarHBondContact NE2-OG 2.86Å; H83-S103 VanDerWaalsContact NE2-OG 3.15Å; Q99-S103 PolarHBondContact O-N 3.23Å; V100-S103 PolarHBondContact O-N 3.02Å; S103-K105 VanDerWaalsContact C-N 3.34Å; S103-K105 PolarHBondContact O-N 2.99Å; S103-E106 PolarHBondContact O-N 3.45Å; S103-N107 WeakPolarHBondContact O-CB 3.04Å; S103-N107 PolarHBondContact O-N 3.12Å; S103-N107 PolarHBondContact O-ND2 2.77Å; S103-N107 PolarHBondContact OG-ND2 2.92Å
104	M	97.5	Very high	94.9	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-35.9	178.3	-70.1	-172.5	177.9	0	0	112.8	T52 L54 V100 L101 S102 K108 A110 I112 L132 L136	T52-M104 HydrophobicContact CG2-CE 4.24Å; T52-M104 HydrophobicContact CG2-CG 3.78Å; T52-M104 PolarHBondContact OG1-N 3.37Å; L54-M104 HydrophobicContact CD2-CE 4.4Å; V100-M104 HydrophobicContact CG1-CE 3.72Å; V100-M104 HydrophobicContact CG1-CG 4.45Å; V100-M104 HydrophobicContact CG1-SD 4.22Å; V100-M104 WeakPolarHBondContact O-CG 3.49Å; V100-M104 PolarHBondContact O-N 3.04Å; L101-M104 PolarHBondContact O-N 3.28Å; S102-M104 PolarHBondContact O-N 3.15Å; M104-K108 WeakPolarHBondContact O-CA 3.39Å; M104-K108 PolarHBondContact O-N 2.82Å; M104-A110 HydrophobicContact CE-CB 3.86Å; M104-A110 HydrophobicContact CG-CB 3.95Å; M104-A110 HydrophobicContact SD-CB 4.16Å; M104-I112 HydrophobicContact CE-CG2 3.61Å; M104-L132 HydrophobicContact CE-CD1 4.19Å; M104-L132 HydrophobicContact CE-CD2 4.03Å; M104-L132 HydrophobicContact SD-CD1 3.84Å; M104-L132 HydrophobicContact SD-CD2 3.89Å; M104-L132 HydrophobicContact SD-CG 4.17Å; M104-L136 HydrophobicContact CB-CD1 4.1Å; M104-L136 HydrophobicContact CB-CD2 4.39Å; M104-L136 HydrophobicContact SD-CD1 3.58Å; M104-L136 VanDerWaalsContact SD-CD1 3.58Å
105	K	97.2	Very high	95.2	Very high	88 Å²	88	41.1 Å²	41.1	38%	0.383	20%	0.198	S	C	.	.	H	α-helix	trans	-69.5	-38.3	175.6	-74.4	171.4	179.6	176.2	0	112.1	L101 S102 S103 L136 Y300	L101-K105 WeakPolarHBondContact O-CB 3.19Å; L101-K105 VanDerWaalsContact O-CG 3.23Å; L101-K105 WeakPolarHBondContact O-CG 3.27Å; L101-K105 PolarHBondContact O-N 3.45Å; S102-K105 PolarHBondContact O-N 3.4Å; S103-K105 VanDerWaalsContact C-N 3.34Å; S103-K105 PolarHBondContact O-N 2.99Å; K105-L136 HydrophobicContact CG-CD2 3.9Å; K105-Y300 HydrophobicContact CB-CE1 4.48Å; K105-Y300 HydrophobicContact CG-CE1 4.41Å; K105-Y300 HydrophobicContact CG-CE2 4.48Å
106	E	97.4	Very high	95.1	Very high	147 Å²	147	38 Å²	38	69%	0.687	18%	0.183	S	C	*	.	H	α-helix	trans	-68.7	-52.3	178.3	-175.4	174.3	-176.5	0	0	111.5	S102 S103	S102-E106 WeakPolarHBondContact O-CB 3.45Å; S102-E106 PolarHBondContact O-N 3.38Å; S103-E106 PolarHBondContact O-N 3.45Å
107	N	97.3	Very high	94.9	Very high	20 Å²	20	37.2 Å²	37.2	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-79.4	-22.8	-176.2	-63.6	-29.3	0	0	0	113.3	P50 T52 Q81 S103 V109	P50-N107 WeakPolarHBondContact CB-OD1 3.48Å; T52-N107 PolarHBondContact OG1-ND2 3.23Å; Q81-N107 PolarHBondContact OE1-ND2 3.4Å; S103-N107 WeakPolarHBondContact O-CB 3.04Å; S103-N107 PolarHBondContact O-N 3.12Å; S103-N107 PolarHBondContact O-ND2 2.77Å; S103-N107 PolarHBondContact OG-ND2 2.92Å; N107-V109 PolarHBondContact O-N 3.32Å
108	K	98.1	Very high	94.2	Very high	118 Å²	118	38.7 Å²	38.7	51%	0.513	19%	0.194	S	C	.	.	S	Bend	trans	62.9	-15.1	-176.9	-52.5	176.8	-176.3	177.7	0	116	M104 Y300 A301	M104-K108 WeakPolarHBondContact O-CA 3.39Å; M104-K108 PolarHBondContact O-N 2.82Å; K108-Y300 HydrophobicContact CB-CD1 4.15Å; K108-Y300 HydrophobicContact CG-CD1 4.24Å; K108-Y300 HydrophobicContact CG-CE1 4.4Å; K108-Y300 CarbonylContact O-C 3.53Å; K108-Y300 VanDerWaalsContact O-CA 3.24Å; K108-Y300 WeakPolarHBondContact O-CA 3.41Å; K108-A301 PolarHBondContact O-N 3.35Å
109	V	98.3	Very high	93.5	Very high	9 Å²	9	44.5 Å²	44.5	6%	0.055	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.5	178.6	-179.1	0	0	0	0	109.4	V51 T52 N107 A301 F303 M332 L336	V51-V109 HydrophobicContact CG1-CG1 4.41Å; V51-V109 HydrophobicContact CG2-CG1 4.34Å; T52-V109 PolarHBondContact N-O 3.35Å; T52-V109 VanDerWaalsContact N-O 3.13Å; N107-V109 PolarHBondContact O-N 3.32Å; V109-A301 WeakPolarHBondContact CA-O 3.2Å; V109-F303 HydrophobicContact CG1-CD2 4.24Å; V109-F303 HydrophobicContact CG1-CE2 4.02Å; V109-M332 HydrophobicContact CG1-CG 3.65Å; V109-M332 HydrophobicContact CG1-SD 4.12Å; V109-L336 HydrophobicContact CB-CD2 4.3Å; V109-L336 HydrophobicContact CG1-CD2 4.37Å; V109-L336 HydrophobicContact CG2-CD2 3.82Å
110	A	98.5	Very high	92.5	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.3	176.3	0	0	0	0	0	112.6	T52 M104 I112 A301 V302 F303	T52-A110 HydrophobicContact CG2-CB 4.5Å; T52-A110 CarbonylContact O-C 3.55Å; T52-A110 WeakPolarHBondContact O-CA 3.45Å; T52-A110 WeakPolarHBondContact O-CB 3.45Å; M104-A110 HydrophobicContact CE-CB 3.86Å; M104-A110 HydrophobicContact CG-CB 3.95Å; M104-A110 HydrophobicContact SD-CB 4.16Å; A110-I112 HydrophobicContact CB-CG2 4.43Å; A110-A301 PolarHBondContact N-O 3.02Å; A110-V302 HydrophobicContact CB-CG1 4.5Å; A110-V302 HydrophobicContact CB-CG2 4.18Å; A110-V302 CarbonylContact O-C 3.58Å; A110-V302 WeakPolarHBondContact O-CA 3.08Å; A110-F303 PolarHBondContact O-N 2.83Å
111	I	98.4	Very high	91.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	126.7	167.2	-167.7	172.3	0	0	0	109.2	V51 T52 M53 L54 M64 V67 F80 F303 M325 A329 M332	V51-I111 HydrophobicContact CG1-CG2 4.38Å; T52-I111 PolarHBondContact O-N 2.91Å; M53-I111 WeakPolarHBondContact CA-O 3.34Å; M53-I111 HydrophobicContact CB-CG2 4.12Å; M53-I111 HydrophobicContact CE-CG2 3.85Å; M53-I111 HydrophobicContact CG-CG2 4.12Å; L54-I111 PolarHBondContact N-O 3.35Å; M64-I111 HydrophobicContact CE-CG1 4.03Å; M64-I111 HydrophobicContact SD-CD1 4.31Å; M64-I111 HydrophobicContact SD-CG1 4.24Å; M64-I111 HydrophobicContact SD-CG2 4.31Å; V67-I111 HydrophobicContact CG1-CD1 4.49Å; V67-I111 HydrophobicContact CG2-CD1 4.45Å; F80-I111 HydrophobicContact CD1-CG2 4.34Å; F80-I111 HydrophobicContact CE1-CG2 3.89Å; I111-F303 CarbonylContact C-O 3.57Å; I111-F303 WeakPolarHBondContact CA-O 3.43Å; I111-F303 HydrophobicContact CG1-CB 4.31Å; I111-F303 WeakPolarHBondContact CG1-O 3.43Å; I111-M325 HydrophobicContact CD1-SD 3.89Å; I111-M325 HydrophobicContact CG1-SD 4Å; I111-A329 HydrophobicContact CD1-CB 3.77Å; I111-M332 HydrophobicContact CB-SD 4.03Å; I111-M332 HydrophobicContact CG2-SD 4.5Å
112	I	96.8	Very high	90	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140	-172.2	72.6	170.5	0	0	0	112.1	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 4.43Å; L54-I112 CarbonylContact O-C 3.5Å; L54-I112 WeakPolarHBondContact O-CA 3.3Å; M104-I112 HydrophobicContact CE-CG2 3.61Å; A110-I112 HydrophobicContact CB-CG2 4.43Å; I112-V302 HydrophobicContact CB-CG1 4.35Å; I112-V302 HydrophobicContact CD1-CG1 3.69Å; I112-V302 HydrophobicContact CG1-CG1 3.69Å; I112-V302 HydrophobicContact CG2-CG1 3.77Å; I112-F303 PolarHBondContact N-O 3.17Å; I112-E304 HydrophobicContact CG1-CB 3.78Å; I112-E304 WeakPolarHBondContact O-CB 3.34Å
113	G	95.2	Very high	88.7	Confident	3 Å²	3	60.6 Å²	60.6	3%	0.031	30%	0.296	C	S	.	.			trans	-87.7	176.7	163.7	0	0	0	0	0	110.9	L54 P55 I115	L54-G113 PolarHBondContact O-N 3.45Å; P55-G113 WeakPolarHBondContact O-CA 3.23Å; G113-I115 PolarHBondContact O-N 2.93Å
114	K	92.9	Very high	87.7	Confident	34 Å²	34	66.2 Å²	66.2	15%	0.148	32%	0.321	C	S	.	.			trans	-75.3	114.5	-178.7	178.4	49	176.3	143.9	0	110.6	D57 H116 R308 P310	D57-K114 WeakPolarHBondContact CB-O 3.43Å; D57-K114 PolarHBondContact N-O 3.25Å; K114-H116 PolarHBondContact O-N 3.13Å; K114-R308 HydrophobicContact CD-CB 4.14Å; K114-P310 HydrophobicContact CG-CB 4.14Å
115	I	90.8	Very high	86.8	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-72.4	117.9	162.6	-52.1	169.9	0	0	0	107.8	L54 L85 E87 G113 T117	L54-I115 HydrophobicContact CD2-CD1 3.79Å; L54-I115 HydrophobicContact CD2-CG1 4.22Å; L85-I115 HydrophobicContact CD2-CD1 4.03Å; E87-I115 HydrophobicContact CG-CG2 4.28Å; G113-I115 PolarHBondContact O-N 2.93Å; I115-T117 PolarHBondContact O-N 3.04Å
116	H	86.3	Confident	86	Confident	68 Å²	68	65.8 Å²	65.8	32%	0.315	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-73.3	129.9	-178.7	-176	50.9	0	0	0	110	D57 E87 V88 K114	D57-H116 HydrophobicContact CB-CB 3.82Å; D57-H116 PolarHBondContact OD2-N 3.29Å; E87-H116 WeakPolarHBondContact CB-O 3.29Å; V88-H116 VanDerWaalsContact CG1-CD2 3.47Å; V88-H116 WeakPolarHBondContact CG1-CD2 3.41Å; V88-H116 HydrophobicContact CG2-CB 4.09Å; K114-H116 PolarHBondContact O-N 3.13Å
117	T	83.7	Confident	85.5	Confident	48 Å²	48	59.2 Å²	59.2	29%	0.294	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-99.5	123.5	177.7	-54	0	0	0	0	108.5	I115 S127	I115-T117 PolarHBondContact O-N 3.04Å; T117-S127 VanDerWaalsContact CG2-CB 3.48Å; T117-S127 WeakPolarHBondContact OG1-CB 3.36Å
118	P	77.5	Confident	85	Confident	32 Å²	32	59.5 Å²	59.5	21%	0.208	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-58.7	141.5	173.8	-18.5	29.4	0	0	0	111.2	E87 V88 E120	E87-P118 HydrophobicContact CB-CG 4.21Å; E87-P118 WeakPolarHBondContact OE2-CD 3.41Å; V88-P118 HydrophobicContact CG1-CG 3.99Å; P118-E120 VanDerWaalsContact C-N 3.34Å
119	M	76.8	Confident	84.6	Confident	194 Å²	194	54.5 Å²	54.5	96%	0.956	27%	0.274	S	S	*	.	S	Bend	trans	-78.7	-21.8	173.9	-67.4	-177.9	-68.9	0	0	112.6
120	E	73.5	Confident	84.2	Confident	142 Å²	142	55.5 Å²	55.5	66%	0.664	28%	0.279	S	S	*	.	S	Bend	trans	-78.3	132.8	179.5	-65.9	173.2	180	0	0	110.8	P118 K122	P118-E120 VanDerWaalsContact C-N 3.34Å; E120-K122 PolarHBondContact O-N 3.44Å
121	Y	72.9	Confident	83.8	Confident	160 Å²	160	57 Å²	57	63%	0.627	28%	0.284	S	S	*	.			trans	-72.1	114.2	172.8	179.8	-117.5	0	0	0	110.5	G123 L125	Y121-G123 PolarHBondContact OH-O 3.03Å; Y121-L125 HydrophobicContact CD2-CD2 3.69Å; Y121-L125 HydrophobicContact CD2-CG 4.41Å; Y121-L125 HydrophobicContact CE2-CD2 3.46Å; Y121-L125 VanDerWaalsContact CE2-CD2 3.46Å; Y121-L125 HydrophobicContact CE2-CG 3.75Å
122	K	67.4	Low	83.5	Confident	150 Å²	150	57 Å²	57	65%	0.652	28%	0.284	S	S	*	.			trans	-109.1	21.6	-179.8	-64.9	-175.9	179.8	-178.6	0	113.4	E120	E120-K122 PolarHBondContact O-N 3.44Å
123	G	69.8	Low	83.4	Confident	49 Å²	49	57.5 Å²	57.5	51%	0.505	29%	0.286	S	S	.	.	S	Bend	trans	98.5	-12.4	-179.7	0	0	0	0	0	115	Y121	Y121-G123 PolarHBondContact OH-O 3.03Å
124	E	76.1	Confident	83.2	Confident	124 Å²	124	62.2 Å²	62.2	58%	0.579	30%	0.303	S	S	*	.			trans	-118	128.9	170.1	-68.9	-171.3	-174.9	0	0	110.3	R131	E124-R131 IonicContact OE2-NH1 3.02Å; E124-R131 PolarHBondContact OE2-NH1 2.87Å; E124-R131 VanDerWaalsContact OE2-NH1 3.15Å
125	L	77.9	Confident	83.3	Confident	65 Å²	65	64.5 Å²	64.5	34%	0.34	31%	0.313	S	S	.	.			trans	-83.9	-22.8	176.9	-66.7	172.1	0	0	0	112.7	Y121 S173 E175	Y121-L125 HydrophobicContact CD2-CD2 3.69Å; Y121-L125 HydrophobicContact CD2-CG 4.41Å; Y121-L125 HydrophobicContact CE2-CD2 3.46Å; Y121-L125 VanDerWaalsContact CE2-CD2 3.46Å; Y121-L125 HydrophobicContact CE2-CG 3.75Å; L125-S173 WeakPolarHBondContact CD1-O 3.43Å; L125-S173 PolarHBondContact O-OG 3.49Å; L125-E175 HydrophobicContact CD1-CB 3.91Å; L125-E175 HydrophobicContact CD1-CG 4.39Å
126	A	79.7	Confident	83.6	Confident	18 Å²	18	64.7 Å²	64.7	15%	0.149	31%	0.314	C	S	.	.	S	Bend	trans	-99.7	115.8	-174.9	0	0	0	0	0	111.3	R131	A126-R131 HydrophobicContact CB-CG 4.06Å; A126-R131 WeakPolarHBondContact O-CD 3.32Å
127	S	86.8	Confident	84.1	Confident	8 Å²	8	64.5 Å²	64.5	6%	0.056	32%	0.315	C	S	.	.			trans	-63.2	159.8	173.3	67.7	0	0	0	0	112.9	E87 T117 D129 M130 R131	E87-S127 WeakPolarHBondContact OE1-CA 3.33Å; E87-S127 WeakPolarHBondContact OE1-CB 3.29Å; T117-S127 VanDerWaalsContact CG2-CB 3.48Å; T117-S127 WeakPolarHBondContact OG1-CB 3.36Å; S127-D129 VanDerWaalsContact C-N 3.29Å; S127-D129 PolarHBondContact O-N 3.08Å; S127-M130 WeakPolarHBondContact O-CB 3.37Å; S127-M130 PolarHBondContact O-N 3.05Å; S127-M130 VanDerWaalsContact O-N 3.16Å; S127-M130 WeakPolarHBondContact OG-CB 3.24Å; S127-M130 WeakPolarHBondContact OG-CG 3.28Å; S127-M130 PolarHBondContact OG-N 3.49Å; S127-R131 WeakPolarHBondContact O-CB 3.44Å; S127-R131 WeakPolarHBondContact O-CG 3.39Å; S127-R131 PolarHBondContact O-N 3.22Å
128	Y	88.4	Confident	84.8	Confident	27 Å²	27	62.2 Å²	62.2	11%	0.106	30%	0.301	C	S	.	.	H	α-helix	trans	-60	-37.6	173.1	-79.9	-103.6	0	0	0	111.9	L85 E87 A92 L97 M130 R131 L132	L85-Y128 HydrophobicContact CD1-CD1 3.94Å; L85-Y128 HydrophobicContact CD1-CE1 4.17Å; L85-Y128 HydrophobicContact CD2-CD1 4.04Å; L85-Y128 HydrophobicContact CG-CD1 4.28Å; E87-Y128 HydrophobicContact CG-CD2 3.31Å; E87-Y128 HydrophobicContact CG-CE2 4Å; E87-Y128 HydrophobicContact CG-CG 3.99Å; E87-Y128 WeakPolarHBondContact OE1-CB 3.5Å; E87-Y128 PolarHBondContact OE1-N 2.49Å; A92-Y128 HydrophobicContact CB-CE1 4.48Å; A92-Y128 HydrophobicContact CB-CE2 3.85Å; L97-Y128 HydrophobicContact CB-CD1 3.92Å; L97-Y128 HydrophobicContact CB-CE1 3.81Å; L97-Y128 HydrophobicContact CD1-CD1 4.11Å; L97-Y128 HydrophobicContact CD2-CD1 3.82Å; L97-Y128 HydrophobicContact CD2-CE1 3.99Å; L97-Y128 HydrophobicContact CG-CD1 4.15Å; L97-Y128 HydrophobicContact CG-CE1 4.4Å; Y128-M130 PolarHBondContact O-N 3.37Å; Y128-R131 PolarHBondContact O-N 3.13Å; Y128-L132 VanDerWaalsContact O-CB 3.27Å; Y128-L132 WeakPolarHBondContact O-CB 3.46Å; Y128-L132 PolarHBondContact O-N 3.32Å
129	D	88.5	Confident	85.7	Confident	13 Å²	13	61.9 Å²	61.9	7%	0.07	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-44.7	173.8	-177.6	79.2	0	0	0	111.1	S127 L132 R133	S127-D129 VanDerWaalsContact C-N 3.29Å; S127-D129 PolarHBondContact O-N 3.08Å; D129-L132 PolarHBondContact O-N 3.2Å; D129-R133 VanDerWaalsContact O-CG 3.3Å; D129-R133 WeakPolarHBondContact O-CG 3.28Å; D129-R133 PolarHBondContact O-N 3.18Å; D129-R133 IonicContact OD1-CZ 3.67Å; D129-R133 IonicContact OD1-NE 3.62Å; D129-R133 PolarHBondContact OD1-NE 2.78Å; D129-R133 IonicContact OD1-NH2 2.8Å; D129-R133 PolarHBondContact OD1-NH2 3.37Å; D129-R133 IonicContact OD2-CZ 2.77Å; D129-R133 IonicContact OD2-NE 3.76Å; D129-R133 PolarHBondContact OD2-NE 2.91Å; D129-R133 IonicContact OD2-NH2 3.81Å; D129-R133 PolarHBondContact OD2-NH2 3.37Å
130	M	89.4	Confident	86.7	Confident	29 Å²	29	52.6 Å²	52.6	14%	0.143	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-39.5	175.9	-69.5	170.7	67.6	0	0	112.4	S127 Y128 R134 Y171 S173	S127-M130 WeakPolarHBondContact O-CB 3.37Å; S127-M130 PolarHBondContact O-N 3.05Å; S127-M130 VanDerWaalsContact O-N 3.16Å; S127-M130 WeakPolarHBondContact OG-CB 3.24Å; S127-M130 WeakPolarHBondContact OG-CG 3.28Å; S127-M130 PolarHBondContact OG-N 3.49Å; Y128-M130 PolarHBondContact O-N 3.37Å; M130-R134 WeakPolarHBondContact O-CB 3.3Å; M130-R134 WeakPolarHBondContact O-CG 3.44Å; M130-R134 PolarHBondContact O-N 3.4Å; M130-Y171 HydrophobicContact CE-CD1 3.92Å; M130-Y171 HydrophobicContact CE-CG 4.36Å; M130-Y171 WeakPolarHBondContact CE-O 3.49Å; M130-Y171 HydrophobicContact CG-CD1 4.33Å; M130-Y171 HydrophobicContact SD-CD1 4.08Å; M130-S173 WeakPolarHBondContact CE-OG 3.18Å
131	R	91.3	Very high	87.9	Confident	34 Å²	34	45.9 Å²	45.9	13%	0.128	22%	0.219	C	C	.	.	H	α-helix	trans	-67.2	-41.9	178.2	-68.6	169.3	67.6	-177.1	-1	111.2	E94 L97 E124 A126 S127 Y128 R134 K135	E94-R131 IonicContact OE1-CZ 2.57Å; E94-R131 IonicContact OE1-NH2 3.78Å; E94-R131 PolarHBondContact OE1-NH2 3Å; E94-R131 IonicContact OE2-CZ 3.64Å; E94-R131 IonicContact OE2-NH1 3.35Å; E94-R131 PolarHBondContact OE2-NH1 3.23Å; E94-R131 IonicContact OE2-NH2 2.73Å; E94-R131 PolarHBondContact OE2-NH2 2.97Å; L97-R131 HydrophobicContact CD2-CB 4.29Å; E124-R131 IonicContact OE2-NH1 3.02Å; E124-R131 PolarHBondContact OE2-NH1 2.87Å; E124-R131 VanDerWaalsContact OE2-NH1 3.15Å; A126-R131 HydrophobicContact CB-CG 4.06Å; A126-R131 WeakPolarHBondContact O-CD 3.32Å; S127-R131 WeakPolarHBondContact O-CB 3.44Å; S127-R131 WeakPolarHBondContact O-CG 3.39Å; S127-R131 PolarHBondContact O-N 3.22Å; Y128-R131 PolarHBondContact O-N 3.13Å; R131-R134 PolarHBondContact O-N 3.38Å; R131-K135 WeakPolarHBondContact O-CB 3.39Å; R131-K135 WeakPolarHBondContact O-CG 3.39Å; R131-K135 PolarHBondContact O-N 3.45Å
132	L	92.8	Very high	89.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-52.2	175	-171.1	103.7	0	0	0	110.7	L97 V100 L101 M104 Y128 D129 R134 K135 L136	L97-L132 HydrophobicContact CD1-CD1 4.12Å; V100-L132 HydrophobicContact CG1-CD1 3.84Å; L101-L132 HydrophobicContact CD2-CD1 3.88Å; L101-L132 HydrophobicContact CD2-CG 4.24Å; L101-L132 HydrophobicContact CG-CD1 4.26Å; M104-L132 HydrophobicContact CE-CD1 4.19Å; M104-L132 HydrophobicContact CE-CD2 4.03Å; M104-L132 HydrophobicContact SD-CD1 3.84Å; M104-L132 HydrophobicContact SD-CD2 3.89Å; M104-L132 HydrophobicContact SD-CG 4.17Å; Y128-L132 VanDerWaalsContact O-CB 3.27Å; Y128-L132 WeakPolarHBondContact O-CB 3.46Å; Y128-L132 PolarHBondContact O-N 3.32Å; D129-L132 PolarHBondContact O-N 3.2Å; L132-R134 VanDerWaalsContact C-N 3.34Å; L132-R134 PolarHBondContact O-N 2.88Å; L132-K135 PolarHBondContact O-N 3.03Å; L132-L136 HydrophobicContact CD2-CD1 4.34Å; L132-L136 HydrophobicContact CG-CD1 4.03Å; L132-L136 WeakPolarHBondContact O-CB 3.3Å; L132-L136 WeakPolarHBondContact O-CG 3.44Å; L132-L136 PolarHBondContact O-N 3.42Å
133	R	93.2	Very high	90.6	Very high	9 Å²	9	31.1 Å²	31.1	3%	0.034	16%	0.158	C	C	.	.	H	α-helix	trans	-59.6	-41.7	178.8	-69	173.8	-164.1	-75.5	-10.3	112.7	D129 D137 L138 S295 E304 R308	D129-R133 VanDerWaalsContact O-CG 3.3Å; D129-R133 WeakPolarHBondContact O-CG 3.28Å; D129-R133 PolarHBondContact O-N 3.18Å; D129-R133 IonicContact OD1-CZ 3.67Å; D129-R133 IonicContact OD1-NE 3.62Å; D129-R133 PolarHBondContact OD1-NE 2.78Å; D129-R133 IonicContact OD1-NH2 2.8Å; D129-R133 PolarHBondContact OD1-NH2 3.37Å; D129-R133 IonicContact OD2-CZ 2.77Å; D129-R133 IonicContact OD2-NE 3.76Å; D129-R133 PolarHBondContact OD2-NE 2.91Å; D129-R133 IonicContact OD2-NH2 3.81Å; D129-R133 PolarHBondContact OD2-NH2 3.37Å; R133-D137 WeakPolarHBondContact O-CA 3.43Å; R133-D137 PolarHBondContact O-N 2.9Å; R133-L138 HydrophobicContact CB-CB 4.39Å; R133-L138 HydrophobicContact CG-CD1 4.22Å; R133-L138 PolarHBondContact O-N 2.99Å; R133-S295 PolarHBondContact NH1-OG 3.27Å; R133-E304 IonicContact CZ-OE1 3.69Å; R133-E304 VanDerWaalsContact CZ-OE1 3.32Å; R133-E304 IonicContact CZ-OE2 3.38Å; R133-E304 IonicContact NH1-OE1 2.76Å; R133-E304 PolarHBondContact NH1-OE1 3.36Å; R133-E304 IonicContact NH1-OE2 2.58Å; R133-E304 VanDerWaalsContact NH2-CD 3.31Å; R133-E304 IonicContact NH2-OE1 3.99Å; R133-E304 PolarHBondContact NH2-OE1 2.93Å; R133-E304 IonicContact NH2-OE2 3.95Å; R133-E304 PolarHBondContact NH2-OE2 3.35Å; R133-R308 VanDerWaalsContact NH1-NH2 3.14Å; R133-R308 VanDerWaalsContact NH2-NE 3.1Å
134	R	92.4	Very high	91.9	Very high	102 Å²	102	30.7 Å²	30.7	39%	0.385	14%	0.143	S	C	.	.	H	α-helix	trans	-69	-45.2	177.1	-73.5	-173	-63	166.1	1.7	112.7	M130 R131 L132 L136 D137	M130-R134 WeakPolarHBondContact O-CB 3.3Å; M130-R134 WeakPolarHBondContact O-CG 3.44Å; M130-R134 PolarHBondContact O-N 3.4Å; R131-R134 PolarHBondContact O-N 3.38Å; L132-R134 VanDerWaalsContact C-N 3.34Å; L132-R134 PolarHBondContact O-N 2.88Å; R134-L136 VanDerWaalsContact C-N 3.25Å; R134-L136 PolarHBondContact O-N 3.35Å; R134-D137 PolarHBondContact O-N 2.83Å; R134-D137 VanDerWaalsContact O-N 3.12Å
135	K	94.9	Very high	92.9	Very high	83 Å²	83	24.9 Å²	24.9	36%	0.361	12%	0.116	S	C	.	.	H	α-helix	trans	-66.8	-25.8	-179.7	-75.7	-176.6	176.7	-177.5	0	112.7	E94 E98 L101 R131 L132	E94-K135 IonicContact OE1-NZ 2.61Å; E94-K135 PolarHBondContact OE1-NZ 2.69Å; E98-K135 IonicContact OE1-NZ 3.47Å; E98-K135 PolarHBondContact OE1-NZ 3.14Å; L101-K135 HydrophobicContact CD1-CB 4.18Å; L101-K135 HydrophobicContact CD1-CD 3.35Å; L101-K135 HydrophobicContact CD1-CG 4.4Å; L101-K135 HydrophobicContact CD2-CB 3.94Å; R131-K135 WeakPolarHBondContact O-CB 3.39Å; R131-K135 WeakPolarHBondContact O-CG 3.39Å; R131-K135 PolarHBondContact O-N 3.45Å; L132-K135 PolarHBondContact O-N 3.03Å
136	L	96.4	Very high	93.8	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-1.7	173.8	-65.8	174.9	0	0	0	113.7	L101 M104 K105 L132 R134 L138 S297 Y300	L101-L136 HydrophobicContact CD2-CD1 4.17Å; L101-L136 HydrophobicContact CD2-CD2 3.99Å; L101-L136 HydrophobicContact CD2-CG 3.74Å; M104-L136 HydrophobicContact CB-CD1 4.1Å; M104-L136 HydrophobicContact CB-CD2 4.39Å; M104-L136 HydrophobicContact SD-CD1 3.58Å; M104-L136 VanDerWaalsContact SD-CD1 3.58Å; K105-L136 HydrophobicContact CG-CD2 3.9Å; L132-L136 HydrophobicContact CD2-CD1 4.34Å; L132-L136 HydrophobicContact CG-CD1 4.03Å; L132-L136 WeakPolarHBondContact O-CB 3.3Å; L132-L136 WeakPolarHBondContact O-CG 3.44Å; L132-L136 PolarHBondContact O-N 3.42Å; R134-L136 VanDerWaalsContact C-N 3.25Å; R134-L136 PolarHBondContact O-N 3.35Å; L136-L138 HydrophobicContact CB-CD1 4.26Å; L136-L138 HydrophobicContact CB-CD2 4.49Å; L136-L138 HydrophobicContact CB-CG 3.86Å; L136-L138 HydrophobicContact CD1-CD1 4.18Å; L136-L138 PolarHBondContact O-N 3.16Å; L136-S297 VanDerWaalsContact O-CB 3.25Å; L136-S297 WeakPolarHBondContact O-CB 3.21Å; L136-S297 PolarHBondContact O-OG 3.44Å; L136-Y300 HydrophobicContact CB-CD2 3.97Å; L136-Y300 HydrophobicContact CB-CE2 4.44Å; L136-Y300 HydrophobicContact CD2-CD2 3.81Å; L136-Y300 HydrophobicContact CD2-CE2 3.83Å; L136-Y300 HydrophobicContact CG-CD2 4.44Å; L136-Y300 WeakPolarHBondContact O-CD2 3.36Å
137	D	96.9	Very high	94.6	Very high	64 Å²	64	27 Å²	27	34%	0.342	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.9	42.4	-171.9	-166.3	39.5	0	0	0	113.4	R133 R134 F139 R196 S297	R133-D137 WeakPolarHBondContact O-CA 3.43Å; R133-D137 PolarHBondContact O-N 2.9Å; R134-D137 PolarHBondContact O-N 2.83Å; R134-D137 VanDerWaalsContact O-N 3.12Å; D137-F139 VanDerWaalsContact C-N 3.25Å; D137-F139 PolarHBondContact O-N 3.48Å; D137-R196 VanDerWaalsContact CG-NH1 3.27Å; D137-R196 IonicContact OD1-CZ 2.75Å; D137-R196 IonicContact OD1-NH1 3.38Å; D137-R196 PolarHBondContact OD1-NH1 3.33Å; D137-R196 IonicContact OD1-NH2 3.21Å; D137-R196 PolarHBondContact OD1-NH2 2.9Å; D137-R196 IonicContact OD2-CZ 3.58Å; D137-R196 IonicContact OD2-NH1 3.59Å; D137-R196 PolarHBondContact OD2-NH1 3.37Å; D137-R196 IonicContact OD2-NH2 3.71Å; D137-S297 WeakPolarHBondContact O-CA 2.89Å; D137-S297 WeakPolarHBondContact O-CB 3.25Å
138	L	97.3	Very high	95.1	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	12%	0.123	C	C	.	.			trans	-69.4	85.9	172.7	-64.1	172.4	0	0	0	108.2	R133 L136 Q166 Y296 V302	R133-L138 HydrophobicContact CB-CB 4.39Å; R133-L138 HydrophobicContact CG-CD1 4.22Å; R133-L138 PolarHBondContact O-N 2.99Å; L136-L138 HydrophobicContact CB-CD1 4.26Å; L136-L138 HydrophobicContact CB-CD2 4.49Å; L136-L138 HydrophobicContact CB-CG 3.86Å; L136-L138 HydrophobicContact CD1-CD1 4.18Å; L136-L138 PolarHBondContact O-N 3.16Å; L138-Q166 WeakPolarHBondContact O-CB 3.42Å; L138-Y296 CarbonylContact C-O 3.6Å; L138-Y296 WeakPolarHBondContact CA-O 3.19Å; L138-V302 HydrophobicContact CD1-CB 4.03Å; L138-V302 HydrophobicContact CD1-CG2 3.57Å; L138-V302 HydrophobicContact CD2-CB 4.49Å; L138-V302 HydrophobicContact CD2-CG2 3.93Å; L138-V302 HydrophobicContact CG-CG2 4.42Å
139	F	97.7	Very high	95.3	Very high	24 Å²	24	29.5 Å²	29.5	11%	0.105	14%	0.139	C	C	.	.			trans	-89.3	-25.7	-167.6	74.3	-93.9	0	0	0	114.2	D137 E165 Q166 T167 R196 I197 F200 Y296	D137-F139 VanDerWaalsContact C-N 3.25Å; D137-F139 PolarHBondContact O-N 3.48Å; F139-E165 WeakPolarHBondContact O-CA 3.26Å; F139-Q166 PolarHBondContact O-N 2.8Å; F139-T167 HydrophobicContact CB-CG2 3.91Å; F139-R196 HydrophobicContact CD2-CG 3.9Å; F139-R196 HydrophobicContact CE2-CB 4.49Å; F139-R196 HydrophobicContact CE2-CG 4.11Å; F139-R196 HydrophobicContact CG-CG 4.46Å; F139-I197 HydrophobicContact CD2-CD1 4.2Å; F139-I197 HydrophobicContact CE2-CD1 4.42Å; F139-F200 HydrophobicContact CE2-CB 3.95Å; F139-F200 HydrophobicContact CE2-CD2 4.17Å; F139-F200 HydrophobicContact CE2-CG 4.19Å; F139-F200 HydrophobicContact CZ-CB 4.38Å; F139-F200 AromaticContact CZ-CD2 3.95Å; F139-F200 HydrophobicContact CZ-CD2 3.95Å; F139-F200 HydrophobicContact CZ-CG 4.42Å; F139-Y296 PolarHBondContact N-O 2.87Å
140	A	98.2	Very high	95.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.1	-176.7	0	0	0	0	0	111	I197 F200 S295 Y296	A140-I197 HydrophobicContact CB-CD1 3.52Å; A140-F200 HydrophobicContact CB-CD1 3.73Å; A140-F200 HydrophobicContact CB-CD2 4.09Å; A140-F200 HydrophobicContact CB-CE1 3.76Å; A140-F200 HydrophobicContact CB-CE2 4.09Å; A140-F200 HydrophobicContact CB-CG 3.91Å; A140-F200 HydrophobicContact CB-CZ 3.93Å; A140-S295 CarbonylContact O-C 3.39Å; A140-S295 WeakPolarHBondContact O-CA 3.08Å; A140-Y296 PolarHBondContact N-O 2.94Å; A140-Y296 VanDerWaalsContact N-O 3.17Å; A140-Y296 PolarHBondContact O-N 3Å
141	N	98	Very high	95.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	139.5	162.9	-152.4	-176.1	0	0	0	108.8	I163 R164 Q166 E294 S295 R308	N141-I163 VanDerWaalsContact O-CA 3.25Å; N141-I163 WeakPolarHBondContact O-CA 3.29Å; N141-R164 HydrophobicContact CB-CB 3.94Å; N141-R164 HydrophobicContact CB-CG 4.36Å; N141-R164 PolarHBondContact N-O 3.1Å; N141-R164 PolarHBondContact O-N 3.02Å; N141-Q166 HydrophobicContact CB-CG 3.67Å; N141-Q166 VanDerWaalsContact N-OE1 3.16Å; N141-E294 CarbonylContact C-O 3.56Å; N141-E294 WeakPolarHBondContact CA-O 3.44Å; N141-E294 PolarHBondContact ND2-O 2.91Å; N141-S295 PolarHBondContact ND2-OG 2.87Å; N141-R308 PolarHBondContact ND2-NH2 2.9Å; N141-R308 PolarHBondContact OD1-NH1 3.34Å; N141-R308 PolarHBondContact OD1-NH2 3.47Å
142	V	98.4	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	121.1	170.2	-173.3	0	0	0	0	108.2	V161 I162 I163 F200 Y204 G293 E294 Y296	V142-V161 HydrophobicContact CG1-CG1 3.56Å; V142-I162 CarbonylContact C-O 3.04Å; V142-I162 WeakPolarHBondContact CA-O 3.36Å; V142-I163 HydrophobicContact CG2-CG1 4.38Å; V142-F200 HydrophobicContact CG2-CE1 3.57Å; V142-F200 HydrophobicContact CG2-CZ 3.89Å; V142-Y204 HydrophobicContact CG1-CE2 3.87Å; V142-G293 CarbonylContact O-C 3.57Å; V142-G293 WeakPolarHBondContact O-CA 3.37Å; V142-E294 HydrophobicContact CB-CB 4.37Å; V142-E294 PolarHBondContact N-O 3.23Å; V142-E294 PolarHBondContact O-N 3.28Å; V142-Y296 HydrophobicContact CB-CE2 4.38Å; V142-Y296 HydrophobicContact CG2-CD2 3.88Å; V142-Y296 HydrophobicContact CG2-CE2 3.91Å
143	V	98.2	Very high	96	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.1	177.2	179	0	0	0	0	109	V145 V161 I162 D278 V291	V143-V145 HydrophobicContact CG1-CG2 4.11Å; V143-V161 WeakPolarHBondContact O-CA 3.36Å; V143-I162 HydrophobicContact CB-CB 4.36Å; V143-I162 PolarHBondContact N-O 3.31Å; V143-I162 PolarHBondContact O-N 3.45Å; V143-D278 HydrophobicContact CG2-CB 4.49Å; V143-D278 WeakPolarHBondContact CG2-OD1 3.32Å; V143-V291 HydrophobicContact CG1-CG1 3.43Å; V143-V291 VanDerWaalsContact CG1-CG1 3.43Å
144	H	96.6	Very high	96.1	Very high	41 Å²	41	47.3 Å²	47.3	19%	0.19	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	102.3	-176.2	-68.1	-100.1	0	0	0	110.4	K146 Y204 P292 E294	H144-K146 PolarHBondContact O-N 2.77Å; H144-Y204 PolarHBondContact CE1-OH 2.95Å; H144-P292 HydrophobicContact CB-CG 4.2Å; H144-P292 PolarHBondContact N-O 2.96Å; H144-E294 IonicContact CD2-OE1 2.8Å; H144-E294 IonicContact NE2-OE1 3.4Å; H144-E294 PolarHBondContact NE2-OE1 3.43Å; H144-E294 IonicContact NE2-OE2 3.78Å
145	V	97.3	Very high	96.3	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	89	-178.4	-178.2	0	0	0	0	108.6	V143 L160 I162 A281 V285	V143-V145 HydrophobicContact CG1-CG2 4.11Å; V145-L160 HydrophobicContact CB-CD1 3.68Å; V145-L160 HydrophobicContact CB-CG 3.87Å; V145-L160 HydrophobicContact CG1-CD1 4.19Å; V145-L160 HydrophobicContact CG1-CG 4.15Å; V145-L160 HydrophobicContact CG2-CD1 3.98Å; V145-L160 PolarHBondContact N-O 3.38Å; V145-L160 PolarHBondContact O-N 2.86Å; V145-I162 HydrophobicContact CG2-CD1 3.78Å; V145-A281 HydrophobicContact CB-CB 4.39Å; V145-A281 HydrophobicContact CG1-CB 3.97Å; V145-A281 WeakPolarHBondContact CG1-O 3.16Å; V145-A281 HydrophobicContact CG2-CB 3.72Å; V145-V285 HydrophobicContact CG1-CB 4.38Å; V145-V285 HydrophobicContact CG1-CG1 3.55Å; V145-V285 HydrophobicContact CG1-CG2 3.89Å
146	K	97.2	Very high	96.3	Very high	115 Å²	115	41.2 Å²	41.2	50%	0.5	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.3	-177.5	-172.3	166.5	-175.4	138.2	0	111.6	H144 L148 L158 D159	H144-K146 PolarHBondContact O-N 2.77Å; K146-L148 PolarHBondContact O-N 3.1Å; K146-L158 CarbonylContact C-O 3.56Å; K146-L158 VanDerWaalsContact CA-O 3.29Å; K146-L158 WeakPolarHBondContact CA-O 3.33Å; K146-D159 IonicContact NZ-OD2 3.02Å; K146-D159 PolarHBondContact NZ-OD2 2.84Å
147	S	97.4	Very high	96.2	Very high	14 Å²	14	48 Å²	48	10%	0.098	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-62.8	131.2	171.7	-64	0	0	0	0	110	N157 L158	S147-N157 PolarHBondContact OG-N 2.91Å; S147-N157 VanDerWaalsContact OG-N 3.17Å; S147-L158 PolarHBondContact N-O 3.07Å; S147-L158 PolarHBondContact OG-N 3.01Å
148	L	96.1	Very high	96.3	Very high	18 Å²	18	45.1 Å²	45.1	9%	0.094	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-86.8	130	179	-65.3	177.6	0	0	0	110.7	K146 G150 Y151 V290 T323 L327 I353	K146-L148 PolarHBondContact O-N 3.1Å; L148-G150 PolarHBondContact O-N 3.33Å; L148-Y151 PolarHBondContact O-N 3.44Å; L148-V290 HydrophobicContact CD1-CB 3.8Å; L148-V290 HydrophobicContact CD1-CG1 4.09Å; L148-T323 HydrophobicContact CD1-CG2 3.94Å; L148-L327 HydrophobicContact CD2-CD1 4.29Å; L148-I353 HydrophobicContact CB-CG2 4.15Å; L148-I353 HydrophobicContact CD1-CD1 3.62Å
149	P	93.5	Very high	96.3	Very high	69 Å²	69	48 Å²	48	45%	0.448	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	129.3	178.9	-27.3	35.1	0	0	0	112.5	Y151 K354	P149-Y151 VanDerWaalsContact C-N 3.26Å; P149-Y151 PolarHBondContact O-N 2.81Å; P149-K354 HydrophobicContact CB-CD 4.42Å; P149-K354 WeakPolarHBondContact O-CA 3.37Å; P149-K354 WeakPolarHBondContact O-CB 3.25Å; P149-K354 PolarHBondContact O-N 2.8Å
150	G	91.7	Very high	96.3	Very high	37 Å²	37	46.9 Å²	46.9	38%	0.381	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	-3.1	-179.1	0	0	0	0	0	115.3	L148 R359	L148-G150 PolarHBondContact O-N 3.33Å; G150-R359 PolarHBondContact O-NH2 3.36Å
151	Y	94.7	Very high	96.3	Very high	25 Å²	25	46.9 Å²	46.9	10%	0.098	24%	0.237	C	C	.	.			trans	-99	100.4	168	-173.5	-152.9	0	0	0	110.1	L148 P149 T153 G286 V290 D362 M363	L148-Y151 PolarHBondContact O-N 3.44Å; P149-Y151 VanDerWaalsContact C-N 3.26Å; P149-Y151 PolarHBondContact O-N 2.81Å; Y151-T153 HydrophobicContact CE1-CG2 4.49Å; Y151-G286 PolarHBondContact OH-O 2.91Å; Y151-V290 HydrophobicContact CD1-CG1 4.49Å; Y151-V290 HydrophobicContact CE1-CG1 4.11Å; Y151-V290 HydrophobicContact CE1-CG2 4.35Å; Y151-D362 PolarHBondContact OH-O 3.09Å; Y151-M363 HydrophobicContact CE1-CG 4.04Å; Y151-M363 HydrophobicContact CE1-SD 4.4Å; Y151-M363 HydrophobicContact CE2-CB 4Å; Y151-M363 HydrophobicContact CE2-CG 4.22Å
152	M	93.8	Very high	96.3	Very high	140 Å²	140	46.9 Å²	46.9	69%	0.69	24%	0.237	S	C	*	.			trans	-80.2	126.1	-177.1	-64.4	-60	-62.2	0	0	110.6
153	T	95.4	Very high	96.4	Very high	31 Å²	31	46.9 Å²	46.9	19%	0.19	24%	0.237	C	C	.	.			trans	-123.2	-174.8	168.9	71.3	0	0	0	0	109.7	Y151 H155 N156 L284	Y151-T153 HydrophobicContact CE1-CG2 4.49Å; T153-H155 VanDerWaalsContact C-N 3.26Å; T153-H155 PolarHBondContact O-N 3.33Å; T153-H155 PolarHBondContact OG1-N 3.32Å; T153-H155 PolarHBondContact OG1-O 3.37Å; T153-N156 PolarHBondContact N-OD1 3.49Å; T153-N156 VanDerWaalsContact N-OD1 3.1Å; T153-N156 PolarHBondContact O-ND2 3.08Å; T153-N156 PolarHBondContact O-OD1 3.35Å; T153-L284 WeakPolarHBondContact CB-O 3.3Å; T153-L284 PolarHBondContact OG1-O 2.94Å
154	R	95.3	Very high	96.3	Very high	225 Å²	225	47.2 Å²	47.2	85%	0.849	24%	0.238	S	C	*	.	S	Bend	trans	-59.7	-38	174.9	-176.2	176.5	179.5	131.7	0.9	112.1
155	H	96.4	Very high	96.4	Very high	20 Å²	20	45.4 Å²	45.4	9%	0.093	23%	0.229	C	C	.	.	S	Bend	trans	-119.3	116.3	179.4	-59	-80.1	0	0	0	109.7	T153 L158 V258 P261	T153-H155 VanDerWaalsContact C-N 3.26Å; T153-H155 PolarHBondContact O-N 3.33Å; T153-H155 PolarHBondContact OG1-N 3.32Å; T153-H155 PolarHBondContact OG1-O 3.37Å; H155-L158 HydrophobicContact CB-CD1 3.71Å; H155-L158 HydrophobicContact CB-CD2 4.3Å; H155-L158 HydrophobicContact CB-CG 4.13Å; H155-V258 PolarHBondContact CE1-O 2.95Å; H155-V258 PolarHBondContact NE2-O 2.79Å; H155-V258 VanDerWaalsContact NE2-O 3.16Å; H155-P261 HydrophobicContact CB-CG 4.14Å
156	N	94.9	Very high	96.2	Very high	38 Å²	38	46 Å²	46	20%	0.203	23%	0.232	C	C	.	.			trans	-108.8	158.5	-175.6	-60	-76.8	0	0	0	110.6	T153 L158 Y262	T153-N156 PolarHBondContact N-OD1 3.49Å; T153-N156 VanDerWaalsContact N-OD1 3.1Å; T153-N156 PolarHBondContact O-ND2 3.08Å; T153-N156 PolarHBondContact O-OD1 3.35Å; N156-L158 VanDerWaalsContact C-N 3.3Å; N156-L158 PolarHBondContact O-N 3.48Å; N156-Y262 PolarHBondContact N-OH 2.88Å; N156-Y262 WeakPolarHBondContact O-CE1 3.48Å; N156-Y262 PolarHBondContact O-OH 3.24Å
157	N	95.6	Very high	96.1	Very high	144 Å²	144	40.8 Å²	40.8	77%	0.77	21%	0.21	S	C	*	.	S	Bend	trans	60.2	35.7	-178.5	-51.2	-40.3	0	0	0	113.9	S147	S147-N157 PolarHBondContact OG-N 2.91Å; S147-N157 VanDerWaalsContact OG-N 3.17Å
158	L	97.7	Very high	96	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.021	21%	0.206	C	C	.	.			trans	-78.8	142.4	170	-59.1	-176.1	0	0	0	110.6	K146 S147 H155 N156 P261 Y262 L284 V285	K146-L158 CarbonylContact C-O 3.56Å; K146-L158 VanDerWaalsContact CA-O 3.29Å; K146-L158 WeakPolarHBondContact CA-O 3.33Å; S147-L158 PolarHBondContact N-O 3.07Å; S147-L158 PolarHBondContact OG-N 3.01Å; H155-L158 HydrophobicContact CB-CD1 3.71Å; H155-L158 HydrophobicContact CB-CD2 4.3Å; H155-L158 HydrophobicContact CB-CG 4.13Å; N156-L158 VanDerWaalsContact C-N 3.3Å; N156-L158 PolarHBondContact O-N 3.48Å; L158-P261 HydrophobicContact CD1-CB 4.21Å; L158-P261 HydrophobicContact CD1-CG 4.12Å; L158-P261 HydrophobicContact CD2-CB 3.84Å; L158-P261 HydrophobicContact CD2-CG 3.67Å; L158-Y262 HydrophobicContact CD2-CD1 3.75Å; L158-Y262 HydrophobicContact CD2-CE1 3.5Å; L158-Y262 HydrophobicContact CD2-CE2 4.43Å; L158-Y262 HydrophobicContact CD2-CG 4.31Å; L158-L284 HydrophobicContact CD1-CB 3.84Å; L158-L284 HydrophobicContact CD1-CD1 4.38Å; L158-V285 HydrophobicContact CB-CG1 4.09Å; L158-V285 HydrophobicContact CD1-CG1 4Å
159	D	97.8	Very high	95.9	Very high	61 Å²	61	39.6 Å²	39.6	33%	0.326	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	77.6	173.7	-166.4	-13.9	0	0	0	110.1	K146 R210	K146-D159 IonicContact NZ-OD2 3.02Å; K146-D159 PolarHBondContact NZ-OD2 2.84Å; D159-R210 PolarHBondContact O-NH1 3.38Å; D159-R210 IonicContact OD1-CZ 2.75Å; D159-R210 IonicContact OD1-NH1 2.71Å; D159-R210 IonicContact OD1-NH2 2.84Å; D159-R210 PolarHBondContact OD1-NH2 3.46Å; D159-R210 IonicContact OD2-NH2 2.94Å
160	L	98	Very high	95.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	155.7	177.5	66.7	93.4	0	0	0	110.9	V145 I162 L257 F264 D265 L267	V145-L160 HydrophobicContact CB-CD1 3.68Å; V145-L160 HydrophobicContact CB-CG 3.87Å; V145-L160 HydrophobicContact CG1-CD1 4.19Å; V145-L160 HydrophobicContact CG1-CG 4.15Å; V145-L160 HydrophobicContact CG2-CD1 3.98Å; V145-L160 PolarHBondContact N-O 3.38Å; V145-L160 PolarHBondContact O-N 2.86Å; L160-I162 HydrophobicContact CD1-CD1 4.14Å; L160-I162 HydrophobicContact CD1-CG1 3.9Å; L160-L257 HydrophobicContact CD2-CD2 4.01Å; L160-F264 HydrophobicContact CB-CB 4.25Å; L160-F264 HydrophobicContact CD2-CB 4.31Å; L160-D265 CarbonylContact C-O 3.52Å; L160-D265 VanDerWaalsContact CA-O 3.3Å; L160-D265 WeakPolarHBondContact CA-O 3.37Å; L160-D265 WeakPolarHBondContact CB-O 3.27Å; L160-L267 HydrophobicContact CB-CD1 4.43Å; L160-L267 HydrophobicContact CD1-CD1 3.82Å
161	V	98.6	Very high	95.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.2	-179	-178.7	0	0	0	0	109.3	V142 V143 I163 Y204 D265 V266 L267	V142-V161 HydrophobicContact CG1-CG1 3.56Å; V143-V161 WeakPolarHBondContact O-CA 3.36Å; V161-I163 HydrophobicContact CG1-CG1 4.11Å; V161-Y204 HydrophobicContact CB-CE1 4.18Å; V161-Y204 HydrophobicContact CG1-CE1 3.79Å; V161-Y204 HydrophobicContact CG2-CE1 4.02Å; V161-D265 PolarHBondContact N-O 3.17Å; V161-V266 HydrophobicContact CB-CG2 4.48Å; V161-V266 CarbonylContact O-C 3.58Å; V161-V266 WeakPolarHBondContact O-CA 3.26Å; V161-L267 PolarHBondContact O-N 3.19Å
162	I	98.6	Very high	95.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126	175.4	-60.4	156.3	0	0	0	108.2	V142 V143 V145 L160 L267 M269 I277 D278 A281	V142-I162 CarbonylContact C-O 3.04Å; V142-I162 WeakPolarHBondContact CA-O 3.36Å; V143-I162 HydrophobicContact CB-CB 4.36Å; V143-I162 PolarHBondContact N-O 3.31Å; V143-I162 PolarHBondContact O-N 3.45Å; V145-I162 HydrophobicContact CG2-CD1 3.78Å; L160-I162 HydrophobicContact CD1-CD1 4.14Å; L160-I162 HydrophobicContact CD1-CG1 3.9Å; I162-L267 HydrophobicContact CG1-CD1 4.23Å; I162-M269 HydrophobicContact CG2-CE 3.85Å; I162-M269 HydrophobicContact CG2-SD 4.31Å; I162-I277 HydrophobicContact CD1-CG2 3.68Å; I162-I277 HydrophobicContact CG1-CG2 4Å; I162-I277 HydrophobicContact CG2-CG2 4.43Å; I162-D278 WeakPolarHBondContact CB-OD1 3.45Å; I162-D278 WeakPolarHBondContact CG2-OD1 3.31Å; I162-A281 HydrophobicContact CD1-CB 3.59Å
163	I	98.8	Very high	94.8	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.7	176.4	-61.1	-179.2	0	0	0	108.3	N141 V142 V161 I197 F200 A201 Y204 V266 L267 V268 M269	N141-I163 VanDerWaalsContact O-CA 3.25Å; N141-I163 WeakPolarHBondContact O-CA 3.29Å; V142-I163 HydrophobicContact CG2-CG1 4.38Å; V161-I163 HydrophobicContact CG1-CG1 4.11Å; I163-I197 HydrophobicContact CG2-CD1 3.61Å; I163-I197 HydrophobicContact CG2-CG1 4.15Å; I163-F200 HydrophobicContact CD1-CD1 4.26Å; I163-F200 HydrophobicContact CD1-CE1 4.25Å; I163-F200 HydrophobicContact CG2-CD1 3.9Å; I163-F200 HydrophobicContact CG2-CE1 4.28Å; I163-A201 HydrophobicContact CB-CB 4.41Å; I163-A201 HydrophobicContact CD1-CB 3.83Å; I163-A201 HydrophobicContact CG2-CB 4.22Å; I163-Y204 HydrophobicContact CD1-CD1 4Å; I163-Y204 HydrophobicContact CD1-CG 3.9Å; I163-V266 HydrophobicContact CD1-CG1 3.66Å; I163-V266 HydrophobicContact CG1-CG1 4.17Å; I163-L267 PolarHBondContact N-O 3.16Å; I163-V268 HydrophobicContact CG2-CG2 4.38Å; I163-V268 VanDerWaalsContact O-CA 3.29Å; I163-V268 WeakPolarHBondContact O-CA 3.3Å; I163-M269 PolarHBondContact O-N 3.46Å
164	R	97.9	Very high	94.5	Very high	6 Å²	6	36.6 Å²	36.6	2%	0.023	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.5	-172.6	160.3	-169	179.7	178.9	2.7	110.3	N141 Q166 Y171 N271 N275 D278	N141-R164 HydrophobicContact CB-CB 3.94Å; N141-R164 HydrophobicContact CB-CG 4.36Å; N141-R164 PolarHBondContact N-O 3.1Å; N141-R164 PolarHBondContact O-N 3.02Å; R164-Q166 HydrophobicContact CG-CG 4.32Å; R164-Y171 VanDerWaalsContact NH2-CZ 3.35Å; R164-Y171 PolarHBondContact NH2-OH 3.08Å; R164-N271 PolarHBondContact NE-O 3.13Å; R164-N271 PolarHBondContact NE-OD1 3.23Å; R164-N271 PolarHBondContact NH2-O 3.48Å; R164-N271 PolarHBondContact NH2-OD1 3.43Å; R164-N275 VanDerWaalsContact CZ-CB 3.49Å; R164-N275 VanDerWaalsContact NH1-CB 3.27Å; R164-N275 PolarHBondContact NH1-OD1 3.36Å; R164-D278 IonicContact NH1-OD2 2.97Å
165	E	97.6	Very high	94.4	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.019	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.1	165.9	-159.7	-66.3	129.9	0	0	109.5	F139 T167 E168 I197 M269 N271	F139-E165 WeakPolarHBondContact O-CA 3.26Å; E165-T167 VanDerWaalsContact CD-N 3.29Å; E165-T167 WeakPolarHBondContact OE1-CA 3.46Å; E165-T167 WeakPolarHBondContact OE1-CB 3.23Å; E165-T167 PolarHBondContact OE1-N 2.77Å; E165-T167 PolarHBondContact OE1-OG1 2.83Å; E165-T167 PolarHBondContact OE2-N 3.37Å; E165-T167 VanDerWaalsContact OE2-N 3.14Å; E165-E168 HydrophobicContact CG-CG 4.49Å; E165-E168 PolarHBondContact OE1-N 2.99Å; E165-E168 WeakPolarHBondContact OE2-CG 3.35Å; E165-E168 PolarHBondContact OE2-N 2.54Å; E165-I197 HydrophobicContact CB-CB 4.36Å; E165-I197 HydrophobicContact CB-CG1 4.11Å; E165-I197 HydrophobicContact CB-CG2 4.17Å; E165-I197 HydrophobicContact CG-CB 4.3Å; E165-I197 HydrophobicContact CG-CG2 4.12Å; E165-M269 PolarHBondContact N-O 3.4Å; E165-N271 WeakPolarHBondContact O-CA 3.5Å; E165-N271 WeakPolarHBondContact O-CB 3.45Å; E165-N271 PolarHBondContact O-OD1 3.06Å
166	Q	93.9	Very high	94.1	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.056	17%	0.17	C	C	.	.			trans	-118.1	-3.4	-172.8	-68.4	-170.3	-74.5	0	0	116	L138 F139 N141 R164 N271 S295	L138-Q166 WeakPolarHBondContact O-CB 3.42Å; F139-Q166 PolarHBondContact O-N 2.8Å; N141-Q166 HydrophobicContact CB-CG 3.67Å; N141-Q166 VanDerWaalsContact N-OE1 3.16Å; R164-Q166 HydrophobicContact CG-CG 4.32Å; Q166-N271 WeakPolarHBondContact CA-ND2 3.25Å; Q166-N271 PolarHBondContact O-ND2 2.89Å; Q166-S295 PolarHBondContact OE1-OG 3.27Å
167	T	94.1	Very high	94.1	Very high	6 Å²	6	37.1 Å²	37.1	4%	0.037	19%	0.186	C	C	.	.	S	Bend	trans	-111.2	-9.5	-167.3	68	0	0	0	0	114.7	F139 E165 K193 R196	F139-T167 HydrophobicContact CB-CG2 3.91Å; E165-T167 VanDerWaalsContact CD-N 3.29Å; E165-T167 WeakPolarHBondContact OE1-CA 3.46Å; E165-T167 WeakPolarHBondContact OE1-CB 3.23Å; E165-T167 PolarHBondContact OE1-N 2.77Å; E165-T167 PolarHBondContact OE1-OG1 2.83Å; E165-T167 PolarHBondContact OE2-N 3.37Å; E165-T167 VanDerWaalsContact OE2-N 3.14Å; T167-K193 PolarHBondContact O-NZ 2.81Å; T167-K193 WeakPolarHBondContact OG1-CD 3.48Å; T167-K193 WeakPolarHBondContact OG1-CE 3.3Å; T167-K193 PolarHBondContact OG1-NZ 3.27Å; T167-K193 VanDerWaalsContact OG1-NZ 3.09Å; T167-R196 PolarHBondContact OG1-NH2 2.97Å
168	E	95	Very high	94.1	Very high	6 Å²	6	33.1 Å²	33.1	3%	0.028	17%	0.169	C	C	.	.	S	Bend	trans	-142.9	-157.4	176.9	65.9	174.7	-163.2	0	0	112	E165 I188 V189 T190 K193 N271	E165-E168 HydrophobicContact CG-CG 4.49Å; E165-E168 PolarHBondContact OE1-N 2.99Å; E165-E168 WeakPolarHBondContact OE2-CG 3.35Å; E165-E168 PolarHBondContact OE2-N 2.54Å; E168-I188 WeakPolarHBondContact CB-O 3.44Å; E168-V189 WeakPolarHBondContact OE1-CA 3.44Å; E168-T190 VanDerWaalsContact CD-N 3.31Å; E168-T190 PolarHBondContact OE1-N 2.63Å; E168-T190 WeakPolarHBondContact OE2-CB 3.46Å; E168-T190 VanDerWaalsContact OE2-CG2 3.31Å; E168-T190 WeakPolarHBondContact OE2-CG2 3.25Å; E168-T190 PolarHBondContact OE2-N 3.39Å; E168-T190 VanDerWaalsContact OE2-N 3.11Å; E168-T190 PolarHBondContact OE2-OG1 2.93Å; E168-K193 HydrophobicContact CB-CD 4Å; E168-K193 HydrophobicContact CG-CB 4.2Å; E168-K193 HydrophobicContact CG-CD 3.8Å; E168-K193 WeakPolarHBondContact OE1-CB 3.39Å; E168-K193 WeakPolarHBondContact OE2-CD 3.12Å; E168-N271 WeakPolarHBondContact O-CB 3.46Å; E168-N271 PolarHBondContact O-ND2 2.85Å
169	G	94.1	Very high	94.1	Very high	2 Å²	2	35.6 Å²	35.6	2%	0.021	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	83.5	-140.2	-175.7	0	0	0	0	0	111.7	Y171 S172 I188	G169-Y171 PolarHBondContact O-N 3.27Å; G169-S172 WeakPolarHBondContact O-CB 3.35Å; G169-S172 PolarHBondContact O-N 3.45Å; G169-S172 PolarHBondContact O-OG 3.45Å; G169-I188 VanDerWaalsContact CA-O 3.24Å; G169-I188 WeakPolarHBondContact CA-O 3.37Å; G169-I188 PolarHBondContact N-O 2.76Å; G169-I188 PolarHBondContact O-N 3.08Å
170	E	91.9	Very high	94	Very high	53 Å²	53	44.4 Å²	44.4	25%	0.248	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-68.2	-19.5	177.6	-58.3	85.1	172.1	0	0	111.4	S172 K187 L272	E170-S172 PolarHBondContact O-N 2.84Å; E170-K187 HydrophobicContact CG-CB 4.46Å; E170-K187 HydrophobicContact CG-CD 4.29Å; E170-K187 HydrophobicContact CG-CG 4.28Å; E170-K187 VanDerWaalsContact OE1-CD 3.29Å; E170-K187 WeakPolarHBondContact OE1-CD 3.47Å; E170-K187 VanDerWaalsContact OE1-CE 3.24Å; E170-K187 WeakPolarHBondContact OE1-CE 3.4Å; E170-K187 IonicContact OE1-NZ 3.71Å; E170-K187 PolarHBondContact OE1-NZ 3.16Å; E170-L272 HydrophobicContact CB-CB 4.19Å; E170-L272 HydrophobicContact CB-CD2 4.27Å; E170-L272 HydrophobicContact CG-CB 4.02Å; E170-L272 HydrophobicContact CG-CD2 3.74Å; E170-L272 HydrophobicContact CG-CG 4.49Å; E170-L272 WeakPolarHBondContact OE2-CB 3.47Å
171	Y	85.4	Confident	93.9	Very high	59 Å²	59	47.5 Å²	47.5	23%	0.231	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-84.1	10.4	176.6	-73.3	-105.2	0	0	0	113.1	M130 R164 G169 S173 N271 L272 N275	M130-Y171 HydrophobicContact CE-CD1 3.92Å; M130-Y171 HydrophobicContact CE-CG 4.36Å; M130-Y171 WeakPolarHBondContact CE-O 3.49Å; M130-Y171 HydrophobicContact CG-CD1 4.33Å; M130-Y171 HydrophobicContact SD-CD1 4.08Å; R164-Y171 VanDerWaalsContact NH2-CZ 3.35Å; R164-Y171 PolarHBondContact NH2-OH 3.08Å; G169-Y171 PolarHBondContact O-N 3.27Å; Y171-S173 PolarHBondContact O-N 3Å; Y171-N271 VanDerWaalsContact CB-ND2 3.34Å; Y171-N271 WeakPolarHBondContact CB-ND2 3.28Å; Y171-N271 HydrophobicContact CD2-CB 4Å; Y171-N271 VanDerWaalsContact CD2-CG 3.45Å; Y171-N271 WeakPolarHBondContact CD2-OD1 3.43Å; Y171-L272 HydrophobicContact CE2-CB 4.39Å; Y171-L272 HydrophobicContact CE2-CD1 4.24Å; Y171-N275 PolarHBondContact OH-ND2 2.98Å
172	S	87	Confident	93.8	Very high	20 Å²	20	50.9 Å²	50.9	14%	0.14	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-67.3	-15.3	166.8	-69.9	0	0	0	0	112.6	G169 E170 L174	G169-S172 WeakPolarHBondContact O-CB 3.35Å; G169-S172 PolarHBondContact O-N 3.45Å; G169-S172 PolarHBondContact O-OG 3.45Å; E170-S172 PolarHBondContact O-N 2.84Å; S172-L174 VanDerWaalsContact C-N 3.27Å; S172-L174 PolarHBondContact O-N 3.21Å
173	S	86.2	Confident	93.6	Very high	21 Å²	21	55.7 Å²	55.7	15%	0.147	30%	0.296	C	S	.	.			trans	55.2	42	178.3	-66.8	0	0	0	0	112.5	L125 M130 Y171	L125-S173 WeakPolarHBondContact CD1-O 3.43Å; L125-S173 PolarHBondContact O-OG 3.49Å; M130-S173 WeakPolarHBondContact CE-OG 3.18Å; Y171-S173 PolarHBondContact O-N 3Å
174	L	90	Very high	93.4	Very high	85 Å²	85	59.4 Å²	59.4	45%	0.445	31%	0.313	S	S	.	.			trans	-106.5	91	178	-66	179.6	0	0	0	108.6	S172 L186 I188	S172-L174 VanDerWaalsContact C-N 3.27Å; S172-L174 PolarHBondContact O-N 3.21Å; L174-L186 HydrophobicContact CB-CB 3.93Å; L174-L186 HydrophobicContact CB-CD1 4.34Å; L174-L186 PolarHBondContact O-N 2.86Å; L174-I188 HydrophobicContact CD1-CD1 4.1Å; L174-I188 HydrophobicContact CD1-CG1 3.79Å
175	E	92.2	Very high	93.3	Very high	96 Å²	96	63.2 Å²	63.2	45%	0.449	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.1	178.9	-56.2	-172.4	172	0	0	110	L125 E184 C185	L125-E175 HydrophobicContact CD1-CB 3.91Å; L125-E175 HydrophobicContact CD1-CG 4.39Å; E175-E184 VanDerWaalsContact CA-O 3.26Å; E175-E184 WeakPolarHBondContact CA-O 3.11Å; E175-C185 HydrophobicContact CG-CB 4.3Å
176	H	91.9	Very high	93.1	Very high	86 Å²	86	66.9 Å²	66.9	40%	0.398	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	156.2	173.7	66.2	-70.2	0	0	0	111.1	E184	H176-E184 IonicContact CE1-OE2 2.63Å; H176-E184 PolarHBondContact CE1-OE2 3.44Å; H176-E184 PolarHBondContact N-O 3.11Å; H176-E184 VanDerWaalsContact N-O 3.11Å; H176-E184 IonicContact NE2-OE2 3.52Å; H176-E184 PolarHBondContact NE2-OE2 3.4Å; H176-E184 PolarHBondContact O-N 3.19Å
177	E	94.6	Very high	93.2	Very high	113 Å²	113	68.7 Å²	68.7	53%	0.528	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	103.1	173.6	-174	171.2	-158.1	0	0	108.8	A179 R180 G181 V182 I183	E177-A179 WeakPolarHBondContact CG-O 3.44Å; E177-R180 VanDerWaalsContact OE1-CA 3.3Å; E177-R180 WeakPolarHBondContact OE1-CA 3.48Å; E177-G181 PolarHBondContact OE1-N 3.14Å; E177-V182 CarbonylContact C-O 3.58Å; E177-V182 VanDerWaalsContact CA-O 3.28Å; E177-V182 WeakPolarHBondContact CA-O 3.47Å; E177-I183 HydrophobicContact CB-CD1 3.62Å; E177-I183 HydrophobicContact CG-CD1 3.77Å
178	S	95.6	Very high	93.4	Very high	60 Å²	60	71.5 Å²	71.5	42%	0.42	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-28.2	-177	59.8	0	0	0	0	112.5	V182 E184	S178-V182 PolarHBondContact N-O 3.31Å; S178-E184 WeakPolarHBondContact CB-OE1 3.37Å; S178-E184 PolarHBondContact OG-OE1 3.46Å
179	A	96.5	Very high	93.5	Very high	55 Å²	55	72.5 Å²	72.5	46%	0.455	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	160	167.8	0	0	0	0	0	109.3	E177 G181 V182	E177-A179 WeakPolarHBondContact CG-O 3.44Å; A179-G181 PolarHBondContact O-N 3.47Å; A179-V182 HydrophobicContact CB-CB 4.24Å; A179-V182 HydrophobicContact CB-CG2 4.14Å; A179-V182 WeakPolarHBondContact O-CA 3.5Å; A179-V182 WeakPolarHBondContact O-CB 3.32Å; A179-V182 PolarHBondContact O-N 2.81Å
180	R	95.7	Very high	93.7	Very high	246 Å²	246	74.9 Å²	74.9	93%	0.928	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	117.4	-179.6	-175.5	178.9	177.7	178.6	-0.3	111.2	E177	E177-R180 VanDerWaalsContact OE1-CA 3.3Å; E177-R180 WeakPolarHBondContact OE1-CA 3.48Å
181	G	95.9	Very high	94	Very high	67 Å²	67	76.5 Å²	76.5	69%	0.691	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	5.9	-177	0	0	0	0	0	115.4	E177 A179	E177-G181 PolarHBondContact OE1-N 3.14Å; A179-G181 PolarHBondContact O-N 3.47Å
182	V	96.7	Very high	94.6	Very high	71 Å²	71	77 Å²	77	43%	0.43	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	102.9	-179.6	-176	0	0	0	0	109.2	E177 S178 A179	E177-V182 CarbonylContact C-O 3.58Å; E177-V182 VanDerWaalsContact CA-O 3.28Å; E177-V182 WeakPolarHBondContact CA-O 3.47Å; S178-V182 PolarHBondContact N-O 3.31Å; A179-V182 HydrophobicContact CB-CB 4.24Å; A179-V182 HydrophobicContact CB-CG2 4.14Å; A179-V182 WeakPolarHBondContact O-CA 3.5Å; A179-V182 WeakPolarHBondContact O-CB 3.32Å; A179-V182 PolarHBondContact O-N 2.81Å
183	I	95	Very high	95.2	Very high	101 Å²	101	78.7 Å²	78.7	52%	0.518	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.4	179	-52.4	-58	0	0	0	109.6	E177	E177-I183 HydrophobicContact CB-CD1 3.62Å; E177-I183 HydrophobicContact CG-CD1 3.77Å
184	E	95.1	Very high	95.8	Very high	79 Å²	79	77.8 Å²	77.8	37%	0.369	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.7	173.5	-68.8	-179.9	-160.2	0	0	109.9	E175 H176 S178	E175-E184 VanDerWaalsContact CA-O 3.26Å; E175-E184 WeakPolarHBondContact CA-O 3.11Å; H176-E184 IonicContact CE1-OE2 2.63Å; H176-E184 PolarHBondContact CE1-OE2 3.44Å; H176-E184 PolarHBondContact N-O 3.11Å; H176-E184 VanDerWaalsContact N-O 3.11Å; H176-E184 IonicContact NE2-OE2 3.52Å; H176-E184 PolarHBondContact NE2-OE2 3.4Å; H176-E184 PolarHBondContact O-N 3.19Å; S178-E184 WeakPolarHBondContact CB-OE1 3.37Å; S178-E184 PolarHBondContact OG-OE1 3.46Å
185	C	94.3	Very high	96.2	Very high	85 Å²	85	77 Å²	77	57%	0.574	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	115.2	174.5	-58.5	0	0	0	0	109.3	E175	E175-C185 HydrophobicContact CG-CB 4.3Å
186	L	95.1	Very high	96.5	Very high	82 Å²	82	75.3 Å²	75.3	43%	0.429	40%	0.404	S	S	.	.			trans	-92.7	114.1	-176.6	-59.2	174.4	0	0	0	110.8	L174 I188	L174-L186 HydrophobicContact CB-CB 3.93Å; L174-L186 HydrophobicContact CB-CD1 4.34Å; L174-L186 PolarHBondContact O-N 2.86Å; L186-I188 HydrophobicContact CB-CD1 4.44Å
187	K	95.6	Very high	96.8	Very high	50 Å²	50	71.2 Å²	71.2	22%	0.217	39%	0.385	C	S	.	.			trans	-85.9	119.1	170.1	177.7	-178.4	179.5	159.2	0	110.1	E170 V189 M222 D226 Y273	E170-K187 HydrophobicContact CG-CB 4.46Å; E170-K187 HydrophobicContact CG-CD 4.29Å; E170-K187 HydrophobicContact CG-CG 4.28Å; E170-K187 VanDerWaalsContact OE1-CD 3.29Å; E170-K187 WeakPolarHBondContact OE1-CD 3.47Å; E170-K187 VanDerWaalsContact OE1-CE 3.24Å; E170-K187 WeakPolarHBondContact OE1-CE 3.4Å; E170-K187 IonicContact OE1-NZ 3.71Å; E170-K187 PolarHBondContact OE1-NZ 3.16Å; K187-V189 HydrophobicContact CD-CG2 4.35Å; K187-V189 HydrophobicContact CG-CG2 4.11Å; K187-M222 HydrophobicContact CD-SD 3.98Å; K187-D226 WeakPolarHBondContact CE-OD1 3.43Å; K187-D226 IonicContact NZ-OD1 2.84Å; K187-D226 PolarHBondContact NZ-OD1 3.04Å; K187-Y273 PolarHBondContact NZ-OH 2.73Å
188	I	97.1	Very high	97	Very high	64 Å²	64	65.8 Å²	65.8	33%	0.328	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-103.1	122	177.6	-51.4	-56.3	0	0	0	109.7	E168 G169 L174 L186 T190	E168-I188 WeakPolarHBondContact CB-O 3.44Å; G169-I188 VanDerWaalsContact CA-O 3.24Å; G169-I188 WeakPolarHBondContact CA-O 3.37Å; G169-I188 PolarHBondContact N-O 2.76Å; G169-I188 PolarHBondContact O-N 3.08Å; L174-I188 HydrophobicContact CD1-CD1 4.1Å; L174-I188 HydrophobicContact CD1-CG1 3.79Å; L186-I188 HydrophobicContact CB-CD1 4.44Å; I188-T190 HydrophobicContact CG2-CG2 4.19Å
189	V	97.9	Very high	97.2	Very high	28 Å²	28	67.5 Å²	67.5	17%	0.17	36%	0.359	C	S	.	.			trans	-125.6	128.5	173.5	-175.8	0	0	0	0	108.4	E168 K187 F229	E168-V189 WeakPolarHBondContact OE1-CA 3.44Å; K187-V189 HydrophobicContact CD-CG2 4.35Å; K187-V189 HydrophobicContact CG-CG2 4.11Å; V189-F229 HydrophobicContact CG1-CB 4.39Å
190	T	98.4	Very high	97.3	Very high	51 Å²	51	66.9 Å²	66.9	31%	0.313	35%	0.347	S	S	.	.			trans	-120.3	145.7	-178.9	66.3	0	0	0	0	111	E168 I188 A192 K193 S194	E168-T190 VanDerWaalsContact CD-N 3.31Å; E168-T190 PolarHBondContact OE1-N 2.63Å; E168-T190 WeakPolarHBondContact OE2-CB 3.46Å; E168-T190 VanDerWaalsContact OE2-CG2 3.31Å; E168-T190 WeakPolarHBondContact OE2-CG2 3.25Å; E168-T190 PolarHBondContact OE2-N 3.39Å; E168-T190 VanDerWaalsContact OE2-N 3.11Å; E168-T190 PolarHBondContact OE2-OG1 2.93Å; I188-T190 HydrophobicContact CG2-CG2 4.19Å; T190-A192 VanDerWaalsContact C-N 3.31Å; T190-A192 PolarHBondContact O-N 2.91Å; T190-K193 PolarHBondContact O-N 3.32Å; T190-K193 WeakPolarHBondContact OG1-CB 3.38Å; T190-K193 WeakPolarHBondContact OG1-CG 3.48Å; T190-K193 PolarHBondContact OG1-N 3.44Å; T190-S194 WeakPolarHBondContact O-CB 3.13Å; T190-S194 PolarHBondContact O-N 2.86Å; T190-S194 PolarHBondContact O-OG 3.29Å
191	R	98.6	Very high	97.4	Very high	87 Å²	87	55.2 Å²	55.2	33%	0.328	30%	0.302	S	S	.	.	H	α-helix	trans	-58.4	-43.8	177.8	177.7	168.2	-75.3	-90.6	2.8	111.7	K193 S194 Q195 L228 Q231 E235	R191-K193 PolarHBondContact O-N 3.03Å; R191-S194 PolarHBondContact O-N 2.71Å; R191-Q195 HydrophobicContact CG-CG 4.16Å; R191-Q195 WeakPolarHBondContact O-CB 3.43Å; R191-Q195 WeakPolarHBondContact O-CG 3.35Å; R191-Q195 PolarHBondContact O-N 3.37Å; R191-L228 HydrophobicContact CB-CD1 4.25Å; R191-L228 HydrophobicContact CB-CD2 4.46Å; R191-Q231 VanDerWaalsContact NH2-CD 3.3Å; R191-E235 IonicContact CZ-OE1 3.69Å; R191-E235 IonicContact NH1-OE1 2.85Å; R191-E235 PolarHBondContact NH1-OE1 3.38Å; R191-E235 IonicContact NH1-OE2 2.75Å; R191-E235 PolarHBondContact NH1-OE2 3.05Å; R191-E235 IonicContact NH2-OE1 3.59Å
192	A	98.4	Very high	97.6	Very high	70 Å²	70	52 Å²	52	58%	0.579	27%	0.269	S	S	*	.	H	α-helix	trans	-60	-46.2	-178	0	0	0	0	0	112.3	T190 R196	T190-A192 VanDerWaalsContact C-N 3.31Å; T190-A192 PolarHBondContact O-N 2.91Å; A192-R196 PolarHBondContact O-N 3.19Å; A192-R196 VanDerWaalsContact O-N 3.12Å
193	K	98.3	Very high	97.6	Very high	56 Å²	56	51.6 Å²	51.6	24%	0.243	27%	0.265	C	S	.	.	H	α-helix	trans	-74.5	-33.4	-179.5	-68.5	178.2	161.5	-170.2	0	112.4	T167 E168 T190 R191 R196 I197	T167-K193 PolarHBondContact O-NZ 2.81Å; T167-K193 WeakPolarHBondContact OG1-CD 3.48Å; T167-K193 WeakPolarHBondContact OG1-CE 3.3Å; T167-K193 PolarHBondContact OG1-NZ 3.27Å; T167-K193 VanDerWaalsContact OG1-NZ 3.09Å; E168-K193 HydrophobicContact CB-CD 4Å; E168-K193 HydrophobicContact CG-CB 4.2Å; E168-K193 HydrophobicContact CG-CD 3.8Å; E168-K193 WeakPolarHBondContact OE1-CB 3.39Å; E168-K193 WeakPolarHBondContact OE2-CD 3.12Å; T190-K193 PolarHBondContact O-N 3.32Å; T190-K193 WeakPolarHBondContact OG1-CB 3.38Å; T190-K193 WeakPolarHBondContact OG1-CG 3.48Å; T190-K193 PolarHBondContact OG1-N 3.44Å; R191-K193 PolarHBondContact O-N 3.03Å; K193-R196 VanDerWaalsContact O-CG 3.25Å; K193-R196 WeakPolarHBondContact O-CG 3.4Å; K193-I197 WeakPolarHBondContact O-CG2 3.3Å; K193-I197 PolarHBondContact O-N 2.91Å
194	S	98.7	Very high	97.8	Very high	1 Å²	1	48 Å²	48	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-44.7	173.2	-62.6	0	0	0	0	112.7	T190 R191 I197 A198	T190-S194 WeakPolarHBondContact O-CB 3.13Å; T190-S194 PolarHBondContact O-N 2.86Å; T190-S194 PolarHBondContact O-OG 3.29Å; R191-S194 PolarHBondContact O-N 2.71Å; S194-I197 VanDerWaalsContact O-CG2 3.29Å; S194-I197 WeakPolarHBondContact O-CG2 3.47Å; S194-A198 WeakPolarHBondContact O-CB 3.35Å; S194-A198 PolarHBondContact O-N 3.49Å; S194-A198 VanDerWaalsContact O-N 3.09Å
195	Q	98.6	Very high	98	Very high	70 Å²	70	44.2 Å²	44.2	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-65.8	-41.4	177.8	-75.6	179.1	-26.9	0	0	111.9	R191 A198 K199 C232 E235	R191-Q195 HydrophobicContact CG-CG 4.16Å; R191-Q195 WeakPolarHBondContact O-CB 3.43Å; R191-Q195 WeakPolarHBondContact O-CG 3.35Å; R191-Q195 PolarHBondContact O-N 3.37Å; Q195-A198 PolarHBondContact O-N 2.79Å; Q195-K199 WeakPolarHBondContact O-CB 3.49Å; Q195-K199 PolarHBondContact O-N 2.98Å; Q195-C232 HydrophobicContact CG-CB 3.71Å; Q195-E235 PolarHBondContact NE2-OE2 3.36Å
196	R	98.5	Very high	98.2	Very high	59 Å²	59	43.9 Å²	43.9	22%	0.223	22%	0.223	C	C	.	.	H	α-helix	trans	-66.5	-40.2	179.7	74.4	-177.8	178.7	172.5	0.7	112.9	D137 F139 T167 A192 K193 K199 F200	D137-R196 VanDerWaalsContact CG-NH1 3.27Å; D137-R196 IonicContact OD1-CZ 2.75Å; D137-R196 IonicContact OD1-NH1 3.38Å; D137-R196 PolarHBondContact OD1-NH1 3.33Å; D137-R196 IonicContact OD1-NH2 3.21Å; D137-R196 PolarHBondContact OD1-NH2 2.9Å; D137-R196 IonicContact OD2-CZ 3.58Å; D137-R196 IonicContact OD2-NH1 3.59Å; D137-R196 PolarHBondContact OD2-NH1 3.37Å; D137-R196 IonicContact OD2-NH2 3.71Å; F139-R196 HydrophobicContact CD2-CG 3.9Å; F139-R196 HydrophobicContact CE2-CB 4.49Å; F139-R196 HydrophobicContact CE2-CG 4.11Å; F139-R196 HydrophobicContact CG-CG 4.46Å; T167-R196 PolarHBondContact OG1-NH2 2.97Å; A192-R196 PolarHBondContact O-N 3.19Å; A192-R196 VanDerWaalsContact O-N 3.12Å; K193-R196 VanDerWaalsContact O-CG 3.25Å; K193-R196 WeakPolarHBondContact O-CG 3.4Å; R196-K199 PolarHBondContact O-N 3.49Å; R196-F200 WeakPolarHBondContact O-CB 3.14Å; R196-F200 PolarHBondContact O-N 2.57Å
197	I	98.8	Very high	98.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-71.6	-37.8	179.3	-168.7	63.3	0	0	0	111.1	F139 A140 I163 E165 K193 S194 F200 A201 F229 V268	F139-I197 HydrophobicContact CD2-CD1 4.2Å; F139-I197 HydrophobicContact CE2-CD1 4.42Å; A140-I197 HydrophobicContact CB-CD1 3.52Å; I163-I197 HydrophobicContact CG2-CD1 3.61Å; I163-I197 HydrophobicContact CG2-CG1 4.15Å; E165-I197 HydrophobicContact CB-CB 4.36Å; E165-I197 HydrophobicContact CB-CG1 4.11Å; E165-I197 HydrophobicContact CB-CG2 4.17Å; E165-I197 HydrophobicContact CG-CB 4.3Å; E165-I197 HydrophobicContact CG-CG2 4.12Å; K193-I197 WeakPolarHBondContact O-CG2 3.3Å; K193-I197 PolarHBondContact O-N 2.91Å; S194-I197 VanDerWaalsContact O-CG2 3.29Å; S194-I197 WeakPolarHBondContact O-CG2 3.47Å; I197-F200 PolarHBondContact O-N 3.09Å; I197-A201 PolarHBondContact O-N 2.89Å; I197-F229 HydrophobicContact CG2-CE2 3.97Å; I197-V268 HydrophobicContact CG1-CG2 4.08Å
198	A	98.8	Very high	98.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-50.6	171.9	0	0	0	0	0	110.7	S194 Q195 F200 A201 F202 C233 V236	S194-A198 WeakPolarHBondContact O-CB 3.35Å; S194-A198 PolarHBondContact O-N 3.49Å; S194-A198 VanDerWaalsContact O-N 3.09Å; Q195-A198 PolarHBondContact O-N 2.79Å; A198-F200 VanDerWaalsContact C-N 3.33Å; A198-F200 PolarHBondContact O-N 3.23Å; A198-A201 WeakPolarHBondContact O-CB 3.49Å; A198-A201 PolarHBondContact O-N 2.86Å; A198-A201 VanDerWaalsContact O-N 3.07Å; A198-F202 VanDerWaalsContact O-CD2 3.31Å; A198-F202 WeakPolarHBondContact O-CD2 3.37Å; A198-F202 PolarHBondContact O-N 3.04Å; A198-F202 VanDerWaalsContact O-N 3.07Å; A198-C233 HydrophobicContact CB-CB 4.42Å; A198-V236 HydrophobicContact CB-CB 4.12Å; A198-V236 HydrophobicContact CB-CG1 4.31Å; A198-V236 HydrophobicContact CB-CG2 4.06Å
199	K	98.8	Very high	98.4	Very high	96 Å²	96	51.5 Å²	51.5	42%	0.417	27%	0.27	S	S	.	.	H	α-helix	trans	-58.1	-45.6	177.8	-171.2	-176.5	-174.9	-60.8	0	111.8	Q195 R196 A201 F202 D203 V236	Q195-K199 WeakPolarHBondContact O-CB 3.49Å; Q195-K199 PolarHBondContact O-N 2.98Å; R196-K199 PolarHBondContact O-N 3.49Å; K199-A201 VanDerWaalsContact C-N 3.28Å; K199-A201 PolarHBondContact O-N 3.25Å; K199-F202 PolarHBondContact O-N 2.89Å; K199-D203 IonicContact NZ-OD1 3.76Å; K199-D203 IonicContact NZ-OD2 2.73Å; K199-D203 PolarHBondContact NZ-OD2 2.94Å; K199-D203 WeakPolarHBondContact O-CB 3.44Å; K199-D203 PolarHBondContact O-N 2.88Å; K199-V236 HydrophobicContact CB-CG1 4.25Å
200	F	98.8	Very high	98.4	Very high	42 Å²	42	52.4 Å²	52.4	18%	0.184	27%	0.27	C	S	.	.	H	α-helix	trans	-56.7	-43	175.5	-179.1	-83.3	0	0	0	111.7	F139 A140 V142 I163 R196 I197 A198 D203 Y204 Y296	F139-F200 HydrophobicContact CE2-CB 3.95Å; F139-F200 HydrophobicContact CE2-CD2 4.17Å; F139-F200 HydrophobicContact CE2-CG 4.19Å; F139-F200 HydrophobicContact CZ-CB 4.38Å; F139-F200 AromaticContact CZ-CD2 3.95Å; F139-F200 HydrophobicContact CZ-CD2 3.95Å; F139-F200 HydrophobicContact CZ-CG 4.42Å; A140-F200 HydrophobicContact CB-CD1 3.73Å; A140-F200 HydrophobicContact CB-CD2 4.09Å; A140-F200 HydrophobicContact CB-CE1 3.76Å; A140-F200 HydrophobicContact CB-CE2 4.09Å; A140-F200 HydrophobicContact CB-CG 3.91Å; A140-F200 HydrophobicContact CB-CZ 3.93Å; V142-F200 HydrophobicContact CG2-CE1 3.57Å; V142-F200 HydrophobicContact CG2-CZ 3.89Å; I163-F200 HydrophobicContact CD1-CD1 4.26Å; I163-F200 HydrophobicContact CD1-CE1 4.25Å; I163-F200 HydrophobicContact CG2-CD1 3.9Å; I163-F200 HydrophobicContact CG2-CE1 4.28Å; R196-F200 WeakPolarHBondContact O-CB 3.14Å; R196-F200 PolarHBondContact O-N 2.57Å; I197-F200 PolarHBondContact O-N 3.09Å; A198-F200 VanDerWaalsContact C-N 3.33Å; A198-F200 PolarHBondContact O-N 3.23Å; F200-D203 PolarHBondContact O-N 3.32Å; F200-Y204 WeakPolarHBondContact O-CB 3.33Å; F200-Y204 PolarHBondContact O-N 3.43Å; F200-Y296 HydrophobicContact CE2-CD2 4.32Å; F200-Y296 HydrophobicContact CE2-CG 4.31Å; F200-Y296 AromaticContact CZ-CD2 3.71Å; F200-Y296 HydrophobicContact CZ-CD2 3.71Å; F200-Y296 HydrophobicContact CZ-CE2 4.38Å; F200-Y296 HydrophobicContact CZ-CG 4.16Å
201	A	98.8	Very high	98.4	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-41.6	179	0	0	0	0	0	113.2	I163 I197 A198 K199 Y204 A205 V266 V268	I163-A201 HydrophobicContact CB-CB 4.41Å; I163-A201 HydrophobicContact CD1-CB 3.83Å; I163-A201 HydrophobicContact CG2-CB 4.22Å; I197-A201 PolarHBondContact O-N 2.89Å; A198-A201 WeakPolarHBondContact O-CB 3.49Å; A198-A201 PolarHBondContact O-N 2.86Å; A198-A201 VanDerWaalsContact O-N 3.07Å; K199-A201 VanDerWaalsContact C-N 3.28Å; K199-A201 PolarHBondContact O-N 3.25Å; A201-Y204 PolarHBondContact O-N 3.27Å; A201-A205 WeakPolarHBondContact O-CB 3.33Å; A201-A205 PolarHBondContact O-N 2.68Å; A201-V266 HydrophobicContact CB-CG1 4.49Å; A201-V268 HydrophobicContact CB-CB 3.77Å; A201-V268 HydrophobicContact CB-CG1 4.37Å; A201-V268 HydrophobicContact CB-CG2 3.8Å
202	F	98.8	Very high	98.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.8	-39.5	176.3	-81.4	-81.1	0	0	0	113.1	A198 K199 Y204 A205 T206 V213 V236 A237 Y240 I243 F245	A198-F202 VanDerWaalsContact O-CD2 3.31Å; A198-F202 WeakPolarHBondContact O-CD2 3.37Å; A198-F202 PolarHBondContact O-N 3.04Å; A198-F202 VanDerWaalsContact O-N 3.07Å; K199-F202 PolarHBondContact O-N 2.89Å; F202-Y204 VanDerWaalsContact C-N 3.33Å; F202-A205 PolarHBondContact O-N 3.16Å; F202-T206 WeakPolarHBondContact O-CB 3.37Å; F202-T206 PolarHBondContact O-N 3.33Å; F202-T206 PolarHBondContact O-OG1 2.8Å; F202-V213 HydrophobicContact CD1-CB 4.48Å; F202-V213 HydrophobicContact CD1-CG2 4.09Å; F202-V213 HydrophobicContact CE1-CB 4.05Å; F202-V213 HydrophobicContact CE1-CG2 4.15Å; F202-V213 HydrophobicContact CE2-CG1 4.14Å; F202-V213 HydrophobicContact CG-CG2 4.45Å; F202-V213 HydrophobicContact CZ-CB 4.07Å; F202-V213 HydrophobicContact CZ-CG1 4.12Å; F202-V236 HydrophobicContact CD2-CG1 3.65Å; F202-V236 HydrophobicContact CE2-CG1 4.21Å; F202-V236 HydrophobicContact CG-CG1 4.34Å; F202-A237 HydrophobicContact CE1-CB 4.12Å; F202-A237 HydrophobicContact CE2-CB 4.03Å; F202-A237 HydrophobicContact CZ-CB 3.43Å; F202-A237 VanDerWaalsContact CZ-CB 3.43Å; F202-Y240 HydrophobicContact CB-CD1 3.85Å; F202-Y240 HydrophobicContact CB-CD2 3.57Å; F202-Y240 HydrophobicContact CB-CE1 3.85Å; F202-Y240 HydrophobicContact CB-CE2 3.61Å; F202-Y240 HydrophobicContact CB-CG 3.71Å; F202-Y240 AromaticContact CD1-CD2 3.97Å; F202-Y240 HydrophobicContact CD1-CD2 3.97Å; F202-Y240 AromaticContact CD1-CG 3.81Å; F202-Y240 HydrophobicContact CD1-CG 3.81Å; F202-Y240 AromaticContact CG-CD2 3.79Å; F202-Y240 HydrophobicContact CG-CD2 3.79Å; F202-Y240 HydrophobicContact CG-CE2 4.23Å; F202-Y240 HydrophobicContact CG-CG 4.01Å; F202-I243 HydrophobicContact CD1-CB 3.95Å; F202-I243 HydrophobicContact CD1-CG1 4.29Å; F202-I243 HydrophobicContact CD1-CG2 3.8Å; F202-I243 HydrophobicContact CE1-CB 3.99Å; F202-I243 HydrophobicContact CE1-CG2 3.69Å; F202-F245 HydrophobicContact CE2-CD2 4.24Å; F202-F245 HydrophobicContact CZ-CB 4.26Å; F202-F245 AromaticContact CZ-CD2 3.58Å; F202-F245 HydrophobicContact CZ-CD2 3.58Å; F202-F245 HydrophobicContact CZ-CE2 4.26Å; F202-F245 HydrophobicContact CZ-CG 4.19Å
203	D	98.6	Very high	98.4	Very high	63 Å²	63	45.9 Å²	45.9	34%	0.337	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-43.8	172.7	-75.1	-24.6	0	0	0	110.9	K199 F200 T206 K207 Y240	K199-D203 IonicContact NZ-OD1 3.76Å; K199-D203 IonicContact NZ-OD2 2.73Å; K199-D203 PolarHBondContact NZ-OD2 2.94Å; K199-D203 WeakPolarHBondContact O-CB 3.44Å; K199-D203 PolarHBondContact O-N 2.88Å; F200-D203 PolarHBondContact O-N 3.32Å; D203-T206 PolarHBondContact O-N 3.35Å; D203-K207 VanDerWaalsContact O-CB 3.29Å; D203-K207 WeakPolarHBondContact O-CB 3.33Å; D203-K207 PolarHBondContact O-N 3.14Å; D203-Y240 WeakPolarHBondContact OD1-CE1 3.5Å; D203-Y240 PolarHBondContact OD1-OH 3.43Å
204	Y	98.5	Very high	98.5	Very high	24 Å²	24	43.2 Å²	43.2	9%	0.094	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-50.3	175.2	-179.8	-81.3	0	0	0	110.9	V142 H144 V161 I163 F200 A201 F202 T206 K207 K208 V266	V142-Y204 HydrophobicContact CG1-CE2 3.87Å; H144-Y204 PolarHBondContact CE1-OH 2.95Å; V161-Y204 HydrophobicContact CB-CE1 4.18Å; V161-Y204 HydrophobicContact CG1-CE1 3.79Å; V161-Y204 HydrophobicContact CG2-CE1 4.02Å; I163-Y204 HydrophobicContact CD1-CD1 4Å; I163-Y204 HydrophobicContact CD1-CG 3.9Å; F200-Y204 WeakPolarHBondContact O-CB 3.33Å; F200-Y204 PolarHBondContact O-N 3.43Å; A201-Y204 PolarHBondContact O-N 3.27Å; F202-Y204 VanDerWaalsContact C-N 3.33Å; Y204-T206 VanDerWaalsContact C-N 3.3Å; Y204-T206 PolarHBondContact O-N 3.17Å; Y204-K207 PolarHBondContact O-N 2.6Å; Y204-K208 HydrophobicContact CD1-CG 4.23Å; Y204-K208 HydrophobicContact CD2-CG 4.41Å; Y204-K208 HydrophobicContact CE1-CB 4.21Å; Y204-K208 HydrophobicContact CE1-CG 3.86Å; Y204-K208 HydrophobicContact CE2-CG 4.11Å; Y204-K208 HydrophobicContact CG-CG 4.47Å; Y204-K208 WeakPolarHBondContact O-CB 3.41Å; Y204-K208 WeakPolarHBondContact O-CG 3.19Å; Y204-K208 PolarHBondContact O-N 3.49Å; Y204-V266 HydrophobicContact CD1-CG2 4.3Å; Y204-V266 HydrophobicContact CE1-CG2 4.48Å
205	A	98.7	Very high	98.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57	-46.7	179.2	0	0	0	0	0	110.9	A201 F202 K208 G209 R210 V213 I243 V266	A201-A205 WeakPolarHBondContact O-CB 3.33Å; A201-A205 PolarHBondContact O-N 2.68Å; F202-A205 PolarHBondContact O-N 3.16Å; A205-K208 PolarHBondContact O-N 3.32Å; A205-G209 PolarHBondContact O-N 3.38Å; A205-R210 HydrophobicContact CB-CB 3.98Å; A205-R210 PolarHBondContact O-N 3.5Å; A205-V213 HydrophobicContact CB-CG2 3.77Å; A205-I243 HydrophobicContact CB-CD1 4.17Å; A205-V266 HydrophobicContact CB-CG2 4.15Å
206	T	98.3	Very high	98.5	Very high	78 Å²	78	39.9 Å²	39.9	48%	0.479	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-50.8	177.3	-55.4	0	0	0	0	111.7	F202 D203 Y204 K208 G209	F202-T206 WeakPolarHBondContact O-CB 3.37Å; F202-T206 PolarHBondContact O-N 3.33Å; F202-T206 PolarHBondContact O-OG1 2.8Å; D203-T206 PolarHBondContact O-N 3.35Å; Y204-T206 VanDerWaalsContact C-N 3.3Å; Y204-T206 PolarHBondContact O-N 3.17Å; T206-K208 VanDerWaalsContact C-N 3.28Å; T206-K208 PolarHBondContact O-N 2.77Å; T206-G209 PolarHBondContact O-N 3.06Å
207	K	97.4	Very high	98.5	Very high	180 Å²	180	37.7 Å²	37.7	78%	0.783	20%	0.204	S	C	*	.	H	α-helix	trans	-64.3	-31.8	-177.7	-175.9	175	-178.9	177.8	0	112.7	D203 Y204	D203-K207 VanDerWaalsContact O-CB 3.29Å; D203-K207 WeakPolarHBondContact O-CB 3.33Å; D203-K207 PolarHBondContact O-N 3.14Å; Y204-K207 PolarHBondContact O-N 2.6Å
208	K	97.3	Very high	98.4	Very high	106 Å²	106	39.2 Å²	39.2	46%	0.461	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	6.4	-178.9	-62.8	-61.6	-173.4	176.6	0	113.5	Y204 A205 T206 R210	Y204-K208 HydrophobicContact CD1-CG 4.23Å; Y204-K208 HydrophobicContact CD2-CG 4.41Å; Y204-K208 HydrophobicContact CE1-CB 4.21Å; Y204-K208 HydrophobicContact CE1-CG 3.86Å; Y204-K208 HydrophobicContact CE2-CG 4.11Å; Y204-K208 HydrophobicContact CG-CG 4.47Å; Y204-K208 WeakPolarHBondContact O-CB 3.41Å; Y204-K208 WeakPolarHBondContact O-CG 3.19Å; Y204-K208 PolarHBondContact O-N 3.49Å; A205-K208 PolarHBondContact O-N 3.32Å; T206-K208 VanDerWaalsContact C-N 3.28Å; T206-K208 PolarHBondContact O-N 2.77Å; K208-R210 VanDerWaalsContact C-N 3.27Å; K208-R210 HydrophobicContact CB-CG 4.16Å; K208-R210 PolarHBondContact O-N 2.88Å
209	G	97.6	Very high	98.3	Very high	70 Å²	70	40 Å²	40	72%	0.722	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	31.3	178.9	0	0	0	0	0	113.6	A205 T206	A205-G209 PolarHBondContact O-N 3.38Å; T206-G209 PolarHBondContact O-N 3.06Å
210	R	98.4	Very high	98.1	Very high	48 Å²	48	39.4 Å²	39.4	18%	0.181	22%	0.219	C	C	.	.			trans	-81.5	150.8	174	-58.1	-48.7	-164	132.2	-9.3	110.2	D159 A205 K208 I243 D265 V266	D159-R210 PolarHBondContact O-NH1 3.38Å; D159-R210 IonicContact OD1-CZ 2.75Å; D159-R210 IonicContact OD1-NH1 2.71Å; D159-R210 IonicContact OD1-NH2 2.84Å; D159-R210 PolarHBondContact OD1-NH2 3.46Å; D159-R210 IonicContact OD2-NH2 2.94Å; A205-R210 HydrophobicContact CB-CB 3.98Å; A205-R210 PolarHBondContact O-N 3.5Å; K208-R210 VanDerWaalsContact C-N 3.27Å; K208-R210 HydrophobicContact CB-CG 4.16Å; K208-R210 PolarHBondContact O-N 2.88Å; R210-I243 WeakPolarHBondContact O-CD1 3.25Å; R210-D265 WeakPolarHBondContact CB-OD2 3.34Å; R210-D265 WeakPolarHBondContact CD-OD1 3.14Å; R210-D265 IonicContact CZ-OD1 2.79Å; R210-D265 IonicContact NE-OD1 3.47Å; R210-D265 IonicContact NH1-OD1 2.86Å; R210-D265 PolarHBondContact NH1-OD1 2.79Å; R210-V266 HydrophobicContact CB-CG2 3.9Å; R210-V266 HydrophobicContact CG-CG2 3.8Å
211	G	98.2	Very high	98.1	Very high	43 Å²	43	43.1 Å²	43.1	44%	0.443	24%	0.239	S	C	.	.			trans	-103.3	-16.7	-173.4	0	0	0	0	0	114.3	K244 D265	G211-K244 PolarHBondContact O-N 3.26Å; G211-D265 PolarHBondContact N-OD2 3.05Å
212	K	98.7	Very high	98	Very high	28 Å²	28	46 Å²	46	12%	0.122	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139	-172.2	-171.2	171.8	79.4	156	0	113.8	K244 E246 Q263 D265 V266	K212-K244 CarbonylContact C-O 3.56Å; K212-K244 VanDerWaalsContact CA-O 3.32Å; K212-K244 WeakPolarHBondContact CA-O 3.19Å; K212-K244 HydrophobicContact CB-CB 4.28Å; K212-K244 HydrophobicContact CD-CD 4Å; K212-K244 HydrophobicContact CD-CG 4.45Å; K212-K244 HydrophobicContact CG-CB 4.07Å; K212-K244 HydrophobicContact CG-CD 4.4Å; K212-K244 HydrophobicContact CG-CG 4.36Å; K212-K244 WeakPolarHBondContact CG-O 3.08Å; K212-E246 HydrophobicContact CD-CG 4.36Å; K212-E246 WeakPolarHBondContact CD-OE2 3.38Å; K212-E246 WeakPolarHBondContact CE-OE2 3.37Å; K212-E246 IonicContact NZ-OE1 3.61Å; K212-E246 IonicContact NZ-OE2 2.76Å; K212-E246 PolarHBondContact NZ-OE2 2.79Å; K212-Q263 WeakPolarHBondContact CE-O 3.34Å; K212-Q263 PolarHBondContact NZ-O 2.83Å; K212-D265 HydrophobicContact CB-CB 4.01Å; K212-D265 PolarHBondContact N-OD2 2.73Å; K212-D265 VanDerWaalsContact N-OD2 3.13Å; K212-V266 WeakPolarHBondContact O-CB 3.49Å; K212-V266 PolarHBondContact O-N 3.28Å
213	V	98.9	Very high	97.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.3	170.3	174.2	0	0	0	0	109.1	F202 A205 I243 K244 F245 E246 V266 V268	F202-V213 HydrophobicContact CD1-CB 4.48Å; F202-V213 HydrophobicContact CD1-CG2 4.09Å; F202-V213 HydrophobicContact CE1-CB 4.05Å; F202-V213 HydrophobicContact CE1-CG2 4.15Å; F202-V213 HydrophobicContact CE2-CG1 4.14Å; F202-V213 HydrophobicContact CG-CG2 4.45Å; F202-V213 HydrophobicContact CZ-CB 4.07Å; F202-V213 HydrophobicContact CZ-CG1 4.12Å; A205-V213 HydrophobicContact CB-CG2 3.77Å; V213-I243 HydrophobicContact CB-CG2 4.12Å; V213-I243 HydrophobicContact CG2-CG2 3.67Å; V213-K244 PolarHBondContact N-O 3.43Å; V213-F245 WeakPolarHBondContact O-CA 3.3Å; V213-E246 PolarHBondContact O-N 2.91Å; V213-V266 CarbonylContact C-O 3.42Å; V213-V266 VanDerWaalsContact CA-O 3.31Å; V213-V266 WeakPolarHBondContact CA-O 3.46Å; V213-V266 HydrophobicContact CG2-CB 4.07Å; V213-V266 HydrophobicContact CG2-CG1 4.27Å; V213-V268 HydrophobicContact CG1-CG1 3.83Å
214	T	98.9	Very high	97.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.5	176.3	-52.7	0	0	0	0	110.3	E246 M248 V266 L267 V268	T214-E246 CarbonylContact C-O 3.29Å; T214-E246 VanDerWaalsContact CA-O 3.27Å; T214-E246 WeakPolarHBondContact CA-O 3.49Å; T214-E246 HydrophobicContact CG2-CB 4.28Å; T214-M248 HydrophobicContact CG2-CB 3.94Å; T214-V266 PolarHBondContact N-O 3.16Å; T214-L267 CarbonylContact O-C 3.59Å; T214-L267 WeakPolarHBondContact O-CA 3.34Å; T214-V268 PolarHBondContact O-N 3.49Å
215	A	98.8	Very high	97.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.7	172.5	0	0	0	0	0	110.3	F229 L230 C233 F245 E246 T247 M248 V268	A215-F229 HydrophobicContact CB-CE1 4.37Å; A215-L230 HydrophobicContact CB-CD1 4.32Å; A215-C233 HydrophobicContact CB-CB 4.02Å; A215-F245 HydrophobicContact CB-CE2 3.75Å; A215-F245 HydrophobicContact CB-CZ 3.82Å; A215-E246 PolarHBondContact N-O 3.31Å; A215-T247 WeakPolarHBondContact O-CA 3.33Å; A215-M248 PolarHBondContact O-N 2.74Å; A215-V268 WeakPolarHBondContact CA-O 3.21Å; A215-V268 HydrophobicContact CB-CG1 4.15Å
216	V	98.8	Very high	97.7	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.8	179.4	-172.9	0	0	0	0	110.3	M248 I250 C253 L267 V268 M269 P270	V216-M248 VanDerWaalsContact CA-O 3.32Å; V216-M248 WeakPolarHBondContact CA-O 3.43Å; V216-I250 HydrophobicContact CG1-CB 3.93Å; V216-I250 HydrophobicContact CG1-CD1 3.64Å; V216-I250 HydrophobicContact CG1-CG1 4.38Å; V216-C253 HydrophobicContact CG1-CB 3.86Å; V216-C253 HydrophobicContact CG2-CB 4.39Å; V216-L267 HydrophobicContact CG2-CB 4.38Å; V216-L267 HydrophobicContact CG2-CD2 3.89Å; V216-V268 PolarHBondContact N-O 3.05Å; V216-M269 HydrophobicContact CB-CB 4Å; V216-M269 HydrophobicContact CB-CE 4.11Å; V216-M269 HydrophobicContact CB-SD 4.44Å; V216-M269 HydrophobicContact CG2-CE 3.87Å; V216-P270 WeakPolarHBondContact O-CD 3.38Å
217	H	98.4	Very high	97.7	Very high	14 Å²	14	55.4 Å²	55.4	7%	0.065	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	178.6	-170.7	65.9	104.1	0	0	0	112.3	A219 D226 M248 I249 I250	H217-A219 WeakPolarHBondContact ND1-CB 3.5Å; H217-A219 PolarHBondContact ND1-N 2.88Å; H217-A219 VanDerWaalsContact ND1-N 3.18Å; H217-D226 HydrophobicContact CB-CB 4.4Å; H217-M248 PolarHBondContact CD2-O 2.87Å; H217-M248 PolarHBondContact N-O 2.84Å; H217-M248 VanDerWaalsContact N-O 3.08Å; H217-I249 CarbonylContact O-C 3.51Å; H217-I249 WeakPolarHBondContact O-CA 3.48Å; H217-I250 PolarHBondContact O-N 3.03Å
218	K	97.7	Very high	97.8	Very high	31 Å²	31	48.8 Å²	48.8	14%	0.135	28%	0.277	C	S	.	.			trans	-135.3	41	171.3	-165.1	74	-173.8	-176.5	0	110.4	N220 I221 M222 D226 I250 D251	K218-N220 WeakPolarHBondContact CD-OD1 3.33Å; K218-N220 WeakPolarHBondContact CE-OD1 3.33Å; K218-N220 PolarHBondContact O-N 2.92Å; K218-N220 VanDerWaalsContact O-N 3.1Å; K218-N220 PolarHBondContact O-OD1 3.27Å; K218-I221 HydrophobicContact CG-CB 4.2Å; K218-I221 HydrophobicContact CG-CG1 4.24Å; K218-I221 PolarHBondContact O-N 2.69Å; K218-M222 HydrophobicContact CB-CE 3.7Å; K218-M222 HydrophobicContact CG-CE 4.02Å; K218-M222 PolarHBondContact O-N 3.04Å; K218-D226 WeakPolarHBondContact CA-OD2 3.46Å; K218-D226 WeakPolarHBondContact CB-OD2 3.5Å; K218-D226 PolarHBondContact N-OD2 2.93Å; K218-I250 HydrophobicContact CB-CG2 4.01Å; K218-I250 HydrophobicContact CD-CG2 3.64Å; K218-I250 HydrophobicContact CG-CG2 4.29Å; K218-D251 IonicContact NZ-OD1 3.18Å; K218-D251 PolarHBondContact NZ-OD1 3.49Å; K218-D251 IonicContact NZ-OD2 3.29Å; K218-D251 PolarHBondContact NZ-OD2 2.98Å
219	A	96.8	Very high	97.9	Very high	17 Å²	17	43.9 Å²	43.9	14%	0.14	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.9	-177	0	0	0	0	0	113.9	H217 I221 D226 L230	H217-A219 WeakPolarHBondContact ND1-CB 3.5Å; H217-A219 PolarHBondContact ND1-N 2.88Å; H217-A219 VanDerWaalsContact ND1-N 3.18Å; A219-I221 PolarHBondContact O-N 2.91Å; A219-D226 HydrophobicContact CB-CB 4.06Å; A219-L230 HydrophobicContact CB-CD2 4.33Å
220	N	95	Very high	97.9	Very high	84 Å²	84	41.6 Å²	41.6	45%	0.449	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.4	171.9	66.6	-36.1	0	0	0	113	K218	K218-N220 WeakPolarHBondContact CD-OD1 3.33Å; K218-N220 WeakPolarHBondContact CE-OD1 3.33Å; K218-N220 PolarHBondContact O-N 2.92Å; K218-N220 VanDerWaalsContact O-N 3.1Å; K218-N220 PolarHBondContact O-OD1 3.27Å
221	I	97.1	Very high	97.9	Very high	120 Å²	120	43.4 Å²	43.4	62%	0.615	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-53.8	174.1	-57.5	-59.8	0	0	0	110.1	K218 A219 K223	K218-I221 HydrophobicContact CG-CB 4.2Å; K218-I221 HydrophobicContact CG-CG1 4.24Å; K218-I221 PolarHBondContact O-N 2.69Å; A219-I221 PolarHBondContact O-N 2.91Å; I221-K223 PolarHBondContact O-N 2.86Å
222	M	96.9	Very high	98	Very high	59 Å²	59	41.4 Å²	41.4	29%	0.291	22%	0.216	S	C	.	.			trans	-91.5	72.9	-179.9	-76	167.2	-70.6	0	0	111.2	K187 K218 L224 D226 G227 Y273	K187-M222 HydrophobicContact CD-SD 3.98Å; K218-M222 HydrophobicContact CB-CE 3.7Å; K218-M222 HydrophobicContact CG-CE 4.02Å; K218-M222 PolarHBondContact O-N 3.04Å; M222-L224 PolarHBondContact O-N 3.43Å; M222-D226 HydrophobicContact CB-CB 4.1Å; M222-D226 PolarHBondContact O-N 3.11Å; M222-D226 VanDerWaalsContact O-N 3.15Å; M222-G227 PolarHBondContact O-N 2.66Å; M222-Y273 WeakPolarHBondContact CE-OH 3.45Å
223	K	96.5	Very high	98	Very high	164 Å²	164	40 Å²	40	71%	0.713	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-32.7	-174.7	-61.9	-177.5	-178.3	-179.6	0	114.2	I221 G227	I221-K223 PolarHBondContact O-N 2.86Å; K223-G227 WeakPolarHBondContact O-CA 3.46Å
224	L	97.8	Very high	97.9	Very high	156 Å²	156	44.2 Å²	44.2	82%	0.817	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-56.9	-178.9	-61.5	-179.4	0	0	0	112.3	M222 L228	M222-L224 PolarHBondContact O-N 3.43Å; L224-L228 VanDerWaalsContact O-CB 3.23Å; L224-L228 WeakPolarHBondContact O-CB 3.38Å; L224-L228 PolarHBondContact O-N 3.31Å
225	G	97.1	Very high	97.9	Very high	25 Å²	25	47.2 Å²	47.2	26%	0.258	24%	0.244	S	C	.	.	H	α-helix	trans	-64.1	-60.9	-176.5	0	0	0	0	0	112.7	G227 L228 F229	G225-G227 VanDerWaalsContact C-N 3.34Å; G225-L228 PolarHBondContact O-N 2.88Å; G225-F229 PolarHBondContact O-N 3.35Å
226	D	98	Very high	97.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-75	-26.4	179.4	-80.8	21.3	0	0	0	112.6	K187 H217 K218 A219 M222 L228 F229 L230 Y273	K187-D226 WeakPolarHBondContact CE-OD1 3.43Å; K187-D226 IonicContact NZ-OD1 2.84Å; K187-D226 PolarHBondContact NZ-OD1 3.04Å; H217-D226 HydrophobicContact CB-CB 4.4Å; K218-D226 WeakPolarHBondContact CA-OD2 3.46Å; K218-D226 WeakPolarHBondContact CB-OD2 3.5Å; K218-D226 PolarHBondContact N-OD2 2.93Å; A219-D226 HydrophobicContact CB-CB 4.06Å; M222-D226 HydrophobicContact CB-CB 4.1Å; M222-D226 PolarHBondContact O-N 3.11Å; M222-D226 VanDerWaalsContact O-N 3.15Å; D226-L228 VanDerWaalsContact C-N 3.34Å; D226-F229 PolarHBondContact O-N 2.89Å; D226-L230 WeakPolarHBondContact O-CB 3.1Å; D226-L230 PolarHBondContact O-N 3.44Å; D226-Y273 WeakPolarHBondContact OD2-CE2 3.34Å; D226-Y273 PolarHBondContact OD2-OH 3.15Å
227	G	98.4	Very high	97.9	Very high	19 Å²	19	48.5 Å²	48.5	20%	0.196	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-41.2	170.9	0	0	0	0	0	112.1	M222 K223 G225 L230 Q231	M222-G227 PolarHBondContact O-N 2.66Å; K223-G227 WeakPolarHBondContact O-CA 3.46Å; G225-G227 VanDerWaalsContact C-N 3.34Å; G227-L230 PolarHBondContact O-N 3.21Å; G227-Q231 WeakPolarHBondContact O-CB 3.47Å; G227-Q231 PolarHBondContact O-N 3.13Å
228	L	98.8	Very high	97.9	Very high	41 Å²	41	55.4 Å²	55.4	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-45.5	174.1	177.3	62.6	0	0	0	111.7	R191 L224 G225 D226 L230 Q231 C232	R191-L228 HydrophobicContact CB-CD1 4.25Å; R191-L228 HydrophobicContact CB-CD2 4.46Å; L224-L228 VanDerWaalsContact O-CB 3.23Å; L224-L228 WeakPolarHBondContact O-CB 3.38Å; L224-L228 PolarHBondContact O-N 3.31Å; G225-L228 PolarHBondContact O-N 2.88Å; D226-L228 VanDerWaalsContact C-N 3.34Å; L228-L230 VanDerWaalsContact C-N 3.35Å; L228-L230 PolarHBondContact O-N 3.06Å; L228-Q231 PolarHBondContact O-N 2.8Å; L228-C232 PolarHBondContact O-N 3.38Å; L228-C232 PolarHBondContact O-SG 2.76Å
229	F	98.8	Very high	98	Very high	2 Å²	2	60 Å²	60	1%	0.009	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-48.8	175.9	171	-95.4	0	0	0	111.4	V189 I197 A215 G225 D226 Q231 C232 C233 V268 P270	V189-F229 HydrophobicContact CG1-CB 4.39Å; I197-F229 HydrophobicContact CG2-CE2 3.97Å; A215-F229 HydrophobicContact CB-CE1 4.37Å; G225-F229 PolarHBondContact O-N 3.35Å; D226-F229 PolarHBondContact O-N 2.89Å; F229-Q231 PolarHBondContact O-N 2.9Å; F229-C232 WeakPolarHBondContact O-CB 3.4Å; F229-C232 PolarHBondContact O-N 3.18Å; F229-C233 VanDerWaalsContact CZ-SG 3.54Å; F229-C233 PolarHBondContact O-N 3.05Å; F229-C233 PolarHBondContact O-SG 2.83Å; F229-V268 HydrophobicContact CZ-CG2 4.32Å; F229-P270 HydrophobicContact CB-CG 4.39Å; F229-P270 HydrophobicContact CD1-CG 3.86Å; F229-P270 HydrophobicContact CD2-CG 3.98Å; F229-P270 HydrophobicContact CE1-CG 4.13Å; F229-P270 HydrophobicContact CE2-CG 4.22Å; F229-P270 HydrophobicContact CG-CG 3.79Å; F229-P270 HydrophobicContact CZ-CG 4.29Å
230	L	98.4	Very high	98.1	Very high	23 Å²	23	60.8 Å²	60.8	12%	0.12	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-48.1	179.7	-175.5	63.9	0	0	0	111.9	A215 A219 D226 G227 L228 C232 C233 E234 T247	A215-L230 HydrophobicContact CB-CD1 4.32Å; A219-L230 HydrophobicContact CB-CD2 4.33Å; D226-L230 WeakPolarHBondContact O-CB 3.1Å; D226-L230 PolarHBondContact O-N 3.44Å; G227-L230 PolarHBondContact O-N 3.21Å; L228-L230 VanDerWaalsContact C-N 3.35Å; L228-L230 PolarHBondContact O-N 3.06Å; L230-C232 VanDerWaalsContact C-N 3.28Å; L230-C232 PolarHBondContact O-N 2.57Å; L230-C233 WeakPolarHBondContact O-CB 3.16Å; L230-C233 PolarHBondContact O-N 2.73Å; L230-C233 VanDerWaalsContact O-N 3.08Å; L230-E234 WeakPolarHBondContact O-CG 3.1Å; L230-E234 PolarHBondContact O-N 2.85Å; L230-T247 HydrophobicContact CD1-CG2 3.49Å; L230-T247 VanDerWaalsContact CD1-CG2 3.49Å
231	Q	98.7	Very high	98.1	Very high	86 Å²	86	62.5 Å²	62.5	40%	0.402	33%	0.327	S	S	.	.	H	α-helix	trans	-57.6	-42.7	176.8	-175.7	-171.5	-17	0	0	111.4	R191 G227 L228 F229 C233 E234 E235	R191-Q231 VanDerWaalsContact NH2-CD 3.3Å; G227-Q231 WeakPolarHBondContact O-CB 3.47Å; G227-Q231 PolarHBondContact O-N 3.13Å; L228-Q231 PolarHBondContact O-N 2.8Å; F229-Q231 PolarHBondContact O-N 2.9Å; Q231-C233 VanDerWaalsContact C-N 3.32Å; Q231-C233 PolarHBondContact O-N 2.8Å; Q231-E234 PolarHBondContact O-N 3.4Å; Q231-E235 HydrophobicContact CG-CG 4.5Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.34Å; Q231-E235 PolarHBondContact NE2-OE1 2.84Å; Q231-E235 VanDerWaalsContact O-CG 3.31Å; Q231-E235 WeakPolarHBondContact O-CG 3.49Å; Q231-E235 PolarHBondContact O-N 3.26Å
232	C	98.8	Very high	98.1	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-63.6	-37.9	177.2	-64.9	0	0	0	0	112.1	Q195 L228 F229 L230 V236	Q195-C232 HydrophobicContact CG-CB 3.71Å; L228-C232 PolarHBondContact O-N 3.38Å; L228-C232 PolarHBondContact O-SG 2.76Å; F229-C232 WeakPolarHBondContact O-CB 3.4Å; F229-C232 PolarHBondContact O-N 3.18Å; L230-C232 VanDerWaalsContact C-N 3.28Å; L230-C232 PolarHBondContact O-N 2.57Å; C232-V236 VanDerWaalsContact O-CG2 3.28Å; C232-V236 WeakPolarHBondContact O-CG2 3.33Å; C232-V236 PolarHBondContact O-N 3.47Å; C232-V236 VanDerWaalsContact O-N 3.12Å
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	-65.6	-42.4	174.8	-68.7	0	0	0	0	112.2	A198 A215 F229 L230 Q231 V236 A237 F245	A198-C233 HydrophobicContact CB-CB 4.42Å; A215-C233 HydrophobicContact CB-CB 4.02Å; F229-C233 VanDerWaalsContact CZ-SG 3.54Å; F229-C233 PolarHBondContact O-N 3.05Å; F229-C233 PolarHBondContact O-SG 2.83Å; L230-C233 WeakPolarHBondContact O-CB 3.16Å; L230-C233 PolarHBondContact O-N 2.73Å; L230-C233 VanDerWaalsContact O-N 3.08Å; Q231-C233 VanDerWaalsContact C-N 3.32Å; Q231-C233 PolarHBondContact O-N 2.8Å; C233-V236 PolarHBondContact O-N 3.38Å; C233-A237 WeakPolarHBondContact O-CB 3.02Å; C233-A237 PolarHBondContact O-N 2.88Å; C233-F245 HydrophobicContact CB-CE2 3.91Å; C233-F245 HydrophobicContact CB-CZ 3.72Å
234	E	98.7	Very high	98.3	Very high	87 Å²	87	62.5 Å²	62.5	41%	0.407	32%	0.321	S	S	.	.	H	α-helix	trans	-61.2	-50.1	176.5	-74.2	169.1	167.8	0	0	111.5	L230 Q231 V236 A237 E238 F245	L230-E234 WeakPolarHBondContact O-CG 3.1Å; L230-E234 PolarHBondContact O-N 2.85Å; Q231-E234 PolarHBondContact O-N 3.4Å; E234-V236 VanDerWaalsContact C-N 3.3Å; E234-V236 PolarHBondContact O-N 3.48Å; E234-A237 WeakPolarHBondContact O-CB 3.05Å; E234-A237 PolarHBondContact O-N 2.93Å; E234-A237 VanDerWaalsContact O-N 3.09Å; E234-E238 PolarHBondContact O-N 3.21Å; E234-F245 HydrophobicContact CB-CE1 4.42Å; E234-F245 HydrophobicContact CG-CE1 3.58Å; E234-F245 HydrophobicContact CG-CZ 4.16Å
235	E	98.8	Very high	98.4	Very high	64 Å²	64	57.6 Å²	57.6	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-57.3	-42.2	176.9	-72.8	169.1	-168.6	0	0	112.1	R191 Q195 Q231	R191-E235 IonicContact CZ-OE1 3.69Å; R191-E235 IonicContact NH1-OE1 2.85Å; R191-E235 PolarHBondContact NH1-OE1 3.38Å; R191-E235 IonicContact NH1-OE2 2.75Å; R191-E235 PolarHBondContact NH1-OE2 3.05Å; R191-E235 IonicContact NH2-OE1 3.59Å; Q195-E235 PolarHBondContact NE2-OE2 3.36Å; Q231-E235 HydrophobicContact CG-CG 4.5Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.34Å; Q231-E235 PolarHBondContact NE2-OE1 2.84Å; Q231-E235 VanDerWaalsContact O-CG 3.31Å; Q231-E235 WeakPolarHBondContact O-CG 3.49Å; Q231-E235 PolarHBondContact O-N 3.26Å
236	V	98.8	Very high	98.4	Very high	12 Å²	12	58.7 Å²	58.7	7%	0.073	29%	0.292	C	S	.	.	H	α-helix	trans	-69.8	-36.8	177.6	171.5	0	0	0	0	111.1	A198 K199 F202 C232 C233 E234 E238 L239 Y240	A198-V236 HydrophobicContact CB-CB 4.12Å; A198-V236 HydrophobicContact CB-CG1 4.31Å; A198-V236 HydrophobicContact CB-CG2 4.06Å; K199-V236 HydrophobicContact CB-CG1 4.25Å; F202-V236 HydrophobicContact CD2-CG1 3.65Å; F202-V236 HydrophobicContact CE2-CG1 4.21Å; F202-V236 HydrophobicContact CG-CG1 4.34Å; C232-V236 VanDerWaalsContact O-CG2 3.28Å; C232-V236 WeakPolarHBondContact O-CG2 3.33Å; C232-V236 PolarHBondContact O-N 3.47Å; C232-V236 VanDerWaalsContact O-N 3.12Å; C233-V236 PolarHBondContact O-N 3.38Å; E234-V236 VanDerWaalsContact C-N 3.3Å; E234-V236 PolarHBondContact O-N 3.48Å; V236-E238 PolarHBondContact O-N 3.28Å; V236-L239 WeakPolarHBondContact O-CB 3.4Å; V236-L239 PolarHBondContact O-N 3.13Å; V236-Y240 HydrophobicContact CG1-CD2 4.28Å; V236-Y240 HydrophobicContact CG1-CE2 3.9Å; V236-Y240 VanDerWaalsContact O-CD2 3.3Å; V236-Y240 WeakPolarHBondContact O-CD2 3.37Å
237	A	98.7	Very high	98.4	Very high	15 Å²	15	61.8 Å²	61.8	12%	0.124	31%	0.311	C	S	.	.	H	α-helix	trans	-58.7	-33.2	-179.2	0	0	0	0	0	112.7	F202 C233 E234 L239 Y240 F245	F202-A237 HydrophobicContact CE1-CB 4.12Å; F202-A237 HydrophobicContact CE2-CB 4.03Å; F202-A237 HydrophobicContact CZ-CB 3.43Å; F202-A237 VanDerWaalsContact CZ-CB 3.43Å; C233-A237 WeakPolarHBondContact O-CB 3.02Å; C233-A237 PolarHBondContact O-N 2.88Å; E234-A237 WeakPolarHBondContact O-CB 3.05Å; E234-A237 PolarHBondContact O-N 2.93Å; E234-A237 VanDerWaalsContact O-N 3.09Å; A237-L239 PolarHBondContact O-N 3.35Å; A237-L239 VanDerWaalsContact O-N 3.16Å; A237-Y240 CarbonylContact O-C 3.56Å; A237-Y240 PolarHBondContact O-N 3.24Å; A237-F245 HydrophobicContact CB-CB 3.83Å; A237-F245 HydrophobicContact CB-CD1 3.97Å; A237-F245 HydrophobicContact CB-CD2 4.08Å; A237-F245 HydrophobicContact CB-CG 3.68Å
238	E	98.5	Very high	98.4	Very high	159 Å²	159	61.8 Å²	61.8	74%	0.743	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.8	175.9	-64.3	-178.7	177	0	0	112.8	E234 V236 Y240	E234-E238 PolarHBondContact O-N 3.21Å; V236-E238 PolarHBondContact O-N 3.28Å; E238-Y240 VanDerWaalsContact C-N 3.29Å; E238-Y240 PolarHBondContact O-N 3.18Å
239	L	98.3	Very high	98.4	Very high	127 Å²	127	62.7 Å²	62.7	67%	0.665	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-12	178.3	-52.7	177.4	0	0	0	113.1	V236 A237 P241	V236-L239 WeakPolarHBondContact O-CB 3.4Å; V236-L239 PolarHBondContact O-N 3.13Å; A237-L239 PolarHBondContact O-N 3.35Å; A237-L239 VanDerWaalsContact O-N 3.16Å; L239-P241 VanDerWaalsContact C-CD 3.5Å; L239-P241 WeakPolarHBondContact O-CD 3.37Å
240	Y	98.4	Very high	98.4	Very high	34 Å²	34	63.3 Å²	63.3	13%	0.133	31%	0.313	C	S	.	.			trans	-127.2	64.4	-174.3	-60.1	-98.8	0	0	0	111.8	F202 D203 V236 A237 E238 K242 I243	F202-Y240 HydrophobicContact CB-CD1 3.85Å; F202-Y240 HydrophobicContact CB-CD2 3.57Å; F202-Y240 HydrophobicContact CB-CE1 3.85Å; F202-Y240 HydrophobicContact CB-CE2 3.61Å; F202-Y240 HydrophobicContact CB-CG 3.71Å; F202-Y240 AromaticContact CD1-CD2 3.97Å; F202-Y240 HydrophobicContact CD1-CD2 3.97Å; F202-Y240 AromaticContact CD1-CG 3.81Å; F202-Y240 HydrophobicContact CD1-CG 3.81Å; F202-Y240 AromaticContact CG-CD2 3.79Å; F202-Y240 HydrophobicContact CG-CD2 3.79Å; F202-Y240 HydrophobicContact CG-CE2 4.23Å; F202-Y240 HydrophobicContact CG-CG 4.01Å; D203-Y240 WeakPolarHBondContact OD1-CE1 3.5Å; D203-Y240 PolarHBondContact OD1-OH 3.43Å; V236-Y240 HydrophobicContact CG1-CD2 4.28Å; V236-Y240 HydrophobicContact CG1-CE2 3.9Å; V236-Y240 VanDerWaalsContact O-CD2 3.3Å; V236-Y240 WeakPolarHBondContact O-CD2 3.37Å; A237-Y240 CarbonylContact O-C 3.56Å; A237-Y240 PolarHBondContact O-N 3.24Å; E238-Y240 VanDerWaalsContact C-N 3.29Å; E238-Y240 PolarHBondContact O-N 3.18Å; Y240-K242 PolarHBondContact O-N 2.93Å; Y240-I243 PolarHBondContact O-N 2.69Å
241	P	96.5	Very high	98.4	Very high	120 Å²	120	66.3 Å²	66.3	78%	0.779	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-12.9	-172	26.6	-36.9	0	0	0	114.9	L239	L239-P241 VanDerWaalsContact C-CD 3.5Å; L239-P241 WeakPolarHBondContact O-CD 3.37Å
242	K	97.4	Very high	98.4	Very high	203 Å²	203	65 Å²	65	88%	0.883	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-14.5	176.8	-65.7	-177.2	179.9	178.6	0	113.5	Y240	Y240-K242 PolarHBondContact O-N 2.93Å
243	I	98.6	Very high	98.3	Very high	19 Å²	19	65 Å²	65	10%	0.097	33%	0.326	C	S	.	.	S	Bend	trans	-99	123.3	-179.9	-58	-61.3	0	0	0	108	F202 A205 R210 V213 Y240 F245	F202-I243 HydrophobicContact CD1-CB 3.95Å; F202-I243 HydrophobicContact CD1-CG1 4.29Å; F202-I243 HydrophobicContact CD1-CG2 3.8Å; F202-I243 HydrophobicContact CE1-CB 3.99Å; F202-I243 HydrophobicContact CE1-CG2 3.69Å; A205-I243 HydrophobicContact CB-CD1 4.17Å; R210-I243 WeakPolarHBondContact O-CD1 3.25Å; V213-I243 HydrophobicContact CB-CG2 4.12Å; V213-I243 HydrophobicContact CG2-CG2 3.67Å; Y240-I243 PolarHBondContact O-N 2.69Å; I243-F245 PolarHBondContact O-N 2.92Å
244	K	98.7	Very high	98.3	Very high	121 Å²	121	66.6 Å²	66.6	53%	0.526	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	124.4	173.7	-173.3	-177.4	-171.7	-165.2	0	108.9	G211 K212 V213 E246	G211-K244 PolarHBondContact O-N 3.26Å; K212-K244 CarbonylContact C-O 3.56Å; K212-K244 VanDerWaalsContact CA-O 3.32Å; K212-K244 WeakPolarHBondContact CA-O 3.19Å; K212-K244 HydrophobicContact CB-CB 4.28Å; K212-K244 HydrophobicContact CD-CD 4Å; K212-K244 HydrophobicContact CD-CG 4.45Å; K212-K244 HydrophobicContact CG-CB 4.07Å; K212-K244 HydrophobicContact CG-CD 4.4Å; K212-K244 HydrophobicContact CG-CG 4.36Å; K212-K244 WeakPolarHBondContact CG-O 3.08Å; V213-K244 PolarHBondContact N-O 3.43Å; K244-E246 WeakPolarHBondContact CE-OE1 3.47Å; K244-E246 IonicContact NZ-OE1 3.94Å; K244-E246 PolarHBondContact NZ-OE1 2.75Å
245	F	98.8	Very high	98.3	Very high	52 Å²	52	67.3 Å²	67.3	23%	0.228	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	132.9	173.4	-178.5	-113.4	0	0	0	110.7	F202 V213 A215 C233 E234 A237 I243 T247	F202-F245 HydrophobicContact CE2-CD2 4.24Å; F202-F245 HydrophobicContact CZ-CB 4.26Å; F202-F245 AromaticContact CZ-CD2 3.58Å; F202-F245 HydrophobicContact CZ-CD2 3.58Å; F202-F245 HydrophobicContact CZ-CE2 4.26Å; F202-F245 HydrophobicContact CZ-CG 4.19Å; V213-F245 WeakPolarHBondContact O-CA 3.3Å; A215-F245 HydrophobicContact CB-CE2 3.75Å; A215-F245 HydrophobicContact CB-CZ 3.82Å; C233-F245 HydrophobicContact CB-CE2 3.91Å; C233-F245 HydrophobicContact CB-CZ 3.72Å; E234-F245 HydrophobicContact CB-CE1 4.42Å; E234-F245 HydrophobicContact CG-CE1 3.58Å; E234-F245 HydrophobicContact CG-CZ 4.16Å; A237-F245 HydrophobicContact CB-CB 3.83Å; A237-F245 HydrophobicContact CB-CD1 3.97Å; A237-F245 HydrophobicContact CB-CD2 4.08Å; A237-F245 HydrophobicContact CB-CG 3.68Å; I243-F245 PolarHBondContact O-N 2.92Å; F245-T247 HydrophobicContact CD1-CG2 4.4Å; F245-T247 HydrophobicContact CE1-CG2 3.5Å; F245-T247 VanDerWaalsContact CE1-CG2 3.5Å; F245-T247 HydrophobicContact CZ-CG2 3.66Å
246	E	98.2	Very high	98.3	Very high	49 Å²	49	66.2 Å²	66.2	23%	0.229	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	157.8	173.8	-74.1	177.3	179.9	0	0	109.7	K212 V213 T214 A215 K244	K212-E246 HydrophobicContact CD-CG 4.36Å; K212-E246 WeakPolarHBondContact CD-OE2 3.38Å; K212-E246 WeakPolarHBondContact CE-OE2 3.37Å; K212-E246 IonicContact NZ-OE1 3.61Å; K212-E246 IonicContact NZ-OE2 2.76Å; K212-E246 PolarHBondContact NZ-OE2 2.79Å; V213-E246 PolarHBondContact O-N 2.91Å; T214-E246 CarbonylContact C-O 3.29Å; T214-E246 VanDerWaalsContact CA-O 3.27Å; T214-E246 WeakPolarHBondContact CA-O 3.49Å; T214-E246 HydrophobicContact CG2-CB 4.28Å; A215-E246 PolarHBondContact N-O 3.31Å; K244-E246 WeakPolarHBondContact CE-OE1 3.47Å; K244-E246 IonicContact NZ-OE1 3.94Å; K244-E246 PolarHBondContact NZ-OE1 2.75Å
247	T	98.3	Very high	98.2	Very high	65 Å²	65	65.7 Å²	65.7	40%	0.399	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.8	175.3	69	0	0	0	0	108.7	A215 L230 F245	A215-T247 WeakPolarHBondContact O-CA 3.33Å; L230-T247 HydrophobicContact CD1-CG2 3.49Å; L230-T247 VanDerWaalsContact CD1-CG2 3.49Å; F245-T247 HydrophobicContact CD1-CG2 4.4Å; F245-T247 HydrophobicContact CE1-CG2 3.5Å; F245-T247 VanDerWaalsContact CE1-CG2 3.5Å; F245-T247 HydrophobicContact CZ-CG2 3.66Å
248	M	98.6	Very high	98.1	Very high	19 Å²	19	68.3 Å²	68.3	9%	0.094	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	133.7	-179.5	-166.5	172.2	-69.5	0	0	111	T214 A215 V216 H217 N252 C253 Q256 F264	T214-M248 HydrophobicContact CG2-CB 3.94Å; A215-M248 PolarHBondContact O-N 2.74Å; V216-M248 VanDerWaalsContact CA-O 3.32Å; V216-M248 WeakPolarHBondContact CA-O 3.43Å; H217-M248 PolarHBondContact CD2-O 2.87Å; H217-M248 PolarHBondContact N-O 2.84Å; H217-M248 VanDerWaalsContact N-O 3.08Å; M248-N252 HydrophobicContact CG-CB 4.23Å; M248-C253 HydrophobicContact CG-CB 4.08Å; M248-C253 WeakPolarHBondContact SD-CA 3.37Å; M248-C253 HydrophobicContact SD-CB 3.81Å; M248-Q256 HydrophobicContact CE-CG 4.4Å; M248-Q256 HydrophobicContact SD-CB 4.38Å; M248-Q256 HydrophobicContact SD-CG 4.22Å; M248-F264 HydrophobicContact CE-CE1 3.89Å; M248-F264 HydrophobicContact CE-CZ 4.06Å; M248-F264 HydrophobicContact SD-CE1 3.87Å; M248-F264 HydrophobicContact SD-CZ 3.8Å
249	I	98.4	Very high	98.1	Very high	60 Å²	60	66.8 Å²	66.8	31%	0.308	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	140.7	171	61.3	173.5	0	0	0	110.6	H217 D251 N252 C253	H217-I249 CarbonylContact O-C 3.51Å; H217-I249 WeakPolarHBondContact O-CA 3.48Å; I249-D251 VanDerWaalsContact C-N 3.3Å; I249-D251 PolarHBondContact O-N 3.36Å; I249-N252 HydrophobicContact CD1-CB 4.41Å; I249-N252 HydrophobicContact CG1-CB 3.74Å; I249-N252 PolarHBondContact O-N 3.21Å; I249-C253 PolarHBondContact O-N 3.31Å
250	I	98.1	Very high	98	Very high	14 Å²	14	64.2 Å²	64.2	7%	0.072	33%	0.327	C	S	.	.	H	α-helix	trans	-55.3	-39.7	-173.6	-179	59.1	0	0	0	113.2	V216 H217 K218 N252 C253 C254 Y273 I277	V216-I250 HydrophobicContact CG1-CB 3.93Å; V216-I250 HydrophobicContact CG1-CD1 3.64Å; V216-I250 HydrophobicContact CG1-CG1 4.38Å; H217-I250 PolarHBondContact O-N 3.03Å; K218-I250 HydrophobicContact CB-CG2 4.01Å; K218-I250 HydrophobicContact CD-CG2 3.64Å; K218-I250 HydrophobicContact CG-CG2 4.29Å; I250-N252 PolarHBondContact O-N 3.12Å; I250-C253 WeakPolarHBondContact O-CB 3.23Å; I250-C253 PolarHBondContact O-N 3.46Å; I250-C254 PolarHBondContact O-N 3.05Å; I250-C254 PolarHBondContact O-SG 3.48Å; I250-C254 VanDerWaalsContact O-SG 3.39Å; I250-Y273 HydrophobicContact CB-CG 4.45Å; I250-Y273 HydrophobicContact CD1-CG 4.42Å; I250-Y273 HydrophobicContact CG1-CD1 4.13Å; I250-Y273 HydrophobicContact CG1-CG 4.17Å; I250-I277 HydrophobicContact CD1-CD1 3.53Å; I250-I277 HydrophobicContact CD1-CG1 3.51Å
251	D	97.8	Very high	98	Very high	86 Å²	86	62.7 Å²	62.7	46%	0.46	32%	0.321	S	S	.	.	H	α-helix	trans	-59.7	-47.2	177	-56.3	18.6	0	0	0	111.8	K218 I249 C253 C254 M255	K218-D251 IonicContact NZ-OD1 3.18Å; K218-D251 PolarHBondContact NZ-OD1 3.49Å; K218-D251 IonicContact NZ-OD2 3.29Å; K218-D251 PolarHBondContact NZ-OD2 2.98Å; I249-D251 VanDerWaalsContact C-N 3.3Å; I249-D251 PolarHBondContact O-N 3.36Å; D251-C253 VanDerWaalsContact C-N 3.33Å; D251-C254 PolarHBondContact O-N 2.49Å; D251-M255 WeakPolarHBondContact O-CG 3.32Å; D251-M255 PolarHBondContact O-N 3.36Å; D251-M255 VanDerWaalsContact O-N 3.11Å
252	N	98.3	Very high	98.1	Very high	60 Å²	60	62.8 Å²	62.8	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-68.3	-37	177.6	-172.8	36.1	0	0	0	110.4	M248 I249 I250 C254 M255 Q256	M248-N252 HydrophobicContact CG-CB 4.23Å; I249-N252 HydrophobicContact CD1-CB 4.41Å; I249-N252 HydrophobicContact CG1-CB 3.74Å; I249-N252 PolarHBondContact O-N 3.21Å; I250-N252 PolarHBondContact O-N 3.12Å; N252-C254 VanDerWaalsContact C-N 3.35Å; N252-C254 PolarHBondContact O-N 3.26Å; N252-M255 PolarHBondContact O-N 3.2Å; N252-Q256 WeakPolarHBondContact O-CB 3.38Å; N252-Q256 VanDerWaalsContact O-CG 3.25Å; N252-Q256 WeakPolarHBondContact O-CG 3.26Å; N252-Q256 PolarHBondContact O-N 2.97Å; N252-Q256 PolarHBondContact OD1-NE2 2.75Å
253	C	98.5	Very high	98.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.4	-47.2	174.5	-175.5	0	0	0	0	111.7	V216 M248 I249 I250 D251 M255 Q256 L257	V216-C253 HydrophobicContact CG1-CB 3.86Å; V216-C253 HydrophobicContact CG2-CB 4.39Å; M248-C253 HydrophobicContact CG-CB 4.08Å; M248-C253 WeakPolarHBondContact SD-CA 3.37Å; M248-C253 HydrophobicContact SD-CB 3.81Å; I249-C253 PolarHBondContact O-N 3.31Å; I250-C253 WeakPolarHBondContact O-CB 3.23Å; I250-C253 PolarHBondContact O-N 3.46Å; D251-C253 VanDerWaalsContact C-N 3.33Å; C253-M255 PolarHBondContact O-N 2.81Å; C253-Q256 PolarHBondContact O-N 2.88Å; C253-L257 WeakPolarHBondContact O-CB 3.43Å; C253-L257 WeakPolarHBondContact O-CG 3.13Å; C253-L257 PolarHBondContact O-N 3.4Å
254	C	98.3	Very high	98.1	Very high	33 Å²	33	55.5 Å²	55.5	22%	0.223	28%	0.275	C	S	.	.	H	α-helix	trans	-58.8	-46	174.3	-68.6	0	0	0	0	112.1	I250 D251 N252 V258 L280	I250-C254 PolarHBondContact O-N 3.05Å; I250-C254 PolarHBondContact O-SG 3.48Å; I250-C254 VanDerWaalsContact O-SG 3.39Å; D251-C254 PolarHBondContact O-N 2.49Å; N252-C254 VanDerWaalsContact C-N 3.35Å; N252-C254 PolarHBondContact O-N 3.26Å; C254-V258 PolarHBondContact O-N 2.94Å; C254-L280 HydrophobicContact CB-CD1 4.12Å
255	M	97.9	Very high	98.1	Very high	102 Å²	102	51 Å²	51	50%	0.502	26%	0.257	S	S	.	.	H	α-helix	trans	-60.4	-47.5	176.8	-69.9	178.9	65.3	0	0	111.8	D251 N252 C253 V258 Q259	D251-M255 WeakPolarHBondContact O-CG 3.32Å; D251-M255 PolarHBondContact O-N 3.36Å; D251-M255 VanDerWaalsContact O-N 3.11Å; N252-M255 PolarHBondContact O-N 3.2Å; C253-M255 PolarHBondContact O-N 2.81Å; M255-V258 PolarHBondContact O-N 3.3Å; M255-Q259 WeakPolarHBondContact O-CB 3.44Å; M255-Q259 VanDerWaalsContact O-CG 3.28Å; M255-Q259 WeakPolarHBondContact O-CG 3.35Å; M255-Q259 PolarHBondContact O-N 3.38Å
256	Q	98.3	Very high	98.1	Very high	41 Å²	41	48.5 Å²	48.5	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-68.4	-35.3	-177.7	-70.7	-54.3	-39.2	0	0	112.6	M248 N252 C253 V258 Q259 N260 F264	M248-Q256 HydrophobicContact CE-CG 4.4Å; M248-Q256 HydrophobicContact SD-CB 4.38Å; M248-Q256 HydrophobicContact SD-CG 4.22Å; N252-Q256 WeakPolarHBondContact O-CB 3.38Å; N252-Q256 VanDerWaalsContact O-CG 3.25Å; N252-Q256 WeakPolarHBondContact O-CG 3.26Å; N252-Q256 PolarHBondContact O-N 2.97Å; N252-Q256 PolarHBondContact OD1-NE2 2.75Å; C253-Q256 PolarHBondContact O-N 2.88Å; Q256-V258 PolarHBondContact O-N 3.02Å; Q256-Q259 PolarHBondContact O-N 2.75Å; Q256-N260 CarbonylContact O-C 3.59Å; Q256-N260 WeakPolarHBondContact O-CA 3.47Å; Q256-N260 PolarHBondContact O-N 2.98Å; Q256-F264 HydrophobicContact CB-CE2 3.86Å; Q256-F264 HydrophobicContact CB-CZ 3.68Å
257	L	97.9	Very high	98.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-32.3	175.2	-81.5	167.1	0	0	0	112.2	L160 C253 P261 F264 I277 L280 L284	L160-L257 HydrophobicContact CD2-CD2 4.01Å; C253-L257 WeakPolarHBondContact O-CB 3.43Å; C253-L257 WeakPolarHBondContact O-CG 3.13Å; C253-L257 PolarHBondContact O-N 3.4Å; L257-P261 HydrophobicContact CD2-CB 4.49Å; L257-P261 VanDerWaalsContact O-CB 3.27Å; L257-P261 WeakPolarHBondContact O-CB 3.35Å; L257-P261 WeakPolarHBondContact O-CD 3.44Å; L257-P261 WeakPolarHBondContact O-CG 3.49Å; L257-F264 HydrophobicContact CB-CE2 4.46Å; L257-F264 HydrophobicContact CD2-CD2 3.53Å; L257-F264 HydrophobicContact CD2-CE2 3.73Å; L257-F264 HydrophobicContact CD2-CG 4.32Å; L257-F264 HydrophobicContact CG-CD2 4.07Å; L257-F264 HydrophobicContact CG-CE2 3.71Å; L257-F264 HydrophobicContact CG-CZ 4.34Å; L257-I277 HydrophobicContact CD1-CD1 3.75Å; L257-I277 HydrophobicContact CD1-CG2 3.85Å; L257-L280 HydrophobicContact CB-CD2 3.53Å; L257-L280 HydrophobicContact CD1-CD2 3.82Å; L257-L280 HydrophobicContact CG-CD2 4.27Å; L257-L284 HydrophobicContact CB-CD1 4.27Å; L257-L284 HydrophobicContact CD2-CD1 4.34Å; L257-L284 VanDerWaalsContact O-CD1 3.3Å; L257-L284 WeakPolarHBondContact O-CD1 3.43Å
258	V	96.8	Very high	98.1	Very high	71 Å²	71	43.1 Å²	43.1	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-84.4	-35.4	176.4	179.8	0	0	0	0	111.7	H155 C254 M255 Q256 L280	H155-V258 PolarHBondContact CE1-O 2.95Å; H155-V258 PolarHBondContact NE2-O 2.79Å; H155-V258 VanDerWaalsContact NE2-O 3.16Å; C254-V258 PolarHBondContact O-N 2.94Å; M255-V258 PolarHBondContact O-N 3.3Å; Q256-V258 PolarHBondContact O-N 3.02Å; V258-L280 HydrophobicContact CG2-CD2 4.44Å
259	Q	97.5	Very high	98.1	Very high	126 Å²	126	42.2 Å²	42.2	59%	0.589	21%	0.211	S	C	*	.	H	α-helix	trans	-83.3	-49.8	-175.9	-70.8	177.8	-2.9	0	0	113	M255 Q256	M255-Q259 WeakPolarHBondContact O-CB 3.44Å; M255-Q259 VanDerWaalsContact O-CG 3.28Å; M255-Q259 WeakPolarHBondContact O-CG 3.35Å; M255-Q259 PolarHBondContact O-N 3.38Å; Q256-Q259 PolarHBondContact O-N 2.75Å
260	N	97.6	Very high	98.1	Very high	74 Å²	74	39.6 Å²	39.6	40%	0.396	20%	0.199	S	C	.	.			trans	-146.7	73.3	-177.5	-177.5	22	0	0	0	111.4	Q256 Y262 Q263	Q256-N260 CarbonylContact O-C 3.59Å; Q256-N260 WeakPolarHBondContact O-CA 3.47Å; Q256-N260 PolarHBondContact O-N 2.98Å; N260-Y262 PolarHBondContact O-N 2.84Å; N260-Q263 WeakPolarHBondContact O-CG 3.18Å; N260-Q263 PolarHBondContact O-NE2 2.96Å
261	P	97.8	Very high	98	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-66	-17.6	-178.7	22	-31.3	0	0	0	114.6	H155 L158 L257 Q263 F264 L284	H155-P261 HydrophobicContact CB-CG 4.14Å; L158-P261 HydrophobicContact CD1-CB 4.21Å; L158-P261 HydrophobicContact CD1-CG 4.12Å; L158-P261 HydrophobicContact CD2-CB 3.84Å; L158-P261 HydrophobicContact CD2-CG 3.67Å; L257-P261 HydrophobicContact CD2-CB 4.49Å; L257-P261 VanDerWaalsContact O-CB 3.27Å; L257-P261 WeakPolarHBondContact O-CB 3.35Å; L257-P261 WeakPolarHBondContact O-CD 3.44Å; L257-P261 WeakPolarHBondContact O-CG 3.49Å; P261-Q263 PolarHBondContact O-N 2.85Å; P261-Q263 VanDerWaalsContact O-N 3.14Å; P261-F264 WeakPolarHBondContact O-CD2 3.41Å; P261-F264 PolarHBondContact O-N 3.01Å; P261-F264 VanDerWaalsContact O-N 3.16Å; P261-L284 HydrophobicContact CB-CD1 4.12Å
262	Y	98.1	Very high	97.9	Very high	123 Å²	123	37.7 Å²	37.7	48%	0.482	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-64.5	-17.2	-177.7	-59.1	-77.2	0	0	0	114.5	N156 L158 N260 F264	N156-Y262 PolarHBondContact N-OH 2.88Å; N156-Y262 WeakPolarHBondContact O-CE1 3.48Å; N156-Y262 PolarHBondContact O-OH 3.24Å; L158-Y262 HydrophobicContact CD2-CD1 3.75Å; L158-Y262 HydrophobicContact CD2-CE1 3.5Å; L158-Y262 HydrophobicContact CD2-CE2 4.43Å; L158-Y262 HydrophobicContact CD2-CG 4.31Å; N260-Y262 PolarHBondContact O-N 2.84Å; Y262-F264 VanDerWaalsContact C-N 3.25Å; Y262-F264 PolarHBondContact O-N 3.4Å
263	Q	97.5	Very high	97.8	Very high	58 Å²	58	35.6 Å²	35.6	27%	0.271	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-74.5	-16.3	177.8	74.7	-169.5	-76.6	0	0	112.9	K212 N260 P261	K212-Q263 WeakPolarHBondContact CE-O 3.34Å; K212-Q263 PolarHBondContact NZ-O 2.83Å; N260-Q263 WeakPolarHBondContact O-CG 3.18Å; N260-Q263 PolarHBondContact O-NE2 2.96Å; P261-Q263 PolarHBondContact O-N 2.85Å; P261-Q263 VanDerWaalsContact O-N 3.14Å
264	F	98.4	Very high	97.7	Very high	11 Å²	11	35.6 Å²	35.6	5%	0.048	18%	0.176	C	C	.	.			trans	-91.4	146.6	-175.1	-62.6	-71.3	0	0	0	112.2	L160 M248 Q256 L257 P261 Y262 L267	L160-F264 HydrophobicContact CB-CB 4.25Å; L160-F264 HydrophobicContact CD2-CB 4.31Å; M248-F264 HydrophobicContact CE-CE1 3.89Å; M248-F264 HydrophobicContact CE-CZ 4.06Å; M248-F264 HydrophobicContact SD-CE1 3.87Å; M248-F264 HydrophobicContact SD-CZ 3.8Å; Q256-F264 HydrophobicContact CB-CE2 3.86Å; Q256-F264 HydrophobicContact CB-CZ 3.68Å; L257-F264 HydrophobicContact CB-CE2 4.46Å; L257-F264 HydrophobicContact CD2-CD2 3.53Å; L257-F264 HydrophobicContact CD2-CE2 3.73Å; L257-F264 HydrophobicContact CD2-CG 4.32Å; L257-F264 HydrophobicContact CG-CD2 4.07Å; L257-F264 HydrophobicContact CG-CE2 3.71Å; L257-F264 HydrophobicContact CG-CZ 4.34Å; P261-F264 WeakPolarHBondContact O-CD2 3.41Å; P261-F264 PolarHBondContact O-N 3.01Å; P261-F264 VanDerWaalsContact O-N 3.16Å; Y262-F264 VanDerWaalsContact C-N 3.25Å; Y262-F264 PolarHBondContact O-N 3.4Å; F264-L267 HydrophobicContact CB-CD1 3.99Å; F264-L267 HydrophobicContact CD1-CD1 4.45Å; F264-L267 HydrophobicContact CD1-CD2 3.73Å; F264-L267 HydrophobicContact CD1-CG 4.13Å; F264-L267 HydrophobicContact CE1-CD2 4.05Å; F264-L267 HydrophobicContact CG-CD1 4.38Å; F264-L267 HydrophobicContact CG-CD2 4.24Å
265	D	98.5	Very high	97.4	Very high	26 Å²	26	36.2 Å²	36.2	14%	0.139	18%	0.177	C	C	.	.	S	Bend	trans	-124.3	-89.7	175.1	-168.7	7.7	0	0	0	108.4	L160 V161 R210 G211 K212	L160-D265 CarbonylContact C-O 3.52Å; L160-D265 VanDerWaalsContact CA-O 3.3Å; L160-D265 WeakPolarHBondContact CA-O 3.37Å; L160-D265 WeakPolarHBondContact CB-O 3.27Å; V161-D265 PolarHBondContact N-O 3.17Å; R210-D265 WeakPolarHBondContact CB-OD2 3.34Å; R210-D265 WeakPolarHBondContact CD-OD1 3.14Å; R210-D265 IonicContact CZ-OD1 2.79Å; R210-D265 IonicContact NE-OD1 3.47Å; R210-D265 IonicContact NH1-OD1 2.86Å; R210-D265 PolarHBondContact NH1-OD1 2.79Å; G211-D265 PolarHBondContact N-OD2 3.05Å; K212-D265 HydrophobicContact CB-CB 4.01Å; K212-D265 PolarHBondContact N-OD2 2.73Å; K212-D265 VanDerWaalsContact N-OD2 3.13Å
266	V	98.8	Very high	97.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.4	169.7	-177.9	0	0	0	0	110.1	V161 I163 A201 Y204 A205 R210 K212 V213 T214	V161-V266 HydrophobicContact CB-CG2 4.48Å; V161-V266 CarbonylContact O-C 3.58Å; V161-V266 WeakPolarHBondContact O-CA 3.26Å; I163-V266 HydrophobicContact CD1-CG1 3.66Å; I163-V266 HydrophobicContact CG1-CG1 4.17Å; A201-V266 HydrophobicContact CB-CG1 4.49Å; Y204-V266 HydrophobicContact CD1-CG2 4.3Å; Y204-V266 HydrophobicContact CE1-CG2 4.48Å; A205-V266 HydrophobicContact CB-CG2 4.15Å; R210-V266 HydrophobicContact CB-CG2 3.9Å; R210-V266 HydrophobicContact CG-CG2 3.8Å; K212-V266 WeakPolarHBondContact O-CB 3.49Å; K212-V266 PolarHBondContact O-N 3.28Å; V213-V266 CarbonylContact C-O 3.42Å; V213-V266 VanDerWaalsContact CA-O 3.31Å; V213-V266 WeakPolarHBondContact CA-O 3.46Å; V213-V266 HydrophobicContact CG2-CB 4.07Å; V213-V266 HydrophobicContact CG2-CG1 4.27Å; T214-V266 PolarHBondContact N-O 3.16Å
267	L	98.9	Very high	97.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.2	170.3	-55.1	93.9	0	0	0	109.8	L160 V161 I162 I163 T214 V216 F264 M269	L160-L267 HydrophobicContact CB-CD1 4.43Å; L160-L267 HydrophobicContact CD1-CD1 3.82Å; V161-L267 PolarHBondContact O-N 3.19Å; I162-L267 HydrophobicContact CG1-CD1 4.23Å; I163-L267 PolarHBondContact N-O 3.16Å; T214-L267 CarbonylContact O-C 3.59Å; T214-L267 WeakPolarHBondContact O-CA 3.34Å; V216-L267 HydrophobicContact CG2-CB 4.38Å; V216-L267 HydrophobicContact CG2-CD2 3.89Å; F264-L267 HydrophobicContact CB-CD1 3.99Å; F264-L267 HydrophobicContact CD1-CD1 4.45Å; F264-L267 HydrophobicContact CD1-CD2 3.73Å; F264-L267 HydrophobicContact CD1-CG 4.13Å; F264-L267 HydrophobicContact CE1-CD2 4.05Å; F264-L267 HydrophobicContact CG-CD1 4.38Å; F264-L267 HydrophobicContact CG-CD2 4.24Å; L267-M269 HydrophobicContact CB-CE 3.51Å; L267-M269 HydrophobicContact CD2-CE 4.28Å
268	V	98.9	Very high	97.1	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	-122	134.4	174.3	64.7	0	0	0	0	110.4	I163 I197 A201 V213 T214 A215 V216 F229	I163-V268 HydrophobicContact CG2-CG2 4.38Å; I163-V268 VanDerWaalsContact O-CA 3.29Å; I163-V268 WeakPolarHBondContact O-CA 3.3Å; I197-V268 HydrophobicContact CG1-CG2 4.08Å; A201-V268 HydrophobicContact CB-CB 3.77Å; A201-V268 HydrophobicContact CB-CG1 4.37Å; A201-V268 HydrophobicContact CB-CG2 3.8Å; V213-V268 HydrophobicContact CG1-CG1 3.83Å; T214-V268 PolarHBondContact O-N 3.49Å; A215-V268 WeakPolarHBondContact CA-O 3.21Å; A215-V268 HydrophobicContact CB-CG1 4.15Å; V216-V268 PolarHBondContact N-O 3.05Å; F229-V268 HydrophobicContact CZ-CG2 4.32Å
269	M	98.6	Very high	97.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	159.5	-174.7	63.1	-162	77.5	0	0	115.1	I162 I163 E165 V216 L267 Y273 G274 I277	I162-M269 HydrophobicContact CG2-CE 3.85Å; I162-M269 HydrophobicContact CG2-SD 4.31Å; I163-M269 PolarHBondContact O-N 3.46Å; E165-M269 PolarHBondContact N-O 3.4Å; V216-M269 HydrophobicContact CB-CB 4Å; V216-M269 HydrophobicContact CB-CE 4.11Å; V216-M269 HydrophobicContact CB-SD 4.44Å; V216-M269 HydrophobicContact CG2-CE 3.87Å; L267-M269 HydrophobicContact CB-CE 3.51Å; L267-M269 HydrophobicContact CD2-CE 4.28Å; M269-Y273 VanDerWaalsContact SD-C 3.56Å; M269-G274 WeakPolarHBondContact SD-CA 3.07Å; M269-G274 PolarHBondContact SD-N 3.21Å; M269-G274 VanDerWaalsContact SD-N 3.38Å; M269-I277 HydrophobicContact CE-CB 4.29Å; M269-I277 HydrophobicContact CE-CG1 4.41Å; M269-I277 HydrophobicContact CE-CG2 4.05Å; M269-I277 HydrophobicContact SD-CB 3.82Å; M269-I277 HydrophobicContact SD-CG1 3.82Å; M269-I277 HydrophobicContact SD-CG2 4.25Å
270	P	98.1	Very high	97	Very high	6 Å²	6	28.7 Å²	28.7	4%	0.039	14%	0.141	C	C	.	.			trans	-60.7	165.7	168	-21.8	33.3	0	0	0	113.3	V216 F229 L272 Y273 G274	V216-P270 WeakPolarHBondContact O-CD 3.38Å; F229-P270 HydrophobicContact CB-CG 4.39Å; F229-P270 HydrophobicContact CD1-CG 3.86Å; F229-P270 HydrophobicContact CD2-CG 3.98Å; F229-P270 HydrophobicContact CE1-CG 4.13Å; F229-P270 HydrophobicContact CE2-CG 4.22Å; F229-P270 HydrophobicContact CG-CG 3.79Å; F229-P270 HydrophobicContact CZ-CG 4.29Å; P270-L272 PolarHBondContact O-N 2.89Å; P270-Y273 HydrophobicContact CB-CD2 4.28Å; P270-Y273 HydrophobicContact CB-CE2 4.39Å; P270-Y273 HydrophobicContact CG-CD2 4.15Å; P270-Y273 HydrophobicContact CG-CE2 4.2Å; P270-Y273 PolarHBondContact O-N 2.84Å; P270-G274 PolarHBondContact O-N 3.46Å
271	N	96.2	Very high	97	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.011	12%	0.122	C	C	.	.	H	α-helix	trans	-57.3	-53.1	-165.3	-158.8	-21.8	0	0	0	115.4	R164 E165 Q166 E168 Y171 Y273 G274 N275	R164-N271 PolarHBondContact NE-O 3.13Å; R164-N271 PolarHBondContact NE-OD1 3.23Å; R164-N271 PolarHBondContact NH2-O 3.48Å; R164-N271 PolarHBondContact NH2-OD1 3.43Å; E165-N271 WeakPolarHBondContact O-CA 3.5Å; E165-N271 WeakPolarHBondContact O-CB 3.45Å; E165-N271 PolarHBondContact O-OD1 3.06Å; Q166-N271 WeakPolarHBondContact CA-ND2 3.25Å; Q166-N271 PolarHBondContact O-ND2 2.89Å; E168-N271 WeakPolarHBondContact O-CB 3.46Å; E168-N271 PolarHBondContact O-ND2 2.85Å; Y171-N271 VanDerWaalsContact CB-ND2 3.34Å; Y171-N271 WeakPolarHBondContact CB-ND2 3.28Å; Y171-N271 HydrophobicContact CD2-CB 4Å; Y171-N271 VanDerWaalsContact CD2-CG 3.45Å; Y171-N271 WeakPolarHBondContact CD2-OD1 3.43Å; N271-Y273 PolarHBondContact O-N 2.95Å; N271-G274 PolarHBondContact O-N 3.41Å; N271-N275 PolarHBondContact O-N 3.47Å
272	L	95.7	Very high	96.9	Very high	57 Å²	57	25.2 Å²	25.2	30%	0.298	12%	0.122	S	C	.	.	H	α-helix	trans	-64.1	-43.1	-177.5	179.5	62	0	0	0	113	E170 Y171 P270 G274 N275 I276	E170-L272 HydrophobicContact CB-CB 4.19Å; E170-L272 HydrophobicContact CB-CD2 4.27Å; E170-L272 HydrophobicContact CG-CB 4.02Å; E170-L272 HydrophobicContact CG-CD2 3.74Å; E170-L272 HydrophobicContact CG-CG 4.49Å; E170-L272 WeakPolarHBondContact OE2-CB 3.47Å; Y171-L272 HydrophobicContact CE2-CB 4.39Å; Y171-L272 HydrophobicContact CE2-CD1 4.24Å; P270-L272 PolarHBondContact O-N 2.89Å; L272-G274 VanDerWaalsContact C-N 3.31Å; L272-G274 PolarHBondContact O-N 3.34Å; L272-N275 WeakPolarHBondContact O-CB 3.3Å; L272-N275 PolarHBondContact O-N 3.27Å; L272-I276 HydrophobicContact CD1-CD1 4.38Å; L272-I276 HydrophobicContact CG-CD1 4.21Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 3.2Å
273	Y	96.3	Very high	96.9	Very high	16 Å²	16	21.8 Å²	21.8	6%	0.063	12%	0.124	C	C	.	.	H	α-helix	trans	-66.1	-39.1	-180	-50.4	-32	0	0	0	111.2	K187 M222 D226 I250 M269 P270 N271 N275 I276 I277	K187-Y273 PolarHBondContact NZ-OH 2.73Å; M222-Y273 WeakPolarHBondContact CE-OH 3.45Å; D226-Y273 WeakPolarHBondContact OD2-CE2 3.34Å; D226-Y273 PolarHBondContact OD2-OH 3.15Å; I250-Y273 HydrophobicContact CB-CG 4.45Å; I250-Y273 HydrophobicContact CD1-CG 4.42Å; I250-Y273 HydrophobicContact CG1-CD1 4.13Å; I250-Y273 HydrophobicContact CG1-CG 4.17Å; M269-Y273 VanDerWaalsContact SD-C 3.56Å; P270-Y273 HydrophobicContact CB-CD2 4.28Å; P270-Y273 HydrophobicContact CB-CE2 4.39Å; P270-Y273 HydrophobicContact CG-CD2 4.15Å; P270-Y273 HydrophobicContact CG-CE2 4.2Å; P270-Y273 PolarHBondContact O-N 2.84Å; N271-Y273 PolarHBondContact O-N 2.95Å; Y273-N275 VanDerWaalsContact C-N 3.31Å; Y273-N275 PolarHBondContact O-N 3.38Å; Y273-I276 PolarHBondContact O-N 3.21Å; Y273-I276 VanDerWaalsContact O-N 3.13Å; Y273-I277 WeakPolarHBondContact O-CB 3.16Å; Y273-I277 WeakPolarHBondContact O-CG1 3.42Å; Y273-I277 PolarHBondContact O-N 3.35Å
274	G	94.9	Very high	96.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-52.3	-51	172.4	0	0	0	0	0	111.4	M269 P270 N271 L272 I276 I277 D278	M269-G274 WeakPolarHBondContact SD-CA 3.07Å; M269-G274 PolarHBondContact SD-N 3.21Å; M269-G274 VanDerWaalsContact SD-N 3.38Å; P270-G274 PolarHBondContact O-N 3.46Å; N271-G274 PolarHBondContact O-N 3.41Å; L272-G274 VanDerWaalsContact C-N 3.31Å; L272-G274 PolarHBondContact O-N 3.34Å; G274-I276 VanDerWaalsContact C-N 3.28Å; G274-I276 PolarHBondContact O-N 3.23Å; G274-I277 PolarHBondContact O-N 3.19Å; G274-D278 WeakPolarHBondContact O-CB 3.27Å; G274-D278 PolarHBondContact O-N 2.64Å; G274-D278 VanDerWaalsContact O-OD2 3.06Å
275	N	93.4	Very high	96.7	Very high	47 Å²	47	19.5 Å²	19.5	25%	0.251	11%	0.114	S	C	.	.	H	α-helix	trans	-57.1	-41.5	178.9	-158.6	54.4	0	0	0	113.5	R164 Y171 N271 L272 Y273 N279	R164-N275 VanDerWaalsContact CZ-CB 3.49Å; R164-N275 VanDerWaalsContact NH1-CB 3.27Å; R164-N275 PolarHBondContact NH1-OD1 3.36Å; Y171-N275 PolarHBondContact OH-ND2 2.98Å; N271-N275 PolarHBondContact O-N 3.47Å; L272-N275 WeakPolarHBondContact O-CB 3.3Å; L272-N275 PolarHBondContact O-N 3.27Å; Y273-N275 VanDerWaalsContact C-N 3.31Å; Y273-N275 PolarHBondContact O-N 3.38Å; N275-N279 PolarHBondContact O-N 2.91Å; N275-N279 PolarHBondContact O-ND2 2.81Å
276	I	96	Very high	96.5	Very high	79 Å²	79	19 Å²	19	41%	0.405	12%	0.115	S	C	.	.	H	α-helix	trans	-70	-47.7	-178.8	-64.8	167.3	0	0	0	109.9	L272 Y273 G274 N279 L280	L272-I276 HydrophobicContact CD1-CD1 4.38Å; L272-I276 HydrophobicContact CG-CD1 4.21Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 3.2Å; Y273-I276 PolarHBondContact O-N 3.21Å; Y273-I276 VanDerWaalsContact O-N 3.13Å; G274-I276 VanDerWaalsContact C-N 3.28Å; G274-I276 PolarHBondContact O-N 3.23Å; I276-N279 PolarHBondContact O-N 2.92Å; I276-L280 PolarHBondContact O-N 2.82Å
277	I	97.3	Very high	96.3	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-38.2	-178.5	-65.9	-57	0	0	0	111.6	I162 I250 L257 M269 Y273 G274 N279 L280 A281	I162-I277 HydrophobicContact CD1-CG2 3.68Å; I162-I277 HydrophobicContact CG1-CG2 4Å; I162-I277 HydrophobicContact CG2-CG2 4.43Å; I250-I277 HydrophobicContact CD1-CD1 3.53Å; I250-I277 HydrophobicContact CD1-CG1 3.51Å; L257-I277 HydrophobicContact CD1-CD1 3.75Å; L257-I277 HydrophobicContact CD1-CG2 3.85Å; M269-I277 HydrophobicContact CE-CB 4.29Å; M269-I277 HydrophobicContact CE-CG1 4.41Å; M269-I277 HydrophobicContact CE-CG2 4.05Å; M269-I277 HydrophobicContact SD-CB 3.82Å; M269-I277 HydrophobicContact SD-CG1 3.82Å; M269-I277 HydrophobicContact SD-CG2 4.25Å; Y273-I277 WeakPolarHBondContact O-CB 3.16Å; Y273-I277 WeakPolarHBondContact O-CG1 3.42Å; Y273-I277 PolarHBondContact O-N 3.35Å; G274-I277 PolarHBondContact O-N 3.19Å; I277-N279 VanDerWaalsContact C-N 3.31Å; I277-N279 PolarHBondContact O-N 2.85Å; I277-L280 PolarHBondContact O-N 3.43Å; I277-A281 WeakPolarHBondContact O-CB 3.5Å; I277-A281 PolarHBondContact O-N 3.24Å
278	D	95.1	Very high	96	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-54.5	-47.8	173.7	-70.8	-28.6	0	0	0	111	V143 I162 R164 G274 A282	V143-D278 HydrophobicContact CG2-CB 4.49Å; V143-D278 WeakPolarHBondContact CG2-OD1 3.32Å; I162-D278 WeakPolarHBondContact CB-OD1 3.45Å; I162-D278 WeakPolarHBondContact CG2-OD1 3.31Å; R164-D278 IonicContact NH1-OD2 2.97Å; G274-D278 WeakPolarHBondContact O-CB 3.27Å; G274-D278 PolarHBondContact O-N 2.64Å; G274-D278 VanDerWaalsContact O-OD2 3.06Å; D278-A282 VanDerWaalsContact O-CB 3.26Å; D278-A282 WeakPolarHBondContact O-CB 3.43Å; D278-A282 PolarHBondContact O-N 3Å
279	N	95.3	Very high	95.8	Very high	54 Å²	54	22.2 Å²	22.2	29%	0.289	15%	0.146	S	C	.	.	H	α-helix	trans	-70.1	-43.5	-179.7	-79.3	-79.3	0	0	0	112.5	N275 I276 I277 A282 G283 H309	N275-N279 PolarHBondContact O-N 2.91Å; N275-N279 PolarHBondContact O-ND2 2.81Å; I276-N279 PolarHBondContact O-N 2.92Å; I277-N279 VanDerWaalsContact C-N 3.31Å; I277-N279 PolarHBondContact O-N 2.85Å; N279-A282 PolarHBondContact O-N 3Å; N279-G283 PolarHBondContact O-N 2.88Å; N279-G283 VanDerWaalsContact O-N 3.16Å; N279-H309 PolarHBondContact OD1-NE2 2.96Å
280	L	96.9	Very high	95.6	Very high	48 Å²	48	22.5 Å²	22.5	25%	0.251	15%	0.147	S	C	.	.	H	α-helix	trans	-60.2	-48.7	177.2	-177.4	151.6	0	0	0	110.5	C254 L257 V258 I276 I277 G283 L284	C254-L280 HydrophobicContact CB-CD1 4.12Å; L257-L280 HydrophobicContact CB-CD2 3.53Å; L257-L280 HydrophobicContact CD1-CD2 3.82Å; L257-L280 HydrophobicContact CG-CD2 4.27Å; V258-L280 HydrophobicContact CG2-CD2 4.44Å; I276-L280 PolarHBondContact O-N 2.82Å; I277-L280 PolarHBondContact O-N 3.43Å; L280-G283 PolarHBondContact O-N 3.07Å; L280-G283 VanDerWaalsContact O-N 3.14Å; L280-L284 HydrophobicContact CD2-CD1 4.3Å; L280-L284 PolarHBondContact O-N 3.43Å
281	A	96.8	Very high	95.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-70	-34.6	-176.9	0	0	0	0	0	112.1	V145 I162 I277 G283 L284	V145-A281 HydrophobicContact CB-CB 4.39Å; V145-A281 HydrophobicContact CG1-CB 3.97Å; V145-A281 WeakPolarHBondContact CG1-O 3.16Å; V145-A281 HydrophobicContact CG2-CB 3.72Å; I162-A281 HydrophobicContact CD1-CB 3.59Å; I277-A281 WeakPolarHBondContact O-CB 3.5Å; I277-A281 PolarHBondContact O-N 3.24Å; A281-G283 VanDerWaalsContact C-N 3.26Å; A281-G283 PolarHBondContact O-N 3.41Å; A281-L284 WeakPolarHBondContact O-CB 3.34Å; A281-L284 PolarHBondContact O-N 3.18Å
282	A	96.4	Very high	95.7	Very high	2 Å²	2	22.7 Å²	22.7	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-38.9	170.1	0	0	0	0	0	112.1	D278 N279 L284 V285 G286 G287 V291 A307	D278-A282 VanDerWaalsContact O-CB 3.26Å; D278-A282 WeakPolarHBondContact O-CB 3.43Å; D278-A282 PolarHBondContact O-N 3Å; N279-A282 PolarHBondContact O-N 3Å; A282-L284 PolarHBondContact O-N 3.1Å; A282-V285 PolarHBondContact O-N 2.68Å; A282-G286 PolarHBondContact O-N 3.36Å; A282-G287 WeakPolarHBondContact O-CA 3.32Å; A282-G287 PolarHBondContact O-N 3.08Å; A282-V291 HydrophobicContact CB-CB 4.3Å; A282-V291 HydrophobicContact CB-CG2 3.77Å; A282-A307 HydrophobicContact CB-CB 3.99Å
283	G	96.2	Very high	95.7	Very high	51 Å²	51	20 Å²	20	53%	0.526	14%	0.135	S	C	.	.	H	α-helix	trans	-58.7	-32.3	172.9	0	0	0	0	0	114	N279 L280 A281	N279-G283 PolarHBondContact O-N 2.88Å; N279-G283 VanDerWaalsContact O-N 3.16Å; L280-G283 PolarHBondContact O-N 3.07Å; L280-G283 VanDerWaalsContact O-N 3.14Å; A281-G283 VanDerWaalsContact C-N 3.26Å; A281-G283 PolarHBondContact O-N 3.41Å
284	L	96.6	Very high	95.8	Very high	18 Å²	18	19.8 Å²	19.8	9%	0.094	13%	0.134	C	C	.	.	H	α-helix	trans	-69.3	-34	-179.8	-55.8	177.5	0	0	0	112.8	T153 L158 L257 P261 L280 A281 A282	T153-L284 WeakPolarHBondContact CB-O 3.3Å; T153-L284 PolarHBondContact OG1-O 2.94Å; L158-L284 HydrophobicContact CD1-CB 3.84Å; L158-L284 HydrophobicContact CD1-CD1 4.38Å; L257-L284 HydrophobicContact CB-CD1 4.27Å; L257-L284 HydrophobicContact CD2-CD1 4.34Å; L257-L284 VanDerWaalsContact O-CD1 3.3Å; L257-L284 WeakPolarHBondContact O-CD1 3.43Å; P261-L284 HydrophobicContact CB-CD1 4.12Å; L280-L284 HydrophobicContact CD2-CD1 4.3Å; L280-L284 PolarHBondContact O-N 3.43Å; A281-L284 WeakPolarHBondContact O-CB 3.34Å; A281-L284 PolarHBondContact O-N 3.18Å; A282-L284 PolarHBondContact O-N 3.1Å
285	V	96.6	Very high	95.9	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.012	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	8.3	-176.5	-61.5	0	0	0	0	113.8	V145 L158 A282 V291	V145-V285 HydrophobicContact CG1-CB 4.38Å; V145-V285 HydrophobicContact CG1-CG1 3.55Å; V145-V285 HydrophobicContact CG1-CG2 3.89Å; L158-V285 HydrophobicContact CB-CG1 4.09Å; L158-V285 HydrophobicContact CD1-CG1 4Å; A282-V285 PolarHBondContact O-N 2.68Å; V285-V291 HydrophobicContact CG2-CG2 3.45Å; V285-V291 VanDerWaalsContact CG2-CG2 3.45Å
286	G	93.3	Very high	96.2	Very high	15 Å²	15	19.4 Å²	19.4	16%	0.155	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	113.7	10.5	167.5	0	0	0	0	0	115.6	Y151 A282	Y151-G286 PolarHBondContact OH-O 2.91Å; A282-G286 PolarHBondContact O-N 3.36Å
287	G	94.1	Very high	96.2	Very high	21 Å²	21	16.5 Å²	16.5	22%	0.216	12%	0.116	C	C	.	.			trans	111.8	179.9	167.1	0	0	0	0	0	114.6	A282 G289 V290	A282-G287 WeakPolarHBondContact O-CA 3.32Å; A282-G287 PolarHBondContact O-N 3.08Å; G287-G289 PolarHBondContact O-N 2.89Å; G287-V290 VanDerWaalsContact O-CG2 3.3Å; G287-V290 WeakPolarHBondContact O-CG2 3.33Å; G287-V290 PolarHBondContact O-N 2.91Å
288	A	92.9	Very high	96.1	Very high	31 Å²	31	21.1 Å²	21.1	26%	0.256	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-61.7	-29	-176.1	0	0	0	0	0	114	V290 A307	A288-V290 PolarHBondContact O-N 3.5Å; A288-V290 VanDerWaalsContact O-N 3.15Å; A288-A307 HydrophobicContact CB-CB 3.56Å
289	G	94.6	Very high	96.2	Very high	17 Å²	17	27.3 Å²	27.3	18%	0.175	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-67	-11.3	-176.8	0	0	0	0	0	115	G287 T323 A324	G287-G289 PolarHBondContact O-N 2.89Å; G289-T323 WeakPolarHBondContact O-CB 3.18Å; G289-A324 VanDerWaalsContact O-CB 3.29Å; G289-A324 WeakPolarHBondContact O-CB 3.38Å; G289-A324 PolarHBondContact O-N 2.76Å
290	V	96.1	Very high	96.3	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.03	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-121.5	-6.1	-174.3	-62	0	0	0	0	115.1	L148 Y151 G287 A288 P292 T323 M363	L148-V290 HydrophobicContact CD1-CB 3.8Å; L148-V290 HydrophobicContact CD1-CG1 4.09Å; Y151-V290 HydrophobicContact CD1-CG1 4.49Å; Y151-V290 HydrophobicContact CE1-CG1 4.11Å; Y151-V290 HydrophobicContact CE1-CG2 4.35Å; G287-V290 VanDerWaalsContact O-CG2 3.3Å; G287-V290 WeakPolarHBondContact O-CG2 3.33Å; G287-V290 PolarHBondContact O-N 2.91Å; A288-V290 PolarHBondContact O-N 3.5Å; A288-V290 VanDerWaalsContact O-N 3.15Å; V290-P292 WeakPolarHBondContact O-CD 3.29Å; V290-T323 HydrophobicContact CB-CG2 4.15Å; V290-T323 HydrophobicContact CG1-CG2 4.03Å; V290-M363 HydrophobicContact CG1-CG 4.36Å; V290-M363 HydrophobicContact CG1-SD 3.93Å
291	V	97.1	Very high	96.4	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	17%	0.165	C	C	.	.			trans	-100.8	115.6	-174	179.9	0	0	0	0	111.1	V143 A282 V285 G306 A324	V143-V291 HydrophobicContact CG1-CG1 3.43Å; V143-V291 VanDerWaalsContact CG1-CG1 3.43Å; A282-V291 HydrophobicContact CB-CB 4.3Å; A282-V291 HydrophobicContact CB-CG2 3.77Å; V285-V291 HydrophobicContact CG2-CG2 3.45Å; V285-V291 VanDerWaalsContact CG2-CG2 3.45Å; V291-G306 PolarHBondContact O-N 2.9Å; V291-A324 WeakPolarHBondContact O-CB 3.44Å
292	P	97.5	Very high	96.5	Very high	12 Å²	12	24.4 Å²	24.4	8%	0.078	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	153.5	174.7	33.1	-33.6	0	0	0	112	H144 V290 L327 S328	H144-P292 HydrophobicContact CB-CG 4.2Å; H144-P292 PolarHBondContact N-O 2.96Å; V290-P292 WeakPolarHBondContact O-CD 3.29Å; P292-L327 HydrophobicContact CB-CB 3.86Å; P292-L327 HydrophobicContact CG-CB 3.95Å; P292-S328 VanDerWaalsContact CA-OG 3.25Å; P292-S328 WeakPolarHBondContact CA-OG 3.45Å; P292-S328 WeakPolarHBondContact CB-OG 3.22Å
293	G	97.1	Very high	96.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.6	-179.6	0	0	0	0	0	112.6	V142 E304 S328	V142-G293 CarbonylContact O-C 3.57Å; V142-G293 WeakPolarHBondContact O-CA 3.37Å; G293-E304 CarbonylContact C-O 3.59Å; G293-E304 WeakPolarHBondContact CA-O 3Å; G293-E304 PolarHBondContact N-O 2.87Å; G293-E304 PolarHBondContact O-N 3.38Å; G293-S328 PolarHBondContact N-OG 3.37Å
294	E	97.5	Very high	96.6	Very high	11 Å²	11	22 Å²	22	5%	0.051	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	143.7	-175.8	-51.5	172.5	-175.6	0	0	108.3	N141 V142 H144 Y296 V302 F303 N331	N141-E294 CarbonylContact C-O 3.56Å; N141-E294 WeakPolarHBondContact CA-O 3.44Å; N141-E294 PolarHBondContact ND2-O 2.91Å; V142-E294 HydrophobicContact CB-CB 4.37Å; V142-E294 PolarHBondContact N-O 3.23Å; V142-E294 PolarHBondContact O-N 3.28Å; H144-E294 IonicContact CD2-OE1 2.8Å; H144-E294 IonicContact NE2-OE1 3.4Å; H144-E294 PolarHBondContact NE2-OE1 3.43Å; H144-E294 IonicContact NE2-OE2 3.78Å; E294-Y296 HydrophobicContact CB-CD2 4.35Å; E294-Y296 HydrophobicContact CB-CE2 3.59Å; E294-Y296 VanDerWaalsContact OE2-CE2 3.26Å; E294-Y296 WeakPolarHBondContact OE2-CE2 3.36Å; E294-Y296 VanDerWaalsContact OE2-CZ 3.23Å; E294-Y296 PolarHBondContact OE2-OH 2.69Å; E294-V302 CarbonylContact C-O 3.51Å; E294-F303 HydrophobicContact CB-CD1 4.41Å; E294-F303 HydrophobicContact CB-CE1 4.36Å; E294-F303 HydrophobicContact CG-CD1 3.84Å; E294-F303 HydrophobicContact CG-CE1 3.86Å; E294-N331 WeakPolarHBondContact OE1-CB 3.45Å; E294-N331 PolarHBondContact OE1-ND2 3.28Å
295	S	97.8	Very high	96.5	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.5	175.2	-58.9	0	0	0	0	108.9	R133 A140 N141 Q166 V302 E304	R133-S295 PolarHBondContact NH1-OG 3.27Å; A140-S295 CarbonylContact O-C 3.39Å; A140-S295 WeakPolarHBondContact O-CA 3.08Å; N141-S295 PolarHBondContact ND2-OG 2.87Å; Q166-S295 PolarHBondContact OE1-OG 3.27Å; S295-V302 PolarHBondContact N-O 3.38Å; S295-V302 PolarHBondContact O-N 2.88Å; S295-E304 PolarHBondContact OG-OE1 3.25Å
296	Y	98.3	Very high	96.2	Very high	40 Å²	40	22 Å²	22	16%	0.157	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.1	-173.1	-67.3	-75.8	0	0	0	111.5	L138 F139 A140 V142 F200 E294 A301 H335	L138-Y296 CarbonylContact C-O 3.6Å; L138-Y296 WeakPolarHBondContact CA-O 3.19Å; F139-Y296 PolarHBondContact N-O 2.87Å; A140-Y296 PolarHBondContact N-O 2.94Å; A140-Y296 VanDerWaalsContact N-O 3.17Å; A140-Y296 PolarHBondContact O-N 3Å; V142-Y296 HydrophobicContact CB-CE2 4.38Å; V142-Y296 HydrophobicContact CG2-CD2 3.88Å; V142-Y296 HydrophobicContact CG2-CE2 3.91Å; F200-Y296 HydrophobicContact CE2-CD2 4.32Å; F200-Y296 HydrophobicContact CE2-CG 4.31Å; F200-Y296 AromaticContact CZ-CD2 3.71Å; F200-Y296 HydrophobicContact CZ-CD2 3.71Å; F200-Y296 HydrophobicContact CZ-CE2 4.38Å; F200-Y296 HydrophobicContact CZ-CG 4.16Å; E294-Y296 HydrophobicContact CB-CD2 4.35Å; E294-Y296 HydrophobicContact CB-CE2 3.59Å; E294-Y296 VanDerWaalsContact OE2-CE2 3.26Å; E294-Y296 WeakPolarHBondContact OE2-CE2 3.36Å; E294-Y296 VanDerWaalsContact OE2-CZ 3.23Å; E294-Y296 PolarHBondContact OE2-OH 2.69Å; Y296-A301 HydrophobicContact CD1-CB 3.95Å; Y296-A301 HydrophobicContact CE1-CB 3.93Å; Y296-H335 AromaticContact CE1-ND1 3.82Å
297	S	97.4	Very high	95.8	Very high	18 Å²	18	21.3 Å²	21.3	13%	0.126	13%	0.134	C	C	.	.			trans	-112.5	-171.6	158.5	78.4	0	0	0	0	110	L136 D137 E299 Y300	L136-S297 VanDerWaalsContact O-CB 3.25Å; L136-S297 WeakPolarHBondContact O-CB 3.21Å; L136-S297 PolarHBondContact O-OG 3.44Å; D137-S297 WeakPolarHBondContact O-CA 2.89Å; D137-S297 WeakPolarHBondContact O-CB 3.25Å; S297-E299 VanDerWaalsContact C-N 3.26Å; S297-E299 PolarHBondContact OG-N 3.06Å; S297-E299 VanDerWaalsContact OG-N 3.15Å; S297-Y300 PolarHBondContact N-O 2.97Å; S297-Y300 WeakPolarHBondContact OG-CB 3.24Å; S297-Y300 VanDerWaalsContact OG-CD2 3.31Å; S297-Y300 WeakPolarHBondContact OG-CD2 3.29Å; S297-Y300 PolarHBondContact OG-N 3.06Å; S297-Y300 PolarHBondContact OG-O 2.98Å
298	A	95.4	Very high	95.3	Very high	96 Å²	96	21.8 Å²	21.8	79%	0.793	13%	0.13	S	C	*	.	S	Bend	trans	-67.4	-26.8	171.1	0	0	0	0	0	113
299	E	95.9	Very high	94.9	Very high	131 Å²	131	25 Å²	25	61%	0.612	14%	0.139	S	C	*	.	S	Bend	trans	-120.6	-22.7	-171.9	-67.1	-176.3	-152.2	0	0	114	S297	S297-E299 VanDerWaalsContact C-N 3.26Å; S297-E299 PolarHBondContact OG-N 3.06Å; S297-E299 VanDerWaalsContact OG-N 3.15Å
300	Y	97.9	Very high	94.3	Very high	39 Å²	39	25.4 Å²	25.4	15%	0.153	14%	0.139	C	C	.	.			trans	-125.8	150.8	-168.4	-42.9	-54	0	0	0	111.6	K105 K108 L136 S297	K105-Y300 HydrophobicContact CB-CE1 4.48Å; K105-Y300 HydrophobicContact CG-CE1 4.41Å; K105-Y300 HydrophobicContact CG-CE2 4.48Å; K108-Y300 HydrophobicContact CB-CD1 4.15Å; K108-Y300 HydrophobicContact CG-CD1 4.24Å; K108-Y300 HydrophobicContact CG-CE1 4.4Å; K108-Y300 CarbonylContact O-C 3.53Å; K108-Y300 VanDerWaalsContact O-CA 3.24Å; K108-Y300 WeakPolarHBondContact O-CA 3.41Å; L136-Y300 HydrophobicContact CB-CD2 3.97Å; L136-Y300 HydrophobicContact CB-CE2 4.44Å; L136-Y300 HydrophobicContact CD2-CD2 3.81Å; L136-Y300 HydrophobicContact CD2-CE2 3.83Å; L136-Y300 HydrophobicContact CG-CD2 4.44Å; L136-Y300 WeakPolarHBondContact O-CD2 3.36Å; S297-Y300 PolarHBondContact N-O 2.97Å; S297-Y300 WeakPolarHBondContact OG-CB 3.24Å; S297-Y300 VanDerWaalsContact OG-CD2 3.31Å; S297-Y300 WeakPolarHBondContact OG-CD2 3.29Å; S297-Y300 PolarHBondContact OG-N 3.06Å; S297-Y300 PolarHBondContact OG-O 2.98Å
301	A	98.3	Very high	93.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	129.7	172.6	0	0	0	0	0	110.8	K108 V109 A110 Y296 F303 H335	K108-A301 PolarHBondContact O-N 3.35Å; V109-A301 WeakPolarHBondContact CA-O 3.2Å; A110-A301 PolarHBondContact N-O 3.02Å; Y296-A301 HydrophobicContact CD1-CB 3.95Å; Y296-A301 HydrophobicContact CE1-CB 3.93Å; A301-F303 HydrophobicContact CB-CE2 3.78Å; A301-F303 HydrophobicContact CB-CZ 4.12Å; A301-H335 WeakPolarHBondContact CB-NE2 3.14Å
302	V	98.4	Very high	93.1	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125	-178.8	179.9	0	0	0	0	110.1	A110 I112 L138 E294 S295	A110-V302 HydrophobicContact CB-CG1 4.5Å; A110-V302 HydrophobicContact CB-CG2 4.18Å; A110-V302 CarbonylContact O-C 3.58Å; A110-V302 WeakPolarHBondContact O-CA 3.08Å; I112-V302 HydrophobicContact CB-CG1 4.35Å; I112-V302 HydrophobicContact CD1-CG1 3.69Å; I112-V302 HydrophobicContact CG1-CG1 3.69Å; I112-V302 HydrophobicContact CG2-CG1 3.77Å; L138-V302 HydrophobicContact CD1-CB 4.03Å; L138-V302 HydrophobicContact CD1-CG2 3.57Å; L138-V302 HydrophobicContact CD2-CB 4.49Å; L138-V302 HydrophobicContact CD2-CG2 3.93Å; L138-V302 HydrophobicContact CG-CG2 4.42Å; E294-V302 CarbonylContact C-O 3.51Å; S295-V302 PolarHBondContact N-O 3.38Å; S295-V302 PolarHBondContact O-N 2.88Å
303	F	98.4	Very high	92.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.3	-176.4	-62.9	-90.9	0	0	0	110.6	V109 A110 I111 I112 E294 A301 S328 N331 M332 H335	V109-F303 HydrophobicContact CG1-CD2 4.24Å; V109-F303 HydrophobicContact CG1-CE2 4.02Å; A110-F303 PolarHBondContact O-N 2.83Å; I111-F303 CarbonylContact C-O 3.57Å; I111-F303 WeakPolarHBondContact CA-O 3.43Å; I111-F303 HydrophobicContact CG1-CB 4.31Å; I111-F303 WeakPolarHBondContact CG1-O 3.43Å; I112-F303 PolarHBondContact N-O 3.17Å; E294-F303 HydrophobicContact CB-CD1 4.41Å; E294-F303 HydrophobicContact CB-CE1 4.36Å; E294-F303 HydrophobicContact CG-CD1 3.84Å; E294-F303 HydrophobicContact CG-CE1 3.86Å; A301-F303 HydrophobicContact CB-CE2 3.78Å; A301-F303 HydrophobicContact CB-CZ 4.12Å; F303-S328 WeakPolarHBondContact CD1-O 3.2Å; F303-N331 HydrophobicContact CD1-CB 4.11Å; F303-N331 HydrophobicContact CE1-CB 4.02Å; F303-M332 HydrophobicContact CB-CB 4.17Å; F303-M332 HydrophobicContact CD1-CB 3.87Å; F303-M332 HydrophobicContact CD2-CB 3.47Å; F303-M332 VanDerWaalsContact CD2-CB 3.47Å; F303-M332 HydrophobicContact CD2-CG 3.48Å; F303-M332 VanDerWaalsContact CD2-CG 3.48Å; F303-M332 HydrophobicContact CD2-SD 4.35Å; F303-M332 HydrophobicContact CE1-CB 4.18Å; F303-M332 HydrophobicContact CE2-CB 3.8Å; F303-M332 HydrophobicContact CE2-CG 3.75Å; F303-M332 HydrophobicContact CG-CB 3.53Å; F303-M332 HydrophobicContact CG-CG 4.06Å; F303-M332 HydrophobicContact CZ-CB 4.17Å; F303-H335 HydrophobicContact CE1-CB 4.42Å; F303-H335 HydrophobicContact CE2-CB 4.16Å; F303-H335 HydrophobicContact CZ-CB 3.52Å; F303-H335 AromaticContact CZ-CG 3.87Å
304	E	96.6	Very high	92.1	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.019	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	176.8	-173.6	61.7	-176.5	140.8	0	0	111.2	I112 R133 G293 S295 R308 S328	I112-E304 HydrophobicContact CG1-CB 3.78Å; I112-E304 WeakPolarHBondContact O-CB 3.34Å; R133-E304 IonicContact CZ-OE1 3.69Å; R133-E304 VanDerWaalsContact CZ-OE1 3.32Å; R133-E304 IonicContact CZ-OE2 3.38Å; R133-E304 IonicContact NH1-OE1 2.76Å; R133-E304 PolarHBondContact NH1-OE1 3.36Å; R133-E304 IonicContact NH1-OE2 2.58Å; R133-E304 VanDerWaalsContact NH2-CD 3.31Å; R133-E304 IonicContact NH2-OE1 3.99Å; R133-E304 PolarHBondContact NH2-OE1 2.93Å; R133-E304 IonicContact NH2-OE2 3.95Å; R133-E304 PolarHBondContact NH2-OE2 3.35Å; G293-E304 CarbonylContact C-O 3.59Å; G293-E304 WeakPolarHBondContact CA-O 3Å; G293-E304 PolarHBondContact N-O 2.87Å; G293-E304 PolarHBondContact O-N 3.38Å; S295-E304 PolarHBondContact OG-OE1 3.25Å; E304-R308 VanDerWaalsContact CD-NE 3.3Å; E304-R308 IonicContact OE1-CZ 2.91Å; E304-R308 IonicContact OE1-NE 2.63Å; E304-R308 PolarHBondContact OE1-NE 2.91Å; E304-R308 IonicContact OE1-NH2 3.35Å; E304-R308 PolarHBondContact OE1-NH2 2.92Å; E304-R308 WeakPolarHBondContact OE2-CD 3.45Å; E304-R308 IonicContact OE2-CZ 2.69Å; E304-R308 IonicContact OE2-NE 3.82Å; E304-R308 PolarHBondContact OE2-NE 3.2Å; E304-R308 IonicContact OE2-NH2 3.15Å; E304-S328 WeakPolarHBondContact O-CB 3.34Å; E304-S328 PolarHBondContact O-OG 3.33Å
305	T	95.2	Very high	91.7	Very high	16 Å²	16	41.3 Å²	41.3	10%	0.098	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	138.1	170.8	55.2	0	0	0	0	110.7	A307 A324 M325	T305-A307 PolarHBondContact O-N 3.31Å; T305-A307 PolarHBondContact OG1-O 3.24Å; T305-A324 HydrophobicContact CG2-CB 3.86Å; T305-M325 HydrophobicContact CG2-CE 3.93Å
306	G	89.2	Confident	91.4	Very high	2 Å²	2	44.8 Å²	44.8	2%	0.021	26%	0.262	C	S	.	.	S	Bend	trans	-63.6	-39.6	-178.4	0	0	0	0	0	113.3	V291	V291-G306 PolarHBondContact O-N 2.9Å
307	A	85.8	Confident	91.2	Very high	2 Å²	2	50.8 Å²	50.8	2%	0.017	29%	0.285	C	S	.	.	S	Bend	trans	-101.8	113.8	169.2	0	0	0	0	0	110.1	A282 A288 T305 H309	A282-A307 HydrophobicContact CB-CB 3.99Å; A288-A307 HydrophobicContact CB-CB 3.56Å; T305-A307 PolarHBondContact O-N 3.31Å; T305-A307 PolarHBondContact OG1-O 3.24Å; A307-H309 PolarHBondContact O-N 3.35Å; A307-H309 VanDerWaalsContact O-N 3.1Å
308	R	83.4	Confident	91.1	Very high	31 Å²	31	52.3 Å²	52.3	12%	0.117	29%	0.291	C	S	.	.			trans	-86.2	78	-167.1	-63.8	179.4	-179	109.4	8.3	112.9	K114 R133 N141 E304	K114-R308 HydrophobicContact CD-CB 4.14Å; R133-R308 VanDerWaalsContact NH1-NH2 3.14Å; R133-R308 VanDerWaalsContact NH2-NE 3.1Å; N141-R308 PolarHBondContact ND2-NH2 2.9Å; N141-R308 PolarHBondContact OD1-NH1 3.34Å; N141-R308 PolarHBondContact OD1-NH2 3.47Å; E304-R308 VanDerWaalsContact CD-NE 3.3Å; E304-R308 IonicContact OE1-CZ 2.91Å; E304-R308 IonicContact OE1-NE 2.63Å; E304-R308 PolarHBondContact OE1-NE 2.91Å; E304-R308 IonicContact OE1-NH2 3.35Å; E304-R308 PolarHBondContact OE1-NH2 2.92Å; E304-R308 WeakPolarHBondContact OE2-CD 3.45Å; E304-R308 IonicContact OE2-CZ 2.69Å; E304-R308 IonicContact OE2-NE 3.82Å; E304-R308 PolarHBondContact OE2-NE 3.2Å; E304-R308 IonicContact OE2-NH2 3.15Å
309	H	84.4	Confident	91.1	Very high	98 Å²	98	50.1 Å²	50.1	45%	0.454	27%	0.266	S	S	.	.			trans	-111.4	130.1	177.3	-66.2	-75	0	0	0	111.6	N279 A307 F311	N279-H309 PolarHBondContact OD1-NE2 2.96Å; A307-H309 PolarHBondContact O-N 3.35Å; A307-H309 VanDerWaalsContact O-N 3.1Å; H309-F311 VanDerWaalsContact C-N 3.29Å; H309-F311 PolarHBondContact O-N 3.01Å
310	P	81.5	Confident	91.1	Very high	26 Å²	26	44 Å²	44	17%	0.169	24%	0.237	C	C	.	.			trans	-73.3	-22.9	177.3	29.7	-34.3	0	0	0	112.6	G58 V59 K114 A312	G58-P310 CarbonylContact C-O 3.57Å; G58-P310 VanDerWaalsContact CA-O 3.28Å; G58-P310 WeakPolarHBondContact CA-O 3.33Å; V59-P310 PolarHBondContact N-O 3.48Å; K114-P310 HydrophobicContact CG-CB 4.14Å; P310-A312 VanDerWaalsContact C-N 3.28Å; P310-A312 PolarHBondContact O-N 2.91Å
311	F	87.2	Confident	91	Very high	82 Å²	82	42.6 Å²	42.6	36%	0.36	23%	0.233	S	C	.	.			trans	47.8	46.2	-176	-164.8	-164.6	0	0	0	113.3	V59 H309 Q313 A314	V59-F311 HydrophobicContact CG1-CB 4.09Å; V59-F311 HydrophobicContact CG1-CD1 4.19Å; V59-F311 HydrophobicContact CG1-CG 4.36Å; V59-F311 HydrophobicContact CG2-CB 4.05Å; H309-F311 VanDerWaalsContact C-N 3.29Å; H309-F311 PolarHBondContact O-N 3.01Å; F311-Q313 HydrophobicContact CD2-CG 3.71Å; F311-Q313 HydrophobicContact CE2-CG 3.56Å; F311-Q313 PolarHBondContact O-N 3.04Å; F311-A314 HydrophobicContact CD1-CB 3.58Å; F311-A314 HydrophobicContact CD2-CB 3.91Å; F311-A314 HydrophobicContact CE1-CB 3.51Å; F311-A314 HydrophobicContact CE2-CB 3.83Å; F311-A314 HydrophobicContact CG-CB 3.79Å; F311-A314 HydrophobicContact CZ-CB 3.64Å; F311-A314 WeakPolarHBondContact O-CB 3.35Å; F311-A314 PolarHBondContact O-N 3.11Å
312	A	82.4	Confident	91	Very high	64 Å²	64	42.6 Å²	42.6	53%	0.529	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-53.3	-32.4	-169.9	0	0	0	0	0	114.7	P310 A314 V315	P310-A312 VanDerWaalsContact C-N 3.28Å; P310-A312 PolarHBondContact O-N 2.91Å; A312-A314 PolarHBondContact O-N 3.37Å; A312-V315 WeakPolarHBondContact O-CB 3.3Å; A312-V315 WeakPolarHBondContact O-CG2 3.44Å; A312-V315 PolarHBondContact O-N 3.29Å
313	Q	86.1	Confident	90.9	Very high	139 Å²	139	42.5 Å²	42.5	65%	0.65	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-67	-13.1	177.4	66.6	-146.5	17.7	0	0	115.2	F311 R317	F311-Q313 HydrophobicContact CD2-CG 3.71Å; F311-Q313 HydrophobicContact CE2-CG 3.56Å; F311-Q313 PolarHBondContact O-N 3.04Å; Q313-R317 WeakPolarHBondContact O-CD 3.46Å; Q313-R317 PolarHBondContact O-NE 3.42Å; Q313-R317 VanDerWaalsContact O-NE 3.12Å; Q313-R317 PolarHBondContact O-NH1 3.06Å
314	A	86.4	Confident	90.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-99.1	-2.3	178.4	0	0	0	0	0	113.8	V59 F311 A312 G316 R317 I319	V59-A314 HydrophobicContact CG1-CB 3.63Å; F311-A314 HydrophobicContact CD1-CB 3.58Å; F311-A314 HydrophobicContact CD2-CB 3.91Å; F311-A314 HydrophobicContact CE1-CB 3.51Å; F311-A314 HydrophobicContact CE2-CB 3.83Å; F311-A314 HydrophobicContact CG-CB 3.79Å; F311-A314 HydrophobicContact CZ-CB 3.64Å; F311-A314 WeakPolarHBondContact O-CB 3.35Å; F311-A314 PolarHBondContact O-N 3.11Å; A312-A314 PolarHBondContact O-N 3.37Å; A314-G316 PolarHBondContact O-N 2.86Å; A314-R317 WeakPolarHBondContact O-CB 3.44Å; A314-R317 PolarHBondContact O-N 3.01Å; A314-R317 VanDerWaalsContact O-N 3.08Å; A314-I319 HydrophobicContact CB-CD1 3.94Å; A314-I319 HydrophobicContact CB-CG1 3.73Å
315	V	90.6	Very high	91	Very high	77 Å²	77	42.5 Å²	42.5	47%	0.467	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	125.9	-179.6	175.3	0	0	0	0	110.9	G58 A312 R317	G58-V315 VanDerWaalsContact C-CG2 3.42Å; G58-V315 WeakPolarHBondContact O-CG2 3.47Å; A312-V315 WeakPolarHBondContact O-CB 3.3Å; A312-V315 WeakPolarHBondContact O-CG2 3.44Å; A312-V315 PolarHBondContact O-N 3.29Å; V315-R317 PolarHBondContact O-N 3.38Å; V315-R317 VanDerWaalsContact O-N 3.14Å
316	G	90.8	Very high	91.1	Very high	73 Å²	73	41.7 Å²	41.7	75%	0.753	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.4	5.9	175.8	0	0	0	0	0	114.7	A314	A314-G316 PolarHBondContact O-N 2.86Å
317	R	93.6	Very high	91.6	Very high	167 Å²	167	42.3 Å²	42.3	63%	0.63	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-6.8	-179.3	-62.5	-173.6	-178.9	-176.5	-0.1	113.3	Q313 A314 V315 I319	Q313-R317 WeakPolarHBondContact O-CD 3.46Å; Q313-R317 PolarHBondContact O-NE 3.42Å; Q313-R317 VanDerWaalsContact O-NE 3.12Å; Q313-R317 PolarHBondContact O-NH1 3.06Å; A314-R317 WeakPolarHBondContact O-CB 3.44Å; A314-R317 PolarHBondContact O-N 3.01Å; A314-R317 VanDerWaalsContact O-N 3.08Å; V315-R317 PolarHBondContact O-N 3.38Å; V315-R317 VanDerWaalsContact O-N 3.14Å; R317-I319 VanDerWaalsContact C-N 3.27Å; R317-I319 HydrophobicContact CB-CD1 4.06Å; R317-I319 HydrophobicContact CB-CG1 3.95Å; R317-I319 HydrophobicContact CB-CG2 4.43Å; R317-I319 WeakPolarHBondContact O-CG2 3.28Å; R317-I319 PolarHBondContact O-N 2.81Å
318	N	95.7	Very high	92.2	Very high	50 Å²	50	42.2 Å²	42.2	27%	0.267	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	38.3	-179.8	-168.4	27.4	0	0	0	112.1	E62 T368 T369 T370	E62-N318 VanDerWaalsContact OE1-CA 3.31Å; E62-N318 WeakPolarHBondContact OE1-CA 3.09Å; N318-T368 WeakPolarHBondContact ND2-CB 3.33Å; N318-T368 PolarHBondContact ND2-OG1 3.08Å; N318-T368 CarbonylContact O-C 3.57Å; N318-T368 WeakPolarHBondContact O-CA 3.35Å; N318-T368 WeakPolarHBondContact O-CB 3.38Å; N318-T369 PolarHBondContact O-N 3.03Å; N318-T369 PolarHBondContact O-OG1 2.55Å; N318-T369 VanDerWaalsContact OD1-CB 3.27Å; N318-T369 WeakPolarHBondContact OD1-CB 3.33Å; N318-T369 PolarHBondContact OD1-N 3.42Å; N318-T370 PolarHBondContact ND2-OG1 3.33Å; N318-T370 VanDerWaalsContact ND2-OG1 3.15Å; N318-T370 PolarHBondContact OD1-N 2.95Å; N318-T370 PolarHBondContact OD1-OG1 3.02Å
319	I	95.5	Very high	92.9	Very high	50 Å²	50	40.7 Å²	40.7	26%	0.256	22%	0.223	S	C	.	.			trans	-124.5	4.2	-179.2	65.2	177.8	0	0	0	113.2	A314 R317 T369	A314-I319 HydrophobicContact CB-CD1 3.94Å; A314-I319 HydrophobicContact CB-CG1 3.73Å; R317-I319 VanDerWaalsContact C-N 3.27Å; R317-I319 HydrophobicContact CB-CD1 4.06Å; R317-I319 HydrophobicContact CB-CG1 3.95Å; R317-I319 HydrophobicContact CB-CG2 4.43Å; R317-I319 WeakPolarHBondContact O-CG2 3.28Å; R317-I319 PolarHBondContact O-N 2.81Å; I319-T369 PolarHBondContact N-OG1 2.92Å
320	A	95.7	Very high	93.6	Very high	1 Å²	1	36 Å²	36	1%	0.008	20%	0.202	C	C	.	.			trans	-70.4	139.8	178.5	0	0	0	0	0	110.7	V59 E62 L63 P322 T369	V59-A320 HydrophobicContact CB-CB 3.75Å; V59-A320 HydrophobicContact CG1-CB 3.83Å; V59-A320 HydrophobicContact CG2-CB 4.2Å; E62-A320 WeakPolarHBondContact OE1-CB 3.26Å; E62-A320 PolarHBondContact OE1-N 2.86Å; L63-A320 HydrophobicContact CD2-CB 3.9Å; A320-P322 VanDerWaalsContact O-CD 3.28Å; A320-P322 WeakPolarHBondContact O-CD 3.47Å; A320-T369 PolarHBondContact N-OG1 2.9Å; A320-T369 WeakPolarHBondContact O-CB 3.4Å; A320-T369 WeakPolarHBondContact O-CG2 3.48Å; A320-T369 PolarHBondContact O-OG1 3.1Å
321	N	96.4	Very high	94.4	Very high	11 Å²	11	36 Å²	36	6%	0.059	20%	0.2	C	C	.	.			trans	-82.9	114.9	175.1	-173.3	-9.4	0	0	0	110.5	L63 T323 T360 D362 M363	L63-N321 WeakPolarHBondContact CD2-O 3.21Å; N321-T323 VanDerWaalsContact C-N 3.27Å; N321-T323 PolarHBondContact O-N 3.26Å; N321-T323 WeakPolarHBondContact OD1-CB 3.32Å; N321-T323 PolarHBondContact OD1-N 2.85Å; N321-T323 PolarHBondContact OD1-OG1 3.36Å; N321-T360 HydrophobicContact CB-CG2 4.41Å; N321-T360 WeakPolarHBondContact CB-OG1 3.25Å; N321-T360 VanDerWaalsContact CG-OG1 3.31Å; N321-T360 PolarHBondContact ND2-OG1 2.94Å; N321-D362 WeakPolarHBondContact CB-OD1 3.45Å; N321-D362 VanDerWaalsContact CB-OD2 3.29Å; N321-D362 WeakPolarHBondContact CB-OD2 3.31Å; N321-D362 PolarHBondContact ND2-OD2 3.34Å; N321-M363 WeakPolarHBondContact ND2-CE 3.03Å
322	P	97.3	Very high	94.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.183	C	C	.	.			trans	-81.7	-2.6	-178.3	36.2	-35.7	0	0	0	113.8	L63 A66 A320 A324 M325 L326 T369 F372	L63-P322 HydrophobicContact CD2-CB 4.2Å; A66-P322 HydrophobicContact CB-CB 3.85Å; A320-P322 VanDerWaalsContact O-CD 3.28Å; A320-P322 WeakPolarHBondContact O-CD 3.47Å; P322-A324 PolarHBondContact O-N 3.4Å; P322-M325 PolarHBondContact O-N 3.42Å; P322-L326 HydrophobicContact CB-CD1 3.98Å; P322-L326 HydrophobicContact CB-CG 4.31Å; P322-L326 HydrophobicContact CG-CD1 4.19Å; P322-L326 WeakPolarHBondContact O-CB 3.37Å; P322-L326 VanDerWaalsContact O-CG 3.29Å; P322-L326 WeakPolarHBondContact O-CG 3.42Å; P322-L326 PolarHBondContact O-N 2.91Å; P322-T369 HydrophobicContact CB-CG2 4.33Å; P322-T369 HydrophobicContact CG-CG2 4.17Å; P322-F372 HydrophobicContact CG-CB 4.2Å; P322-F372 HydrophobicContact CG-CD1 3.39Å; P322-F372 HydrophobicContact CG-CE1 4Å; P322-F372 HydrophobicContact CG-CG 4Å
323	T	97.8	Very high	95.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-55.6	-54.9	-172.9	-61.2	0	0	0	0	112.7	L148 G289 V290 N321 M325 L326 L327 V349 I353 F372	L148-T323 HydrophobicContact CD1-CG2 3.94Å; G289-T323 WeakPolarHBondContact O-CB 3.18Å; V290-T323 HydrophobicContact CB-CG2 4.15Å; V290-T323 HydrophobicContact CG1-CG2 4.03Å; N321-T323 VanDerWaalsContact C-N 3.27Å; N321-T323 PolarHBondContact O-N 3.26Å; N321-T323 WeakPolarHBondContact OD1-CB 3.32Å; N321-T323 PolarHBondContact OD1-N 2.85Å; N321-T323 PolarHBondContact OD1-OG1 3.36Å; T323-M325 VanDerWaalsContact C-N 3.33Å; T323-M325 PolarHBondContact O-N 2.92Å; T323-L326 PolarHBondContact O-N 3.42Å; T323-L327 HydrophobicContact CG2-CD1 3.85Å; T323-L327 HydrophobicContact CG2-CG 4.37Å; T323-L327 WeakPolarHBondContact O-CB 3.33Å; T323-L327 VanDerWaalsContact O-CG 3.3Å; T323-L327 WeakPolarHBondContact O-CG 3.46Å; T323-L327 PolarHBondContact O-N 3.45Å; T323-V349 HydrophobicContact CG2-CG1 3.9Å; T323-I353 HydrophobicContact CG2-CD1 3.49Å; T323-I353 VanDerWaalsContact CG2-CD1 3.49Å; T323-F372 VanDerWaalsContact OG1-CZ 3.28Å; T323-F372 WeakPolarHBondContact OG1-CZ 3.38Å
324	A	97.6	Very high	96.2	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-57.3	-46.7	-178.5	0	0	0	0	0	111.6	G289 V291 T305 P322 L327 S328	G289-A324 VanDerWaalsContact O-CB 3.29Å; G289-A324 WeakPolarHBondContact O-CB 3.38Å; G289-A324 PolarHBondContact O-N 2.76Å; V291-A324 WeakPolarHBondContact O-CB 3.44Å; T305-A324 HydrophobicContact CG2-CB 3.86Å; P322-A324 PolarHBondContact O-N 3.4Å; A324-L327 PolarHBondContact O-N 2.94Å; A324-S328 PolarHBondContact O-N 3.31Å; A324-S328 PolarHBondContact O-OG 3.33Å; A324-S328 VanDerWaalsContact O-OG 3.08Å
325	M	98.1	Very high	96.7	Very high	2 Å²	2	30 Å²	30	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-68	-40.2	-178.2	-168.8	60	77.1	0	0	112.2	L63 M64 V67 I111 T305 P322 T323 L327 S328 A329	L63-M325 HydrophobicContact CB-CB 4.2Å; L63-M325 HydrophobicContact CB-CG 4.22Å; M64-M325 HydrophobicContact CE-CE 3.52Å; M64-M325 HydrophobicContact CE-SD 3.77Å; M64-M325 HydrophobicContact SD-CE 4.35Å; M64-M325 HydrophobicContact SD-CG 4.28Å; M64-M325 HydrophobicContact SD-SD 4.13Å; V67-M325 HydrophobicContact CG2-CB 4.49Å; V67-M325 HydrophobicContact CG2-CG 3.65Å; I111-M325 HydrophobicContact CD1-SD 3.89Å; I111-M325 HydrophobicContact CG1-SD 4Å; T305-M325 HydrophobicContact CG2-CE 3.93Å; P322-M325 PolarHBondContact O-N 3.42Å; T323-M325 VanDerWaalsContact C-N 3.33Å; T323-M325 PolarHBondContact O-N 2.92Å; M325-L327 VanDerWaalsContact C-N 3.34Å; M325-L327 PolarHBondContact O-N 3.42Å; M325-S328 PolarHBondContact O-N 2.86Å; M325-A329 WeakPolarHBondContact O-CB 3.27Å; M325-A329 PolarHBondContact O-N 3.06Å
326	L	98.6	Very high	97	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.4	-36.7	175.6	-71.1	170.7	0	0	0	112.2	V67 V70 P322 T323 S330 V349 F372 V376	V67-L326 HydrophobicContact CG2-CD2 4.18Å; V70-L326 HydrophobicContact CB-CD2 3.99Å; V70-L326 HydrophobicContact CG1-CD2 4.28Å; V70-L326 HydrophobicContact CG2-CD1 4.49Å; V70-L326 HydrophobicContact CG2-CD2 3.85Å; P322-L326 HydrophobicContact CB-CD1 3.98Å; P322-L326 HydrophobicContact CB-CG 4.31Å; P322-L326 HydrophobicContact CG-CD1 4.19Å; P322-L326 WeakPolarHBondContact O-CB 3.37Å; P322-L326 VanDerWaalsContact O-CG 3.29Å; P322-L326 WeakPolarHBondContact O-CG 3.42Å; P322-L326 PolarHBondContact O-N 2.91Å; T323-L326 PolarHBondContact O-N 3.42Å; L326-S330 PolarHBondContact O-N 2.96Å; L326-S330 PolarHBondContact O-OG 3.47Å; L326-V349 HydrophobicContact CB-CG2 3.94Å; L326-V349 HydrophobicContact CD1-CG2 3.96Å; L326-F372 HydrophobicContact CD1-CE1 4.44Å; L326-V376 HydrophobicContact CD1-CG2 4.46Å
327	L	98.4	Very high	97.3	Very high	14 Å²	14	30.9 Å²	30.9	7%	0.073	14%	0.144	C	C	.	.	H	α-helix	trans	-69.6	-40.3	174.5	-68.9	176.8	0	0	0	111.6	L148 P292 T323 A324 M325 S330 N331 A346 V349	L148-L327 HydrophobicContact CD2-CD1 4.29Å; P292-L327 HydrophobicContact CB-CB 3.86Å; P292-L327 HydrophobicContact CG-CB 3.95Å; T323-L327 HydrophobicContact CG2-CD1 3.85Å; T323-L327 HydrophobicContact CG2-CG 4.37Å; T323-L327 WeakPolarHBondContact O-CB 3.33Å; T323-L327 VanDerWaalsContact O-CG 3.3Å; T323-L327 WeakPolarHBondContact O-CG 3.46Å; T323-L327 PolarHBondContact O-N 3.45Å; A324-L327 PolarHBondContact O-N 2.94Å; M325-L327 VanDerWaalsContact C-N 3.34Å; M325-L327 PolarHBondContact O-N 3.42Å; L327-S330 WeakPolarHBondContact O-CB 3.37Å; L327-S330 PolarHBondContact O-N 3.29Å; L327-N331 PolarHBondContact O-N 3.4Å; L327-A346 HydrophobicContact CD2-CB 4.34Å; L327-V349 HydrophobicContact CD2-CB 4.42Å; L327-V349 HydrophobicContact CD2-CG1 4.17Å; L327-V349 HydrophobicContact CG-CG1 4.29Å
328	S	98.4	Very high	97.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-41.8	172.8	-62.1	0	0	0	0	111.9	P292 G293 F303 E304 A324 M325 S330 N331 M332	P292-S328 VanDerWaalsContact CA-OG 3.25Å; P292-S328 WeakPolarHBondContact CA-OG 3.45Å; P292-S328 WeakPolarHBondContact CB-OG 3.22Å; G293-S328 PolarHBondContact N-OG 3.37Å; F303-S328 WeakPolarHBondContact CD1-O 3.2Å; E304-S328 WeakPolarHBondContact O-CB 3.34Å; E304-S328 PolarHBondContact O-OG 3.33Å; A324-S328 PolarHBondContact O-N 3.31Å; A324-S328 PolarHBondContact O-OG 3.33Å; A324-S328 VanDerWaalsContact O-OG 3.08Å; M325-S328 PolarHBondContact O-N 2.86Å; S328-S330 VanDerWaalsContact C-N 3.29Å; S328-S330 PolarHBondContact O-N 3.15Å; S328-N331 WeakPolarHBondContact O-CB 3.23Å; S328-N331 PolarHBondContact O-N 2.93Å; S328-N331 VanDerWaalsContact O-N 3.14Å; S328-M332 PolarHBondContact O-N 2.96Å
329	A	98.5	Very high	97.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-36.5	173.1	0	0	0	0	0	111.7	V67 F71 I111 M325 N331 M332 L333	V67-A329 HydrophobicContact CG1-CB 3.9Å; V67-A329 HydrophobicContact CG2-CB 4.16Å; F71-A329 HydrophobicContact CE1-CB 3.78Å; F71-A329 HydrophobicContact CZ-CB 3.78Å; I111-A329 HydrophobicContact CD1-CB 3.77Å; M325-A329 WeakPolarHBondContact O-CB 3.27Å; M325-A329 PolarHBondContact O-N 3.06Å; A329-N331 VanDerWaalsContact C-N 3.34Å; A329-M332 WeakPolarHBondContact O-CB 3.43Å; A329-M332 PolarHBondContact O-N 2.82Å; A329-L333 WeakPolarHBondContact O-CG 3.41Å; A329-L333 PolarHBondContact O-N 2.91Å
330	S	98.4	Very high	97.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.1	-39.1	173.1	-56.1	0	0	0	0	111.6	L326 L327 S328 M332 L333 R334 S342 I345 A346	L326-S330 PolarHBondContact O-N 2.96Å; L326-S330 PolarHBondContact O-OG 3.47Å; L327-S330 WeakPolarHBondContact O-CB 3.37Å; L327-S330 PolarHBondContact O-N 3.29Å; S328-S330 VanDerWaalsContact C-N 3.29Å; S328-S330 PolarHBondContact O-N 3.15Å; S330-M332 VanDerWaalsContact C-N 3.34Å; S330-L333 PolarHBondContact O-N 2.58Å; S330-R334 PolarHBondContact O-N 2.79Å; S330-R334 VanDerWaalsContact O-N 3.16Å; S330-S342 VanDerWaalsContact O-CB 3.3Å; S330-S342 WeakPolarHBondContact O-CB 3.31Å; S330-S342 PolarHBondContact O-OG 2.86Å; S330-I345 WeakPolarHBondContact OG-CG2 3.3Å; S330-A346 PolarHBondContact OG-N 2.86Å
331	N	98.3	Very high	97.6	Very high	26 Å²	26	28.3 Å²	28.3	14%	0.139	13%	0.134	C	C	.	.	H	α-helix	trans	-67.6	-35.6	175.3	-68.5	-10.6	0	0	0	112.3	E294 F303 L327 S328 A329 L333 R334 H335	E294-N331 WeakPolarHBondContact OE1-CB 3.45Å; E294-N331 PolarHBondContact OE1-ND2 3.28Å; F303-N331 HydrophobicContact CD1-CB 4.11Å; F303-N331 HydrophobicContact CE1-CB 4.02Å; L327-N331 PolarHBondContact O-N 3.4Å; S328-N331 WeakPolarHBondContact O-CB 3.23Å; S328-N331 PolarHBondContact O-N 2.93Å; S328-N331 VanDerWaalsContact O-N 3.14Å; A329-N331 VanDerWaalsContact C-N 3.34Å; N331-L333 VanDerWaalsContact C-N 3.35Å; N331-L333 PolarHBondContact O-N 2.9Å; N331-R334 WeakPolarHBondContact O-CB 3.41Å; N331-R334 PolarHBondContact O-N 2.73Å; N331-R334 PolarHBondContact OD1-NH1 3.28Å; N331-H335 PolarHBondContact O-N 3.27Å
332	M	98.6	Very high	97.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.9	-46.2	170.8	-175.9	-172.7	75.7	0	0	111.8	V51 F71 F80 V109 I111 F303 S328 A329 S330 R334 H335 L336	V51-M332 HydrophobicContact CG1-CE 4.34Å; V51-M332 HydrophobicContact CG1-SD 3.66Å; V51-M332 HydrophobicContact CG2-CE 4.43Å; V51-M332 HydrophobicContact CG2-SD 4.33Å; F71-M332 HydrophobicContact CE2-CE 3.77Å; F71-M332 HydrophobicContact CZ-CE 3.95Å; F80-M332 HydrophobicContact CE1-CE 4.06Å; F80-M332 HydrophobicContact CZ-CE 4.26Å; V109-M332 HydrophobicContact CG1-CG 3.65Å; V109-M332 HydrophobicContact CG1-SD 4.12Å; I111-M332 HydrophobicContact CB-SD 4.03Å; I111-M332 HydrophobicContact CG2-SD 4.5Å; F303-M332 HydrophobicContact CB-CB 4.17Å; F303-M332 HydrophobicContact CD1-CB 3.87Å; F303-M332 HydrophobicContact CD2-CB 3.47Å; F303-M332 VanDerWaalsContact CD2-CB 3.47Å; F303-M332 HydrophobicContact CD2-CG 3.48Å; F303-M332 VanDerWaalsContact CD2-CG 3.48Å; F303-M332 HydrophobicContact CD2-SD 4.35Å; F303-M332 HydrophobicContact CE1-CB 4.18Å; F303-M332 HydrophobicContact CE2-CB 3.8Å; F303-M332 HydrophobicContact CE2-CG 3.75Å; F303-M332 HydrophobicContact CG-CB 3.53Å; F303-M332 HydrophobicContact CG-CG 4.06Å; F303-M332 HydrophobicContact CZ-CB 4.17Å; S328-M332 PolarHBondContact O-N 2.96Å; A329-M332 WeakPolarHBondContact O-CB 3.43Å; A329-M332 PolarHBondContact O-N 2.82Å; S330-M332 VanDerWaalsContact C-N 3.34Å; M332-R334 VanDerWaalsContact C-N 3.29Å; M332-R334 PolarHBondContact O-N 3.25Å; M332-H335 WeakPolarHBondContact O-CA 3.35Å; M332-H335 WeakPolarHBondContact O-CB 3.42Å; M332-H335 PolarHBondContact O-N 3.4Å; M332-L336 HydrophobicContact CG-CD1 4.32Å; M332-L336 WeakPolarHBondContact O-CG 3.44Å; M332-L336 PolarHBondContact O-N 3.42Å
333	L	98.5	Very high	97.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-39.4	176.7	-66.6	176	0	0	0	112.1	F71 V76 V78 A329 S330 N331 H335 L336 N337 L338 H341 I345	F71-L333 HydrophobicContact CE1-CD1 4.07Å; F71-L333 HydrophobicContact CE2-CD1 4.25Å; F71-L333 HydrophobicContact CE2-CD2 3.84Å; F71-L333 HydrophobicContact CE2-CG 4.21Å; F71-L333 HydrophobicContact CZ-CD1 3.66Å; F71-L333 HydrophobicContact CZ-CD2 3.96Å; F71-L333 HydrophobicContact CZ-CG 3.8Å; V76-L333 HydrophobicContact CG1-CD1 4.25Å; V76-L333 HydrophobicContact CG1-CD2 3.49Å; V76-L333 VanDerWaalsContact CG1-CD2 3.49Å; V76-L333 HydrophobicContact CG2-CD1 4.37Å; V78-L333 HydrophobicContact CG2-CD2 3.86Å; A329-L333 WeakPolarHBondContact O-CG 3.41Å; A329-L333 PolarHBondContact O-N 2.91Å; S330-L333 PolarHBondContact O-N 2.58Å; N331-L333 VanDerWaalsContact C-N 3.35Å; N331-L333 PolarHBondContact O-N 2.9Å; L333-H335 VanDerWaalsContact C-N 3.32Å; L333-H335 PolarHBondContact O-N 3.49Å; L333-L336 CarbonylContact O-C 3.59Å; L333-L336 PolarHBondContact O-N 3.33Å; L333-N337 PolarHBondContact O-N 3.5Å; L333-L338 HydrophobicContact CB-CB 4.15Å; L333-L338 HydrophobicContact CD2-CB 4.36Å; L333-L338 HydrophobicContact CD2-CD1 3.75Å; L333-L338 WeakPolarHBondContact O-CA 3.33Å; L333-L338 WeakPolarHBondContact O-CB 3.32Å; L333-L338 PolarHBondContact O-N 3.04Å; L333-H341 HydrophobicContact CD1-CB 3.89Å; L333-I345 HydrophobicContact CD1-CD1 3.83Å
334	R	97.3	Very high	97.7	Very high	77 Å²	77	30.7 Å²	30.7	29%	0.291	15%	0.149	S	C	.	.	H	α-helix	trans	-62.8	-39	173.3	175.3	170.6	-53.9	101	8.6	112.2	S330 N331 M332 L336 N337 E339 S342	S330-R334 PolarHBondContact O-N 2.79Å; S330-R334 VanDerWaalsContact O-N 3.16Å; N331-R334 WeakPolarHBondContact O-CB 3.41Å; N331-R334 PolarHBondContact O-N 2.73Å; N331-R334 PolarHBondContact OD1-NH1 3.28Å; M332-R334 VanDerWaalsContact C-N 3.29Å; M332-R334 PolarHBondContact O-N 3.25Å; R334-L336 VanDerWaalsContact C-N 3.29Å; R334-L336 PolarHBondContact O-N 3.18Å; R334-N337 PolarHBondContact O-N 3.04Å; R334-N337 VanDerWaalsContact O-N 3.12Å; R334-E339 VanDerWaalsContact CG-OE2 3.23Å; R334-E339 WeakPolarHBondContact CG-OE2 3.34Å; R334-E339 IonicContact CZ-OE1 3.4Å; R334-E339 IonicContact NE-OE1 2.87Å; R334-E339 PolarHBondContact NE-OE1 3.36Å; R334-E339 IonicContact NE-OE2 2.8Å; R334-E339 PolarHBondContact NE-OE2 3.07Å; R334-E339 IonicContact NH2-OE1 2.64Å; R334-E339 PolarHBondContact NH2-OE1 2.87Å; R334-S342 PolarHBondContact NH2-OG 2.94Å; R334-S342 VanDerWaalsContact NH2-OG 3.09Å
335	H	97.1	Very high	97.7	Very high	82 Å²	82	30.7 Å²	30.7	38%	0.38	15%	0.149	S	C	.	.	H	α-helix	trans	-64.6	-34.9	174.9	-175.6	90.3	0	0	0	112.4	Y296 A301 F303 N331 M332 L333 N337	Y296-H335 AromaticContact CE1-ND1 3.82Å; A301-H335 WeakPolarHBondContact CB-NE2 3.14Å; F303-H335 HydrophobicContact CE1-CB 4.42Å; F303-H335 HydrophobicContact CE2-CB 4.16Å; F303-H335 HydrophobicContact CZ-CB 3.52Å; F303-H335 AromaticContact CZ-CG 3.87Å; N331-H335 PolarHBondContact O-N 3.27Å; M332-H335 WeakPolarHBondContact O-CA 3.35Å; M332-H335 WeakPolarHBondContact O-CB 3.42Å; M332-H335 PolarHBondContact O-N 3.4Å; L333-H335 VanDerWaalsContact C-N 3.32Å; L333-H335 PolarHBondContact O-N 3.49Å; H335-N337 PolarHBondContact O-N 3.18Å
336	L	97	Very high	97.7	Very high	22 Å²	22	30.9 Å²	30.9	12%	0.115	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	5.1	173.4	-65.3	171.8	0	0	0	113.8	F49 V51 V78 V109 M332 L333 R334 L338	F49-L336 HydrophobicContact CB-CD1 4.33Å; F49-L336 HydrophobicContact CD1-CD2 4.15Å; V51-L336 HydrophobicContact CG2-CD1 4Å; V78-L336 HydrophobicContact CG2-CD1 4.12Å; V109-L336 HydrophobicContact CB-CD2 4.3Å; V109-L336 HydrophobicContact CG1-CD2 4.37Å; V109-L336 HydrophobicContact CG2-CD2 3.82Å; M332-L336 HydrophobicContact CG-CD1 4.32Å; M332-L336 WeakPolarHBondContact O-CG 3.44Å; M332-L336 PolarHBondContact O-N 3.42Å; L333-L336 CarbonylContact O-C 3.59Å; L333-L336 PolarHBondContact O-N 3.33Å; R334-L336 VanDerWaalsContact C-N 3.29Å; R334-L336 PolarHBondContact O-N 3.18Å; L336-L338 VanDerWaalsContact C-N 3.25Å; L336-L338 HydrophobicContact CB-CD1 4.23Å; L336-L338 HydrophobicContact CB-CG 4.27Å; L336-L338 PolarHBondContact O-N 3.47Å
337	N	96.7	Very high	97.7	Very high	146 Å²	146	35 Å²	35	78%	0.781	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	22.3	-174	-53.2	-62.1	0	0	0	115	L333 R334 H335 E339	L333-N337 PolarHBondContact O-N 3.5Å; R334-N337 PolarHBondContact O-N 3.04Å; R334-N337 VanDerWaalsContact O-N 3.12Å; H335-N337 PolarHBondContact O-N 3.18Å; N337-E339 VanDerWaalsContact C-N 3.35Å; N337-E339 PolarHBondContact O-N 3.27Å
338	L	96.9	Very high	97.7	Very high	20 Å²	20	34.4 Å²	34.4	11%	0.105	17%	0.17	C	C	.	.			trans	-92.8	59.8	174.1	-61.2	173.1	0	0	0	110.8	F49 P77 V78 L333 L336 Y340 H341 S342	F49-L338 HydrophobicContact CD2-CD1 3.95Å; F49-L338 HydrophobicContact CD2-CD2 4.48Å; F49-L338 HydrophobicContact CE2-CD1 4.12Å; F49-L338 HydrophobicContact CE2-CD2 3.86Å; F49-L338 HydrophobicContact CE2-CG 4.23Å; P77-L338 HydrophobicContact CG-CD1 3.97Å; P77-L338 HydrophobicContact CG-CD2 3.94Å; V78-L338 HydrophobicContact CG2-CD1 4.2Å; L333-L338 HydrophobicContact CB-CB 4.15Å; L333-L338 HydrophobicContact CD2-CB 4.36Å; L333-L338 HydrophobicContact CD2-CD1 3.75Å; L333-L338 WeakPolarHBondContact O-CA 3.33Å; L333-L338 WeakPolarHBondContact O-CB 3.32Å; L333-L338 PolarHBondContact O-N 3.04Å; L336-L338 VanDerWaalsContact C-N 3.25Å; L336-L338 HydrophobicContact CB-CD1 4.23Å; L336-L338 HydrophobicContact CB-CG 4.27Å; L336-L338 PolarHBondContact O-N 3.47Å; L338-Y340 VanDerWaalsContact C-N 3.31Å; L338-Y340 PolarHBondContact O-N 3.38Å; L338-H341 PolarHBondContact O-N 3.4Å; L338-S342 WeakPolarHBondContact O-CB 3.46Å; L338-S342 PolarHBondContact O-N 2.93Å
339	E	96.4	Very high	97.7	Very high	88 Å²	88	34.4 Å²	34.4	41%	0.411	17%	0.17	S	C	.	.	H	α-helix	trans	-63.8	-34.3	-171.7	-166.5	65.3	-143	0	0	112.9	R334 N337 S342 S343	R334-E339 VanDerWaalsContact CG-OE2 3.23Å; R334-E339 WeakPolarHBondContact CG-OE2 3.34Å; R334-E339 IonicContact CZ-OE1 3.4Å; R334-E339 IonicContact NE-OE1 2.87Å; R334-E339 PolarHBondContact NE-OE1 3.36Å; R334-E339 IonicContact NE-OE2 2.8Å; R334-E339 PolarHBondContact NE-OE2 3.07Å; R334-E339 IonicContact NH2-OE1 2.64Å; R334-E339 PolarHBondContact NH2-OE1 2.87Å; N337-E339 VanDerWaalsContact C-N 3.35Å; N337-E339 PolarHBondContact O-N 3.27Å; E339-S342 PolarHBondContact O-N 3.07Å; E339-S343 WeakPolarHBondContact O-CB 3.42Å; E339-S343 PolarHBondContact O-N 3.47Å; E339-S343 PolarHBondContact O-OG 3.48Å
340	Y	96.4	Very high	97.6	Very high	76 Å²	76	38 Å²	38	30%	0.298	19%	0.186	S	C	.	.	H	α-helix	trans	-60.4	-54.6	176.6	170.6	-107.9	0	0	0	111.4	L338 S342 S343 M344 K383	L338-Y340 VanDerWaalsContact C-N 3.31Å; L338-Y340 PolarHBondContact O-N 3.38Å; Y340-S342 PolarHBondContact O-N 2.84Å; Y340-S343 PolarHBondContact O-N 3.15Å; Y340-M344 HydrophobicContact CD1-CE 4.13Å; Y340-M344 HydrophobicContact CE1-CE 3.28Å; Y340-M344 HydrophobicContact CE2-CE 3.91Å; Y340-M344 WeakPolarHBondContact O-CB 3.42Å; Y340-M344 PolarHBondContact O-N 3.09Å; Y340-M344 WeakPolarHBondContact OH-CE 3.29Å; Y340-K383 HydrophobicContact CE2-CD 4.2Å; Y340-K383 HydrophobicContact CE2-CG 4.42Å; Y340-K383 PolarHBondContact OH-N 3.16Å
341	H	97.6	Very high	97.6	Very high	29 Å²	29	42.4 Å²	42.4	13%	0.134	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-40.1	178.2	-62.2	76.6	0	0	0	111.8	A75 V76 L333 L338 S343 M344 I345	A75-H341 PolarHBondContact O-NE2 2.92Å; A75-H341 VanDerWaalsContact O-NE2 3.08Å; V76-H341 HydrophobicContact CG2-CB 4.26Å; L333-H341 HydrophobicContact CD1-CB 3.89Å; L338-H341 PolarHBondContact O-N 3.4Å; H341-S343 PolarHBondContact O-N 3.19Å; H341-M344 PolarHBondContact O-N 2.97Å; H341-I345 WeakPolarHBondContact O-CG1 3.42Å; H341-I345 PolarHBondContact O-N 3.4Å
342	S	97.8	Very high	97.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-55.4	-51.7	174.4	-179	0	0	0	0	111.7	S330 R334 L338 E339 Y340 A346	S330-S342 VanDerWaalsContact O-CB 3.3Å; S330-S342 WeakPolarHBondContact O-CB 3.31Å; S330-S342 PolarHBondContact O-OG 2.86Å; R334-S342 PolarHBondContact NH2-OG 2.94Å; R334-S342 VanDerWaalsContact NH2-OG 3.09Å; L338-S342 WeakPolarHBondContact O-CB 3.46Å; L338-S342 PolarHBondContact O-N 2.93Å; E339-S342 PolarHBondContact O-N 3.07Å; Y340-S342 PolarHBondContact O-N 2.84Å; S342-A346 VanDerWaalsContact O-CB 3.25Å; S342-A346 WeakPolarHBondContact O-CB 3.29Å; S342-A346 PolarHBondContact O-N 3.22Å
343	S	97.8	Very high	97.4	Very high	40 Å²	40	41.2 Å²	41.2	28%	0.28	20%	0.199	S	C	.	.	H	α-helix	trans	-66.6	-43	-178	-59.8	0	0	0	0	111.4	E339 Y340 H341 I345 A346 D347	E339-S343 WeakPolarHBondContact O-CB 3.42Å; E339-S343 PolarHBondContact O-N 3.47Å; E339-S343 PolarHBondContact O-OG 3.48Å; Y340-S343 PolarHBondContact O-N 3.15Å; H341-S343 PolarHBondContact O-N 3.19Å; S343-I345 PolarHBondContact O-N 3.27Å; S343-A346 PolarHBondContact O-N 3.36Å; S343-D347 VanDerWaalsContact O-CB 3.23Å; S343-D347 WeakPolarHBondContact O-CB 3.35Å; S343-D347 VanDerWaalsContact O-CG 3.24Å; S343-D347 PolarHBondContact O-N 2.89Å
344	M	97.6	Very high	97.3	Very high	22 Å²	22	48.2 Å²	48.2	11%	0.108	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-50.6	178.2	-174.7	-165.4	-58.5	0	0	112	A74 Y340 H341 A348 L380	A74-M344 HydrophobicContact CB-SD 4.18Å; Y340-M344 HydrophobicContact CD1-CE 4.13Å; Y340-M344 HydrophobicContact CE1-CE 3.28Å; Y340-M344 HydrophobicContact CE2-CE 3.91Å; Y340-M344 WeakPolarHBondContact O-CB 3.42Å; Y340-M344 PolarHBondContact O-N 3.09Å; Y340-M344 WeakPolarHBondContact OH-CE 3.29Å; H341-M344 PolarHBondContact O-N 2.97Å; M344-A348 WeakPolarHBondContact O-CB 3.34Å; M344-A348 PolarHBondContact O-N 2.79Å; M344-L380 HydrophobicContact CG-CD2 4.01Å; M344-L380 HydrophobicContact SD-CB 4.24Å; M344-L380 HydrophobicContact SD-CD2 4.09Å
345	I	98.3	Very high	97.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.2	-47.7	-178.2	-65.2	173.6	0	0	0	110.4	V70 F71 A74 V76 S330 L333 H341 S343 D347 A348 V349 L380	V70-I345 HydrophobicContact CG1-CD1 4.14Å; V70-I345 HydrophobicContact CG1-CG1 4.05Å; V70-I345 HydrophobicContact CG1-CG2 3.97Å; F71-I345 HydrophobicContact CD1-CD1 3.75Å; F71-I345 HydrophobicContact CE1-CD1 3.65Å; A74-I345 HydrophobicContact CB-CD1 4.25Å; A74-I345 HydrophobicContact CB-CG1 4.25Å; V76-I345 HydrophobicContact CG2-CD1 3.98Å; S330-I345 WeakPolarHBondContact OG-CG2 3.3Å; L333-I345 HydrophobicContact CD1-CD1 3.83Å; H341-I345 WeakPolarHBondContact O-CG1 3.42Å; H341-I345 PolarHBondContact O-N 3.4Å; S343-I345 PolarHBondContact O-N 3.27Å; I345-D347 VanDerWaalsContact C-N 3.3Å; I345-D347 PolarHBondContact O-N 3.46Å; I345-A348 PolarHBondContact O-N 2.83Å; I345-V349 HydrophobicContact CG2-CG2 4.49Å; I345-V349 WeakPolarHBondContact O-CG2 3.49Å; I345-V349 PolarHBondContact O-N 2.92Å; I345-L380 HydrophobicContact CG1-CD2 4.19Å
346	A	98	Very high	97.1	Very high	6 Å²	6	45.4 Å²	45.4	5%	0.05	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-40.5	-179.1	0	0	0	0	0	112.1	L327 S330 S342 S343 K350	L327-A346 HydrophobicContact CD2-CB 4.34Å; S330-A346 PolarHBondContact OG-N 2.86Å; S342-A346 VanDerWaalsContact O-CB 3.25Å; S342-A346 WeakPolarHBondContact O-CB 3.29Å; S342-A346 PolarHBondContact O-N 3.22Å; S343-A346 PolarHBondContact O-N 3.36Å; A346-K350 VanDerWaalsContact O-CG 3.23Å; A346-K350 WeakPolarHBondContact O-CG 3.46Å; A346-K350 PolarHBondContact O-N 3.47Å
347	D	97.9	Very high	97	Very high	86 Å²	86	52.9 Å²	52.9	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-75.7	-34.1	-179.5	-68.4	-15.7	0	0	0	112.3	S343 I345 K350 K351	S343-D347 VanDerWaalsContact O-CB 3.23Å; S343-D347 WeakPolarHBondContact O-CB 3.35Å; S343-D347 VanDerWaalsContact O-CG 3.24Å; S343-D347 PolarHBondContact O-N 2.89Å; I345-D347 VanDerWaalsContact C-N 3.3Å; I345-D347 PolarHBondContact O-N 3.46Å; D347-K350 PolarHBondContact O-N 2.79Å; D347-K350 IonicContact OD1-NZ 2.87Å; D347-K350 PolarHBondContact OD1-NZ 2.53Å; D347-K351 WeakPolarHBondContact O-CB 3.47Å; D347-K351 PolarHBondContact O-N 3.29Å
348	A	98.2	Very high	97	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.017	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-46.8	170.5	0	0	0	0	0	111.4	M344 I345 K351 V352 V376 H379 L380	M344-A348 WeakPolarHBondContact O-CB 3.34Å; M344-A348 PolarHBondContact O-N 2.79Å; I345-A348 PolarHBondContact O-N 2.83Å; A348-K351 PolarHBondContact O-N 3.18Å; A348-V352 WeakPolarHBondContact O-CG2 3.24Å; A348-V352 PolarHBondContact O-N 2.72Å; A348-V376 HydrophobicContact CB-CG1 4.11Å; A348-H379 HydrophobicContact CB-CB 4.02Å; A348-L380 HydrophobicContact CB-CD2 3.98Å
349	V	98.1	Very high	96.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-50.8	175.7	172.5	0	0	0	0	111.2	T323 L326 L327 I345 K351 V352 I353 V376	T323-V349 HydrophobicContact CG2-CG1 3.9Å; L326-V349 HydrophobicContact CB-CG2 3.94Å; L326-V349 HydrophobicContact CD1-CG2 3.96Å; L327-V349 HydrophobicContact CD2-CB 4.42Å; L327-V349 HydrophobicContact CD2-CG1 4.17Å; L327-V349 HydrophobicContact CG-CG1 4.29Å; I345-V349 HydrophobicContact CG2-CG2 4.49Å; I345-V349 WeakPolarHBondContact O-CG2 3.49Å; I345-V349 PolarHBondContact O-N 2.92Å; V349-K351 VanDerWaalsContact C-N 3.25Å; V349-K351 PolarHBondContact O-N 3.14Å; V349-V352 PolarHBondContact O-N 2.88Å; V349-I353 HydrophobicContact CG1-CD1 4Å; V349-I353 WeakPolarHBondContact O-CG1 3.39Å; V349-I353 PolarHBondContact O-N 3.01Å; V349-V376 HydrophobicContact CG2-CG1 4.01Å; V349-V376 HydrophobicContact CG2-CG2 4.05Å
350	K	97.3	Very high	96.8	Very high	76 Å²	76	45 Å²	45	33%	0.33	22%	0.219	S	C	.	.	H	α-helix	trans	-59.4	-37	177.3	-69.4	167.8	-154.4	155.1	0	111.9	A346 D347 I353 K354	A346-K350 VanDerWaalsContact O-CG 3.23Å; A346-K350 WeakPolarHBondContact O-CG 3.46Å; A346-K350 PolarHBondContact O-N 3.47Å; D347-K350 PolarHBondContact O-N 2.79Å; D347-K350 IonicContact OD1-NZ 2.87Å; D347-K350 PolarHBondContact OD1-NZ 2.53Å; K350-I353 PolarHBondContact O-N 3.09Å; K350-K354 WeakPolarHBondContact O-CB 3.16Å; K350-K354 PolarHBondContact O-N 3.02Å
351	K	97.1	Very high	96.7	Very high	92 Å²	92	50.7 Å²	50.7	40%	0.4	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-43.5	179.6	-173.6	169.3	177.6	-176.5	0	111.9	D347 A348 V349 I353 K354 V355 H379	D347-K351 WeakPolarHBondContact O-CB 3.47Å; D347-K351 PolarHBondContact O-N 3.29Å; A348-K351 PolarHBondContact O-N 3.18Å; V349-K351 VanDerWaalsContact C-N 3.25Å; V349-K351 PolarHBondContact O-N 3.14Å; K351-I353 VanDerWaalsContact C-N 3.32Å; K351-I353 PolarHBondContact O-N 2.85Å; K351-K354 PolarHBondContact O-N 2.85Å; K351-V355 HydrophobicContact CG-CG2 4.48Å; K351-V355 WeakPolarHBondContact O-CB 3.15Å; K351-V355 VanDerWaalsContact O-CG2 3.28Å; K351-V355 WeakPolarHBondContact O-CG2 3.32Å; K351-V355 PolarHBondContact O-N 2.93Å; K351-H379 VanDerWaalsContact CD-CD2 3.44Å; K351-H379 WeakPolarHBondContact CD-CD2 3.35Å; K351-H379 WeakPolarHBondContact CE-CD2 3.49Å
352	V	97.4	Very high	96.5	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.012	25%	0.25	C	S	.	.	H	α-helix	trans	-56.9	-48.4	174.4	172.3	0	0	0	0	110.7	A348 V349 K354 V355 G356 V358 F372 V376	A348-V352 WeakPolarHBondContact O-CG2 3.24Å; A348-V352 PolarHBondContact O-N 2.72Å; V349-V352 PolarHBondContact O-N 2.88Å; V352-K354 PolarHBondContact O-N 3.2Å; V352-V355 PolarHBondContact O-N 2.84Å; V352-G356 PolarHBondContact O-N 3.46Å; V352-V358 HydrophobicContact CG1-CB 4.14Å; V352-F372 HydrophobicContact CG1-CD2 4.09Å; V352-F372 HydrophobicContact CG1-CE2 3.69Å; V352-F372 HydrophobicContact CG1-CZ 4.01Å; V352-V376 HydrophobicContact CB-CG2 4.49Å; V352-V376 HydrophobicContact CG2-CG2 3.92Å
353	I	96.8	Very high	96.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-42.9	-179.4	-65.2	172.4	0	0	0	111.4	L148 T323 V349 K350 K351 G356 R359 F372	L148-I353 HydrophobicContact CB-CG2 4.15Å; L148-I353 HydrophobicContact CD1-CD1 3.62Å; T323-I353 HydrophobicContact CG2-CD1 3.49Å; T323-I353 VanDerWaalsContact CG2-CD1 3.49Å; V349-I353 HydrophobicContact CG1-CD1 4Å; V349-I353 WeakPolarHBondContact O-CG1 3.39Å; V349-I353 PolarHBondContact O-N 3.01Å; K350-I353 PolarHBondContact O-N 3.09Å; K351-I353 VanDerWaalsContact C-N 3.32Å; K351-I353 PolarHBondContact O-N 2.85Å; I353-G356 WeakPolarHBondContact O-CA 3.02Å; I353-G356 PolarHBondContact O-N 3.12Å; I353-R359 PolarHBondContact O-NH2 2.61Å; I353-F372 HydrophobicContact CD1-CZ 4.28Å; I353-F372 HydrophobicContact CG1-CE2 4.19Å; I353-F372 HydrophobicContact CG1-CZ 3.97Å
354	K	96.4	Very high	96	Very high	146 Å²	146	54 Å²	54	64%	0.635	27%	0.271	S	S	*	.	H	α-helix	trans	-63	-42.2	178.2	-175.9	179.4	178.2	-179.7	0	112.7	P149 K350 K351 V352 G356	P149-K354 HydrophobicContact CB-CD 4.42Å; P149-K354 WeakPolarHBondContact O-CA 3.37Å; P149-K354 WeakPolarHBondContact O-CB 3.25Å; P149-K354 PolarHBondContact O-N 2.8Å; K350-K354 WeakPolarHBondContact O-CB 3.16Å; K350-K354 PolarHBondContact O-N 3.02Å; K351-K354 PolarHBondContact O-N 2.85Å; V352-K354 PolarHBondContact O-N 3.2Å; K354-G356 VanDerWaalsContact C-N 3.28Å
355	V	95.9	Very high	95.9	Very high	76 Å²	76	53.6 Å²	53.6	46%	0.461	27%	0.273	S	S	.	.	H	α-helix	trans	-66.8	-33.9	176.4	169.1	0	0	0	0	110.9	K351 V352 K357	K351-V355 HydrophobicContact CG-CG2 4.48Å; K351-V355 WeakPolarHBondContact O-CB 3.15Å; K351-V355 VanDerWaalsContact O-CG2 3.28Å; K351-V355 WeakPolarHBondContact O-CG2 3.32Å; K351-V355 PolarHBondContact O-N 2.93Å; V352-V355 PolarHBondContact O-N 2.84Å; V355-K357 HydrophobicContact CG1-CB 4.17Å; V355-K357 HydrophobicContact CG1-CD 4.01Å; V355-K357 HydrophobicContact CG1-CG 3.83Å; V355-K357 PolarHBondContact O-N 3.15Å
356	G	93.6	Very high	95.7	Very high	24 Å²	24	64.1 Å²	64.1	25%	0.247	31%	0.314	C	S	.	.			trans	74.7	2.1	169.5	0	0	0	0	0	116.1	V352 I353 K354	V352-G356 PolarHBondContact O-N 3.46Å; I353-G356 WeakPolarHBondContact O-CA 3.02Å; I353-G356 PolarHBondContact O-N 3.12Å; K354-G356 VanDerWaalsContact C-N 3.28Å
357	K	94.6	Very high	95.7	Very high	179 Å²	179	65 Å²	65	78%	0.778	32%	0.32	S	S	*	.	S	Bend	trans	-72.8	-31.7	177.8	-71	-176.8	-179.8	-175.5	0	113.6	V355	V355-K357 HydrophobicContact CG1-CB 4.17Å; V355-K357 HydrophobicContact CG1-CD 4.01Å; V355-K357 HydrophobicContact CG1-CG 3.83Å; V355-K357 PolarHBondContact O-N 3.15Å
358	V	96.1	Very high	95.7	Very high	27 Å²	27	62.8 Å²	62.8	16%	0.164	31%	0.31	C	S	.	.	S	Bend	trans	-117.8	105	-177.5	-174.9	0	0	0	0	108.2	V352 S367 D371 F372	V352-V358 HydrophobicContact CG1-CB 4.14Å; V358-S367 WeakPolarHBondContact CA-OG 3.5Å; V358-D371 HydrophobicContact CG1-CB 4.15Å; V358-F372 HydrophobicContact CG1-CB 4.22Å; V358-F372 HydrophobicContact CG1-CD2 4.21Å
359	R	95.1	Very high	95.6	Very high	62 Å²	62	62.8 Å²	62.8	23%	0.234	31%	0.309	C	S	.	.			trans	-137.8	131	-176.7	-73.3	-176.3	178.7	174.7	3.8	109.8	G150 I353 M363 G365 Y366 S367	G150-R359 PolarHBondContact O-NH2 3.36Å; I353-R359 PolarHBondContact O-NH2 2.61Å; R359-M363 HydrophobicContact CB-CB 4.23Å; R359-M363 HydrophobicContact CG-CB 4.44Å; R359-G365 CarbonylContact O-C 3.53Å; R359-G365 VanDerWaalsContact O-C 3.28Å; R359-G365 VanDerWaalsContact O-CA 3.24Å; R359-G365 WeakPolarHBondContact O-CA 3.41Å; R359-Y366 PolarHBondContact O-N 3.01Å; R359-Y366 VanDerWaalsContact O-N 3.13Å; R359-S367 PolarHBondContact N-OG 2.95Å; R359-S367 VanDerWaalsContact O-CB 3.3Å; R359-S367 WeakPolarHBondContact O-CB 3.46Å; R359-S367 PolarHBondContact O-N 3.34Å; R359-S367 PolarHBondContact O-OG 3.43Å
360	T	95.4	Very high	95.6	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.325	C	S	.	.			trans	-71.7	168.2	170.7	50	0	0	0	0	110.9	N321 D362 M363 G364 G365	N321-T360 HydrophobicContact CB-CG2 4.41Å; N321-T360 WeakPolarHBondContact CB-OG1 3.25Å; N321-T360 VanDerWaalsContact CG-OG1 3.31Å; N321-T360 PolarHBondContact ND2-OG1 2.94Å; T360-D362 VanDerWaalsContact C-N 3.33Å; T360-D362 VanDerWaalsContact CB-OD1 3.25Å; T360-D362 WeakPolarHBondContact CB-OD1 3.24Å; T360-D362 PolarHBondContact O-N 3.23Å; T360-D362 PolarHBondContact OG1-OD1 2.92Å; T360-M363 CarbonylContact O-C 3.42Å; T360-M363 PolarHBondContact O-N 2.93Å; T360-M363 WeakPolarHBondContact OG1-CE 3.5Å; T360-G364 PolarHBondContact O-N 2.97Å; T360-G365 PolarHBondContact O-N 3.16Å
361	R	93.8	Very high	95.6	Very high	195 Å²	195	64.9 Å²	64.9	74%	0.736	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-62	-36.6	-171.6	-172.7	175.6	176.6	173.4	-0.3	114.2	M363 G364 G365	R361-M363 PolarHBondContact O-N 3.36Å; R361-G364 PolarHBondContact O-N 3.46Å; R361-G365 VanDerWaalsContact CA-O 3.31Å; R361-G365 WeakPolarHBondContact CA-O 3.41Å
362	D	92.6	Very high	95.7	Very high	65 Å²	65	60.5 Å²	60.5	35%	0.348	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-64	-27	175.4	63.8	-46.3	0	0	0	112.8	Y151 N321 T360 G364	Y151-D362 PolarHBondContact OH-O 3.09Å; N321-D362 WeakPolarHBondContact CB-OD1 3.45Å; N321-D362 VanDerWaalsContact CB-OD2 3.29Å; N321-D362 WeakPolarHBondContact CB-OD2 3.31Å; N321-D362 PolarHBondContact ND2-OD2 3.34Å; T360-D362 VanDerWaalsContact C-N 3.33Å; T360-D362 VanDerWaalsContact CB-OD1 3.25Å; T360-D362 WeakPolarHBondContact CB-OD1 3.24Å; T360-D362 PolarHBondContact O-N 3.23Å; T360-D362 PolarHBondContact OG1-OD1 2.92Å; D362-G364 VanDerWaalsContact C-N 3.32Å
363	M	93.8	Very high	95.7	Very high	8 Å²	8	61.1 Å²	61.1	4%	0.039	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-92.3	12.8	172.9	-60.9	-170.5	-72	0	0	113.4	Y151 V290 N321 R359 T360 R361 F372	Y151-M363 HydrophobicContact CE1-CG 4.04Å; Y151-M363 HydrophobicContact CE1-SD 4.4Å; Y151-M363 HydrophobicContact CE2-CB 4Å; Y151-M363 HydrophobicContact CE2-CG 4.22Å; V290-M363 HydrophobicContact CG1-CG 4.36Å; V290-M363 HydrophobicContact CG1-SD 3.93Å; N321-M363 WeakPolarHBondContact ND2-CE 3.03Å; R359-M363 HydrophobicContact CB-CB 4.23Å; R359-M363 HydrophobicContact CG-CB 4.44Å; T360-M363 CarbonylContact O-C 3.42Å; T360-M363 PolarHBondContact O-N 2.93Å; T360-M363 WeakPolarHBondContact OG1-CE 3.5Å; R361-M363 PolarHBondContact O-N 3.36Å; M363-F372 HydrophobicContact CE-CD2 4.32Å; M363-F372 HydrophobicContact CE-CE2 3.79Å
364	G	92.8	Very high	95.8	Very high	66 Å²	66	67.6 Å²	67.6	68%	0.68	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	14.8	178.9	0	0	0	0	0	115.4	T360 R361 D362	T360-G364 PolarHBondContact O-N 2.97Å; R361-G364 PolarHBondContact O-N 3.46Å; D362-G364 VanDerWaalsContact C-N 3.32Å
365	G	94.2	Very high	95.9	Very high	13 Å²	13	62 Å²	62	13%	0.134	32%	0.317	C	S	.	.			trans	-105.5	-167.5	175.4	0	0	0	0	0	114.2	R359 T360 R361	R359-G365 CarbonylContact O-C 3.53Å; R359-G365 VanDerWaalsContact O-C 3.28Å; R359-G365 VanDerWaalsContact O-CA 3.24Å; R359-G365 WeakPolarHBondContact O-CA 3.41Å; T360-G365 PolarHBondContact O-N 3.16Å; R361-G365 VanDerWaalsContact CA-O 3.31Å; R361-G365 WeakPolarHBondContact CA-O 3.41Å
366	Y	95.2	Very high	96	Very high	222 Å²	222	58.3 Å²	58.3	87%	0.871	30%	0.295	S	S	*	.			trans	-129.2	3.6	-179.4	-59.4	-81.4	0	0	0	113.2	R359	R359-Y366 PolarHBondContact O-N 3.01Å; R359-Y366 VanDerWaalsContact O-N 3.13Å
367	S	97.4	Very high	96.2	Very high	25 Å²	25	59.8 Å²	59.8	18%	0.175	30%	0.297	C	S	.	.			trans	-70.7	146.3	-179.7	-54.5	0	0	0	0	110.8	V358 R359	V358-S367 WeakPolarHBondContact CA-OG 3.5Å; R359-S367 PolarHBondContact N-OG 2.95Å; R359-S367 VanDerWaalsContact O-CB 3.3Å; R359-S367 WeakPolarHBondContact O-CB 3.46Å; R359-S367 PolarHBondContact O-N 3.34Å; R359-S367 PolarHBondContact O-OG 3.43Å
368	T	97.7	Very high	96.3	Very high	39 Å²	39	54.5 Å²	54.5	24%	0.239	29%	0.293	C	S	.	.			trans	-79.5	166.6	174.7	65.3	0	0	0	0	111.6	N318 T370 D371 F372	N318-T368 WeakPolarHBondContact ND2-CB 3.33Å; N318-T368 PolarHBondContact ND2-OG1 3.08Å; N318-T368 CarbonylContact O-C 3.57Å; N318-T368 WeakPolarHBondContact O-CA 3.35Å; N318-T368 WeakPolarHBondContact O-CB 3.38Å; T368-T370 PolarHBondContact O-N 3.3Å; T368-D371 WeakPolarHBondContact CB-OD2 3.34Å; T368-D371 PolarHBondContact N-OD2 2.89Å; T368-D371 PolarHBondContact O-N 2.95Å; T368-D371 PolarHBondContact OG1-N 3.36Å; T368-D371 VanDerWaalsContact OG1-N 3.09Å; T368-D371 PolarHBondContact OG1-OD2 2.63Å; T368-F372 PolarHBondContact O-N 3.44Å
369	T	97.1	Very high	96.3	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-55.5	-43.1	171.1	-43.4	0	0	0	0	110.7	E62 N318 I319 A320 P322 F372 I373	E62-T369 HydrophobicContact CG-CG2 4.22Å; E62-T369 WeakPolarHBondContact OE1-CB 3.3Å; E62-T369 WeakPolarHBondContact OE1-CG2 3.28Å; E62-T369 PolarHBondContact OE1-OG1 3.12Å; N318-T369 PolarHBondContact O-N 3.03Å; N318-T369 PolarHBondContact O-OG1 2.55Å; N318-T369 VanDerWaalsContact OD1-CB 3.27Å; N318-T369 WeakPolarHBondContact OD1-CB 3.33Å; N318-T369 PolarHBondContact OD1-N 3.42Å; I319-T369 PolarHBondContact N-OG1 2.92Å; A320-T369 PolarHBondContact N-OG1 2.9Å; A320-T369 WeakPolarHBondContact O-CB 3.4Å; A320-T369 WeakPolarHBondContact O-CG2 3.48Å; A320-T369 PolarHBondContact O-OG1 3.1Å; P322-T369 HydrophobicContact CB-CG2 4.33Å; P322-T369 HydrophobicContact CG-CG2 4.17Å; T369-F372 WeakPolarHBondContact O-CB 3.38Å; T369-F372 PolarHBondContact O-N 3.11Å; T369-I373 HydrophobicContact CG2-CD1 4.09Å; T369-I373 WeakPolarHBondContact O-CD1 3.31Å; T369-I373 VanDerWaalsContact O-CG1 3.26Å; T369-I373 WeakPolarHBondContact O-CG1 3.32Å; T369-I373 PolarHBondContact O-N 3.39Å
370	T	97.6	Very high	96.2	Very high	54 Å²	54	53.7 Å²	53.7	33%	0.331	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-43.1	177.6	-58.6	0	0	0	0	112.4	N318 T368 F372 I373 K374	N318-T370 PolarHBondContact ND2-OG1 3.33Å; N318-T370 VanDerWaalsContact ND2-OG1 3.15Å; N318-T370 PolarHBondContact OD1-N 2.95Å; N318-T370 PolarHBondContact OD1-OG1 3.02Å; T368-T370 PolarHBondContact O-N 3.3Å; T370-F372 VanDerWaalsContact C-N 3.29Å; T370-F372 PolarHBondContact O-N 2.99Å; T370-I373 PolarHBondContact O-N 3.35Å; T370-K374 HydrophobicContact CG2-CD 4.27Å; T370-K374 WeakPolarHBondContact O-CG 3.23Å; T370-K374 PolarHBondContact O-N 3.44Å
371	D	98	Very high	95.1	Very high	67 Å²	67	60.8 Å²	60.8	36%	0.358	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-41	176.4	-61.1	-40.5	0	0	0	111	V358 T368 K374 S375	V358-D371 HydrophobicContact CG1-CB 4.15Å; T368-D371 WeakPolarHBondContact CB-OD2 3.34Å; T368-D371 PolarHBondContact N-OD2 2.89Å; T368-D371 PolarHBondContact O-N 2.95Å; T368-D371 PolarHBondContact OG1-N 3.36Å; T368-D371 VanDerWaalsContact OG1-N 3.09Å; T368-D371 PolarHBondContact OG1-OD2 2.63Å; D371-K374 PolarHBondContact O-N 2.84Å; D371-S375 WeakPolarHBondContact O-CB 3.31Å; D371-S375 PolarHBondContact O-N 3.12Å
372	F	98.2	Very high	93.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-48.2	176.7	-163.9	-82.8	0	0	0	111.5	P322 T323 L326 V352 I353 V358 M363 T368 T369 T370 K374 S375 V376	P322-F372 HydrophobicContact CG-CB 4.2Å; P322-F372 HydrophobicContact CG-CD1 3.39Å; P322-F372 HydrophobicContact CG-CE1 4Å; P322-F372 HydrophobicContact CG-CG 4Å; T323-F372 VanDerWaalsContact OG1-CZ 3.28Å; T323-F372 WeakPolarHBondContact OG1-CZ 3.38Å; L326-F372 HydrophobicContact CD1-CE1 4.44Å; V352-F372 HydrophobicContact CG1-CD2 4.09Å; V352-F372 HydrophobicContact CG1-CE2 3.69Å; V352-F372 HydrophobicContact CG1-CZ 4.01Å; I353-F372 HydrophobicContact CD1-CZ 4.28Å; I353-F372 HydrophobicContact CG1-CE2 4.19Å; I353-F372 HydrophobicContact CG1-CZ 3.97Å; V358-F372 HydrophobicContact CG1-CB 4.22Å; V358-F372 HydrophobicContact CG1-CD2 4.21Å; M363-F372 HydrophobicContact CE-CD2 4.32Å; M363-F372 HydrophobicContact CE-CE2 3.79Å; T368-F372 PolarHBondContact O-N 3.44Å; T369-F372 WeakPolarHBondContact O-CB 3.38Å; T369-F372 PolarHBondContact O-N 3.11Å; T370-F372 VanDerWaalsContact C-N 3.29Å; T370-F372 PolarHBondContact O-N 2.99Å; F372-K374 PolarHBondContact O-N 3.5Å; F372-S375 WeakPolarHBondContact O-CB 3.45Å; F372-S375 PolarHBondContact O-N 3.41Å; F372-S375 VanDerWaalsContact O-N 3.16Å; F372-V376 HydrophobicContact CD1-CG2 3.8Å; F372-V376 HydrophobicContact CE1-CG2 3.58Å; F372-V376 HydrophobicContact CZ-CG2 4.42Å; F372-V376 WeakPolarHBondContact O-CG2 3.35Å; F372-V376 PolarHBondContact O-N 2.67Å
373	I	97.9	Very high	91.4	Very high	14 Å²	14	60.6 Å²	60.6	7%	0.072	33%	0.331	C	S	.	.	H	α-helix	trans	-57.1	-50.1	176.8	-66.3	159.4	0	0	0	110.8	A66 E69 V70 T369 T370 S375 V376 I377	A66-I373 HydrophobicContact CB-CD1 3.46Å; A66-I373 VanDerWaalsContact CB-CD1 3.46Å; A66-I373 HydrophobicContact CB-CG1 3.7Å; E69-I373 HydrophobicContact CB-CG2 4.14Å; V70-I373 HydrophobicContact CG2-CG2 4.18Å; T369-I373 HydrophobicContact CG2-CD1 4.09Å; T369-I373 WeakPolarHBondContact O-CD1 3.31Å; T369-I373 VanDerWaalsContact O-CG1 3.26Å; T369-I373 WeakPolarHBondContact O-CG1 3.32Å; T369-I373 PolarHBondContact O-N 3.39Å; T370-I373 PolarHBondContact O-N 3.35Å; I373-S375 VanDerWaalsContact C-N 3.26Å; I373-S375 PolarHBondContact O-N 2.73Å; I373-V376 PolarHBondContact O-N 3.01Å; I373-V376 VanDerWaalsContact O-N 3.13Å; I373-I377 HydrophobicContact CG2-CD1 3.75Å; I373-I377 HydrophobicContact CG2-CG1 4.37Å; I373-I377 WeakPolarHBondContact O-CG1 3.45Å; I373-I377 PolarHBondContact O-N 3.44Å
374	K	97.9	Very high	89.1	Confident	137 Å²	137	63.5 Å²	63.5	60%	0.596	36%	0.363	S	S	*	.	H	α-helix	trans	-58	-40.6	178	-73.8	173.9	179.6	174.5	0	111.7	T370 D371 F372 I377 G378	T370-K374 HydrophobicContact CG2-CD 4.27Å; T370-K374 WeakPolarHBondContact O-CG 3.23Å; T370-K374 PolarHBondContact O-N 3.44Å; D371-K374 PolarHBondContact O-N 2.84Å; F372-K374 PolarHBondContact O-N 3.5Å; K374-I377 PolarHBondContact O-N 2.97Å; K374-G378 PolarHBondContact O-N 3.25Å
375	S	97.9	Very high	86.3	Confident	27 Å²	27	64.7 Å²	64.7	19%	0.189	36%	0.361	C	S	.	.	H	α-helix	trans	-66.1	-40.4	177.3	-160.5	0	0	0	0	112.3	D371 F372 I373 G378 H379	D371-S375 WeakPolarHBondContact O-CB 3.31Å; D371-S375 PolarHBondContact O-N 3.12Å; F372-S375 WeakPolarHBondContact O-CB 3.45Å; F372-S375 PolarHBondContact O-N 3.41Å; F372-S375 VanDerWaalsContact O-N 3.16Å; I373-S375 VanDerWaalsContact C-N 3.26Å; I373-S375 PolarHBondContact O-N 2.73Å; S375-G378 PolarHBondContact O-N 3.44Å; S375-H379 PolarHBondContact O-N 2.81Å; S375-H379 PolarHBondContact O-ND1 3.23Å
376	V	98.1	Very high	83.3	Confident	0 Å²	0	72 Å²	72	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.2	-48.4	174.9	172.4	0	0	0	0	110.3	V70 L326 A348 V349 V352 F372 I373 G378 H379 L380	V70-V376 HydrophobicContact CG1-CG1 4.18Å; V70-V376 HydrophobicContact CG2-CG1 4.14Å; L326-V376 HydrophobicContact CD1-CG2 4.46Å; A348-V376 HydrophobicContact CB-CG1 4.11Å; V349-V376 HydrophobicContact CG2-CG1 4.01Å; V349-V376 HydrophobicContact CG2-CG2 4.05Å; V352-V376 HydrophobicContact CB-CG2 4.49Å; V352-V376 HydrophobicContact CG2-CG2 3.92Å; F372-V376 HydrophobicContact CD1-CG2 3.8Å; F372-V376 HydrophobicContact CE1-CG2 3.58Å; F372-V376 HydrophobicContact CZ-CG2 4.42Å; F372-V376 WeakPolarHBondContact O-CG2 3.35Å; F372-V376 PolarHBondContact O-N 2.67Å; I373-V376 PolarHBondContact O-N 3.01Å; I373-V376 VanDerWaalsContact O-N 3.13Å; V376-G378 VanDerWaalsContact C-N 3.3Å; V376-G378 PolarHBondContact O-N 2.75Å; V376-H379 CarbonylContact O-C 3.28Å; V376-H379 WeakPolarHBondContact O-CA 3.4Å; V376-H379 PolarHBondContact O-N 2.85Å; V376-L380 PolarHBondContact O-N 3.26Å
377	I	97.9	Very high	80.2	Confident	55 Å²	55	73.1 Å²	73.1	28%	0.282	42%	0.416	S	S	.	.	H	α-helix	trans	-57.6	-44	178.2	-69.2	172.2	0	0	0	111	V70 A73 I373 K374 H379 L380	V70-I377 HydrophobicContact CG2-CG1 4.24Å; A73-I377 HydrophobicContact CB-CB 4.45Å; A73-I377 HydrophobicContact CB-CD1 4.05Å; A73-I377 HydrophobicContact CB-CG1 3.89Å; A73-I377 HydrophobicContact CB-CG2 3.83Å; I373-I377 HydrophobicContact CG2-CD1 3.75Å; I373-I377 HydrophobicContact CG2-CG1 4.37Å; I373-I377 WeakPolarHBondContact O-CG1 3.45Å; I373-I377 PolarHBondContact O-N 3.44Å; K374-I377 PolarHBondContact O-N 2.97Å; I377-H379 PolarHBondContact O-N 3.16Å; I377-H379 VanDerWaalsContact O-N 3.12Å; I377-L380 HydrophobicContact CB-CD1 4.46Å; I377-L380 HydrophobicContact CG1-CD1 4.39Å; I377-L380 WeakPolarHBondContact O-CB 3.09Å; I377-L380 PolarHBondContact O-N 3.18Å; I377-L380 VanDerWaalsContact O-N 3.1Å
378	G	96.8	Very high	79.4	Confident	67 Å²	67	75.5 Å²	75.5	69%	0.691	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.3	176.6	0	0	0	0	0	114.8	K374 S375 V376	K374-G378 PolarHBondContact O-N 3.25Å; S375-G378 PolarHBondContact O-N 3.44Å; V376-G378 VanDerWaalsContact C-N 3.3Å; V376-G378 PolarHBondContact O-N 2.75Å
379	H	95.9	Very high	78.4	Confident	52 Å²	52	77.4 Å²	77.4	24%	0.241	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-0.5	176.2	-73.7	100.3	0	0	0	114	A348 K351 S375 V376 I377 Q381	A348-H379 HydrophobicContact CB-CB 4.02Å; K351-H379 VanDerWaalsContact CD-CD2 3.44Å; K351-H379 WeakPolarHBondContact CD-CD2 3.35Å; K351-H379 WeakPolarHBondContact CE-CD2 3.49Å; S375-H379 PolarHBondContact O-N 2.81Å; S375-H379 PolarHBondContact O-ND1 3.23Å; V376-H379 CarbonylContact O-C 3.28Å; V376-H379 WeakPolarHBondContact O-CA 3.4Å; V376-H379 PolarHBondContact O-N 2.85Å; I377-H379 PolarHBondContact O-N 3.16Å; I377-H379 VanDerWaalsContact O-N 3.12Å; H379-Q381 PolarHBondContact O-N 3.21Å; H379-Q381 VanDerWaalsContact O-N 3.12Å
380	L	94.3	Very high	77.4	Confident	21 Å²	21	81.7 Å²	81.7	11%	0.11	46%	0.462	C	S	.	.			trans	-66.2	110.5	172.4	-64.7	173.3	0	0	0	108.8	A73 A74 M344 I345 A348 V376 I377 T382	A73-L380 HydrophobicContact CB-CD1 3.83Å; A74-L380 HydrophobicContact CB-CD1 3.96Å; A74-L380 HydrophobicContact CB-CD2 4.32Å; M344-L380 HydrophobicContact CG-CD2 4.01Å; M344-L380 HydrophobicContact SD-CB 4.24Å; M344-L380 HydrophobicContact SD-CD2 4.09Å; I345-L380 HydrophobicContact CG1-CD2 4.19Å; A348-L380 HydrophobicContact CB-CD2 3.98Å; V376-L380 PolarHBondContact O-N 3.26Å; I377-L380 HydrophobicContact CB-CD1 4.46Å; I377-L380 HydrophobicContact CG1-CD1 4.39Å; I377-L380 WeakPolarHBondContact O-CB 3.09Å; I377-L380 PolarHBondContact O-N 3.18Å; I377-L380 VanDerWaalsContact O-N 3.1Å; L380-T382 PolarHBondContact O-N 3.22Å
381	Q	72.9	Confident	76.2	Confident	148 Å²	148	83.3 Å²	83.3	69%	0.692	47%	0.47	S	S	*	.			trans	-82.8	95.3	173.4	-68.5	-174.2	-22.9	0	0	108.6	H379 K383	H379-Q381 PolarHBondContact O-N 3.21Å; H379-Q381 VanDerWaalsContact O-N 3.12Å; Q381-K383 PolarHBondContact O-N 3.16Å
382	T	60.3	Low	74.8	Confident	71 Å²	71	84.3 Å²	84.3	44%	0.436	48%	0.477	S	S	.	.			trans	-75.2	118.3	167.3	55	0	0	0	0	107.8	L380 G384	L380-T382 PolarHBondContact O-N 3.22Å; T382-G384 PolarHBondContact O-N 3.32Å
383	K	47.8	Very low	73.2	Confident	186 Å²	186	89.9 Å²	89.9	81%	0.809	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	87.3	166.9	-77.3	-176.4	176.8	177	0	108	Y340 Q381	Y340-K383 HydrophobicContact CE2-CD 4.2Å; Y340-K383 HydrophobicContact CE2-CG 4.42Å; Y340-K383 PolarHBondContact OH-N 3.16Å; Q381-K383 PolarHBondContact O-N 3.16Å
384	G	44.5	Very low	71.5	Confident	69 Å²	69	95.4 Å²	95.4	71%	0.711	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	173	-2.6	-178.9	0	0	0	0	0	118	T382	T382-G384 PolarHBondContact O-N 3.32Å
385	S	34	Very low	69.4	Low	91 Å²	91	92.2 Å²	92.2	64%	0.636	54%	0.536	S	S	*	.	S	Bend	trans	-109.3	19.1	-177.3	27.9	0	0	0	0	115.1
386	N	31	Very low	67.1	Low	166 Å²	166	97.6 Å²	97.6	89%	0.888	57%	0.565	S	S	*	*			trans	-125.7	78.8	164.1	-79.3	-11.8	0	0	0	109
387	L	31.3	Very low	64.2	Low	245 Å²	245	106.5 Å²	106.5	100%	1.283	62%	0.616	S	S	*	*			trans	-138.4	0	156.2	-92.7	168.8	0	0	0	108

Retrieved 387 of 387 residues in 995.8 ms (Link to these results)

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