A0A060YI94_ONCMY Loading...

Enoyl-CoA hydratase domain-containing protein 3, mitochondrial

May play a role in fatty acid biosynthesis and insulin sensitivity.

AlphaFold DB , UniProt , Accession A0A060YI94, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110490369, Length 297 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	31.4	Very low	242 Å²	242	157.2 Å²	157.2	100%	1.192	79%	0.786	S	S	*	*				0	144.1	0	-82.8	161.5	162.5	0	0	109.2
2	T	32.3	Very low	31.6	Very low	129 Å²	129	158.2 Å²	158.2	79%	0.791	79%	0.793	S	S	*	*			trans	-16.7	126.5	166.8	39.6	0	0	0	0	117.4
3	R	32.2	Very low	31.6	Very low	214 Å²	214	155.2 Å²	155.2	81%	0.808	79%	0.788	S	S	*	*				94.2	115.5	61.2	-115.7	-166.8	173.4	-178.5	-1.7	113.3
4	N	31.7	Very low	31.6	Very low	121 Å²	121	157.6 Å²	157.6	65%	0.647	79%	0.794	S	S	*	*			trans	63.9	165.8	147.1	-56.4	-7.4	0	0	0	116.8
5	L	33	Very low	31.7	Very low	137 Å²	137	158.1 Å²	158.1	72%	0.717	80%	0.799	S	S	*	*			cis	-149.5	143.8	21.7	-104.8	101	0	0	0	112
6	F	32.4	Very low	31.9	Very low	171 Å²	171	154.7 Å²	154.7	75%	0.75	79%	0.794	S	S	*	*			trans	55.3	165.8	131.1	-73.6	-120.7	0	0	0	122.5
7	Y	27.1	Very low	32.1	Very low	170 Å²	170	160.2 Å²	160.2	67%	0.667	80%	0.803	S	S	*	*			cis	179	128.4	-39.9	-146.4	-102.1	0	0	0	108.7
8	R	30.1	Very low	32.3	Very low	220 Å²	220	162.1 Å²	162.1	83%	0.83	81%	0.805	S	S	*	*			trans	57.4	176.8	166.8	-74.9	179.9	-176.6	178.5	0.8	115.6
9	A	30.1	Very low	32.4	Very low	92 Å²	92	160.5 Å²	160.5	76%	0.76	81%	0.806	S	S	*	*			cis	-164.1	172.6	-40.1	0	0	0	0	0	106.3
10	A	30.1	Very low	32.6	Very low	82 Å²	82	160.7 Å²	160.7	68%	0.678	81%	0.808	S	S	*	*			cis	-158.7	-176.4	3.3	0	0	0	0	0	110.3
11	N	28.7	Very low	32.9	Very low	151 Å²	151	160.7 Å²	160.7	81%	0.807	81%	0.81	S	S	*	*			trans	27	128.4	152.7	-61	-15	0	0	0	121.6
12	I	33.5	Very low	33	Very low	169 Å²	169	153.6 Å²	153.6	87%	0.867	79%	0.79	S	S	*	*				-155.8	143.3	112	-100.3	152.9	0	0	0	109.7
13	V	31.1	Very low	33.2	Very low	120 Å²	120	150.8 Å²	150.8	73%	0.727	79%	0.786	S	S	*	*			trans	-89.1	135.3	-178.2	170.8	0	0	0	0	109.9	L15	V13-L15 HydrophobicContact CG1-CD1 3.81Å
14	Q	31.5	Very low	33.6	Very low	188 Å²	188	145.6 Å²	145.6	88%	0.879	78%	0.783	S	S	*	*			trans	-137.5	116.6	159.4	-158.3	168.9	8.7	0	0	109.6
15	L	34.5	Very low	34.2	Very low	166 Å²	166	151 Å²	151	87%	0.869	80%	0.795	S	S	*	*			trans	-75.3	127.7	179.6	-73	88.9	0	0	0	110.2	V13	V13-L15 HydrophobicContact CG1-CD1 3.81Å
16	S	34.5	Very low	34.7	Very low	103 Å²	103	152.5 Å²	152.5	72%	0.72	80%	0.802	S	S	*	*			trans	-120.9	131.3	157.8	57.6	0	0	0	0	109.4	F18	S16-F18 PolarHBondContact O-N 3.15Å
17	R	35.3	Very low	35.2	Very low	249 Å²	249	151.9 Å²	151.9	94%	0.94	81%	0.806	S	S	*	*			trans	-72.4	120.9	-179.7	-73.7	174.9	168.3	-178.1	-4.5	109.6
18	F	35.9	Very low	35.9	Very low	193 Å²	193	149.1 Å²	149.1	85%	0.846	81%	0.81	S	S	*	*			trans	-113.8	117.6	159.2	-104.3	-85.7	0	0	0	110.2	S16 L20	S16-F18 PolarHBondContact O-N 3.15Å; F18-L20 PolarHBondContact O-N 3.25Å; F18-L20 VanDerWaalsContact O-N 3.15Å
19	T	34.4	Very low	36.7	Very low	132 Å²	132	144.2 Å²	144.2	81%	0.81	81%	0.805	S	S	*	*			trans	-74.3	99.7	177.3	-49.3	0	0	0	0	109.3	L21	T19-L21 PolarHBondContact O-N 3.11Å
20	L	35.6	Very low	37.3	Very low	165 Å²	165	148.5 Å²	148.5	86%	0.864	81%	0.809	S	S	*	*			trans	-77.8	107.7	173.9	-105.8	144.4	0	0	0	109.9	F18	F18-L20 PolarHBondContact O-N 3.25Å; F18-L20 VanDerWaalsContact O-N 3.15Å
21	L	38	Very low	38.4	Very low	160 Å²	160	150.9 Å²	150.9	84%	0.838	82%	0.815	S	S	*	*			trans	-61.1	143.2	168	-88.8	137.7	0	0	0	110.6	T19 G23	T19-L21 PolarHBondContact O-N 3.11Å; L21-G23 PolarHBondContact O-N 2.96Å; L21-G23 VanDerWaalsContact O-N 3.07Å
22	A	41.5	Very low	39.8	Very low	93 Å²	93	152.6 Å²	152.6	77%	0.769	82%	0.819	S	S	*	*			trans	-65.6	106.1	-170	0	0	0	0	0	113.1	S24	A22-S24 PolarHBondContact O-N 2.98Å
23	G	35.9	Very low	41.8	Very low	70 Å²	70	149.1 Å²	149.1	72%	0.722	82%	0.815	S	S	*	*			trans	-86.2	76.9	162.7	0	0	0	0	0	110.8	L21 R25	L21-G23 PolarHBondContact O-N 2.96Å; L21-G23 VanDerWaalsContact O-N 3.07Å; G23-R25 VanDerWaalsContact C-N 3.31Å; G23-R25 PolarHBondContact O-N 2.96Å
24	S	41.4	Very low	44.5	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	81%	0.81	S	S	*	*			trans	-63.5	87.9	176.3	-64.3	0	0	0	0	111.1	A22 L26	A22-S24 PolarHBondContact O-N 2.98Å; S24-L26 PolarHBondContact O-N 3.05Å
25	R	42.7	Very low	47.5	Very low	235 Å²	235	144 Å²	144	89%	0.887	79%	0.789	S	S	*	*			trans	-65.2	98.1	167.9	-72.6	-172.5	178.8	-157.3	-0.3	108.1	G23 L27	G23-R25 VanDerWaalsContact C-N 3.31Å; G23-R25 PolarHBondContact O-N 2.96Å; R25-L27 VanDerWaalsContact C-N 3.28Å; R25-L27 PolarHBondContact O-N 3.48Å
26	L	43.5	Very low	50.5	Low	167 Å²	167	137.5 Å²	137.5	87%	0.874	76%	0.757	S	S	*	*			trans	-55.9	96.8	161.4	-88.6	141.7	0	0	0	107.9	S24 C28	S24-L26 PolarHBondContact O-N 3.05Å; L26-C28 PolarHBondContact O-N 3.32Å
27	L	44.8	Very low	53.6	Low	158 Å²	158	132.8 Å²	132.8	83%	0.827	72%	0.724	S	S	*	*			trans	-62.5	93	162.7	-83.5	154.1	0	0	0	106.3	R25 T29	R25-L27 VanDerWaalsContact C-N 3.28Å; R25-L27 PolarHBondContact O-N 3.48Å; L27-T29 PolarHBondContact O-N 2.96Å
28	C	40.7	Very low	56.6	Low	113 Å²	113	122.8 Å²	122.8	76%	0.764	69%	0.69	S	S	*	*			trans	-63.9	90.4	170.7	-170.9	0	0	0	0	107.2	L26 Q30	L26-C28 PolarHBondContact O-N 3.32Å; C28-Q30 VanDerWaalsContact C-N 3.3Å; C28-Q30 PolarHBondContact O-N 2.89Å
29	T	46.1	Very low	59.5	Low	117 Å²	117	118.3 Å²	118.3	72%	0.718	67%	0.668	S	S	*	*			trans	-64.9	96.6	170.4	36.9	0	0	0	0	107	L27 T31	L27-T29 PolarHBondContact O-N 2.96Å; T29-T31 PolarHBondContact O-N 3.41Å
30	Q	44.4	Very low	62.6	Low	182 Å²	182	117.1 Å²	117.1	85%	0.85	65%	0.653	S	S	*	*			trans	-60.5	94.8	164.7	-70.3	-174.8	-3.1	0	0	107.1	C28 Q32	C28-Q30 VanDerWaalsContact C-N 3.3Å; C28-Q30 PolarHBondContact O-N 2.89Å; Q30-Q32 VanDerWaalsContact C-N 3.3Å; Q30-Q32 PolarHBondContact O-N 3.44Å
31	T	51.6	Low	65.5	Low	131 Å²	131	113 Å²	113	80%	0.804	63%	0.629	S	S	*	*			trans	-62.2	98.6	167.5	29.1	0	0	0	0	107	T29 A33	T29-T31 PolarHBondContact O-N 3.41Å; T31-A33 PolarHBondContact O-N 3.42Å; T31-A33 VanDerWaalsContact O-N 3.11Å
32	Q	58.2	Low	68.3	Low	188 Å²	188	110.7 Å²	110.7	88%	0.879	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-49.7	121.8	170.6	-113.7	176.5	-6.2	0	0	107.7	Q30 E34	Q30-Q32 VanDerWaalsContact C-N 3.3Å; Q30-Q32 PolarHBondContact O-N 3.44Å; Q32-E34 PolarHBondContact O-N 2.97Å
33	A	75.3	Confident	70.9	Confident	95 Å²	95	112.8 Å²	112.8	79%	0.785	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-59.3	128.4	178.4	0	0	0	0	0	108.6	T31	T31-A33 PolarHBondContact O-N 3.42Å; T31-A33 VanDerWaalsContact O-N 3.11Å
34	E	88.3	Confident	73.9	Confident	132 Å²	132	110 Å²	110	62%	0.617	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-54.7	139.1	176.6	-77.3	-170.1	-144.7	0	0	110.2	Q32 N51 K88	Q32-E34 PolarHBondContact O-N 2.97Å; E34-N51 PolarHBondContact OE2-ND2 3.05Å; E34-N51 PolarHBondContact OE2-OD1 2.98Å; E34-K88 IonicContact OE2-NZ 3.25Å
35	P	95.4	Very high	76.6	Confident	70 Å²	70	105.8 Å²	105.8	46%	0.455	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-63.1	144.7	-178.5	27.2	-35.2	0	0	0	110.4	T37 V38 N51	P35-T37 PolarHBondContact O-N 3.46Å; P35-T37 VanDerWaalsContact O-N 3.15Å; P35-V38 HydrophobicContact CG-CG2 4.39Å; P35-N51 WeakPolarHBondContact O-CB 3.33Å; P35-N51 PolarHBondContact O-ND2 3.26Å
36	P	97.6	Very high	79.3	Confident	29 Å²	29	94.6 Å²	94.6	19%	0.188	51%	0.514	C	S	.	.	S	Bend	trans	-58	-29.3	-179.4	-25.1	33.4	0	0	0	113.7	N51 M63	P36-N51 WeakPolarHBondContact O-CA 3.33Å; P36-N51 WeakPolarHBondContact O-CB 3.13Å; P36-N51 PolarHBondContact O-N 3.18Å; P36-M63 HydrophobicContact CB-CB 4.39Å; P36-M63 HydrophobicContact CB-CE 4.12Å; P36-M63 HydrophobicContact CB-SD 3.78Å; P36-M63 WeakPolarHBondContact O-CE 3.42Å
37	T	98.7	Very high	81.9	Confident	3 Å²	3	89.3 Å²	89.3	2%	0.018	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.8	170	66.9	0	0	0	0	111.7	P35 I48 I49 L50 M63 S66 L67 N70	P35-T37 PolarHBondContact O-N 3.46Å; P35-T37 VanDerWaalsContact O-N 3.15Å; T37-I48 HydrophobicContact CG2-CG2 4.4Å; T37-I49 CarbonylContact C-O 3.4Å; T37-I49 WeakPolarHBondContact CA-O 3.33Å; T37-L50 HydrophobicContact CG2-CD2 3.81Å; T37-M63 HydrophobicContact CG2-SD 3.57Å; T37-M63 VanDerWaalsContact CG2-SD 3.57Å; T37-S66 PolarHBondContact N-OG 2.9Å; T37-S66 PolarHBondContact OG1-O 3.45Å; T37-S66 PolarHBondContact OG1-OG 3.45Å; T37-L67 HydrophobicContact CG2-CB 4.21Å; T37-N70 PolarHBondContact OG1-ND2 3.34Å
38	V	98.4	Very high	84.5	Confident	39 Å²	39	81.8 Å²	81.8	24%	0.236	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.4	173.7	175.6	0	0	0	0	109.2	P35 I48 I49 N51	P35-V38 HydrophobicContact CG-CG2 4.39Å; V38-I48 WeakPolarHBondContact O-CA 3.18Å; V38-I49 HydrophobicContact CB-CB 4.37Å; V38-I49 PolarHBondContact N-O 3.41Å; V38-I49 PolarHBondContact O-N 3Å; V38-N51 HydrophobicContact CG2-CB 4.02Å
39	R	98.1	Very high	87.3	Confident	100 Å²	100	77.6 Å²	77.6	38%	0.377	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135	176.1	-172.3	177.4	83.6	-138.2	22.9	110.9	R46 R47 N70 A73 D74	R39-R46 HydrophobicContact CG-CG 4.04Å; R39-R47 WeakPolarHBondContact CA-O 3.38Å; R39-N70 HydrophobicContact CB-CB 4.29Å; R39-N70 WeakPolarHBondContact CB-OD1 3.39Å; R39-N70 WeakPolarHBondContact CD-OD1 3.45Å; R39-N70 PolarHBondContact NH1-OD1 2.93Å; R39-A73 VanDerWaalsContact NH1-CB 3.32Å; R39-D74 IonicContact NH2-OD2 2.63Å
40	Q	97.9	Very high	89.8	Confident	107 Å²	107	72 Å²	72	50%	0.5	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	148.2	169	-64.4	175.2	-13	0	0	108.4	R46 R47	Q40-R46 CarbonylContact O-C 3.5Å; Q40-R46 WeakPolarHBondContact O-CA 3.22Å; Q40-R47 HydrophobicContact CB-CB 4.43Å; Q40-R47 PolarHBondContact N-O 2.79Å; Q40-R47 PolarHBondContact O-N 3.31Å
41	Q	97.8	Very high	92.4	Very high	79 Å²	79	63.8 Å²	63.8	37%	0.369	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	128.9	176.7	-173.6	170.6	-55.6	0	0	110.3	I45 R46	Q41-I45 WeakPolarHBondContact CA-O 3.3Å; Q41-R46 HydrophobicContact CB-CB 4.47Å; Q41-R46 HydrophobicContact CG-CB 4.28Å; Q41-R46 VanDerWaalsContact OE1-CZ 3.32Å
42	N	96.9	Very high	94.6	Very high	110 Å²	110	59.9 Å²	59.9	59%	0.588	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.5	138.8	178.7	-170.2	0.8	0	0	0	109.7	G44 I45	N42-G44 PolarHBondContact O-N 2.67Å; N42-I45 PolarHBondContact N-O 3.32Å; N42-I45 PolarHBondContact O-N 2.96Å
43	N	95.9	Very high	96.5	Very high	138 Å²	138	53.7 Å²	53.7	74%	0.738	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	39.3	178.5	-61.4	-33.2	0	0	0	113.8	I45 C230	N43-I45 PolarHBondContact O-N 3.01Å; N43-C230 PolarHBondContact O-SG 3.38Å; N43-C230 VanDerWaalsContact O-SG 3.38Å
44	G	97.8	Very high	97.5	Very high	11 Å²	11	59 Å²	59	11%	0.113	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	1.3	-178.3	0	0	0	0	0	117.9	N42 N79 R81 V82	N42-G44 PolarHBondContact O-N 2.67Å; G44-N79 WeakPolarHBondContact CA-O 3.48Å; G44-R81 WeakPolarHBondContact O-CB 3.36Å; G44-R81 PolarHBondContact O-N 3.28Å; G44-V82 PolarHBondContact O-N 2.94Å
45	I	98.8	Very high	98	Very high	17 Å²	17	57.4 Å²	57.4	9%	0.087	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	116.6	171.3	-54.2	173.4	0	0	0	107.9	Q41 N42 N43 V82 V84 L223 A226 R227	Q41-I45 WeakPolarHBondContact CA-O 3.3Å; N42-I45 PolarHBondContact N-O 3.32Å; N42-I45 PolarHBondContact O-N 2.96Å; N43-I45 PolarHBondContact O-N 3.01Å; I45-V82 HydrophobicContact CB-CG1 4.21Å; I45-V82 HydrophobicContact CG1-CG1 3.82Å; I45-V82 HydrophobicContact CG2-CG1 4.24Å; I45-V84 HydrophobicContact CG2-CG2 3.9Å; I45-L223 HydrophobicContact CD1-CD2 4.2Å; I45-L223 HydrophobicContact CG2-CD2 4.36Å; I45-A226 HydrophobicContact CD1-CB 3.72Å; I45-A226 HydrophobicContact CG1-CB 4Å; I45-A226 HydrophobicContact CG2-CB 4.14Å; I45-R227 HydrophobicContact CD1-CG 4.01Å
46	R	98.8	Very high	98.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.9	169.2	176.7	179	-64.3	175.3	5.6	110	R39 Q40 Q41 I48 N70 I71 A73 L80 V82 I83 V84	R39-R46 HydrophobicContact CG-CG 4.04Å; Q40-R46 CarbonylContact O-C 3.5Å; Q40-R46 WeakPolarHBondContact O-CA 3.22Å; Q41-R46 HydrophobicContact CB-CB 4.47Å; Q41-R46 HydrophobicContact CG-CB 4.28Å; Q41-R46 VanDerWaalsContact OE1-CZ 3.32Å; R46-I48 HydrophobicContact CG-CG1 4.14Å; R46-N70 WeakPolarHBondContact CD-O 3.42Å; R46-N70 PolarHBondContact NH1-O 3.02Å; R46-I71 PolarHBondContact NH1-O 2.86Å; R46-A73 PolarHBondContact NH1-O 3.18Å; R46-A73 PolarHBondContact NH2-O 2.82Å; R46-L80 HydrophobicContact CB-CD1 3.58Å; R46-V82 PolarHBondContact N-O 3.14Å; R46-I83 HydrophobicContact CB-CG1 4.31Å; R46-I83 CarbonylContact O-C 3.51Å; R46-I83 WeakPolarHBondContact O-CA 3.39Å; R46-V84 PolarHBondContact O-N 3.41Å
47	R	98.8	Very high	98.2	Very high	56 Å²	56	60.8 Å²	60.8	21%	0.211	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.3	169.1	-54.6	-176.5	71.9	146.2	14	109.3	R39 Q40 V84 E219	R39-R47 WeakPolarHBondContact CA-O 3.38Å; Q40-R47 HydrophobicContact CB-CB 4.43Å; Q40-R47 PolarHBondContact N-O 2.79Å; Q40-R47 PolarHBondContact O-N 3.31Å; R47-V84 CarbonylContact C-O 3.55Å; R47-V84 WeakPolarHBondContact CA-O 3.47Å; R47-E219 IonicContact CZ-OE1 3.57Å; R47-E219 IonicContact CZ-OE2 3.05Å; R47-E219 IonicContact NH1-OE1 3.47Å; R47-E219 PolarHBondContact NH1-OE1 3.43Å; R47-E219 IonicContact NH1-OE2 2.69Å; R47-E219 VanDerWaalsContact NH2-CD 3.33Å; R47-E219 IonicContact NH2-OE1 3.55Å; R47-E219 PolarHBondContact NH2-OE1 2.95Å; R47-E219 VanDerWaalsContact NH2-OE1 3.11Å; R47-E219 IonicContact NH2-OE2 3.3Å; R47-E219 PolarHBondContact NH2-OE2 3.04Å
48	I	98.9	Very high	98.2	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.9	167.1	-51.2	175.9	0	0	0	106.8	T37 V38 R46 L67 N70 I71 I83 V84 I85 S86	T37-I48 HydrophobicContact CG2-CG2 4.4Å; V38-I48 WeakPolarHBondContact O-CA 3.18Å; R46-I48 HydrophobicContact CG-CG1 4.14Å; I48-L67 HydrophobicContact CD1-CD1 4.4Å; I48-L67 HydrophobicContact CG2-CD1 3.77Å; I48-N70 HydrophobicContact CD1-CB 4Å; I48-N70 WeakPolarHBondContact CD1-O 3.47Å; I48-N70 HydrophobicContact CG1-CB 4.28Å; I48-N70 HydrophobicContact CG2-CB 4.15Å; I48-I71 HydrophobicContact CD1-CB 4.49Å; I48-I71 HydrophobicContact CD1-CG1 3.68Å; I48-I83 HydrophobicContact CD1-CG2 3.73Å; I48-I83 HydrophobicContact CG1-CG2 4.07Å; I48-V84 PolarHBondContact N-O 2.98Å; I48-I85 WeakPolarHBondContact O-CA 3.46Å; I48-S86 PolarHBondContact O-N 3.37Å; I48-S86 PolarHBondContact O-OG 2.85Å
49	I	98.9	Very high	98.2	Very high	25 Å²	25	59.1 Å²	59.1	13%	0.128	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.4	-174.2	-48.8	170.8	0	0	0	108.2	T37 V38 N51 S86 K88	T37-I49 CarbonylContact C-O 3.4Å; T37-I49 WeakPolarHBondContact CA-O 3.33Å; V38-I49 HydrophobicContact CB-CB 4.37Å; V38-I49 PolarHBondContact N-O 3.41Å; V38-I49 PolarHBondContact O-N 3Å; I49-N51 PolarHBondContact O-N 3.23Å; I49-S86 CarbonylContact C-O 3.56Å; I49-S86 WeakPolarHBondContact CA-O 3.29Å; I49-K88 HydrophobicContact CG2-CG 3.87Å
50	L	98.9	Very high	98.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	121.6	169.2	-52.6	-176.2	0	0	0	108.6	T37 N57 M63 L67 S86 A87 K88 F92 L146	T37-L50 HydrophobicContact CG2-CD2 3.81Å; L50-N57 HydrophobicContact CB-CB 4Å; L50-N57 HydrophobicContact CD1-CB 4.39Å; L50-N57 PolarHBondContact O-OD1 3.44Å; L50-M63 HydrophobicContact CD2-SD 3.92Å; L50-L67 HydrophobicContact CD2-CD2 4.36Å; L50-S86 PolarHBondContact N-O 3.12Å; L50-A87 HydrophobicContact CB-CB 4.01Å; L50-K88 PolarHBondContact O-N 3.38Å; L50-F92 WeakPolarHBondContact CD1-O 3.49Å; L50-L146 HydrophobicContact CD1-CD2 4.16Å
51	N	98.6	Very high	98.3	Very high	10 Å²	10	50.3 Å²	50.3	5%	0.053	24%	0.242	C	C	.	.			trans	-123.9	42	-161	-171.4	47.2	0	0	0	112.7	E34 P35 P36 V38 I49 K88	E34-N51 PolarHBondContact OE2-ND2 3.05Å; E34-N51 PolarHBondContact OE2-OD1 2.98Å; P35-N51 WeakPolarHBondContact O-CB 3.33Å; P35-N51 PolarHBondContact O-ND2 3.26Å; P36-N51 WeakPolarHBondContact O-CA 3.33Å; P36-N51 WeakPolarHBondContact O-CB 3.13Å; P36-N51 PolarHBondContact O-N 3.18Å; V38-N51 HydrophobicContact CG2-CB 4.02Å; I49-N51 PolarHBondContact O-N 3.23Å; N51-K88 WeakPolarHBondContact OD1-CD 3.48Å; N51-K88 WeakPolarHBondContact OD1-CE 3.29Å; N51-K88 PolarHBondContact OD1-NZ 3.08Å
52	N	98.2	Very high	98.3	Very high	48 Å²	48	49.6 Å²	49.6	26%	0.257	25%	0.246	S	C	.	.			trans	-135.9	62	172.2	-159.8	-20.8	0	0	0	112.5	K54 K55 R56 N57 M63	N52-K54 PolarHBondContact O-N 3.24Å; N52-K55 CarbonylContact O-C 3.48Å; N52-K55 PolarHBondContact O-N 3.37Å; N52-K55 PolarHBondContact OD1-N 2.69Å; N52-R56 PolarHBondContact O-N 3.06Å; N52-N57 WeakPolarHBondContact CA-OD1 3.33Å; N52-N57 PolarHBondContact N-OD1 2.9Å; N52-N57 PolarHBondContact O-N 3.18Å; N52-N57 PolarHBondContact O-OD1 3.38Å; N52-M63 HydrophobicContact CB-CE 3.86Å
53	P	97.9	Very high	98.4	Very high	58 Å²	58	44.4 Å²	44.4	38%	0.377	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-58.8	-31.2	179.7	21.7	-32.6	0	0	0	112.8	K55 R56 K88	P53-K55 PolarHBondContact O-N 3.12Å; P53-R56 PolarHBondContact O-N 2.91Å; P53-K88 HydrophobicContact CG-CB 4.27Å
54	K	97.6	Very high	98.5	Very high	206 Å²	206	37.9 Å²	37.9	90%	0.896	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-61.7	-30.6	176.5	-64.9	-177.7	-178.7	177	0	112.7	N52	N52-K54 PolarHBondContact O-N 3.24Å
55	K	97.9	Very high	98.6	Very high	99 Å²	99	41.5 Å²	41.5	43%	0.43	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-102.9	23.8	169.9	-67.5	-166	171.5	-164.8	0	113.1	N52 P53 N57 A58 D97	N52-K55 CarbonylContact O-C 3.48Å; N52-K55 PolarHBondContact O-N 3.37Å; N52-K55 PolarHBondContact OD1-N 2.69Å; P53-K55 PolarHBondContact O-N 3.12Å; K55-N57 PolarHBondContact O-N 3.31Å; K55-N57 VanDerWaalsContact O-N 3.1Å; K55-A58 WeakPolarHBondContact O-CB 3.3Å; K55-A58 PolarHBondContact O-N 2.59Å; K55-D97 IonicContact NZ-OD2 2.73Å; K55-D97 PolarHBondContact NZ-OD2 3.01Å
56	R	98.5	Very high	98.6	Very high	169 Å²	169	41.7 Å²	41.7	64%	0.638	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	32.6	-179.1	-58.1	-178.9	-178.9	132.2	-1.5	113.8	N52 P53 A58 V91 S94	N52-R56 PolarHBondContact O-N 3.06Å; P53-R56 PolarHBondContact O-N 2.91Å; R56-A58 PolarHBondContact O-N 3.16Å; R56-V91 HydrophobicContact CB-CB 4.13Å; R56-V91 HydrophobicContact CB-CG1 4.02Å; R56-V91 HydrophobicContact CB-CG2 4.31Å; R56-V91 HydrophobicContact CG-CG2 4.32Å; R56-V91 WeakPolarHBondContact O-CG1 3.35Å; R56-S94 PolarHBondContact O-N 2.88Å; R56-S94 VanDerWaalsContact O-N 3.09Å
57	N	98.8	Very high	98.6	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	39.3	-175.9	-61.4	-52.6	0	0	0	113.3	L50 N52 K55 L59 K88 V91 F92 S93	L50-N57 HydrophobicContact CB-CB 4Å; L50-N57 HydrophobicContact CD1-CB 4.39Å; L50-N57 PolarHBondContact O-OD1 3.44Å; N52-N57 WeakPolarHBondContact CA-OD1 3.33Å; N52-N57 PolarHBondContact N-OD1 2.9Å; N52-N57 PolarHBondContact O-N 3.18Å; N52-N57 PolarHBondContact O-OD1 3.38Å; K55-N57 PolarHBondContact O-N 3.31Å; K55-N57 VanDerWaalsContact O-N 3.1Å; N57-L59 PolarHBondContact O-N 2.96Å; N57-K88 PolarHBondContact ND2-O 3.35Å; N57-V91 PolarHBondContact ND2-O 3.35Å; N57-F92 WeakPolarHBondContact CB-O 3.37Å; N57-S93 VanDerWaalsContact O-CB 3.31Å; N57-S93 WeakPolarHBondContact O-CB 3.44Å; N57-S93 PolarHBondContact O-OG 2.75Å
58	A	98.8	Very high	98.6	Very high	7 Å²	7	44.1 Å²	44.1	6%	0.058	21%	0.209	C	C	.	.			trans	-56.7	135.3	177.2	0	0	0	0	0	111.9	K55 R56 S60 M63 G95 D97	K55-A58 WeakPolarHBondContact O-CB 3.3Å; K55-A58 PolarHBondContact O-N 2.59Å; R56-A58 PolarHBondContact O-N 3.16Å; A58-S60 PolarHBondContact O-N 3.34Å; A58-M63 WeakPolarHBondContact O-CB 3.22Å; A58-G95 CarbonylContact C-O 3.24Å; A58-G95 WeakPolarHBondContact CA-O 3.41Å; A58-G95 WeakPolarHBondContact CB-O 3.34Å; A58-D97 HydrophobicContact CB-CB 4.1Å
59	L	98.8	Very high	98.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.233	C	C	.	.			trans	-78	64.4	175.5	-57.4	-173.4	0	0	0	110.3	N57 M63 L64 S93 G95 H96 M121 A142	N57-L59 PolarHBondContact O-N 2.96Å; L59-M63 HydrophobicContact CD2-CG 3.87Å; L59-L64 HydrophobicContact CB-CD2 4.05Å; L59-L64 HydrophobicContact CB-CG 4.2Å; L59-L64 HydrophobicContact CD1-CD2 4.31Å; L59-S93 WeakPolarHBondContact CG-OG 3.46Å; L59-G95 PolarHBondContact N-O 3.32Å; L59-H96 PolarHBondContact O-ND1 3.15Å; L59-M121 HydrophobicContact CD1-CE 4.26Å; L59-A142 HydrophobicContact CD1-CB 3.93Å; L59-A142 WeakPolarHBondContact CD1-O 3.42Å
60	S	98.8	Very high	98.6	Very high	12 Å²	12	47.2 Å²	47.2	8%	0.084	23%	0.232	C	C	.	.			trans	-62.7	162.9	164.2	60	0	0	0	0	111	A58 S62 M63 L64 E100	A58-S60 PolarHBondContact O-N 3.34Å; S60-S62 PolarHBondContact O-N 2.85Å; S60-M63 WeakPolarHBondContact O-CA 3.46Å; S60-M63 WeakPolarHBondContact O-CB 3.22Å; S60-M63 PolarHBondContact O-N 3.26Å; S60-M63 WeakPolarHBondContact OG-CB 3.46Å; S60-M63 PolarHBondContact OG-N 3.34Å; S60-L64 WeakPolarHBondContact O-CG 3.2Å; S60-L64 PolarHBondContact O-N 3.01Å; S60-E100 WeakPolarHBondContact CA-OE2 3.25Å; S60-E100 VanDerWaalsContact CB-OE1 3.29Å; S60-E100 WeakPolarHBondContact CB-OE1 3.33Å; S60-E100 WeakPolarHBondContact CB-OE2 3.33Å
61	L	98.8	Very high	98.6	Very high	11 Å²	11	47.2 Å²	47.2	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-52.8	-44.7	175.1	-179.3	59.2	0	0	0	111.9	M63 L64 E65 E100 Y109 K112 V113 A116	L61-M63 VanDerWaalsContact C-N 3.35Å; L61-M63 PolarHBondContact O-N 2.94Å; L61-L64 PolarHBondContact O-N 3.17Å; L61-E65 HydrophobicContact CD1-CG 4.15Å; L61-E65 HydrophobicContact CG-CG 4.43Å; L61-E65 WeakPolarHBondContact O-CB 3.27Å; L61-E65 WeakPolarHBondContact O-CG 3.34Å; L61-E65 PolarHBondContact O-N 3.07Å; L61-E100 PolarHBondContact N-OE2 3.41Å; L61-Y109 HydrophobicContact CD2-CE2 3.78Å; L61-K112 HydrophobicContact CD1-CD 4.3Å; L61-K112 HydrophobicContact CD1-CG 4.19Å; L61-K112 HydrophobicContact CD2-CD 3.81Å; L61-K112 HydrophobicContact CD2-CG 4.4Å; L61-V113 HydrophobicContact CB-CG2 4.27Å; L61-A116 HydrophobicContact CD1-CB 3.81Å
62	S	98.4	Very high	98.6	Very high	63 Å²	63	50 Å²	50	44%	0.441	25%	0.246	S	C	.	.	H	α-helix	trans	-64.7	-34.7	176.9	178.9	0	0	0	0	113.2	S60 S66	S60-S62 PolarHBondContact O-N 2.85Å; S62-S66 WeakPolarHBondContact O-CB 3.47Å; S62-S66 PolarHBondContact O-N 2.89Å
63	M	98.8	Very high	98.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-43.8	172.9	-179.1	67.2	80.7	0	0	111	P36 T37 L50 N52 A58 L59 S60 L61 S66 L67	P36-M63 HydrophobicContact CB-CB 4.39Å; P36-M63 HydrophobicContact CB-CE 4.12Å; P36-M63 HydrophobicContact CB-SD 3.78Å; P36-M63 WeakPolarHBondContact O-CE 3.42Å; T37-M63 HydrophobicContact CG2-SD 3.57Å; T37-M63 VanDerWaalsContact CG2-SD 3.57Å; L50-M63 HydrophobicContact CD2-SD 3.92Å; N52-M63 HydrophobicContact CB-CE 3.86Å; A58-M63 WeakPolarHBondContact O-CB 3.22Å; L59-M63 HydrophobicContact CD2-CG 3.87Å; S60-M63 WeakPolarHBondContact O-CA 3.46Å; S60-M63 WeakPolarHBondContact O-CB 3.22Å; S60-M63 PolarHBondContact O-N 3.26Å; S60-M63 WeakPolarHBondContact OG-CB 3.46Å; S60-M63 PolarHBondContact OG-N 3.34Å; L61-M63 VanDerWaalsContact C-N 3.35Å; L61-M63 PolarHBondContact O-N 2.94Å; M63-S66 PolarHBondContact O-N 2.97Å; M63-L67 VanDerWaalsContact O-CB 3.27Å; M63-L67 WeakPolarHBondContact O-CB 3.42Å; M63-L67 PolarHBondContact O-N 3.49Å
64	L	98.9	Very high	98.5	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-46.8	179.1	-68.5	167.6	0	0	0	111.9	L59 S60 L61 S66 L67 R68 A116 C117 V120	L59-L64 HydrophobicContact CB-CD2 4.05Å; L59-L64 HydrophobicContact CB-CG 4.2Å; L59-L64 HydrophobicContact CD1-CD2 4.31Å; S60-L64 WeakPolarHBondContact O-CG 3.2Å; S60-L64 PolarHBondContact O-N 3.01Å; L61-L64 PolarHBondContact O-N 3.17Å; L64-S66 VanDerWaalsContact C-N 3.34Å; L64-S66 PolarHBondContact O-N 3.31Å; L64-L67 PolarHBondContact O-N 2.82Å; L64-R68 WeakPolarHBondContact O-CB 3.31Å; L64-R68 PolarHBondContact O-N 3.37Å; L64-A116 HydrophobicContact CB-CB 4.42Å; L64-A116 HydrophobicContact CD1-CB 4.45Å; L64-C117 HydrophobicContact CD1-CB 3.75Å; L64-C117 HydrophobicContact CD2-CB 4.21Å; L64-V120 HydrophobicContact CD2-CG2 4.36Å
65	E	98.7	Very high	98.5	Very high	87 Å²	87	42 Å²	42	41%	0.407	21%	0.213	S	C	.	.	H	α-helix	trans	-60.9	-41.7	175.4	-71.8	172.2	167.2	0	0	111.2	L61 S69 K112	L61-E65 HydrophobicContact CD1-CG 4.15Å; L61-E65 HydrophobicContact CG-CG 4.43Å; L61-E65 WeakPolarHBondContact O-CB 3.27Å; L61-E65 WeakPolarHBondContact O-CG 3.34Å; L61-E65 PolarHBondContact O-N 3.07Å; E65-S69 WeakPolarHBondContact O-CB 3.44Å; E65-S69 PolarHBondContact O-N 2.96Å; E65-K112 WeakPolarHBondContact OE1-CE 3.35Å; E65-K112 IonicContact OE1-NZ 3.67Å; E65-K112 PolarHBondContact OE1-NZ 3.39Å
66	S	98.8	Very high	98.3	Very high	22 Å²	22	43.3 Å²	43.3	15%	0.154	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-43.6	175.7	-174.4	0	0	0	0	112.7	T37 S62 M63 L64 N70	T37-S66 PolarHBondContact N-OG 2.9Å; T37-S66 PolarHBondContact OG1-O 3.45Å; T37-S66 PolarHBondContact OG1-OG 3.45Å; S62-S66 WeakPolarHBondContact O-CB 3.47Å; S62-S66 PolarHBondContact O-N 2.89Å; M63-S66 PolarHBondContact O-N 2.97Å; L64-S66 VanDerWaalsContact C-N 3.34Å; L64-S66 PolarHBondContact O-N 3.31Å; S66-N70 PolarHBondContact O-N 3.17Å; S66-N70 VanDerWaalsContact O-N 3.09Å; S66-N70 PolarHBondContact O-ND2 3.22Å
67	L	98.8	Very high	98.2	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-47.9	176.5	178.8	54.9	0	0	0	111.2	T37 I48 L50 M63 L64 S69 N70 I71 I85 V120 L146	T37-L67 HydrophobicContact CG2-CB 4.21Å; I48-L67 HydrophobicContact CD1-CD1 4.4Å; I48-L67 HydrophobicContact CG2-CD1 3.77Å; L50-L67 HydrophobicContact CD2-CD2 4.36Å; M63-L67 VanDerWaalsContact O-CB 3.27Å; M63-L67 WeakPolarHBondContact O-CB 3.42Å; M63-L67 PolarHBondContact O-N 3.49Å; L64-L67 PolarHBondContact O-N 2.82Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 3.42Å; L67-N70 PolarHBondContact O-N 3.32Å; L67-I71 HydrophobicContact CD1-CD1 3.95Å; L67-I71 HydrophobicContact CD1-CG1 4.21Å; L67-I71 HydrophobicContact CG-CD1 3.97Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; L67-I71 PolarHBondContact O-N 3.19Å; L67-I85 HydrophobicContact CD1-CD1 4.27Å; L67-V120 HydrophobicContact CD2-CG1 3.81Å; L67-V120 HydrophobicContact CG-CG1 4.14Å; L67-L146 HydrophobicContact CD2-CD1 4.26Å; L67-L146 HydrophobicContact CD2-CD2 4.16Å
68	R	98.8	Very high	97.9	Very high	105 Å²	105	40 Å²	40	40%	0.396	22%	0.223	S	C	.	.	H	α-helix	trans	-56	-47	176.8	-160.4	-173.3	79.4	144.6	9.2	111.5	L64 N70 I71 L72 E119 V120 L123	L64-R68 WeakPolarHBondContact O-CB 3.31Å; L64-R68 PolarHBondContact O-N 3.37Å; R68-N70 PolarHBondContact O-N 2.98Å; R68-I71 PolarHBondContact O-N 3.16Å; R68-L72 HydrophobicContact CG-CD1 4.14Å; R68-L72 WeakPolarHBondContact O-CB 3.41Å; R68-L72 WeakPolarHBondContact O-CG 3.42Å; R68-L72 PolarHBondContact O-N 2.94Å; R68-E119 IonicContact CZ-OE2 3.53Å; R68-E119 IonicContact NH1-OE2 3.1Å; R68-E119 PolarHBondContact NH1-OE2 3.34Å; R68-V120 HydrophobicContact CB-CG2 3.84Å; R68-V120 HydrophobicContact CG-CG2 4.21Å; R68-L123 HydrophobicContact CG-CD2 3.88Å
69	S	98.7	Very high	97.7	Very high	71 Å²	71	45.5 Å²	45.5	50%	0.497	25%	0.251	S	S	.	.	H	α-helix	trans	-59.7	-44.6	177.3	-177.9	0	0	0	0	112.3	E65 L67 L72 A73	E65-S69 WeakPolarHBondContact O-CB 3.44Å; E65-S69 PolarHBondContact O-N 2.96Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 3.42Å; S69-L72 PolarHBondContact O-N 2.91Å; S69-A73 PolarHBondContact O-N 2.84Å
70	N	98.7	Very high	97.7	Very high	19 Å²	19	45.5 Å²	45.5	10%	0.102	25%	0.251	C	S	.	.	H	α-helix	trans	-75.2	-22.1	180	-79.9	-42.2	0	0	0	114.5	T37 R39 R46 I48 S66 L67 R68	T37-N70 PolarHBondContact OG1-ND2 3.34Å; R39-N70 HydrophobicContact CB-CB 4.29Å; R39-N70 WeakPolarHBondContact CB-OD1 3.39Å; R39-N70 WeakPolarHBondContact CD-OD1 3.45Å; R39-N70 PolarHBondContact NH1-OD1 2.93Å; R46-N70 WeakPolarHBondContact CD-O 3.42Å; R46-N70 PolarHBondContact NH1-O 3.02Å; I48-N70 HydrophobicContact CD1-CB 4Å; I48-N70 WeakPolarHBondContact CD1-O 3.47Å; I48-N70 HydrophobicContact CG1-CB 4.28Å; I48-N70 HydrophobicContact CG2-CB 4.15Å; S66-N70 PolarHBondContact O-N 3.17Å; S66-N70 VanDerWaalsContact O-N 3.09Å; S66-N70 PolarHBondContact O-ND2 3.22Å; L67-N70 PolarHBondContact O-N 3.32Å; R68-N70 PolarHBondContact O-N 2.98Å
71	I	98.7	Very high	97.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-70.8	-50	167.1	-67.5	166	0	0	0	109.9	R46 I48 L67 R68 I83 V120 L123 I124 I127	R46-I71 PolarHBondContact NH1-O 2.86Å; I48-I71 HydrophobicContact CD1-CB 4.49Å; I48-I71 HydrophobicContact CD1-CG1 3.68Å; L67-I71 HydrophobicContact CD1-CD1 3.95Å; L67-I71 HydrophobicContact CD1-CG1 4.21Å; L67-I71 HydrophobicContact CG-CD1 3.97Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; L67-I71 PolarHBondContact O-N 3.19Å; R68-I71 PolarHBondContact O-N 3.16Å; I71-I83 HydrophobicContact CG2-CD1 4.12Å; I71-V120 HydrophobicContact CD1-CG1 4.39Å; I71-L123 HydrophobicContact CB-CD2 4.04Å; I71-L123 HydrophobicContact CD1-CD2 4.46Å; I71-L123 HydrophobicContact CG2-CD2 3.65Å; I71-L123 HydrophobicContact CG2-CG 3.97Å; I71-I124 HydrophobicContact CD1-CD1 4.41Å; I71-I124 HydrophobicContact CD1-CG1 4Å; I71-I127 HydrophobicContact CG2-CD1 3.77Å; I71-I127 HydrophobicContact CG2-CG2 4.21Å
72	L	98.5	Very high	97.7	Very high	68 Å²	68	45.4 Å²	45.4	36%	0.356	25%	0.248	S	C	.	.	H	α-helix	trans	-75	-24.7	-173.5	-74.6	173.5	0	0	0	115.8	R68 S69 D74 I75 L123	R68-L72 HydrophobicContact CG-CD1 4.14Å; R68-L72 WeakPolarHBondContact O-CB 3.41Å; R68-L72 WeakPolarHBondContact O-CG 3.42Å; R68-L72 PolarHBondContact O-N 2.94Å; S69-L72 PolarHBondContact O-N 2.91Å; L72-D74 PolarHBondContact O-N 3.47Å; L72-I75 WeakPolarHBondContact O-CB 3.37Å; L72-I75 WeakPolarHBondContact O-CG2 3.05Å; L72-I75 PolarHBondContact O-N 3.03Å; L72-L123 HydrophobicContact CD1-CD2 4.36Å; L72-L123 HydrophobicContact CD2-CD1 3.6Å; L72-L123 HydrophobicContact CD2-CD2 4.13Å; L72-L123 HydrophobicContact CD2-CG 4.48Å; L72-L123 HydrophobicContact CG-CD1 4.28Å; L72-L123 HydrophobicContact CG-CD2 3.88Å
73	A	98.1	Very high	97.7	Very high	21 Å²	21	42.4 Å²	42.4	17%	0.174	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	128.2	-178.2	0	0	0	0	0	111.2	R39 R46 S69 I75	R39-A73 VanDerWaalsContact NH1-CB 3.32Å; R46-A73 PolarHBondContact NH1-O 3.18Å; R46-A73 PolarHBondContact NH2-O 2.82Å; S69-A73 PolarHBondContact O-N 2.84Å; A73-I75 PolarHBondContact O-N 3.24Å
74	D	96.8	Very high	97.7	Very high	105 Å²	105	42.4 Å²	42.4	56%	0.561	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	30.3	176.2	-39.6	-51.8	0	0	0	114.2	R39 L72 D76 S77	R39-D74 IonicContact NH2-OD2 2.63Å; L72-D74 PolarHBondContact O-N 3.47Å; D74-D76 PolarHBondContact O-N 2.97Å; D74-S77 WeakPolarHBondContact O-CB 3.4Å; D74-S77 PolarHBondContact O-N 2.79Å
75	I	96.8	Very high	97.7	Very high	20 Å²	20	42.3 Å²	42.3	10%	0.103	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-32.3	-169.9	-171.3	54.9	0	0	0	113.2	L72 A73 S77 L80 I127 P128 V129 R234	L72-I75 WeakPolarHBondContact O-CB 3.37Å; L72-I75 WeakPolarHBondContact O-CG2 3.05Å; L72-I75 PolarHBondContact O-N 3.03Å; A73-I75 PolarHBondContact O-N 3.24Å; I75-S77 VanDerWaalsContact C-N 3.3Å; I75-S77 PolarHBondContact O-N 2.97Å; I75-L80 HydrophobicContact CD1-CD2 3.6Å; I75-I127 HydrophobicContact CD1-CB 4.1Å; I75-I127 HydrophobicContact CD1-CD1 4.38Å; I75-I127 HydrophobicContact CD1-CG2 4.12Å; I75-I127 HydrophobicContact CG1-CB 4.42Å; I75-I127 HydrophobicContact CG1-CG2 4.15Å; I75-P128 HydrophobicContact CD1-CG 4.42Å; I75-P128 HydrophobicContact CG1-CG 4.18Å; I75-V129 HydrophobicContact CD1-CG2 4.05Å; I75-R234 PolarHBondContact O-NH2 3.44Å
76	D	94.6	Very high	97.7	Very high	126 Å²	126	38.4 Å²	38.4	67%	0.674	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-7.3	178.5	-61.1	-51.8	0	0	0	113.8	D74 D78 R234	D74-D76 PolarHBondContact O-N 2.97Å; D76-D78 PolarHBondContact O-N 3.19Å; D76-R234 PolarHBondContact O-NH1 2.95Å; D76-R234 PolarHBondContact O-NH2 3.04Å
77	S	95.7	Very high	97.7	Very high	42 Å²	42	38.7 Å²	38.7	29%	0.294	21%	0.213	S	C	.	.			trans	-61.6	127	178.8	-172	0	0	0	0	111.4	D74 I75 N79 L80 R234	D74-S77 WeakPolarHBondContact O-CB 3.4Å; D74-S77 PolarHBondContact O-N 2.79Å; I75-S77 VanDerWaalsContact C-N 3.3Å; I75-S77 PolarHBondContact O-N 2.97Å; S77-N79 PolarHBondContact O-N 3.17Å; S77-N79 VanDerWaalsContact O-N 3.12Å; S77-N79 PolarHBondContact OG-N 3.21Å; S77-L80 PolarHBondContact O-N 3.02Å; S77-R234 PolarHBondContact O-NE 2.91Å
78	D	92.6	Very high	97.7	Very high	59 Å²	59	42.8 Å²	42.8	32%	0.316	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.2	175.1	-60.4	-34.5	0	0	0	112.9	D76 L80 R81 R234 K290	D76-D78 PolarHBondContact O-N 3.19Å; D78-L80 VanDerWaalsContact C-N 3.31Å; D78-L80 PolarHBondContact O-N 3.06Å; D78-R81 WeakPolarHBondContact O-CD 3.41Å; D78-R234 IonicContact OD1-NH1 3.45Å; D78-R234 PolarHBondContact OD1-NH1 2.86Å; D78-R234 VanDerWaalsContact OD1-NH1 3.1Å; D78-K290 WeakPolarHBondContact OD2-CG 3.24Å
79	N	94.6	Very high	97.6	Very high	121 Å²	121	39.8 Å²	39.8	65%	0.647	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-22.4	173.3	-71.2	-39.4	0	0	0	112.9	G44 S77	G44-N79 WeakPolarHBondContact CA-O 3.48Å; S77-N79 PolarHBondContact O-N 3.17Å; S77-N79 VanDerWaalsContact O-N 3.12Å; S77-N79 PolarHBondContact OG-N 3.21Å
80	L	98.3	Very high	97.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.24	C	C	.	.			trans	-84.2	119.5	175.7	179.7	64.8	0	0	0	109.8	R46 I75 S77 D78 I83 V129 R234	R46-L80 HydrophobicContact CB-CD1 3.58Å; I75-L80 HydrophobicContact CD1-CD2 3.6Å; S77-L80 PolarHBondContact O-N 3.02Å; D78-L80 VanDerWaalsContact C-N 3.31Å; D78-L80 PolarHBondContact O-N 3.06Å; L80-I83 HydrophobicContact CD1-CG1 4.29Å; L80-V129 HydrophobicContact CD2-CG2 4.12Å; L80-V129 HydrophobicContact CG-CG1 4.24Å; L80-V129 HydrophobicContact CG-CG2 4.22Å; L80-V129 WeakPolarHBondContact O-CG1 3.46Å; L80-R234 WeakPolarHBondContact O-CD 3.48Å; L80-R234 PolarHBondContact O-NE 2.97Å; L80-R234 VanDerWaalsContact O-NE 3.1Å
81	R	98.6	Very high	97.6	Very high	21 Å²	21	41.5 Å²	41.5	8%	0.079	24%	0.242	C	C	.	.			trans	-117.8	-34.2	-172.4	-54.6	-54.5	-50.7	-73.1	-13.9	113.4	G44 D78 V229 C230 A232 N289	G44-R81 WeakPolarHBondContact O-CB 3.36Å; G44-R81 PolarHBondContact O-N 3.28Å; D78-R81 WeakPolarHBondContact O-CD 3.41Å; R81-V229 PolarHBondContact NH2-O 2.76Å; R81-C230 HydrophobicContact CB-CB 4.38Å; R81-C230 PolarHBondContact NH1-O 2.98Å; R81-A232 PolarHBondContact NH1-O 2.95Å; R81-A232 PolarHBondContact NH2-O 3.23Å; R81-N289 VanDerWaalsContact CZ-OD1 3.22Å; R81-N289 PolarHBondContact NH1-OD1 2.94Å
82	V	98.9	Very high	97.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	146	-177.8	60.9	0	0	0	0	110.3	G44 I45 R46 P130 I132 A226 V229	G44-V82 PolarHBondContact O-N 2.94Å; I45-V82 HydrophobicContact CB-CG1 4.21Å; I45-V82 HydrophobicContact CG1-CG1 3.82Å; I45-V82 HydrophobicContact CG2-CG1 4.24Å; R46-V82 PolarHBondContact N-O 3.14Å; V82-P130 HydrophobicContact CG2-CB 4.41Å; V82-P130 WeakPolarHBondContact CG2-O 3.41Å; V82-I132 HydrophobicContact CG2-CD1 3.77Å; V82-I132 HydrophobicContact CG2-CG1 3.94Å; V82-A226 HydrophobicContact CG1-CB 3.85Å; V82-V229 HydrophobicContact CB-CB 4.25Å; V82-V229 HydrophobicContact CB-CG1 3.97Å; V82-V229 HydrophobicContact CG2-CB 4.47Å; V82-V229 HydrophobicContact CG2-CG1 4.41Å
83	I	98.9	Very high	97.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.1	173.2	-57.4	-178.8	0	0	0	109.3	R46 I48 I71 L80 I85 I127 V129 P130 V131 I132	R46-I83 HydrophobicContact CB-CG1 4.31Å; R46-I83 CarbonylContact O-C 3.51Å; R46-I83 WeakPolarHBondContact O-CA 3.39Å; I48-I83 HydrophobicContact CD1-CG2 3.73Å; I48-I83 HydrophobicContact CG1-CG2 4.07Å; I71-I83 HydrophobicContact CG2-CD1 4.12Å; L80-I83 HydrophobicContact CD1-CG1 4.29Å; I83-I85 HydrophobicContact CG2-CG1 4.16Å; I83-I127 HydrophobicContact CD1-CD1 3.77Å; I83-V129 HydrophobicContact CD1-CG2 4.08Å; I83-V129 HydrophobicContact CG1-CG2 3.95Å; I83-P130 PolarHBondContact N-O 3.44Å; I83-V131 HydrophobicContact CB-CG1 4.37Å; I83-V131 HydrophobicContact CB-CG2 4.34Å; I83-V131 HydrophobicContact CG2-CG1 4.36Å; I83-V131 CarbonylContact O-C 3.54Å; I83-V131 WeakPolarHBondContact O-CA 3.41Å; I83-I132 PolarHBondContact O-N 3.03Å
84	V	98.9	Very high	97.7	Very high	1 Å²	1	39 Å²	39	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.2	170.6	-179	0	0	0	0	108.4	I45 R46 R47 I48 I132 M134 T222 A226	I45-V84 HydrophobicContact CG2-CG2 3.9Å; R46-V84 PolarHBondContact O-N 3.41Å; R47-V84 CarbonylContact C-O 3.55Å; R47-V84 WeakPolarHBondContact CA-O 3.47Å; I48-V84 PolarHBondContact N-O 2.98Å; V84-I132 CarbonylContact C-O 3.6Å; V84-I132 WeakPolarHBondContact CA-O 3.36Å; V84-I132 HydrophobicContact CG2-CB 4.37Å; V84-I132 HydrophobicContact CG2-CD1 4.46Å; V84-M134 HydrophobicContact CG1-CB 3.96Å; V84-T222 HydrophobicContact CG1-CG2 3.72Å; V84-T222 HydrophobicContact CG2-CG2 4.29Å; V84-A226 HydrophobicContact CG2-CB 4.26Å
85	I	98.9	Very high	97.8	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.6	173.5	-58.3	178.2	0	0	0	108.3	I48 L67 I83 F92 I124 V131 I132 M134 L146	I48-I85 WeakPolarHBondContact O-CA 3.46Å; L67-I85 HydrophobicContact CD1-CD1 4.27Å; I83-I85 HydrophobicContact CG2-CG1 4.16Å; I85-F92 HydrophobicContact CG2-CE2 4.37Å; I85-F92 HydrophobicContact CG2-CZ 4.11Å; I85-I124 HydrophobicContact CD1-CD1 4.05Å; I85-V131 HydrophobicContact CD1-CG1 3.59Å; I85-V131 HydrophobicContact CG1-CG1 3.87Å; I85-I132 PolarHBondContact N-O 2.96Å; I85-M134 PolarHBondContact O-N 3.05Å; I85-L146 HydrophobicContact CD1-CD1 4.33Å; I85-L146 HydrophobicContact CG2-CD2 4.32Å
86	S	98.9	Very high	97.9	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.028	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	179.1	-177.4	57.5	0	0	0	0	110	I48 I49 L50	I48-S86 PolarHBondContact O-N 3.37Å; I48-S86 PolarHBondContact O-OG 2.85Å; I49-S86 CarbonylContact C-O 3.56Å; I49-S86 WeakPolarHBondContact CA-O 3.29Å; L50-S86 PolarHBondContact N-O 3.12Å
87	A	98.9	Very high	98	Very high	28 Å²	28	29.1 Å²	29.1	23%	0.231	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	151.1	-177.3	0	0	0	0	0	112.5	L50 F92	L50-A87 HydrophobicContact CB-CB 4.01Å; A87-F92 HydrophobicContact CB-CB 4.46Å; A87-F92 HydrophobicContact CB-CD2 3.91Å; A87-F92 HydrophobicContact CB-CG 4.44Å; A87-F92 WeakPolarHBondContact CB-O 3.39Å
88	K	98.4	Very high	98.1	Very high	88 Å²	88	31.4 Å²	31.4	38%	0.383	18%	0.184	S	C	.	.	S	Bend	trans	-83.5	138.7	166.2	-68.3	-164.1	-169.1	160.6	0	110.6	E34 I49 L50 N51 P53 N57	E34-K88 IonicContact OE2-NZ 3.25Å; I49-K88 HydrophobicContact CG2-CG 3.87Å; L50-K88 PolarHBondContact O-N 3.38Å; N51-K88 WeakPolarHBondContact OD1-CD 3.48Å; N51-K88 WeakPolarHBondContact OD1-CE 3.29Å; N51-K88 PolarHBondContact OD1-NZ 3.08Å; P53-K88 HydrophobicContact CG-CB 4.27Å; N57-K88 PolarHBondContact ND2-O 3.35Å
89	G	97.8	Very high	98.4	Very high	42 Å²	42	35.9 Å²	35.9	43%	0.433	20%	0.201	S	C	.	.	S	Bend	trans	85.7	-179.3	174.9	0	0	0	0	0	114.4	V91	G89-V91 VanDerWaalsContact C-N 3.28Å; G89-V91 PolarHBondContact O-N 3.18Å
90	P	98	Very high	98.5	Very high	102 Å²	102	31.4 Å²	31.4	66%	0.662	18%	0.176	S	C	*	.	S	Bend	trans	-81.4	2	-167.7	33.4	-37.8	0	0	0	115.2	V138	P90-V138 PolarHBondContact O-N 2.79Å
91	V	98.8	Very high	98.5	Very high	24 Å²	24	32.8 Å²	32.8	15%	0.145	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	116.9	177.2	-177.9	0	0	0	0	107.1	R56 N57 G89 V138	R56-V91 HydrophobicContact CB-CB 4.13Å; R56-V91 HydrophobicContact CB-CG1 4.02Å; R56-V91 HydrophobicContact CB-CG2 4.31Å; R56-V91 HydrophobicContact CG-CG2 4.32Å; R56-V91 WeakPolarHBondContact O-CG1 3.35Å; N57-V91 PolarHBondContact ND2-O 3.35Å; G89-V91 VanDerWaalsContact C-N 3.28Å; G89-V91 PolarHBondContact O-N 3.18Å; V91-V138 CarbonylContact C-O 3.51Å; V91-V138 HydrophobicContact CG1-CB 4.29Å; V91-V138 WeakPolarHBondContact CG1-O 3.12Å; V91-V138 HydrophobicContact CG2-CB 4.37Å
92	F	98.9	Very high	98.5	Very high	1 Å²	1	34.7 Å²	34.7	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	-53.2	175.1	174.3	-97.2	0	0	0	110.4	L50 N57 I85 A87 V135 V138 A139 L146 V147	L50-F92 WeakPolarHBondContact CD1-O 3.49Å; N57-F92 WeakPolarHBondContact CB-O 3.37Å; I85-F92 HydrophobicContact CG2-CE2 4.37Å; I85-F92 HydrophobicContact CG2-CZ 4.11Å; A87-F92 HydrophobicContact CB-CB 4.46Å; A87-F92 HydrophobicContact CB-CD2 3.91Å; A87-F92 HydrophobicContact CB-CG 4.44Å; A87-F92 WeakPolarHBondContact CB-O 3.39Å; F92-V135 HydrophobicContact CB-CG1 3.81Å; F92-V135 HydrophobicContact CD2-CB 4.44Å; F92-V135 HydrophobicContact CD2-CG1 4.36Å; F92-V135 HydrophobicContact CD2-CG2 4.15Å; F92-V135 HydrophobicContact CE2-CG2 4.25Å; F92-V135 HydrophobicContact CG-CG1 4.03Å; F92-V135 HydrophobicContact CG-CG2 4.31Å; F92-V138 PolarHBondContact N-O 2.9Å; F92-A139 HydrophobicContact CB-CB 4.35Å; F92-A139 HydrophobicContact CD1-CB 4.04Å; F92-L146 HydrophobicContact CE1-CB 4.36Å; F92-L146 HydrophobicContact CE1-CD2 3.92Å; F92-L146 HydrophobicContact CE1-CG 4.18Å; F92-L146 HydrophobicContact CZ-CD2 4.03Å; F92-L146 HydrophobicContact CZ-CG 4.33Å; F92-V147 HydrophobicContact CD1-CG2 3.9Å; F92-V147 HydrophobicContact CE1-CG2 3.58Å; F92-V147 HydrophobicContact CZ-CG2 4.21Å
93	S	98.9	Very high	98.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	139.4	164.3	179.6	0	0	0	0	111.2	N57 L59 G95 V138 A139 T140	N57-S93 VanDerWaalsContact O-CB 3.31Å; N57-S93 WeakPolarHBondContact O-CB 3.44Å; N57-S93 PolarHBondContact O-OG 2.75Å; L59-S93 WeakPolarHBondContact CG-OG 3.46Å; S93-G95 VanDerWaalsContact C-N 3.28Å; S93-G95 PolarHBondContact O-N 3.37Å; S93-G95 PolarHBondContact OG-N 3.21Å; S93-V138 PolarHBondContact N-O 2.76Å; S93-A139 WeakPolarHBondContact O-CA 3.33Å; S93-T140 PolarHBondContact O-N 3.48Å
94	S	98.8	Very high	98.3	Very high	36 Å²	36	44.9 Å²	44.9	25%	0.252	27%	0.274	S	S	.	.			trans	-78.3	-4.5	173.4	57.7	0	0	0	0	114.8	R56 T140	R56-S94 PolarHBondContact O-N 2.88Å; R56-S94 VanDerWaalsContact O-N 3.09Å; S94-T140 CarbonylContact C-O 2.99Å; S94-T140 VanDerWaalsContact C-O 3.24Å; S94-T140 VanDerWaalsContact C-OG1 3.27Å; S94-T140 VanDerWaalsContact CA-OG1 3.29Å; S94-T140 WeakPolarHBondContact CA-OG1 3.37Å; S94-T140 PolarHBondContact O-OG1 3.44Å
95	G	98.7	Very high	98.3	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	87.7	-159	-164.8	0	0	0	0	0	111.8	A58 L59 S93 T140	A58-G95 CarbonylContact C-O 3.24Å; A58-G95 WeakPolarHBondContact CA-O 3.41Å; A58-G95 WeakPolarHBondContact CB-O 3.34Å; L59-G95 PolarHBondContact N-O 3.32Å; S93-G95 VanDerWaalsContact C-N 3.28Å; S93-G95 PolarHBondContact O-N 3.37Å; S93-G95 PolarHBondContact OG-N 3.21Å; G95-T140 WeakPolarHBondContact CA-O 3.39Å; G95-T140 PolarHBondContact N-O 2.9Å
96	H	98.8	Very high	98.2	Very high	24 Å²	24	50.5 Å²	50.5	11%	0.111	31%	0.308	C	S	.	.	S	Bend	trans	-58.9	151.6	-174.3	-62.3	-60.1	0	0	0	114.4	L59 L98 L101 F114	L59-H96 PolarHBondContact O-ND1 3.15Å; H96-L98 PolarHBondContact O-N 3.32Å; H96-L101 HydrophobicContact CB-CD1 3.85Å; H96-F114 AromaticContact CD2-CE1 3.69Å; H96-F114 AromaticContact NE2-CD1 3.63Å; H96-F114 AromaticContact NE2-CE1 3.58Å
97	D	98.5	Very high	98.2	Very high	18 Å²	18	59.8 Å²	59.8	10%	0.096	34%	0.343	C	S	.	.			trans	-72.6	106.5	166.5	-170	-20.7	0	0	0	108.1	K55 A58 K99 E100	K55-D97 IonicContact NZ-OD2 2.73Å; K55-D97 PolarHBondContact NZ-OD2 3.01Å; A58-D97 HydrophobicContact CB-CB 4.1Å; D97-K99 PolarHBondContact O-N 3.28Å; D97-K99 WeakPolarHBondContact OD1-CB 3.08Å; D97-K99 WeakPolarHBondContact OD1-CG 3.41Å; D97-K99 PolarHBondContact OD1-N 2.98Å; D97-E100 WeakPolarHBondContact O-CB 3.19Å; D97-E100 PolarHBondContact O-N 3.25Å
98	L	97.5	Very high	98.2	Very high	91 Å²	91	64.8 Å²	64.8	48%	0.476	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-60.4	-15.7	-176.1	-61.6	-178.2	0	0	0	113.5	H96 E100 L101 V168	H96-L98 PolarHBondContact O-N 3.32Å; L98-E100 PolarHBondContact O-N 3.19Å; L98-L101 HydrophobicContact CD2-CD1 4.2Å; L98-L101 PolarHBondContact O-N 2.98Å; L98-L101 VanDerWaalsContact O-N 3.12Å; L98-V168 HydrophobicContact CD1-CB 4.44Å; L98-V168 HydrophobicContact CD1-CG1 4.28Å; L98-V168 HydrophobicContact CD1-CG2 4.31Å
99	K	97.8	Very high	98.2	Very high	152 Å²	152	63.9 Å²	63.9	66%	0.661	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-67	-22.7	172.4	-60.7	179.8	178.1	-172.3	0	113	D97 L101 Q105	D97-K99 PolarHBondContact O-N 3.28Å; D97-K99 WeakPolarHBondContact OD1-CB 3.08Å; D97-K99 WeakPolarHBondContact OD1-CG 3.41Å; D97-K99 PolarHBondContact OD1-N 2.98Å; K99-L101 VanDerWaalsContact C-N 3.35Å; K99-Q105 PolarHBondContact O-NE2 2.86Å
100	E	98.1	Very high	98.2	Very high	27 Å²	27	63.8 Å²	63.8	13%	0.126	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-83.9	-9.7	173.9	-73.1	-177.4	178.8	0	0	112.7	S60 L61 D97 L98 Y109 H110	S60-E100 WeakPolarHBondContact CA-OE2 3.25Å; S60-E100 VanDerWaalsContact CB-OE1 3.29Å; S60-E100 WeakPolarHBondContact CB-OE1 3.33Å; S60-E100 WeakPolarHBondContact CB-OE2 3.33Å; L61-E100 PolarHBondContact N-OE2 3.41Å; D97-E100 WeakPolarHBondContact O-CB 3.19Å; D97-E100 PolarHBondContact O-N 3.25Å; L98-E100 PolarHBondContact O-N 3.19Å; E100-Y109 HydrophobicContact CB-CE1 3.77Å; E100-Y109 HydrophobicContact CG-CE1 3.96Å; E100-Y109 WeakPolarHBondContact O-CD1 3.48Å; E100-H110 PolarHBondContact O-CD2 3.24Å
101	L	97.9	Very high	98.2	Very high	29 Å²	29	61.4 Å²	61.4	15%	0.152	33%	0.332	C	S	.	.	S	Bend	trans	-113	15.2	-176	-58	-177.8	0	0	0	113.6	H96 L98 K99 H110 V113 F114 L170	H96-L101 HydrophobicContact CB-CD1 3.85Å; L98-L101 HydrophobicContact CD2-CD1 4.2Å; L98-L101 PolarHBondContact O-N 2.98Å; L98-L101 VanDerWaalsContact O-N 3.12Å; K99-L101 VanDerWaalsContact C-N 3.35Å; L101-H110 HydrophobicContact CD2-CB 4.48Å; L101-V113 HydrophobicContact CD2-CB 4.41Å; L101-V113 HydrophobicContact CD2-CG1 4.16Å; L101-F114 HydrophobicContact CD1-CE1 4.42Å; L101-F114 HydrophobicContact CD1-CZ 3.98Å; L101-F114 HydrophobicContact CD2-CE2 4.1Å; L101-F114 HydrophobicContact CD2-CZ 3.94Å; L101-L170 HydrophobicContact CD1-CD2 3.79Å
102	T	98.1	Very high	98.2	Very high	62 Å²	62	64.8 Å²	64.8	38%	0.38	35%	0.345	S	S	.	.	S	Bend	trans	-76.7	156.7	175	66.1	0	0	0	0	111.4	A104 Q105 H110	T102-A104 PolarHBondContact O-N 2.95Å; T102-Q105 PolarHBondContact O-N 2.62Å; T102-Q105 VanDerWaalsContact O-N 3.08Å; T102-H110 PolarHBondContact O-CE1 2.72Å; T102-H110 PolarHBondContact O-NE2 2.8Å
103	S	97	Very high	98.2	Very high	119 Å²	119	64.7 Å²	64.7	83%	0.832	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-55.8	-32.8	177.4	51.1	0	0	0	0	113.3	Q105 G106	S103-Q105 PolarHBondContact O-N 3.07Å; S103-G106 PolarHBondContact O-N 2.95Å; S103-G106 VanDerWaalsContact O-N 3.15Å
104	A	97.3	Very high	98.2	Very high	94 Å²	94	67.5 Å²	67.5	78%	0.777	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-63.5	-21.7	178.4	0	0	0	0	0	114.4	T102	T102-A104 PolarHBondContact O-N 2.95Å
105	Q	97.6	Very high	98.2	Very high	89 Å²	89	71.2 Å²	71.2	42%	0.416	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-80.9	-21	176.6	-58.5	-70.7	3.7	0	0	112.9	K99 T102 S103 Y109	K99-Q105 PolarHBondContact O-NE2 2.86Å; T102-Q105 PolarHBondContact O-N 2.62Å; T102-Q105 VanDerWaalsContact O-N 3.08Å; S103-Q105 PolarHBondContact O-N 3.07Å; Q105-Y109 HydrophobicContact CB-CD1 3.75Å; Q105-Y109 HydrophobicContact CB-CE1 4.48Å; Q105-Y109 HydrophobicContact CB-CG 4.31Å; Q105-Y109 HydrophobicContact CG-CD1 4.23Å; Q105-Y109 VanDerWaalsContact O-CB 3.27Å; Q105-Y109 WeakPolarHBondContact O-CB 3.26Å
106	G	98	Very high	98.2	Very high	30 Å²	30	71.8 Å²	71.8	31%	0.309	38%	0.375	S	S	.	.			trans	77	158.1	-179.7	0	0	0	0	0	115.3	S103 D108 Y109 H110	S103-G106 PolarHBondContact O-N 2.95Å; S103-G106 VanDerWaalsContact O-N 3.15Å; G106-D108 VanDerWaalsContact C-N 3.32Å; G106-D108 PolarHBondContact O-N 3.42Å; G106-Y109 PolarHBondContact O-N 2.87Å; G106-H110 PolarHBondContact O-CD2 3.03Å; G106-H110 PolarHBondContact O-N 3.23Å
107	R	98.3	Very high	98.2	Very high	199 Å²	199	70.7 Å²	70.7	75%	0.751	37%	0.37	S	S	*	.	H	α-helix	trans	-58.9	-38.1	-174.7	179.3	-178.2	174.5	88.7	1.5	113.4	H110 T111	R107-H110 PolarHBondContact O-N 2.96Å; R107-T111 WeakPolarHBondContact O-CB 3.24Å; R107-T111 PolarHBondContact O-N 2.99Å; R107-T111 PolarHBondContact O-OG1 3.47Å
108	D	98.5	Very high	98.2	Very high	134 Å²	134	72 Å²	72	72%	0.717	38%	0.381	S	S	*	.	H	α-helix	trans	-70.1	-36.8	-175.1	-59.4	-19.5	0	0	0	111.1	G106 T111 K112	G106-D108 VanDerWaalsContact C-N 3.32Å; G106-D108 PolarHBondContact O-N 3.42Å; D108-T111 WeakPolarHBondContact O-CB 2.87Å; D108-T111 PolarHBondContact O-N 3.44Å; D108-K112 PolarHBondContact O-N 2.88Å
109	Y	98.6	Very high	98.3	Very high	68 Å²	68	71.7 Å²	71.7	27%	0.267	38%	0.377	S	S	.	.	H	α-helix	trans	-67.7	-43.9	173.3	-171	-98.9	0	0	0	111.7	L61 E100 Q105 G106 T111 K112 V113	L61-Y109 HydrophobicContact CD2-CE2 3.78Å; E100-Y109 HydrophobicContact CB-CE1 3.77Å; E100-Y109 HydrophobicContact CG-CE1 3.96Å; E100-Y109 WeakPolarHBondContact O-CD1 3.48Å; Q105-Y109 HydrophobicContact CB-CD1 3.75Å; Q105-Y109 HydrophobicContact CB-CE1 4.48Å; Q105-Y109 HydrophobicContact CB-CG 4.31Å; Q105-Y109 HydrophobicContact CG-CD1 4.23Å; Q105-Y109 VanDerWaalsContact O-CB 3.27Å; Q105-Y109 WeakPolarHBondContact O-CB 3.26Å; G106-Y109 PolarHBondContact O-N 2.87Å; Y109-T111 VanDerWaalsContact C-N 3.26Å; Y109-T111 PolarHBondContact O-N 3.21Å; Y109-K112 WeakPolarHBondContact O-CB 3.33Å; Y109-K112 PolarHBondContact O-N 3.19Å; Y109-K112 VanDerWaalsContact O-N 3.16Å; Y109-V113 HydrophobicContact CD1-CG2 4.13Å; Y109-V113 HydrophobicContact CE1-CG2 3.85Å; Y109-V113 WeakPolarHBondContact O-CG2 3.33Å; Y109-V113 PolarHBondContact O-N 3.01Å
110	H	98.6	Very high	98.3	Very high	41 Å²	41	64.5 Å²	64.5	19%	0.19	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-42.4	172.9	-56.3	165.9	0	0	0	111.4	E100 L101 T102 G106 R107 V113 F114	E100-H110 PolarHBondContact O-CD2 3.24Å; L101-H110 HydrophobicContact CD2-CB 4.48Å; T102-H110 PolarHBondContact O-CE1 2.72Å; T102-H110 PolarHBondContact O-NE2 2.8Å; G106-H110 PolarHBondContact O-CD2 3.03Å; G106-H110 PolarHBondContact O-N 3.23Å; R107-H110 PolarHBondContact O-N 2.96Å; H110-V113 PolarHBondContact O-N 3.21Å; H110-F114 HydrophobicContact CB-CD2 4.49Å; H110-F114 HydrophobicContact CB-CE2 4.3Å; H110-F114 WeakPolarHBondContact O-CD2 3.41Å; H110-F114 PolarHBondContact O-N 3.39Å
111	T	98.6	Very high	98.4	Very high	52 Å²	52	63.7 Å²	63.7	32%	0.319	34%	0.342	S	S	.	.	H	α-helix	trans	-59.8	-46.6	176.4	-57	0	0	0	0	110.7	R107 D108 Y109 V113 F114 Q115	R107-T111 WeakPolarHBondContact O-CB 3.24Å; R107-T111 PolarHBondContact O-N 2.99Å; R107-T111 PolarHBondContact O-OG1 3.47Å; D108-T111 WeakPolarHBondContact O-CB 2.87Å; D108-T111 PolarHBondContact O-N 3.44Å; Y109-T111 VanDerWaalsContact C-N 3.26Å; Y109-T111 PolarHBondContact O-N 3.21Å; T111-V113 PolarHBondContact O-N 3.34Å; T111-F114 PolarHBondContact O-N 3.36Å; T111-Q115 HydrophobicContact CG2-CG 4.32Å; T111-Q115 WeakPolarHBondContact O-CB 3.4Å; T111-Q115 VanDerWaalsContact O-CG 3.29Å; T111-Q115 WeakPolarHBondContact O-CG 3.28Å; T111-Q115 PolarHBondContact O-N 2.98Å
112	K	98.6	Very high	98.4	Very high	94 Å²	94	65.6 Å²	65.6	41%	0.409	36%	0.355	S	S	.	.	H	α-helix	trans	-58.4	-44.4	174.5	-170	-175.3	176.2	-160.6	0	112.1	L61 E65 D108 Y109 Q115 A116	L61-K112 HydrophobicContact CD1-CD 4.3Å; L61-K112 HydrophobicContact CD1-CG 4.19Å; L61-K112 HydrophobicContact CD2-CD 3.81Å; L61-K112 HydrophobicContact CD2-CG 4.4Å; E65-K112 WeakPolarHBondContact OE1-CE 3.35Å; E65-K112 IonicContact OE1-NZ 3.67Å; E65-K112 PolarHBondContact OE1-NZ 3.39Å; D108-K112 PolarHBondContact O-N 2.88Å; Y109-K112 WeakPolarHBondContact O-CB 3.33Å; Y109-K112 PolarHBondContact O-N 3.19Å; Y109-K112 VanDerWaalsContact O-N 3.16Å; K112-Q115 PolarHBondContact O-N 3.46Å; K112-A116 VanDerWaalsContact O-CB 3.29Å; K112-A116 WeakPolarHBondContact O-CB 3.25Å; K112-A116 PolarHBondContact O-N 3.23Å
113	V	98.7	Very high	98.4	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-60.8	-48.2	178.6	173.4	0	0	0	0	111.5	L61 L101 Y109 H110 T111 C117	L61-V113 HydrophobicContact CB-CG2 4.27Å; L101-V113 HydrophobicContact CD2-CB 4.41Å; L101-V113 HydrophobicContact CD2-CG1 4.16Å; Y109-V113 HydrophobicContact CD1-CG2 4.13Å; Y109-V113 HydrophobicContact CE1-CG2 3.85Å; Y109-V113 WeakPolarHBondContact O-CG2 3.33Å; Y109-V113 PolarHBondContact O-N 3.01Å; H110-V113 PolarHBondContact O-N 3.21Å; T111-V113 PolarHBondContact O-N 3.34Å; V113-C117 WeakPolarHBondContact O-CB 3.24Å; V113-C117 PolarHBondContact O-N 3.47Å
114	F	98.7	Very high	98.4	Very high	58 Å²	58	58.4 Å²	58.4	25%	0.254	31%	0.305	S	S	.	.	H	α-helix	trans	-72.5	-32.5	-179.2	-66.7	-58	0	0	0	113.2	H96 L101 H110 T111 S118 L170	H96-F114 AromaticContact CD2-CE1 3.69Å; H96-F114 AromaticContact NE2-CD1 3.63Å; H96-F114 AromaticContact NE2-CE1 3.58Å; L101-F114 HydrophobicContact CD1-CE1 4.42Å; L101-F114 HydrophobicContact CD1-CZ 3.98Å; L101-F114 HydrophobicContact CD2-CE2 4.1Å; L101-F114 HydrophobicContact CD2-CZ 3.94Å; H110-F114 HydrophobicContact CB-CD2 4.49Å; H110-F114 HydrophobicContact CB-CE2 4.3Å; H110-F114 WeakPolarHBondContact O-CD2 3.41Å; H110-F114 PolarHBondContact O-N 3.39Å; T111-F114 PolarHBondContact O-N 3.36Å; F114-S118 WeakPolarHBondContact O-CB 3.47Å; F114-S118 PolarHBondContact O-N 3.26Å; F114-S118 PolarHBondContact O-OG 3.13Å; F114-L170 HydrophobicContact CZ-CD2 4.38Å
115	Q	98.6	Very high	98.3	Very high	115 Å²	115	56.7 Å²	56.7	54%	0.537	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-51.8	172.7	-77	175	-23.1	0	0	111.3	T111 K112 C117 S118 E119	T111-Q115 HydrophobicContact CG2-CG 4.32Å; T111-Q115 WeakPolarHBondContact O-CB 3.4Å; T111-Q115 VanDerWaalsContact O-CG 3.29Å; T111-Q115 WeakPolarHBondContact O-CG 3.28Å; T111-Q115 PolarHBondContact O-N 2.98Å; K112-Q115 PolarHBondContact O-N 3.46Å; Q115-C117 PolarHBondContact O-N 2.69Å; Q115-S118 PolarHBondContact O-N 3.25Å; Q115-E119 WeakPolarHBondContact O-CG 3.5Å; Q115-E119 PolarHBondContact O-N 3.24Å
116	A	98.8	Very high	98.2	Very high	12 Å²	12	57.9 Å²	57.9	10%	0.099	29%	0.29	C	S	.	.	H	α-helix	trans	-58	-34.2	176.6	0	0	0	0	0	112.4	L61 L64 K112 V120	L61-A116 HydrophobicContact CD1-CB 3.81Å; L64-A116 HydrophobicContact CB-CB 4.42Å; L64-A116 HydrophobicContact CD1-CB 4.45Å; K112-A116 VanDerWaalsContact O-CB 3.29Å; K112-A116 WeakPolarHBondContact O-CB 3.25Å; K112-A116 PolarHBondContact O-N 3.23Å; A116-V120 WeakPolarHBondContact O-CG2 3.48Å; A116-V120 PolarHBondContact O-N 3.07Å
117	C	98.8	Very high	98.3	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-67.9	-48.1	173.3	-169	0	0	0	0	112	L64 V113 Q115 E119 V120 M121	L64-C117 HydrophobicContact CD1-CB 3.75Å; L64-C117 HydrophobicContact CD2-CB 4.21Å; V113-C117 WeakPolarHBondContact O-CB 3.24Å; V113-C117 PolarHBondContact O-N 3.47Å; Q115-C117 PolarHBondContact O-N 2.69Å; C117-E119 VanDerWaalsContact C-N 3.35Å; C117-E119 PolarHBondContact O-N 3.09Å; C117-V120 PolarHBondContact O-N 3Å; C117-M121 WeakPolarHBondContact O-CG 3.31Å; C117-M121 PolarHBondContact O-N 3.2Å; C117-M121 VanDerWaalsContact O-N 3.13Å
118	S	98.8	Very high	98.2	Very high	45 Å²	45	49.1 Å²	49.1	32%	0.315	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-43.1	178.6	-56	0	0	0	0	111.7	F114 Q115 V120 M121 T122	F114-S118 WeakPolarHBondContact O-CB 3.47Å; F114-S118 PolarHBondContact O-N 3.26Å; F114-S118 PolarHBondContact O-OG 3.13Å; Q115-S118 PolarHBondContact O-N 3.25Å; S118-V120 PolarHBondContact O-N 3.04Å; S118-M121 PolarHBondContact O-N 2.77Å; S118-M121 VanDerWaalsContact O-N 3.15Å; S118-T122 PolarHBondContact O-N 3.17Å; S118-T122 PolarHBondContact O-OG1 3.1Å
119	E	98.6	Very high	98.2	Very high	85 Å²	85	42.8 Å²	42.8	40%	0.397	22%	0.219	S	C	.	.	H	α-helix	trans	-55.4	-45.5	173.3	-77.1	179	-147.2	0	0	112.4	R68 Q115 C117 M121 T122 L123	R68-E119 IonicContact CZ-OE2 3.53Å; R68-E119 IonicContact NH1-OE2 3.1Å; R68-E119 PolarHBondContact NH1-OE2 3.34Å; Q115-E119 WeakPolarHBondContact O-CG 3.5Å; Q115-E119 PolarHBondContact O-N 3.24Å; C117-E119 VanDerWaalsContact C-N 3.35Å; C117-E119 PolarHBondContact O-N 3.09Å; E119-M121 VanDerWaalsContact C-N 3.32Å; E119-M121 PolarHBondContact O-N 2.73Å; E119-T122 PolarHBondContact O-OG1 3.38Å; E119-L123 WeakPolarHBondContact O-CB 3.41Å; E119-L123 PolarHBondContact O-N 3.03Å
120	V	98.9	Very high	98.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-40.7	177.5	166.8	0	0	0	0	111	L64 L67 R68 I71 A116 C117 S118 I124	L64-V120 HydrophobicContact CD2-CG2 4.36Å; L67-V120 HydrophobicContact CD2-CG1 3.81Å; L67-V120 HydrophobicContact CG-CG1 4.14Å; R68-V120 HydrophobicContact CB-CG2 3.84Å; R68-V120 HydrophobicContact CG-CG2 4.21Å; I71-V120 HydrophobicContact CD1-CG1 4.39Å; A116-V120 WeakPolarHBondContact O-CG2 3.48Å; A116-V120 PolarHBondContact O-N 3.07Å; C117-V120 PolarHBondContact O-N 3Å; S118-V120 PolarHBondContact O-N 3.04Å; V120-I124 HydrophobicContact CG1-CD1 4.13Å; V120-I124 WeakPolarHBondContact O-CD1 3.31Å; V120-I124 VanDerWaalsContact O-CG1 3.25Å; V120-I124 WeakPolarHBondContact O-CG1 3.37Å; V120-I124 PolarHBondContact O-N 2.89Å; V120-I124 VanDerWaalsContact O-N 3.11Å
121	M	98.7	Very high	98.3	Very high	10 Å²	10	38.2 Å²	38.2	5%	0.049	20%	0.201	C	C	.	.	H	α-helix	trans	-71.6	-39.7	-178.5	-57.9	-47.5	167.4	0	0	113.1	L59 C117 S118 E119 Q145 L146 S149	L59-M121 HydrophobicContact CD1-CE 4.26Å; C117-M121 WeakPolarHBondContact O-CG 3.31Å; C117-M121 PolarHBondContact O-N 3.2Å; C117-M121 VanDerWaalsContact O-N 3.13Å; S118-M121 PolarHBondContact O-N 2.77Å; S118-M121 VanDerWaalsContact O-N 3.15Å; E119-M121 VanDerWaalsContact C-N 3.32Å; E119-M121 PolarHBondContact O-N 2.73Å; M121-Q145 HydrophobicContact CE-CB 4.34Å; M121-Q145 HydrophobicContact CE-CG 4.14Å; M121-Q145 HydrophobicContact CG-CG 4.03Å; M121-Q145 HydrophobicContact SD-CG 4.28Å; M121-L146 HydrophobicContact CE-CB 3.96Å; M121-L146 HydrophobicContact CE-CD1 4.22Å; M121-L146 HydrophobicContact SD-CB 4.26Å; M121-L146 HydrophobicContact SD-CD1 3.91Å; M121-S149 WeakPolarHBondContact CB-OG 3.41Å
122	T	97.9	Very high	98.3	Very high	70 Å²	70	35.8 Å²	35.8	43%	0.429	19%	0.186	S	C	.	.	H	α-helix	trans	-70.2	-42.6	175	56.6	0	0	0	0	110.7	S118 E119 I124 Q125 D126	S118-T122 PolarHBondContact O-N 3.17Å; S118-T122 PolarHBondContact O-OG1 3.1Å; E119-T122 PolarHBondContact O-OG1 3.38Å; T122-I124 PolarHBondContact O-N 3.48Å; T122-Q125 WeakPolarHBondContact O-CA 3.28Å; T122-Q125 WeakPolarHBondContact O-CB 3.44Å; T122-Q125 PolarHBondContact O-N 3.35Å; T122-D126 PolarHBondContact O-N 2.89Å
123	L	97.9	Very high	98.3	Very high	30 Å²	30	31.3 Å²	31.3	16%	0.157	17%	0.167	C	C	.	.	H	α-helix	trans	-53.7	-41.7	175.3	178.1	70.3	0	0	0	112.1	R68 I71 L72 E119 Q125 D126 I127	R68-L123 HydrophobicContact CG-CD2 3.88Å; I71-L123 HydrophobicContact CB-CD2 4.04Å; I71-L123 HydrophobicContact CD1-CD2 4.46Å; I71-L123 HydrophobicContact CG2-CD2 3.65Å; I71-L123 HydrophobicContact CG2-CG 3.97Å; L72-L123 HydrophobicContact CD1-CD2 4.36Å; L72-L123 HydrophobicContact CD2-CD1 3.6Å; L72-L123 HydrophobicContact CD2-CD2 4.13Å; L72-L123 HydrophobicContact CD2-CG 4.48Å; L72-L123 HydrophobicContact CG-CD1 4.28Å; L72-L123 HydrophobicContact CG-CD2 3.88Å; E119-L123 WeakPolarHBondContact O-CB 3.41Å; E119-L123 PolarHBondContact O-N 3.03Å; L123-Q125 PolarHBondContact O-N 2.93Å; L123-D126 PolarHBondContact O-N 3.16Å; L123-I127 HydrophobicContact CD1-CG2 3.47Å; L123-I127 VanDerWaalsContact CD1-CG2 3.47Å; L123-I127 HydrophobicContact CG-CG2 3.89Å; L123-I127 WeakPolarHBondContact O-CG1 3.5Å; L123-I127 VanDerWaalsContact O-CG2 3.27Å; L123-I127 WeakPolarHBondContact O-CG2 3.39Å; L123-I127 PolarHBondContact O-N 2.95Å
124	I	98.5	Very high	98.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.5	-33.9	176.2	-75.9	166.5	0	0	0	111.9	I71 I85 V120 T122 V131 L146 S149 K241	I71-I124 HydrophobicContact CD1-CD1 4.41Å; I71-I124 HydrophobicContact CD1-CG1 4Å; I85-I124 HydrophobicContact CD1-CD1 4.05Å; V120-I124 HydrophobicContact CG1-CD1 4.13Å; V120-I124 WeakPolarHBondContact O-CD1 3.31Å; V120-I124 VanDerWaalsContact O-CG1 3.25Å; V120-I124 WeakPolarHBondContact O-CG1 3.37Å; V120-I124 PolarHBondContact O-N 2.89Å; V120-I124 VanDerWaalsContact O-N 3.11Å; T122-I124 PolarHBondContact O-N 3.48Å; I124-V131 HydrophobicContact CG2-CB 3.89Å; I124-V131 HydrophobicContact CG2-CG1 4.16Å; I124-V131 HydrophobicContact CG2-CG2 3.92Å; I124-L146 HydrophobicContact CD1-CD1 3.46Å; I124-L146 VanDerWaalsContact CD1-CD1 3.46Å; I124-S149 WeakPolarHBondContact CG2-O 3.43Å; I124-K241 PolarHBondContact O-NZ 3.39Å
125	Q	94.4	Very high	98.3	Very high	57 Å²	57	29.5 Å²	29.5	27%	0.266	16%	0.159	S	C	.	.	H	α-helix	trans	-83.7	-33.9	178.5	-61.7	179.1	-10.3	0	0	112.3	T122 L123 K241 H245	T122-Q125 WeakPolarHBondContact O-CA 3.28Å; T122-Q125 WeakPolarHBondContact O-CB 3.44Å; T122-Q125 PolarHBondContact O-N 3.35Å; L123-Q125 PolarHBondContact O-N 2.93Å; Q125-K241 WeakPolarHBondContact O-CE 3.32Å; Q125-H245 PolarHBondContact O-CD2 3.11Å; Q125-H245 VanDerWaalsContact O-CD2 3.3Å
126	D	96.8	Very high	98.3	Very high	115 Å²	115	26.2 Å²	26.2	62%	0.615	15%	0.145	S	C	*	.	H	α-helix	trans	-85.1	-22.6	-172.9	-64.4	-36.7	0	0	0	114.6	T122 L123	T122-D126 PolarHBondContact O-N 2.89Å; L123-D126 PolarHBondContact O-N 3.16Å
127	I	98.4	Very high	98.3	Very high	8 Å²	8	25.9 Å²	25.9	4%	0.041	14%	0.143	C	C	.	.	S	Bend	trans	-68.3	150.9	-177.8	57.8	172.5	0	0	0	113.8	I71 I75 I83 L123 V129 V131 K241	I71-I127 HydrophobicContact CG2-CD1 3.77Å; I71-I127 HydrophobicContact CG2-CG2 4.21Å; I75-I127 HydrophobicContact CD1-CB 4.1Å; I75-I127 HydrophobicContact CD1-CD1 4.38Å; I75-I127 HydrophobicContact CD1-CG2 4.12Å; I75-I127 HydrophobicContact CG1-CB 4.42Å; I75-I127 HydrophobicContact CG1-CG2 4.15Å; I83-I127 HydrophobicContact CD1-CD1 3.77Å; L123-I127 HydrophobicContact CD1-CG2 3.47Å; L123-I127 VanDerWaalsContact CD1-CG2 3.47Å; L123-I127 HydrophobicContact CG-CG2 3.89Å; L123-I127 WeakPolarHBondContact O-CG1 3.5Å; L123-I127 VanDerWaalsContact O-CG2 3.27Å; L123-I127 WeakPolarHBondContact O-CG2 3.39Å; L123-I127 PolarHBondContact O-N 2.95Å; I127-V129 HydrophobicContact CD1-CG2 4.03Å; I127-V129 PolarHBondContact O-N 3.08Å; I127-V131 HydrophobicContact CD1-CG2 3.56Å; I127-V131 HydrophobicContact CG1-CG2 4.26Å; I127-K241 VanDerWaalsContact O-CE 3.24Å; I127-K241 WeakPolarHBondContact O-CE 3.33Å
128	P	97.8	Very high	98.3	Very high	37 Å²	37	28.3 Å²	28.3	24%	0.24	16%	0.158	C	C	.	.	S	Bend	trans	-69.9	-1.4	-174.9	28.7	-38	0	0	0	115.7	I75 A238	I75-P128 HydrophobicContact CD1-CG 4.42Å; I75-P128 HydrophobicContact CG1-CG 4.18Å; P128-A238 HydrophobicContact CB-CB 3.75Å; P128-A238 VanDerWaalsContact O-CA 3.28Å; P128-A238 WeakPolarHBondContact O-CA 3.34Å; P128-A238 WeakPolarHBondContact O-CB 3.45Å
129	V	98.6	Very high	98.3	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	14%	0.143	C	C	.	.	S	Bend	trans	-123.9	146.6	-178.9	-65.4	0	0	0	0	111.5	I75 L80 I83 I127 K241	I75-V129 HydrophobicContact CD1-CG2 4.05Å; L80-V129 HydrophobicContact CD2-CG2 4.12Å; L80-V129 HydrophobicContact CG-CG1 4.24Å; L80-V129 HydrophobicContact CG-CG2 4.22Å; L80-V129 WeakPolarHBondContact O-CG1 3.46Å; I83-V129 HydrophobicContact CD1-CG2 4.08Å; I83-V129 HydrophobicContact CG1-CG2 3.95Å; I127-V129 HydrophobicContact CD1-CG2 4.03Å; I127-V129 PolarHBondContact O-N 3.08Å; V129-K241 PolarHBondContact O-NZ 3.06Å
130	P	98.8	Very high	98.3	Very high	13 Å²	13	23.3 Å²	23.3	8%	0.084	13%	0.132	C	C	.	.			trans	-64.4	148.6	174.8	-22.5	35.5	0	0	0	112.3	V82 I83 D151 V229 V237	V82-P130 HydrophobicContact CG2-CB 4.41Å; V82-P130 WeakPolarHBondContact CG2-O 3.41Å; I83-P130 PolarHBondContact N-O 3.44Å; P130-D151 WeakPolarHBondContact CA-OD2 3.29Å; P130-V229 HydrophobicContact CG-CG1 3.9Å; P130-V237 HydrophobicContact CG-CG1 3.55Å
131	V	98.9	Very high	98.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.4	175.4	-170.6	0	0	0	0	109.5	I83 I85 I124 I127 C150 D151 I152	I83-V131 HydrophobicContact CB-CG1 4.37Å; I83-V131 HydrophobicContact CB-CG2 4.34Å; I83-V131 HydrophobicContact CG2-CG1 4.36Å; I83-V131 CarbonylContact O-C 3.54Å; I83-V131 WeakPolarHBondContact O-CA 3.41Å; I85-V131 HydrophobicContact CD1-CG1 3.59Å; I85-V131 HydrophobicContact CG1-CG1 3.87Å; I124-V131 HydrophobicContact CG2-CB 3.89Å; I124-V131 HydrophobicContact CG2-CG1 4.16Å; I124-V131 HydrophobicContact CG2-CG2 3.92Å; I127-V131 HydrophobicContact CD1-CG2 3.56Å; I127-V131 HydrophobicContact CG1-CG2 4.26Å; V131-C150 HydrophobicContact CG1-CB 4.46Å; V131-D151 PolarHBondContact N-OD2 2.81Å; V131-D151 PolarHBondContact O-N 2.84Å; V131-I152 PolarHBondContact O-N 2.82Å
132	I	99	Very high	98.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123	179.7	-49	179.3	0	0	0	109.1	V82 I83 V84 I85 I152 V154 T222 I225 A226	V82-I132 HydrophobicContact CG2-CD1 3.77Å; V82-I132 HydrophobicContact CG2-CG1 3.94Å; I83-I132 PolarHBondContact O-N 3.03Å; V84-I132 CarbonylContact C-O 3.6Å; V84-I132 WeakPolarHBondContact CA-O 3.36Å; V84-I132 HydrophobicContact CG2-CB 4.37Å; V84-I132 HydrophobicContact CG2-CD1 4.46Å; I85-I132 PolarHBondContact N-O 2.96Å; I132-I152 CarbonylContact C-O 3.51Å; I132-I152 VanDerWaalsContact CA-O 3.29Å; I132-I152 WeakPolarHBondContact CA-O 3.32Å; I132-I152 HydrophobicContact CG1-CB 4.24Å; I132-I152 HydrophobicContact CG2-CB 4.24Å; I132-I152 HydrophobicContact CG2-CG2 4.09Å; I132-V154 HydrophobicContact CG2-CG2 4.27Å; I132-T222 HydrophobicContact CG2-CG2 4.06Å; I132-I225 HydrophobicContact CD1-CB 4.28Å; I132-I225 HydrophobicContact CD1-CG2 3.79Å; I132-A226 HydrophobicContact CD1-CB 4.05Å
133	A	99	Very high	98.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.3	166	0	0	0	0	0	110.1	V135 V147 C150 I152 A153 V154	A133-V135 HydrophobicContact CB-CG2 4.09Å; A133-V147 HydrophobicContact CB-CG1 4.32Å; A133-V147 HydrophobicContact CB-CG2 4.47Å; A133-C150 HydrophobicContact CB-CB 4.04Å; A133-I152 PolarHBondContact N-O 2.93Å; A133-A153 HydrophobicContact CB-CB 4.04Å; A133-A153 WeakPolarHBondContact O-CA 3.45Å; A133-V154 PolarHBondContact O-N 3.11Å
134	M	98.9	Very high	98.4	Very high	21 Å²	21	19 Å²	19	10%	0.103	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	99	173	-170.9	-179.9	83.6	0	0	109.1	V84 I85 V154 L218 E219 T222	V84-M134 HydrophobicContact CG1-CB 3.96Å; I85-M134 PolarHBondContact O-N 3.05Å; M134-V154 WeakPolarHBondContact CA-O 3.27Å; M134-L218 HydrophobicContact CE-CD2 4.44Å; M134-L218 HydrophobicContact CG-CD1 4.04Å; M134-L218 HydrophobicContact CG-CD2 3.78Å; M134-L218 HydrophobicContact CG-CG 3.68Å; M134-L218 HydrophobicContact SD-CD2 4.34Å; M134-L218 HydrophobicContact SD-CG 4.18Å; M134-E219 WeakPolarHBondContact CE-OE2 3.47Å; M134-T222 HydrophobicContact CB-CG2 3.96Å; M134-T222 HydrophobicContact CG-CG2 3.99Å; M134-T222 WeakPolarHBondContact CG-OG1 3.16Å; M134-T222 HydrophobicContact SD-CG2 3.88Å
135	V	98.9	Very high	98.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	110.9	-166.2	-172.1	0	0	0	0	111.1	F92 A133 A139 V147 V154 V155 T156 S159 F161	F92-V135 HydrophobicContact CB-CG1 3.81Å; F92-V135 HydrophobicContact CD2-CB 4.44Å; F92-V135 HydrophobicContact CD2-CG1 4.36Å; F92-V135 HydrophobicContact CD2-CG2 4.15Å; F92-V135 HydrophobicContact CE2-CG2 4.25Å; F92-V135 HydrophobicContact CG-CG1 4.03Å; F92-V135 HydrophobicContact CG-CG2 4.31Å; A133-V135 HydrophobicContact CB-CG2 4.09Å; V135-A139 HydrophobicContact CG1-CB 4.42Å; V135-V147 HydrophobicContact CG2-CG1 4.19Å; V135-V147 HydrophobicContact CG2-CG2 3.61Å; V135-V154 PolarHBondContact N-O 3.41Å; V135-V155 HydrophobicContact CB-CB 4Å; V135-V155 HydrophobicContact CB-CG1 3.7Å; V135-V155 HydrophobicContact CG2-CG1 3.9Å; V135-V155 CarbonylContact O-C 3.53Å; V135-V155 VanDerWaalsContact O-CA 3.28Å; V135-V155 WeakPolarHBondContact O-CA 3.37Å; V135-T156 PolarHBondContact O-N 3.01Å; V135-S159 PolarHBondContact O-OG 3.2Å; V135-F161 HydrophobicContact CB-CZ 4.5Å; V135-F161 HydrophobicContact CG1-CE1 4.04Å; V135-F161 HydrophobicContact CG1-CZ 4.07Å
136	N	98.7	Very high	98.7	Very high	45 Å²	45	16.7 Å²	16.7	24%	0.241	10%	0.098	C	C	.	.			trans	-107.9	108.6	168.2	-168.8	-0.8	0	0	0	110	T156 K158 E215 L218	N136-T156 HydrophobicContact CB-CG2 4.07Å; N136-T156 PolarHBondContact OD1-OG1 2.79Å; N136-K158 WeakPolarHBondContact OD1-CE 3.47Å; N136-E215 PolarHBondContact ND2-OE1 3.02Å; N136-E215 PolarHBondContact OD1-OE1 3.38Å; N136-L218 HydrophobicContact CB-CD2 3.8Å
137	G	98.4	Very high	98.8	Very high	6 Å²	6	11.3 Å²	11.3	6%	0.062	7%	0.07	C	C	.	.	S	Bend	trans	89.2	-142.6	180	0	0	0	0	0	113.8	S159 T160	G137-S159 PolarHBondContact N-OG 3.02Å; G137-S159 VanDerWaalsContact O-CA 3.24Å; G137-S159 WeakPolarHBondContact O-CA 3.42Å; G137-S159 VanDerWaalsContact O-CB 3.25Å; G137-S159 WeakPolarHBondContact O-CB 3.34Å; G137-S159 PolarHBondContact O-OG 3.2Å; G137-T160 PolarHBondContact O-N 2.84Å
138	V	98.9	Very high	98.8	Very high	51 Å²	51	11.8 Å²	11.8	31%	0.309	7%	0.074	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.9	-159.7	-175.6	0	0	0	0	113	P90 V91 F92 S93 T140	P90-V138 PolarHBondContact O-N 2.79Å; V91-V138 CarbonylContact C-O 3.51Å; V91-V138 HydrophobicContact CG1-CB 4.29Å; V91-V138 WeakPolarHBondContact CG1-O 3.12Å; V91-V138 HydrophobicContact CG2-CB 4.37Å; F92-V138 PolarHBondContact N-O 2.9Å; S93-V138 PolarHBondContact N-O 2.76Å; V138-T140 HydrophobicContact CG1-CG2 3.71Å
139	A	98.9	Very high	98.9	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	114.1	169.7	0	0	0	0	0	111.1	F92 S93 V135 V147 T160 F161 A162	F92-A139 HydrophobicContact CB-CB 4.35Å; F92-A139 HydrophobicContact CD1-CB 4.04Å; S93-A139 WeakPolarHBondContact O-CA 3.33Å; V135-A139 HydrophobicContact CG1-CB 4.42Å; A139-V147 HydrophobicContact CB-CG2 4.11Å; A139-T160 PolarHBondContact N-O 2.88Å; A139-F161 HydrophobicContact CB-CD1 3.93Å; A139-F161 HydrophobicContact CB-CE1 4.02Å; A139-F161 WeakPolarHBondContact O-CA 3.41Å; A139-A162 PolarHBondContact O-N 3.23Å
140	T	98.9	Very high	98.9	Very high	26 Å²	26	11 Å²	11	16%	0.16	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.4	-176.9	61.5	0	0	0	0	114.2	S93 S94 G95 V138 A142 G143 C144 A162 P164	S93-T140 PolarHBondContact O-N 3.48Å; S94-T140 CarbonylContact C-O 2.99Å; S94-T140 VanDerWaalsContact C-O 3.24Å; S94-T140 VanDerWaalsContact C-OG1 3.27Å; S94-T140 VanDerWaalsContact CA-OG1 3.29Å; S94-T140 WeakPolarHBondContact CA-OG1 3.37Å; S94-T140 PolarHBondContact O-OG1 3.44Å; G95-T140 WeakPolarHBondContact CA-O 3.39Å; G95-T140 PolarHBondContact N-O 2.9Å; V138-T140 HydrophobicContact CG1-CG2 3.71Å; T140-A142 PolarHBondContact O-N 3.01Å; T140-G143 WeakPolarHBondContact O-CA 3.47Å; T140-G143 PolarHBondContact O-N 3.37Å; T140-C144 PolarHBondContact O-N 3.24Å; T140-A162 CarbonylContact C-O 3.55Å; T140-A162 VanDerWaalsContact CA-O 3.29Å; T140-A162 WeakPolarHBondContact CA-O 3.41Å; T140-A162 HydrophobicContact CG2-CB 3.97Å; T140-P164 HydrophobicContact CG2-CG 4.23Å
141	A	98.8	Very high	98.9	Very high	19 Å²	19	12.8 Å²	12.8	16%	0.157	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	-121.1	176.7	0	0	0	0	0	111.5	G143 C144 Q145 A162 P175	A141-G143 PolarHBondContact O-N 2.96Å; A141-C144 WeakPolarHBondContact O-CA 3.35Å; A141-C144 WeakPolarHBondContact O-CB 3.38Å; A141-C144 PolarHBondContact O-N 2.94Å; A141-Q145 PolarHBondContact O-N 3.16Å; A141-A162 PolarHBondContact N-O 3.48Å; A141-P175 VanDerWaalsContact C-CG 3.5Å
142	A	98.9	Very high	98.9	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-64.8	-18.3	177	0	0	0	0	0	113.7	L59 T140 Q145 L146	L59-A142 HydrophobicContact CD1-CB 3.93Å; L59-A142 WeakPolarHBondContact CD1-O 3.42Å; T140-A142 PolarHBondContact O-N 3.01Å; A142-Q145 WeakPolarHBondContact O-CB 3.4Å; A142-L146 PolarHBondContact O-N 3.36Å
143	G	98.9	Very high	98.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-70.7	-37.5	167.8	0	0	0	0	0	112.8	T140 A141 L146 V147	T140-G143 WeakPolarHBondContact O-CA 3.47Å; T140-G143 PolarHBondContact O-N 3.37Å; A141-G143 PolarHBondContact O-N 2.96Å; G143-L146 PolarHBondContact O-N 3.19Å; G143-V147 PolarHBondContact O-N 3.36Å
144	C	98.9	Very high	98.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-71.4	-34.7	171.2	-169.1	0	0	0	0	111.5	T140 A141 L146 V147 A148 I179	T140-C144 PolarHBondContact O-N 3.24Å; A141-C144 WeakPolarHBondContact O-CA 3.35Å; A141-C144 WeakPolarHBondContact O-CB 3.38Å; A141-C144 PolarHBondContact O-N 2.94Å; C144-L146 VanDerWaalsContact C-N 3.35Å; C144-V147 PolarHBondContact O-N 2.75Å; C144-A148 WeakPolarHBondContact O-CB 3.14Å; C144-A148 PolarHBondContact O-N 2.63Å; C144-I179 HydrophobicContact CB-CD1 4.21Å
145	Q	98.9	Very high	98.9	Very high	8 Å²	8	13.9 Å²	13.9	4%	0.037	9%	0.085	C	C	.	.	H	α-helix	trans	-57.8	-46	170.7	-171.3	-179.1	-10.2	0	0	111.3	M121 A141 A142 V147 A148 S149 T174 P175 A178	M121-Q145 HydrophobicContact CE-CB 4.34Å; M121-Q145 HydrophobicContact CE-CG 4.14Å; M121-Q145 HydrophobicContact CG-CG 4.03Å; M121-Q145 HydrophobicContact SD-CG 4.28Å; A141-Q145 PolarHBondContact O-N 3.16Å; A142-Q145 WeakPolarHBondContact O-CB 3.4Å; Q145-V147 VanDerWaalsContact C-N 3.31Å; Q145-V147 PolarHBondContact O-N 3.25Å; Q145-A148 CarbonylContact O-C 3.57Å; Q145-A148 PolarHBondContact O-N 3.22Å; Q145-S149 WeakPolarHBondContact O-CB 3.34Å; Q145-S149 PolarHBondContact O-N 3.27Å; Q145-S149 PolarHBondContact O-OG 2.95Å; Q145-S149 VanDerWaalsContact O-OG 3.07Å; Q145-T174 PolarHBondContact NE2-O 3.27Å; Q145-P175 HydrophobicContact CB-CB 4.01Å; Q145-P175 HydrophobicContact CB-CG 4.18Å; Q145-A178 HydrophobicContact CG-CB 4.11Å
146	L	98.9	Very high	98.9	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58.2	-41.3	178.1	-176.8	57.3	0	0	0	112.6	L50 L67 I85 F92 M121 I124 A142 G143 C144 S149 C150	L50-L146 HydrophobicContact CD1-CD2 4.16Å; L67-L146 HydrophobicContact CD2-CD1 4.26Å; L67-L146 HydrophobicContact CD2-CD2 4.16Å; I85-L146 HydrophobicContact CD1-CD1 4.33Å; I85-L146 HydrophobicContact CG2-CD2 4.32Å; F92-L146 HydrophobicContact CE1-CB 4.36Å; F92-L146 HydrophobicContact CE1-CD2 3.92Å; F92-L146 HydrophobicContact CE1-CG 4.18Å; F92-L146 HydrophobicContact CZ-CD2 4.03Å; F92-L146 HydrophobicContact CZ-CG 4.33Å; M121-L146 HydrophobicContact CE-CB 3.96Å; M121-L146 HydrophobicContact CE-CD1 4.22Å; M121-L146 HydrophobicContact SD-CB 4.26Å; M121-L146 HydrophobicContact SD-CD1 3.91Å; I124-L146 HydrophobicContact CD1-CD1 3.46Å; I124-L146 VanDerWaalsContact CD1-CD1 3.46Å; A142-L146 PolarHBondContact O-N 3.36Å; G143-L146 PolarHBondContact O-N 3.19Å; C144-L146 VanDerWaalsContact C-N 3.35Å; L146-S149 PolarHBondContact O-N 2.74Å; L146-C150 PolarHBondContact O-N 2.87Å; L146-C150 PolarHBondContact O-SG 3.28Å
147	V	98.9	Very high	98.9	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-64.8	-50.1	175.1	179.3	0	0	0	0	110.6	F92 A133 V135 A139 G143 C144 Q145 S149 C150 A153 F161 V209	F92-V147 HydrophobicContact CD1-CG2 3.9Å; F92-V147 HydrophobicContact CE1-CG2 3.58Å; F92-V147 HydrophobicContact CZ-CG2 4.21Å; A133-V147 HydrophobicContact CB-CG1 4.32Å; A133-V147 HydrophobicContact CB-CG2 4.47Å; V135-V147 HydrophobicContact CG2-CG1 4.19Å; V135-V147 HydrophobicContact CG2-CG2 3.61Å; A139-V147 HydrophobicContact CB-CG2 4.11Å; G143-V147 PolarHBondContact O-N 3.36Å; C144-V147 PolarHBondContact O-N 2.75Å; Q145-V147 VanDerWaalsContact C-N 3.31Å; Q145-V147 PolarHBondContact O-N 3.25Å; V147-S149 PolarHBondContact O-N 3.38Å; V147-C150 PolarHBondContact O-N 3.33Å; V147-A153 HydrophobicContact CG1-CB 3.85Å; V147-F161 HydrophobicContact CB-CE1 4.5Å; V147-F161 HydrophobicContact CG1-CE1 4.04Å; V147-F161 HydrophobicContact CG2-CE1 4.26Å; V147-V209 HydrophobicContact CG1-CG1 4.28Å
148	A	98.9	Very high	98.9	Very high	17 Å²	17	22.2 Å²	22.2	14%	0.14	12%	0.119	C	C	.	.	H	α-helix	trans	-66.8	-15.1	179.9	0	0	0	0	0	114.5	C144 Q145 A178 I179 A182 L208	C144-A148 WeakPolarHBondContact O-CB 3.14Å; C144-A148 PolarHBondContact O-N 2.63Å; Q145-A148 CarbonylContact O-C 3.57Å; Q145-A148 PolarHBondContact O-N 3.22Å; A148-A178 HydrophobicContact CB-CB 3.68Å; A148-I179 HydrophobicContact CB-CG1 4.08Å; A148-A182 HydrophobicContact CB-CB 4.47Å; A148-L208 HydrophobicContact CB-CD1 3.73Å
149	S	98.9	Very high	98.9	Very high	5 Å²	5	19.8 Å²	19.8	4%	0.035	10%	0.104	C	C	.	.	H	α-helix	trans	-90.2	-19.2	176.1	-69.2	0	0	0	0	113.6	M121 I124 Q145 L146 V147	M121-S149 WeakPolarHBondContact CB-OG 3.41Å; I124-S149 WeakPolarHBondContact CG2-O 3.43Å; Q145-S149 WeakPolarHBondContact O-CB 3.34Å; Q145-S149 PolarHBondContact O-N 3.27Å; Q145-S149 PolarHBondContact O-OG 2.95Å; Q145-S149 VanDerWaalsContact O-OG 3.07Å; L146-S149 PolarHBondContact O-N 2.74Å; V147-S149 PolarHBondContact O-N 3.38Å
150	C	98.9	Very high	98.9	Very high	16 Å²	16	22 Å²	22	11%	0.108	12%	0.118	C	C	.	.	S	Bend	trans	-72.6	151	176.7	-66.7	0	0	0	0	111.7	V131 A133 L146 V147 I152	V131-C150 HydrophobicContact CG1-CB 4.46Å; A133-C150 HydrophobicContact CB-CB 4.04Å; L146-C150 PolarHBondContact O-N 2.87Å; L146-C150 PolarHBondContact O-SG 3.28Å; V147-C150 PolarHBondContact O-N 3.33Å; C150-I152 VanDerWaalsContact C-N 3.29Å; C150-I152 PolarHBondContact O-N 3.31Å
151	D	98.9	Very high	98.9	Very high	52 Å²	52	20.8 Å²	20.8	28%	0.278	11%	0.11	S	C	.	.	S	Bend	trans	-70.3	-27.7	-179.3	-50.1	-77.1	0	0	0	112.3	P130 V131 K241 H245	P130-D151 WeakPolarHBondContact CA-OD2 3.29Å; V131-D151 PolarHBondContact N-OD2 2.81Å; V131-D151 PolarHBondContact O-N 2.84Å; D151-K241 WeakPolarHBondContact OD1-CE 3.44Å; D151-K241 IonicContact OD1-NZ 3.21Å; D151-K241 PolarHBondContact OD1-NZ 3.42Å; D151-K241 IonicContact OD2-NZ 2.64Å; D151-K241 PolarHBondContact OD2-NZ 2.8Å; D151-H245 IonicContact OD1-CE1 3.68Å; D151-H245 IonicContact OD1-NE2 2.72Å; D151-H245 PolarHBondContact OD1-NE2 3.26Å; D151-H245 VanDerWaalsContact OD1-NE2 3.11Å
152	I	98.9	Very high	98.9	Very high	41 Å²	41	20.1 Å²	20.1	21%	0.21	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145	179	-58.1	179	0	0	0	108.7	V131 I132 A133 C150 V154 I225	V131-I152 PolarHBondContact O-N 2.82Å; I132-I152 CarbonylContact C-O 3.51Å; I132-I152 VanDerWaalsContact CA-O 3.29Å; I132-I152 WeakPolarHBondContact CA-O 3.32Å; I132-I152 HydrophobicContact CG1-CB 4.24Å; I132-I152 HydrophobicContact CG2-CB 4.24Å; I132-I152 HydrophobicContact CG2-CG2 4.09Å; A133-I152 PolarHBondContact N-O 2.93Å; C150-I152 VanDerWaalsContact C-N 3.29Å; C150-I152 PolarHBondContact O-N 3.31Å; I152-V154 HydrophobicContact CG2-CG2 4.48Å; I152-I225 HydrophobicContact CD1-CG2 3.73Å; I152-I225 HydrophobicContact CG2-CD1 4.25Å
153	A	98.9	Very high	98.9	Very high	3 Å²	3	20.1 Å²	20.1	3%	0.025	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128.1	168.9	0	0	0	0	0	112.3	A133 V147 V155 V209 S210 K211	A133-A153 HydrophobicContact CB-CB 4.04Å; A133-A153 WeakPolarHBondContact O-CA 3.45Å; V147-A153 HydrophobicContact CG1-CB 3.85Å; A153-V155 HydrophobicContact CB-CG1 4.34Å; A153-V209 HydrophobicContact CB-CB 4.08Å; A153-V209 HydrophobicContact CB-CG1 4.07Å; A153-S210 PolarHBondContact N-OG 3.21Å; A153-S210 WeakPolarHBondContact O-CA 3.33Å; A153-S210 WeakPolarHBondContact O-CB 3.35Å; A153-S210 PolarHBondContact O-N 3.47Å; A153-K211 PolarHBondContact O-N 3.04Å
154	V	98.9	Very high	98.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.2	172.9	-171.3	0	0	0	0	107.7	I132 A133 M134 V135 I152 K211 V213 L218 E221 T222 I225	I132-V154 HydrophobicContact CG2-CG2 4.27Å; A133-V154 PolarHBondContact O-N 3.11Å; M134-V154 WeakPolarHBondContact CA-O 3.27Å; V135-V154 PolarHBondContact N-O 3.41Å; I152-V154 HydrophobicContact CG2-CG2 4.48Å; V154-K211 HydrophobicContact CG1-CB 4.09Å; V154-K211 HydrophobicContact CG2-CB 4.44Å; V154-V213 HydrophobicContact CG1-CG2 4.19Å; V154-L218 HydrophobicContact CG1-CD1 4.11Å; V154-E221 HydrophobicContact CG1-CB 4.33Å; V154-T222 WeakPolarHBondContact CB-OG1 3.49Å; V154-I225 HydrophobicContact CG2-CD1 3.66Å
155	V	98.9	Very high	98.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	153.4	-168	-41.8	0	0	0	0	111.9	V135 A153 F161 A200 V209 K211 V212 V213	V135-V155 HydrophobicContact CB-CB 4Å; V135-V155 HydrophobicContact CB-CG1 3.7Å; V135-V155 HydrophobicContact CG2-CG1 3.9Å; V135-V155 CarbonylContact O-C 3.53Å; V135-V155 VanDerWaalsContact O-CA 3.28Å; V135-V155 WeakPolarHBondContact O-CA 3.37Å; A153-V155 HydrophobicContact CB-CG1 4.34Å; V155-F161 HydrophobicContact CB-CZ 4.1Å; V155-F161 HydrophobicContact CG1-CZ 3.86Å; V155-F161 HydrophobicContact CG2-CE2 4.3Å; V155-F161 HydrophobicContact CG2-CZ 4.2Å; V155-A200 HydrophobicContact CG2-CB 3.91Å; V155-V209 HydrophobicContact CG1-CB 3.99Å; V155-V209 HydrophobicContact CG1-CG1 3.62Å; V155-V209 HydrophobicContact CG2-CB 4.37Å; V155-V209 HydrophobicContact CG2-CG1 4.32Å; V155-V209 HydrophobicContact CG2-CG2 4.04Å; V155-K211 PolarHBondContact N-O 3.29Å; V155-V212 HydrophobicContact CG2-CB 4.47Å; V155-V212 HydrophobicContact CG2-CG2 3.83Å; V155-V212 WeakPolarHBondContact O-CA 3.38Å; V155-V213 PolarHBondContact O-N 3.33Å
156	T	98.9	Very high	98.8	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	154.1	174.4	63.9	0	0	0	0	111.9	V135 N136 K158 S159 A200 V213 E215 L218	V135-T156 PolarHBondContact O-N 3.01Å; N136-T156 HydrophobicContact CB-CG2 4.07Å; N136-T156 PolarHBondContact OD1-OG1 2.79Å; T156-K158 PolarHBondContact O-N 3.45Å; T156-K158 WeakPolarHBondContact OG1-CG 3.41Å; T156-S159 PolarHBondContact N-OG 3.06Å; T156-S159 VanDerWaalsContact O-CB 3.24Å; T156-S159 WeakPolarHBondContact O-CB 3.18Å; T156-S159 PolarHBondContact O-N 3.19Å; T156-S159 PolarHBondContact O-OG 3.44Å; T156-S159 PolarHBondContact OG1-OG 3.28Å; T156-A200 VanDerWaalsContact O-CB 3.26Å; T156-A200 WeakPolarHBondContact O-CB 3.31Å; T156-V213 CarbonylContact C-O 3.48Å; T156-V213 VanDerWaalsContact CA-O 3.25Å; T156-V213 WeakPolarHBondContact CA-O 3.47Å; T156-E215 HydrophobicContact CG2-CB 4.07Å; T156-E215 HydrophobicContact CG2-CG 4.27Å; T156-L218 HydrophobicContact CG2-CB 4.05Å; T156-L218 HydrophobicContact CG2-CD1 3.91Å; T156-L218 HydrophobicContact CG2-CD2 3.69Å; T156-L218 HydrophobicContact CG2-CG 4.09Å
157	E	98.8	Very high	98.8	Very high	111 Å²	111	29.2 Å²	29.2	52%	0.519	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.1	174.6	-72.4	172.9	149.7	0	0	113.4	S159 V212 V213	E157-S159 VanDerWaalsContact C-N 3.32Å; E157-V212 HydrophobicContact CB-CG1 4.3Å; E157-V212 HydrophobicContact CG-CG1 3.73Å; E157-V213 PolarHBondContact N-O 2.81Å
158	K	98.4	Very high	98.7	Very high	113 Å²	113	33.4 Å²	33.4	49%	0.491	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-2.6	176.5	70.4	176.5	-174.9	-170.2	0	114.6	N136 T156 E215	N136-K158 WeakPolarHBondContact OD1-CE 3.47Å; T156-K158 PolarHBondContact O-N 3.45Å; T156-K158 WeakPolarHBondContact OG1-CG 3.41Å; K158-E215 WeakPolarHBondContact CE-OE1 3.29Å; K158-E215 WeakPolarHBondContact CE-OE2 3.38Å; K158-E215 IonicContact NZ-OE1 2.72Å; K158-E215 PolarHBondContact NZ-OE1 3.44Å; K158-E215 IonicContact NZ-OE2 2.62Å; K158-E215 PolarHBondContact NZ-OE2 2.87Å
159	S	98.9	Very high	98.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.214	C	C	.	.			trans	-69.8	145.5	179.1	-69.2	0	0	0	0	111.5	V135 G137 T156 E157 A200	V135-S159 PolarHBondContact O-OG 3.2Å; G137-S159 PolarHBondContact N-OG 3.02Å; G137-S159 VanDerWaalsContact O-CA 3.24Å; G137-S159 WeakPolarHBondContact O-CA 3.42Å; G137-S159 VanDerWaalsContact O-CB 3.25Å; G137-S159 WeakPolarHBondContact O-CB 3.34Å; G137-S159 PolarHBondContact O-OG 3.2Å; T156-S159 PolarHBondContact N-OG 3.06Å; T156-S159 VanDerWaalsContact O-CB 3.24Å; T156-S159 WeakPolarHBondContact O-CB 3.18Å; T156-S159 PolarHBondContact O-N 3.19Å; T156-S159 PolarHBondContact O-OG 3.44Å; T156-S159 PolarHBondContact OG1-OG 3.28Å; E157-S159 VanDerWaalsContact C-N 3.32Å; S159-A200 WeakPolarHBondContact O-CB 3.36Å; S159-A200 PolarHBondContact O-N 3.39Å
160	T	98.9	Very high	98.6	Very high	47 Å²	47	39.4 Å²	39.4	29%	0.288	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	146	-179.9	58.2	0	0	0	0	111.3	G137 A139 I198	G137-T160 PolarHBondContact O-N 2.84Å; A139-T160 PolarHBondContact N-O 2.88Å; T160-I198 WeakPolarHBondContact CA-O 3.41Å
161	F	98.9	Very high	98.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.8	-169.7	-57.4	-84.8	0	0	0	110	V135 A139 V147 V155 P197 I198 A200 A203 L208 V209	V135-F161 HydrophobicContact CB-CZ 4.5Å; V135-F161 HydrophobicContact CG1-CE1 4.04Å; V135-F161 HydrophobicContact CG1-CZ 4.07Å; A139-F161 HydrophobicContact CB-CD1 3.93Å; A139-F161 HydrophobicContact CB-CE1 4.02Å; A139-F161 WeakPolarHBondContact O-CA 3.41Å; V147-F161 HydrophobicContact CB-CE1 4.5Å; V147-F161 HydrophobicContact CG1-CE1 4.04Å; V147-F161 HydrophobicContact CG2-CE1 4.26Å; V155-F161 HydrophobicContact CB-CZ 4.1Å; V155-F161 HydrophobicContact CG1-CZ 3.86Å; V155-F161 HydrophobicContact CG2-CE2 4.3Å; V155-F161 HydrophobicContact CG2-CZ 4.2Å; F161-P197 CarbonylContact O-C 3.52Å; F161-P197 VanDerWaalsContact O-CA 3.31Å; F161-P197 WeakPolarHBondContact O-CA 3.16Å; F161-I198 HydrophobicContact CB-CG1 3.97Å; F161-I198 PolarHBondContact N-O 3.29Å; F161-I198 VanDerWaalsContact N-O 3.07Å; F161-I198 PolarHBondContact O-N 2.85Å; F161-A200 HydrophobicContact CE2-CB 4.49Å; F161-A203 HydrophobicContact CD2-CB 3.65Å; F161-A203 HydrophobicContact CE2-CB 3.99Å; F161-A203 HydrophobicContact CG-CB 4.41Å; F161-L208 HydrophobicContact CB-CD2 3.71Å; F161-L208 HydrophobicContact CD1-CD2 4.17Å; F161-L208 HydrophobicContact CD2-CD2 4.46Å; F161-L208 HydrophobicContact CG-CD2 3.84Å; F161-V209 HydrophobicContact CE1-CG1 4.33Å; F161-V209 HydrophobicContact CE2-CG1 4.27Å; F161-V209 HydrophobicContact CZ-CG1 3.97Å
162	A	98.9	Very high	98.6	Very high	6 Å²	6	40.3 Å²	40.3	5%	0.05	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	158	-175.8	0	0	0	0	0	113.3	A139 T140 A141 P164 P197	A139-A162 PolarHBondContact O-N 3.23Å; T140-A162 CarbonylContact C-O 3.55Å; T140-A162 VanDerWaalsContact CA-O 3.29Å; T140-A162 WeakPolarHBondContact CA-O 3.41Å; T140-A162 HydrophobicContact CG2-CB 3.97Å; A141-A162 PolarHBondContact N-O 3.48Å; A162-P164 WeakPolarHBondContact O-CD 3.46Å; A162-P197 HydrophobicContact CB-CB 4.07Å
163	T	98.8	Very high	98.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.246	C	C	.	.			trans	-119.4	62.8	169.5	41.2	0	0	0	0	111.9	G165 C172 P175 I179 M191 L192	T163-G165 PolarHBondContact O-N 3.16Å; T163-C172 HydrophobicContact CG2-CB 3.97Å; T163-P175 HydrophobicContact CG2-CB 4.02Å; T163-I179 HydrophobicContact CG2-CD1 3.29Å; T163-M191 WeakPolarHBondContact OG1-CB 3.41Å; T163-M191 PolarHBondContact OG1-O 2.88Å; T163-L192 HydrophobicContact CG2-CD2 3.98Å; T163-L192 WeakPolarHBondContact OG1-CA 3.34Å; T163-L192 PolarHBondContact OG1-N 3.24Å
164	P	98.6	Very high	98.6	Very high	35 Å²	35	43.5 Å²	43.5	23%	0.227	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-77	16.1	-168.7	36.1	-39.6	0	0	0	114.5	T140 A162 V166 N167	T140-P164 HydrophobicContact CG2-CG 4.23Å; A162-P164 WeakPolarHBondContact O-CD 3.46Å; P164-V166 PolarHBondContact O-N 3.35Å; P164-N167 WeakPolarHBondContact O-CB 3.38Å; P164-N167 PolarHBondContact O-N 3.29Å
165	G	98.2	Very high	98.6	Very high	6 Å²	6	43.7 Å²	43.7	6%	0.062	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-60.7	-30.7	-175.6	0	0	0	0	0	113.7	T163 N167 V168 G169 L170 C172	T163-G165 PolarHBondContact O-N 3.16Å; G165-N167 PolarHBondContact O-N 3.4Å; G165-V168 CarbonylContact O-C 3.51Å; G165-V168 WeakPolarHBondContact O-CG2 3.2Å; G165-V168 PolarHBondContact O-N 3.06Å; G165-G169 PolarHBondContact O-N 3.24Å; G165-L170 CarbonylContact C-O 3.52Å; G165-L170 WeakPolarHBondContact CA-O 3.34Å; G165-L170 CarbonylContact O-C 3.38Å; G165-L170 PolarHBondContact O-N 2.88Å; G165-L170 VanDerWaalsContact O-O 3.07Å; G165-C172 PolarHBondContact N-SG 2.91Å
166	V	98.3	Very high	98.6	Very high	45 Å²	45	44.9 Å²	44.9	27%	0.273	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-55.2	-35.6	171.4	-74.8	0	0	0	0	113	P164 V168 G169 F171 L192	P164-V166 PolarHBondContact O-N 3.35Å; V166-V168 PolarHBondContact O-N 3.46Å; V166-G169 PolarHBondContact O-N 2.91Å; V166-G169 VanDerWaalsContact O-N 3.12Å; V166-F171 HydrophobicContact CG1-CD2 3.59Å; V166-F171 HydrophobicContact CG1-CE2 4.11Å; V166-L192 WeakPolarHBondContact CG1-O 3.33Å
167	N	98.3	Very high	98.5	Very high	114 Å²	114	48.6 Å²	48.6	61%	0.61	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-72.3	-9.2	-179.2	-58.9	-21.3	0	0	0	113	P164 G165	P164-N167 WeakPolarHBondContact O-CB 3.38Å; P164-N167 PolarHBondContact O-N 3.29Å; G165-N167 PolarHBondContact O-N 3.4Å
168	V	97.3	Very high	98.5	Very high	89 Å²	89	43.6 Å²	43.6	54%	0.539	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-121.2	16.7	173.7	-60.6	0	0	0	0	112.4	L98 G165 V166 L170	L98-V168 HydrophobicContact CD1-CB 4.44Å; L98-V168 HydrophobicContact CD1-CG1 4.28Å; L98-V168 HydrophobicContact CD1-CG2 4.31Å; G165-V168 CarbonylContact O-C 3.51Å; G165-V168 WeakPolarHBondContact O-CG2 3.2Å; G165-V168 PolarHBondContact O-N 3.06Å; V166-V168 PolarHBondContact O-N 3.46Å; V168-L170 VanDerWaalsContact C-N 3.29Å; V168-L170 HydrophobicContact CG2-CB 4.43Å; V168-L170 PolarHBondContact O-N 3.3Å
169	G	98	Very high	98.5	Very high	75 Å²	75	38.2 Å²	38.2	77%	0.773	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	12	177.9	0	0	0	0	0	115.6	G165 V166	G165-G169 PolarHBondContact O-N 3.24Å; V166-G169 PolarHBondContact O-N 2.91Å; V166-G169 VanDerWaalsContact O-N 3.12Å
170	L	98.3	Very high	98.5	Very high	73 Å²	73	40.3 Å²	40.3	38%	0.382	27%	0.265	S	S	.	.			trans	-125	92.3	-177.9	-179.1	63.2	0	0	0	110.5	L101 F114 G165 V168 C172	L101-L170 HydrophobicContact CD1-CD2 3.79Å; F114-L170 HydrophobicContact CZ-CD2 4.38Å; G165-L170 CarbonylContact C-O 3.52Å; G165-L170 WeakPolarHBondContact CA-O 3.34Å; G165-L170 CarbonylContact O-C 3.38Å; G165-L170 PolarHBondContact O-N 2.88Å; G165-L170 VanDerWaalsContact O-O 3.07Å; V168-L170 VanDerWaalsContact C-N 3.29Å; V168-L170 HydrophobicContact CG2-CB 4.43Å; V168-L170 PolarHBondContact O-N 3.3Å; L170-C172 PolarHBondContact O-N 3.25Å
171	F	98.7	Very high	98.5	Very high	79 Å²	79	47.1 Å²	47.1	35%	0.346	29%	0.286	S	S	.	.			trans	-53.6	137	179.9	-165.7	-92.3	0	0	0	111.6	V166 S173 L192 F193	V166-F171 HydrophobicContact CG1-CD2 3.59Å; V166-F171 HydrophobicContact CG1-CE2 4.11Å; F171-S173 PolarHBondContact O-N 3.31Å; F171-L192 HydrophobicContact CE1-CB 4.41Å; F171-L192 HydrophobicContact CE1-CD2 4.29Å; F171-L192 HydrophobicContact CE2-CB 4.2Å; F171-L192 WeakPolarHBondContact CE2-O 3.25Å; F171-L192 HydrophobicContact CZ-CB 3.71Å; F171-L192 HydrophobicContact CZ-CD1 4.49Å; F171-L192 HydrophobicContact CZ-CD2 4.4Å; F171-L192 HydrophobicContact CZ-CG 4.43Å; F171-F193 AromaticContact CE2-CD1 3.87Å; F171-F193 HydrophobicContact CE2-CD1 3.87Å; F171-F193 HydrophobicContact CE2-CE1 4.16Å; F171-F193 HydrophobicContact CZ-CD1 4.37Å; F171-F193 HydrophobicContact CZ-CE1 4.38Å
172	C	98.6	Very high	98.4	Very high	9 Å²	9	48.5 Å²	48.5	6%	0.061	30%	0.297	C	S	.	.			trans	-77	53.7	-176.1	-80.5	0	0	0	0	113	T163 G165 L170 T174 P175 A176 L192	T163-C172 HydrophobicContact CG2-CB 3.97Å; G165-C172 PolarHBondContact N-SG 2.91Å; L170-C172 PolarHBondContact O-N 3.25Å; C172-T174 PolarHBondContact O-N 2.87Å; C172-P175 HydrophobicContact CB-CB 4.03Å; C172-P175 HydrophobicContact CB-CG 3.87Å; C172-P175 WeakPolarHBondContact O-CD 2.99Å; C172-A176 WeakPolarHBondContact O-CB 3.15Å; C172-A176 PolarHBondContact O-N 3.34Å; C172-L192 HydrophobicContact CB-CD2 3.73Å
173	S	98.8	Very high	98.4	Very high	73 Å²	73	48.7 Å²	48.7	51%	0.51	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-42.9	-176.2	-55.1	0	0	0	0	113.5	F171 A176	F171-S173 PolarHBondContact O-N 3.31Å; S173-A176 WeakPolarHBondContact O-CB 3.44Å; S173-A176 PolarHBondContact O-N 3.18Å
174	T	98.6	Very high	98.4	Very high	38 Å²	38	52 Å²	52	23%	0.233	32%	0.319	C	S	.	.	H	α-helix	trans	-71.4	-44.1	176.5	33.9	0	0	0	0	112.5	Q145 C172 A176 V177	Q145-T174 PolarHBondContact NE2-O 3.27Å; C172-T174 PolarHBondContact O-N 2.87Å; T174-A176 VanDerWaalsContact C-N 3.27Å; T174-A176 PolarHBondContact O-N 3.19Å; T174-V177 WeakPolarHBondContact O-CB 3.43Å; T174-V177 PolarHBondContact O-N 2.93Å; T174-V177 VanDerWaalsContact O-N 3.14Å
175	P	98.8	Very high	98.4	Very high	4 Å²	4	58.5 Å²	58.5	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-55.9	-36.5	167.9	-28.1	32.3	0	0	0	114.9	A141 Q145 T163 C172 V177 A178 I179	A141-P175 VanDerWaalsContact C-CG 3.5Å; Q145-P175 HydrophobicContact CB-CB 4.01Å; Q145-P175 HydrophobicContact CB-CG 4.18Å; T163-P175 HydrophobicContact CG2-CB 4.02Å; C172-P175 HydrophobicContact CB-CB 4.03Å; C172-P175 HydrophobicContact CB-CG 3.87Å; C172-P175 WeakPolarHBondContact O-CD 2.99Å; P175-V177 PolarHBondContact O-N 3.17Å; P175-A178 PolarHBondContact O-N 3.21Å; P175-I179 HydrophobicContact CB-CD1 3.97Å; P175-I179 WeakPolarHBondContact O-CB 3.48Å; P175-I179 WeakPolarHBondContact O-CG1 3.25Å; P175-I179 PolarHBondContact O-N 3.11Å
176	A	98.7	Very high	98.4	Very high	25 Å²	25	66.8 Å²	66.8	21%	0.207	38%	0.378	C	S	.	.	H	α-helix	trans	-59.3	-26.3	178	0	0	0	0	0	113.3	C172 S173 T174 G180 L192	C172-A176 WeakPolarHBondContact O-CB 3.15Å; C172-A176 PolarHBondContact O-N 3.34Å; S173-A176 WeakPolarHBondContact O-CB 3.44Å; S173-A176 PolarHBondContact O-N 3.18Å; T174-A176 VanDerWaalsContact C-N 3.27Å; T174-A176 PolarHBondContact O-N 3.19Å; A176-G180 WeakPolarHBondContact O-CA 3.5Å; A176-G180 PolarHBondContact O-N 3.46Å; A176-L192 HydrophobicContact CB-CD1 3.55Å; A176-L192 HydrophobicContact CB-CD2 3.85Å; A176-L192 HydrophobicContact CB-CG 4.37Å
177	V	98.7	Very high	98.5	Very high	78 Å²	78	65.6 Å²	65.6	47%	0.473	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-46.8	176.8	-179.2	0	0	0	0	111.2	T174 P175 R181	T174-V177 WeakPolarHBondContact O-CB 3.43Å; T174-V177 PolarHBondContact O-N 2.93Å; T174-V177 VanDerWaalsContact O-N 3.14Å; P175-V177 PolarHBondContact O-N 3.17Å; V177-R181 WeakPolarHBondContact O-CD 3.41Å; V177-R181 WeakPolarHBondContact O-CG 3.37Å; V177-R181 PolarHBondContact O-NH1 3.23Å
178	A	98.7	Very high	98.5	Very high	6 Å²	6	60.3 Å²	60.3	5%	0.05	34%	0.343	C	S	.	.	H	α-helix	trans	-80	-47.7	179.6	0	0	0	0	0	111.2	Q145 A148 P175 G180 R181 A182	Q145-A178 HydrophobicContact CG-CB 4.11Å; A148-A178 HydrophobicContact CB-CB 3.68Å; P175-A178 PolarHBondContact O-N 3.21Å; A178-G180 PolarHBondContact O-N 3.15Å; A178-R181 WeakPolarHBondContact O-CB 3.47Å; A178-R181 PolarHBondContact O-N 3.13Å; A178-A182 PolarHBondContact O-N 3.22Å; A178-A182 VanDerWaalsContact O-N 3.16Å
179	I	98.6	Very high	98.6	Very high	0 Å²	0	59 Å²	59	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-40.6	-176.7	-64.9	165.9	0	0	0	111.3	C144 A148 T163 P175 R181 A182 V183 A188	C144-I179 HydrophobicContact CB-CD1 4.21Å; A148-I179 HydrophobicContact CB-CG1 4.08Å; T163-I179 HydrophobicContact CG2-CD1 3.29Å; P175-I179 HydrophobicContact CB-CD1 3.97Å; P175-I179 WeakPolarHBondContact O-CB 3.48Å; P175-I179 WeakPolarHBondContact O-CG1 3.25Å; P175-I179 PolarHBondContact O-N 3.11Å; I179-R181 PolarHBondContact O-N 2.9Å; I179-A182 PolarHBondContact O-N 2.95Å; I179-V183 HydrophobicContact CG2-CG2 3.88Å; I179-V183 PolarHBondContact O-N 3.28Å; I179-A188 HydrophobicContact CG2-CB 4.27Å
180	G	98.2	Very high	98.6	Very high	45 Å²	45	61.5 Å²	61.5	46%	0.464	32%	0.323	S	S	.	.	H	α-helix	trans	-68.7	-7.8	175.6	0	0	0	0	0	115.1	A176 A178	A176-G180 WeakPolarHBondContact O-CA 3.5Å; A176-G180 PolarHBondContact O-N 3.46Å; A178-G180 PolarHBondContact O-N 3.15Å
181	R	98.1	Very high	98.6	Very high	190 Å²	190	58.2 Å²	58.2	72%	0.717	31%	0.306	S	S	*	.	H	α-helix	trans	-98.2	-19.3	168.6	-71.5	170	171.5	67.9	0.5	112.8	V177 A178 I179	V177-R181 WeakPolarHBondContact O-CD 3.41Å; V177-R181 WeakPolarHBondContact O-CG 3.37Å; V177-R181 PolarHBondContact O-NH1 3.23Å; A178-R181 WeakPolarHBondContact O-CB 3.47Å; A178-R181 PolarHBondContact O-N 3.13Å; I179-R181 PolarHBondContact O-N 2.9Å
182	A	98.1	Very high	98.6	Very high	29 Å²	29	54.7 Å²	54.7	24%	0.24	29%	0.291	C	S	.	.	H	α-helix	trans	-95.2	-37.2	-176.8	0	0	0	0	0	113.5	A148 A178 I179 H206 G207 L208	A148-A182 HydrophobicContact CB-CB 4.47Å; A178-A182 PolarHBondContact O-N 3.22Å; A178-A182 VanDerWaalsContact O-N 3.16Å; I179-A182 PolarHBondContact O-N 2.95Å; A182-H206 VanDerWaalsContact O-O 3.11Å; A182-G207 CarbonylContact O-C 3.6Å; A182-L208 HydrophobicContact CB-CD1 4.02Å
183	V	98.6	Very high	98.6	Very high	10 Å²	10	60.7 Å²	60.7	6%	0.061	32%	0.316	C	S	.	.	S	Bend	trans	-121.9	158.6	-175.6	-51.4	0	0	0	0	113.4	I179 V187 A188 H206 L208	I179-V183 HydrophobicContact CG2-CG2 3.88Å; I179-V183 PolarHBondContact O-N 3.28Å; V183-V187 HydrophobicContact CB-CB 4.35Å; V183-V187 HydrophobicContact CB-CG1 4.29Å; V183-V187 HydrophobicContact CG2-CB 4.03Å; V183-V187 HydrophobicContact CG2-CG1 4.02Å; V183-A188 HydrophobicContact CG2-CB 3.75Å; V183-H206 WeakPolarHBondContact CA-O 3.48Å; V183-H206 HydrophobicContact CB-CB 4.17Å; V183-H206 HydrophobicContact CG1-CB 4.03Å; V183-L208 HydrophobicContact CG1-CB 3.66Å; V183-L208 HydrophobicContact CG1-CD1 4.44Å; V183-L208 HydrophobicContact CG1-CG 4.5Å
184	P	98.7	Very high	98.6	Very high	70 Å²	70	60.2 Å²	60.2	46%	0.455	31%	0.31	S	S	.	.			trans	-56.2	142.9	175.8	-25.5	35	0	0	0	112.6	K186 V187 A188	P184-K186 PolarHBondContact O-N 3.23Å; P184-V187 HydrophobicContact CB-CG2 4.38Å; P184-V187 WeakPolarHBondContact O-CB 3.39Å; P184-V187 PolarHBondContact O-N 3.46Å; P184-A188 PolarHBondContact O-N 3.43Å
185	K	98.6	Very high	98.6	Very high	170 Å²	170	58.6 Å²	58.6	74%	0.739	30%	0.302	S	S	*	.	H	α-helix	trans	-47.2	-38.7	-177	-178.3	176	-179.9	176.4	0	114	M189	K185-M189 HydrophobicContact CG-CG 4.2Å; K185-M189 WeakPolarHBondContact O-CB 3.31Å; K185-M189 VanDerWaalsContact O-CG 3.22Å; K185-M189 WeakPolarHBondContact O-CG 3.02Å; K185-M189 PolarHBondContact O-N 3.21Å
186	K	98.8	Very high	98.6	Very high	180 Å²	180	61.3 Å²	61.3	78%	0.783	32%	0.32	S	S	*	.	H	α-helix	trans	-66.5	-45.8	179.8	-70	-66	-171.5	171	0	112.3	P184 M189 E190	P184-K186 PolarHBondContact O-N 3.23Å; K186-M189 PolarHBondContact O-N 2.91Å; K186-E190 WeakPolarHBondContact O-CB 3.47Å; K186-E190 PolarHBondContact O-N 3.25Å
187	V	98.8	Very high	98.6	Very high	20 Å²	20	64.3 Å²	64.3	12%	0.121	34%	0.338	C	S	.	.	H	α-helix	trans	-60.8	-48.7	175.2	-177.3	0	0	0	0	110.3	V183 P184 M189 E190 M191	V183-V187 HydrophobicContact CB-CB 4.35Å; V183-V187 HydrophobicContact CB-CG1 4.29Å; V183-V187 HydrophobicContact CG2-CB 4.03Å; V183-V187 HydrophobicContact CG2-CG1 4.02Å; P184-V187 HydrophobicContact CB-CG2 4.38Å; P184-V187 WeakPolarHBondContact O-CB 3.39Å; P184-V187 PolarHBondContact O-N 3.46Å; V187-M189 PolarHBondContact O-N 2.85Å; V187-E190 PolarHBondContact O-N 3Å; V187-M191 HydrophobicContact CG1-SD 4.07Å; V187-M191 WeakPolarHBondContact O-CG 3.41Å; V187-M191 PolarHBondContact O-N 3.2Å
188	A	98.8	Very high	98.6	Very high	4 Å²	4	61.8 Å²	61.8	3%	0.033	32%	0.321	C	S	.	.	H	α-helix	trans	-58	-49.4	178.2	0	0	0	0	0	112.1	I179 V183 P184 E190 M191 L192	I179-A188 HydrophobicContact CG2-CB 4.27Å; V183-A188 HydrophobicContact CG2-CB 3.75Å; P184-A188 PolarHBondContact O-N 3.43Å; A188-E190 PolarHBondContact O-N 2.84Å; A188-M191 PolarHBondContact O-N 3.06Å; A188-L192 VanDerWaalsContact O-CB 3.3Å; A188-L192 WeakPolarHBondContact O-CB 3.36Å; A188-L192 WeakPolarHBondContact O-CD1 3.29Å; A188-L192 WeakPolarHBondContact O-CG 3.45Å; A188-L192 PolarHBondContact O-N 3.22Å
189	M	98.7	Very high	98.6	Very high	60 Å²	60	63.5 Å²	63.5	30%	0.296	33%	0.333	S	S	.	.	H	α-helix	trans	-67.7	-34.7	-178.9	-66.1	-50.4	-55.4	0	0	112.7	K185 K186 V187 L192 F193	K185-M189 HydrophobicContact CG-CG 4.2Å; K185-M189 WeakPolarHBondContact O-CB 3.31Å; K185-M189 VanDerWaalsContact O-CG 3.22Å; K185-M189 WeakPolarHBondContact O-CG 3.02Å; K185-M189 PolarHBondContact O-N 3.21Å; K186-M189 PolarHBondContact O-N 2.91Å; V187-M189 PolarHBondContact O-N 2.85Å; M189-L192 PolarHBondContact O-N 3.44Å; M189-L192 HydrophobicContact SD-CD1 4.3Å; M189-F193 HydrophobicContact CB-CD2 4.2Å; M189-F193 HydrophobicContact CB-CE2 4.11Å; M189-F193 HydrophobicContact CE-CD1 4.4Å; M189-F193 HydrophobicContact CE-CD2 4.08Å; M189-F193 HydrophobicContact CE-CE1 3.72Å; M189-F193 HydrophobicContact CE-CE2 3.36Å; M189-F193 HydrophobicContact CE-CZ 3.15Å; M189-F193 WeakPolarHBondContact O-CB 3.49Å; M189-F193 WeakPolarHBondContact O-CD2 3.37Å; M189-F193 WeakPolarHBondContact O-CG 3.29Å; M189-F193 PolarHBondContact O-N 3.26Å
190	E	98.8	Very high	98.6	Very high	128 Å²	128	63.5 Å²	63.5	60%	0.598	33%	0.333	S	S	*	.	H	α-helix	trans	-63.7	-50.4	174.7	-177.5	174.1	-177.1	0	0	111.4	K186 V187 A188 L192 F193 T194	K186-E190 WeakPolarHBondContact O-CB 3.47Å; K186-E190 PolarHBondContact O-N 3.25Å; V187-E190 PolarHBondContact O-N 3Å; A188-E190 PolarHBondContact O-N 2.84Å; E190-L192 VanDerWaalsContact C-N 3.26Å; E190-L192 PolarHBondContact O-N 3.01Å; E190-F193 PolarHBondContact O-N 2.92Å; E190-T194 HydrophobicContact CG-CG2 4.39Å; E190-T194 WeakPolarHBondContact O-CB 3.39Å; E190-T194 WeakPolarHBondContact O-CG2 3.45Å; E190-T194 PolarHBondContact O-N 3.28Å; E190-T194 PolarHBondContact O-OG1 3.17Å
191	M	98.8	Very high	98.7	Very high	4 Å²	4	64.8 Å²	64.8	2%	0.02	33%	0.327	C	S	.	.	H	α-helix	trans	-57.5	-40.3	174.8	-67.5	174.6	71.9	0	0	111.9	T163 V187 A188 G195 I198	T163-M191 WeakPolarHBondContact OG1-CB 3.41Å; T163-M191 PolarHBondContact OG1-O 2.88Å; V187-M191 HydrophobicContact CG1-SD 4.07Å; V187-M191 WeakPolarHBondContact O-CG 3.41Å; V187-M191 PolarHBondContact O-N 3.2Å; A188-M191 PolarHBondContact O-N 3.06Å; M191-G195 VanDerWaalsContact O-CA 3.27Å; M191-G195 WeakPolarHBondContact O-CA 3.28Å; M191-G195 PolarHBondContact O-N 3.13Å; M191-I198 HydrophobicContact CE-CD1 4.04Å; M191-I198 HydrophobicContact CE-CG1 3.95Å; M191-I198 HydrophobicContact CE-CG2 4.46Å; M191-I198 HydrophobicContact CG-CG2 3.94Å; M191-I198 HydrophobicContact SD-CD1 3.82Å; M191-I198 HydrophobicContact SD-CG1 4.19Å; M191-I198 HydrophobicContact SD-CG2 3.99Å
192	L	98.8	Very high	98.7	Very high	5 Å²	5	58 Å²	58	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-74.4	-37.7	-176.9	-73.9	166.1	0	0	0	113.2	T163 V166 F171 C172 A176 A188 M189 E190	T163-L192 HydrophobicContact CG2-CD2 3.98Å; T163-L192 WeakPolarHBondContact OG1-CA 3.34Å; T163-L192 PolarHBondContact OG1-N 3.24Å; V166-L192 WeakPolarHBondContact CG1-O 3.33Å; F171-L192 HydrophobicContact CE1-CB 4.41Å; F171-L192 HydrophobicContact CE1-CD2 4.29Å; F171-L192 HydrophobicContact CE2-CB 4.2Å; F171-L192 WeakPolarHBondContact CE2-O 3.25Å; F171-L192 HydrophobicContact CZ-CB 3.71Å; F171-L192 HydrophobicContact CZ-CD1 4.49Å; F171-L192 HydrophobicContact CZ-CD2 4.4Å; F171-L192 HydrophobicContact CZ-CG 4.43Å; C172-L192 HydrophobicContact CB-CD2 3.73Å; A176-L192 HydrophobicContact CB-CD1 3.55Å; A176-L192 HydrophobicContact CB-CD2 3.85Å; A176-L192 HydrophobicContact CB-CG 4.37Å; A188-L192 VanDerWaalsContact O-CB 3.3Å; A188-L192 WeakPolarHBondContact O-CB 3.36Å; A188-L192 WeakPolarHBondContact O-CD1 3.29Å; A188-L192 WeakPolarHBondContact O-CG 3.45Å; A188-L192 PolarHBondContact O-N 3.22Å; M189-L192 PolarHBondContact O-N 3.44Å; M189-L192 HydrophobicContact SD-CD1 4.3Å; E190-L192 VanDerWaalsContact C-N 3.26Å; E190-L192 PolarHBondContact O-N 3.01Å
193	F	98.8	Very high	98.7	Very high	136 Å²	136	56.6 Å²	56.6	60%	0.596	29%	0.293	S	S	*	.	H	α-helix	trans	-82.5	-34.1	-179.9	-70.6	-41.9	0	0	0	113.5	F171 M189 E190	F171-F193 AromaticContact CE2-CD1 3.87Å; F171-F193 HydrophobicContact CE2-CD1 3.87Å; F171-F193 HydrophobicContact CE2-CE1 4.16Å; F171-F193 HydrophobicContact CZ-CD1 4.37Å; F171-F193 HydrophobicContact CZ-CE1 4.38Å; M189-F193 HydrophobicContact CB-CD2 4.2Å; M189-F193 HydrophobicContact CB-CE2 4.11Å; M189-F193 HydrophobicContact CE-CD1 4.4Å; M189-F193 HydrophobicContact CE-CD2 4.08Å; M189-F193 HydrophobicContact CE-CE1 3.72Å; M189-F193 HydrophobicContact CE-CE2 3.36Å; M189-F193 HydrophobicContact CE-CZ 3.15Å; M189-F193 WeakPolarHBondContact O-CB 3.49Å; M189-F193 WeakPolarHBondContact O-CD2 3.37Å; M189-F193 WeakPolarHBondContact O-CG 3.29Å; M189-F193 PolarHBondContact O-N 3.26Å; E190-F193 PolarHBondContact O-N 2.92Å
194	T	98.8	Very high	98.7	Very high	62 Å²	62	59.2 Å²	59.2	38%	0.38	31%	0.307	S	S	.	.	H	α-helix	trans	-95.7	-24.6	-177.1	65.8	0	0	0	0	113	E190 S196	E190-T194 HydrophobicContact CG-CG2 4.39Å; E190-T194 WeakPolarHBondContact O-CB 3.39Å; E190-T194 WeakPolarHBondContact O-CG2 3.45Å; E190-T194 PolarHBondContact O-N 3.28Å; E190-T194 PolarHBondContact O-OG1 3.17Å; T194-S196 PolarHBondContact O-N 3Å; T194-S196 VanDerWaalsContact OG1-CB 3.3Å; T194-S196 WeakPolarHBondContact OG1-CB 3.33Å; T194-S196 PolarHBondContact OG1-N 3.43Å; T194-S196 VanDerWaalsContact OG1-N 3.11Å; T194-S196 PolarHBondContact OG1-OG 3.46Å
195	G	98.6	Very high	98.7	Very high	5 Å²	5	64.3 Å²	64.3	5%	0.052	32%	0.317	C	S	.	.			trans	70.3	2.5	-169.2	0	0	0	0	0	114.7	M191	M191-G195 VanDerWaalsContact O-CA 3.27Å; M191-G195 WeakPolarHBondContact O-CA 3.28Å; M191-G195 PolarHBondContact O-N 3.13Å
196	S	98.3	Very high	98.8	Very high	60 Å²	60	59.4 Å²	59.4	42%	0.42	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-62.6	142.7	-177.9	-65.9	0	0	0	0	112	T194	T194-S196 PolarHBondContact O-N 3Å; T194-S196 VanDerWaalsContact OG1-CB 3.3Å; T194-S196 WeakPolarHBondContact OG1-CB 3.33Å; T194-S196 PolarHBondContact OG1-N 3.43Å; T194-S196 VanDerWaalsContact OG1-N 3.11Å; T194-S196 PolarHBondContact OG1-OG 3.46Å
197	P	98.6	Very high	98.7	Very high	88 Å²	88	53.2 Å²	53.2	57%	0.571	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-76.7	147.1	173.4	32.4	-34.2	0	0	0	111.8	F161 A162	F161-P197 CarbonylContact O-C 3.52Å; F161-P197 VanDerWaalsContact O-CA 3.31Å; F161-P197 WeakPolarHBondContact O-CA 3.16Å; A162-P197 HydrophobicContact CB-CB 4.07Å
198	I	98.8	Very high	98.7	Very high	25 Å²	25	52.6 Å²	52.6	13%	0.128	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	151.1	160.9	67	172	0	0	0	110.1	T160 F161 M191 D202 A203 L208	T160-I198 WeakPolarHBondContact CA-O 3.41Å; F161-I198 HydrophobicContact CB-CG1 3.97Å; F161-I198 PolarHBondContact N-O 3.29Å; F161-I198 VanDerWaalsContact N-O 3.07Å; F161-I198 PolarHBondContact O-N 2.85Å; M191-I198 HydrophobicContact CE-CD1 4.04Å; M191-I198 HydrophobicContact CE-CG1 3.95Å; M191-I198 HydrophobicContact CE-CG2 4.46Å; M191-I198 HydrophobicContact CG-CG2 3.94Å; M191-I198 HydrophobicContact SD-CD1 3.82Å; M191-I198 HydrophobicContact SD-CG1 4.19Å; M191-I198 HydrophobicContact SD-CG2 3.99Å; I198-D202 HydrophobicContact CB-CB 4.19Å; I198-A203 HydrophobicContact CD1-CB 3.93Å; I198-A203 HydrophobicContact CG1-CB 4.38Å; I198-L208 HydrophobicContact CD1-CD2 4Å
199	S	98.9	Very high	98.7	Very high	42 Å²	42	52.7 Å²	52.7	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	163.9	175.8	77.9	0	0	0	0	111.6	Q201 D202 A203	S199-Q201 PolarHBondContact O-N 3.35Å; S199-Q201 PolarHBondContact OG-N 2.97Å; S199-D202 WeakPolarHBondContact CB-OD2 3.44Å; S199-D202 PolarHBondContact O-N 3.41Å; S199-D202 VanDerWaalsContact OG-CG 3.25Å; S199-D202 PolarHBondContact OG-N 2.68Å; S199-D202 PolarHBondContact OG-OD2 3.04Å; S199-A203 WeakPolarHBondContact O-CB 3.33Å; S199-A203 PolarHBondContact O-N 2.8Å
200	A	98.9	Very high	98.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-55.3	-38.6	169.9	0	0	0	0	0	112.6	V155 T156 S159 F161 A203 L204 V212	V155-A200 HydrophobicContact CG2-CB 3.91Å; T156-A200 VanDerWaalsContact O-CB 3.26Å; T156-A200 WeakPolarHBondContact O-CB 3.31Å; S159-A200 WeakPolarHBondContact O-CB 3.36Å; S159-A200 PolarHBondContact O-N 3.39Å; F161-A200 HydrophobicContact CE2-CB 4.49Å; A200-A203 WeakPolarHBondContact O-CB 3.4Å; A200-A203 PolarHBondContact O-N 2.89Å; A200-L204 PolarHBondContact O-N 2.73Å; A200-V212 HydrophobicContact CB-CG1 3.8Å; A200-V212 HydrophobicContact CB-CG2 3.98Å; A200-V212 WeakPolarHBondContact O-CG2 3.48Å
201	Q	98.8	Very high	98.8	Very high	72 Å²	72	50.6 Å²	50.6	34%	0.336	28%	0.275	S	S	.	.	H	α-helix	trans	-69.5	-37.8	179.5	-67.9	-65.4	-12.9	0	0	112.2	S199 L204 R205	S199-Q201 PolarHBondContact O-N 3.35Å; S199-Q201 PolarHBondContact OG-N 2.97Å; Q201-L204 PolarHBondContact O-N 3.01Å; Q201-R205 WeakPolarHBondContact O-CD 3.41Å; Q201-R205 WeakPolarHBondContact O-CG 3.21Å; Q201-R205 PolarHBondContact O-N 2.82Å
202	D	98.8	Very high	98.8	Very high	47 Å²	47	51.4 Å²	51.4	25%	0.251	28%	0.28	S	S	.	.	H	α-helix	trans	-72.3	-36.7	175	-57.4	-51	0	0	0	111.7	I198 S199 L204 R205 H206	I198-D202 HydrophobicContact CB-CB 4.19Å; S199-D202 WeakPolarHBondContact CB-OD2 3.44Å; S199-D202 PolarHBondContact O-N 3.41Å; S199-D202 VanDerWaalsContact OG-CG 3.25Å; S199-D202 PolarHBondContact OG-N 2.68Å; S199-D202 PolarHBondContact OG-OD2 3.04Å; D202-L204 VanDerWaalsContact C-N 3.27Å; D202-L204 PolarHBondContact O-N 2.88Å; D202-R205 PolarHBondContact O-N 2.86Å; D202-R205 IonicContact OD1-CZ 3.7Å; D202-R205 IonicContact OD1-NH1 2.69Å; D202-R205 PolarHBondContact OD1-NH1 2.8Å; D202-H206 WeakPolarHBondContact O-CB 3.13Å; D202-H206 PolarHBondContact O-CD2 2.79Å; D202-H206 PolarHBondContact O-N 2.91Å
203	A	98.9	Very high	98.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.8	-40.1	170.2	0	0	0	0	0	111.7	F161 I198 S199 A200 G207 L208 V209	F161-A203 HydrophobicContact CD2-CB 3.65Å; F161-A203 HydrophobicContact CE2-CB 3.99Å; F161-A203 HydrophobicContact CG-CB 4.41Å; I198-A203 HydrophobicContact CD1-CB 3.93Å; I198-A203 HydrophobicContact CG1-CB 4.38Å; S199-A203 WeakPolarHBondContact O-CB 3.33Å; S199-A203 PolarHBondContact O-N 2.8Å; A200-A203 WeakPolarHBondContact O-CB 3.4Å; A200-A203 PolarHBondContact O-N 2.89Å; A203-G207 PolarHBondContact O-N 2.92Å; A203-L208 HydrophobicContact CB-CB 4Å; A203-L208 HydrophobicContact CB-CD2 4.02Å; A203-L208 HydrophobicContact CB-CG 4.38Å; A203-L208 WeakPolarHBondContact O-CB 3.39Å; A203-L208 PolarHBondContact O-N 3.38Å; A203-V209 HydrophobicContact CB-CG1 4.16Å; A203-V209 HydrophobicContact CB-CG2 3.95Å; A203-V209 PolarHBondContact O-N 2.79Å
204	L	98.9	Very high	98.8	Very high	65 Å²	65	46.9 Å²	46.9	34%	0.34	26%	0.264	S	S	.	.	H	α-helix	trans	-68.7	-49.5	175.5	-178.2	64.2	0	0	0	111.8	A200 Q201 D202 H206 G207 V209 V212	A200-L204 PolarHBondContact O-N 2.73Å; Q201-L204 PolarHBondContact O-N 3.01Å; D202-L204 VanDerWaalsContact C-N 3.27Å; D202-L204 PolarHBondContact O-N 2.88Å; L204-H206 PolarHBondContact O-N 3.33Å; L204-G207 PolarHBondContact O-N 2.91Å; L204-V209 HydrophobicContact CB-CG2 3.95Å; L204-V209 HydrophobicContact CD1-CG2 4.4Å; L204-V209 WeakPolarHBondContact CD1-O 3.41Å; L204-V212 HydrophobicContact CB-CG2 3.71Å; L204-V212 HydrophobicContact CD2-CB 4.21Å; L204-V212 HydrophobicContact CD2-CG2 3.87Å; L204-V212 HydrophobicContact CG-CG2 4.28Å
205	R	98.8	Very high	98.7	Very high	177 Å²	177	48.1 Å²	48.1	67%	0.668	27%	0.266	S	S	*	.	H	α-helix	trans	-56.4	-31.8	177.8	-71.7	163.6	-174	168.1	-3.2	112.8	Q201 D202	Q201-R205 WeakPolarHBondContact O-CD 3.41Å; Q201-R205 WeakPolarHBondContact O-CG 3.21Å; Q201-R205 PolarHBondContact O-N 2.82Å; D202-R205 PolarHBondContact O-N 2.86Å; D202-R205 IonicContact OD1-CZ 3.7Å; D202-R205 IonicContact OD1-NH1 2.69Å; D202-R205 PolarHBondContact OD1-NH1 2.8Å
206	H	98.7	Very high	98.7	Very high	68 Å²	68	55.3 Å²	55.3	32%	0.315	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	0.9	-177	-63.6	-40.6	0	0	0	114.7	A182 V183 D202 L204	A182-H206 VanDerWaalsContact O-O 3.11Å; V183-H206 WeakPolarHBondContact CA-O 3.48Å; V183-H206 HydrophobicContact CB-CB 4.17Å; V183-H206 HydrophobicContact CG1-CB 4.03Å; D202-H206 WeakPolarHBondContact O-CB 3.13Å; D202-H206 PolarHBondContact O-CD2 2.79Å; D202-H206 PolarHBondContact O-N 2.91Å; L204-H206 PolarHBondContact O-N 3.33Å
207	G	98.4	Very high	98.8	Very high	49 Å²	49	56.7 Å²	56.7	51%	0.505	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	8.8	174.9	0	0	0	0	0	116.1	A182 A203 L204 V209	A182-G207 CarbonylContact O-C 3.6Å; A203-G207 PolarHBondContact O-N 2.92Å; L204-G207 PolarHBondContact O-N 2.91Å; G207-V209 VanDerWaalsContact C-N 3.33Å
208	L	98.9	Very high	98.8	Very high	7 Å²	7	52.9 Å²	52.9	4%	0.037	27%	0.269	C	S	.	.	S	Bend	trans	-71.1	-28.8	174.5	-176	61.5	0	0	0	112.6	A148 F161 A182 V183 I198 A203	A148-L208 HydrophobicContact CB-CD1 3.73Å; F161-L208 HydrophobicContact CB-CD2 3.71Å; F161-L208 HydrophobicContact CD1-CD2 4.17Å; F161-L208 HydrophobicContact CD2-CD2 4.46Å; F161-L208 HydrophobicContact CG-CD2 3.84Å; A182-L208 HydrophobicContact CB-CD1 4.02Å; V183-L208 HydrophobicContact CG1-CB 3.66Å; V183-L208 HydrophobicContact CG1-CD1 4.44Å; V183-L208 HydrophobicContact CG1-CG 4.5Å; I198-L208 HydrophobicContact CD1-CD2 4Å; A203-L208 HydrophobicContact CB-CB 4Å; A203-L208 HydrophobicContact CB-CD2 4.02Å; A203-L208 HydrophobicContact CB-CG 4.38Å; A203-L208 WeakPolarHBondContact O-CB 3.39Å; A203-L208 PolarHBondContact O-N 3.38Å
209	V	98.9	Very high	98.8	Very high	7 Å²	7	54.9 Å²	54.9	4%	0.042	28%	0.278	C	S	.	.			trans	-134.7	153.7	179.7	-55.8	0	0	0	0	111.4	V147 A153 V155 F161 A203 L204 G207 V212	V147-V209 HydrophobicContact CG1-CG1 4.28Å; A153-V209 HydrophobicContact CB-CB 4.08Å; A153-V209 HydrophobicContact CB-CG1 4.07Å; V155-V209 HydrophobicContact CG1-CB 3.99Å; V155-V209 HydrophobicContact CG1-CG1 3.62Å; V155-V209 HydrophobicContact CG2-CB 4.37Å; V155-V209 HydrophobicContact CG2-CG1 4.32Å; V155-V209 HydrophobicContact CG2-CG2 4.04Å; F161-V209 HydrophobicContact CE1-CG1 4.33Å; F161-V209 HydrophobicContact CE2-CG1 4.27Å; F161-V209 HydrophobicContact CZ-CG1 3.97Å; A203-V209 HydrophobicContact CB-CG1 4.16Å; A203-V209 HydrophobicContact CB-CG2 3.95Å; A203-V209 PolarHBondContact O-N 2.79Å; L204-V209 HydrophobicContact CB-CG2 3.95Å; L204-V209 HydrophobicContact CD1-CG2 4.4Å; L204-V209 WeakPolarHBondContact CD1-O 3.41Å; G207-V209 VanDerWaalsContact C-N 3.33Å; V209-V212 HydrophobicContact CG2-CG2 4.08Å
210	S	98.9	Very high	98.7	Very high	62 Å²	62	57.8 Å²	57.8	43%	0.434	29%	0.287	S	S	.	.	S	Bend	trans	-91.3	-29.7	-174.7	-39.4	0	0	0	0	113.5	A153	A153-S210 PolarHBondContact N-OG 3.21Å; A153-S210 WeakPolarHBondContact O-CA 3.33Å; A153-S210 WeakPolarHBondContact O-CB 3.35Å; A153-S210 PolarHBondContact O-N 3.47Å
211	K	98.9	Very high	98.7	Very high	81 Å²	81	59.2 Å²	59.2	35%	0.352	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	144.3	177.7	-77.5	-158.9	176.2	-158.1	0	111.9	A153 V154 V155 E221 I225	A153-K211 PolarHBondContact O-N 3.04Å; V154-K211 HydrophobicContact CG1-CB 4.09Å; V154-K211 HydrophobicContact CG2-CB 4.44Å; V155-K211 PolarHBondContact N-O 3.29Å; K211-E221 IonicContact NZ-OE2 3.62Å; K211-E221 PolarHBondContact NZ-OE2 3.08Å; K211-I225 HydrophobicContact CD-CD1 4.34Å
212	V	98.9	Very high	98.7	Very high	22 Å²	22	55.8 Å²	55.8	13%	0.133	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.5	167.7	-177.6	0	0	0	0	108	V155 E157 A200 L204 V209	V155-V212 HydrophobicContact CG2-CB 4.47Å; V155-V212 HydrophobicContact CG2-CG2 3.83Å; V155-V212 WeakPolarHBondContact O-CA 3.38Å; E157-V212 HydrophobicContact CB-CG1 4.3Å; E157-V212 HydrophobicContact CG-CG1 3.73Å; A200-V212 HydrophobicContact CB-CG1 3.8Å; A200-V212 HydrophobicContact CB-CG2 3.98Å; A200-V212 WeakPolarHBondContact O-CG2 3.48Å; L204-V212 HydrophobicContact CB-CG2 3.71Å; L204-V212 HydrophobicContact CD2-CB 4.21Å; L204-V212 HydrophobicContact CD2-CG2 3.87Å; L204-V212 HydrophobicContact CG-CG2 4.28Å; V209-V212 HydrophobicContact CG2-CG2 4.08Å
213	V	98.9	Very high	98.7	Very high	10 Å²	10	55.2 Å²	55.2	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.6	-175.3	-61.1	0	0	0	0	111.6	V154 V155 T156 E157 R217 L218 E221	V154-V213 HydrophobicContact CG1-CG2 4.19Å; V155-V213 PolarHBondContact O-N 3.33Å; T156-V213 CarbonylContact C-O 3.48Å; T156-V213 VanDerWaalsContact CA-O 3.25Å; T156-V213 WeakPolarHBondContact CA-O 3.47Å; E157-V213 PolarHBondContact N-O 2.81Å; V213-R217 HydrophobicContact CB-CB 4.46Å; V213-L218 HydrophobicContact CG2-CB 4.38Å; V213-L218 HydrophobicContact CG2-CD1 4.23Å; V213-E221 HydrophobicContact CG1-CB 4.37Å; V213-E221 HydrophobicContact CG1-CG 4.05Å
214	P	98.7	Very high	98.7	Very high	36 Å²	36	57.2 Å²	57.2	23%	0.234	29%	0.29	C	S	.	.			trans	-55.8	151.2	167.3	-26.5	36.3	0	0	0	112.1	E216 R217 L218	P214-E216 VanDerWaalsContact C-N 3.32Å; P214-E216 VanDerWaalsContact CB-CD 3.43Å; P214-E216 WeakPolarHBondContact CB-OE1 3.24Å; P214-E216 WeakPolarHBondContact CB-OE2 3.39Å; P214-E216 PolarHBondContact O-N 3.02Å; P214-R217 HydrophobicContact CB-CG 4.49Å; P214-R217 PolarHBondContact O-N 2.84Å; P214-L218 PolarHBondContact O-N 3.27Å
215	E	98.4	Very high	98.7	Very high	88 Å²	88	55.8 Å²	55.8	41%	0.411	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-60.3	-41.1	-172.7	175.8	169	-153.2	0	0	112.8	N136 T156 K158 R217 L218	N136-E215 PolarHBondContact ND2-OE1 3.02Å; N136-E215 PolarHBondContact OD1-OE1 3.38Å; T156-E215 HydrophobicContact CG2-CB 4.07Å; T156-E215 HydrophobicContact CG2-CG 4.27Å; K158-E215 WeakPolarHBondContact CE-OE1 3.29Å; K158-E215 WeakPolarHBondContact CE-OE2 3.38Å; K158-E215 IonicContact NZ-OE1 2.72Å; K158-E215 PolarHBondContact NZ-OE1 3.44Å; K158-E215 IonicContact NZ-OE2 2.62Å; K158-E215 PolarHBondContact NZ-OE2 2.87Å; E215-R217 PolarHBondContact O-N 2.72Å; E215-L218 VanDerWaalsContact O-CB 3.31Å; E215-L218 WeakPolarHBondContact O-CB 3.35Å; E215-L218 PolarHBondContact O-N 2.72Å
216	E	98.4	Very high	98.7	Very high	155 Å²	155	47.3 Å²	47.3	72%	0.724	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-64.4	-19.9	177	69.1	-79	-172.6	0	0	113.6	P214	P214-E216 VanDerWaalsContact C-N 3.32Å; P214-E216 VanDerWaalsContact CB-CD 3.43Å; P214-E216 WeakPolarHBondContact CB-OE1 3.24Å; P214-E216 WeakPolarHBondContact CB-OE2 3.39Å; P214-E216 PolarHBondContact O-N 3.02Å
217	R	98.6	Very high	98.7	Very high	90 Å²	90	49.7 Å²	49.7	34%	0.34	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-99.8	-7.2	177.9	-58.3	-160.4	66.4	-127	-14.1	114	V213 P214 E215 E219 E220 E221	V213-R217 HydrophobicContact CB-CB 4.46Å; P214-R217 HydrophobicContact CB-CG 4.49Å; P214-R217 PolarHBondContact O-N 2.84Å; E215-R217 PolarHBondContact O-N 2.72Å; R217-E219 PolarHBondContact O-N 2.93Å; R217-E220 IonicContact CZ-OE2 2.73Å; R217-E220 IonicContact NE-OE2 3.11Å; R217-E220 PolarHBondContact NE-OE2 2.74Å; R217-E220 VanDerWaalsContact NE-OE2 3.13Å; R217-E220 IonicContact NH2-OE1 3.35Å; R217-E220 IonicContact NH2-OE2 2.75Å; R217-E220 PolarHBondContact NH2-OE2 3.19Å; R217-E220 PolarHBondContact O-N 2.85Å; R217-E221 HydrophobicContact CB-CG 4.48Å; R217-E221 IonicContact CZ-OE1 2.74Å; R217-E221 IonicContact NH1-OE1 2.82Å; R217-E221 PolarHBondContact NH1-OE1 3.4Å; R217-E221 IonicContact NH2-OE1 3.75Å; R217-E221 PolarHBondContact NH2-OE1 3.39Å; R217-E221 WeakPolarHBondContact O-CB 3.27Å; R217-E221 WeakPolarHBondContact O-CG 3.34Å; R217-E221 PolarHBondContact O-N 2.82Å
218	L	98.9	Very high	98.7	Very high	7 Å²	7	56.5 Å²	56.5	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-55.4	-50.3	-176.1	-177.5	72.5	0	0	0	112.9	M134 N136 V154 T156 V213 P214 E215 T222	M134-L218 HydrophobicContact CE-CD2 4.44Å; M134-L218 HydrophobicContact CG-CD1 4.04Å; M134-L218 HydrophobicContact CG-CD2 3.78Å; M134-L218 HydrophobicContact CG-CG 3.68Å; M134-L218 HydrophobicContact SD-CD2 4.34Å; M134-L218 HydrophobicContact SD-CG 4.18Å; N136-L218 HydrophobicContact CB-CD2 3.8Å; V154-L218 HydrophobicContact CG1-CD1 4.11Å; T156-L218 HydrophobicContact CG2-CB 4.05Å; T156-L218 HydrophobicContact CG2-CD1 3.91Å; T156-L218 HydrophobicContact CG2-CD2 3.69Å; T156-L218 HydrophobicContact CG2-CG 4.09Å; V213-L218 HydrophobicContact CG2-CB 4.38Å; V213-L218 HydrophobicContact CG2-CD1 4.23Å; P214-L218 PolarHBondContact O-N 3.27Å; E215-L218 VanDerWaalsContact O-CB 3.31Å; E215-L218 WeakPolarHBondContact O-CB 3.35Å; E215-L218 PolarHBondContact O-N 2.72Å; L218-T222 VanDerWaalsContact O-CB 3.25Å; L218-T222 WeakPolarHBondContact O-CB 3.27Å; L218-T222 PolarHBondContact O-N 3.39Å; L218-T222 PolarHBondContact O-OG1 2.87Å
219	E	98.6	Very high	98.7	Very high	68 Å²	68	57.1 Å²	57.1	32%	0.318	27%	0.272	S	S	.	.	H	α-helix	trans	-65.1	-44.8	-179.2	-178.6	71.7	-159.6	0	0	111.1	R47 M134 R217 L223	R47-E219 IonicContact CZ-OE1 3.57Å; R47-E219 IonicContact CZ-OE2 3.05Å; R47-E219 IonicContact NH1-OE1 3.47Å; R47-E219 PolarHBondContact NH1-OE1 3.43Å; R47-E219 IonicContact NH1-OE2 2.69Å; R47-E219 VanDerWaalsContact NH2-CD 3.33Å; R47-E219 IonicContact NH2-OE1 3.55Å; R47-E219 PolarHBondContact NH2-OE1 2.95Å; R47-E219 VanDerWaalsContact NH2-OE1 3.11Å; R47-E219 IonicContact NH2-OE2 3.3Å; R47-E219 PolarHBondContact NH2-OE2 3.04Å; M134-E219 WeakPolarHBondContact CE-OE2 3.47Å; R217-E219 PolarHBondContact O-N 2.93Å; E219-L223 HydrophobicContact CG-CD1 4.2Å; E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 VanDerWaalsContact O-CG 3.28Å; E219-L223 WeakPolarHBondContact O-CG 3.42Å; E219-L223 PolarHBondContact O-N 3.33Å; E219-L223 WeakPolarHBondContact OE1-CD1 3.49Å
220	E	98.6	Very high	98.7	Very high	103 Å²	103	58 Å²	58	48%	0.481	28%	0.278	S	S	.	.	H	α-helix	trans	-58.2	-53.3	179.7	-172.7	-158.4	-174.2	0	0	111.4	R217 L223 A224 R227	R217-E220 IonicContact CZ-OE2 2.73Å; R217-E220 IonicContact NE-OE2 3.11Å; R217-E220 PolarHBondContact NE-OE2 2.74Å; R217-E220 VanDerWaalsContact NE-OE2 3.13Å; R217-E220 IonicContact NH2-OE1 3.35Å; R217-E220 IonicContact NH2-OE2 2.75Å; R217-E220 PolarHBondContact NH2-OE2 3.19Å; R217-E220 PolarHBondContact O-N 2.85Å; E220-L223 PolarHBondContact O-N 3.46Å; E220-A224 WeakPolarHBondContact O-CB 3.47Å; E220-A224 PolarHBondContact O-N 3.04Å; E220-R227 PolarHBondContact O-NH2 3.03Å
221	E	98.8	Very high	98.6	Very high	30 Å²	30	61.6 Å²	61.6	14%	0.14	29%	0.288	C	S	.	.	H	α-helix	trans	-69.3	-40.4	-175.7	-74.5	-83.6	175.5	0	0	111.9	V154 K211 V213 R217 A224 I225	V154-E221 HydrophobicContact CG1-CB 4.33Å; K211-E221 IonicContact NZ-OE2 3.62Å; K211-E221 PolarHBondContact NZ-OE2 3.08Å; V213-E221 HydrophobicContact CG1-CB 4.37Å; V213-E221 HydrophobicContact CG1-CG 4.05Å; R217-E221 HydrophobicContact CB-CG 4.48Å; R217-E221 IonicContact CZ-OE1 2.74Å; R217-E221 IonicContact NH1-OE1 2.82Å; R217-E221 PolarHBondContact NH1-OE1 3.4Å; R217-E221 IonicContact NH2-OE1 3.75Å; R217-E221 PolarHBondContact NH2-OE1 3.39Å; R217-E221 WeakPolarHBondContact O-CB 3.27Å; R217-E221 WeakPolarHBondContact O-CG 3.34Å; R217-E221 PolarHBondContact O-N 2.82Å; E221-A224 PolarHBondContact O-N 3.25Å; E221-I225 PolarHBondContact O-N 3.44Å; E221-I225 VanDerWaalsContact O-N 3.17Å
222	T	98.9	Very high	98.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-48.3	173.9	-57.7	0	0	0	0	111	V84 I132 M134 V154 L218 A224 I225 A226	V84-T222 HydrophobicContact CG1-CG2 3.72Å; V84-T222 HydrophobicContact CG2-CG2 4.29Å; I132-T222 HydrophobicContact CG2-CG2 4.06Å; M134-T222 HydrophobicContact CB-CG2 3.96Å; M134-T222 HydrophobicContact CG-CG2 3.99Å; M134-T222 WeakPolarHBondContact CG-OG1 3.16Å; M134-T222 HydrophobicContact SD-CG2 3.88Å; V154-T222 WeakPolarHBondContact CB-OG1 3.49Å; L218-T222 VanDerWaalsContact O-CB 3.25Å; L218-T222 WeakPolarHBondContact O-CB 3.27Å; L218-T222 PolarHBondContact O-N 3.39Å; L218-T222 PolarHBondContact O-OG1 2.87Å; T222-A224 VanDerWaalsContact C-N 3.3Å; T222-A224 PolarHBondContact O-N 3.15Å; T222-I225 PolarHBondContact O-N 3.27Å; T222-A226 PolarHBondContact O-N 3.13Å
223	L	98.6	Very high	98.5	Very high	34 Å²	34	58.2 Å²	58.2	18%	0.178	28%	0.277	C	S	.	.	H	α-helix	trans	-69.7	-26.8	178.2	-67.9	-178.4	0	0	0	112.5	I45 E219 E220 A226 R227	I45-L223 HydrophobicContact CD1-CD2 4.2Å; I45-L223 HydrophobicContact CG2-CD2 4.36Å; E219-L223 HydrophobicContact CG-CD1 4.2Å; E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 VanDerWaalsContact O-CG 3.28Å; E219-L223 WeakPolarHBondContact O-CG 3.42Å; E219-L223 PolarHBondContact O-N 3.33Å; E219-L223 WeakPolarHBondContact OE1-CD1 3.49Å; E220-L223 PolarHBondContact O-N 3.46Å; L223-A226 PolarHBondContact O-N 2.85Å; L223-R227 VanDerWaalsContact O-CB 3.28Å; L223-R227 WeakPolarHBondContact O-CB 3.39Å; L223-R227 WeakPolarHBondContact O-CG 3.36Å; L223-R227 PolarHBondContact O-N 3Å; L223-R227 PolarHBondContact O-NE 3.05Å
224	A	98.8	Very high	98.5	Very high	42 Å²	42	59.1 Å²	59.1	35%	0.347	28%	0.279	S	S	.	.	H	α-helix	trans	-63.9	-44.1	173.5	0	0	0	0	0	111.5	E220 E221 T222 R228	E220-A224 WeakPolarHBondContact O-CB 3.47Å; E220-A224 PolarHBondContact O-N 3.04Å; E221-A224 PolarHBondContact O-N 3.25Å; T222-A224 VanDerWaalsContact C-N 3.3Å; T222-A224 PolarHBondContact O-N 3.15Å; A224-R228 WeakPolarHBondContact O-CB 3.21Å; A224-R228 PolarHBondContact O-N 3.19Å; A224-R228 VanDerWaalsContact O-N 3.13Å
225	I	98.8	Very high	98.4	Very high	35 Å²	35	58.1 Å²	58.1	18%	0.179	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-49.6	173.4	-62.4	173.4	0	0	0	110.3	I132 I152 V154 K211 E221 T222 R227 R228 V229	I132-I225 HydrophobicContact CD1-CB 4.28Å; I132-I225 HydrophobicContact CD1-CG2 3.79Å; I152-I225 HydrophobicContact CD1-CG2 3.73Å; I152-I225 HydrophobicContact CG2-CD1 4.25Å; V154-I225 HydrophobicContact CG2-CD1 3.66Å; K211-I225 HydrophobicContact CD-CD1 4.34Å; E221-I225 PolarHBondContact O-N 3.44Å; E221-I225 VanDerWaalsContact O-N 3.17Å; T222-I225 PolarHBondContact O-N 3.27Å; I225-R227 PolarHBondContact O-N 2.72Å; I225-R228 PolarHBondContact O-N 3.3Å; I225-R228 VanDerWaalsContact O-N 3.08Å; I225-V229 PolarHBondContact O-N 3.39Å
226	A	98.8	Very high	98.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.2	-45.3	-179.8	0	0	0	0	0	112.5	I45 V82 V84 I132 T222 L223 R228 V229 C230	I45-A226 HydrophobicContact CD1-CB 3.72Å; I45-A226 HydrophobicContact CG1-CB 4Å; I45-A226 HydrophobicContact CG2-CB 4.14Å; V82-A226 HydrophobicContact CG1-CB 3.85Å; V84-A226 HydrophobicContact CG2-CB 4.26Å; I132-A226 HydrophobicContact CD1-CB 4.05Å; T222-A226 PolarHBondContact O-N 3.13Å; L223-A226 PolarHBondContact O-N 2.85Å; A226-R228 VanDerWaalsContact C-N 3.31Å; A226-R228 PolarHBondContact O-N 3.12Å; A226-V229 WeakPolarHBondContact O-CB 3.33Å; A226-V229 PolarHBondContact O-N 3.4Å; A226-C230 PolarHBondContact O-N 3.16Å; A226-C230 PolarHBondContact O-SG 3.46Å; A226-C230 VanDerWaalsContact O-SG 3.4Å
227	R	98.7	Very high	98.4	Very high	117 Å²	117	50.3 Å²	50.3	44%	0.442	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-37.3	174.9	-74.9	179.9	-65.1	-110.7	-0.4	112.4	I45 E220 L223 I225 C230 Q231	I45-R227 HydrophobicContact CD1-CG 4.01Å; E220-R227 PolarHBondContact O-NH2 3.03Å; L223-R227 VanDerWaalsContact O-CB 3.28Å; L223-R227 WeakPolarHBondContact O-CB 3.39Å; L223-R227 WeakPolarHBondContact O-CG 3.36Å; L223-R227 PolarHBondContact O-N 3Å; L223-R227 PolarHBondContact O-NE 3.05Å; I225-R227 PolarHBondContact O-N 2.72Å; R227-C230 WeakPolarHBondContact O-CB 3.47Å; R227-C230 PolarHBondContact O-N 3.11Å; R227-Q231 WeakPolarHBondContact O-CG 3.28Å; R227-Q231 PolarHBondContact O-N 2.64Å; R227-Q231 VanDerWaalsContact O-N 3.15Å
228	R	98.4	Very high	98.4	Very high	192 Å²	192	47 Å²	47	73%	0.725	23%	0.234	S	C	*	.	H	α-helix	trans	-70.2	-30.5	176.6	-177.8	163.4	156.1	85.2	-6.1	112.5	A224 I225 A226 Q231	A224-R228 WeakPolarHBondContact O-CB 3.21Å; A224-R228 PolarHBondContact O-N 3.19Å; A224-R228 VanDerWaalsContact O-N 3.13Å; I225-R228 PolarHBondContact O-N 3.3Å; I225-R228 VanDerWaalsContact O-N 3.08Å; A226-R228 VanDerWaalsContact C-N 3.31Å; A226-R228 PolarHBondContact O-N 3.12Å; R228-Q231 PolarHBondContact O-N 3.18Å
229	V	98.4	Very high	98.3	Very high	21 Å²	21	49 Å²	49	13%	0.127	24%	0.244	C	C	.	.	H	α-helix	trans	-66.5	-43.3	168	177.4	0	0	0	0	110.9	R81 V82 P130 I225 A226 Q231 A232	R81-V229 PolarHBondContact NH2-O 2.76Å; V82-V229 HydrophobicContact CB-CB 4.25Å; V82-V229 HydrophobicContact CB-CG1 3.97Å; V82-V229 HydrophobicContact CG2-CB 4.47Å; V82-V229 HydrophobicContact CG2-CG1 4.41Å; P130-V229 HydrophobicContact CG-CG1 3.9Å; I225-V229 PolarHBondContact O-N 3.39Å; A226-V229 WeakPolarHBondContact O-CB 3.33Å; A226-V229 PolarHBondContact O-N 3.4Å; V229-Q231 PolarHBondContact O-N 2.7Å; V229-A232 PolarHBondContact O-N 3.23Å; V229-A232 VanDerWaalsContact O-N 3.12Å
230	C	98.1	Very high	98.3	Very high	26 Å²	26	47.6 Å²	47.6	18%	0.176	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-25	175.4	-62.6	0	0	0	0	113.6	N43 R81 A226 R227	N43-C230 PolarHBondContact O-SG 3.38Å; N43-C230 VanDerWaalsContact O-SG 3.38Å; R81-C230 HydrophobicContact CB-CB 4.38Å; R81-C230 PolarHBondContact NH1-O 2.98Å; A226-C230 PolarHBondContact O-N 3.16Å; A226-C230 PolarHBondContact O-SG 3.46Å; A226-C230 VanDerWaalsContact O-SG 3.4Å; R227-C230 WeakPolarHBondContact O-CB 3.47Å; R227-C230 PolarHBondContact O-N 3.11Å
231	Q	97.6	Very high	98.3	Very high	136 Å²	136	43.5 Å²	43.5	64%	0.636	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.5	177.1	-72.9	169.6	-4.6	0	0	114.5	R227 R228 V229 W287	R227-Q231 WeakPolarHBondContact O-CG 3.28Å; R227-Q231 PolarHBondContact O-N 2.64Å; R227-Q231 VanDerWaalsContact O-N 3.15Å; R228-Q231 PolarHBondContact O-N 3.18Å; V229-Q231 PolarHBondContact O-N 2.7Å; Q231-W287 PolarHBondContact O-NE1 2.92Å
232	A	97.6	Very high	98.2	Very high	30 Å²	30	44.3 Å²	44.3	25%	0.248	24%	0.241	C	C	.	.	S	Bend	trans	-82.6	-179.5	172.7	0	0	0	0	0	111.2	R81 V229 V237 W287	R81-A232 PolarHBondContact NH1-O 2.95Å; R81-A232 PolarHBondContact NH2-O 3.23Å; V229-A232 PolarHBondContact O-N 3.23Å; V229-A232 VanDerWaalsContact O-N 3.12Å; A232-V237 HydrophobicContact CB-CG2 3.7Å; A232-W287 VanDerWaalsContact O-CD1 3.26Å
233	S	98.2	Very high	98.2	Very high	3 Å²	3	45 Å²	45	2%	0.021	25%	0.245	C	C	.	.			trans	-82	134.4	165.9	159.8	0	0	0	0	110.9	P235 V236 V237 D271	S233-P235 WeakPolarHBondContact OG-CD 3.49Å; S233-P235 WeakPolarHBondContact OG-CG 3.46Å; S233-V236 WeakPolarHBondContact OG-CG2 2.96Å; S233-V237 WeakPolarHBondContact O-CG2 3.32Å; S233-V237 PolarHBondContact O-N 3.04Å; S233-V237 VanDerWaalsContact O-N 3.16Å; S233-D271 WeakPolarHBondContact CB-OD2 3.4Å; S233-D271 VanDerWaalsContact OG-CB 3.24Å; S233-D271 WeakPolarHBondContact OG-CB 3.4Å; S233-D271 VanDerWaalsContact OG-CG 3.27Å; S233-D271 PolarHBondContact OG-OD2 3.49Å
234	R	97.8	Very high	98.2	Very high	28 Å²	28	48.7 Å²	48.7	11%	0.106	26%	0.26	C	S	.	.	H	α-helix	trans	-57.3	-57.1	175.5	-170.8	-179.7	173.6	-100.8	-9.1	113.7	I75 D76 S77 D78 L80 V236 V237 A238 N289	I75-R234 PolarHBondContact O-NH2 3.44Å; D76-R234 PolarHBondContact O-NH1 2.95Å; D76-R234 PolarHBondContact O-NH2 3.04Å; S77-R234 PolarHBondContact O-NE 2.91Å; D78-R234 IonicContact OD1-NH1 3.45Å; D78-R234 PolarHBondContact OD1-NH1 2.86Å; D78-R234 VanDerWaalsContact OD1-NH1 3.1Å; L80-R234 WeakPolarHBondContact O-CD 3.48Å; L80-R234 PolarHBondContact O-NE 2.97Å; L80-R234 VanDerWaalsContact O-NE 3.1Å; R234-V236 VanDerWaalsContact C-N 3.32Å; R234-V236 PolarHBondContact O-N 2.85Å; R234-V237 PolarHBondContact O-N 3.25Å; R234-A238 PolarHBondContact O-N 2.75Å; R234-N289 HydrophobicContact CB-CB 4Å; R234-N289 PolarHBondContact N-OD1 3.3Å; R234-N289 VanDerWaalsContact N-OD1 3.07Å
235	P	97.4	Very high	98.1	Very high	15 Å²	15	49.2 Å²	49.2	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-35.3	-177.2	26	-38.4	0	0	0	112.9	S233 A238 L239 L269 N289 A291	S233-P235 WeakPolarHBondContact OG-CD 3.49Å; S233-P235 WeakPolarHBondContact OG-CG 3.46Å; P235-A238 PolarHBondContact O-N 3.4Å; P235-L239 VanDerWaalsContact O-CB 3.26Å; P235-L239 WeakPolarHBondContact O-CB 3.37Å; P235-L239 PolarHBondContact O-N 3.16Å; P235-L269 HydrophobicContact CB-CD1 4.37Å; P235-N289 WeakPolarHBondContact CD-O 3.46Å; P235-A291 HydrophobicContact CB-CB 4.23Å
236	V	97.9	Very high	97.9	Very high	42 Å²	42	54.3 Å²	54.3	26%	0.255	27%	0.272	S	S	.	.	H	α-helix	trans	-63.6	-44.2	175.7	172.9	0	0	0	0	111.1	S233 R234 G240 L269 D271	S233-V236 WeakPolarHBondContact OG-CG2 2.96Å; R234-V236 VanDerWaalsContact C-N 3.32Å; R234-V236 PolarHBondContact O-N 2.85Å; V236-G240 PolarHBondContact O-N 3.15Å; V236-L269 HydrophobicContact CG2-CD1 4.22Å; V236-D271 HydrophobicContact CG2-CB 4.33Å
237	V	98.3	Very high	97.9	Very high	38 Å²	38	56.5 Å²	56.5	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-65.8	-42.5	176	171	0	0	0	0	111.5	P130 A232 S233 R234 G240 K241	P130-V237 HydrophobicContact CG-CG1 3.55Å; A232-V237 HydrophobicContact CB-CG2 3.7Å; S233-V237 WeakPolarHBondContact O-CG2 3.32Å; S233-V237 PolarHBondContact O-N 3.04Å; S233-V237 VanDerWaalsContact O-N 3.16Å; R234-V237 PolarHBondContact O-N 3.25Å; V237-G240 PolarHBondContact O-N 3.43Å; V237-K241 WeakPolarHBondContact O-CB 3.5Å; V237-K241 PolarHBondContact O-N 3.39Å
238	A	98.1	Very high	97.8	Very high	20 Å²	20	56.7 Å²	56.7	17%	0.165	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-48.8	177.3	0	0	0	0	0	111.9	P128 R234 P235 K241 A242	P128-A238 HydrophobicContact CB-CB 3.75Å; P128-A238 VanDerWaalsContact O-CA 3.28Å; P128-A238 WeakPolarHBondContact O-CA 3.34Å; P128-A238 WeakPolarHBondContact O-CB 3.45Å; R234-A238 PolarHBondContact O-N 2.75Å; P235-A238 PolarHBondContact O-N 3.4Å; A238-K241 PolarHBondContact O-N 3.2Å; A238-A242 WeakPolarHBondContact O-CB 3.44Å; A238-A242 PolarHBondContact O-N 3.34Å
239	L	97.6	Very high	97.6	Very high	48 Å²	48	52 Å²	52	25%	0.251	29%	0.292	S	S	.	.	H	α-helix	trans	-62.2	-43.3	178.2	-177.2	59.8	0	0	0	111.6	P235 T243 V262 N266 L269	P235-L239 VanDerWaalsContact O-CB 3.26Å; P235-L239 WeakPolarHBondContact O-CB 3.37Å; P235-L239 PolarHBondContact O-N 3.16Å; L239-T243 WeakPolarHBondContact O-CB 3.46Å; L239-T243 PolarHBondContact O-N 2.96Å; L239-T243 PolarHBondContact O-OG1 2.83Å; L239-V262 HydrophobicContact CD1-CG1 3.79Å; L239-V262 HydrophobicContact CD2-CG1 4.02Å; L239-V262 HydrophobicContact CG-CG1 3.65Å; L239-N266 HydrophobicContact CD2-CB 3.73Å; L239-L269 HydrophobicContact CD2-CD1 4.21Å
240	G	98.3	Very high	97.6	Very high	40 Å²	40	54.3 Å²	54.3	41%	0.412	30%	0.301	S	S	.	.	H	α-helix	trans	-60.7	-48.4	175.3	0	0	0	0	0	112.9	V236 V237 T243 F244	V236-G240 PolarHBondContact O-N 3.15Å; V237-G240 PolarHBondContact O-N 3.43Å; G240-T243 PolarHBondContact O-N 3.48Å; G240-F244 WeakPolarHBondContact O-CB 3.43Å; G240-F244 PolarHBondContact O-N 2.78Å
241	K	98.4	Very high	97.6	Very high	17 Å²	17	55.7 Å²	55.7	7%	0.074	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-53.1	178.9	172.4	170.3	168.7	165.1	0	112.3	I124 Q125 I127 V129 D151 V237 A238 T243 F244 H245	I124-K241 PolarHBondContact O-NZ 3.39Å; Q125-K241 WeakPolarHBondContact O-CE 3.32Å; I127-K241 VanDerWaalsContact O-CE 3.24Å; I127-K241 WeakPolarHBondContact O-CE 3.33Å; V129-K241 PolarHBondContact O-NZ 3.06Å; D151-K241 WeakPolarHBondContact OD1-CE 3.44Å; D151-K241 IonicContact OD1-NZ 3.21Å; D151-K241 PolarHBondContact OD1-NZ 3.42Å; D151-K241 IonicContact OD2-NZ 2.64Å; D151-K241 PolarHBondContact OD2-NZ 2.8Å; V237-K241 WeakPolarHBondContact O-CB 3.5Å; V237-K241 PolarHBondContact O-N 3.39Å; A238-K241 PolarHBondContact O-N 3.2Å; K241-T243 PolarHBondContact O-N 3.09Å; K241-F244 PolarHBondContact O-N 3.36Å; K241-H245 PolarHBondContact O-CD2 2.91Å; K241-H245 PolarHBondContact O-N 3.26Å; K241-H245 VanDerWaalsContact O-N 3.16Å
242	A	97.9	Very high	97.6	Very high	47 Å²	47	57.6 Å²	57.6	39%	0.388	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-36.1	-179.8	0	0	0	0	0	112	A238 R246	A238-A242 WeakPolarHBondContact O-CB 3.44Å; A238-A242 PolarHBondContact O-N 3.34Å; A242-R246 VanDerWaalsContact O-CB 3.31Å; A242-R246 WeakPolarHBondContact O-CB 3.42Å; A242-R246 PolarHBondContact O-N 3.36Å
243	T	98.2	Very high	97.6	Very high	13 Å²	13	61.2 Å²	61.2	8%	0.08	34%	0.336	C	S	.	.	H	α-helix	trans	-74.1	-39.8	178.8	-58.5	0	0	0	0	112.2	L239 G240 K241 R246 Q247 V262	L239-T243 WeakPolarHBondContact O-CB 3.46Å; L239-T243 PolarHBondContact O-N 2.96Å; L239-T243 PolarHBondContact O-OG1 2.83Å; G240-T243 PolarHBondContact O-N 3.48Å; K241-T243 PolarHBondContact O-N 3.09Å; T243-R246 PolarHBondContact O-N 2.84Å; T243-Q247 VanDerWaalsContact O-CG 3.28Å; T243-Q247 WeakPolarHBondContact O-CG 3.26Å; T243-Q247 PolarHBondContact O-N 3.39Å; T243-V262 HydrophobicContact CG2-CB 3.94Å; T243-V262 HydrophobicContact CG2-CG1 3.92Å; T243-V262 HydrophobicContact CG2-CG2 3.85Å; T243-V262 WeakPolarHBondContact OG1-CG1 3.38Å; T243-V262 WeakPolarHBondContact OG1-CG2 3.49Å
244	F	98.3	Very high	97.6	Very high	112 Å²	112	63.5 Å²	63.5	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-57.8	-53.8	176.1	179.4	-94.9	0	0	0	111.3	G240 K241 R246 Q247 M248	G240-F244 WeakPolarHBondContact O-CB 3.43Å; G240-F244 PolarHBondContact O-N 2.78Å; K241-F244 PolarHBondContact O-N 3.36Å; F244-R246 VanDerWaalsContact C-N 3.31Å; F244-R246 PolarHBondContact O-N 3.46Å; F244-Q247 WeakPolarHBondContact O-CG 3.28Å; F244-Q247 PolarHBondContact O-N 3.15Å; F244-Q247 PolarHBondContact O-NE2 2.96Å; F244-M248 HydrophobicContact CD1-CG 4.3Å; F244-M248 HydrophobicContact CE1-CG 3.89Å; F244-M248 HydrophobicContact CE2-CG 4.23Å; F244-M248 HydrophobicContact CE2-SD 4.19Å; F244-M248 HydrophobicContact CZ-CG 3.85Å; F244-M248 HydrophobicContact CZ-SD 4.02Å; F244-M248 VanDerWaalsContact O-CG 3.32Å; F244-M248 WeakPolarHBondContact O-CG 3.18Å; F244-M248 PolarHBondContact O-N 3.35Å; F244-M248 VanDerWaalsContact O-N 3.13Å
245	H	96.4	Very high	97.7	Very high	53 Å²	53	62.7 Å²	62.7	25%	0.245	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-38.7	179.3	-72	-53.9	0	0	0	111.9	Q125 D151 K241	Q125-H245 PolarHBondContact O-CD2 3.11Å; Q125-H245 VanDerWaalsContact O-CD2 3.3Å; D151-H245 IonicContact OD1-CE1 3.68Å; D151-H245 IonicContact OD1-NE2 2.72Å; D151-H245 PolarHBondContact OD1-NE2 3.26Å; D151-H245 VanDerWaalsContact OD1-NE2 3.11Å; K241-H245 PolarHBondContact O-CD2 2.91Å; K241-H245 PolarHBondContact O-N 3.26Å; K241-H245 VanDerWaalsContact O-N 3.16Å
246	R	96	Very high	97.7	Very high	143 Å²	143	69.6 Å²	69.6	54%	0.54	38%	0.379	S	S	.	.	H	α-helix	trans	-63.7	-47.2	176	-177.4	179.6	-66.3	169	-0.2	113.2	A242 T243 F244 A249 T258	A242-R246 VanDerWaalsContact O-CB 3.31Å; A242-R246 WeakPolarHBondContact O-CB 3.42Å; A242-R246 PolarHBondContact O-N 3.36Å; T243-R246 PolarHBondContact O-N 2.84Å; F244-R246 VanDerWaalsContact C-N 3.31Å; F244-R246 PolarHBondContact O-N 3.46Å; R246-A249 PolarHBondContact O-N 3.21Å; R246-T258 HydrophobicContact CG-CG2 4.37Å
247	Q	97.4	Very high	97.7	Very high	45 Å²	45	70.6 Å²	70.6	21%	0.21	39%	0.393	C	S	.	.	H	α-helix	trans	-72.6	-30.4	-175.4	69.4	72.2	32	0	0	112.5	T243 F244 A249 Q250 A255	T243-Q247 VanDerWaalsContact O-CG 3.28Å; T243-Q247 WeakPolarHBondContact O-CG 3.26Å; T243-Q247 PolarHBondContact O-N 3.39Å; F244-Q247 WeakPolarHBondContact O-CG 3.28Å; F244-Q247 PolarHBondContact O-N 3.15Å; F244-Q247 PolarHBondContact O-NE2 2.96Å; Q247-A249 PolarHBondContact O-N 2.99Å; Q247-A249 VanDerWaalsContact O-N 3.08Å; Q247-Q250 WeakPolarHBondContact O-CB 3.48Å; Q247-Q250 PolarHBondContact O-N 3Å; Q247-A255 HydrophobicContact CB-CB 4.05Å
248	M	96.8	Very high	97.7	Very high	121 Å²	121	69.4 Å²	69.4	60%	0.596	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-19.7	176.7	-75.2	-56	-63	0	0	113.8	F244	F244-M248 HydrophobicContact CD1-CG 4.3Å; F244-M248 HydrophobicContact CE1-CG 3.89Å; F244-M248 HydrophobicContact CE2-CG 4.23Å; F244-M248 HydrophobicContact CE2-SD 4.19Å; F244-M248 HydrophobicContact CZ-CG 3.85Å; F244-M248 HydrophobicContact CZ-SD 4.02Å; F244-M248 VanDerWaalsContact O-CG 3.32Å; F244-M248 WeakPolarHBondContact O-CG 3.18Å; F244-M248 PolarHBondContact O-N 3.35Å; F244-M248 VanDerWaalsContact O-N 3.13Å
249	A	94.6	Very high	97.7	Very high	95 Å²	95	70 Å²	70	79%	0.785	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	0.8	176.1	0	0	0	0	0	114	R246 Q247	R246-A249 PolarHBondContact O-N 3.21Å; Q247-A249 PolarHBondContact O-N 2.99Å; Q247-A249 VanDerWaalsContact O-N 3.08Å
250	Q	97.8	Very high	97.7	Very high	69 Å²	69	70.9 Å²	70.9	32%	0.322	40%	0.4	S	S	.	.	S	Bend	trans	-109.2	157.2	-172.1	-63.9	175.7	-24.3	0	0	112.5	Q247 A254 A255 T258	Q247-Q250 WeakPolarHBondContact O-CB 3.48Å; Q247-Q250 PolarHBondContact O-N 3Å; Q250-A254 HydrophobicContact CB-CB 4.29Å; Q250-A254 PolarHBondContact OE1-O 3.38Å; Q250-A255 HydrophobicContact CB-CB 4.2Å; Q250-A255 VanDerWaalsContact OE1-CA 3.3Å; Q250-T258 PolarHBondContact NE2-OG1 2.71Å; Q250-T258 PolarHBondContact OE1-OG1 3.2Å
251	G	98.1	Very high	97.7	Very high	54 Å²	54	76 Å²	76	56%	0.557	41%	0.407	S	S	*	.			trans	-68.5	149.5	164.5	0	0	0	0	0	111.2	D253 A254 A255	G251-D253 VanDerWaalsContact C-N 3.31Å; G251-D253 PolarHBondContact O-N 3.32Å; G251-A254 PolarHBondContact O-N 3.31Å; G251-A255 PolarHBondContact O-N 3.05Å
252	R	98.3	Very high	97.7	Very high	177 Å²	177	76 Å²	76	67%	0.668	41%	0.408	S	S	*	.	H	α-helix	trans	-40.6	-50.9	-171.2	-174	-167.1	67.5	-166.1	-5.5	114.6	A255 Y256	R252-A255 WeakPolarHBondContact O-CB 3.38Å; R252-A255 PolarHBondContact O-N 3.5Å; R252-Y256 HydrophobicContact CG-CD2 3.9Å; R252-Y256 HydrophobicContact CG-CE2 3.75Å; R252-Y256 VanDerWaalsContact O-CD2 3.31Å; R252-Y256 WeakPolarHBondContact O-CD2 3.48Å; R252-Y256 PolarHBondContact O-N 3.19Å
253	D	98.4	Very high	97.7	Very high	106 Å²	106	80.1 Å²	80.1	57%	0.567	42%	0.421	S	S	*	.	H	α-helix	trans	-73.7	-34	-171.3	-56.4	-14	0	0	0	111.5	G251 A257	G251-D253 VanDerWaalsContact C-N 3.31Å; G251-D253 PolarHBondContact O-N 3.32Å; D253-A257 WeakPolarHBondContact O-CB 3.48Å; D253-A257 PolarHBondContact O-N 3.48Å
254	A	98.3	Very high	97.6	Very high	50 Å²	50	84.1 Å²	84.1	41%	0.413	45%	0.446	S	S	.	.	H	α-helix	trans	-72	-33.6	171.5	0	0	0	0	0	112.5	Q250 G251 A257 T258	Q250-A254 HydrophobicContact CB-CB 4.29Å; Q250-A254 PolarHBondContact OE1-O 3.38Å; G251-A254 PolarHBondContact O-N 3.31Å; A254-A257 PolarHBondContact O-N 3.45Å; A254-T258 WeakPolarHBondContact O-CB 3.35Å; A254-T258 PolarHBondContact O-N 2.89Å; A254-T258 PolarHBondContact O-OG1 3.49Å
255	A	98.4	Very high	97.4	Very high	11 Å²	11	82.7 Å²	82.7	9%	0.091	44%	0.443	C	S	.	.	H	α-helix	trans	-62.3	-47.7	172.8	0	0	0	0	0	111.3	Q247 Q250 G251 R252 T258 A259	Q247-A255 HydrophobicContact CB-CB 4.05Å; Q250-A255 HydrophobicContact CB-CB 4.2Å; Q250-A255 VanDerWaalsContact OE1-CA 3.3Å; G251-A255 PolarHBondContact O-N 3.05Å; R252-A255 WeakPolarHBondContact O-CB 3.38Å; R252-A255 PolarHBondContact O-N 3.5Å; A255-T258 PolarHBondContact O-N 3.38Å; A255-A259 WeakPolarHBondContact O-CB 3.47Å; A255-A259 PolarHBondContact O-N 3.3Å
256	Y	98.5	Very high	97.5	Very high	160 Å²	160	82 Å²	82	63%	0.627	44%	0.441	S	S	*	.	H	α-helix	trans	-63.2	-44.8	174.1	-81.3	-64.6	0	0	0	112.6	R252 T258 A259 S260	R252-Y256 HydrophobicContact CG-CD2 3.9Å; R252-Y256 HydrophobicContact CG-CE2 3.75Å; R252-Y256 VanDerWaalsContact O-CD2 3.31Å; R252-Y256 WeakPolarHBondContact O-CD2 3.48Å; R252-Y256 PolarHBondContact O-N 3.19Å; Y256-T258 VanDerWaalsContact C-N 3.29Å; Y256-T258 PolarHBondContact O-N 3.05Å; Y256-A259 PolarHBondContact O-N 3.44Å; Y256-S260 WeakPolarHBondContact O-CB 3.27Å; Y256-S260 PolarHBondContact O-N 3.06Å; Y256-S260 PolarHBondContact O-OG 3.25Å; Y256-S260 VanDerWaalsContact O-OG 3.06Å
257	A	98.3	Very high	97.5	Very high	64 Å²	64	79 Å²	79	53%	0.529	44%	0.436	S	S	.	.	H	α-helix	trans	-58.7	-40.9	176.1	0	0	0	0	0	112.4	D253 A254 R261	D253-A257 WeakPolarHBondContact O-CB 3.48Å; D253-A257 PolarHBondContact O-N 3.48Å; A254-A257 PolarHBondContact O-N 3.45Å; A257-R261 PolarHBondContact O-N 3.01Å
258	T	97.9	Very high	97.3	Very high	13 Å²	13	79 Å²	79	8%	0.08	44%	0.443	C	S	.	.	H	α-helix	trans	-65.2	-49.7	175.8	-62.1	0	0	0	0	111.4	R246 Q250 A254 A255 Y256 V262	R246-T258 HydrophobicContact CG-CG2 4.37Å; Q250-T258 PolarHBondContact NE2-OG1 2.71Å; Q250-T258 PolarHBondContact OE1-OG1 3.2Å; A254-T258 WeakPolarHBondContact O-CB 3.35Å; A254-T258 PolarHBondContact O-N 2.89Å; A254-T258 PolarHBondContact O-OG1 3.49Å; A255-T258 PolarHBondContact O-N 3.38Å; Y256-T258 VanDerWaalsContact C-N 3.29Å; Y256-T258 PolarHBondContact O-N 3.05Å; T258-V262 WeakPolarHBondContact O-CG2 3.38Å; T258-V262 PolarHBondContact O-N 2.8Å
259	A	98.2	Very high	97.3	Very high	31 Å²	31	74.3 Å²	74.3	26%	0.256	42%	0.42	S	S	.	.	H	α-helix	trans	-66.2	-44.2	-177.3	0	0	0	0	0	112.6	A255 Y256 R261 V262 M263	A255-A259 WeakPolarHBondContact O-CB 3.47Å; A255-A259 PolarHBondContact O-N 3.3Å; Y256-A259 PolarHBondContact O-N 3.44Å; A259-R261 PolarHBondContact O-N 2.88Å; A259-V262 PolarHBondContact O-N 3.03Å; A259-M263 WeakPolarHBondContact O-CG 3.26Å; A259-M263 PolarHBondContact O-N 3.38Å
260	S	98.2	Very high	97.4	Very high	67 Å²	67	73.2 Å²	73.2	47%	0.469	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-41	179.9	-63	0	0	0	0	112.4	Y256 M263 V264	Y256-S260 WeakPolarHBondContact O-CB 3.27Å; Y256-S260 PolarHBondContact O-N 3.06Å; Y256-S260 PolarHBondContact O-OG 3.25Å; Y256-S260 VanDerWaalsContact O-OG 3.06Å; S260-M263 PolarHBondContact O-N 3.04Å; S260-V264 PolarHBondContact O-N 2.98Å
261	R	97.7	Very high	97.4	Very high	147 Å²	147	70 Å²	70	56%	0.555	38%	0.381	S	S	*	.	H	α-helix	trans	-60.7	-47.4	173	-179.4	179	60.4	-168.7	-7.2	111.2	A257 A259 M263 V264 D265	A257-R261 PolarHBondContact O-N 3.01Å; A259-R261 PolarHBondContact O-N 2.88Å; R261-M263 VanDerWaalsContact C-N 3.27Å; R261-M263 PolarHBondContact O-N 3.39Å; R261-V264 WeakPolarHBondContact O-CA 3.49Å; R261-V264 WeakPolarHBondContact O-CB 3.41Å; R261-V264 PolarHBondContact O-N 3.42Å; R261-D265 PolarHBondContact O-N 2.92Å
262	V	97.4	Very high	97.3	Very high	17 Å²	17	67.9 Å²	67.9	10%	0.103	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-35.1	177.7	165.2	0	0	0	0	112.3	L239 T243 T258 A259 V264 D265 N266	L239-V262 HydrophobicContact CD1-CG1 3.79Å; L239-V262 HydrophobicContact CD2-CG1 4.02Å; L239-V262 HydrophobicContact CG-CG1 3.65Å; T243-V262 HydrophobicContact CG2-CB 3.94Å; T243-V262 HydrophobicContact CG2-CG1 3.92Å; T243-V262 HydrophobicContact CG2-CG2 3.85Å; T243-V262 WeakPolarHBondContact OG1-CG1 3.38Å; T243-V262 WeakPolarHBondContact OG1-CG2 3.49Å; T258-V262 WeakPolarHBondContact O-CG2 3.38Å; T258-V262 PolarHBondContact O-N 2.8Å; A259-V262 PolarHBondContact O-N 3.03Å; V262-V264 VanDerWaalsContact C-N 3.31Å; V262-V264 PolarHBondContact O-N 3.07Å; V262-D265 PolarHBondContact O-N 2.8Å; V262-N266 WeakPolarHBondContact O-CB 2.96Å; V262-N266 PolarHBondContact O-N 3.33Å
263	M	98	Very high	97.3	Very high	134 Å²	134	62.8 Å²	62.8	66%	0.66	34%	0.343	S	S	*	.	H	α-helix	trans	-62.6	-39.2	173.9	-74.2	-171.3	70	0	0	111.8	A259 S260 R261 N266 L267	A259-M263 WeakPolarHBondContact O-CG 3.26Å; A259-M263 PolarHBondContact O-N 3.38Å; S260-M263 PolarHBondContact O-N 3.04Å; R261-M263 VanDerWaalsContact C-N 3.27Å; R261-M263 PolarHBondContact O-N 3.39Å; M263-N266 PolarHBondContact O-N 2.93Å; M263-L267 WeakPolarHBondContact O-CG 3.22Å; M263-L267 PolarHBondContact O-N 2.85Å
264	V	97.3	Very high	97.3	Very high	98 Å²	98	59.2 Å²	59.2	59%	0.594	32%	0.322	S	S	*	.	H	α-helix	trans	-65.2	-43.9	173	178.2	0	0	0	0	111	S260 R261 V262 N266 L267 A268	S260-V264 PolarHBondContact O-N 2.98Å; R261-V264 WeakPolarHBondContact O-CA 3.49Å; R261-V264 WeakPolarHBondContact O-CB 3.41Å; R261-V264 PolarHBondContact O-N 3.42Å; V262-V264 VanDerWaalsContact C-N 3.31Å; V262-V264 PolarHBondContact O-N 3.07Å; V264-N266 VanDerWaalsContact C-N 3.3Å; V264-N266 PolarHBondContact O-N 3.1Å; V264-L267 WeakPolarHBondContact O-CB 3.47Å; V264-L267 PolarHBondContact O-N 3.34Å; V264-L267 VanDerWaalsContact O-N 3.15Å; V264-A268 PolarHBondContact O-N 2.56Å
265	D	94.2	Very high	97.3	Very high	81 Å²	81	57.9 Å²	57.9	43%	0.433	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-39.2	175.7	-61.1	-36.2	0	0	0	111.7	R261 V262 A268	R261-D265 PolarHBondContact O-N 2.92Å; V262-D265 PolarHBondContact O-N 2.8Å; D265-A268 WeakPolarHBondContact O-CB 3.24Å; D265-A268 PolarHBondContact O-N 3.08Å; D265-A268 VanDerWaalsContact O-N 3.16Å
266	N	96.9	Very high	97.3	Very high	38 Å²	38	60.6 Å²	60.6	20%	0.203	33%	0.326	C	S	.	.	H	α-helix	trans	-66.4	-35.5	176	-167.4	104	0	0	0	112.2	L239 V262 M263 V264 A268 L269	L239-N266 HydrophobicContact CD2-CB 3.73Å; V262-N266 WeakPolarHBondContact O-CB 2.96Å; V262-N266 PolarHBondContact O-N 3.33Å; M263-N266 PolarHBondContact O-N 2.93Å; V264-N266 VanDerWaalsContact C-N 3.3Å; V264-N266 PolarHBondContact O-N 3.1Å; N266-A268 PolarHBondContact O-N 2.88Å; N266-L269 WeakPolarHBondContact O-CB 3.21Å; N266-L269 PolarHBondContact O-N 3.5Å
267	L	96.3	Very high	97.2	Very high	82 Å²	82	59.6 Å²	59.6	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-66.8	-25.2	173.8	-70.9	172.3	0	0	0	112.2	M263 V264 L269 Q273 I276	M263-L267 WeakPolarHBondContact O-CG 3.22Å; M263-L267 PolarHBondContact O-N 2.85Å; V264-L267 WeakPolarHBondContact O-CB 3.47Å; V264-L267 PolarHBondContact O-N 3.34Å; V264-L267 VanDerWaalsContact O-N 3.15Å; L267-L269 VanDerWaalsContact C-N 3.3Å; L267-Q273 WeakPolarHBondContact O-CG 3.41Å; L267-Q273 PolarHBondContact O-NE2 2.88Å; L267-I276 HydrophobicContact CD2-CD1 3.39Å
268	A	94.6	Very high	97.2	Very high	45 Å²	45	56.6 Å²	56.6	37%	0.372	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-15.1	175.2	0	0	0	0	0	113.4	V264 D265 N266 K293 A294	V264-A268 PolarHBondContact O-N 2.56Å; D265-A268 WeakPolarHBondContact O-CB 3.24Å; D265-A268 PolarHBondContact O-N 3.08Å; D265-A268 VanDerWaalsContact O-N 3.16Å; N266-A268 PolarHBondContact O-N 2.88Å; A268-K293 CarbonylContact O-C 3.4Å; A268-K293 WeakPolarHBondContact O-CA 3.32Å; A268-K293 WeakPolarHBondContact O-CB 3.21Å; A268-A294 PolarHBondContact O-N 2.88Å
269	L	96	Very high	97.2	Very high	22 Å²	22	64.3 Å²	64.3	12%	0.115	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-71.7	142.6	177.8	-63.5	176.2	0	0	0	112	P235 V236 L239 N266 L267 D271 G272 Q273 E292	P235-L269 HydrophobicContact CB-CD1 4.37Å; V236-L269 HydrophobicContact CG2-CD1 4.22Å; L239-L269 HydrophobicContact CD2-CD1 4.21Å; N266-L269 WeakPolarHBondContact O-CB 3.21Å; N266-L269 PolarHBondContact O-N 3.5Å; L267-L269 VanDerWaalsContact C-N 3.3Å; L269-D271 VanDerWaalsContact C-N 3.35Å; L269-D271 PolarHBondContact O-N 3.23Å; L269-G272 WeakPolarHBondContact O-CA 3.38Å; L269-G272 PolarHBondContact O-N 3.23Å; L269-Q273 PolarHBondContact O-N 2.69Å; L269-E292 WeakPolarHBondContact CA-O 3.44Å
270	R	96.5	Very high	97.3	Very high	72 Å²	72	68.7 Å²	68.7	27%	0.272	35%	0.347	S	S	.	.	H	α-helix	trans	-55.2	-48	173.6	-175.1	179.8	-69.6	-111.3	-0	111.6	G272 Q273 E274 T288 E292 E297	R270-G272 VanDerWaalsContact C-N 3.28Å; R270-G272 PolarHBondContact O-N 2.73Å; R270-Q273 PolarHBondContact O-N 2.99Å; R270-E274 WeakPolarHBondContact O-CB 3.19Å; R270-E274 PolarHBondContact O-N 2.8Å; R270-T288 HydrophobicContact CG-CG2 4.3Å; R270-E292 HydrophobicContact CB-CB 4.33Å; R270-E292 PolarHBondContact N-O 3.1Å; R270-E292 IonicContact NE-OE2 3.55Å; R270-E297 IonicContact CZ-OE1 3.18Å; R270-E297 IonicContact NH1-OE1 2.72Å; R270-E297 PolarHBondContact NH1-OE1 3.15Å; R270-E297 IonicContact NH2-OE1 2.73Å; R270-E297 PolarHBondContact NH2-OE1 3.41Å
271	D	97.5	Very high	97.3	Very high	2 Å²	2	70.6 Å²	70.6	1%	0.011	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-29.1	174.5	-84.2	-8.8	0	0	0	112.9	S233 V236 L269 G275 W287 T288 N289	S233-D271 WeakPolarHBondContact CB-OD2 3.4Å; S233-D271 VanDerWaalsContact OG-CB 3.24Å; S233-D271 WeakPolarHBondContact OG-CB 3.4Å; S233-D271 VanDerWaalsContact OG-CG 3.27Å; S233-D271 PolarHBondContact OG-OD2 3.49Å; V236-D271 HydrophobicContact CG2-CB 4.33Å; L269-D271 VanDerWaalsContact C-N 3.35Å; L269-D271 PolarHBondContact O-N 3.23Å; D271-G275 PolarHBondContact O-N 2.91Å; D271-W287 HydrophobicContact CB-CE3 4.13Å; D271-W287 VanDerWaalsContact O-CZ3 3.27Å; D271-W287 WeakPolarHBondContact O-CZ3 3.43Å; D271-W287 VanDerWaalsContact OD1-CA 3.24Å; D271-W287 WeakPolarHBondContact OD1-CA 3.26Å; D271-T288 PolarHBondContact OD1-N 3.24Å; D271-N289 WeakPolarHBondContact OD2-CA 3.38Å; D271-N289 PolarHBondContact OD2-N 3Å; D271-N289 VanDerWaalsContact OD2-N 3.08Å
272	G	97.3	Very high	97.3	Very high	9 Å²	9	73.1 Å²	73.1	9%	0.093	36%	0.363	C	S	.	.	H	α-helix	trans	-65.5	-48	174.3	0	0	0	0	0	111.8	L269 R270 G275 I276	L269-G272 WeakPolarHBondContact O-CA 3.38Å; L269-G272 PolarHBondContact O-N 3.23Å; R270-G272 VanDerWaalsContact C-N 3.28Å; R270-G272 PolarHBondContact O-N 2.73Å; G272-G275 PolarHBondContact O-N 3.25Å; G272-I276 WeakPolarHBondContact O-CG1 3.42Å; G272-I276 PolarHBondContact O-N 3.26Å
273	Q	97.9	Very high	97.3	Very high	70 Å²	70	76.8 Å²	76.8	33%	0.327	38%	0.375	S	S	.	.	H	α-helix	trans	-68	-39.2	176.6	-69.8	-59.5	-38.7	0	0	112.9	L267 L269 R270 G275 I276 R277 A294	L267-Q273 WeakPolarHBondContact O-CG 3.41Å; L267-Q273 PolarHBondContact O-NE2 2.88Å; L269-Q273 PolarHBondContact O-N 2.69Å; R270-Q273 PolarHBondContact O-N 2.99Å; Q273-G275 VanDerWaalsContact C-N 3.34Å; Q273-G275 PolarHBondContact O-N 3.25Å; Q273-I276 PolarHBondContact O-N 2.93Å; Q273-R277 VanDerWaalsContact O-CB 3.26Å; Q273-R277 WeakPolarHBondContact O-CB 3.49Å; Q273-R277 PolarHBondContact O-N 2.69Å; Q273-A294 HydrophobicContact CB-CB 4.27Å; Q273-A294 HydrophobicContact CG-CB 3.72Å
274	E	97.9	Very high	97.3	Very high	30 Å²	30	79.2 Å²	79.2	14%	0.14	38%	0.382	C	S	.	.	H	α-helix	trans	-62.1	-39.9	175.1	166.4	55.8	-174	0	0	112.1	R270 I276 R277 A278 R283 P285 V286 W287	R270-E274 WeakPolarHBondContact O-CB 3.19Å; R270-E274 PolarHBondContact O-N 2.8Å; E274-I276 PolarHBondContact O-N 3.05Å; E274-R277 PolarHBondContact O-N 2.87Å; E274-A278 VanDerWaalsContact O-CB 3.22Å; E274-A278 WeakPolarHBondContact O-CB 3.13Å; E274-A278 PolarHBondContact O-N 3.47Å; E274-R283 IonicContact OE1-CZ 3.91Å; E274-R283 IonicContact OE1-NH1 2.88Å; E274-R283 PolarHBondContact OE1-NH1 3.33Å; E274-R283 IonicContact OE1-NH2 3.13Å; E274-R283 IonicContact OE2-CZ 3.11Å; E274-R283 IonicContact OE2-NH1 3.41Å; E274-R283 PolarHBondContact OE2-NH1 2.81Å; E274-R283 IonicContact OE2-NH2 3.97Å; E274-R283 PolarHBondContact OE2-NH2 2.86Å; E274-P285 HydrophobicContact CG-CB 4.26Å; E274-P285 VanDerWaalsContact OE1-CA 3.26Å; E274-P285 WeakPolarHBondContact OE1-CA 3.22Å; E274-V286 PolarHBondContact OE1-N 2.84Å; E274-W287 HydrophobicContact CG-CE3 4.23Å; E274-W287 HydrophobicContact CG-CZ3 4.3Å
275	G	97.6	Very high	97.3	Very high	22 Å²	22	76.9 Å²	76.9	23%	0.227	37%	0.369	C	S	.	.	H	α-helix	trans	-62.7	-43.2	176.9	0	0	0	0	0	112.8	D271 G272 Q273 F279	D271-G275 PolarHBondContact O-N 2.91Å; G272-G275 PolarHBondContact O-N 3.25Å; Q273-G275 VanDerWaalsContact C-N 3.34Å; Q273-G275 PolarHBondContact O-N 3.25Å; G275-F279 WeakPolarHBondContact O-CB 3.49Å; G275-F279 PolarHBondContact O-N 2.68Å
276	I	98.1	Very high	97.4	Very high	69 Å²	69	78.3 Å²	78.3	35%	0.354	38%	0.381	S	S	.	.	H	α-helix	trans	-65.4	-47.2	175.9	-66.6	166.9	0	0	0	110.6	L267 G272 Q273 E274 F279 I280	L267-I276 HydrophobicContact CD2-CD1 3.39Å; G272-I276 WeakPolarHBondContact O-CG1 3.42Å; G272-I276 PolarHBondContact O-N 3.26Å; Q273-I276 PolarHBondContact O-N 2.93Å; E274-I276 PolarHBondContact O-N 3.05Å; I276-F279 PolarHBondContact O-N 2.85Å; I276-I280 HydrophobicContact CG2-CD1 3.82Å; I276-I280 WeakPolarHBondContact O-CG1 3.45Å; I276-I280 PolarHBondContact O-N 2.93Å
277	R	98.1	Very high	97.5	Very high	139 Å²	139	79.7 Å²	79.7	53%	0.525	38%	0.383	S	S	.	.	H	α-helix	trans	-60.5	-50.2	180	-171.2	-174.1	-52.9	-156.1	4.8	111.6	Q273 E274 F279 I280 E281	Q273-R277 VanDerWaalsContact O-CB 3.26Å; Q273-R277 WeakPolarHBondContact O-CB 3.49Å; Q273-R277 PolarHBondContact O-N 2.69Å; E274-R277 PolarHBondContact O-N 2.87Å; R277-F279 VanDerWaalsContact C-N 3.27Å; R277-F279 PolarHBondContact O-N 2.79Å; R277-I280 PolarHBondContact O-N 2.77Å; R277-E281 WeakPolarHBondContact CD-OE1 3.34Å; R277-E281 VanDerWaalsContact CG-CD 3.45Å; R277-E281 HydrophobicContact CG-CG 4.35Å; R277-E281 WeakPolarHBondContact CG-OE1 3.37Å; R277-E281 WeakPolarHBondContact O-CB 3.48Å; R277-E281 WeakPolarHBondContact O-CG 3.17Å; R277-E281 PolarHBondContact O-N 3.34Å
278	A	98.3	Very high	97.4	Very high	1 Å²	1	78.4 Å²	78.4	1%	0.008	38%	0.378	C	S	.	.	H	α-helix	trans	-60	-36.6	178.7	0	0	0	0	0	112.7	E274 K282 R283 P285	E274-A278 VanDerWaalsContact O-CB 3.22Å; E274-A278 WeakPolarHBondContact O-CB 3.13Å; E274-A278 PolarHBondContact O-N 3.47Å; A278-K282 PolarHBondContact O-N 3.47Å; A278-R283 HydrophobicContact CB-CG 4.05Å; A278-R283 PolarHBondContact O-N 2.84Å; A278-P285 HydrophobicContact CB-CB 3.72Å; A278-P285 HydrophobicContact CB-CG 4.47Å
279	F	98.3	Very high	97.4	Very high	175 Å²	175	77.7 Å²	77.7	77%	0.768	37%	0.369	S	S	*	.	H	α-helix	trans	-65.3	-47.7	174.5	178.2	-96.5	0	0	0	112.2	G275 I276 R277 E281 K282	G275-F279 WeakPolarHBondContact O-CB 3.49Å; G275-F279 PolarHBondContact O-N 2.68Å; I276-F279 PolarHBondContact O-N 2.85Å; R277-F279 VanDerWaalsContact C-N 3.27Å; R277-F279 PolarHBondContact O-N 2.79Å; F279-E281 PolarHBondContact O-N 2.79Å; F279-K282 PolarHBondContact O-N 3.12Å
280	I	98.5	Very high	97.2	Very high	123 Å²	123	81.4 Å²	81.4	63%	0.631	38%	0.384	S	S	*	.	H	α-helix	trans	-61.8	-43.9	177.2	-66.9	167.4	0	0	0	110.8	I276 R277 K282	I276-I280 HydrophobicContact CG2-CD1 3.82Å; I276-I280 WeakPolarHBondContact O-CG1 3.45Å; I276-I280 PolarHBondContact O-N 2.93Å; R277-I280 PolarHBondContact O-N 2.77Å; I280-K282 PolarHBondContact O-N 2.87Å
281	E	98.3	Very high	96.7	Very high	106 Å²	106	82 Å²	82	50%	0.495	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-0.6	179.5	-67.6	170.2	179.3	0	0	113.6	R277 F279 R283	R277-E281 WeakPolarHBondContact CD-OE1 3.34Å; R277-E281 VanDerWaalsContact CG-CD 3.45Å; R277-E281 HydrophobicContact CG-CG 4.35Å; R277-E281 WeakPolarHBondContact CG-OE1 3.37Å; R277-E281 WeakPolarHBondContact O-CB 3.48Å; R277-E281 WeakPolarHBondContact O-CG 3.17Å; R277-E281 PolarHBondContact O-N 3.34Å; F279-E281 PolarHBondContact O-N 2.79Å; E281-R283 VanDerWaalsContact C-N 3.26Å; E281-R283 HydrophobicContact CB-CG 4.12Å; E281-R283 PolarHBondContact O-N 3.3Å; E281-R283 IonicContact OE2-CZ 2.79Å; E281-R283 VanDerWaalsContact OE2-CZ 3.3Å; E281-R283 IonicContact OE2-NE 3.55Å; E281-R283 PolarHBondContact OE2-NE 3.5Å; E281-R283 IonicContact OE2-NH2 2.68Å; E281-R283 PolarHBondContact OE2-NH2 3.28Å
282	K	97.9	Very high	96.4	Very high	200 Å²	200	85 Å²	85	87%	0.87	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	34.2	-179.4	-57.8	179.8	-178.6	175.5	0	114.6	A278 F279 I280	A278-K282 PolarHBondContact O-N 3.47Å; F279-K282 PolarHBondContact O-N 3.12Å; I280-K282 PolarHBondContact O-N 2.87Å
283	R	98.4	Very high	95.9	Very high	95 Å²	95	90 Å²	90	36%	0.358	44%	0.437	S	S	.	.	S	Bend	trans	-113.5	171.6	176.4	63.5	173.8	177.1	78.3	5.3	111.7	E274 A278 E281	E274-R283 IonicContact OE1-CZ 3.91Å; E274-R283 IonicContact OE1-NH1 2.88Å; E274-R283 PolarHBondContact OE1-NH1 3.33Å; E274-R283 IonicContact OE1-NH2 3.13Å; E274-R283 IonicContact OE2-CZ 3.11Å; E274-R283 IonicContact OE2-NH1 3.41Å; E274-R283 PolarHBondContact OE2-NH1 2.81Å; E274-R283 IonicContact OE2-NH2 3.97Å; E274-R283 PolarHBondContact OE2-NH2 2.86Å; A278-R283 HydrophobicContact CB-CG 4.05Å; A278-R283 PolarHBondContact O-N 2.84Å; E281-R283 VanDerWaalsContact C-N 3.26Å; E281-R283 HydrophobicContact CB-CG 4.12Å; E281-R283 PolarHBondContact O-N 3.3Å; E281-R283 IonicContact OE2-CZ 2.79Å; E281-R283 VanDerWaalsContact OE2-CZ 3.3Å; E281-R283 IonicContact OE2-NE 3.55Å; E281-R283 PolarHBondContact OE2-NE 3.5Å; E281-R283 IonicContact OE2-NH2 2.68Å; E281-R283 PolarHBondContact OE2-NH2 3.28Å
284	K	97.1	Very high	95	Very high	185 Å²	185	88.2 Å²	88.2	80%	0.804	44%	0.435	S	S	*	.			trans	-74.5	138.8	168.7	-68.3	-177.8	-179.3	176.5	0	109.6
285	P	97.5	Very high	93.7	Very high	48 Å²	48	93.8 Å²	93.8	31%	0.312	47%	0.466	S	S	.	.			trans	-72.6	152	172.4	29.3	-33.7	0	0	0	111.6	E274 A278 W287	E274-P285 HydrophobicContact CG-CB 4.26Å; E274-P285 VanDerWaalsContact OE1-CA 3.26Å; E274-P285 WeakPolarHBondContact OE1-CA 3.22Å; A278-P285 HydrophobicContact CB-CB 3.72Å; A278-P285 HydrophobicContact CB-CG 4.47Å; P285-W287 HydrophobicContact CB-CD2 4.15Å; P285-W287 HydrophobicContact CB-CE3 3.96Å; P285-W287 HydrophobicContact CB-CH2 3.42Å; P285-W287 VanDerWaalsContact CB-CH2 3.42Å; P285-W287 HydrophobicContact CB-CZ2 3.6Å; P285-W287 HydrophobicContact CB-CZ3 3.59Å; P285-W287 HydrophobicContact CG-CD2 4.43Å; P285-W287 HydrophobicContact CG-CH2 3.47Å; P285-W287 VanDerWaalsContact CG-CH2 3.47Å; P285-W287 HydrophobicContact CG-CZ2 3.2Å; P285-W287 HydrophobicContact CG-CZ3 4.17Å
286	V	97.5	Very high	91.9	Very high	112 Å²	112	98 Å²	98	68%	0.679	48%	0.483	S	S	*	.			trans	-121.1	94.9	176.7	-177.3	0	0	0	0	108.9	E274	E274-V286 PolarHBondContact OE1-N 2.84Å
287	W	97.3	Very high	89.4	Confident	66 Å²	66	104.7 Å²	104.7	25%	0.25	51%	0.512	C	S	.	.			trans	-73.5	136.5	-175.1	-45.3	125.6	0	0	0	112.9	Q231 A232 D271 E274 P285 N289	Q231-W287 PolarHBondContact O-NE1 2.92Å; A232-W287 VanDerWaalsContact O-CD1 3.26Å; D271-W287 HydrophobicContact CB-CE3 4.13Å; D271-W287 VanDerWaalsContact O-CZ3 3.27Å; D271-W287 WeakPolarHBondContact O-CZ3 3.43Å; D271-W287 VanDerWaalsContact OD1-CA 3.24Å; D271-W287 WeakPolarHBondContact OD1-CA 3.26Å; E274-W287 HydrophobicContact CG-CE3 4.23Å; E274-W287 HydrophobicContact CG-CZ3 4.3Å; P285-W287 HydrophobicContact CB-CD2 4.15Å; P285-W287 HydrophobicContact CB-CE3 3.96Å; P285-W287 HydrophobicContact CB-CH2 3.42Å; P285-W287 VanDerWaalsContact CB-CH2 3.42Å; P285-W287 HydrophobicContact CB-CZ2 3.6Å; P285-W287 HydrophobicContact CB-CZ3 3.59Å; P285-W287 HydrophobicContact CG-CD2 4.43Å; P285-W287 HydrophobicContact CG-CH2 3.47Å; P285-W287 VanDerWaalsContact CG-CH2 3.47Å; P285-W287 HydrophobicContact CG-CZ2 3.2Å; P285-W287 HydrophobicContact CG-CZ3 4.17Å; W287-N289 VanDerWaalsContact C-N 3.3Å; W287-N289 PolarHBondContact O-ND2 2.81Å
288	T	94.9	Very high	89	Confident	55 Å²	55	103 Å²	103	34%	0.337	51%	0.512	S	S	.	.			trans	-74.6	-25.5	166.8	74.4	0	0	0	0	111.7	R270 D271 K290 E292	R270-T288 HydrophobicContact CG-CG2 4.3Å; D271-T288 PolarHBondContact OD1-N 3.24Å; T288-K290 PolarHBondContact O-N 3.35Å; T288-K290 PolarHBondContact OG1-N 2.73Å; T288-E292 PolarHBondContact OG1-OE2 2.72Å
289	N	94.9	Very high	88.5	Confident	31 Å²	31	108.3 Å²	108.3	17%	0.166	54%	0.538	C	S	.	.			trans	62.2	14.4	-174	-63.3	-78	0	0	0	115.1	R81 R234 P235 D271 W287	R81-N289 VanDerWaalsContact CZ-OD1 3.22Å; R81-N289 PolarHBondContact NH1-OD1 2.94Å; R234-N289 HydrophobicContact CB-CB 4Å; R234-N289 PolarHBondContact N-OD1 3.3Å; R234-N289 VanDerWaalsContact N-OD1 3.07Å; P235-N289 WeakPolarHBondContact CD-O 3.46Å; D271-N289 WeakPolarHBondContact OD2-CA 3.38Å; D271-N289 PolarHBondContact OD2-N 3Å; D271-N289 VanDerWaalsContact OD2-N 3.08Å; W287-N289 VanDerWaalsContact C-N 3.3Å; W287-N289 PolarHBondContact O-ND2 2.81Å
290	K	90.9	Very high	88	Confident	99 Å²	99	104.6 Å²	104.6	43%	0.43	53%	0.526	S	S	.	.	S	Bend	trans	-110.8	147.5	179.4	-66.5	176	177.4	-178.2	0	111.3	D78 T288 E292	D78-K290 WeakPolarHBondContact OD2-CG 3.24Å; T288-K290 PolarHBondContact O-N 3.35Å; T288-K290 PolarHBondContact OG1-N 2.73Å; K290-E292 HydrophobicContact CB-CG 3.85Å; K290-E292 WeakPolarHBondContact CD-OE1 3.48Å; K290-E292 IonicContact NZ-OE1 3.73Å; K290-E292 PolarHBondContact O-N 3.07Å
291	A	87.8	Confident	87.3	Confident	86 Å²	86	103.5 Å²	103.5	71%	0.711	52%	0.519	S	S	*	.			trans	-76.2	51.8	177.6	0	0	0	0	0	112.8	P235	P235-A291 HydrophobicContact CB-CB 4.23Å
292	E	90.3	Very high	86.6	Confident	63 Å²	63	103.4 Å²	103.4	29%	0.294	52%	0.521	S	S	.	.			trans	-92.9	142.7	178.8	-66.7	163.2	171.6	0	0	110	L269 R270 T288 K290	L269-E292 WeakPolarHBondContact CA-O 3.44Å; R270-E292 HydrophobicContact CB-CB 4.33Å; R270-E292 PolarHBondContact N-O 3.1Å; R270-E292 IonicContact NE-OE2 3.55Å; T288-E292 PolarHBondContact OG1-OE2 2.72Å; K290-E292 HydrophobicContact CB-CG 3.85Å; K290-E292 WeakPolarHBondContact CD-OE1 3.48Å; K290-E292 IonicContact NZ-OE1 3.73Å; K290-E292 PolarHBondContact O-N 3.07Å
293	K	86.9	Confident	85.9	Confident	114 Å²	114	96.9 Å²	96.9	50%	0.496	50%	0.498	S	S	.	.	B	Isolated β-bridge	trans	-83.1	159.4	171.1	-55.1	176.6	-176.5	168.7	0	111.2	A268 N295 D296	A268-K293 CarbonylContact O-C 3.4Å; A268-K293 WeakPolarHBondContact O-CA 3.32Å; A268-K293 WeakPolarHBondContact O-CB 3.21Å; K293-N295 VanDerWaalsContact C-N 3.31Å; K293-D296 VanDerWaalsContact CB-OD2 3.31Å; K293-D296 WeakPolarHBondContact CB-OD2 3.01Å; K293-D296 WeakPolarHBondContact CG-OD2 3.31Å
294	A	78.4	Confident	85	Confident	33 Å²	33	97.1 Å²	97.1	27%	0.273	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.8	178.2	0	0	0	0	0	113.9	A268 Q273	A268-A294 PolarHBondContact O-N 2.88Å; Q273-A294 HydrophobicContact CB-CB 4.27Å; Q273-A294 HydrophobicContact CG-CB 3.72Å
295	N	71.6	Confident	84.1	Confident	148 Å²	148	90.3 Å²	90.3	79%	0.791	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	14.3	-174.4	-60.4	0.9	0	0	0	113.3	K293 E297	K293-N295 VanDerWaalsContact C-N 3.31Å; N295-E297 PolarHBondContact O-N 3.31Å
296	D	58	Low	83	Confident	109 Å²	109	93.8 Å²	93.8	58%	0.583	50%	0.499	S	S	*	.			trans	-91.1	37.4	176.9	-64.1	-19	0	0	0	111.1	K293	K293-D296 VanDerWaalsContact CB-OD2 3.31Å; K293-D296 WeakPolarHBondContact CB-OD2 3.01Å; K293-D296 WeakPolarHBondContact CG-OD2 3.31Å
297	E	47	Very low	81.6	Confident	210 Å²	210	92.2 Å²	92.2	98%	0.981	48%	0.483	S	S	*	.			trans	-122.3	0	173.5	-81	-179.3	-160.4	0	0	110.7	R270 N295	R270-E297 IonicContact CZ-OE1 3.18Å; R270-E297 IonicContact NH1-OE1 2.72Å; R270-E297 PolarHBondContact NH1-OE1 3.15Å; R270-E297 IonicContact NH2-OE1 2.73Å; R270-E297 PolarHBondContact NH2-OE1 3.41Å; N295-E297 PolarHBondContact O-N 3.31Å

Retrieved 297 of 297 residues in 307.5 ms (Link to these results)

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