A0A077ZFL0_TRITR Loading...

TP methylase domain containing protein

AlphaFold DB (P67087), UniProt , Accession A0A077ZFL0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 286 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	38.3	Very low	57.5	Low	239 Å²	239	139.2 Å²	139.2	100%	1.177	72%	0.724	S	S	*	*				0	90.6	0	-167.3	174	171.4	0	0	107.7	Q3	M1-Q3 PolarHBondContact O-N 3.06Å
2	K	39.2	Very low	60.8	Low	204 Å²	204	127.8 Å²	127.8	89%	0.887	67%	0.665	S	S	*	*			trans	-74.3	119.2	170.1	-77.3	-175.5	177.4	-177.9	0	106.1	H4	K2-H4 PolarHBondContact O-N 3.44Å
3	Q	44.5	Very low	63.7	Low	181 Å²	181	120.7 Å²	120.7	85%	0.846	63%	0.627	S	S	*	*			trans	-48.4	130	174.3	-73.8	168.8	-18	0	0	108.3	M1 Q5	M1-Q3 PolarHBondContact O-N 3.06Å; Q3-Q5 PolarHBondContact O-N 3.27Å
4	H	47	Very low	66.2	Low	189 Å²	189	112.1 Å²	112.1	88%	0.875	58%	0.582	S	S	*	*			trans	-56.6	107.9	163.4	-82.9	45.6	0	0	0	105.7	K2 S6	K2-H4 PolarHBondContact O-N 3.44Å; H4-S6 PolarHBondContact O-N 3.04Å
5	Q	49.9	Very low	68.3	Low	178 Å²	178	107.5 Å²	107.5	83%	0.832	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-50.6	117.6	160.5	-83.3	170.4	-25.1	0	0	105.2	Q3 A7	Q3-Q5 PolarHBondContact O-N 3.27Å; Q5-A7 PolarHBondContact O-N 3.28Å
6	S	51.6	Low	70.2	Confident	111 Å²	111	101.8 Å²	101.8	78%	0.776	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-50	117	167.8	47.2	0	0	0	0	106.2	H4 D8	H4-S6 PolarHBondContact O-N 3.04Å; S6-D8 PolarHBondContact O-N 3.46Å; S6-D8 VanDerWaalsContact O-N 3.09Å
7	A	55.9	Low	71.9	Confident	61 Å²	61	95.8 Å²	95.8	50%	0.504	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-50.4	123.5	176.7	0	0	0	0	0	107.7	Q5 N9	Q5-A7 PolarHBondContact O-N 3.28Å; A7-N9 PolarHBondContact O-N 3.34Å
8	D	62.7	Low	73.4	Confident	90 Å²	90	90.5 Å²	90.5	48%	0.481	47%	0.467	S	S	.	.			trans	-65.5	102.8	172.9	-177.2	-4.1	0	0	0	107.3	S6 S10 Q11	S6-D8 PolarHBondContact O-N 3.46Å; S6-D8 VanDerWaalsContact O-N 3.09Å; D8-S10 PolarHBondContact O-N 3.32Å; D8-S10 WeakPolarHBondContact OD1-CB 3.3Å; D8-S10 PolarHBondContact OD1-N 3.09Å; D8-S10 VanDerWaalsContact OD1-N 3.1Å; D8-S10 PolarHBondContact OD1-OG 3.42Å; D8-S10 PolarHBondContact OD2-OG 3.49Å; D8-S10 VanDerWaalsContact OD2-OG 3.12Å; D8-Q11 HydrophobicContact CB-CG 4.4Å; D8-Q11 PolarHBondContact O-N 3.03Å; D8-Q11 VanDerWaalsContact O-N 3.1Å
9	N	68.4	Low	74.7	Confident	148 Å²	148	85.8 Å²	85.8	79%	0.791	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-3.7	-177	-76.2	-17.5	0	0	0	113.1	A7 Q11	A7-N9 PolarHBondContact O-N 3.34Å; N9-Q11 VanDerWaalsContact C-N 3.29Å
10	S	84.3	Confident	75.9	Confident	80 Å²	80	82.2 Å²	82.2	56%	0.559	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-19.6	171.3	69.5	0	0	0	0	112.9	D8 G84	D8-S10 PolarHBondContact O-N 3.32Å; D8-S10 WeakPolarHBondContact OD1-CB 3.3Å; D8-S10 PolarHBondContact OD1-N 3.09Å; D8-S10 VanDerWaalsContact OD1-N 3.1Å; D8-S10 PolarHBondContact OD1-OG 3.42Å; D8-S10 PolarHBondContact OD2-OG 3.49Å; D8-S10 VanDerWaalsContact OD2-OG 3.12Å; S10-G84 WeakPolarHBondContact O-CA 3.41Å
11	Q	90.6	Very high	76.9	Confident	50 Å²	50	79 Å²	79	23%	0.234	41%	0.408	C	S	.	.	S	Bend	trans	-88.5	149.4	179.9	-61	-176.7	-33.5	0	0	112.1	D8 N9 I114	D8-Q11 HydrophobicContact CB-CG 4.4Å; D8-Q11 PolarHBondContact O-N 3.03Å; D8-Q11 VanDerWaalsContact O-N 3.1Å; N9-Q11 VanDerWaalsContact C-N 3.29Å; Q11-I114 HydrophobicContact CB-CD1 4.1Å; Q11-I114 HydrophobicContact CG-CD1 4.43Å
12	G	97.2	Very high	79.7	Confident	2 Å²	2	69.1 Å²	69.1	2%	0.021	37%	0.368	C	S	.	.			trans	-73.3	167.6	173.2	0	0	0	0	0	112.2	L81 Q85	G12-L81 PolarHBondContact N-O 3.02Å; G12-Q85 WeakPolarHBondContact CA-O 3.42Å
13	Q	98	Very high	82.5	Confident	36 Å²	36	63.1 Å²	63.1	17%	0.168	35%	0.346	C	S	.	.			trans	-116.3	142	-178.4	-53.8	-178.8	12.4	0	0	110.7	Y15 L81 N86 I87 R115	Q13-Y15 HydrophobicContact CB-CD2 4.35Å; Q13-Y15 HydrophobicContact CB-CE2 3.73Å; Q13-Y15 PolarHBondContact OE1-OH 3.33Å; Q13-Y15 VanDerWaalsContact OE1-OH 3.08Å; Q13-L81 VanDerWaalsContact C-CD2 3.41Å; Q13-L81 WeakPolarHBondContact O-CD2 3.38Å; Q13-N86 PolarHBondContact N-OD1 3.25Å; Q13-I87 PolarHBondContact O-N 3.31Å; Q13-R115 HydrophobicContact CG-CB 4.18Å
14	L	98.5	Very high	85	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	114.3	170.4	179.7	67.3	0	0	0	108.9	I16 L81 I87 L89 L105 V106 C109 R115 V116 V117	L14-I16 HydrophobicContact CD2-CD1 4.05Å; L14-I16 HydrophobicContact CG-CD1 4.06Å; L14-L81 HydrophobicContact CB-CD1 4.31Å; L14-L81 HydrophobicContact CB-CD2 4.27Å; L14-I87 CarbonylContact C-O 3.43Å; L14-I87 WeakPolarHBondContact CA-O 3.3Å; L14-I87 HydrophobicContact CD1-CB 4.24Å; L14-I87 HydrophobicContact CD1-CG2 4.19Å; L14-L89 HydrophobicContact CD1-CB 4.23Å; L14-L105 HydrophobicContact CD1-CD2 4.05Å; L14-L105 HydrophobicContact CD2-CD2 4.17Å; L14-L105 HydrophobicContact CD2-CG 3.93Å; L14-V106 HydrophobicContact CD2-CG2 4.05Å; L14-C109 HydrophobicContact CD2-CB 4.29Å; L14-R115 PolarHBondContact N-O 3.36Å; L14-V116 HydrophobicContact CB-CG2 4.47Å; L14-V116 HydrophobicContact CD2-CG2 4.31Å; L14-V116 CarbonylContact O-C 3.52Å; L14-V116 WeakPolarHBondContact O-CA 3.1Å; L14-V117 PolarHBondContact O-N 2.75Å
15	Y	98.7	Very high	87.4	Confident	44 Å²	44	52.1 Å²	52.1	17%	0.173	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129	175	-63.8	-91.3	0	0	0	110	Q13 V34 V38 N86 I87 A88 L89 V117 L119	Q13-Y15 HydrophobicContact CB-CD2 4.35Å; Q13-Y15 HydrophobicContact CB-CE2 3.73Å; Q13-Y15 PolarHBondContact OE1-OH 3.33Å; Q13-Y15 VanDerWaalsContact OE1-OH 3.08Å; Y15-V34 HydrophobicContact CD1-CG1 3.89Å; Y15-V34 HydrophobicContact CD1-CG2 4.1Å; Y15-V34 HydrophobicContact CD2-CG1 4.1Å; Y15-V34 HydrophobicContact CE1-CG2 4.33Å; Y15-V34 HydrophobicContact CG-CG1 3.6Å; Y15-V38 HydrophobicContact CD2-CG1 3.83Å; Y15-V38 HydrophobicContact CE2-CG1 4.25Å; Y15-N86 HydrophobicContact CE2-CB 4.14Å; Y15-I87 PolarHBondContact N-O 2.88Å; Y15-A88 CarbonylContact O-C 3.52Å; Y15-A88 WeakPolarHBondContact O-CA 3.34Å; Y15-L89 PolarHBondContact O-N 2.98Å; Y15-V117 WeakPolarHBondContact CA-O 3.23Å; Y15-V117 HydrophobicContact CD1-CB 3.75Å; Y15-V117 HydrophobicContact CD1-CG1 3.91Å; Y15-V117 HydrophobicContact CD1-CG2 4.39Å; Y15-V117 HydrophobicContact CE1-CB 4.02Å; Y15-V117 HydrophobicContact CE1-CG1 4.03Å; Y15-V117 HydrophobicContact CE1-CG2 4.22Å; Y15-V117 HydrophobicContact CG-CB 4.5Å; Y15-L119 HydrophobicContact CD1-CD1 4.13Å
16	I	98.6	Very high	89.7	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.077	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.6	172.1	-46	-57.3	0	0	0	106.7	L14 P18 L89 P96 L97 V106 V116 V117 L119	L14-I16 HydrophobicContact CD2-CD1 4.05Å; L14-I16 HydrophobicContact CG-CD1 4.06Å; I16-P18 WeakPolarHBondContact O-CD 3.4Å; I16-L89 HydrophobicContact CD1-CB 4.19Å; I16-L89 HydrophobicContact CD1-CD2 4.02Å; I16-P96 HydrophobicContact CG2-CB 3.81Å; I16-P96 HydrophobicContact CG2-CG 3.9Å; I16-L97 HydrophobicContact CD1-CD1 4.42Å; I16-L97 HydrophobicContact CG2-CD1 4.23Å; I16-V106 HydrophobicContact CD1-CG2 3.67Å; I16-V116 HydrophobicContact CD1-CG1 4.02Å; I16-V116 HydrophobicContact CG1-CG1 3.83Å; I16-V117 PolarHBondContact N-O 2.96Å; I16-L119 WeakPolarHBondContact O-CB 3.21Å; I16-L119 PolarHBondContact O-N 3.31Å
17	V	98.6	Very high	91.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.252	C	S	.	.			trans	-114.2	108.7	-168.6	-176.6	0	0	0	0	109.8	A31 V34 L35 A88 L89 V90 L119	V17-A31 HydrophobicContact CG1-CB 3.59Å; V17-V34 HydrophobicContact CG2-CB 4.48Å; V17-V34 HydrophobicContact CG2-CG1 3.77Å; V17-L35 HydrophobicContact CB-CD2 4.4Å; V17-L35 HydrophobicContact CG1-CD1 4.13Å; V17-L35 HydrophobicContact CG1-CD2 4.1Å; V17-L35 HydrophobicContact CG1-CG 3.99Å; V17-L35 HydrophobicContact CG2-CD2 4.48Å; V17-A88 HydrophobicContact CG2-CB 3.82Å; V17-L89 PolarHBondContact N-O 3.16Å; V17-V90 HydrophobicContact CB-CG1 4Å; V17-V90 HydrophobicContact CG1-CG1 4.43Å; V17-L119 HydrophobicContact CG1-CD2 4.45Å; V17-L119 HydrophobicContact CG2-CD2 4.34Å
18	P	98.4	Very high	93.9	Very high	1 Å²	1	41 Å²	41	1%	0.006	24%	0.24	C	C	.	.			trans	-64.6	136.6	172.7	-24	35.8	0	0	0	112.7	I16 G94 T95 L119	I16-P18 WeakPolarHBondContact O-CD 3.4Å; P18-G94 CarbonylContact C-O 3.52Å; P18-G94 VanDerWaalsContact CA-O 3.32Å; P18-G94 WeakPolarHBondContact CA-O 3.43Å; P18-T95 HydrophobicContact CG-CG2 4.17Å; P18-L119 WeakPolarHBondContact CD-O 3.12Å; P18-L119 WeakPolarHBondContact CG-O 3.2Å
19	T	98.3	Very high	95.6	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-105.9	160.5	174.8	55.6	0	0	0	0	110.7	L52 V90 S91 A93 G94 P122	T19-L52 HydrophobicContact CG2-CD2 3.73Å; T19-V90 HydrophobicContact CG2-CB 3.89Å; T19-V90 HydrophobicContact CG2-CG1 4Å; T19-S91 PolarHBondContact OG1-O 3.29Å; T19-A93 WeakPolarHBondContact OG1-CA 3.45Å; T19-G94 PolarHBondContact N-O 3Å; T19-G94 WeakPolarHBondContact O-CA 3.49Å; T19-G94 PolarHBondContact O-N 3.17Å; T19-G94 PolarHBondContact OG1-N 3.01Å; T19-G94 PolarHBondContact OG1-O 3.29Å; T19-P122 WeakPolarHBondContact O-CB 3.23Å; T19-P122 WeakPolarHBondContact O-CG 3.46Å
20	P	98.3	Very high	97	Very high	12 Å²	12	40.9 Å²	40.9	8%	0.078	23%	0.227	C	C	.	.			trans	-52.4	144.8	172.6	-31.2	39.2	0	0	0	113.8	N23 L24 I27 L52 A93	P20-N23 WeakPolarHBondContact CB-O 3.46Å; P20-L24 HydrophobicContact CG-CD2 4.39Å; P20-I27 HydrophobicContact CG-CB 3.86Å; P20-L52 HydrophobicContact CG-CD1 4.27Å; P20-A93 WeakPolarHBondContact O-CA 3.5Å
21	I	97.3	Very high	97.7	Very high	15 Å²	15	37 Å²	37	8%	0.077	20%	0.2	C	C	.	.	S	Bend	trans	-95.2	-4.9	170.2	60.8	175.2	0	0	0	113	A93 G94 P122 A124 L198 T199 K200	I21-A93 HydrophobicContact CG2-CB 4.44Å; I21-G94 VanDerWaalsContact CG2-CA 3.48Å; I21-P122 HydrophobicContact CG1-CB 4.46Å; I21-P122 HydrophobicContact CG2-CB 4.12Å; I21-A124 HydrophobicContact CD1-CB 3.97Å; I21-L198 HydrophobicContact CD1-CB 4.13Å; I21-T199 HydrophobicContact CD1-CG2 4.13Å; I21-T199 HydrophobicContact CG1-CG2 4.06Å; I21-K200 WeakPolarHBondContact O-CE 3.42Å
22	G	97.1	Very high	98.1	Very high	32 Å²	32	35.7 Å²	35.7	33%	0.33	20%	0.195	S	C	.	.	S	Bend	trans	-176.9	-67.2	179.9	0	0	0	0	0	111.8	L24 T199	G22-L24 PolarHBondContact O-N 2.65Å; G22-T199 WeakPolarHBondContact CA-OG1 3.25Å; G22-T199 PolarHBondContact N-OG1 3.02Å; G22-T199 VanDerWaalsContact N-OG1 3.17Å
23	N	97.8	Very high	98.2	Very high	78 Å²	78	40.3 Å²	40.3	42%	0.417	22%	0.216	S	C	.	.			trans	-78.1	119	178.4	-171.9	-11.6	0	0	0	110.8	P20 A25 D26 T199	P20-N23 WeakPolarHBondContact CB-O 3.46Å; N23-A25 PolarHBondContact O-N 3.1Å; N23-A25 WeakPolarHBondContact OD1-CB 3.49Å; N23-A25 PolarHBondContact OD1-N 2.97Å; N23-D26 WeakPolarHBondContact CB-OD2 3.39Å; N23-D26 WeakPolarHBondContact O-CB 3.39Å; N23-D26 PolarHBondContact O-N 3.07Å; N23-T199 WeakPolarHBondContact CB-O 3.31Å; N23-T199 PolarHBondContact N-O 3.09Å; N23-T199 VanDerWaalsContact N-O 3.11Å; N23-T199 PolarHBondContact N-OG1 3.12Å
24	L	97.4	Very high	98.2	Very high	63 Å²	63	39.4 Å²	39.4	33%	0.33	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-57.1	-26.3	178.9	-64.4	176	0	0	0	113	P20 G22 D26 I27 L52 H55 F56	P20-L24 HydrophobicContact CG-CD2 4.39Å; G22-L24 PolarHBondContact O-N 2.65Å; L24-D26 PolarHBondContact O-N 2.81Å; L24-I27 WeakPolarHBondContact O-CG2 3.37Å; L24-I27 PolarHBondContact O-N 3.07Å; L24-L52 HydrophobicContact CD2-CD1 3.75Å; L24-H55 HydrophobicContact CD1-CB 4.48Å; L24-H55 VanDerWaalsContact CD1-CE1 3.49Å; L24-H55 WeakPolarHBondContact CD1-CE1 3.32Å; L24-F56 HydrophobicContact CB-CZ 4.28Å; L24-F56 WeakPolarHBondContact O-CZ 3.38Å
25	A	97.3	Very high	98.2	Very high	76 Å²	76	39.5 Å²	39.5	63%	0.628	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-68.5	-12.4	176.5	0	0	0	0	0	114.4	N23 I27	N23-A25 PolarHBondContact O-N 3.1Å; N23-A25 WeakPolarHBondContact OD1-CB 3.49Å; N23-A25 PolarHBondContact OD1-N 2.97Å; A25-I27 PolarHBondContact O-N 3.1Å
26	D	98.1	Very high	98.2	Very high	60 Å²	60	43.2 Å²	43.2	32%	0.321	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-78.7	-6.4	-179.5	-61.7	-25.4	0	0	0	112.9	N23 L24 P122 T199	N23-D26 WeakPolarHBondContact CB-OD2 3.39Å; N23-D26 WeakPolarHBondContact O-CB 3.39Å; N23-D26 PolarHBondContact O-N 3.07Å; L24-D26 PolarHBondContact O-N 2.81Å; D26-P122 HydrophobicContact CB-CG 3.91Å; D26-P122 VanDerWaalsContact O-CG 3.28Å; D26-P122 WeakPolarHBondContact O-CG 3.39Å; D26-T199 VanDerWaalsContact OD2-CB 3.29Å; D26-T199 WeakPolarHBondContact OD2-CB 3.24Å; D26-T199 VanDerWaalsContact OD2-CG2 3.27Å; D26-T199 WeakPolarHBondContact OD2-CG2 3.49Å
27	I	98.1	Very high	98.1	Very high	15 Å²	15	46.1 Å²	46.1	8%	0.077	26%	0.258	C	S	.	.	S	Bend	trans	-68.7	133.9	171.3	-162.3	163.4	0	0	0	110.1	P20 L24 A25 A31 L32 L35 F56	P20-I27 HydrophobicContact CG-CB 3.86Å; L24-I27 WeakPolarHBondContact O-CG2 3.37Å; L24-I27 PolarHBondContact O-N 3.07Å; A25-I27 PolarHBondContact O-N 3.1Å; I27-A31 HydrophobicContact CD1-CB 4.3Å; I27-A31 HydrophobicContact CG1-CB 3.77Å; I27-L32 HydrophobicContact CD1-CD2 3.81Å; I27-L32 HydrophobicContact CD1-CG 4.34Å; I27-L32 HydrophobicContact CG1-CD2 4.32Å; I27-L32 HydrophobicContact CG1-CG 4.35Å; I27-L32 HydrophobicContact CG2-CD1 4.06Å; I27-L32 HydrophobicContact CG2-CD2 3.93Å; I27-L32 HydrophobicContact CG2-CG 3.97Å; I27-L35 HydrophobicContact CD1-CD1 4.11Å; I27-F56 HydrophobicContact CG2-CE1 4.04Å; I27-F56 HydrophobicContact CG2-CE2 3.83Å; I27-F56 HydrophobicContact CG2-CZ 3.46Å; I27-F56 VanDerWaalsContact CG2-CZ 3.46Å
28	T	98.3	Very high	98.1	Very high	43 Å²	43	46.7 Å²	46.7	26%	0.264	26%	0.262	S	S	.	.			trans	-76.3	151.7	-179.9	70.9	0	0	0	0	111.4	R30 A31 L32	T28-R30 PolarHBondContact O-N 2.98Å; T28-A31 WeakPolarHBondContact O-CB 3.41Å; T28-A31 PolarHBondContact O-N 2.78Å; T28-A31 WeakPolarHBondContact OG1-CB 3.36Å; T28-A31 PolarHBondContact OG1-N 3Å; T28-A31 VanDerWaalsContact OG1-N 3.14Å; T28-L32 PolarHBondContact O-N 3.25Å; T28-L32 VanDerWaalsContact O-N 3.17Å
29	Q	98.2	Very high	98.1	Very high	126 Å²	126	49.5 Å²	49.5	59%	0.589	28%	0.277	S	S	*	.	H	α-helix	trans	-54.6	-41.7	173.9	-179.6	57.8	36.4	0	0	112.2	A31 L32 E33	Q29-A31 VanDerWaalsContact C-N 3.34Å; Q29-A31 PolarHBondContact O-N 3.43Å; Q29-L32 PolarHBondContact O-N 3.04Å; Q29-E33 WeakPolarHBondContact CG-OE1 3.38Å; Q29-E33 PolarHBondContact NE2-OE1 3.14Å; Q29-E33 WeakPolarHBondContact O-CG 3.32Å; Q29-E33 PolarHBondContact O-N 3.08Å
30	R	98.5	Very high	98.1	Very high	108 Å²	108	50.1 Å²	50.1	41%	0.408	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-33.8	177.5	-176	179.2	160.6	-149.4	-11.2	112.5	T28 V34 L119	T28-R30 PolarHBondContact O-N 2.98Å; R30-V34 WeakPolarHBondContact O-CB 3.49Å; R30-V34 VanDerWaalsContact O-CG2 3.31Å; R30-V34 WeakPolarHBondContact O-CG2 3.45Å; R30-V34 PolarHBondContact O-N 3.04Å; R30-L119 HydrophobicContact CB-CD2 4.46Å; R30-L119 HydrophobicContact CG-CD2 3.96Å; R30-L119 HydrophobicContact CG-CG 4.35Å
31	A	98.6	Very high	98.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-45.2	174.5	0	0	0	0	0	110.9	V17 I27 T28 Q29 E33 V34 L35 L119	V17-A31 HydrophobicContact CG1-CB 3.59Å; I27-A31 HydrophobicContact CD1-CB 4.3Å; I27-A31 HydrophobicContact CG1-CB 3.77Å; T28-A31 WeakPolarHBondContact O-CB 3.41Å; T28-A31 PolarHBondContact O-N 2.78Å; T28-A31 WeakPolarHBondContact OG1-CB 3.36Å; T28-A31 PolarHBondContact OG1-N 3Å; T28-A31 VanDerWaalsContact OG1-N 3.14Å; Q29-A31 VanDerWaalsContact C-N 3.34Å; Q29-A31 PolarHBondContact O-N 3.43Å; A31-E33 PolarHBondContact O-N 2.91Å; A31-V34 PolarHBondContact O-N 2.92Å; A31-L35 WeakPolarHBondContact O-CB 3.34Å; A31-L35 VanDerWaalsContact O-CG 3.24Å; A31-L35 WeakPolarHBondContact O-CG 3.36Å; A31-L35 PolarHBondContact O-N 2.95Å; A31-L119 HydrophobicContact CB-CD2 4.1Å
32	L	98.6	Very high	98.2	Very high	21 Å²	21	48.8 Å²	48.8	11%	0.11	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-46.1	175.7	-65.5	173	0	0	0	112.3	I27 T28 Q29 V34 L35 Q36 F56 I58	I27-L32 HydrophobicContact CD1-CD2 3.81Å; I27-L32 HydrophobicContact CD1-CG 4.34Å; I27-L32 HydrophobicContact CG1-CD2 4.32Å; I27-L32 HydrophobicContact CG1-CG 4.35Å; I27-L32 HydrophobicContact CG2-CD1 4.06Å; I27-L32 HydrophobicContact CG2-CD2 3.93Å; I27-L32 HydrophobicContact CG2-CG 3.97Å; T28-L32 PolarHBondContact O-N 3.25Å; T28-L32 VanDerWaalsContact O-N 3.17Å; Q29-L32 PolarHBondContact O-N 3.04Å; L32-V34 PolarHBondContact O-N 3.17Å; L32-L35 PolarHBondContact O-N 2.99Å; L32-Q36 VanDerWaalsContact O-CG 3.3Å; L32-Q36 WeakPolarHBondContact O-CG 3.41Å; L32-Q36 PolarHBondContact O-N 3.44Å; L32-F56 HydrophobicContact CD1-CD1 4.13Å; L32-F56 HydrophobicContact CD1-CE1 4.23Å; L32-F56 HydrophobicContact CD2-CB 3.93Å; L32-F56 HydrophobicContact CD2-CD1 3.69Å; L32-F56 HydrophobicContact CD2-CD2 3.8Å; L32-F56 HydrophobicContact CD2-CE1 4.14Å; L32-F56 HydrophobicContact CD2-CE2 4.24Å; L32-F56 HydrophobicContact CD2-CG 3.51Å; L32-F56 HydrophobicContact CD2-CZ 4.41Å; L32-I58 HydrophobicContact CD2-CD1 3.98Å
33	E	98.5	Very high	98.2	Very high	99 Å²	99	47.3 Å²	47.3	46%	0.463	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-44	177.3	-72.8	165.7	-170.7	0	0	112.2	Q29 A31 Q36 A37	Q29-E33 WeakPolarHBondContact CG-OE1 3.38Å; Q29-E33 PolarHBondContact NE2-OE1 3.14Å; Q29-E33 WeakPolarHBondContact O-CG 3.32Å; Q29-E33 PolarHBondContact O-N 3.08Å; A31-E33 PolarHBondContact O-N 2.91Å; E33-Q36 PolarHBondContact O-N 3.04Å; E33-A37 VanDerWaalsContact O-CB 3.3Å; E33-A37 WeakPolarHBondContact O-CB 3.39Å; E33-A37 PolarHBondContact O-N 3.06Å; E33-A37 VanDerWaalsContact O-N 3.09Å
34	V	98.6	Very high	97.9	Very high	17 Å²	17	46.3 Å²	46.3	10%	0.103	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-47.1	177.1	169.1	0	0	0	0	110.9	Y15 V17 R30 A31 L32 Q36 A37 V38 L119	Y15-V34 HydrophobicContact CD1-CG1 3.89Å; Y15-V34 HydrophobicContact CD1-CG2 4.1Å; Y15-V34 HydrophobicContact CD2-CG1 4.1Å; Y15-V34 HydrophobicContact CE1-CG2 4.33Å; Y15-V34 HydrophobicContact CG-CG1 3.6Å; V17-V34 HydrophobicContact CG2-CB 4.48Å; V17-V34 HydrophobicContact CG2-CG1 3.77Å; R30-V34 WeakPolarHBondContact O-CB 3.49Å; R30-V34 VanDerWaalsContact O-CG2 3.31Å; R30-V34 WeakPolarHBondContact O-CG2 3.45Å; R30-V34 PolarHBondContact O-N 3.04Å; A31-V34 PolarHBondContact O-N 2.92Å; L32-V34 PolarHBondContact O-N 3.17Å; V34-Q36 PolarHBondContact O-N 3.38Å; V34-A37 PolarHBondContact O-N 3.46Å; V34-V38 HydrophobicContact CG1-CG1 3.87Å; V34-V38 WeakPolarHBondContact O-CG1 3.46Å; V34-V38 WeakPolarHBondContact O-CG2 3.35Å; V34-V38 PolarHBondContact O-N 3.26Å; V34-L119 HydrophobicContact CB-CD2 4.37Å; V34-L119 HydrophobicContact CG2-CD2 4.06Å
35	L	98.7	Very high	97.8	Very high	2 Å²	2	45 Å²	45	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-29.9	179.7	-68	170.9	0	0	0	112.7	V17 I27 A31 L32 I41 L53 I58 A88 V90	V17-L35 HydrophobicContact CB-CD2 4.4Å; V17-L35 HydrophobicContact CG1-CD1 4.13Å; V17-L35 HydrophobicContact CG1-CD2 4.1Å; V17-L35 HydrophobicContact CG1-CG 3.99Å; V17-L35 HydrophobicContact CG2-CD2 4.48Å; I27-L35 HydrophobicContact CD1-CD1 4.11Å; A31-L35 WeakPolarHBondContact O-CB 3.34Å; A31-L35 VanDerWaalsContact O-CG 3.24Å; A31-L35 WeakPolarHBondContact O-CG 3.36Å; A31-L35 PolarHBondContact O-N 2.95Å; L32-L35 PolarHBondContact O-N 2.99Å; L35-I41 HydrophobicContact CB-CD1 4.43Å; L35-I41 HydrophobicContact CD2-CD1 3.8Å; L35-I41 HydrophobicContact CD2-CG1 4.15Å; L35-I41 HydrophobicContact CD2-CG2 4.46Å; L35-L53 HydrophobicContact CB-CD2 4.39Å; L35-L53 HydrophobicContact CD1-CD2 4.35Å; L35-I58 HydrophobicContact CB-CD1 3.94Å; L35-A88 HydrophobicContact CD2-CB 3.92Å; L35-V90 HydrophobicContact CD2-CG1 3.87Å
36	Q	98.3	Very high	97.7	Very high	122 Å²	122	43.6 Å²	43.6	57%	0.57	23%	0.226	S	C	*	.	H	α-helix	trans	-75.3	-30.4	172.9	-71.9	172.5	24.8	0	0	113.4	L32 E33 V34 I58	L32-Q36 VanDerWaalsContact O-CG 3.3Å; L32-Q36 WeakPolarHBondContact O-CG 3.41Å; L32-Q36 PolarHBondContact O-N 3.44Å; E33-Q36 PolarHBondContact O-N 3.04Å; V34-Q36 PolarHBondContact O-N 3.38Å; Q36-I58 HydrophobicContact CG-CB 4.37Å; Q36-I58 HydrophobicContact CG-CD1 3.88Å; Q36-I58 HydrophobicContact CG-CG1 3.68Å; Q36-I58 HydrophobicContact CG-CG2 4Å
37	A	98	Very high	97.6	Very high	76 Å²	76	49.6 Å²	49.6	63%	0.628	25%	0.245	S	C	*	.	H	α-helix	trans	-94.8	-22.2	-171.4	0	0	0	0	0	114.7	E33 V34	E33-A37 VanDerWaalsContact O-CB 3.3Å; E33-A37 WeakPolarHBondContact O-CB 3.39Å; E33-A37 PolarHBondContact O-N 3.06Å; E33-A37 VanDerWaalsContact O-N 3.09Å; V34-A37 PolarHBondContact O-N 3.46Å
38	V	98.6	Very high	97.5	Very high	13 Å²	13	53 Å²	53	8%	0.079	26%	0.26	C	S	.	.			trans	-72.2	152.4	-179.5	-68.2	0	0	0	0	112.7	Y15 V34 I41 N86 A88	Y15-V38 HydrophobicContact CD2-CG1 3.83Å; Y15-V38 HydrophobicContact CE2-CG1 4.25Å; V34-V38 HydrophobicContact CG1-CG1 3.87Å; V34-V38 WeakPolarHBondContact O-CG1 3.46Å; V34-V38 WeakPolarHBondContact O-CG2 3.35Å; V34-V38 PolarHBondContact O-N 3.26Å; V38-I41 HydrophobicContact CG2-CG1 3.77Å; V38-N86 HydrophobicContact CB-CB 4.44Å; V38-N86 HydrophobicContact CG1-CB 4.15Å; V38-A88 HydrophobicContact CB-CB 4.47Å; V38-A88 HydrophobicContact CG1-CB 4.12Å; V38-A88 HydrophobicContact CG2-CB 3.87Å
39	D	98.4	Very high	97.5	Very high	60 Å²	60	51.1 Å²	51.1	32%	0.321	25%	0.248	S	C	.	.	S	Bend	trans	-77.8	-25.6	-179.5	-61.6	-73.7	0	0	0	113.2	R61 Q85 N86	D39-R61 PolarHBondContact O-NE 3.06Å; D39-R61 PolarHBondContact O-NH2 2.99Å; D39-Q85 HydrophobicContact CB-CB 4.12Å; D39-Q85 HydrophobicContact CB-CG 4.4Å; D39-Q85 WeakPolarHBondContact OD2-CA 3.28Å; D39-N86 PolarHBondContact N-O 3.38Å; D39-N86 PolarHBondContact OD2-N 3.03Å
40	L	98.4	Very high	97.5	Very high	14 Å²	14	46.2 Å²	46.2	7%	0.073	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	143.7	-175	-168.3	70.3	0	0	0	110.7	R61 F63 L77 K80 N86 I87 A88	L40-R61 HydrophobicContact CD1-CB 3.72Å; L40-F63 HydrophobicContact CD1-CB 4.06Å; L40-F63 HydrophobicContact CD2-CB 3.89Å; L40-F63 HydrophobicContact CD2-CD2 4.33Å; L40-F63 HydrophobicContact CD2-CG 4.29Å; L40-F63 HydrophobicContact CG-CB 4.01Å; L40-L77 HydrophobicContact CD2-CD2 3.81Å; L40-K80 HydrophobicContact CD2-CD 3.92Å; L40-N86 PolarHBondContact N-O 2.98Å; L40-I87 HydrophobicContact CB-CG1 4.32Å; L40-I87 HydrophobicContact CD2-CD1 4.27Å; L40-I87 VanDerWaalsContact O-CA 3.29Å; L40-I87 WeakPolarHBondContact O-CA 3.34Å; L40-A88 PolarHBondContact O-N 2.93Å
41	I	98.5	Very high	97.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	114.8	172	-60	170	0	0	0	108.4	L35 V38 T49 L53 A60 R61 L62 F63 A88 V90	L35-I41 HydrophobicContact CB-CD1 4.43Å; L35-I41 HydrophobicContact CD2-CD1 3.8Å; L35-I41 HydrophobicContact CD2-CG1 4.15Å; L35-I41 HydrophobicContact CD2-CG2 4.46Å; V38-I41 HydrophobicContact CG2-CG1 3.77Å; I41-T49 HydrophobicContact CG2-CG2 4.3Å; I41-L53 HydrophobicContact CD1-CD1 3.72Å; I41-L53 HydrophobicContact CD1-CD2 3.88Å; I41-L53 HydrophobicContact CD1-CG 4.45Å; I41-A60 HydrophobicContact CD1-CB 3.41Å; I41-A60 VanDerWaalsContact CD1-CB 3.41Å; I41-A60 HydrophobicContact CG1-CB 4.1Å; I41-R61 PolarHBondContact N-O 3.01Å; I41-L62 HydrophobicContact CB-CD2 3.93Å; I41-L62 HydrophobicContact CG2-CD2 3.95Å; I41-L62 CarbonylContact O-C 3.59Å; I41-L62 WeakPolarHBondContact O-CA 3.28Å; I41-F63 PolarHBondContact O-N 3.34Å; I41-A88 CarbonylContact C-O 3.55Å; I41-A88 WeakPolarHBondContact CA-O 3.39Å; I41-A88 HydrophobicContact CG1-CB 4.26Å; I41-V90 HydrophobicContact CG2-CG1 4.24Å; I41-V90 HydrophobicContact CG2-CG2 3.71Å
42	A	97.8	Very high	97.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.9	167.3	0	0	0	0	0	109.1	F63 L77 I87 A88 L89 V90	A42-F63 CarbonylContact C-O 3.58Å; A42-F63 VanDerWaalsContact CA-O 3.28Å; A42-F63 WeakPolarHBondContact CA-O 3.39Å; A42-L77 HydrophobicContact CB-CD1 3.91Å; A42-L77 HydrophobicContact CB-CD2 4.42Å; A42-I87 HydrophobicContact CB-CG2 4.18Å; A42-A88 PolarHBondContact N-O 3.18Å; A42-L89 HydrophobicContact CB-CD1 4.13Å; A42-L89 WeakPolarHBondContact O-CA 3.43Å; A42-V90 PolarHBondContact O-N 3.27Å
43	A	96.5	Very high	97.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	147.3	-173.6	0	0	0	0	0	111.5	T46 T49 L62 F63 A64 L65 V90	A43-T46 HydrophobicContact CB-CG2 4.38Å; A43-T49 HydrophobicContact CB-CG2 4.11Å; A43-T49 WeakPolarHBondContact CB-OG1 3.44Å; A43-L62 HydrophobicContact CB-CD2 4.28Å; A43-F63 PolarHBondContact N-O 3.23Å; A43-A64 CarbonylContact O-C 3.52Å; A43-A64 WeakPolarHBondContact O-CA 3.45Å; A43-L65 PolarHBondContact O-N 3.28Å; A43-V90 HydrophobicContact CB-CG2 3.66Å
44	E	92.4	Very high	97.3	Very high	57 Å²	57	48.9 Å²	48.9	27%	0.266	25%	0.252	S	S	.	.	S	Bend	trans	-63.6	-65.8	172.4	-176.3	-178.4	178.5	0	0	111.8	L65 H66 P101	E44-L65 WeakPolarHBondContact CA-O 3.32Å; E44-H66 PolarHBondContact O-CE1 2.8Å; E44-H66 PolarHBondContact O-ND1 2.83Å; E44-P101 HydrophobicContact CB-CG 4.13Å; E44-P101 HydrophobicContact CG-CG 3.89Å
45	D	94.4	Very high	97.3	Very high	36 Å²	36	53.6 Å²	53.6	19%	0.193	27%	0.273	C	S	.	.			trans	-108.2	112.5	167	-167.9	-30.4	0	0	0	110.4	R47 H48 T49 D92	D45-R47 PolarHBondContact O-N 3.45Å; D45-R47 WeakPolarHBondContact OD1-CA 3.42Å; D45-R47 VanDerWaalsContact OD1-CB 3.22Å; D45-R47 WeakPolarHBondContact OD1-CB 3.48Å; D45-R47 PolarHBondContact OD1-N 3Å; D45-R47 IonicContact OD1-NE 3.43Å; D45-R47 PolarHBondContact OD1-NE 3.44Å; D45-R47 IonicContact OD1-NH2 2.78Å; D45-R47 IonicContact OD2-CZ 2.67Å; D45-R47 IonicContact OD2-NE 3.99Å; D45-R47 PolarHBondContact OD2-NE 3.44Å; D45-R47 IonicContact OD2-NH2 3.53Å; D45-R47 PolarHBondContact OD2-NH2 2.93Å; D45-H48 HydrophobicContact CB-CB 3.99Å; D45-H48 PolarHBondContact O-N 3.21Å; D45-H48 PolarHBondContact OD1-N 3.4Å; D45-T49 PolarHBondContact O-N 3.34Å; D45-T49 PolarHBondContact O-OG1 3.26Å; D45-D92 WeakPolarHBondContact CB-OD1 3.44Å; D45-D92 WeakPolarHBondContact CB-OD2 3.17Å; D45-D92 PolarHBondContact N-OD1 3.49Å
46	T	95.9	Very high	97.3	Very high	46 Å²	46	56.2 Å²	56.2	28%	0.282	28%	0.284	S	S	.	.	H	α-helix	trans	-66.7	-23.5	179.4	56.7	0	0	0	0	113	A43 G50 L62 A64	A43-T46 HydrophobicContact CB-CG2 4.38Å; T46-G50 WeakPolarHBondContact O-CA 3.44Å; T46-G50 PolarHBondContact O-N 2.97Å; T46-L62 HydrophobicContact CG2-CB 4.04Å; T46-L62 WeakPolarHBondContact O-CD1 3.49Å; T46-A64 HydrophobicContact CG2-CB 3.74Å
47	R	96.3	Very high	97.3	Very high	186 Å²	186	53.7 Å²	53.7	70%	0.702	29%	0.291	S	S	*	.	H	α-helix	trans	-74	-44.6	174.8	-57.3	171.8	-64	166.7	3.6	110.4	D45 G50 L51	D45-R47 PolarHBondContact O-N 3.45Å; D45-R47 WeakPolarHBondContact OD1-CA 3.42Å; D45-R47 VanDerWaalsContact OD1-CB 3.22Å; D45-R47 WeakPolarHBondContact OD1-CB 3.48Å; D45-R47 PolarHBondContact OD1-N 3Å; D45-R47 IonicContact OD1-NE 3.43Å; D45-R47 PolarHBondContact OD1-NE 3.44Å; D45-R47 IonicContact OD1-NH2 2.78Å; D45-R47 IonicContact OD2-CZ 2.67Å; D45-R47 IonicContact OD2-NE 3.99Å; D45-R47 PolarHBondContact OD2-NE 3.44Å; D45-R47 IonicContact OD2-NH2 3.53Å; D45-R47 PolarHBondContact OD2-NH2 2.93Å; R47-G50 PolarHBondContact O-N 3.38Å; R47-L51 WeakPolarHBondContact O-CG 3.38Å; R47-L51 PolarHBondContact O-N 3.03Å
48	H	96.1	Very high	97.3	Very high	88 Å²	88	50.7 Å²	50.7	41%	0.407	26%	0.264	S	S	.	.	H	α-helix	trans	-60.1	-52.4	176	-172.2	98	0	0	0	110.2	D45 G50 L51 L52 D92	D45-H48 HydrophobicContact CB-CB 3.99Å; D45-H48 PolarHBondContact O-N 3.21Å; D45-H48 PolarHBondContact OD1-N 3.4Å; H48-G50 VanDerWaalsContact C-N 3.29Å; H48-G50 PolarHBondContact O-N 3.22Å; H48-L51 PolarHBondContact O-N 3.26Å; H48-L52 PolarHBondContact O-N 2.9Å; H48-D92 PolarHBondContact CD2-O 3.22Å; H48-D92 VanDerWaalsContact CD2-O 3.29Å; H48-D92 PolarHBondContact NE2-O 3.14Å
49	T	97.7	Very high	97.2	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-38.4	177.8	-59.1	0	0	0	0	111.8	I41 A43 D45 L51 L52 L53 L62 V90	I41-T49 HydrophobicContact CG2-CG2 4.3Å; A43-T49 HydrophobicContact CB-CG2 4.11Å; A43-T49 WeakPolarHBondContact CB-OG1 3.44Å; D45-T49 PolarHBondContact O-N 3.34Å; D45-T49 PolarHBondContact O-OG1 3.26Å; T49-L51 VanDerWaalsContact C-N 3.32Å; T49-L51 PolarHBondContact O-N 2.92Å; T49-L52 WeakPolarHBondContact O-CB 3.37Å; T49-L52 PolarHBondContact O-N 3.03Å; T49-L53 HydrophobicContact CG2-CD1 4.09Å; T49-L53 HydrophobicContact CG2-CG 4.2Å; T49-L53 WeakPolarHBondContact O-CG 3.42Å; T49-L53 PolarHBondContact O-N 3.39Å; T49-L62 HydrophobicContact CG2-CD2 3.58Å; T49-V90 HydrophobicContact CG2-CG2 3.82Å
50	G	97.7	Very high	97	Very high	23 Å²	23	56 Å²	56	24%	0.237	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-39.6	176.6	0	0	0	0	0	113.5	T46 R47 H48 L53 Q54	T46-G50 WeakPolarHBondContact O-CA 3.44Å; T46-G50 PolarHBondContact O-N 2.97Å; R47-G50 PolarHBondContact O-N 3.38Å; H48-G50 VanDerWaalsContact C-N 3.29Å; H48-G50 PolarHBondContact O-N 3.22Å; G50-L53 PolarHBondContact O-N 3.49Å; G50-Q54 WeakPolarHBondContact O-CB 3.22Å; G50-Q54 PolarHBondContact O-N 3.15Å
51	L	97.7	Very high	97	Very high	118 Å²	118	62.6 Å²	62.6	62%	0.618	32%	0.319	S	S	*	.	H	α-helix	trans	-66.2	-41.1	175.7	-68.1	170.2	0	0	0	111.9	R47 H48 T49 Q54 H55	R47-L51 WeakPolarHBondContact O-CG 3.38Å; R47-L51 PolarHBondContact O-N 3.03Å; H48-L51 PolarHBondContact O-N 3.26Å; T49-L51 VanDerWaalsContact C-N 3.32Å; T49-L51 PolarHBondContact O-N 2.92Å; L51-Q54 PolarHBondContact O-N 2.99Å; L51-H55 PolarHBondContact O-N 3.25Å
52	L	98	Very high	97	Very high	13 Å²	13	65.5 Å²	65.5	7%	0.068	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-49.8	175	178	68	0	0	0	111.1	T19 P20 L24 H48 T49 Q54 H55 F56	T19-L52 HydrophobicContact CG2-CD2 3.73Å; P20-L52 HydrophobicContact CG-CD1 4.27Å; L24-L52 HydrophobicContact CD2-CD1 3.75Å; H48-L52 PolarHBondContact O-N 2.9Å; T49-L52 WeakPolarHBondContact O-CB 3.37Å; T49-L52 PolarHBondContact O-N 3.03Å; L52-Q54 VanDerWaalsContact C-N 3.33Å; L52-Q54 PolarHBondContact O-N 3.35Å; L52-H55 WeakPolarHBondContact O-CB 3.29Å; L52-H55 PolarHBondContact O-N 3.47Å; L52-F56 HydrophobicContact CD1-CD2 3.96Å; L52-F56 HydrophobicContact CD1-CE2 3.64Å; L52-F56 HydrophobicContact CG-CD2 4.42Å; L52-F56 WeakPolarHBondContact O-CD2 3.41Å; L52-F56 PolarHBondContact O-N 2.81Å
53	L	98.4	Very high	96.9	Very high	7 Å²	7	67.8 Å²	67.8	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-62.8	-40.9	179.5	-64.9	177.3	0	0	0	111.7	L35 I41 T49 G50 H55 F56 G57 I58 A60 L62	L35-L53 HydrophobicContact CB-CD2 4.39Å; L35-L53 HydrophobicContact CD1-CD2 4.35Å; I41-L53 HydrophobicContact CD1-CD1 3.72Å; I41-L53 HydrophobicContact CD1-CD2 3.88Å; I41-L53 HydrophobicContact CD1-CG 4.45Å; T49-L53 HydrophobicContact CG2-CD1 4.09Å; T49-L53 HydrophobicContact CG2-CG 4.2Å; T49-L53 WeakPolarHBondContact O-CG 3.42Å; T49-L53 PolarHBondContact O-N 3.39Å; G50-L53 PolarHBondContact O-N 3.49Å; L53-H55 VanDerWaalsContact C-N 3.33Å; L53-H55 PolarHBondContact O-N 3.27Å; L53-F56 CarbonylContact O-C 3.48Å; L53-F56 PolarHBondContact O-N 2.81Å; L53-G57 PolarHBondContact O-N 3Å; L53-I58 HydrophobicContact CB-CB 4.24Å; L53-I58 HydrophobicContact CD2-CB 3.89Å; L53-I58 HydrophobicContact CD2-CD1 4.19Å; L53-I58 HydrophobicContact CD2-CG2 3.86Å; L53-I58 PolarHBondContact O-N 2.78Å; L53-A60 HydrophobicContact CD1-CB 4.34Å; L53-L62 HydrophobicContact CD1-CD1 4.37Å; L53-L62 HydrophobicContact CD1-CD2 3.94Å; L53-L62 HydrophobicContact CD1-CG 4.3Å
54	Q	98	Very high	96.9	Very high	147 Å²	147	69.2 Å²	69.2	69%	0.687	36%	0.356	S	S	*	.	H	α-helix	trans	-59.7	-43	175.1	-178	-177.4	-10.7	0	0	111.8	G50 L51 L52 F56 G57	G50-Q54 WeakPolarHBondContact O-CB 3.22Å; G50-Q54 PolarHBondContact O-N 3.15Å; L51-Q54 PolarHBondContact O-N 2.99Å; L52-Q54 VanDerWaalsContact C-N 3.33Å; L52-Q54 PolarHBondContact O-N 3.35Å; Q54-F56 VanDerWaalsContact C-N 3.26Å; Q54-F56 PolarHBondContact O-N 2.96Å; Q54-G57 PolarHBondContact O-N 2.93Å; Q54-G57 VanDerWaalsContact O-N 3.16Å
55	H	97.9	Very high	96.8	Very high	115 Å²	115	66.5 Å²	66.5	53%	0.532	34%	0.343	S	S	.	.	H	α-helix	trans	-57.7	-39.8	177.6	-179.1	86.5	0	0	0	112.1	L24 L51 L52 L53	L24-H55 HydrophobicContact CD1-CB 4.48Å; L24-H55 VanDerWaalsContact CD1-CE1 3.49Å; L24-H55 WeakPolarHBondContact CD1-CE1 3.32Å; L51-H55 PolarHBondContact O-N 3.25Å; L52-H55 WeakPolarHBondContact O-CB 3.29Å; L52-H55 PolarHBondContact O-N 3.47Å; L53-H55 VanDerWaalsContact C-N 3.33Å; L53-H55 PolarHBondContact O-N 3.27Å
56	F	98.1	Very high	96.2	Very high	57 Å²	57	68.8 Å²	68.8	25%	0.25	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	5.1	179.7	-70.2	-69.7	0	0	0	114.5	L24 I27 L32 L52 L53 Q54 I58	L24-F56 HydrophobicContact CB-CZ 4.28Å; L24-F56 WeakPolarHBondContact O-CZ 3.38Å; I27-F56 HydrophobicContact CG2-CE1 4.04Å; I27-F56 HydrophobicContact CG2-CE2 3.83Å; I27-F56 HydrophobicContact CG2-CZ 3.46Å; I27-F56 VanDerWaalsContact CG2-CZ 3.46Å; L32-F56 HydrophobicContact CD1-CD1 4.13Å; L32-F56 HydrophobicContact CD1-CE1 4.23Å; L32-F56 HydrophobicContact CD2-CB 3.93Å; L32-F56 HydrophobicContact CD2-CD1 3.69Å; L32-F56 HydrophobicContact CD2-CD2 3.8Å; L32-F56 HydrophobicContact CD2-CE1 4.14Å; L32-F56 HydrophobicContact CD2-CE2 4.24Å; L32-F56 HydrophobicContact CD2-CG 3.51Å; L32-F56 HydrophobicContact CD2-CZ 4.41Å; L52-F56 HydrophobicContact CD1-CD2 3.96Å; L52-F56 HydrophobicContact CD1-CE2 3.64Å; L52-F56 HydrophobicContact CG-CD2 4.42Å; L52-F56 WeakPolarHBondContact O-CD2 3.41Å; L52-F56 PolarHBondContact O-N 2.81Å; L53-F56 CarbonylContact O-C 3.48Å; L53-F56 PolarHBondContact O-N 2.81Å; Q54-F56 VanDerWaalsContact C-N 3.26Å; Q54-F56 PolarHBondContact O-N 2.96Å; F56-I58 HydrophobicContact CB-CD1 3.97Å; F56-I58 HydrophobicContact CB-CG1 3.93Å; F56-I58 PolarHBondContact O-N 2.74Å
57	G	97.9	Very high	95.4	Very high	69 Å²	69	71.2 Å²	71.2	71%	0.711	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	25.8	-179.1	0	0	0	0	0	114.1	L53 Q54	L53-G57 PolarHBondContact O-N 3Å; Q54-G57 PolarHBondContact O-N 2.93Å; Q54-G57 VanDerWaalsContact O-N 3.16Å
58	I	98.2	Very high	94.6	Very high	13 Å²	13	71.7 Å²	71.7	7%	0.067	37%	0.374	C	S	.	.			trans	-90	121.4	-179.1	-56.2	179.7	0	0	0	109.1	L32 L35 Q36 L53 F56 A60	L32-I58 HydrophobicContact CD2-CD1 3.98Å; L35-I58 HydrophobicContact CB-CD1 3.94Å; Q36-I58 HydrophobicContact CG-CB 4.37Å; Q36-I58 HydrophobicContact CG-CD1 3.88Å; Q36-I58 HydrophobicContact CG-CG1 3.68Å; Q36-I58 HydrophobicContact CG-CG2 4Å; L53-I58 HydrophobicContact CB-CB 4.24Å; L53-I58 HydrophobicContact CD2-CB 3.89Å; L53-I58 HydrophobicContact CD2-CD1 4.19Å; L53-I58 HydrophobicContact CD2-CG2 3.86Å; L53-I58 PolarHBondContact O-N 2.78Å; F56-I58 HydrophobicContact CB-CD1 3.97Å; F56-I58 HydrophobicContact CB-CG1 3.93Å; F56-I58 PolarHBondContact O-N 2.74Å; I58-A60 HydrophobicContact CG2-CB 4.26Å
59	N	96.1	Very high	93.7	Very high	164 Å²	164	70.2 Å²	70.2	88%	0.877	37%	0.369	S	S	*	.			trans	-101.7	106	173	-173	2.7	0	0	0	109.6
60	A	95.9	Very high	93	Very high	22 Å²	22	70.9 Å²	70.9	18%	0.182	37%	0.372	C	S	.	.			trans	-138.7	152.5	-178	0	0	0	0	0	111.1	I41 L53 I58	I41-A60 HydrophobicContact CD1-CB 3.41Å; I41-A60 VanDerWaalsContact CD1-CB 3.41Å; I41-A60 HydrophobicContact CG1-CB 4.1Å; L53-A60 HydrophobicContact CD1-CB 4.34Å; I58-A60 HydrophobicContact CG2-CB 4.26Å
61	R	97.7	Very high	92.5	Very high	152 Å²	152	75.9 Å²	75.9	57%	0.574	39%	0.389	S	S	*	.			trans	-77.4	131.4	174.6	-68	-178.6	-69.3	-174	-4.3	109.4	D39 L40 I41	D39-R61 PolarHBondContact O-NE 3.06Å; D39-R61 PolarHBondContact O-NH2 2.99Å; L40-R61 HydrophobicContact CD1-CB 3.72Å; I41-R61 PolarHBondContact N-O 3.01Å
62	L	98	Very high	92.1	Very high	61 Å²	61	77 Å²	77	32%	0.319	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	143.2	178.9	-70.5	165.2	0	0	0	111.5	I41 A43 T46 T49 L53	I41-L62 HydrophobicContact CB-CD2 3.93Å; I41-L62 HydrophobicContact CG2-CD2 3.95Å; I41-L62 CarbonylContact O-C 3.59Å; I41-L62 WeakPolarHBondContact O-CA 3.28Å; A43-L62 HydrophobicContact CB-CD2 4.28Å; T46-L62 HydrophobicContact CG2-CB 4.04Å; T46-L62 WeakPolarHBondContact O-CD1 3.49Å; T49-L62 HydrophobicContact CG2-CD2 3.58Å; L53-L62 HydrophobicContact CD1-CD1 4.37Å; L53-L62 HydrophobicContact CD1-CD2 3.94Å; L53-L62 HydrophobicContact CD1-CG 4.3Å
63	F	96.8	Very high	91.8	Very high	48 Å²	48	77.7 Å²	77.7	21%	0.211	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.6	174.1	-173.5	-82.3	0	0	0	108.8	L40 I41 A42 A43 K73 T76 L77	L40-F63 HydrophobicContact CD1-CB 4.06Å; L40-F63 HydrophobicContact CD2-CB 3.89Å; L40-F63 HydrophobicContact CD2-CD2 4.33Å; L40-F63 HydrophobicContact CD2-CG 4.29Å; L40-F63 HydrophobicContact CG-CB 4.01Å; I41-F63 PolarHBondContact O-N 3.34Å; A42-F63 CarbonylContact C-O 3.58Å; A42-F63 VanDerWaalsContact CA-O 3.28Å; A42-F63 WeakPolarHBondContact CA-O 3.39Å; A43-F63 PolarHBondContact N-O 3.23Å; F63-K73 HydrophobicContact CE1-CB 4.07Å; F63-K73 HydrophobicContact CE1-CD 4.01Å; F63-K73 HydrophobicContact CE1-CG 4.05Å; F63-K73 HydrophobicContact CZ-CG 4.28Å; F63-T76 HydrophobicContact CE2-CG2 4.2Å; F63-T76 HydrophobicContact CZ-CG2 4.13Å; F63-L77 HydrophobicContact CD1-CD1 4.25Å; F63-L77 HydrophobicContact CD1-CD2 3.86Å; F63-L77 HydrophobicContact CD1-CG 4.26Å; F63-L77 HydrophobicContact CD2-CD2 4.49Å; F63-L77 HydrophobicContact CE1-CD1 4.23Å; F63-L77 HydrophobicContact CE1-CD2 4.11Å; F63-L77 HydrophobicContact CE1-CG 4.09Å; F63-L77 HydrophobicContact CG-CD2 4.07Å
64	A	95.1	Very high	91.6	Very high	29 Å²	29	77.4 Å²	77.4	24%	0.24	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.6	-178.9	0	0	0	0	0	110.8	A43 T46 K73	A43-A64 CarbonylContact O-C 3.52Å; A43-A64 WeakPolarHBondContact O-CA 3.45Å; T46-A64 HydrophobicContact CG2-CB 3.74Å; A64-K73 WeakPolarHBondContact O-CD 3.46Å; A64-K73 WeakPolarHBondContact O-CE 3.29Å; A64-K73 PolarHBondContact O-NZ 3.11Å
65	L	90.3	Very high	91.4	Very high	1 Å²	1	77 Å²	77	1%	0.005	39%	0.39	C	S	.	.			trans	-123.6	109.4	174.6	-176.1	69.9	0	0	0	108.5	A43 E44 E70 K73 L77 L89 L105	A43-L65 PolarHBondContact O-N 3.28Å; E44-L65 WeakPolarHBondContact CA-O 3.32Å; L65-E70 HydrophobicContact CD1-CG 4.19Å; L65-E70 HydrophobicContact CG-CG 4.47Å; L65-K73 HydrophobicContact CD1-CB 3.51Å; L65-K73 HydrophobicContact CD1-CD 3.99Å; L65-K73 HydrophobicContact CD1-CG 4.44Å; L65-L77 HydrophobicContact CD1-CD1 4.3Å; L65-L89 HydrophobicContact CD2-CD1 3.71Å; L65-L105 HydrophobicContact CD2-CD2 4.08Å
66	H	83.5	Confident	91.3	Very high	83 Å²	83	74.5 Å²	74.5	38%	0.384	38%	0.383	S	S	.	.			trans	-117.5	152.1	-178.7	-52.7	-55.4	0	0	0	109.5	E44 H68 N69 E70	E44-H66 PolarHBondContact O-CE1 2.8Å; E44-H66 PolarHBondContact O-ND1 2.83Å; H66-H68 VanDerWaalsContact C-N 3.32Å; H66-H68 PolarHBondContact O-N 2.97Å; H66-N69 PolarHBondContact O-N 3.19Å; H66-N69 PolarHBondContact O-OD1 2.88Å; H66-E70 PolarHBondContact O-N 3.34Å; H66-E70 VanDerWaalsContact O-N 3.15Å
67	D	79.1	Confident	91.3	Very high	98 Å²	98	71.8 Å²	71.8	52%	0.524	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-51.4	-45.9	-178.5	-73.5	-12.6	0	0	0	113.7	N69 E70 P101	D67-N69 PolarHBondContact O-N 2.91Å; D67-E70 PolarHBondContact O-N 2.94Å; D67-P101 WeakPolarHBondContact OD1-CA 3.38Å; D67-P101 WeakPolarHBondContact OD1-CB 3.29Å
68	H	77.6	Confident	91.2	Very high	195 Å²	195	69.7 Å²	69.7	90%	0.903	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-62.2	-18.7	-173.8	-64.2	-50.4	0	0	0	114.7	H66	H66-H68 VanDerWaalsContact C-N 3.32Å; H66-H68 PolarHBondContact O-N 2.97Å
69	N	77.4	Confident	91.2	Very high	57 Å²	57	71 Å²	71	31%	0.305	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-133.5	22.5	179.9	57.3	14.8	0	0	0	113.3	H66 D67 Q71 Q72 K73	H66-N69 PolarHBondContact O-N 3.19Å; H66-N69 PolarHBondContact O-OD1 2.88Å; D67-N69 PolarHBondContact O-N 2.91Å; N69-Q71 VanDerWaalsContact C-N 3.29Å; N69-Q71 PolarHBondContact O-N 3.48Å; N69-Q72 PolarHBondContact O-N 3.27Å; N69-K73 WeakPolarHBondContact ND2-CE 3.47Å; N69-K73 PolarHBondContact ND2-NZ 3.37Å; N69-K73 PolarHBondContact O-N 3.18Å; N69-K73 VanDerWaalsContact O-N 3.13Å; N69-K73 WeakPolarHBondContact OD1-CD 3.27Å; N69-K73 WeakPolarHBondContact OD1-CE 3.36Å; N69-K73 PolarHBondContact OD1-NZ 3.33Å
70	E	82.8	Confident	91.3	Very high	17 Å²	17	66 Å²	66	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-56.9	-41.5	-173.2	-162.7	-168.4	167.2	0	0	112.2	L65 H66 D67 K73 A74 G102 Y103 H104	L65-E70 HydrophobicContact CD1-CG 4.19Å; L65-E70 HydrophobicContact CG-CG 4.47Å; H66-E70 PolarHBondContact O-N 3.34Å; H66-E70 VanDerWaalsContact O-N 3.15Å; D67-E70 PolarHBondContact O-N 2.94Å; E70-K73 PolarHBondContact O-N 3.41Å; E70-A74 WeakPolarHBondContact O-CB 3.4Å; E70-A74 PolarHBondContact O-N 2.9Å; E70-G102 WeakPolarHBondContact OE1-CA 3.41Å; E70-G102 PolarHBondContact OE1-N 3.38Å; E70-Y103 PolarHBondContact OE1-N 3.23Å; E70-H104 HydrophobicContact CG-CB 4.09Å; E70-H104 PolarHBondContact OE1-N 3.16Å; E70-H104 IonicContact OE2-CD2 3.88Å; E70-H104 PolarHBondContact OE2-CD2 3.41Å; E70-H104 VanDerWaalsContact OE2-CD2 3.25Å; E70-H104 IonicContact OE2-CG 3.66Å
71	Q	87.3	Confident	91.4	Very high	128 Å²	128	65 Å²	65	60%	0.598	32%	0.318	S	S	*	.	H	α-helix	trans	-63.6	-50.7	-178.7	-69.7	-177.3	-1.2	0	0	113.2	N69 K73 A74 E75	N69-Q71 VanDerWaalsContact C-N 3.29Å; N69-Q71 PolarHBondContact O-N 3.48Å; Q71-K73 VanDerWaalsContact C-N 3.31Å; Q71-K73 PolarHBondContact O-N 3.05Å; Q71-A74 WeakPolarHBondContact O-CB 3.33Å; Q71-A74 PolarHBondContact O-N 3.46Å; Q71-E75 PolarHBondContact O-N 3.27Å
72	Q	89.1	Confident	91.4	Very high	140 Å²	140	62.2 Å²	62.2	65%	0.654	31%	0.312	S	S	*	.	H	α-helix	trans	-63.8	-39.4	-179.9	-174.4	-176.4	22	0	0	111.6	N69 T76	N69-Q72 PolarHBondContact O-N 3.27Å; Q72-T76 PolarHBondContact O-N 3.01Å; Q72-T76 PolarHBondContact O-OG1 3.17Å
73	K	92.3	Very high	91.3	Very high	29 Å²	29	65.9 Å²	65.9	13%	0.126	33%	0.327	C	S	.	.	H	α-helix	trans	-70.6	-34	177	-74.3	-176.5	173.9	171.6	0	112.2	F63 A64 L65 N69 E70 Q71 E75 T76 L77	F63-K73 HydrophobicContact CE1-CB 4.07Å; F63-K73 HydrophobicContact CE1-CD 4.01Å; F63-K73 HydrophobicContact CE1-CG 4.05Å; F63-K73 HydrophobicContact CZ-CG 4.28Å; A64-K73 WeakPolarHBondContact O-CD 3.46Å; A64-K73 WeakPolarHBondContact O-CE 3.29Å; A64-K73 PolarHBondContact O-NZ 3.11Å; L65-K73 HydrophobicContact CD1-CB 3.51Å; L65-K73 HydrophobicContact CD1-CD 3.99Å; L65-K73 HydrophobicContact CD1-CG 4.44Å; N69-K73 WeakPolarHBondContact ND2-CE 3.47Å; N69-K73 PolarHBondContact ND2-NZ 3.37Å; N69-K73 PolarHBondContact O-N 3.18Å; N69-K73 VanDerWaalsContact O-N 3.13Å; N69-K73 WeakPolarHBondContact OD1-CD 3.27Å; N69-K73 WeakPolarHBondContact OD1-CE 3.36Å; N69-K73 PolarHBondContact OD1-NZ 3.33Å; E70-K73 PolarHBondContact O-N 3.41Å; Q71-K73 VanDerWaalsContact C-N 3.31Å; Q71-K73 PolarHBondContact O-N 3.05Å; K73-E75 VanDerWaalsContact C-N 3.32Å; K73-E75 PolarHBondContact O-N 3.15Å; K73-T76 WeakPolarHBondContact O-CB 3.43Å; K73-T76 PolarHBondContact O-N 3.15Å; K73-L77 WeakPolarHBondContact O-CG 3.36Å; K73-L77 PolarHBondContact O-N 3.5Å
74	A	93.6	Very high	91.3	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.2	-41.7	175.4	0	0	0	0	0	111.8	E70 Q71 T76 L77 L78 L105	E70-A74 WeakPolarHBondContact O-CB 3.4Å; E70-A74 PolarHBondContact O-N 2.9Å; Q71-A74 WeakPolarHBondContact O-CB 3.33Å; Q71-A74 PolarHBondContact O-N 3.46Å; A74-T76 VanDerWaalsContact C-N 3.34Å; A74-T76 PolarHBondContact O-N 2.97Å; A74-L77 PolarHBondContact O-N 3.01Å; A74-L78 WeakPolarHBondContact O-CB 3.41Å; A74-L78 PolarHBondContact O-N 3.47Å; A74-L105 HydrophobicContact CB-CB 4.19Å; A74-L105 HydrophobicContact CB-CD1 4.22Å
75	E	94.3	Very high	91.5	Very high	139 Å²	139	65.4 Å²	65.4	65%	0.65	33%	0.328	S	S	*	.	H	α-helix	trans	-63.2	-40.6	174.5	-67.3	-179.2	172	0	0	112.1	Q71 K73 L77 L78 A79	Q71-E75 PolarHBondContact O-N 3.27Å; K73-E75 VanDerWaalsContact C-N 3.32Å; K73-E75 PolarHBondContact O-N 3.15Å; E75-L77 PolarHBondContact O-N 3.5Å; E75-L78 PolarHBondContact O-N 3.26Å; E75-A79 PolarHBondContact O-N 3.35Å
76	T	96	Very high	91.9	Very high	63 Å²	63	67.6 Å²	67.6	39%	0.387	34%	0.34	S	S	.	.	H	α-helix	trans	-63.4	-41.9	177.6	-58	0	0	0	0	111.7	F63 Q72 K73 A74 K80	F63-T76 HydrophobicContact CE2-CG2 4.2Å; F63-T76 HydrophobicContact CZ-CG2 4.13Å; Q72-T76 PolarHBondContact O-N 3.01Å; Q72-T76 PolarHBondContact O-OG1 3.17Å; K73-T76 WeakPolarHBondContact O-CB 3.43Å; K73-T76 PolarHBondContact O-N 3.15Å; A74-T76 VanDerWaalsContact C-N 3.34Å; A74-T76 PolarHBondContact O-N 2.97Å; T76-K80 PolarHBondContact O-N 3.16Å
77	L	97.5	Very high	92.6	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-71.3	-38.3	177	-68.3	170.4	0	0	0	111.6	L40 A42 F63 L65 K73 A74 E75 A79 K80 L81 I87 L105	L40-L77 HydrophobicContact CD2-CD2 3.81Å; A42-L77 HydrophobicContact CB-CD1 3.91Å; A42-L77 HydrophobicContact CB-CD2 4.42Å; F63-L77 HydrophobicContact CD1-CD1 4.25Å; F63-L77 HydrophobicContact CD1-CD2 3.86Å; F63-L77 HydrophobicContact CD1-CG 4.26Å; F63-L77 HydrophobicContact CD2-CD2 4.49Å; F63-L77 HydrophobicContact CE1-CD1 4.23Å; F63-L77 HydrophobicContact CE1-CD2 4.11Å; F63-L77 HydrophobicContact CE1-CG 4.09Å; F63-L77 HydrophobicContact CG-CD2 4.07Å; L65-L77 HydrophobicContact CD1-CD1 4.3Å; K73-L77 WeakPolarHBondContact O-CG 3.36Å; K73-L77 PolarHBondContact O-N 3.5Å; A74-L77 PolarHBondContact O-N 3.01Å; E75-L77 PolarHBondContact O-N 3.5Å; L77-A79 PolarHBondContact O-N 3.48Å; L77-K80 PolarHBondContact O-N 2.85Å; L77-L81 WeakPolarHBondContact O-CD1 3.41Å; L77-L81 WeakPolarHBondContact O-CG 3.47Å; L77-L81 PolarHBondContact O-N 2.94Å; L77-I87 HydrophobicContact CB-CD1 4.24Å; L77-I87 HydrophobicContact CD2-CD1 3.82Å; L77-I87 HydrophobicContact CD2-CG2 4.43Å; L77-L105 HydrophobicContact CB-CD1 3.81Å; L77-L105 HydrophobicContact CD1-CD1 4.06Å; L77-L105 HydrophobicContact CD1-CD2 3.72Å
78	L	97.2	Very high	93.5	Very high	24 Å²	24	59 Å²	59	13%	0.126	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-45.7	175.1	174.9	62.4	0	0	0	111.5	A74 E75 K80 L81 Q82 T108 A112 I114	A74-L78 WeakPolarHBondContact O-CB 3.41Å; A74-L78 PolarHBondContact O-N 3.47Å; E75-L78 PolarHBondContact O-N 3.26Å; L78-K80 VanDerWaalsContact C-N 3.29Å; L78-K80 PolarHBondContact O-N 3.37Å; L78-L81 WeakPolarHBondContact O-CB 3.32Å; L78-L81 PolarHBondContact O-N 2.8Å; L78-L81 VanDerWaalsContact O-N 3.15Å; L78-Q82 HydrophobicContact CD1-CG 4.13Å; L78-Q82 HydrophobicContact CG-CG 4.43Å; L78-Q82 WeakPolarHBondContact O-CG 3.28Å; L78-Q82 PolarHBondContact O-N 3.47Å; L78-T108 HydrophobicContact CB-CG2 4.36Å; L78-T108 HydrophobicContact CD2-CG2 3.64Å; L78-T108 HydrophobicContact CG-CG2 4.48Å; L78-A112 HydrophobicContact CD1-CB 3.66Å; L78-A112 HydrophobicContact CD2-CB 3.93Å; L78-A112 HydrophobicContact CG-CB 4.45Å; L78-I114 HydrophobicContact CD1-CD1 4.36Å; L78-I114 HydrophobicContact CD1-CG1 3.57Å
79	A	97.1	Very high	94.5	Very high	40 Å²	40	49.9 Å²	49.9	33%	0.331	26%	0.255	S	S	.	.	H	α-helix	trans	-57.5	-43.2	177.9	0	0	0	0	0	111.6	E75 L77 L81 Q82 E83	E75-A79 PolarHBondContact O-N 3.35Å; L77-A79 PolarHBondContact O-N 3.48Å; A79-L81 PolarHBondContact O-N 2.96Å; A79-Q82 PolarHBondContact O-N 2.93Å; A79-E83 WeakPolarHBondContact O-CG 3.24Å; A79-E83 PolarHBondContact O-N 2.96Å
80	K	98	Very high	95.5	Very high	60 Å²	60	47.3 Å²	47.3	26%	0.261	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-40.8	176.1	-66.8	-179.6	-176.5	-56.9	0	112.8	L40 T76 L77 L78 Q82 E83 G84 Q85 I87	L40-K80 HydrophobicContact CD2-CD 3.92Å; T76-K80 PolarHBondContact O-N 3.16Å; L77-K80 PolarHBondContact O-N 2.85Å; L78-K80 VanDerWaalsContact C-N 3.29Å; L78-K80 PolarHBondContact O-N 3.37Å; K80-Q82 VanDerWaalsContact C-N 3.34Å; K80-E83 WeakPolarHBondContact O-CB 3.44Å; K80-E83 PolarHBondContact O-N 3.38Å; K80-G84 PolarHBondContact O-N 3.28Å; K80-Q85 HydrophobicContact CB-CB 4.39Å; K80-Q85 WeakPolarHBondContact O-CB 3.36Å; K80-Q85 PolarHBondContact O-N 3.06Å; K80-Q85 VanDerWaalsContact O-N 3.07Å; K80-I87 HydrophobicContact CB-CD1 4.06Å
81	L	98.2	Very high	96.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-41.7	175	-75	154.7	0	0	0	111.1	G12 Q13 L14 L77 L78 A79 E83 G84 Q85 I87 I114	G12-L81 PolarHBondContact N-O 3.02Å; Q13-L81 VanDerWaalsContact C-CD2 3.41Å; Q13-L81 WeakPolarHBondContact O-CD2 3.38Å; L14-L81 HydrophobicContact CB-CD1 4.31Å; L14-L81 HydrophobicContact CB-CD2 4.27Å; L77-L81 WeakPolarHBondContact O-CD1 3.41Å; L77-L81 WeakPolarHBondContact O-CG 3.47Å; L77-L81 PolarHBondContact O-N 2.94Å; L78-L81 WeakPolarHBondContact O-CB 3.32Å; L78-L81 PolarHBondContact O-N 2.8Å; L78-L81 VanDerWaalsContact O-N 3.15Å; A79-L81 PolarHBondContact O-N 2.96Å; L81-E83 VanDerWaalsContact C-N 3.26Å; L81-E83 PolarHBondContact O-N 2.88Å; L81-G84 PolarHBondContact O-N 3.16Å; L81-Q85 WeakPolarHBondContact CD2-O 3.5Å; L81-I87 HydrophobicContact CD1-CD1 4.15Å; L81-I87 HydrophobicContact CD2-CB 4.17Å; L81-I87 HydrophobicContact CD2-CD1 4.24Å; L81-I87 HydrophobicContact CD2-CG1 3.98Å; L81-I87 HydrophobicContact CG-CD1 3.73Å; L81-I87 HydrophobicContact CG-CG1 4.04Å; L81-I114 HydrophobicContact CB-CD1 4Å; L81-I114 HydrophobicContact CB-CG1 4.25Å; L81-I114 HydrophobicContact CB-CG2 4.25Å; L81-I114 HydrophobicContact CD1-CG2 4.23Å; L81-I114 HydrophobicContact CD2-CG2 4.1Å; L81-I114 HydrophobicContact CG-CG2 4.43Å
82	Q	97.4	Very high	96.5	Very high	95 Å²	95	42.4 Å²	42.4	44%	0.444	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-27.8	175.7	-71	175.1	-30.9	0	0	112.9	L78 A79 K80 G84 I114	L78-Q82 HydrophobicContact CD1-CG 4.13Å; L78-Q82 HydrophobicContact CG-CG 4.43Å; L78-Q82 WeakPolarHBondContact O-CG 3.28Å; L78-Q82 PolarHBondContact O-N 3.47Å; A79-Q82 PolarHBondContact O-N 2.93Å; K80-Q82 VanDerWaalsContact C-N 3.34Å; Q82-G84 PolarHBondContact O-N 3.48Å; Q82-I114 HydrophobicContact CG-CD1 4.11Å
83	E	97	Very high	96.8	Very high	138 Å²	138	37.4 Å²	37.4	65%	0.645	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-0.4	171.9	-69.4	167.7	-176.9	0	0	113.8	A79 K80 L81 Q85	A79-E83 WeakPolarHBondContact O-CG 3.24Å; A79-E83 PolarHBondContact O-N 2.96Å; K80-E83 WeakPolarHBondContact O-CB 3.44Å; K80-E83 PolarHBondContact O-N 3.38Å; L81-E83 VanDerWaalsContact C-N 3.26Å; L81-E83 PolarHBondContact O-N 2.88Å; E83-Q85 PolarHBondContact OE2-NE2 3.47Å
84	G	97.2	Very high	97.1	Very high	28 Å²	28	36.2 Å²	36.2	29%	0.289	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	99	-0.3	177.7	0	0	0	0	0	115.3	S10 K80 L81 Q82	S10-G84 WeakPolarHBondContact O-CA 3.41Å; K80-G84 PolarHBondContact O-N 3.28Å; L81-G84 PolarHBondContact O-N 3.16Å; Q82-G84 PolarHBondContact O-N 3.48Å
85	Q	98.2	Very high	97.2	Very high	39 Å²	39	37.9 Å²	37.9	18%	0.182	21%	0.208	C	C	.	.			trans	-77.1	130.8	-178.4	-65.3	175.5	64.3	0	0	111.4	G12 D39 K80 L81 E83	G12-Q85 WeakPolarHBondContact CA-O 3.42Å; D39-Q85 HydrophobicContact CB-CB 4.12Å; D39-Q85 HydrophobicContact CB-CG 4.4Å; D39-Q85 WeakPolarHBondContact OD2-CA 3.28Å; K80-Q85 HydrophobicContact CB-CB 4.39Å; K80-Q85 WeakPolarHBondContact O-CB 3.36Å; K80-Q85 PolarHBondContact O-N 3.06Å; K80-Q85 VanDerWaalsContact O-N 3.07Å; L81-Q85 WeakPolarHBondContact CD2-O 3.5Å; E83-Q85 PolarHBondContact OE2-NE2 3.47Å
86	N	98.5	Very high	97.3	Very high	47 Å²	47	31.4 Å²	31.4	25%	0.251	18%	0.178	S	C	.	.			trans	-81	133.4	171.5	-65.7	-60.8	0	0	0	110.3	Q13 Y15 V38 D39 L40	Q13-N86 PolarHBondContact N-OD1 3.25Å; Y15-N86 HydrophobicContact CE2-CB 4.14Å; V38-N86 HydrophobicContact CB-CB 4.44Å; V38-N86 HydrophobicContact CG1-CB 4.15Å; D39-N86 PolarHBondContact N-O 3.38Å; D39-N86 PolarHBondContact OD2-N 3.03Å; L40-N86 PolarHBondContact N-O 2.98Å
87	I	98.7	Very high	97.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.6	-177	-54.7	-173.3	0	0	0	109.5	Q13 L14 Y15 L40 A42 L77 K80 L81	Q13-I87 PolarHBondContact O-N 3.31Å; L14-I87 CarbonylContact C-O 3.43Å; L14-I87 WeakPolarHBondContact CA-O 3.3Å; L14-I87 HydrophobicContact CD1-CB 4.24Å; L14-I87 HydrophobicContact CD1-CG2 4.19Å; Y15-I87 PolarHBondContact N-O 2.88Å; L40-I87 HydrophobicContact CB-CG1 4.32Å; L40-I87 HydrophobicContact CD2-CD1 4.27Å; L40-I87 VanDerWaalsContact O-CA 3.29Å; L40-I87 WeakPolarHBondContact O-CA 3.34Å; A42-I87 HydrophobicContact CB-CG2 4.18Å; L77-I87 HydrophobicContact CB-CD1 4.24Å; L77-I87 HydrophobicContact CD2-CD1 3.82Å; L77-I87 HydrophobicContact CD2-CG2 4.43Å; K80-I87 HydrophobicContact CB-CD1 4.06Å; L81-I87 HydrophobicContact CD1-CD1 4.15Å; L81-I87 HydrophobicContact CD2-CB 4.17Å; L81-I87 HydrophobicContact CD2-CD1 4.24Å; L81-I87 HydrophobicContact CD2-CG1 3.98Å; L81-I87 HydrophobicContact CG-CD1 3.73Å; L81-I87 HydrophobicContact CG-CG1 4.04Å
88	A	98.7	Very high	97.1	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	137.1	165.1	0	0	0	0	0	110.1	Y15 V17 L35 V38 L40 I41 A42	Y15-A88 CarbonylContact O-C 3.52Å; Y15-A88 WeakPolarHBondContact O-CA 3.34Å; V17-A88 HydrophobicContact CG2-CB 3.82Å; L35-A88 HydrophobicContact CD2-CB 3.92Å; V38-A88 HydrophobicContact CB-CB 4.47Å; V38-A88 HydrophobicContact CG1-CB 4.12Å; V38-A88 HydrophobicContact CG2-CB 3.87Å; L40-A88 PolarHBondContact O-N 2.93Å; I41-A88 CarbonylContact C-O 3.55Å; I41-A88 WeakPolarHBondContact CA-O 3.39Å; I41-A88 HydrophobicContact CG1-CB 4.26Å; A42-A88 PolarHBondContact N-O 3.18Å
89	L	98.3	Very high	96.9	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.9	165.5	176	66.9	0	0	0	108.7	L14 Y15 I16 V17 A42 L65 P96 L97 L105	L14-L89 HydrophobicContact CD1-CB 4.23Å; Y15-L89 PolarHBondContact O-N 2.98Å; I16-L89 HydrophobicContact CD1-CB 4.19Å; I16-L89 HydrophobicContact CD1-CD2 4.02Å; V17-L89 PolarHBondContact N-O 3.16Å; A42-L89 HydrophobicContact CB-CD1 4.13Å; A42-L89 WeakPolarHBondContact O-CA 3.43Å; L65-L89 HydrophobicContact CD2-CD1 3.71Å; L89-P96 HydrophobicContact CD2-CB 4.17Å; L89-P96 HydrophobicContact CG-CB 4.15Å; L89-P96 WeakPolarHBondContact O-CG 3.49Å; L89-L97 HydrophobicContact CD2-CD1 3.56Å; L89-L105 HydrophobicContact CD1-CD2 4.4Å; L89-L105 HydrophobicContact CD2-CD2 4.46Å
90	V	98	Very high	96.7	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	149.8	175.6	-61.6	0	0	0	0	110.7	V17 T19 L35 I41 A42 A43 T49	V17-V90 HydrophobicContact CB-CG1 4Å; V17-V90 HydrophobicContact CG1-CG1 4.43Å; T19-V90 HydrophobicContact CG2-CB 3.89Å; T19-V90 HydrophobicContact CG2-CG1 4Å; L35-V90 HydrophobicContact CD2-CG1 3.87Å; I41-V90 HydrophobicContact CG2-CG1 4.24Å; I41-V90 HydrophobicContact CG2-CG2 3.71Å; A42-V90 PolarHBondContact O-N 3.27Å; A43-V90 HydrophobicContact CB-CG2 3.66Å; T49-V90 HydrophobicContact CG2-CG2 3.82Å
91	S	95.9	Very high	96.4	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.014	19%	0.188	C	C	.	.			trans	-100.6	167	163.7	-61.2	0	0	0	0	109.6	T19 A93 P96 D100	T19-S91 PolarHBondContact OG1-O 3.29Å; S91-A93 PolarHBondContact O-N 2.76Å; S91-P96 VanDerWaalsContact OG-CA 3.28Å; S91-P96 WeakPolarHBondContact OG-CA 3.17Å; S91-D100 WeakPolarHBondContact CB-OD2 3.43Å; S91-D100 VanDerWaalsContact OG-CB 3.23Å; S91-D100 WeakPolarHBondContact OG-CB 3.18Å; S91-D100 PolarHBondContact OG-OD2 3.01Å
92	D	95.3	Very high	96.1	Very high	39 Å²	39	34.2 Å²	34.2	21%	0.209	19%	0.188	C	C	.	.	S	Bend	trans	-57.8	-38.1	173.7	-73	-1.6	0	0	0	111.4	D45 H48	D45-D92 WeakPolarHBondContact CB-OD1 3.44Å; D45-D92 WeakPolarHBondContact CB-OD2 3.17Å; D45-D92 PolarHBondContact N-OD1 3.49Å; H48-D92 PolarHBondContact CD2-O 3.22Å; H48-D92 VanDerWaalsContact CD2-O 3.29Å; H48-D92 PolarHBondContact NE2-O 3.14Å
93	A	95.8	Very high	96	Very high	35 Å²	35	35.6 Å²	35.6	29%	0.289	19%	0.19	S	C	.	.	S	Bend	trans	-145.5	137	177	0	0	0	0	0	112.7	T19 P20 I21 S91	T19-A93 WeakPolarHBondContact OG1-CA 3.45Å; P20-A93 WeakPolarHBondContact O-CA 3.5Å; I21-A93 HydrophobicContact CG2-CB 4.44Å; S91-A93 PolarHBondContact O-N 2.76Å
94	G	97.2	Very high	95.8	Very high	4 Å²	4	32 Å²	32	4%	0.041	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	79.2	-158.8	172.2	0	0	0	0	0	114.4	P18 T19 I21 P122	P18-G94 CarbonylContact C-O 3.52Å; P18-G94 VanDerWaalsContact CA-O 3.32Å; P18-G94 WeakPolarHBondContact CA-O 3.43Å; T19-G94 PolarHBondContact N-O 3Å; T19-G94 WeakPolarHBondContact O-CA 3.49Å; T19-G94 PolarHBondContact O-N 3.17Å; T19-G94 PolarHBondContact OG1-N 3.01Å; T19-G94 PolarHBondContact OG1-O 3.29Å; I21-G94 VanDerWaalsContact CG2-CA 3.48Å; G94-P122 CarbonylContact C-O 3.56Å; G94-P122 WeakPolarHBondContact CA-O 3.18Å
95	T	97.3	Very high	95.8	Very high	35 Å²	35	30.7 Å²	30.7	22%	0.215	16%	0.159	C	C	.	.	S	Bend	trans	-82.4	124	-176.4	-63	0	0	0	0	110.3	P18 I98 P122	P18-T95 HydrophobicContact CG-CG2 4.17Å; T95-I98 HydrophobicContact CG2-CG1 4.41Å; T95-P122 PolarHBondContact N-O 3.31Å; T95-P122 PolarHBondContact OG1-O 3.46Å
96	P	96.4	Very high	95.7	Very high	4 Å²	4	29.9 Å²	29.9	3%	0.026	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	155.6	179.8	-25.5	32.7	0	0	0	114.4	I16 L89 S91 I98	I16-P96 HydrophobicContact CG2-CB 3.81Å; I16-P96 HydrophobicContact CG2-CG 3.9Å; L89-P96 HydrophobicContact CD2-CB 4.17Å; L89-P96 HydrophobicContact CG-CB 4.15Å; L89-P96 WeakPolarHBondContact O-CG 3.49Å; S91-P96 VanDerWaalsContact OG-CA 3.28Å; S91-P96 WeakPolarHBondContact OG-CA 3.17Å; P96-I98 PolarHBondContact O-N 2.74Å
97	L	94.3	Very high	95.6	Very high	51 Å²	51	33.4 Å²	33.4	27%	0.267	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	-6.1	-176.7	-62.6	78.2	0	0	0	116	I16 L89 N99 D100 V106	I16-L97 HydrophobicContact CD1-CD1 4.42Å; I16-L97 HydrophobicContact CG2-CD1 4.23Å; L89-L97 HydrophobicContact CD2-CD1 3.56Å; L97-N99 PolarHBondContact O-N 2.77Å; L97-D100 WeakPolarHBondContact CA-O 3.22Å; L97-V106 HydrophobicContact CD1-CG2 4.03Å; L97-V106 HydrophobicContact CD2-CB 3.96Å; L97-V106 HydrophobicContact CD2-CG1 4.47Å; L97-V106 HydrophobicContact CD2-CG2 3.68Å; L97-V106 HydrophobicContact CG-CG2 4.46Å
98	I	95	Very high	95.5	Very high	65 Å²	65	35.2 Å²	35.2	33%	0.333	18%	0.178	S	C	.	.	S	Bend	trans	-92.1	92.5	178.8	-52.7	-55.6	0	0	0	109.1	T95 P96 D100 Y141	T95-I98 HydrophobicContact CG2-CG1 4.41Å; P96-I98 PolarHBondContact O-N 2.74Å; I98-D100 PolarHBondContact O-N 3.2Å; I98-Y141 HydrophobicContact CG2-CE1 3.87Å; I98-Y141 HydrophobicContact CG2-CE2 4.49Å
99	N	93	Very high	95.4	Very high	75 Å²	75	35.2 Å²	35.2	40%	0.401	18%	0.178	S	C	.	.	S	Bend	trans	62.3	18.7	-167	-84.7	-14.9	0	0	0	114.6	L97 Y141 G143 F144 Y169	L97-N99 PolarHBondContact O-N 2.77Å; N99-Y141 PolarHBondContact ND2-OH 2.99Å; N99-G143 WeakPolarHBondContact ND2-CA 3.43Å; N99-F144 HydrophobicContact CB-CE2 4.33Å; N99-F144 WeakPolarHBondContact ND2-CD2 3.44Å; N99-Y169 HydrophobicContact CB-CD2 4.41Å; N99-Y169 HydrophobicContact CB-CE2 4.46Å
100	D	92.5	Very high	95.3	Very high	44 Å²	44	43.2 Å²	43.2	24%	0.235	21%	0.208	C	C	.	.	S	Bend	trans	-125.1	162.3	-179.7	-61.7	-30.7	0	0	0	111.4	S91 L97 I98	S91-D100 WeakPolarHBondContact CB-OD2 3.43Å; S91-D100 VanDerWaalsContact OG-CB 3.23Å; S91-D100 WeakPolarHBondContact OG-CB 3.18Å; S91-D100 PolarHBondContact OG-OD2 3.01Å; L97-D100 WeakPolarHBondContact CA-O 3.22Å; I98-D100 PolarHBondContact O-N 3.2Å
101	P	90.6	Very high	95.2	Very high	10 Å²	10	49.4 Å²	49.4	7%	0.065	24%	0.237	C	C	.	.	S	Bend	trans	-54.8	160.7	170.9	13.1	-26.1	0	0	0	114.1	E44 D67	E44-P101 HydrophobicContact CB-CG 4.13Å; E44-P101 HydrophobicContact CG-CG 3.89Å; D67-P101 WeakPolarHBondContact OD1-CA 3.38Å; D67-P101 WeakPolarHBondContact OD1-CB 3.29Å
102	G	93.4	Very high	95.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.			trans	123.6	-9.5	168.7	0	0	0	0	0	114.5	E70 H104 L105 V106	E70-G102 WeakPolarHBondContact OE1-CA 3.41Å; E70-G102 PolarHBondContact OE1-N 3.38Å; G102-H104 VanDerWaalsContact C-N 3.33Å; G102-H104 PolarHBondContact O-N 2.9Å; G102-L105 PolarHBondContact O-N 3.4Å; G102-V106 WeakPolarHBondContact O-CG2 3.49Å; G102-V106 PolarHBondContact O-N 3.44Å
103	Y	94.1	Very high	95.3	Very high	125 Å²	125	51.4 Å²	51.4	49%	0.49	26%	0.263	S	S	.	.	H	α-helix	trans	-54.3	-48.2	177	168.7	-100.5	0	0	0	112	E70 V106 R107	E70-Y103 PolarHBondContact OE1-N 3.23Å; Y103-V106 PolarHBondContact O-N 2.91Å; Y103-R107 WeakPolarHBondContact O-CB 3.33Å; Y103-R107 PolarHBondContact O-N 3.41Å; Y103-R107 PolarHBondContact OH-NH1 3.45Å
104	H	93.8	Very high	95.4	Very high	62 Å²	62	50 Å²	50	29%	0.287	25%	0.251	S	S	.	.	H	α-helix	trans	-67.2	-40.4	-178.5	-75.2	-62.4	0	0	0	111.2	E70 G102 R107 T108	E70-H104 HydrophobicContact CG-CB 4.09Å; E70-H104 PolarHBondContact OE1-N 3.16Å; E70-H104 IonicContact OE2-CD2 3.88Å; E70-H104 PolarHBondContact OE2-CD2 3.41Å; E70-H104 VanDerWaalsContact OE2-CD2 3.25Å; E70-H104 IonicContact OE2-CG 3.66Å; G102-H104 VanDerWaalsContact C-N 3.33Å; G102-H104 PolarHBondContact O-N 2.9Å; H104-R107 PolarHBondContact O-N 2.91Å; H104-T108 VanDerWaalsContact O-CB 3.3Å; H104-T108 WeakPolarHBondContact O-CB 3.3Å; H104-T108 PolarHBondContact O-N 3.4Å; H104-T108 PolarHBondContact O-OG1 3.45Å
105	L	96	Very high	95.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-50.4	175.6	174.7	61.9	0	0	0	111.8	L14 L65 A74 L77 L89 G102 R107 T108 C109	L14-L105 HydrophobicContact CD1-CD2 4.05Å; L14-L105 HydrophobicContact CD2-CD2 4.17Å; L14-L105 HydrophobicContact CD2-CG 3.93Å; L65-L105 HydrophobicContact CD2-CD2 4.08Å; A74-L105 HydrophobicContact CB-CB 4.19Å; A74-L105 HydrophobicContact CB-CD1 4.22Å; L77-L105 HydrophobicContact CB-CD1 3.81Å; L77-L105 HydrophobicContact CD1-CD1 4.06Å; L77-L105 HydrophobicContact CD1-CD2 3.72Å; L89-L105 HydrophobicContact CD1-CD2 4.4Å; L89-L105 HydrophobicContact CD2-CD2 4.46Å; G102-L105 PolarHBondContact O-N 3.4Å; L105-R107 VanDerWaalsContact C-N 3.34Å; L105-R107 PolarHBondContact O-N 3.01Å; L105-T108 PolarHBondContact O-N 2.95Å; L105-C109 WeakPolarHBondContact O-CB 3.48Å; L105-C109 PolarHBondContact O-N 2.94Å; L105-C109 PolarHBondContact O-SG 3.17Å
106	V	97	Very high	95.4	Very high	23 Å²	23	56.2 Å²	56.2	14%	0.139	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-44	179.6	169.1	0	0	0	0	110.8	L14 I16 L97 G102 Y103 C109 R110 V116	L14-V106 HydrophobicContact CD2-CG2 4.05Å; I16-V106 HydrophobicContact CD1-CG2 3.67Å; L97-V106 HydrophobicContact CD1-CG2 4.03Å; L97-V106 HydrophobicContact CD2-CB 3.96Å; L97-V106 HydrophobicContact CD2-CG1 4.47Å; L97-V106 HydrophobicContact CD2-CG2 3.68Å; L97-V106 HydrophobicContact CG-CG2 4.46Å; G102-V106 WeakPolarHBondContact O-CG2 3.49Å; G102-V106 PolarHBondContact O-N 3.44Å; Y103-V106 PolarHBondContact O-N 2.91Å; V106-C109 PolarHBondContact O-N 3.27Å; V106-R110 HydrophobicContact CG1-CG 4.41Å; V106-R110 WeakPolarHBondContact O-CB 3.44Å; V106-R110 VanDerWaalsContact O-CG 3.24Å; V106-R110 WeakPolarHBondContact O-CG 3.2Å; V106-R110 PolarHBondContact O-N 3.34Å; V106-V116 HydrophobicContact CG1-CG1 4.27Å; V106-V116 HydrophobicContact CG2-CG1 4.49Å
107	R	96.4	Very high	95.5	Very high	121 Å²	121	56.7 Å²	56.7	46%	0.457	28%	0.275	S	S	.	.	H	α-helix	trans	-60	-52.5	177.6	-180	171.2	-179.2	165.5	-3.5	111.7	Y103 H104 L105 C109 R110 E111	Y103-R107 WeakPolarHBondContact O-CB 3.33Å; Y103-R107 PolarHBondContact O-N 3.41Å; Y103-R107 PolarHBondContact OH-NH1 3.45Å; H104-R107 PolarHBondContact O-N 2.91Å; L105-R107 VanDerWaalsContact C-N 3.34Å; L105-R107 PolarHBondContact O-N 3.01Å; R107-C109 VanDerWaalsContact C-N 3.32Å; R107-C109 PolarHBondContact O-N 3.49Å; R107-R110 PolarHBondContact O-N 3.45Å; R107-R110 VanDerWaalsContact O-N 3.15Å; R107-E111 HydrophobicContact CG-CG 4.42Å; R107-E111 WeakPolarHBondContact CG-OE1 3.46Å; R107-E111 IonicContact CZ-OE1 3.98Å; R107-E111 IonicContact NE-OE1 2.76Å; R107-E111 PolarHBondContact NE-OE1 3.41Å; R107-E111 IonicContact NH2-OE1 3.92Å; R107-E111 WeakPolarHBondContact O-CG 3.44Å; R107-E111 PolarHBondContact O-N 3.22Å
108	T	95.6	Very high	95.7	Very high	38 Å²	38	58.5 Å²	58.5	23%	0.233	29%	0.29	C	S	.	.	H	α-helix	trans	-58.9	-42.5	179.2	-65.8	0	0	0	0	111.6	L78 H104 L105 R110 E111 A112	L78-T108 HydrophobicContact CB-CG2 4.36Å; L78-T108 HydrophobicContact CD2-CG2 3.64Å; L78-T108 HydrophobicContact CG-CG2 4.48Å; H104-T108 VanDerWaalsContact O-CB 3.3Å; H104-T108 WeakPolarHBondContact O-CB 3.3Å; H104-T108 PolarHBondContact O-N 3.4Å; H104-T108 PolarHBondContact O-OG1 3.45Å; L105-T108 PolarHBondContact O-N 2.95Å; T108-R110 PolarHBondContact O-N 3.25Å; T108-E111 PolarHBondContact O-N 2.81Å; T108-A112 WeakPolarHBondContact O-CB 3.06Å; T108-A112 PolarHBondContact O-N 3.48Å
109	C	97	Very high	95.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-46.4	174.6	-71.7	0	0	0	0	112.2	L14 L105 V106 R107 A112 G113 I114 V116	L14-C109 HydrophobicContact CD2-CB 4.29Å; L105-C109 WeakPolarHBondContact O-CB 3.48Å; L105-C109 PolarHBondContact O-N 2.94Å; L105-C109 PolarHBondContact O-SG 3.17Å; V106-C109 PolarHBondContact O-N 3.27Å; R107-C109 VanDerWaalsContact C-N 3.32Å; R107-C109 PolarHBondContact O-N 3.49Å; C109-A112 CarbonylContact O-C 3.55Å; C109-A112 PolarHBondContact O-N 3.13Å; C109-G113 PolarHBondContact O-N 3Å; C109-G113 VanDerWaalsContact O-N 3.15Å; C109-I114 HydrophobicContact CB-CB 3.93Å; C109-I114 HydrophobicContact CB-CG2 4.19Å; C109-I114 WeakPolarHBondContact O-CB 3.13Å; C109-I114 PolarHBondContact O-N 2.67Å; C109-V116 HydrophobicContact CB-CG2 3.96Å
110	R	96.8	Very high	96.1	Very high	172 Å²	172	56.7 Å²	56.7	65%	0.649	29%	0.286	S	S	*	.	H	α-helix	trans	-65	-40.2	179.1	-71	-178.3	68	72.1	5.9	112.5	V106 R107 T108 A112 G113 V116	V106-R110 HydrophobicContact CG1-CG 4.41Å; V106-R110 WeakPolarHBondContact O-CB 3.44Å; V106-R110 VanDerWaalsContact O-CG 3.24Å; V106-R110 WeakPolarHBondContact O-CG 3.2Å; V106-R110 PolarHBondContact O-N 3.34Å; R107-R110 PolarHBondContact O-N 3.45Å; R107-R110 VanDerWaalsContact O-N 3.15Å; T108-R110 PolarHBondContact O-N 3.25Å; R110-A112 VanDerWaalsContact C-N 3.29Å; R110-A112 PolarHBondContact O-N 3.22Å; R110-G113 PolarHBondContact O-N 2.85Å; R110-V116 HydrophobicContact CG-CG2 3.85Å
111	E	96.9	Very high	96.3	Very high	132 Å²	132	56.2 Å²	56.2	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-65.3	-33.6	176.5	-72.8	173.8	-180	0	0	111.6	R107 T108 G113	R107-E111 HydrophobicContact CG-CG 4.42Å; R107-E111 WeakPolarHBondContact CG-OE1 3.46Å; R107-E111 IonicContact CZ-OE1 3.98Å; R107-E111 IonicContact NE-OE1 2.76Å; R107-E111 PolarHBondContact NE-OE1 3.41Å; R107-E111 IonicContact NH2-OE1 3.92Å; R107-E111 WeakPolarHBondContact O-CG 3.44Å; R107-E111 PolarHBondContact O-N 3.22Å; T108-E111 PolarHBondContact O-N 2.81Å; E111-G113 VanDerWaalsContact C-N 3.34Å
112	A	96.3	Very high	96.7	Very high	38 Å²	38	56.4 Å²	56.4	31%	0.314	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	0.3	176.1	0	0	0	0	0	114.8	L78 T108 C109 R110 I114	L78-A112 HydrophobicContact CD1-CB 3.66Å; L78-A112 HydrophobicContact CD2-CB 3.93Å; L78-A112 HydrophobicContact CG-CB 4.45Å; T108-A112 WeakPolarHBondContact O-CB 3.06Å; T108-A112 PolarHBondContact O-N 3.48Å; C109-A112 CarbonylContact O-C 3.55Å; C109-A112 PolarHBondContact O-N 3.13Å; R110-A112 VanDerWaalsContact C-N 3.29Å; R110-A112 PolarHBondContact O-N 3.22Å; A112-I114 VanDerWaalsContact C-N 3.31Å; A112-I114 HydrophobicContact CB-CG1 4.48Å; A112-I114 PolarHBondContact O-N 3.39Å
113	G	96.1	Very high	96.9	Very high	45 Å²	45	57.6 Å²	57.6	46%	0.464	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	6.9	-179.3	0	0	0	0	0	115.3	C109 R110 E111	C109-G113 PolarHBondContact O-N 3Å; C109-G113 VanDerWaalsContact O-N 3.15Å; R110-G113 PolarHBondContact O-N 2.85Å; E111-G113 VanDerWaalsContact C-N 3.34Å
114	I	97.5	Very high	97.1	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.031	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-65.8	134.8	173.5	-61.5	-61	0	0	0	109.8	Q11 L78 L81 Q82 C109 A112 V116	Q11-I114 HydrophobicContact CB-CD1 4.1Å; Q11-I114 HydrophobicContact CG-CD1 4.43Å; L78-I114 HydrophobicContact CD1-CD1 4.36Å; L78-I114 HydrophobicContact CD1-CG1 3.57Å; L81-I114 HydrophobicContact CB-CD1 4Å; L81-I114 HydrophobicContact CB-CG1 4.25Å; L81-I114 HydrophobicContact CB-CG2 4.25Å; L81-I114 HydrophobicContact CD1-CG2 4.23Å; L81-I114 HydrophobicContact CD2-CG2 4.1Å; L81-I114 HydrophobicContact CG-CG2 4.43Å; Q82-I114 HydrophobicContact CG-CD1 4.11Å; C109-I114 HydrophobicContact CB-CB 3.93Å; C109-I114 HydrophobicContact CB-CG2 4.19Å; C109-I114 WeakPolarHBondContact O-CB 3.13Å; C109-I114 PolarHBondContact O-N 2.67Å; A112-I114 VanDerWaalsContact C-N 3.31Å; A112-I114 HydrophobicContact CB-CG1 4.48Å; A112-I114 PolarHBondContact O-N 3.39Å; I114-V116 PolarHBondContact O-N 2.8Å
115	R	97.4	Very high	97.3	Very high	141 Å²	141	49.8 Å²	49.8	53%	0.532	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-69.8	119	176.6	-171.8	-176.7	-179.7	-168.7	1.6	110.1	Q13 L14 V117	Q13-R115 HydrophobicContact CG-CB 4.18Å; L14-R115 PolarHBondContact N-O 3.36Å; R115-V117 HydrophobicContact CG-CG2 3.86Å
116	V	98.2	Very high	97.4	Very high	28 Å²	28	53.8 Å²	53.8	17%	0.17	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.5	171.2	-176.7	0	0	0	0	109.2	L14 I16 V106 C109 R110 I114	L14-V116 HydrophobicContact CB-CG2 4.47Å; L14-V116 HydrophobicContact CD2-CG2 4.31Å; L14-V116 CarbonylContact O-C 3.52Å; L14-V116 WeakPolarHBondContact O-CA 3.1Å; I16-V116 HydrophobicContact CD1-CG1 4.02Å; I16-V116 HydrophobicContact CG1-CG1 3.83Å; V106-V116 HydrophobicContact CG1-CG1 4.27Å; V106-V116 HydrophobicContact CG2-CG1 4.49Å; C109-V116 HydrophobicContact CB-CG2 3.96Å; R110-V116 HydrophobicContact CG-CG2 3.85Å; I114-V116 PolarHBondContact O-N 2.8Å
117	V	98.2	Very high	97.5	Very high	14 Å²	14	55 Å²	55	9%	0.085	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	101.8	-174.7	-176.1	0	0	0	0	109.6	L14 Y15 I16 R115 L119	L14-V117 PolarHBondContact O-N 2.75Å; Y15-V117 WeakPolarHBondContact CA-O 3.23Å; Y15-V117 HydrophobicContact CD1-CB 3.75Å; Y15-V117 HydrophobicContact CD1-CG1 3.91Å; Y15-V117 HydrophobicContact CD1-CG2 4.39Å; Y15-V117 HydrophobicContact CE1-CB 4.02Å; Y15-V117 HydrophobicContact CE1-CG1 4.03Å; Y15-V117 HydrophobicContact CE1-CG2 4.22Å; Y15-V117 HydrophobicContact CG-CB 4.5Å; I16-V117 PolarHBondContact N-O 2.96Å; R115-V117 HydrophobicContact CG-CG2 3.86Å; V117-L119 HydrophobicContact CG1-CD1 4.39Å
118	P	98.2	Very high	97.6	Very high	90 Å²	90	49.2 Å²	49.2	58%	0.584	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	142.2	173.5	30.6	-33.7	0	0	0	111.5
119	L	98.6	Very high	97.7	Very high	10 Å²	10	47.9 Å²	47.9	5%	0.052	27%	0.27	C	S	.	.			trans	-105.9	142.5	166.9	-81.5	66.8	0	0	0	109.7	Y15 I16 V17 P18 R30 A31 V34 V117	Y15-L119 HydrophobicContact CD1-CD1 4.13Å; I16-L119 WeakPolarHBondContact O-CB 3.21Å; I16-L119 PolarHBondContact O-N 3.31Å; V17-L119 HydrophobicContact CG1-CD2 4.45Å; V17-L119 HydrophobicContact CG2-CD2 4.34Å; P18-L119 WeakPolarHBondContact CD-O 3.12Å; P18-L119 WeakPolarHBondContact CG-O 3.2Å; R30-L119 HydrophobicContact CB-CD2 4.46Å; R30-L119 HydrophobicContact CG-CD2 3.96Å; R30-L119 HydrophobicContact CG-CG 4.35Å; A31-L119 HydrophobicContact CB-CD2 4.1Å; V34-L119 HydrophobicContact CB-CD2 4.37Å; V34-L119 HydrophobicContact CG2-CD2 4.06Å; V117-L119 HydrophobicContact CG1-CD1 4.39Å
120	P	97.7	Very high	97.8	Very high	92 Å²	92	52.5 Å²	52.5	60%	0.597	30%	0.302	S	S	*	.			trans	-70.6	151.7	166.6	31.9	-34.2	0	0	0	110.3
121	G	97.3	Very high	97.8	Very high	34 Å²	34	46.9 Å²	46.9	35%	0.351	29%	0.293	S	S	.	.			trans	169.9	-162.3	176.7	0	0	0	0	0	113.3
122	P	97.9	Very high	97.9	Very high	14 Å²	14	41.1 Å²	41.1	9%	0.091	27%	0.268	C	S	.	.			trans	-60.1	139.6	-170.6	-26.8	36.9	0	0	0	113.9	T19 I21 D26 G94 T95	T19-P122 WeakPolarHBondContact O-CB 3.23Å; T19-P122 WeakPolarHBondContact O-CG 3.46Å; I21-P122 HydrophobicContact CG1-CB 4.46Å; I21-P122 HydrophobicContact CG2-CB 4.12Å; D26-P122 HydrophobicContact CB-CG 3.91Å; D26-P122 VanDerWaalsContact O-CG 3.28Å; D26-P122 WeakPolarHBondContact O-CG 3.39Å; G94-P122 CarbonylContact C-O 3.56Å; G94-P122 WeakPolarHBondContact CA-O 3.18Å; T95-P122 PolarHBondContact N-O 3.31Å; T95-P122 PolarHBondContact OG1-O 3.46Å
123	C	97.6	Very high	98	Very high	24 Å²	24	43.1 Å²	43.1	16%	0.162	29%	0.292	C	S	.	.			trans	-151.5	111.7	175.4	178	0	0	0	0	109.4	A125 I126 T127	C123-A125 VanDerWaalsContact C-N 3.3Å; C123-A125 PolarHBondContact O-N 3.4Å; C123-I126 HydrophobicContact CB-CB 4.26Å; C123-I126 HydrophobicContact CB-CG1 4.27Å; C123-I126 PolarHBondContact O-N 3.47Å; C123-I126 VanDerWaalsContact O-N 3.16Å; C123-T127 PolarHBondContact O-N 3.06Å; C123-T127 PolarHBondContact O-OG1 2.99Å; C123-T127 VanDerWaalsContact O-OG1 3.06Å
124	A	97.9	Very high	98.1	Very high	20 Å²	20	41.7 Å²	41.7	17%	0.165	27%	0.274	C	S	.	.	H	α-helix	trans	-57.9	-41	-174	0	0	0	0	0	112.8	I21 I126 T127 A128 Y169 L198 V229	I21-A124 HydrophobicContact CD1-CB 3.97Å; A124-I126 PolarHBondContact O-N 2.96Å; A124-T127 PolarHBondContact O-N 2.89Å; A124-A128 VanDerWaalsContact O-CB 3.26Å; A124-A128 WeakPolarHBondContact O-CB 3.37Å; A124-A128 PolarHBondContact O-N 2.67Å; A124-Y169 HydrophobicContact CB-CE1 4.16Å; A124-L198 HydrophobicContact CB-CD1 4.36Å; A124-L198 WeakPolarHBondContact O-CD1 3.4Å; A124-V229 HydrophobicContact CB-CG2 3.97Å
125	A	98.3	Very high	98.1	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-56.8	-48.5	176.4	0	0	0	0	0	112.8	C123 L129 Y141 I167 Y169	C123-A125 VanDerWaalsContact C-N 3.3Å; C123-A125 PolarHBondContact O-N 3.4Å; A125-L129 WeakPolarHBondContact O-CB 3.4Å; A125-L129 PolarHBondContact O-N 3.34Å; A125-Y141 HydrophobicContact CB-CD2 4.09Å; A125-Y141 HydrophobicContact CB-CE2 4.05Å; A125-I167 HydrophobicContact CB-CG2 3.86Å; A125-Y169 HydrophobicContact CB-CE1 3.86Å; A125-Y169 PolarHBondContact N-OH 2.91Å
126	I	98.2	Very high	98.1	Very high	84 Å²	84	41.5 Å²	41.5	43%	0.431	29%	0.293	S	S	.	.	H	α-helix	trans	-74	-40	-177.7	-59.9	-57.4	0	0	0	111.1	C123 A124 A128 L129 S130 F139	C123-I126 HydrophobicContact CB-CB 4.26Å; C123-I126 HydrophobicContact CB-CG1 4.27Å; C123-I126 PolarHBondContact O-N 3.47Å; C123-I126 VanDerWaalsContact O-N 3.16Å; A124-I126 PolarHBondContact O-N 2.96Å; I126-A128 PolarHBondContact O-N 2.93Å; I126-L129 PolarHBondContact O-N 3.29Å; I126-S130 WeakPolarHBondContact O-CB 3.34Å; I126-S130 PolarHBondContact O-N 3.42Å; I126-S130 PolarHBondContact O-OG 3.21Å; I126-F139 HydrophobicContact CD1-CE2 4.09Å; I126-F139 HydrophobicContact CD1-CZ 3.78Å
127	T	98.5	Very high	98.1	Very high	47 Å²	47	46.4 Å²	46.4	29%	0.288	32%	0.318	S	S	.	.	H	α-helix	trans	-57.5	-49.1	173.7	-58.4	0	0	0	0	110.6	C123 A124 S130 A131 L198	C123-T127 PolarHBondContact O-N 3.06Å; C123-T127 PolarHBondContact O-OG1 2.99Å; C123-T127 VanDerWaalsContact O-OG1 3.06Å; A124-T127 PolarHBondContact O-N 2.89Å; T127-S130 PolarHBondContact O-N 2.78Å; T127-S130 PolarHBondContact O-OG 3.28Å; T127-A131 PolarHBondContact O-N 2.78Å; T127-L198 HydrophobicContact CG2-CD1 4.44Å; T127-L198 HydrophobicContact CG2-CD2 4.34Å
128	A	98.7	Very high	98	Very high	0 Å²	0	53 Å²	53	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-59.3	-51.4	176.3	0	0	0	0	0	112.4	A124 I126 S130 A131 A132 A195 L198 V229 I231	A124-A128 VanDerWaalsContact O-CB 3.26Å; A124-A128 WeakPolarHBondContact O-CB 3.37Å; A124-A128 PolarHBondContact O-N 2.67Å; I126-A128 PolarHBondContact O-N 2.93Å; A128-S130 VanDerWaalsContact C-N 3.27Å; A128-S130 PolarHBondContact O-N 3.43Å; A128-A131 PolarHBondContact O-N 3.24Å; A128-A131 VanDerWaalsContact O-N 3.14Å; A128-A132 WeakPolarHBondContact O-CB 3.47Å; A128-A132 PolarHBondContact O-N 2.96Å; A128-A195 HydrophobicContact CB-CB 3.78Å; A128-L198 HydrophobicContact CB-CD1 3.88Å; A128-V229 HydrophobicContact CB-CB 3.76Å; A128-V229 HydrophobicContact CB-CG1 3.69Å; A128-V229 HydrophobicContact CB-CG2 4.18Å; A128-I231 HydrophobicContact CB-CD1 3.82Å; A128-I231 HydrophobicContact CB-CG1 4.05Å
129	L	98.7	Very high	98	Very high	10 Å²	10	52.4 Å²	52.4	5%	0.052	33%	0.33	C	S	.	.	H	α-helix	trans	-57.2	-42	-179.2	179.5	65.9	0	0	0	111.5	A125 I126 A131 A132 F139 T165 I167 I231	A125-L129 WeakPolarHBondContact O-CB 3.4Å; A125-L129 PolarHBondContact O-N 3.34Å; I126-L129 PolarHBondContact O-N 3.29Å; L129-A131 PolarHBondContact O-N 2.85Å; L129-A132 PolarHBondContact O-N 2.97Å; L129-F139 HydrophobicContact CD2-CB 4.36Å; L129-F139 HydrophobicContact CD2-CD1 3.58Å; L129-F139 HydrophobicContact CD2-CD2 4.38Å; L129-F139 HydrophobicContact CD2-CE1 3.87Å; L129-F139 HydrophobicContact CD2-CG 3.86Å; L129-F139 HydrophobicContact CD2-CZ 4.39Å; L129-T165 HydrophobicContact CD1-CG2 3.8Å; L129-I167 HydrophobicContact CB-CD1 4.06Å; L129-I167 HydrophobicContact CD1-CD1 4.37Å; L129-I167 HydrophobicContact CD2-CD1 4.08Å; L129-I167 HydrophobicContact CG-CD1 4.39Å; L129-I231 HydrophobicContact CB-CD1 4.41Å; L129-I231 HydrophobicContact CD1-CG2 3.96Å
130	S	98.2	Very high	98	Very high	97 Å²	97	52.3 Å²	52.3	68%	0.678	33%	0.33	S	S	*	.	H	α-helix	trans	-63.6	-24.1	-178.2	75.5	0	0	0	0	113.9	I126 T127 A128	I126-S130 WeakPolarHBondContact O-CB 3.34Å; I126-S130 PolarHBondContact O-N 3.42Å; I126-S130 PolarHBondContact O-OG 3.21Å; T127-S130 PolarHBondContact O-N 2.78Å; T127-S130 PolarHBondContact O-OG 3.28Å; A128-S130 VanDerWaalsContact C-N 3.27Å; A128-S130 PolarHBondContact O-N 3.43Å
131	A	98.3	Very high	98	Very high	54 Å²	54	51.5 Å²	51.5	45%	0.446	32%	0.315	S	S	.	.	H	α-helix	trans	-104	-6.4	179.1	0	0	0	0	0	113.6	T127 A128 L129 G133 I205	T127-A131 PolarHBondContact O-N 2.78Å; A128-A131 PolarHBondContact O-N 3.24Å; A128-A131 VanDerWaalsContact O-N 3.14Å; L129-A131 PolarHBondContact O-N 2.85Å; A131-G133 PolarHBondContact O-N 2.87Å; A131-I205 HydrophobicContact CB-CD1 3.56Å
132	A	98.5	Very high	98	Very high	11 Å²	11	53.9 Å²	53.9	9%	0.091	32%	0.317	C	S	.	.	S	Bend	trans	-74.9	-19.4	-172	0	0	0	0	0	114.5	A128 L129 L134 V193 I231	A128-A132 WeakPolarHBondContact O-CB 3.47Å; A128-A132 PolarHBondContact O-N 2.96Å; L129-A132 PolarHBondContact O-N 2.97Å; A132-L134 HydrophobicContact CB-CB 4.47Å; A132-L134 PolarHBondContact O-N 3.28Å; A132-V193 HydrophobicContact CB-CB 4.17Å; A132-V193 HydrophobicContact CB-CG1 4.23Å; A132-V193 HydrophobicContact CB-CG2 4.04Å; A132-I231 HydrophobicContact CB-CB 4.08Å; A132-I231 HydrophobicContact CB-CG1 4.05Å; A132-I231 HydrophobicContact CB-CG2 4Å
133	G	98	Very high	98	Very high	80 Å²	80	53.3 Å²	53.3	83%	0.825	31%	0.314	S	S	*	.			trans	67.3	17.4	-174.7	0	0	0	0	0	114.2	A131	A131-G133 PolarHBondContact O-N 2.87Å
134	L	98.1	Very high	98	Very high	16 Å²	16	56.7 Å²	56.7	8%	0.084	33%	0.326	C	S	.	.	S	Bend	trans	-102.4	160.4	175.7	-69.3	179	0	0	0	111.4	A132 S136 T165 Y191 V193 I231 E233	A132-L134 HydrophobicContact CB-CB 4.47Å; A132-L134 PolarHBondContact O-N 3.28Å; L134-S136 PolarHBondContact O-N 2.93Å; L134-T165 HydrophobicContact CB-CG2 4.3Å; L134-T165 HydrophobicContact CD1-CG2 4.45Å; L134-Y191 HydrophobicContact CD1-CD1 4.46Å; L134-Y191 HydrophobicContact CD2-CD1 3.91Å; L134-Y191 HydrophobicContact CD2-CE1 4.41Å; L134-V193 HydrophobicContact CD1-CG2 4.11Å; L134-V193 HydrophobicContact CG-CG2 4.43Å; L134-I231 HydrophobicContact CD1-CB 4.33Å; L134-I231 HydrophobicContact CD1-CG2 3.76Å; L134-E233 HydrophobicContact CD1-CB 4.2Å; L134-E233 HydrophobicContact CD2-CB 3.86Å; L134-E233 HydrophobicContact CD2-CG 3.9Å
135	P	97.7	Very high	97.9	Very high	70 Å²	70	56.1 Å²	56.1	46%	0.455	32%	0.32	S	S	.	.			trans	-53.6	130.1	176.3	-26	35.1	0	0	0	112	T165	P135-T165 VanDerWaalsContact O-CB 3.28Å; P135-T165 WeakPolarHBondContact O-CB 3.35Å; P135-T165 PolarHBondContact O-OG1 3.34Å
136	S	97.7	Very high	97.9	Very high	72 Å²	72	58.7 Å²	58.7	50%	0.503	34%	0.337	S	S	.	.			trans	-125.3	3	-174.5	57.4	0	0	0	0	113.4	L134 R138	L134-S136 PolarHBondContact O-N 2.93Å; S136-R138 VanDerWaalsContact C-N 3.32Å
137	D	96.7	Very high	97.7	Very high	132 Å²	132	57.7 Å²	57.7	71%	0.706	34%	0.341	S	S	*	.	S	Bend	trans	-68.3	-33.4	173.9	64.4	-56.1	0	0	0	111.8
138	R	97.4	Very high	97.6	Very high	151 Å²	151	63.6 Å²	63.6	57%	0.57	36%	0.363	S	S	*	.	S	Bend	trans	-143.3	126.2	174.7	-60.4	178.1	67	-153.7	-1.9	110.2	S136 R164 T165	S136-R138 VanDerWaalsContact C-N 3.32Å; R138-R164 HydrophobicContact CB-CG 3.81Å; R138-T165 PolarHBondContact O-N 3.35Å
139	F	98.4	Very high	97.6	Very high	78 Å²	78	65.4 Å²	65.4	34%	0.342	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	165	178.9	59.5	-89	0	0	0	111.5	I126 L129 T165 I167	I126-F139 HydrophobicContact CD1-CE2 4.09Å; I126-F139 HydrophobicContact CD1-CZ 3.78Å; L129-F139 HydrophobicContact CD2-CB 4.36Å; L129-F139 HydrophobicContact CD2-CD1 3.58Å; L129-F139 HydrophobicContact CD2-CD2 4.38Å; L129-F139 HydrophobicContact CD2-CE1 3.87Å; L129-F139 HydrophobicContact CD2-CG 3.86Å; L129-F139 HydrophobicContact CD2-CZ 4.39Å; F139-T165 CarbonylContact C-O 3.5Å; F139-T165 WeakPolarHBondContact CA-O 3.39Å; F139-T165 VanDerWaalsContact CB-O 3.29Å; F139-T165 WeakPolarHBondContact CB-O 3.3Å; F139-I167 HydrophobicContact CB-CD1 4.47Å; F139-I167 HydrophobicContact CD2-CD1 3.78Å; F139-I167 HydrophobicContact CE2-CD1 4.35Å; F139-I167 HydrophobicContact CG-CD1 4.3Å
140	C	98	Very high	97.6	Very high	8 Å²	8	71.8 Å²	71.8	5%	0.054	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.1	172	-56	0	0	0	0	109.2	E142 R164 T165 L166 I167	C140-E142 HydrophobicContact CB-CG 4.42Å; C140-E142 WeakPolarHBondContact CB-OE1 3.48Å; C140-R164 PolarHBondContact SG-NE 3.32Å; C140-R164 PolarHBondContact SG-NH1 2.92Å; C140-R164 VanDerWaalsContact SG-NH1 3.37Å; C140-R164 PolarHBondContact SG-NH2 3.5Å; C140-T165 PolarHBondContact N-O 3.42Å; C140-L166 HydrophobicContact CB-CD2 3.75Å; C140-L166 CarbonylContact O-C 3.54Å; C140-I167 PolarHBondContact O-N 2.72Å
141	Y	98.1	Very high	97.6	Very high	75 Å²	75	68.5 Å²	68.5	29%	0.294	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.3	167.4	178	-106.4	0	0	0	109	I98 N99 A125 I167 Y169	I98-Y141 HydrophobicContact CG2-CE1 3.87Å; I98-Y141 HydrophobicContact CG2-CE2 4.49Å; N99-Y141 PolarHBondContact ND2-OH 2.99Å; A125-Y141 HydrophobicContact CB-CD2 4.09Å; A125-Y141 HydrophobicContact CB-CE2 4.05Å; Y141-I167 HydrophobicContact CD2-CB 4.26Å; Y141-I167 HydrophobicContact CD2-CG2 4.05Å; Y141-I167 HydrophobicContact CE2-CG2 4.49Å; Y141-Y169 HydrophobicContact CE2-CD1 4.28Å; Y141-Y169 AromaticContact CE2-CE1 3.96Å; Y141-Y169 HydrophobicContact CE2-CE1 3.96Å; Y141-Y169 HydrophobicContact CE2-CE2 4.21Å; Y141-Y169 AromaticContact CE2-CZ 3.92Å; Y141-Y169 WeakPolarHBondContact OH-CD2 3.15Å; Y141-Y169 WeakPolarHBondContact OH-CE2 3.24Å
142	E	97.6	Very high	97.6	Very high	84 Å²	84	66.2 Å²	66.2	39%	0.393	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	0.9	-174.7	-64.1	-60	140.1	0	0	112.4	C140 F144 I159 I167 F168	C140-E142 HydrophobicContact CB-CG 4.42Å; C140-E142 WeakPolarHBondContact CB-OE1 3.48Å; E142-F144 PolarHBondContact O-N 3.01Å; E142-I159 HydrophobicContact CG-CD1 4.28Å; E142-I167 PolarHBondContact N-O 2.85Å; E142-F168 HydrophobicContact CB-CD1 3.51Å; E142-F168 HydrophobicContact CB-CE1 3.24Å; E142-F168 HydrophobicContact CB-CG 4.44Å; E142-F168 HydrophobicContact CB-CZ 3.98Å; E142-F168 HydrophobicContact CG-CD1 4.37Å; E142-F168 HydrophobicContact CG-CE1 3.67Å; E142-F168 HydrophobicContact CG-CZ 3.93Å
143	G	96.9	Very high	97.6	Very high	2 Å²	2	70.2 Å²	70.2	2%	0.021	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	60.9	-130.9	-178.9	0	0	0	0	0	112.5	N99 F168 Y169	N99-G143 WeakPolarHBondContact ND2-CA 3.43Å; G143-F168 CarbonylContact O-C 3.58Å; G143-F168 WeakPolarHBondContact O-CA 3.49Å; G143-Y169 PolarHBondContact O-N 2.82Å
144	F	97.1	Very high	97.6	Very high	95 Å²	95	70 Å²	70	42%	0.417	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	136.5	177.4	-69.4	-81.9	0	0	0	111.4	N99 E142 Y169	N99-F144 HydrophobicContact CB-CE2 4.33Å; N99-F144 WeakPolarHBondContact ND2-CD2 3.44Å; E142-F144 PolarHBondContact O-N 3.01Å; F144-Y169 VanDerWaalsContact CD1-C 3.48Å; F144-Y169 WeakPolarHBondContact CD1-O 3.33Å; F144-Y169 HydrophobicContact CE2-CD2 4.03Å; F144-Y169 VanDerWaalsContact CZ-CB 3.49Å; F144-Y169 HydrophobicContact CZ-CD2 4.1Å; F144-Y169 HydrophobicContact CZ-CG 4.3Å
145	L	96.9	Very high	97.6	Very high	8 Å²	8	71 Å²	71	4%	0.042	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-64.6	150.3	169.8	-73.9	169.8	0	0	0	111.1	A147 R152 A155 L156 F168	L145-A147 PolarHBondContact O-N 3.4Å; L145-R152 HydrophobicContact CB-CG 3.95Å; L145-R152 HydrophobicContact CD1-CG 3.94Å; L145-R152 HydrophobicContact CD2-CG 4.37Å; L145-R152 HydrophobicContact CG-CG 4.31Å; L145-A155 HydrophobicContact CD2-CB 4.46Å; L145-L156 HydrophobicContact CD1-CD2 4.25Å; L145-L156 HydrophobicContact CD2-CD2 4.15Å; L145-L156 HydrophobicContact CD2-CG 4.19Å; L145-F168 HydrophobicContact CD1-CD1 4.26Å; L145-F168 HydrophobicContact CD1-CE1 4.48Å; L145-F168 HydrophobicContact CD2-CD1 3.86Å; L145-F168 HydrophobicContact CD2-CE1 3.58Å; L145-F168 HydrophobicContact CD2-CZ 4.46Å; L145-F168 HydrophobicContact CG-CD1 3.69Å; L145-F168 HydrophobicContact CG-CE1 3.95Å; L145-F168 HydrophobicContact CG-CG 4.43Å
146	P	97.3	Very high	97.6	Very high	58 Å²	58	67.7 Å²	67.7	38%	0.377	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-53.4	138.1	172.9	-27	34	0	0	0	112.1	K148 R152 A155	P146-K148 VanDerWaalsContact C-N 3.31Å; P146-K148 PolarHBondContact O-N 2.86Å; P146-R152 WeakPolarHBondContact O-CB 3.26Å; P146-R152 PolarHBondContact O-NH1 3.25Å; P146-A155 HydrophobicContact CG-CB 4.19Å
147	A	95.6	Very high	97.6	Very high	63 Å²	63	70 Å²	70	52%	0.521	35%	0.347	S	S	.	.	S	Bend	trans	-64.8	-33.8	-174.3	0	0	0	0	0	113.5	L145 R152	L145-A147 PolarHBondContact O-N 3.4Å; A147-R152 PolarHBondContact O-NH1 3.21Å
148	K	96.8	Very high	97.6	Very high	172 Å²	172	67.8 Å²	67.8	75%	0.748	35%	0.347	S	S	*	.	S	Bend	trans	-88.8	133.8	-178.2	-65.1	-176.9	-179.3	178.7	0	110.7	P146 K150 G151 R152	P146-K148 VanDerWaalsContact C-N 3.31Å; P146-K148 PolarHBondContact O-N 2.86Å; K148-K150 VanDerWaalsContact C-N 3.33Å; K148-K150 PolarHBondContact O-N 3.37Å; K148-K150 VanDerWaalsContact O-N 3.16Å; K148-G151 PolarHBondContact O-N 3.25Å; K148-R152 PolarHBondContact O-N 3.02Å
149	S	97.4	Very high	97.6	Very high	38 Å²	38	61.9 Å²	61.9	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-51.8	-41.7	-175	179.5	0	0	0	0	114.9	G151 R152 R153 D181	S149-G151 PolarHBondContact O-N 3.32Å; S149-R152 PolarHBondContact O-N 3.15Å; S149-R153 WeakPolarHBondContact O-CB 3.4Å; S149-R153 WeakPolarHBondContact O-CG 3.28Å; S149-R153 PolarHBondContact O-N 3.33Å; S149-R153 PolarHBondContact OG-NH1 2.81Å; S149-R153 PolarHBondContact OG-NH2 2.82Å; S149-D181 WeakPolarHBondContact CA-OD2 3.41Å; S149-D181 WeakPolarHBondContact CB-OD2 3.44Å; S149-D181 PolarHBondContact OG-OD1 2.88Å; S149-D181 PolarHBondContact OG-OD2 2.78Å
150	K	98.3	Very high	97.5	Very high	143 Å²	143	62.5 Å²	62.5	62%	0.622	33%	0.33	S	S	*	.	H	α-helix	trans	-57.2	-52.6	174.2	178.3	176.5	168.9	52.2	0	112	K148 R152 R153 D154	K148-K150 VanDerWaalsContact C-N 3.33Å; K148-K150 PolarHBondContact O-N 3.37Å; K148-K150 VanDerWaalsContact O-N 3.16Å; K150-R152 VanDerWaalsContact C-N 3.31Å; K150-R152 PolarHBondContact O-N 2.99Å; K150-R153 PolarHBondContact O-N 3.46Å; K150-D154 WeakPolarHBondContact CG-OD2 3.29Å; K150-D154 IonicContact NZ-OD2 3.61Å; K150-D154 PolarHBondContact NZ-OD2 2.81Å; K150-D154 VanDerWaalsContact NZ-OD2 3.11Å; K150-D154 WeakPolarHBondContact O-CB 3.38Å; K150-D154 PolarHBondContact O-N 2.65Å
151	G	98.2	Very high	97.2	Very high	29 Å²	29	65.4 Å²	65.4	30%	0.299	36%	0.355	S	S	.	.	H	α-helix	trans	-63.9	-37.9	179.7	0	0	0	0	0	112.1	K148 S149 D154 A155	K148-G151 PolarHBondContact O-N 3.25Å; S149-G151 PolarHBondContact O-N 3.32Å; G151-D154 PolarHBondContact O-N 3.27Å; G151-A155 WeakPolarHBondContact O-CB 3.11Å; G151-A155 PolarHBondContact O-N 2.86Å
152	R	98.2	Very high	97.2	Very high	5 Å²	5	63.5 Å²	63.5	2%	0.019	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-49.2	176.3	-176.3	160.5	56.4	-111.8	-2.5	112.1	L145 P146 A147 K148 S149 K150 A155 L156 D177 D181	L145-R152 HydrophobicContact CB-CG 3.95Å; L145-R152 HydrophobicContact CD1-CG 3.94Å; L145-R152 HydrophobicContact CD2-CG 4.37Å; L145-R152 HydrophobicContact CG-CG 4.31Å; P146-R152 WeakPolarHBondContact O-CB 3.26Å; P146-R152 PolarHBondContact O-NH1 3.25Å; A147-R152 PolarHBondContact O-NH1 3.21Å; K148-R152 PolarHBondContact O-N 3.02Å; S149-R152 PolarHBondContact O-N 3.15Å; K150-R152 VanDerWaalsContact C-N 3.31Å; K150-R152 PolarHBondContact O-N 2.99Å; R152-A155 PolarHBondContact O-N 2.81Å; R152-L156 HydrophobicContact CG-CD1 4Å; R152-L156 WeakPolarHBondContact O-CG 3.47Å; R152-L156 PolarHBondContact O-N 2.91Å; R152-D177 PolarHBondContact NE-O 2.98Å; R152-D177 PolarHBondContact NH2-O 3.24Å; R152-D181 HydrophobicContact CG-CB 4.2Å; R152-D181 IonicContact CZ-OD2 2.73Å; R152-D181 IonicContact NE-OD2 2.73Å; R152-D181 PolarHBondContact NE-OD2 3.04Å; R152-D181 IonicContact NH2-OD2 3.12Å; R152-D181 PolarHBondContact NH2-OD2 3.25Å
153	R	98.5	Very high	97.1	Very high	95 Å²	95	63.7 Å²	63.7	36%	0.358	36%	0.357	S	S	.	.	H	α-helix	trans	-65.1	-39.2	176.5	-71.8	-167.8	-70.2	-107.9	0.9	112.6	S149 K150 A155 L156 K157 D181 V185	S149-R153 WeakPolarHBondContact O-CB 3.4Å; S149-R153 WeakPolarHBondContact O-CG 3.28Å; S149-R153 PolarHBondContact O-N 3.33Å; S149-R153 PolarHBondContact OG-NH1 2.81Å; S149-R153 PolarHBondContact OG-NH2 2.82Å; K150-R153 PolarHBondContact O-N 3.46Å; R153-A155 VanDerWaalsContact C-N 3.31Å; R153-A155 PolarHBondContact O-N 2.87Å; R153-L156 PolarHBondContact O-N 3.07Å; R153-K157 WeakPolarHBondContact O-CB 3.35Å; R153-K157 VanDerWaalsContact O-CG 3.25Å; R153-K157 WeakPolarHBondContact O-CG 3.49Å; R153-K157 PolarHBondContact O-N 2.83Å; R153-D181 VanDerWaalsContact CD-OD1 3.25Å; R153-D181 WeakPolarHBondContact CD-OD1 3.39Å; R153-D181 HydrophobicContact CG-CB 3.87Å; R153-D181 VanDerWaalsContact CG-OD1 3.23Å; R153-D181 WeakPolarHBondContact CG-OD1 3.21Å; R153-D181 IonicContact CZ-OD1 2.94Å; R153-D181 IonicContact NE-OD1 2.79Å; R153-D181 IonicContact NH1-OD1 3.87Å; R153-D181 PolarHBondContact NH1-OD1 3.4Å; R153-V185 HydrophobicContact CB-CG2 3.97Å; R153-V185 HydrophobicContact CG-CG2 3.78Å
154	D	98.3	Very high	97.2	Very high	77 Å²	77	67.5 Å²	67.5	41%	0.412	37%	0.371	S	S	.	.	H	α-helix	trans	-63.5	-40	177	-68.2	-16.3	0	0	0	110.3	K150 G151 A158	K150-D154 WeakPolarHBondContact CG-OD2 3.29Å; K150-D154 IonicContact NZ-OD2 3.61Å; K150-D154 PolarHBondContact NZ-OD2 2.81Å; K150-D154 VanDerWaalsContact NZ-OD2 3.11Å; K150-D154 WeakPolarHBondContact O-CB 3.38Å; K150-D154 PolarHBondContact O-N 2.65Å; G151-D154 PolarHBondContact O-N 3.27Å; D154-A158 PolarHBondContact O-N 2.94Å
155	A	98.2	Very high	97.2	Very high	36 Å²	36	63 Å²	63	30%	0.298	35%	0.351	S	S	.	.	H	α-helix	trans	-65.3	-46.5	173	0	0	0	0	0	112.6	L145 P146 G151 R152 R153 K157 A158	L145-A155 HydrophobicContact CD2-CB 4.46Å; P146-A155 HydrophobicContact CG-CB 4.19Å; G151-A155 WeakPolarHBondContact O-CB 3.11Å; G151-A155 PolarHBondContact O-N 2.86Å; R152-A155 PolarHBondContact O-N 2.81Å; R153-A155 VanDerWaalsContact C-N 3.31Å; R153-A155 PolarHBondContact O-N 2.87Å; A155-K157 VanDerWaalsContact C-N 3.35Å; A155-K157 PolarHBondContact O-N 2.82Å; A155-A158 WeakPolarHBondContact O-CB 3.28Å; A155-A158 PolarHBondContact O-N 2.96Å
156	L	98.5	Very high	97.3	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.8	-40.3	177.6	-72.6	166.6	0	0	0	112.3	L145 R152 R153 A158 I159 E160 D181 I182 V185 L186	L145-L156 HydrophobicContact CD1-CD2 4.25Å; L145-L156 HydrophobicContact CD2-CD2 4.15Å; L145-L156 HydrophobicContact CD2-CG 4.19Å; R152-L156 HydrophobicContact CG-CD1 4Å; R152-L156 WeakPolarHBondContact O-CG 3.47Å; R152-L156 PolarHBondContact O-N 2.91Å; R153-L156 PolarHBondContact O-N 3.07Å; L156-A158 VanDerWaalsContact C-N 3.28Å; L156-A158 PolarHBondContact O-N 2.9Å; L156-I159 CarbonylContact O-C 3.48Å; L156-I159 WeakPolarHBondContact O-CG1 3.43Å; L156-I159 PolarHBondContact O-N 3.25Å; L156-E160 PolarHBondContact O-N 2.93Å; L156-D181 HydrophobicContact CD1-CB 4.05Å; L156-I182 HydrophobicContact CD1-CG1 4Å; L156-I182 HydrophobicContact CD2-CG1 3.94Å; L156-V185 HydrophobicContact CB-CB 4.05Å; L156-V185 HydrophobicContact CB-CG1 3.74Å; L156-V185 HydrophobicContact CB-CG2 4.33Å; L156-L186 HydrophobicContact CD2-CD1 4.35Å
157	K	97.5	Very high	97.4	Very high	121 Å²	121	59.9 Å²	59.9	53%	0.526	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-35.4	176.7	-78.1	176	-179.6	-176.9	0	112.4	R153 A155 I159 E160 V185	R153-K157 WeakPolarHBondContact O-CB 3.35Å; R153-K157 VanDerWaalsContact O-CG 3.25Å; R153-K157 WeakPolarHBondContact O-CG 3.49Å; R153-K157 PolarHBondContact O-N 2.83Å; A155-K157 VanDerWaalsContact C-N 3.35Å; A155-K157 PolarHBondContact O-N 2.82Å; K157-I159 PolarHBondContact O-N 3.11Å; K157-E160 PolarHBondContact O-N 2.88Å; K157-V185 HydrophobicContact CB-CG1 4.33Å; K157-V185 HydrophobicContact CG-CG1 3.55Å; K157-V185 HydrophobicContact CG-CG2 4.38Å
158	A	97.3	Very high	97.5	Very high	85 Å²	85	57 Å²	57	70%	0.702	31%	0.307	S	S	*	.	H	α-helix	trans	-65.1	-21.6	178.7	0	0	0	0	0	113.1	D154 A155 L156	D154-A158 PolarHBondContact O-N 2.94Å; A155-A158 WeakPolarHBondContact O-CB 3.28Å; A155-A158 PolarHBondContact O-N 2.96Å; L156-A158 VanDerWaalsContact C-N 3.28Å; L156-A158 PolarHBondContact O-N 2.9Å
159	I	96.3	Very high	97.6	Very high	27 Å²	27	50.3 Å²	50.3	14%	0.138	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	14.2	-177.4	63.5	-177.8	0	0	0	112.7	E142 L156 K157 A161 E162 L166 F168	E142-I159 HydrophobicContact CG-CD1 4.28Å; L156-I159 CarbonylContact O-C 3.48Å; L156-I159 WeakPolarHBondContact O-CG1 3.43Å; L156-I159 PolarHBondContact O-N 3.25Å; K157-I159 PolarHBondContact O-N 3.11Å; I159-A161 VanDerWaalsContact C-N 3.28Å; I159-A161 PolarHBondContact O-N 3.39Å; I159-E162 HydrophobicContact CB-CB 4.27Å; I159-E162 VanDerWaalsContact O-CB 3.23Å; I159-E162 WeakPolarHBondContact O-CB 2.99Å; I159-E162 PolarHBondContact O-N 2.98Å; I159-L166 HydrophobicContact CD1-CD1 4.06Å; I159-L166 HydrophobicContact CD1-CD2 4.38Å; I159-L166 HydrophobicContact CG1-CD1 4.36Å; I159-F168 HydrophobicContact CD1-CE1 4.18Å; I159-F168 HydrophobicContact CD1-CZ 3.7Å
160	E	95.9	Very high	97.6	Very high	92 Å²	92	48.7 Å²	48.7	43%	0.43	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-40.9	-173.8	-178.9	-178.6	172.5	0	0	112.9	L156 K157 L186 R190	L156-E160 PolarHBondContact O-N 2.93Å; K157-E160 PolarHBondContact O-N 2.88Å; E160-L186 HydrophobicContact CB-CD2 4.05Å; E160-L186 HydrophobicContact CG-CD2 4.02Å; E160-R190 PolarHBondContact O-NH2 3.12Å
161	A	93.4	Very high	97.4	Very high	69 Å²	69	43.6 Å²	43.6	57%	0.57	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	10.9	180	0	0	0	0	0	113.7	I159 P163	I159-A161 VanDerWaalsContact C-N 3.28Å; I159-A161 PolarHBondContact O-N 3.39Å; A161-P163 WeakPolarHBondContact O-CD 3.15Å
162	E	96.6	Very high	97.2	Very high	35 Å²	35	44 Å²	44	16%	0.164	25%	0.245	C	C	.	.			trans	-66.3	117.6	179.6	175.2	53.9	-112.4	0	0	110.6	I159 R164 L166 H235	I159-E162 HydrophobicContact CB-CB 4.27Å; I159-E162 VanDerWaalsContact O-CB 3.23Å; I159-E162 WeakPolarHBondContact O-CB 2.99Å; I159-E162 PolarHBondContact O-N 2.98Å; E162-R164 VanDerWaalsContact C-N 3.34Å; E162-R164 VanDerWaalsContact CD-NE 3.28Å; E162-R164 HydrophobicContact CG-CB 4.18Å; E162-R164 PolarHBondContact O-N 3.24Å; E162-R164 WeakPolarHBondContact OE1-CB 3.45Å; E162-R164 WeakPolarHBondContact OE1-CG 3.47Å; E162-R164 IonicContact OE1-CZ 3.25Å; E162-R164 PolarHBondContact OE1-N 3.37Å; E162-R164 IonicContact OE1-NE 3.66Å; E162-R164 PolarHBondContact OE1-NE 2.78Å; E162-R164 IonicContact OE1-NH2 3.98Å; E162-R164 IonicContact OE2-CZ 2.85Å; E162-R164 IonicContact OE2-NE 3.42Å; E162-R164 PolarHBondContact OE2-NE 3.43Å; E162-R164 IonicContact OE2-NH2 3.93Å; E162-R164 PolarHBondContact OE2-NH2 2.93Å; E162-L166 HydrophobicContact CB-CD2 4.09Å; E162-L166 HydrophobicContact CG-CD2 3.56Å; E162-L166 HydrophobicContact CG-CG 4.46Å; E162-H235 WeakPolarHBondContact O-CB 3.32Å; E162-H235 PolarHBondContact O-N 2.7Å
163	P	95.9	Very high	97	Very high	88 Å²	88	52.1 Å²	52.1	57%	0.571	28%	0.282	S	S	*	.			trans	-77	-14.8	-178.8	31.3	-39.2	0	0	0	114.5	A161 G234	A161-P163 WeakPolarHBondContact O-CD 3.15Å; P163-G234 WeakPolarHBondContact O-CA 3.37Å
164	R	98.2	Very high	96.8	Very high	82 Å²	82	50.6 Å²	50.6	31%	0.309	28%	0.277	S	S	.	.	S	Bend	trans	-78.7	153.9	177.2	-65.6	174.9	-75.4	162.8	2	111.3	R138 C140 E162 L166 G234	R138-R164 HydrophobicContact CB-CG 3.81Å; C140-R164 PolarHBondContact SG-NE 3.32Å; C140-R164 PolarHBondContact SG-NH1 2.92Å; C140-R164 VanDerWaalsContact SG-NH1 3.37Å; C140-R164 PolarHBondContact SG-NH2 3.5Å; E162-R164 VanDerWaalsContact C-N 3.34Å; E162-R164 VanDerWaalsContact CD-NE 3.28Å; E162-R164 HydrophobicContact CG-CB 4.18Å; E162-R164 PolarHBondContact O-N 3.24Å; E162-R164 WeakPolarHBondContact OE1-CB 3.45Å; E162-R164 WeakPolarHBondContact OE1-CG 3.47Å; E162-R164 IonicContact OE1-CZ 3.25Å; E162-R164 PolarHBondContact OE1-N 3.37Å; E162-R164 IonicContact OE1-NE 3.66Å; E162-R164 PolarHBondContact OE1-NE 2.78Å; E162-R164 IonicContact OE1-NH2 3.98Å; E162-R164 IonicContact OE2-CZ 2.85Å; E162-R164 IonicContact OE2-NE 3.42Å; E162-R164 PolarHBondContact OE2-NE 3.43Å; E162-R164 IonicContact OE2-NH2 3.93Å; E162-R164 PolarHBondContact OE2-NH2 2.93Å; R164-L166 PolarHBondContact O-N 3.33Å; R164-G234 VanDerWaalsContact O-CA 3.24Å; R164-G234 WeakPolarHBondContact O-CA 3.3Å
165	T	98.6	Very high	96.8	Very high	1 Å²	1	47 Å²	47	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	131.3	169.6	-63.5	0	0	0	0	109.9	L129 L134 P135 R138 F139 C140 I231 V232	L129-T165 HydrophobicContact CD1-CG2 3.8Å; L134-T165 HydrophobicContact CB-CG2 4.3Å; L134-T165 HydrophobicContact CD1-CG2 4.45Å; P135-T165 VanDerWaalsContact O-CB 3.28Å; P135-T165 WeakPolarHBondContact O-CB 3.35Å; P135-T165 PolarHBondContact O-OG1 3.34Å; R138-T165 PolarHBondContact O-N 3.35Å; F139-T165 CarbonylContact C-O 3.5Å; F139-T165 WeakPolarHBondContact CA-O 3.39Å; F139-T165 VanDerWaalsContact CB-O 3.29Å; F139-T165 WeakPolarHBondContact CB-O 3.3Å; C140-T165 PolarHBondContact N-O 3.42Å; T165-I231 HydrophobicContact CG2-CG2 3.32Å; T165-V232 WeakPolarHBondContact CA-O 3.4Å
166	L	98.7	Very high	96.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.4	-179.4	-52.6	164.7	0	0	0	110.2	C140 I159 E162 R164 F168 I231 V232	C140-L166 HydrophobicContact CB-CD2 3.75Å; C140-L166 CarbonylContact O-C 3.54Å; I159-L166 HydrophobicContact CD1-CD1 4.06Å; I159-L166 HydrophobicContact CD1-CD2 4.38Å; I159-L166 HydrophobicContact CG1-CD1 4.36Å; E162-L166 HydrophobicContact CB-CD2 4.09Å; E162-L166 HydrophobicContact CG-CD2 3.56Å; E162-L166 HydrophobicContact CG-CG 4.46Å; R164-L166 PolarHBondContact O-N 3.33Å; L166-F168 HydrophobicContact CB-CD2 4.49Å; L166-F168 HydrophobicContact CB-CE2 3.6Å; L166-F168 HydrophobicContact CB-CZ 4.04Å; L166-F168 HydrophobicContact CD1-CE2 4.31Å; L166-F168 HydrophobicContact CD1-CZ 4.33Å; L166-I231 CarbonylContact O-C 3.58Å; L166-I231 WeakPolarHBondContact O-CA 3.25Å; L166-V232 HydrophobicContact CB-CB 4.16Å; L166-V232 HydrophobicContact CD1-CG1 4.44Å; L166-V232 PolarHBondContact N-O 3.45Å; L166-V232 PolarHBondContact O-N 2.88Å
167	I	98.8	Very high	96.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125	-179.6	-54	-179.4	0	0	0	109.7	A125 L129 F139 C140 Y141 E142 V229 L230 I231	A125-I167 HydrophobicContact CB-CG2 3.86Å; L129-I167 HydrophobicContact CB-CD1 4.06Å; L129-I167 HydrophobicContact CD1-CD1 4.37Å; L129-I167 HydrophobicContact CD2-CD1 4.08Å; L129-I167 HydrophobicContact CG-CD1 4.39Å; F139-I167 HydrophobicContact CB-CD1 4.47Å; F139-I167 HydrophobicContact CD2-CD1 3.78Å; F139-I167 HydrophobicContact CE2-CD1 4.35Å; F139-I167 HydrophobicContact CG-CD1 4.3Å; C140-I167 PolarHBondContact O-N 2.72Å; Y141-I167 HydrophobicContact CD2-CB 4.26Å; Y141-I167 HydrophobicContact CD2-CG2 4.05Å; Y141-I167 HydrophobicContact CE2-CG2 4.49Å; E142-I167 PolarHBondContact N-O 2.85Å; I167-V229 HydrophobicContact CG2-CG1 3.65Å; I167-L230 WeakPolarHBondContact CA-O 3.27Å; I167-I231 HydrophobicContact CB-CD1 4.17Å; I167-I231 HydrophobicContact CD1-CD1 4.12Å; I167-I231 HydrophobicContact CG1-CD1 3.72Å; I167-I231 HydrophobicContact CG2-CD1 3.75Å
168	F	98.6	Very high	96.8	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.9	174.6	-52.6	-91.7	0	0	0	110.6	E142 G143 L145 I159 L166 V229 L230 V232	E142-F168 HydrophobicContact CB-CD1 3.51Å; E142-F168 HydrophobicContact CB-CE1 3.24Å; E142-F168 HydrophobicContact CB-CG 4.44Å; E142-F168 HydrophobicContact CB-CZ 3.98Å; E142-F168 HydrophobicContact CG-CD1 4.37Å; E142-F168 HydrophobicContact CG-CE1 3.67Å; E142-F168 HydrophobicContact CG-CZ 3.93Å; G143-F168 CarbonylContact O-C 3.58Å; G143-F168 WeakPolarHBondContact O-CA 3.49Å; L145-F168 HydrophobicContact CD1-CD1 4.26Å; L145-F168 HydrophobicContact CD1-CE1 4.48Å; L145-F168 HydrophobicContact CD2-CD1 3.86Å; L145-F168 HydrophobicContact CD2-CE1 3.58Å; L145-F168 HydrophobicContact CD2-CZ 4.46Å; L145-F168 HydrophobicContact CG-CD1 3.69Å; L145-F168 HydrophobicContact CG-CE1 3.95Å; L145-F168 HydrophobicContact CG-CG 4.43Å; I159-F168 HydrophobicContact CD1-CE1 4.18Å; I159-F168 HydrophobicContact CD1-CZ 3.7Å; L166-F168 HydrophobicContact CB-CD2 4.49Å; L166-F168 HydrophobicContact CB-CE2 3.6Å; L166-F168 HydrophobicContact CB-CZ 4.04Å; L166-F168 HydrophobicContact CD1-CE2 4.31Å; L166-F168 HydrophobicContact CD1-CZ 4.33Å; F168-V229 CarbonylContact O-C 3.57Å; F168-V229 VanDerWaalsContact O-CA 3.3Å; F168-V229 WeakPolarHBondContact O-CA 3.47Å; F168-V229 WeakPolarHBondContact O-CG1 3.32Å; F168-L230 HydrophobicContact CB-CB 4.35Å; F168-L230 PolarHBondContact N-O 2.91Å; F168-L230 PolarHBondContact O-N 3.33Å; F168-V232 HydrophobicContact CD2-CG2 4.05Å; F168-V232 HydrophobicContact CE2-CG2 3.88Å
169	Y	98.2	Very high	96.8	Very high	33 Å²	33	40.6 Å²	40.6	13%	0.129	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	148.1	159.9	-67	-13.9	0	0	0	109.4	N99 A124 A125 Y141 G143 F144 M228 V229	N99-Y169 HydrophobicContact CB-CD2 4.41Å; N99-Y169 HydrophobicContact CB-CE2 4.46Å; A124-Y169 HydrophobicContact CB-CE1 4.16Å; A125-Y169 HydrophobicContact CB-CE1 3.86Å; A125-Y169 PolarHBondContact N-OH 2.91Å; Y141-Y169 HydrophobicContact CE2-CD1 4.28Å; Y141-Y169 AromaticContact CE2-CE1 3.96Å; Y141-Y169 HydrophobicContact CE2-CE1 3.96Å; Y141-Y169 HydrophobicContact CE2-CE2 4.21Å; Y141-Y169 AromaticContact CE2-CZ 3.92Å; Y141-Y169 WeakPolarHBondContact OH-CD2 3.15Å; Y141-Y169 WeakPolarHBondContact OH-CE2 3.24Å; G143-Y169 PolarHBondContact O-N 2.82Å; F144-Y169 VanDerWaalsContact CD1-C 3.48Å; F144-Y169 WeakPolarHBondContact CD1-O 3.33Å; F144-Y169 HydrophobicContact CE2-CD2 4.03Å; F144-Y169 VanDerWaalsContact CZ-CB 3.49Å; F144-Y169 HydrophobicContact CZ-CD2 4.1Å; F144-Y169 HydrophobicContact CZ-CG 4.3Å; Y169-M228 WeakPolarHBondContact CA-O 3.42Å; Y169-V229 HydrophobicContact CD1-CB 4.43Å; Y169-V229 HydrophobicContact CD1-CG1 4.17Å; Y169-V229 HydrophobicContact CD1-CG2 3.83Å; Y169-V229 HydrophobicContact CE1-CG1 4.3Å; Y169-V229 HydrophobicContact CE1-CG2 3.82Å
170	E	97.1	Very high	96.9	Very high	4 Å²	4	43 Å²	43	2%	0.019	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	154.2	174.3	-157.5	44.1	-89.2	0	0	113	R174 L175 S178 M228 L230	E170-R174 HydrophobicContact CG-CB 4.42Å; E170-R174 WeakPolarHBondContact OE1-CB 3.19Å; E170-R174 IonicContact OE1-CZ 3.13Å; E170-R174 VanDerWaalsContact OE1-CZ 3.23Å; E170-R174 IonicContact OE1-NE 2.68Å; E170-R174 PolarHBondContact OE1-NE 2.85Å; E170-R174 IonicContact OE1-NH2 3.33Å; E170-R174 PolarHBondContact OE1-NH2 3.27Å; E170-R174 IonicContact OE2-NE 2.85Å; E170-R174 IonicContact OE2-NH2 2.78Å; E170-L175 HydrophobicContact CG-CD1 4.46Å; E170-S178 PolarHBondContact OE2-OG 2.71Å; E170-M228 PolarHBondContact N-O 2.85Å; E170-M228 PolarHBondContact O-N 2.81Å; E170-L230 HydrophobicContact CB-CD1 4.36Å
171	S	93.7	Very high	97.1	Very high	36 Å²	36	39 Å²	39	25%	0.252	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	157.2	-177.7	65.1	0	0	0	0	112.2	H173 R174 L175 M228	S171-H173 PolarHBondContact O-N 2.8Å; S171-H173 VanDerWaalsContact O-N 3.11Å; S171-R174 PolarHBondContact O-N 2.68Å; S171-R174 PolarHBondContact OG-NE 2.76Å; S171-L175 PolarHBondContact O-N 2.87Å; S171-L175 VanDerWaalsContact O-N 3.1Å; S171-M228 WeakPolarHBondContact O-CE 3.33Å
172	T	95.3	Very high	97.3	Very high	38 Å²	38	35.8 Å²	35.8	23%	0.233	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-41.4	179.4	-63.1	0	0	0	0	113.6	R174 R224 G226 M228	T172-R174 VanDerWaalsContact C-N 3.34Å; T172-R174 PolarHBondContact O-N 2.81Å; T172-R224 WeakPolarHBondContact CA-O 3.41Å; T172-R224 VanDerWaalsContact CB-O 3.31Å; T172-R224 WeakPolarHBondContact CB-O 3.31Å; T172-R224 VanDerWaalsContact CG2-O 3.27Å; T172-R224 WeakPolarHBondContact CG2-O 3.39Å; T172-R224 PolarHBondContact OG1-O 3.18Å; T172-R224 VanDerWaalsContact OG1-O 3.11Å; T172-G226 PolarHBondContact OG1-N 3.42Å; T172-G226 PolarHBondContact OG1-O 2.68Å; T172-M228 VanDerWaalsContact N-CE 3.32Å
173	H	93.1	Very high	97.4	Very high	174 Å²	174	35.2 Å²	35.2	81%	0.806	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-13.9	-174.2	-60.2	-58.9	0	0	0	114.3	S171	S171-H173 PolarHBondContact O-N 2.8Å; S171-H173 VanDerWaalsContact O-N 3.11Å
174	R	95.1	Very high	97.5	Very high	64 Å²	64	34.5 Å²	34.5	24%	0.242	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-7.3	-172.8	-62	-168.6	-45.7	-150	0	113.7	E170 S171 T172 L176 D177 S178	E170-R174 HydrophobicContact CG-CB 4.42Å; E170-R174 WeakPolarHBondContact OE1-CB 3.19Å; E170-R174 IonicContact OE1-CZ 3.13Å; E170-R174 VanDerWaalsContact OE1-CZ 3.23Å; E170-R174 IonicContact OE1-NE 2.68Å; E170-R174 PolarHBondContact OE1-NE 2.85Å; E170-R174 IonicContact OE1-NH2 3.33Å; E170-R174 PolarHBondContact OE1-NH2 3.27Å; E170-R174 IonicContact OE2-NE 2.85Å; E170-R174 IonicContact OE2-NH2 2.78Å; S171-R174 PolarHBondContact O-N 2.68Å; S171-R174 PolarHBondContact OG-NE 2.76Å; T172-R174 VanDerWaalsContact C-N 3.34Å; T172-R174 PolarHBondContact O-N 2.81Å; R174-L176 PolarHBondContact O-N 2.93Å; R174-D177 PolarHBondContact O-N 3.06Å; R174-S178 WeakPolarHBondContact O-CB 3.23Å; R174-S178 PolarHBondContact O-N 3.05Å; R174-S178 PolarHBondContact O-OG 2.83Å
175	L	97.6	Very high	97.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56.8	-51	-176.9	179.7	71.2	0	0	0	112.4	E170 S171 D177 S178 L179 L194 V217 R224 M228 L230	E170-L175 HydrophobicContact CG-CD1 4.46Å; S171-L175 PolarHBondContact O-N 2.87Å; S171-L175 VanDerWaalsContact O-N 3.1Å; L175-D177 PolarHBondContact O-N 3.11Å; L175-S178 PolarHBondContact O-N 3.1Å; L175-S178 VanDerWaalsContact O-N 3.15Å; L175-L179 HydrophobicContact CD1-CD1 4.09Å; L175-L179 HydrophobicContact CD1-CG 4.12Å; L175-L179 HydrophobicContact CD2-CD1 4.4Å; L175-L179 HydrophobicContact CG-CD1 3.94Å; L175-L179 HydrophobicContact CG-CG 4.3Å; L175-L179 WeakPolarHBondContact O-CG 3.47Å; L175-L179 PolarHBondContact O-N 3.38Å; L175-L194 HydrophobicContact CD1-CD1 4.08Å; L175-L194 HydrophobicContact CD2-CD2 4.11Å; L175-V217 HydrophobicContact CD2-CG1 3.65Å; L175-V217 HydrophobicContact CD2-CG2 4.24Å; L175-R224 HydrophobicContact CD2-CB 3.63Å; L175-M228 HydrophobicContact CB-CE 4.04Å; L175-M228 HydrophobicContact CB-SD 4.42Å; L175-M228 HydrophobicContact CD1-SD 4.15Å; L175-M228 HydrophobicContact CD2-CE 4.29Å; L175-M228 HydrophobicContact CD2-SD 3.61Å; L175-M228 HydrophobicContact CG-SD 4.26Å; L175-L230 HydrophobicContact CD1-CD1 4.28Å; L175-L230 HydrophobicContact CD1-CD2 4.05Å; L175-L230 HydrophobicContact CD1-CG 4.46Å
176	L	97.8	Very high	97.4	Very high	30 Å²	30	31.8 Å²	31.8	16%	0.157	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-50.2	-177.5	-73.2	-172.9	0	0	0	111.5	R174 S178 L179 E180 L214 V217 K218	R174-L176 PolarHBondContact O-N 2.93Å; L176-S178 PolarHBondContact O-N 2.87Å; L176-L179 PolarHBondContact O-N 3.43Å; L176-E180 WeakPolarHBondContact O-CB 3.47Å; L176-E180 WeakPolarHBondContact O-CG 3.36Å; L176-E180 PolarHBondContact O-N 3.4Å; L176-L214 HydrophobicContact CD2-CD1 4.01Å; L176-V217 HydrophobicContact CD2-CB 4.31Å; L176-V217 HydrophobicContact CD2-CG1 3.64Å; L176-K218 HydrophobicContact CD1-CG 4.42Å; L176-K218 HydrophobicContact CD2-CG 3.76Å
177	D	97.9	Very high	97.3	Very high	78 Å²	78	33.1 Å²	33.1	42%	0.417	18%	0.184	S	C	.	.	H	α-helix	trans	-58.9	-32.7	177.7	-65.3	4.1	0	0	0	112.4	R152 R174 L175 D181	R152-D177 PolarHBondContact NE-O 2.98Å; R152-D177 PolarHBondContact NH2-O 3.24Å; R174-D177 PolarHBondContact O-N 3.06Å; L175-D177 PolarHBondContact O-N 3.11Å; D177-D181 PolarHBondContact O-N 3.45Å; D177-D181 VanDerWaalsContact O-N 3.13Å
178	S	98.2	Very high	97.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-75.3	-45.4	178.6	-57.8	0	0	0	0	111.7	E170 R174 L175 L176 E180 D181 I182	E170-S178 PolarHBondContact OE2-OG 2.71Å; R174-S178 WeakPolarHBondContact O-CB 3.23Å; R174-S178 PolarHBondContact O-N 3.05Å; R174-S178 PolarHBondContact O-OG 2.83Å; L175-S178 PolarHBondContact O-N 3.1Å; L175-S178 VanDerWaalsContact O-N 3.15Å; L176-S178 PolarHBondContact O-N 2.87Å; S178-E180 VanDerWaalsContact C-N 3.32Å; S178-E180 PolarHBondContact O-N 3.33Å; S178-D181 PolarHBondContact O-N 3.35Å; S178-I182 WeakPolarHBondContact O-CB 3.1Å; S178-I182 WeakPolarHBondContact O-CG1 3.21Å; S178-I182 PolarHBondContact O-N 3.22Å
179	L	98.6	Very high	97.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-39.3	174.3	-68.6	177.3	0	0	0	111.6	L175 L176 I182 V183 V210 L213 L214 V217 L230	L175-L179 HydrophobicContact CD1-CD1 4.09Å; L175-L179 HydrophobicContact CD1-CG 4.12Å; L175-L179 HydrophobicContact CD2-CD1 4.4Å; L175-L179 HydrophobicContact CG-CD1 3.94Å; L175-L179 HydrophobicContact CG-CG 4.3Å; L175-L179 WeakPolarHBondContact O-CG 3.47Å; L175-L179 PolarHBondContact O-N 3.38Å; L176-L179 PolarHBondContact O-N 3.43Å; L179-I182 PolarHBondContact O-N 3.5Å; L179-V183 WeakPolarHBondContact O-CG2 3.49Å; L179-V183 PolarHBondContact O-N 3.41Å; L179-V210 HydrophobicContact CD2-CG2 4.04Å; L179-L213 HydrophobicContact CD1-CG 4.5Å; L179-L213 HydrophobicContact CD2-CD2 3.96Å; L179-L214 HydrophobicContact CB-CB 4.32Å; L179-L214 HydrophobicContact CB-CD1 3.83Å; L179-L214 HydrophobicContact CD1-CD1 4.44Å; L179-V217 HydrophobicContact CD1-CB 4.28Å; L179-V217 HydrophobicContact CD1-CG2 3.92Å; L179-L230 HydrophobicContact CD2-CD1 4.37Å; L179-L230 HydrophobicContact CD2-CD2 4.17Å
180	E	98.5	Very high	97.2	Very high	79 Å²	79	44 Å²	44	37%	0.369	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-45.1	174.5	-76.4	176.8	-180	0	0	112.3	L176 S178 V183 A184 L214 K218	L176-E180 WeakPolarHBondContact O-CB 3.47Å; L176-E180 WeakPolarHBondContact O-CG 3.36Å; L176-E180 PolarHBondContact O-N 3.4Å; S178-E180 VanDerWaalsContact C-N 3.32Å; S178-E180 PolarHBondContact O-N 3.33Å; E180-V183 PolarHBondContact O-N 2.84Å; E180-A184 WeakPolarHBondContact O-CB 3.45Å; E180-A184 PolarHBondContact O-N 3.31Å; E180-L214 HydrophobicContact CG-CD1 3.98Å; E180-L214 HydrophobicContact CG-CD2 3.68Å; E180-L214 HydrophobicContact CG-CG 4.49Å; E180-K218 WeakPolarHBondContact OE1-CE 3.3Å; E180-K218 IonicContact OE1-NZ 3.23Å; E180-K218 PolarHBondContact OE1-NZ 3.32Å
181	D	98.6	Very high	97.3	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.043	26%	0.26	C	S	.	.	H	α-helix	trans	-73	-30.1	177.3	-79	-37.7	0	0	0	112.4	S149 R152 R153 L156 D177 S178 A184 V185	S149-D181 WeakPolarHBondContact CA-OD2 3.41Å; S149-D181 WeakPolarHBondContact CB-OD2 3.44Å; S149-D181 PolarHBondContact OG-OD1 2.88Å; S149-D181 PolarHBondContact OG-OD2 2.78Å; R152-D181 HydrophobicContact CG-CB 4.2Å; R152-D181 IonicContact CZ-OD2 2.73Å; R152-D181 IonicContact NE-OD2 2.73Å; R152-D181 PolarHBondContact NE-OD2 3.04Å; R152-D181 IonicContact NH2-OD2 3.12Å; R152-D181 PolarHBondContact NH2-OD2 3.25Å; R153-D181 VanDerWaalsContact CD-OD1 3.25Å; R153-D181 WeakPolarHBondContact CD-OD1 3.39Å; R153-D181 HydrophobicContact CG-CB 3.87Å; R153-D181 VanDerWaalsContact CG-OD1 3.23Å; R153-D181 WeakPolarHBondContact CG-OD1 3.21Å; R153-D181 IonicContact CZ-OD1 2.94Å; R153-D181 IonicContact NE-OD1 2.79Å; R153-D181 IonicContact NH1-OD1 3.87Å; R153-D181 PolarHBondContact NH1-OD1 3.4Å; L156-D181 HydrophobicContact CD1-CB 4.05Å; D177-D181 PolarHBondContact O-N 3.45Å; D177-D181 VanDerWaalsContact O-N 3.13Å; S178-D181 PolarHBondContact O-N 3.35Å; D181-A184 PolarHBondContact O-N 3.07Å; D181-V185 WeakPolarHBondContact O-CB 3.21Å; D181-V185 WeakPolarHBondContact O-CG2 3.42Å; D181-V185 PolarHBondContact O-N 3.47Å
182	I	98.5	Very high	97.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-46.5	171.4	-70.1	164.4	0	0	0	110.1	L156 S178 L179 A184 V185 L186 V192 V210 L230	L156-I182 HydrophobicContact CD1-CG1 4Å; L156-I182 HydrophobicContact CD2-CG1 3.94Å; S178-I182 WeakPolarHBondContact O-CB 3.1Å; S178-I182 WeakPolarHBondContact O-CG1 3.21Å; S178-I182 PolarHBondContact O-N 3.22Å; L179-I182 PolarHBondContact O-N 3.5Å; I182-A184 VanDerWaalsContact C-N 3.32Å; I182-A184 PolarHBondContact O-N 2.97Å; I182-V185 PolarHBondContact O-N 3.15Å; I182-L186 HydrophobicContact CG2-CB 4.29Å; I182-L186 HydrophobicContact CG2-CD1 3.98Å; I182-L186 HydrophobicContact CG2-CG 4.25Å; I182-L186 WeakPolarHBondContact O-CA 3.34Å; I182-L186 WeakPolarHBondContact O-CB 3.1Å; I182-L186 PolarHBondContact O-N 3.41Å; I182-V192 HydrophobicContact CG2-CG2 4.49Å; I182-V210 HydrophobicContact CB-CG2 4.25Å; I182-V210 HydrophobicContact CG2-CB 4.34Å; I182-V210 HydrophobicContact CG2-CG1 4.23Å; I182-V210 HydrophobicContact CG2-CG2 3.76Å; I182-L230 HydrophobicContact CD1-CD1 4.08Å
183	V	98.5	Very high	97.7	Very high	23 Å²	23	44.2 Å²	44.2	14%	0.139	24%	0.238	C	C	.	.	H	α-helix	trans	-54.3	-50.4	172.8	163	0	0	0	0	110.4	L179 E180 V185 G187 E188 V210 L214	L179-V183 WeakPolarHBondContact O-CG2 3.49Å; L179-V183 PolarHBondContact O-N 3.41Å; E180-V183 PolarHBondContact O-N 2.84Å; V183-V185 VanDerWaalsContact C-N 3.28Å; V183-V185 PolarHBondContact O-N 2.77Å; V183-G187 CarbonylContact O-C 3.59Å; V183-G187 VanDerWaalsContact O-CA 3.31Å; V183-G187 WeakPolarHBondContact O-CA 3.27Å; V183-G187 PolarHBondContact O-N 2.81Å; V183-G187 VanDerWaalsContact O-N 3.12Å; V183-E188 HydrophobicContact CG1-CG 3.52Å; V183-V210 HydrophobicContact CG2-CB 4.33Å; V183-V210 HydrophobicContact CG2-CG1 3.74Å; V183-V210 HydrophobicContact CG2-CG2 4.03Å; V183-L214 HydrophobicContact CG2-CD2 4.12Å
184	A	98.2	Very high	98	Very high	73 Å²	73	36.1 Å²	36.1	60%	0.603	20%	0.201	S	C	*	.	H	α-helix	trans	-66.8	-26.6	-174.2	0	0	0	0	0	114	E180 D181 I182	E180-A184 WeakPolarHBondContact O-CB 3.45Å; E180-A184 PolarHBondContact O-N 3.31Å; D181-A184 PolarHBondContact O-N 3.07Å; I182-A184 VanDerWaalsContact C-N 3.32Å; I182-A184 PolarHBondContact O-N 2.97Å
185	V	98	Very high	98.1	Very high	13 Å²	13	33.1 Å²	33.1	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-106.9	-43	-175	179	0	0	0	0	112.7	R153 L156 K157 D181 I182 V183	R153-V185 HydrophobicContact CB-CG2 3.97Å; R153-V185 HydrophobicContact CG-CG2 3.78Å; L156-V185 HydrophobicContact CB-CB 4.05Å; L156-V185 HydrophobicContact CB-CG1 3.74Å; L156-V185 HydrophobicContact CB-CG2 4.33Å; K157-V185 HydrophobicContact CB-CG1 4.33Å; K157-V185 HydrophobicContact CG-CG1 3.55Å; K157-V185 HydrophobicContact CG-CG2 4.38Å; D181-V185 WeakPolarHBondContact O-CB 3.21Å; D181-V185 WeakPolarHBondContact O-CG2 3.42Å; D181-V185 PolarHBondContact O-N 3.47Å; I182-V185 PolarHBondContact O-N 3.15Å; V183-V185 VanDerWaalsContact C-N 3.28Å; V183-V185 PolarHBondContact O-N 2.77Å
186	L	97.2	Very high	98.2	Very high	13 Å²	13	34.2 Å²	34.2	7%	0.068	19%	0.194	C	C	.	.	H	α-helix	trans	-95.5	-8.8	-176.1	-53.8	-168.9	0	0	0	113.5	L156 E160 I182 R190 V232	L156-L186 HydrophobicContact CD2-CD1 4.35Å; E160-L186 HydrophobicContact CB-CD2 4.05Å; E160-L186 HydrophobicContact CG-CD2 4.02Å; I182-L186 HydrophobicContact CG2-CB 4.29Å; I182-L186 HydrophobicContact CG2-CD1 3.98Å; I182-L186 HydrophobicContact CG2-CG 4.25Å; I182-L186 WeakPolarHBondContact O-CA 3.34Å; I182-L186 WeakPolarHBondContact O-CB 3.1Å; I182-L186 PolarHBondContact O-N 3.41Å; L186-R190 HydrophobicContact CB-CB 4.19Å; L186-R190 HydrophobicContact CB-CG 4.1Å; L186-R190 HydrophobicContact CD1-CG 4.38Å; L186-V232 HydrophobicContact CD1-CG1 3.94Å
187	G	96.9	Very high	98.1	Very high	29 Å²	29	34.2 Å²	34.2	30%	0.299	19%	0.193	S	C	.	.			trans	88.4	146.2	-178.4	0	0	0	0	0	113.7	V183 S189 R190 V210	V183-G187 CarbonylContact O-C 3.59Å; V183-G187 VanDerWaalsContact O-CA 3.31Å; V183-G187 WeakPolarHBondContact O-CA 3.27Å; V183-G187 PolarHBondContact O-N 2.81Å; V183-G187 VanDerWaalsContact O-N 3.12Å; G187-S189 PolarHBondContact O-N 3.09Å; G187-S189 VanDerWaalsContact O-N 3.16Å; G187-R190 VanDerWaalsContact O-CB 3.28Å; G187-R190 WeakPolarHBondContact O-CB 3.31Å; G187-R190 PolarHBondContact O-N 3.01Å; G187-R190 VanDerWaalsContact O-N 3.09Å; G187-V210 VanDerWaalsContact O-CG1 3.25Å; G187-V210 WeakPolarHBondContact O-CG1 3.38Å
188	E	97.8	Very high	98.1	Very high	136 Å²	136	31.1 Å²	31.1	64%	0.636	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.6	-177	-69.6	177.8	-177.4	0	0	114.3	V183 R190 P209 V210 G211	V183-E188 HydrophobicContact CG1-CG 3.52Å; E188-R190 VanDerWaalsContact C-N 3.31Å; E188-P209 CarbonylContact O-C 3.53Å; E188-V210 PolarHBondContact O-N 3.43Å; E188-V210 VanDerWaalsContact O-N 3.14Å; E188-G211 PolarHBondContact O-N 3.14Å
189	S	97.3	Very high	98.1	Very high	105 Å²	105	32.7 Å²	32.7	73%	0.734	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-10.2	-178.5	60	0	0	0	0	113.7	G187 Y191	G187-S189 PolarHBondContact O-N 3.09Å; G187-S189 VanDerWaalsContact O-N 3.16Å; S189-Y191 PolarHBondContact O-N 3.24Å
190	R	97.9	Very high	98	Very high	20 Å²	20	35.6 Å²	35.6	8%	0.075	20%	0.199	C	C	.	.			trans	-60.6	120.2	179.2	-177.6	64.3	66.4	121.8	8.8	109.5	E160 L186 G187 E188 V192 V210 V232 E233	E160-R190 PolarHBondContact O-NH2 3.12Å; L186-R190 HydrophobicContact CB-CB 4.19Å; L186-R190 HydrophobicContact CB-CG 4.1Å; L186-R190 HydrophobicContact CD1-CG 4.38Å; G187-R190 VanDerWaalsContact O-CB 3.28Å; G187-R190 WeakPolarHBondContact O-CB 3.31Å; G187-R190 PolarHBondContact O-N 3.01Å; G187-R190 VanDerWaalsContact O-N 3.09Å; E188-R190 VanDerWaalsContact C-N 3.31Å; R190-V192 HydrophobicContact CG-CG2 4.46Å; R190-V210 HydrophobicContact CB-CG1 4.13Å; R190-V210 WeakPolarHBondContact O-CB 3.19Å; R190-V210 PolarHBondContact O-N 3.03Å; R190-V232 HydrophobicContact CG-CG1 3.7Å; R190-E233 VanDerWaalsContact CD-O 3.23Å; R190-E233 WeakPolarHBondContact CD-O 3.37Å; R190-E233 PolarHBondContact NH1-O 3.13Å
191	Y	98.6	Very high	97.9	Very high	81 Å²	81	37.9 Å²	37.9	32%	0.318	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.9	-179.8	-163.1	-91.7	0	0	0	110.8	L134 S189 V193 G207 E233	L134-Y191 HydrophobicContact CD1-CD1 4.46Å; L134-Y191 HydrophobicContact CD2-CD1 3.91Å; L134-Y191 HydrophobicContact CD2-CE1 4.41Å; S189-Y191 PolarHBondContact O-N 3.24Å; Y191-V193 HydrophobicContact CD1-CG2 4.31Å; Y191-V193 HydrophobicContact CE1-CG2 3.76Å; Y191-G207 VanDerWaalsContact CZ-C 3.48Å; Y191-G207 WeakPolarHBondContact OH-CA 3.28Å; Y191-G207 PolarHBondContact OH-O 2.87Å; Y191-G207 VanDerWaalsContact OH-O 3.07Å; Y191-E233 WeakPolarHBondContact O-CB 3.33Å; Y191-E233 PolarHBondContact O-N 2.88Å
192	V	98.8	Very high	97.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	136.1	-179	179.3	0	0	0	0	109.4	I182 R190 G207 A208 V210 L213 L230 I231 V232	I182-V192 HydrophobicContact CG2-CG2 4.49Å; R190-V192 HydrophobicContact CG-CG2 4.46Å; V192-G207 WeakPolarHBondContact O-CA 3.45Å; V192-A208 PolarHBondContact N-O 2.76Å; V192-A208 PolarHBondContact O-N 3.08Å; V192-A208 VanDerWaalsContact O-O 3.1Å; V192-V210 HydrophobicContact CB-CB 4.34Å; V192-V210 HydrophobicContact CB-CG2 4.42Å; V192-V210 HydrophobicContact CG2-CB 3.76Å; V192-V210 HydrophobicContact CG2-CG2 3.94Å; V192-L213 HydrophobicContact CB-CD2 3.79Å; V192-L213 HydrophobicContact CG1-CD2 3.64Å; V192-L230 HydrophobicContact CG1-CD2 4.12Å; V192-I231 CarbonylContact C-O 3.55Å; V192-I231 WeakPolarHBondContact CA-O 3.2Å; V192-V232 HydrophobicContact CG1-CG2 4.18Å; V192-V232 HydrophobicContact CG2-CB 4.26Å; V192-V232 HydrophobicContact CG2-CG1 4Å; V192-V232 HydrophobicContact CG2-CG2 3.95Å
193	V	98.9	Very high	97.7	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.018	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.4	171	-176.1	0	0	0	0	109.2	A132 L134 Y191 I205 H206 L230 I231	A132-V193 HydrophobicContact CB-CB 4.17Å; A132-V193 HydrophobicContact CB-CG1 4.23Å; A132-V193 HydrophobicContact CB-CG2 4.04Å; L134-V193 HydrophobicContact CD1-CG2 4.11Å; L134-V193 HydrophobicContact CG-CG2 4.43Å; Y191-V193 HydrophobicContact CD1-CG2 4.31Å; Y191-V193 HydrophobicContact CE1-CG2 3.76Å; V193-I205 HydrophobicContact CG1-CG2 3.56Å; V193-H206 CarbonylContact C-O 3.6Å; V193-H206 WeakPolarHBondContact CA-O 3.41Å; V193-L230 WeakPolarHBondContact O-CA 3.36Å; V193-I231 HydrophobicContact CB-CB 4.23Å; V193-I231 PolarHBondContact N-O 3Å; V193-I231 PolarHBondContact O-N 3.16Å
194	L	98.8	Very high	97.7	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.016	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	114.3	167.2	173.9	62.2	0	0	0	108.9	L175 I205 H206 L213 W216 V217 M228 L230	L175-L194 HydrophobicContact CD1-CD1 4.08Å; L175-L194 HydrophobicContact CD2-CD2 4.11Å; L194-I205 WeakPolarHBondContact O-CA 3.34Å; L194-H206 PolarHBondContact N-O 3.26Å; L194-H206 PolarHBondContact O-N 3.22Å; L194-L213 HydrophobicContact CB-CD1 4.18Å; L194-L213 HydrophobicContact CB-CD2 4.29Å; L194-W216 HydrophobicContact CD2-CZ3 4.24Å; L194-V217 HydrophobicContact CD2-CG2 3.91Å; L194-M228 HydrophobicContact CD1-CB 3.8Å; L194-M228 HydrophobicContact CD1-CG 3.84Å; L194-M228 HydrophobicContact CD1-SD 3.95Å; L194-L230 HydrophobicContact CB-CD2 4.14Å; L194-L230 HydrophobicContact CD1-CD2 3.67Å; L194-L230 HydrophobicContact CG-CD2 4.49Å
195	A	98.6	Very high	97.7	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.008	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	116.1	169.5	0	0	0	0	0	109	A128 L198 I205 M228 V229	A128-A195 HydrophobicContact CB-CB 3.78Å; A195-L198 HydrophobicContact CB-CD1 4.2Å; A195-L198 HydrophobicContact CB-CD2 4.05Å; A195-L198 HydrophobicContact CB-CG 4.24Å; A195-I205 HydrophobicContact CB-CG1 4.21Å; A195-M228 CarbonylContact O-C 3.48Å; A195-M228 VanDerWaalsContact O-CA 3.3Å; A195-M228 WeakPolarHBondContact O-CA 3.21Å; A195-V229 HydrophobicContact CB-CB 4.39Å; A195-V229 PolarHBondContact N-O 2.91Å; A195-V229 PolarHBondContact O-N 3.34Å
196	R	97.8	Very high	97.7	Very high	24 Å²	24	53.5 Å²	53.5	9%	0.091	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.6	-172.1	-175.6	179.2	73.9	69.7	10.6	110.3	L198 W202 E203 T204 R223 K225 E227 M228	R196-L198 PolarHBondContact O-N 3.46Å; R196-W202 PolarHBondContact NH2-O 3.42Å; R196-E203 WeakPolarHBondContact O-CA 3.23Å; R196-T204 PolarHBondContact N-O 3.15Å; R196-T204 PolarHBondContact NH2-OG1 3.11Å; R196-T204 PolarHBondContact O-N 2.98Å; R196-R223 VanDerWaalsContact CD-O 3.25Å; R196-R223 WeakPolarHBondContact CD-O 3.25Å; R196-K225 VanDerWaalsContact CD-O 3.27Å; R196-K225 WeakPolarHBondContact CD-O 3.28Å; R196-K225 WeakPolarHBondContact CG-O 3.36Å; R196-K225 PolarHBondContact NH1-O 3.49Å; R196-E227 WeakPolarHBondContact CA-O 3.42Å; R196-M228 HydrophobicContact CB-CG 3.99Å; R196-M228 HydrophobicContact CG-CG 3.75Å; R196-M228 HydrophobicContact CG-SD 4.37Å
197	E	97.1	Very high	97.8	Very high	29 Å²	29	54 Å²	54	14%	0.136	28%	0.281	C	S	.	.	S	Bend	trans	51.9	43.9	172.7	-70.5	-73.1	93.9	0	0	112.2	T199 K200 W202 E203 G226 E227	E197-T199 PolarHBondContact O-N 3.47Å; E197-K200 HydrophobicContact CB-CB 4.28Å; E197-K200 HydrophobicContact CB-CD 4.33Å; E197-K200 WeakPolarHBondContact O-CB 3.18Å; E197-K200 PolarHBondContact O-N 2.87Å; E197-K200 IonicContact OE1-NZ 3.28Å; E197-K200 PolarHBondContact OE1-NZ 3.23Å; E197-K200 VanDerWaalsContact OE2-CD 3.29Å; E197-K200 WeakPolarHBondContact OE2-CD 3.39Å; E197-K200 IonicContact OE2-NZ 2.97Å; E197-W202 HydrophobicContact CB-CB 4.49Å; E197-E203 WeakPolarHBondContact O-CA 3.44Å; E197-G226 VanDerWaalsContact OE1-CA 3.28Å; E197-G226 WeakPolarHBondContact OE1-CA 3.35Å; E197-E227 PolarHBondContact N-O 3.47Å; E197-E227 PolarHBondContact OE1-N 2.87Å
198	L	98.2	Very high	97.9	Very high	13 Å²	13	53 Å²	53	7%	0.068	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	133.1	-178.3	-73.1	170.2	0	0	0	111	I21 A124 T127 A128 A195 R196 K200 E203 I205 V229	I21-L198 HydrophobicContact CD1-CB 4.13Å; A124-L198 HydrophobicContact CB-CD1 4.36Å; A124-L198 WeakPolarHBondContact O-CD1 3.4Å; T127-L198 HydrophobicContact CG2-CD1 4.44Å; T127-L198 HydrophobicContact CG2-CD2 4.34Å; A128-L198 HydrophobicContact CB-CD1 3.88Å; A195-L198 HydrophobicContact CB-CD1 4.2Å; A195-L198 HydrophobicContact CB-CD2 4.05Å; A195-L198 HydrophobicContact CB-CG 4.24Å; R196-L198 PolarHBondContact O-N 3.46Å; L198-K200 PolarHBondContact O-N 2.91Å; L198-E203 WeakPolarHBondContact CA-OE2 3.44Å; L198-E203 HydrophobicContact CD2-CG 4.43Å; L198-I205 HydrophobicContact CD2-CD1 4.07Å; L198-I205 HydrophobicContact CD2-CG1 4.33Å; L198-V229 HydrophobicContact CD1-CG2 4.07Å
199	T	97.9	Very high	97.9	Very high	33 Å²	33	48.2 Å²	48.2	20%	0.202	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	8.6	-178.6	77.1	0	0	0	0	114.8	I21 G22 N23 D26 E197 E203	I21-T199 HydrophobicContact CD1-CG2 4.13Å; I21-T199 HydrophobicContact CG1-CG2 4.06Å; G22-T199 WeakPolarHBondContact CA-OG1 3.25Å; G22-T199 PolarHBondContact N-OG1 3.02Å; G22-T199 VanDerWaalsContact N-OG1 3.17Å; N23-T199 WeakPolarHBondContact CB-O 3.31Å; N23-T199 PolarHBondContact N-O 3.09Å; N23-T199 VanDerWaalsContact N-O 3.11Å; N23-T199 PolarHBondContact N-OG1 3.12Å; D26-T199 VanDerWaalsContact OD2-CB 3.29Å; D26-T199 WeakPolarHBondContact OD2-CB 3.24Å; D26-T199 VanDerWaalsContact OD2-CG2 3.27Å; D26-T199 WeakPolarHBondContact OD2-CG2 3.49Å; E197-T199 PolarHBondContact O-N 3.47Å; T199-E203 PolarHBondContact N-OE2 3.44Å
200	K	96.8	Very high	98	Very high	62 Å²	62	43.2 Å²	43.2	27%	0.27	22%	0.216	S	C	.	.	S	Bend	trans	-105.6	175.8	177.5	-56.3	174.1	-167.9	173.1	0	111.2	I21 E197 L198 W202 E203 E227	I21-K200 WeakPolarHBondContact O-CE 3.42Å; E197-K200 HydrophobicContact CB-CB 4.28Å; E197-K200 HydrophobicContact CB-CD 4.33Å; E197-K200 WeakPolarHBondContact O-CB 3.18Å; E197-K200 PolarHBondContact O-N 2.87Å; E197-K200 IonicContact OE1-NZ 3.28Å; E197-K200 PolarHBondContact OE1-NZ 3.23Å; E197-K200 VanDerWaalsContact OE2-CD 3.29Å; E197-K200 WeakPolarHBondContact OE2-CD 3.39Å; E197-K200 IonicContact OE2-NZ 2.97Å; L198-K200 PolarHBondContact O-N 2.91Å; K200-W202 PolarHBondContact O-N 3.23Å; K200-W202 VanDerWaalsContact O-N 3.16Å; K200-E203 PolarHBondContact O-N 2.89Å; K200-E227 IonicContact NZ-OE2 2.83Å; K200-E227 PolarHBondContact NZ-OE2 2.85Å
201	T	95.4	Very high	98	Very high	127 Å²	127	43.3 Å²	43.3	78%	0.779	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-35	-177.8	-51.1	0	0	0	0	114.1
202	W	95.4	Very high	98	Very high	180 Å²	180	45.6 Å²	45.6	68%	0.682	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	28.1	-174.5	-55.8	112.7	0	0	0	112.6	R196 E197 K200 T204	R196-W202 PolarHBondContact NH2-O 3.42Å; E197-W202 HydrophobicContact CB-CB 4.49Å; K200-W202 PolarHBondContact O-N 3.23Å; K200-W202 VanDerWaalsContact O-N 3.16Å; W202-T204 PolarHBondContact O-N 2.85Å; W202-T204 PolarHBondContact O-OG1 3.45Å
203	E	97.9	Very high	98	Very high	96 Å²	96	45.6 Å²	45.6	45%	0.449	24%	0.236	S	C	.	.			trans	-51.4	132.9	179.1	-176.5	174.7	87.2	0	0	111.2	R196 E197 L198 T199 K200	R196-E203 WeakPolarHBondContact O-CA 3.23Å; E197-E203 WeakPolarHBondContact O-CA 3.44Å; L198-E203 WeakPolarHBondContact CA-OE2 3.44Å; L198-E203 HydrophobicContact CD2-CG 4.43Å; T199-E203 PolarHBondContact N-OE2 3.44Å; K200-E203 PolarHBondContact O-N 2.89Å
204	T	97.9	Very high	98	Very high	45 Å²	45	46.3 Å²	46.3	28%	0.276	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	127.9	175.6	-53.4	0	0	0	0	109.4	R196 W202 W216	R196-T204 PolarHBondContact N-O 3.15Å; R196-T204 PolarHBondContact NH2-OG1 3.11Å; R196-T204 PolarHBondContact O-N 2.98Å; W202-T204 PolarHBondContact O-N 2.85Å; W202-T204 PolarHBondContact O-OG1 3.45Å; T204-W216 HydrophobicContact CG2-CH2 4.2Å
205	I	98.4	Very high	98	Very high	64 Å²	64	48.6 Å²	48.6	33%	0.328	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	115.3	173.7	-55.6	-179.4	0	0	0	107.1	A131 V193 L194 A195 L198	A131-I205 HydrophobicContact CB-CD1 3.56Å; V193-I205 HydrophobicContact CG1-CG2 3.56Å; L194-I205 WeakPolarHBondContact O-CA 3.34Å; A195-I205 HydrophobicContact CB-CG1 4.21Å; L198-I205 HydrophobicContact CD2-CD1 4.07Å; L198-I205 HydrophobicContact CD2-CG1 4.33Å
206	H	98.5	Very high	98	Very high	59 Å²	59	51 Å²	51	27%	0.273	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	126.6	-177.2	-174.4	65.6	0	0	0	110.7	V193 L194 W216	V193-H206 CarbonylContact C-O 3.6Å; V193-H206 WeakPolarHBondContact CA-O 3.41Å; L194-H206 PolarHBondContact N-O 3.26Å; L194-H206 PolarHBondContact O-N 3.22Å; H206-W216 HydrophobicContact CB-CH2 3.89Å; H206-W216 HydrophobicContact CB-CZ2 4.24Å; H206-W216 HydrophobicContact CB-CZ3 4.13Å; H206-W216 AromaticContact CD2-CD2 3.54Å; H206-W216 AromaticContact CD2-CE2 3.78Å; H206-W216 AromaticContact CD2-CE3 3.6Å; H206-W216 AromaticContact CD2-CZ3 3.91Å; H206-W216 AromaticContact NE2-CD2 3.81Å; H206-W216 AromaticContact NE2-CE2 3.99Å; H206-W216 AromaticContact NE2-CG 3.88Å
207	G	98.7	Very high	98	Very high	24 Å²	24	49.9 Å²	49.9	25%	0.247	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.4	-179.5	0	0	0	0	0	112.2	Y191 V192	Y191-G207 VanDerWaalsContact CZ-C 3.48Å; Y191-G207 WeakPolarHBondContact OH-CA 3.28Å; Y191-G207 PolarHBondContact OH-O 2.87Å; Y191-G207 VanDerWaalsContact OH-O 3.07Å; V192-G207 WeakPolarHBondContact O-CA 3.45Å
208	A	98.7	Very high	98	Very high	7 Å²	7	53.6 Å²	53.6	6%	0.058	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	164.8	176.9	0	0	0	0	0	110.2	V192 V210 E212 L213	V192-A208 PolarHBondContact N-O 2.76Å; V192-A208 PolarHBondContact O-N 3.08Å; V192-A208 VanDerWaalsContact O-O 3.1Å; A208-V210 PolarHBondContact O-N 3.34Å; A208-E212 HydrophobicContact CB-CB 4.16Å; A208-L213 HydrophobicContact CB-CB 4.24Å
209	P	98.6	Very high	98	Very high	36 Å²	36	59.7 Å²	59.7	23%	0.234	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.1	135.8	159.1	-25.2	35.9	0	0	0	110.2	E188 G211 E212 L213	E188-P209 CarbonylContact O-C 3.53Å; P209-G211 PolarHBondContact O-N 3.24Å; P209-G211 VanDerWaalsContact O-N 3.12Å; P209-E212 HydrophobicContact CB-CG 4.41Å; P209-E212 WeakPolarHBondContact O-CA 3.38Å; P209-E212 WeakPolarHBondContact O-CB 3.49Å; P209-E212 PolarHBondContact O-N 3.04Å; P209-L213 PolarHBondContact O-N 3Å
210	V	98.7	Very high	97.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-28.8	-168	66.6	0	0	0	0	113.4	L179 I182 V183 G187 E188 R190 V192 A208 L213 L214	L179-V210 HydrophobicContact CD2-CG2 4.04Å; I182-V210 HydrophobicContact CB-CG2 4.25Å; I182-V210 HydrophobicContact CG2-CB 4.34Å; I182-V210 HydrophobicContact CG2-CG1 4.23Å; I182-V210 HydrophobicContact CG2-CG2 3.76Å; V183-V210 HydrophobicContact CG2-CB 4.33Å; V183-V210 HydrophobicContact CG2-CG1 3.74Å; V183-V210 HydrophobicContact CG2-CG2 4.03Å; G187-V210 VanDerWaalsContact O-CG1 3.25Å; G187-V210 WeakPolarHBondContact O-CG1 3.38Å; E188-V210 PolarHBondContact O-N 3.43Å; E188-V210 VanDerWaalsContact O-N 3.14Å; R190-V210 HydrophobicContact CB-CG1 4.13Å; R190-V210 WeakPolarHBondContact O-CB 3.19Å; R190-V210 PolarHBondContact O-N 3.03Å; V192-V210 HydrophobicContact CB-CB 4.34Å; V192-V210 HydrophobicContact CB-CG2 4.42Å; V192-V210 HydrophobicContact CG2-CB 3.76Å; V192-V210 HydrophobicContact CG2-CG2 3.94Å; A208-V210 PolarHBondContact O-N 3.34Å; V210-L213 PolarHBondContact O-N 3.22Å; V210-L214 VanDerWaalsContact O-CB 3.31Å; V210-L214 WeakPolarHBondContact O-CB 3.31Å; V210-L214 PolarHBondContact O-N 3.44Å
211	G	98.6	Very high	97.8	Very high	22 Å²	22	63.4 Å²	63.4	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-61.7	-44	171.5	0	0	0	0	0	112.5	E188 P209 A215	E188-G211 PolarHBondContact O-N 3.14Å; P209-G211 PolarHBondContact O-N 3.24Å; P209-G211 VanDerWaalsContact O-N 3.12Å; G211-A215 PolarHBondContact O-N 3.05Å
212	E	98.8	Very high	97.8	Very high	129 Å²	129	61.4 Å²	61.4	60%	0.603	31%	0.31	S	S	*	.	H	α-helix	trans	-70.3	-41.2	175.5	-64.1	177.3	-150.3	0	0	111.4	A208 P209 L214 A215 W216	A208-E212 HydrophobicContact CB-CB 4.16Å; P209-E212 HydrophobicContact CB-CG 4.41Å; P209-E212 WeakPolarHBondContact O-CA 3.38Å; P209-E212 WeakPolarHBondContact O-CB 3.49Å; P209-E212 PolarHBondContact O-N 3.04Å; E212-L214 VanDerWaalsContact C-N 3.32Å; E212-L214 PolarHBondContact O-N 3.5Å; E212-A215 PolarHBondContact O-N 2.87Å; E212-W216 WeakPolarHBondContact O-CB 3.42Å; E212-W216 PolarHBondContact O-N 3.17Å
213	L	98.7	Very high	97.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-44	176.5	-177.8	62.5	0	0	0	111.2	L179 V192 L194 A208 P209 V210 W216 V217	L179-L213 HydrophobicContact CD1-CG 4.5Å; L179-L213 HydrophobicContact CD2-CD2 3.96Å; V192-L213 HydrophobicContact CB-CD2 3.79Å; V192-L213 HydrophobicContact CG1-CD2 3.64Å; L194-L213 HydrophobicContact CB-CD1 4.18Å; L194-L213 HydrophobicContact CB-CD2 4.29Å; A208-L213 HydrophobicContact CB-CB 4.24Å; P209-L213 PolarHBondContact O-N 3Å; V210-L213 PolarHBondContact O-N 3.22Å; L213-W216 HydrophobicContact CD1-CE3 4Å; L213-W216 HydrophobicContact CD1-CZ3 4.46Å; L213-W216 PolarHBondContact O-N 3.28Å; L213-V217 HydrophobicContact CD1-CG2 4.41Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 3.4Å
214	L	98.6	Very high	97.7	Very high	19 Å²	19	54.3 Å²	54.3	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-44.8	176.8	174.2	60.2	0	0	0	111.6	L176 L179 E180 V183 V210 E212 V217 K218	L176-L214 HydrophobicContact CD2-CD1 4.01Å; L179-L214 HydrophobicContact CB-CB 4.32Å; L179-L214 HydrophobicContact CB-CD1 3.83Å; L179-L214 HydrophobicContact CD1-CD1 4.44Å; E180-L214 HydrophobicContact CG-CD1 3.98Å; E180-L214 HydrophobicContact CG-CD2 3.68Å; E180-L214 HydrophobicContact CG-CG 4.49Å; V183-L214 HydrophobicContact CG2-CD2 4.12Å; V210-L214 VanDerWaalsContact O-CB 3.31Å; V210-L214 WeakPolarHBondContact O-CB 3.31Å; V210-L214 PolarHBondContact O-N 3.44Å; E212-L214 VanDerWaalsContact C-N 3.32Å; E212-L214 PolarHBondContact O-N 3.5Å; L214-V217 PolarHBondContact O-N 3.32Å; L214-K218 HydrophobicContact CD1-CD 4.21Å; L214-K218 HydrophobicContact CD1-CG 4.43Å; L214-K218 HydrophobicContact CG-CD 4.37Å; L214-K218 WeakPolarHBondContact O-CG 3.47Å; L214-K218 PolarHBondContact O-N 2.94Å; L214-K218 VanDerWaalsContact O-N 3.11Å
215	A	98.4	Very high	97.5	Very high	51 Å²	51	57 Å²	57	42%	0.421	29%	0.287	S	S	.	.	H	α-helix	trans	-61.3	-48	175.6	0	0	0	0	0	111	G211 E212 V217 K218 E219	G211-A215 PolarHBondContact O-N 3.05Å; E212-A215 PolarHBondContact O-N 2.87Å; A215-V217 PolarHBondContact O-N 3.41Å; A215-K218 WeakPolarHBondContact O-CB 3.41Å; A215-K218 PolarHBondContact O-N 3.45Å; A215-K218 VanDerWaalsContact O-N 3.08Å; A215-E219 PolarHBondContact O-N 2.94Å
216	W	98.3	Very high	97.3	Very high	51 Å²	51	55.2 Å²	55.2	19%	0.193	29%	0.285	C	S	.	.	H	α-helix	trans	-58.5	-42.4	177.4	179.3	85.5	0	0	0	112.5	L194 T204 H206 E212 L213 K218 E219 R223	L194-W216 HydrophobicContact CD2-CZ3 4.24Å; T204-W216 HydrophobicContact CG2-CH2 4.2Å; H206-W216 HydrophobicContact CB-CH2 3.89Å; H206-W216 HydrophobicContact CB-CZ2 4.24Å; H206-W216 HydrophobicContact CB-CZ3 4.13Å; H206-W216 AromaticContact CD2-CD2 3.54Å; H206-W216 AromaticContact CD2-CE2 3.78Å; H206-W216 AromaticContact CD2-CE3 3.6Å; H206-W216 AromaticContact CD2-CZ3 3.91Å; H206-W216 AromaticContact NE2-CD2 3.81Å; H206-W216 AromaticContact NE2-CE2 3.99Å; H206-W216 AromaticContact NE2-CG 3.88Å; E212-W216 WeakPolarHBondContact O-CB 3.42Å; E212-W216 PolarHBondContact O-N 3.17Å; L213-W216 HydrophobicContact CD1-CE3 4Å; L213-W216 HydrophobicContact CD1-CZ3 4.46Å; L213-W216 PolarHBondContact O-N 3.28Å; W216-K218 VanDerWaalsContact C-N 3.33Å; W216-K218 PolarHBondContact O-N 3.37Å; W216-E219 PolarHBondContact O-N 2.9Å; W216-R223 HydrophobicContact CE3-CB 4.49Å; W216-R223 HydrophobicContact CH2-CB 4.09Å; W216-R223 HydrophobicContact CH2-CG 3.82Å; W216-R223 HydrophobicContact CZ2-CG 4.03Å; W216-R223 HydrophobicContact CZ3-CB 3.95Å; W216-R223 HydrophobicContact CZ3-CG 4.1Å; W216-R223 WeakPolarHBondContact O-CD 3.46Å; W216-R223 PolarHBondContact O-NH1 3.12Å
217	V	98	Very high	97.2	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-35.7	176.2	173.2	0	0	0	0	111.7	L175 L176 L179 L194 L213 L214 A215 E219 R224	L175-V217 HydrophobicContact CD2-CG1 3.65Å; L175-V217 HydrophobicContact CD2-CG2 4.24Å; L176-V217 HydrophobicContact CD2-CB 4.31Å; L176-V217 HydrophobicContact CD2-CG1 3.64Å; L179-V217 HydrophobicContact CD1-CB 4.28Å; L179-V217 HydrophobicContact CD1-CG2 3.92Å; L194-V217 HydrophobicContact CD2-CG2 3.91Å; L213-V217 HydrophobicContact CD1-CG2 4.41Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 3.4Å; L214-V217 PolarHBondContact O-N 3.32Å; A215-V217 PolarHBondContact O-N 3.41Å; V217-E219 VanDerWaalsContact C-N 3.29Å; V217-E219 PolarHBondContact O-N 2.88Å; V217-R224 HydrophobicContact CG1-CB 3.99Å
218	K	97.8	Very high	97.1	Very high	107 Å²	107	56.9 Å²	56.9	47%	0.465	29%	0.286	S	S	.	.	H	α-helix	trans	-68.6	-24.2	-179.6	-78.4	176.5	171.4	173.1	0	113.7	L176 E180 L214 A215 W216	L176-K218 HydrophobicContact CD1-CG 4.42Å; L176-K218 HydrophobicContact CD2-CG 3.76Å; E180-K218 WeakPolarHBondContact OE1-CE 3.3Å; E180-K218 IonicContact OE1-NZ 3.23Å; E180-K218 PolarHBondContact OE1-NZ 3.32Å; L214-K218 HydrophobicContact CD1-CD 4.21Å; L214-K218 HydrophobicContact CD1-CG 4.43Å; L214-K218 HydrophobicContact CG-CD 4.37Å; L214-K218 WeakPolarHBondContact O-CG 3.47Å; L214-K218 PolarHBondContact O-N 2.94Å; L214-K218 VanDerWaalsContact O-N 3.11Å; A215-K218 WeakPolarHBondContact O-CB 3.41Å; A215-K218 PolarHBondContact O-N 3.45Å; A215-K218 VanDerWaalsContact O-N 3.08Å; W216-K218 VanDerWaalsContact C-N 3.33Å; W216-K218 PolarHBondContact O-N 3.37Å
219	E	97.9	Very high	97.1	Very high	140 Å²	140	56.7 Å²	56.7	65%	0.654	28%	0.284	S	S	*	.	H	α-helix	trans	-70.9	-26.2	-178.6	-72.5	170.9	-179.8	0	0	114.4	A215 W216 V217 R223	A215-E219 PolarHBondContact O-N 2.94Å; W216-E219 PolarHBondContact O-N 2.9Å; V217-E219 VanDerWaalsContact C-N 3.29Å; V217-E219 PolarHBondContact O-N 2.88Å; E219-R223 IonicContact OE2-CZ 2.85Å; E219-R223 IonicContact OE2-NH1 2.68Å; E219-R223 PolarHBondContact OE2-NH1 2.79Å; E219-R223 IonicContact OE2-NH2 3.57Å
220	D	96.7	Very high	97.1	Very high	57 Å²	57	55 Å²	55	31%	0.305	27%	0.273	S	S	.	.			trans	-146.5	116.3	-178.7	176.1	5.6	0	0	0	110.7	N222 R223	D220-N222 PolarHBondContact O-N 3.43Å; D220-N222 VanDerWaalsContact O-N 3.07Å; D220-N222 WeakPolarHBondContact OD1-CB 3.32Å; D220-N222 PolarHBondContact OD1-N 2.98Å; D220-N222 PolarHBondContact OD1-ND2 3.16Å; D220-R223 HydrophobicContact CB-CG 3.96Å; D220-R223 VanDerWaalsContact O-CB 3.28Å; D220-R223 WeakPolarHBondContact O-CB 3.37Å; D220-R223 PolarHBondContact O-N 3.3Å
221	E	94.1	Very high	97.1	Very high	117 Å²	117	55 Å²	55	55%	0.547	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-59.6	-22.5	-179.8	-59.2	-162.5	129.5	0	0	113.8	R223 R224	E221-R223 PolarHBondContact O-N 3.25Å; E221-R224 WeakPolarHBondContact O-CG 3.47Å; E221-R224 PolarHBondContact O-N 3.36Å; E221-R224 IonicContact OE1-CZ 2.81Å; E221-R224 IonicContact OE1-NH2 3.84Å; E221-R224 PolarHBondContact OE1-NH2 3.06Å
222	N	95.1	Very high	97.1	Very high	84 Å²	84	54 Å²	54	45%	0.449	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-68.4	-24	175.9	-60.3	-53.3	0	0	0	112.2	D220 R224 K225	D220-N222 PolarHBondContact O-N 3.43Å; D220-N222 VanDerWaalsContact O-N 3.07Å; D220-N222 WeakPolarHBondContact OD1-CB 3.32Å; D220-N222 PolarHBondContact OD1-N 2.98Å; D220-N222 PolarHBondContact OD1-ND2 3.16Å; N222-R224 PolarHBondContact O-N 3.31Å; N222-K225 PolarHBondContact O-N 3.43Å; N222-K225 PolarHBondContact OD1-NZ 3.35Å
223	R	95.8	Very high	97.1	Very high	57 Å²	57	49.7 Å²	49.7	22%	0.215	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-69.4	-12.4	177.7	-62.7	172.4	-177.3	171.4	3.2	113.4	R196 W216 E219 D220 E221	R196-R223 VanDerWaalsContact CD-O 3.25Å; R196-R223 WeakPolarHBondContact CD-O 3.25Å; W216-R223 HydrophobicContact CE3-CB 4.49Å; W216-R223 HydrophobicContact CH2-CB 4.09Å; W216-R223 HydrophobicContact CH2-CG 3.82Å; W216-R223 HydrophobicContact CZ2-CG 4.03Å; W216-R223 HydrophobicContact CZ3-CB 3.95Å; W216-R223 HydrophobicContact CZ3-CG 4.1Å; W216-R223 WeakPolarHBondContact O-CD 3.46Å; W216-R223 PolarHBondContact O-NH1 3.12Å; E219-R223 IonicContact OE2-CZ 2.85Å; E219-R223 IonicContact OE2-NH1 2.68Å; E219-R223 PolarHBondContact OE2-NH1 2.79Å; E219-R223 IonicContact OE2-NH2 3.57Å; D220-R223 HydrophobicContact CB-CG 3.96Å; D220-R223 VanDerWaalsContact O-CB 3.28Å; D220-R223 WeakPolarHBondContact O-CB 3.37Å; D220-R223 PolarHBondContact O-N 3.3Å; E221-R223 PolarHBondContact O-N 3.25Å
224	R	94.6	Very high	97.1	Very high	71 Å²	71	50 Å²	50	27%	0.268	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-110.1	0.9	175.6	60.4	175.6	177.7	178.4	-1.8	114.4	T172 L175 V217 E221 N222 M228	T172-R224 WeakPolarHBondContact CA-O 3.41Å; T172-R224 VanDerWaalsContact CB-O 3.31Å; T172-R224 WeakPolarHBondContact CB-O 3.31Å; T172-R224 VanDerWaalsContact CG2-O 3.27Å; T172-R224 WeakPolarHBondContact CG2-O 3.39Å; T172-R224 PolarHBondContact OG1-O 3.18Å; T172-R224 VanDerWaalsContact OG1-O 3.11Å; L175-R224 HydrophobicContact CD2-CB 3.63Å; V217-R224 HydrophobicContact CG1-CB 3.99Å; E221-R224 WeakPolarHBondContact O-CG 3.47Å; E221-R224 PolarHBondContact O-N 3.36Å; E221-R224 IonicContact OE1-CZ 2.81Å; E221-R224 IonicContact OE1-NH2 3.84Å; E221-R224 PolarHBondContact OE1-NH2 3.06Å; N222-R224 PolarHBondContact O-N 3.31Å; R224-M228 WeakPolarHBondContact O-CE 3.43Å
225	K	94.8	Very high	96.9	Very high	102 Å²	102	52.1 Å²	52.1	44%	0.443	26%	0.255	S	S	.	.			trans	-85	137.7	-178.2	-73.8	178.8	-173.3	165	0	112.3	R196 N222	R196-K225 VanDerWaalsContact CD-O 3.27Å; R196-K225 WeakPolarHBondContact CD-O 3.28Å; R196-K225 WeakPolarHBondContact CG-O 3.36Å; R196-K225 PolarHBondContact NH1-O 3.49Å; N222-K225 PolarHBondContact O-N 3.43Å; N222-K225 PolarHBondContact OD1-NZ 3.35Å
226	G	94.2	Very high	96.5	Very high	26 Å²	26	56.4 Å²	56.4	27%	0.268	26%	0.264	S	S	.	.	S	Bend	trans	101.3	-160.1	176.9	0	0	0	0	0	113.3	T172 E197	T172-G226 PolarHBondContact OG1-N 3.42Å; T172-G226 PolarHBondContact OG1-O 2.68Å; E197-G226 VanDerWaalsContact OE1-CA 3.28Å; E197-G226 WeakPolarHBondContact OE1-CA 3.35Å
227	E	95.3	Very high	95.6	Very high	110 Å²	110	57.4 Å²	57.4	51%	0.514	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	141.8	178.2	-66.8	171.7	161.5	0	0	110.7	R196 E197 K200	R196-E227 WeakPolarHBondContact CA-O 3.42Å; E197-E227 PolarHBondContact N-O 3.47Å; E197-E227 PolarHBondContact OE1-N 2.87Å; K200-E227 IonicContact NZ-OE2 2.83Å; K200-E227 PolarHBondContact NZ-OE2 2.85Å
228	M	97.8	Very high	94.6	Very high	7 Å²	7	63.9 Å²	63.9	3%	0.034	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	146.7	-170.3	-66.4	165.3	-67.8	0	0	112.4	Y169 E170 S171 T172 L175 L194 A195 R196 R224	Y169-M228 WeakPolarHBondContact CA-O 3.42Å; E170-M228 PolarHBondContact N-O 2.85Å; E170-M228 PolarHBondContact O-N 2.81Å; S171-M228 WeakPolarHBondContact O-CE 3.33Å; T172-M228 VanDerWaalsContact N-CE 3.32Å; L175-M228 HydrophobicContact CB-CE 4.04Å; L175-M228 HydrophobicContact CB-SD 4.42Å; L175-M228 HydrophobicContact CD1-SD 4.15Å; L175-M228 HydrophobicContact CD2-CE 4.29Å; L175-M228 HydrophobicContact CD2-SD 3.61Å; L175-M228 HydrophobicContact CG-SD 4.26Å; L194-M228 HydrophobicContact CD1-CB 3.8Å; L194-M228 HydrophobicContact CD1-CG 3.84Å; L194-M228 HydrophobicContact CD1-SD 3.95Å; A195-M228 CarbonylContact O-C 3.48Å; A195-M228 VanDerWaalsContact O-CA 3.3Å; A195-M228 WeakPolarHBondContact O-CA 3.21Å; R196-M228 HydrophobicContact CB-CG 3.99Å; R196-M228 HydrophobicContact CG-CG 3.75Å; R196-M228 HydrophobicContact CG-SD 4.37Å; R224-M228 WeakPolarHBondContact O-CE 3.43Å
229	V	98.6	Very high	93.2	Very high	4 Å²	4	68.6 Å²	68.6	2%	0.024	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.8	168.4	-171.1	0	0	0	0	107.9	A124 A128 I167 F168 Y169 A195 L198 I231	A124-V229 HydrophobicContact CB-CG2 3.97Å; A128-V229 HydrophobicContact CB-CB 3.76Å; A128-V229 HydrophobicContact CB-CG1 3.69Å; A128-V229 HydrophobicContact CB-CG2 4.18Å; I167-V229 HydrophobicContact CG2-CG1 3.65Å; F168-V229 CarbonylContact O-C 3.57Å; F168-V229 VanDerWaalsContact O-CA 3.3Å; F168-V229 WeakPolarHBondContact O-CA 3.47Å; F168-V229 WeakPolarHBondContact O-CG1 3.32Å; Y169-V229 HydrophobicContact CD1-CB 4.43Å; Y169-V229 HydrophobicContact CD1-CG1 4.17Å; Y169-V229 HydrophobicContact CD1-CG2 3.83Å; Y169-V229 HydrophobicContact CE1-CG1 4.3Å; Y169-V229 HydrophobicContact CE1-CG2 3.82Å; A195-V229 HydrophobicContact CB-CB 4.39Å; A195-V229 PolarHBondContact N-O 2.91Å; A195-V229 PolarHBondContact O-N 3.34Å; L198-V229 HydrophobicContact CD1-CG2 4.07Å; V229-I231 HydrophobicContact CG1-CD1 3.66Å; V229-I231 HydrophobicContact CG1-CG1 4.46Å
230	L	98.8	Very high	91.9	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.9	170.2	-64.7	174.6	0	0	0	108.7	I167 F168 E170 L175 L179 I182 V192 V193 L194	I167-L230 WeakPolarHBondContact CA-O 3.27Å; F168-L230 HydrophobicContact CB-CB 4.35Å; F168-L230 PolarHBondContact N-O 2.91Å; F168-L230 PolarHBondContact O-N 3.33Å; E170-L230 HydrophobicContact CB-CD1 4.36Å; L175-L230 HydrophobicContact CD1-CD1 4.28Å; L175-L230 HydrophobicContact CD1-CD2 4.05Å; L175-L230 HydrophobicContact CD1-CG 4.46Å; L179-L230 HydrophobicContact CD2-CD1 4.37Å; L179-L230 HydrophobicContact CD2-CD2 4.17Å; I182-L230 HydrophobicContact CD1-CD1 4.08Å; V192-L230 HydrophobicContact CG1-CD2 4.12Å; V193-L230 WeakPolarHBondContact O-CA 3.36Å; L194-L230 HydrophobicContact CB-CD2 4.14Å; L194-L230 HydrophobicContact CD1-CD2 3.67Å; L194-L230 HydrophobicContact CG-CD2 4.49Å
231	I	98.9	Very high	91	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	111.2	172	-45.2	-64.7	0	0	0	107.6	A128 L129 A132 L134 T165 L166 I167 V192 V193 V229	A128-I231 HydrophobicContact CB-CD1 3.82Å; A128-I231 HydrophobicContact CB-CG1 4.05Å; L129-I231 HydrophobicContact CB-CD1 4.41Å; L129-I231 HydrophobicContact CD1-CG2 3.96Å; A132-I231 HydrophobicContact CB-CB 4.08Å; A132-I231 HydrophobicContact CB-CG1 4.05Å; A132-I231 HydrophobicContact CB-CG2 4Å; L134-I231 HydrophobicContact CD1-CB 4.33Å; L134-I231 HydrophobicContact CD1-CG2 3.76Å; T165-I231 HydrophobicContact CG2-CG2 3.32Å; L166-I231 CarbonylContact O-C 3.58Å; L166-I231 WeakPolarHBondContact O-CA 3.25Å; I167-I231 HydrophobicContact CB-CD1 4.17Å; I167-I231 HydrophobicContact CD1-CD1 4.12Å; I167-I231 HydrophobicContact CG1-CD1 3.72Å; I167-I231 HydrophobicContact CG2-CD1 3.75Å; V192-I231 CarbonylContact C-O 3.55Å; V192-I231 WeakPolarHBondContact CA-O 3.2Å; V193-I231 HydrophobicContact CB-CB 4.23Å; V193-I231 PolarHBondContact N-O 3Å; V193-I231 PolarHBondContact O-N 3.16Å; V229-I231 HydrophobicContact CG1-CD1 3.66Å; V229-I231 HydrophobicContact CG1-CG1 4.46Å
232	V	98.8	Very high	90.5	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.5	-176	-178.7	0	0	0	0	109	T165 L166 F168 L186 R190 V192	T165-V232 WeakPolarHBondContact CA-O 3.4Å; L166-V232 HydrophobicContact CB-CB 4.16Å; L166-V232 HydrophobicContact CD1-CG1 4.44Å; L166-V232 PolarHBondContact N-O 3.45Å; L166-V232 PolarHBondContact O-N 2.88Å; F168-V232 HydrophobicContact CD2-CG2 4.05Å; F168-V232 HydrophobicContact CE2-CG2 3.88Å; L186-V232 HydrophobicContact CD1-CG1 3.94Å; R190-V232 HydrophobicContact CG-CG1 3.7Å; V192-V232 HydrophobicContact CG1-CG2 4.18Å; V192-V232 HydrophobicContact CG2-CB 4.26Å; V192-V232 HydrophobicContact CG2-CG1 4Å; V192-V232 HydrophobicContact CG2-CG2 3.95Å
233	E	98.4	Very high	90	Very high	40 Å²	40	67 Å²	67	19%	0.187	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-61.8	138.6	176.8	-171.5	174.2	-133.1	0	0	110.9	L134 R190 Y191 K236	L134-E233 HydrophobicContact CD1-CB 4.2Å; L134-E233 HydrophobicContact CD2-CB 3.86Å; L134-E233 HydrophobicContact CD2-CG 3.9Å; R190-E233 VanDerWaalsContact CD-O 3.23Å; R190-E233 WeakPolarHBondContact CD-O 3.37Å; R190-E233 PolarHBondContact NH1-O 3.13Å; Y191-E233 WeakPolarHBondContact O-CB 3.33Å; Y191-E233 PolarHBondContact O-N 2.88Å; E233-K236 WeakPolarHBondContact OE1-CE 3.4Å; E233-K236 IonicContact OE1-NZ 3.71Å; E233-K236 PolarHBondContact OE1-NZ 3.14Å; E233-K236 IonicContact OE2-NZ 2.7Å; E233-K236 PolarHBondContact OE2-NZ 2.91Å
234	G	97.7	Very high	89.5	Confident	7 Å²	7	68 Å²	68	7%	0.072	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-60.8	153.8	175.4	0	0	0	0	0	113	P163 R164 K236	P163-G234 WeakPolarHBondContact O-CA 3.37Å; R164-G234 VanDerWaalsContact O-CA 3.24Å; R164-G234 WeakPolarHBondContact O-CA 3.3Å; G234-K236 PolarHBondContact O-N 2.73Å
235	H	95.6	Very high	89.3	Confident	63 Å²	63	68.4 Å²	68.4	29%	0.292	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-65.5	124.1	178.1	177.6	-96	0	0	0	110.7	E162	E162-H235 WeakPolarHBondContact O-CB 3.32Å; E162-H235 PolarHBondContact O-N 2.7Å
236	K	90	Very high	89.2	Confident	140 Å²	140	63.5 Å²	63.5	61%	0.609	34%	0.341	S	S	*	.			trans	-93.9	99.6	173.1	-67.3	172.7	-178.1	152	0	108.6	E233 G234 Q238	E233-K236 WeakPolarHBondContact OE1-CE 3.4Å; E233-K236 IonicContact OE1-NZ 3.71Å; E233-K236 PolarHBondContact OE1-NZ 3.14Å; E233-K236 IonicContact OE2-NZ 2.7Å; E233-K236 PolarHBondContact OE2-NZ 2.91Å; G234-K236 PolarHBondContact O-N 2.73Å; K236-Q238 PolarHBondContact O-N 3.42Å
237	A	79.5	Confident	89.1	Confident	73 Å²	73	64 Å²	64	60%	0.603	34%	0.337	S	S	*	.			trans	-62.8	135.1	170	0	0	0	0	0	109.5
238	Q	77.1	Confident	89.1	Confident	136 Å²	136	65.9 Å²	65.9	64%	0.636	34%	0.34	S	S	*	.			trans	-76.2	143	169.7	-53.5	-174	-5.2	0	0	108.3	K236 E240 D241	K236-Q238 PolarHBondContact O-N 3.42Å; Q238-E240 PolarHBondContact O-N 3.5Å; Q238-D241 VanDerWaalsContact CB-OD2 3.3Å; Q238-D241 WeakPolarHBondContact CB-OD2 3.4Å; Q238-D241 PolarHBondContact N-OD2 3.24Å; Q238-D241 WeakPolarHBondContact O-CB 3.28Å; Q238-D241 PolarHBondContact O-N 3.06Å
239	E	68	Low	89	Confident	207 Å²	207	66.7 Å²	66.7	97%	0.967	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.4	-179.1	-72.1	-172.4	170.5	0	0	113.2
240	E	70.7	Confident	88.8	Confident	182 Å²	182	66.7 Å²	66.7	85%	0.85	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-11.4	-179.8	-59.7	-169.7	172.5	0	0	113.7	Q238 L242	Q238-E240 PolarHBondContact O-N 3.5Å; E240-L242 PolarHBondContact O-N 3.2Å
241	D	77.9	Confident	88.6	Confident	90 Å²	90	69.7 Å²	69.7	48%	0.481	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-69.3	123.4	-176.7	-71.1	-29.5	0	0	0	111	Q238	Q238-D241 VanDerWaalsContact CB-OD2 3.3Å; Q238-D241 WeakPolarHBondContact CB-OD2 3.4Å; Q238-D241 PolarHBondContact N-OD2 3.24Å; Q238-D241 WeakPolarHBondContact O-CB 3.28Å; Q238-D241 PolarHBondContact O-N 3.06Å
242	L	83.9	Confident	88.5	Confident	33 Å²	33	75.3 Å²	75.3	17%	0.173	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-74.1	135.5	169	-74.8	163.2	0	0	0	109.4	E240 A244 L247 A276 L277 Y280	E240-L242 PolarHBondContact O-N 3.2Å; L242-A244 PolarHBondContact O-N 2.91Å; L242-L247 HydrophobicContact CB-CD1 4.34Å; L242-L247 HydrophobicContact CB-CD2 3.76Å; L242-L247 HydrophobicContact CB-CG 4.06Å; L242-L247 HydrophobicContact CD1-CD2 3.91Å; L242-L247 HydrophobicContact CG-CD2 4.47Å; L242-A276 HydrophobicContact CD2-CB 3.78Å; L242-A276 HydrophobicContact CG-CB 4.5Å; L242-L277 HydrophobicContact CD1-CD2 4.07Å; L242-L277 HydrophobicContact CD2-CD2 3.91Å; L242-L277 HydrophobicContact CD2-CG 4.04Å; L242-L277 HydrophobicContact CG-CD2 4.41Å; L242-Y280 VanDerWaalsContact CD1-CB 3.46Å; L242-Y280 HydrophobicContact CD1-CD2 4.12Å; L242-Y280 HydrophobicContact CD1-CG 3.82Å
243	P	84.6	Confident	88.4	Confident	59 Å²	59	77.2 Å²	77.2	38%	0.383	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-55.4	133.5	178.3	-25	33.7	0	0	0	111.5	D245 A246 L247 V272	P243-D245 PolarHBondContact O-N 2.85Å; P243-A246 HydrophobicContact CB-CB 4.1Å; P243-A246 HydrophobicContact CG-CB 4.46Å; P243-A246 WeakPolarHBondContact O-CA 3.47Å; P243-A246 VanDerWaalsContact O-CB 3.28Å; P243-A246 WeakPolarHBondContact O-CB 3.38Å; P243-A246 PolarHBondContact O-N 3.28Å; P243-L247 PolarHBondContact O-N 3.03Å; P243-V272 HydrophobicContact CG-CG1 3.66Å
244	A	85.3	Confident	88.2	Confident	78 Å²	78	78.3 Å²	78.3	65%	0.645	41%	0.414	S	S	*	.	H	α-helix	trans	-56.9	-37.6	-178.5	0	0	0	0	0	112.7	L242 A246 L247 R248	L242-A244 PolarHBondContact O-N 2.91Å; A244-A246 VanDerWaalsContact C-N 3.31Å; A244-A246 PolarHBondContact O-N 3.34Å; A244-L247 PolarHBondContact O-N 2.96Å; A244-R248 PolarHBondContact O-N 3.45Å
245	D	90	Very high	88	Confident	79 Å²	79	81.8 Å²	81.8	42%	0.422	44%	0.442	S	S	.	.	H	α-helix	trans	-65.4	-34.1	174.9	-75.8	-37.5	0	0	0	112.4	P243 R248 T249 H270	P243-D245 PolarHBondContact O-N 2.85Å; D245-R248 PolarHBondContact O-N 3.21Å; D245-R248 IonicContact OD1-CZ 3.11Å; D245-R248 IonicContact OD1-NH1 3.78Å; D245-R248 PolarHBondContact OD1-NH1 3.21Å; D245-R248 IonicContact OD1-NH2 2.76Å; D245-R248 PolarHBondContact OD1-NH2 3.33Å; D245-T249 WeakPolarHBondContact O-CB 3.48Å; D245-T249 PolarHBondContact O-N 3.05Å; D245-T249 PolarHBondContact O-OG1 3.31Å; D245-H270 PolarHBondContact O-NE2 3.36Å
246	A	92.4	Very high	88	Confident	0 Å²	0	86.4 Å²	86.4	0%	0	46%	0.464	C	S	.	.	H	α-helix	trans	-67	-40.9	174.1	0	0	0	0	0	111.7	P243 A244 L250 H270 V272 L277	P243-A246 HydrophobicContact CB-CB 4.1Å; P243-A246 HydrophobicContact CG-CB 4.46Å; P243-A246 WeakPolarHBondContact O-CA 3.47Å; P243-A246 VanDerWaalsContact O-CB 3.28Å; P243-A246 WeakPolarHBondContact O-CB 3.38Å; P243-A246 PolarHBondContact O-N 3.28Å; A244-A246 VanDerWaalsContact C-N 3.31Å; A244-A246 PolarHBondContact O-N 3.34Å; A246-L250 WeakPolarHBondContact O-CB 3.4Å; A246-L250 PolarHBondContact O-N 3.11Å; A246-H270 WeakPolarHBondContact CA-CD2 3.48Å; A246-H270 HydrophobicContact CB-CB 3.75Å; A246-V272 HydrophobicContact CB-CG2 4.11Å; A246-L277 HydrophobicContact CB-CD1 4.5Å; A246-L277 HydrophobicContact CB-CD2 4.05Å
247	L	92.8	Very high	88.3	Confident	37 Å²	37	81.9 Å²	81.9	19%	0.194	45%	0.446	C	S	.	.	H	α-helix	trans	-64.5	-42.6	173.9	-61.1	-177.2	0	0	0	111.8	L242 P243 A244 L250 A251 L277 Y280	L242-L247 HydrophobicContact CB-CD1 4.34Å; L242-L247 HydrophobicContact CB-CD2 3.76Å; L242-L247 HydrophobicContact CB-CG 4.06Å; L242-L247 HydrophobicContact CD1-CD2 3.91Å; L242-L247 HydrophobicContact CG-CD2 4.47Å; P243-L247 PolarHBondContact O-N 3.03Å; A244-L247 PolarHBondContact O-N 2.96Å; L247-L250 WeakPolarHBondContact O-CB 3.25Å; L247-L250 PolarHBondContact O-N 2.92Å; L247-A251 PolarHBondContact O-N 2.89Å; L247-L277 HydrophobicContact CD2-CD2 3.88Å; L247-Y280 HydrophobicContact CD1-CE1 4.19Å; L247-Y280 HydrophobicContact CD1-CE2 4.16Å; L247-Y280 HydrophobicContact CD2-CD1 3.47Å; L247-Y280 VanDerWaalsContact CD2-CD1 3.47Å; L247-Y280 HydrophobicContact CD2-CD2 4.33Å; L247-Y280 HydrophobicContact CD2-CE1 3.45Å; L247-Y280 VanDerWaalsContact CD2-CE1 3.45Å; L247-Y280 HydrophobicContact CD2-CE2 4.3Å; L247-Y280 HydrophobicContact CD2-CG 3.94Å; L247-Y280 HydrophobicContact CG-CE1 4.31Å
248	R	93.6	Very high	89.1	Confident	148 Å²	148	83 Å²	83	56%	0.558	45%	0.447	S	S	*	.	H	α-helix	trans	-63	-47.7	176.2	-171.1	178.1	74.8	-127.1	-7	111.7	A244 D245 L250 A251 L252	A244-R248 PolarHBondContact O-N 3.45Å; D245-R248 PolarHBondContact O-N 3.21Å; D245-R248 IonicContact OD1-CZ 3.11Å; D245-R248 IonicContact OD1-NH1 3.78Å; D245-R248 PolarHBondContact OD1-NH1 3.21Å; D245-R248 IonicContact OD1-NH2 2.76Å; D245-R248 PolarHBondContact OD1-NH2 3.33Å; R248-L250 VanDerWaalsContact C-N 3.32Å; R248-L250 PolarHBondContact O-N 3.48Å; R248-A251 PolarHBondContact O-N 3.16Å; R248-L252 HydrophobicContact CG-CD1 4.42Å; R248-L252 WeakPolarHBondContact O-CG 3.47Å; R248-L252 PolarHBondContact O-N 3.35Å
249	T	96	Very high	89.9	Confident	25 Å²	25	77.8 Å²	77.8	15%	0.153	42%	0.423	C	S	.	.	H	α-helix	trans	-61.8	-41.8	176.3	-67.5	0	0	0	0	111.3	D245 A251 L252 L253 A266 I269 H270	D245-T249 WeakPolarHBondContact O-CB 3.48Å; D245-T249 PolarHBondContact O-N 3.05Å; D245-T249 PolarHBondContact O-OG1 3.31Å; T249-A251 PolarHBondContact O-N 2.73Å; T249-L252 PolarHBondContact O-N 2.77Å; T249-L253 HydrophobicContact CG2-CD1 3.74Å; T249-L253 HydrophobicContact CG2-CG 4.21Å; T249-L253 WeakPolarHBondContact O-CB 3.47Å; T249-L253 VanDerWaalsContact O-CG 3.26Å; T249-L253 WeakPolarHBondContact O-CG 3.48Å; T249-L253 PolarHBondContact O-N 3.45Å; T249-A266 HydrophobicContact CG2-CB 4.04Å; T249-I269 HydrophobicContact CG2-CD1 3.84Å; T249-H270 VanDerWaalsContact CB-NE2 3.33Å; T249-H270 WeakPolarHBondContact CB-NE2 3.32Å; T249-H270 PolarHBondContact OG1-NE2 2.91Å
250	L	95.6	Very high	91.2	Very high	3 Å²	3	74.6 Å²	74.6	2%	0.016	41%	0.406	C	S	.	.	H	α-helix	trans	-58.7	-46.3	175.1	171.9	61	0	0	0	111.8	A246 L247 R248 L253 Q254 L259 A262 A263 A266 L277 A281	A246-L250 WeakPolarHBondContact O-CB 3.4Å; A246-L250 PolarHBondContact O-N 3.11Å; L247-L250 WeakPolarHBondContact O-CB 3.25Å; L247-L250 PolarHBondContact O-N 2.92Å; R248-L250 VanDerWaalsContact C-N 3.32Å; R248-L250 PolarHBondContact O-N 3.48Å; L250-L253 PolarHBondContact O-N 3.4Å; L250-Q254 HydrophobicContact CD1-CG 4.05Å; L250-Q254 VanDerWaalsContact CG-NE2 3.33Å; L250-Q254 WeakPolarHBondContact O-CB 3.23Å; L250-Q254 WeakPolarHBondContact O-CG 3.46Å; L250-Q254 PolarHBondContact O-N 2.79Å; L250-L259 HydrophobicContact CD1-CD1 4.39Å; L250-A262 HydrophobicContact CD1-CB 4.1Å; L250-A263 HydrophobicContact CD1-CB 4.07Å; L250-A266 HydrophobicContact CB-CB 3.95Å; L250-L277 HydrophobicContact CD2-CB 4.12Å; L250-L277 HydrophobicContact CD2-CD2 3.94Å; L250-A281 HydrophobicContact CD2-CB 4.19Å
251	A	94.1	Very high	92.5	Very high	63 Å²	63	71.8 Å²	71.8	52%	0.521	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-44.7	178	0	0	0	0	0	112.3	L247 R248 T249 Q254 A255	L247-A251 PolarHBondContact O-N 2.89Å; R248-A251 PolarHBondContact O-N 3.16Å; T249-A251 PolarHBondContact O-N 2.73Å; A251-Q254 PolarHBondContact O-N 3.14Å; A251-A255 PolarHBondContact O-N 3.38Å
252	L	95.9	Very high	93.4	Very high	119 Å²	119	67.5 Å²	67.5	62%	0.623	37%	0.369	S	S	*	.	H	α-helix	trans	-63.2	-41.9	176.4	-69.8	172.4	0	0	0	112.1	R248 T249 A255	R248-L252 HydrophobicContact CG-CD1 4.42Å; R248-L252 WeakPolarHBondContact O-CG 3.47Å; R248-L252 PolarHBondContact O-N 3.35Å; T249-L252 PolarHBondContact O-N 2.77Å; L252-A255 WeakPolarHBondContact O-CB 3.23Å; L252-A255 PolarHBondContact O-N 3.38Å
253	L	96.7	Very high	94	Very high	39 Å²	39	66 Å²	66	20%	0.204	36%	0.36	C	S	.	.	H	α-helix	trans	-71.7	-31.5	178.9	-69.9	175.1	0	0	0	112.7	T249 L250 A255 E256 L257 A262 L265 A266 I269	T249-L253 HydrophobicContact CG2-CD1 3.74Å; T249-L253 HydrophobicContact CG2-CG 4.21Å; T249-L253 WeakPolarHBondContact O-CB 3.47Å; T249-L253 VanDerWaalsContact O-CG 3.26Å; T249-L253 WeakPolarHBondContact O-CG 3.48Å; T249-L253 PolarHBondContact O-N 3.45Å; L250-L253 PolarHBondContact O-N 3.4Å; L253-A255 PolarHBondContact O-N 3.41Å; L253-E256 PolarHBondContact O-N 3.02Å; L253-E256 VanDerWaalsContact O-N 3.14Å; L253-L257 HydrophobicContact CD2-CD1 4.14Å; L253-L257 WeakPolarHBondContact O-CB 3.34Å; L253-L257 PolarHBondContact O-N 3.34Å; L253-A262 HydrophobicContact CB-CB 3.73Å; L253-L265 HydrophobicContact CD1-CB 3.79Å; L253-A266 HydrophobicContact CD1-CB 4.23Å; L253-I269 HydrophobicContact CD1-CD1 4.48Å
254	Q	94.6	Very high	94.5	Very high	64 Å²	64	64.7 Å²	64.7	30%	0.299	36%	0.355	S	S	.	.	H	α-helix	trans	-65	-25	175.8	-82.2	-174.7	57.3	0	0	113.2	L250 A251 E256 L259 A262	L250-Q254 HydrophobicContact CD1-CG 4.05Å; L250-Q254 VanDerWaalsContact CG-NE2 3.33Å; L250-Q254 WeakPolarHBondContact O-CB 3.23Å; L250-Q254 WeakPolarHBondContact O-CG 3.46Å; L250-Q254 PolarHBondContact O-N 2.79Å; A251-Q254 PolarHBondContact O-N 3.14Å; Q254-E256 PolarHBondContact O-N 2.91Å; Q254-L259 VanDerWaalsContact CD-CD1 3.47Å; Q254-L259 HydrophobicContact CG-CD1 3.93Å; Q254-A262 HydrophobicContact CG-CB 3.79Å
255	A	93.6	Very high	95.1	Very high	79 Å²	79	63.8 Å²	63.8	65%	0.653	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.7	173.6	0	0	0	0	0	112.6	A251 L252 L253	A251-A255 PolarHBondContact O-N 3.38Å; L252-A255 WeakPolarHBondContact O-CB 3.23Å; L252-A255 PolarHBondContact O-N 3.38Å; L253-A255 PolarHBondContact O-N 3.41Å
256	E	96.2	Very high	95.4	Very high	160 Å²	160	60 Å²	60	75%	0.748	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-19.6	-171.9	-59.6	-60.3	152.5	0	0	113.6	L253 Q254	L253-E256 PolarHBondContact O-N 3.02Å; L253-E256 VanDerWaalsContact O-N 3.14Å; Q254-E256 PolarHBondContact O-N 2.91Å
257	L	96.2	Very high	95.6	Very high	45 Å²	45	60.3 Å²	60.3	24%	0.236	32%	0.321	C	S	.	.	S	Bend	trans	-133.7	147.9	-170.6	-59.3	175.5	0	0	0	112	L253 L259 K261 A262 L265	L253-L257 HydrophobicContact CD2-CD1 4.14Å; L253-L257 WeakPolarHBondContact O-CB 3.34Å; L253-L257 PolarHBondContact O-N 3.34Å; L257-L259 PolarHBondContact O-N 3.45Å; L257-K261 HydrophobicContact CD1-CG 4.42Å; L257-K261 HydrophobicContact CD2-CD 4.31Å; L257-A262 HydrophobicContact CB-CB 4.34Å; L257-L265 HydrophobicContact CD1-CD1 3.54Å
258	P	96	Very high	95.7	Very high	96 Å²	96	66 Å²	66	62%	0.623	35%	0.347	S	S	*	.			trans	-54.5	140.6	170.5	-23.9	32.9	0	0	0	111.5	K260 K261 A262	P258-K260 PolarHBondContact O-N 2.92Å; P258-K261 WeakPolarHBondContact O-CA 3.17Å; P258-K261 PolarHBondContact O-N 3.48Å; P258-A262 PolarHBondContact O-N 2.89Å
259	L	94.5	Very high	95.8	Very high	27 Å²	27	64.1 Å²	64.1	14%	0.141	35%	0.347	C	S	.	.	H	α-helix	trans	-46.2	-44.3	-173.2	173.9	58.8	0	0	0	114	L250 Q254 L257 K261 A262 A263 Y278 A281 L282	L250-L259 HydrophobicContact CD1-CD1 4.39Å; Q254-L259 VanDerWaalsContact CD-CD1 3.47Å; Q254-L259 HydrophobicContact CG-CD1 3.93Å; L257-L259 PolarHBondContact O-N 3.45Å; L259-K261 VanDerWaalsContact C-N 3.29Å; L259-K261 PolarHBondContact O-N 3.35Å; L259-A262 PolarHBondContact O-N 3.06Å; L259-A263 WeakPolarHBondContact O-CB 3.42Å; L259-A263 PolarHBondContact O-N 2.94Å; L259-Y278 HydrophobicContact CB-CE2 4.45Å; L259-Y278 HydrophobicContact CD2-CD2 4.18Å; L259-Y278 HydrophobicContact CD2-CE2 3.79Å; L259-Y278 HydrophobicContact CG-CD2 3.86Å; L259-Y278 HydrophobicContact CG-CE2 3.68Å; L259-A281 HydrophobicContact CD1-CB 3.31Å; L259-A281 HydrophobicContact CD2-CB 4.11Å; L259-A281 HydrophobicContact CG-CB 4.3Å; L259-L282 HydrophobicContact CD2-CD2 3.9Å; L259-L282 HydrophobicContact CD2-CG 4.2Å
260	K	95.5	Very high	95.7	Very high	140 Å²	140	65.8 Å²	65.8	61%	0.609	35%	0.353	S	S	*	.	H	α-helix	trans	-61.1	-35.5	180	-173.1	177.2	-180	178.5	0	113.1	P258 A264 Y278	P258-K260 PolarHBondContact O-N 2.92Å; K260-A264 WeakPolarHBondContact O-CB 3.24Å; K260-A264 PolarHBondContact O-N 3.34Å; K260-Y278 HydrophobicContact CB-CE2 4.13Å
261	K	96.9	Very high	95.5	Very high	124 Å²	124	69.1 Å²	69.1	54%	0.539	39%	0.388	S	S	.	.	H	α-helix	trans	-81.8	-41.3	178.5	-169.2	175.4	178.9	-174.8	0	110.8	L257 P258 L259 A263 A264 L265	L257-K261 HydrophobicContact CD1-CG 4.42Å; L257-K261 HydrophobicContact CD2-CD 4.31Å; P258-K261 WeakPolarHBondContact O-CA 3.17Å; P258-K261 PolarHBondContact O-N 3.48Å; L259-K261 VanDerWaalsContact C-N 3.29Å; L259-K261 PolarHBondContact O-N 3.35Å; K261-A263 PolarHBondContact O-N 2.9Å; K261-A264 PolarHBondContact O-N 3.14Å; K261-L265 HydrophobicContact CG-CD1 4.29Å; K261-L265 WeakPolarHBondContact O-CG 3.33Å; K261-L265 PolarHBondContact O-N 2.95Å
262	A	96.8	Very high	95.4	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-56.6	-48.5	173.2	0	0	0	0	0	111.7	L250 L253 Q254 L257 P258 L259 A264 L265 A266	L250-A262 HydrophobicContact CD1-CB 4.1Å; L253-A262 HydrophobicContact CB-CB 3.73Å; Q254-A262 HydrophobicContact CG-CB 3.79Å; L257-A262 HydrophobicContact CB-CB 4.34Å; P258-A262 PolarHBondContact O-N 2.89Å; L259-A262 PolarHBondContact O-N 3.06Å; A262-A264 PolarHBondContact O-N 3.42Å; A262-L265 PolarHBondContact O-N 3.41Å; A262-A266 WeakPolarHBondContact O-CB 2.93Å; A262-A266 PolarHBondContact O-N 2.94Å
263	A	96.3	Very high	95.2	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64.8	-35.3	177.2	0	0	0	0	0	113.7	L250 L259 K261 A267 L277 Y278	L250-A263 HydrophobicContact CD1-CB 4.07Å; L259-A263 WeakPolarHBondContact O-CB 3.42Å; L259-A263 PolarHBondContact O-N 2.94Å; K261-A263 PolarHBondContact O-N 2.9Å; A263-A267 WeakPolarHBondContact O-CB 3.5Å; A263-A267 PolarHBondContact O-N 2.96Å; A263-L277 HydrophobicContact CB-CB 4.34Å; A263-Y278 HydrophobicContact CB-CD2 4.19Å
264	A	96.7	Very high	94.9	Very high	32 Å²	32	72.1 Å²	72.1	26%	0.264	39%	0.385	S	S	.	.	H	α-helix	trans	-67.4	-45.7	176.5	0	0	0	0	0	112	K260 K261 A262 A267 E268 K274	K260-A264 WeakPolarHBondContact O-CB 3.24Å; K260-A264 PolarHBondContact O-N 3.34Å; K261-A264 PolarHBondContact O-N 3.14Å; A262-A264 PolarHBondContact O-N 3.42Å; A264-A267 WeakPolarHBondContact O-CB 3.44Å; A264-A267 PolarHBondContact O-N 3.04Å; A264-E268 PolarHBondContact O-N 3.28Å; A264-K274 HydrophobicContact CB-CD 3.91Å; A264-K274 HydrophobicContact CB-CG 4.38Å
265	L	97	Very high	94.9	Very high	59 Å²	59	75.1 Å²	75.1	31%	0.309	40%	0.403	S	S	.	.	H	α-helix	trans	-69.2	-43.3	179.2	-70.8	173.2	0	0	0	112	L253 L257 K261 A262 A267 E268 I269	L253-L265 HydrophobicContact CD1-CB 3.79Å; L257-L265 HydrophobicContact CD1-CD1 3.54Å; K261-L265 HydrophobicContact CG-CD1 4.29Å; K261-L265 WeakPolarHBondContact O-CG 3.33Å; K261-L265 PolarHBondContact O-N 2.95Å; A262-L265 PolarHBondContact O-N 3.41Å; L265-A267 VanDerWaalsContact C-N 3.29Å; L265-A267 PolarHBondContact O-N 2.87Å; L265-E268 PolarHBondContact O-N 3.48Å; L265-I269 WeakPolarHBondContact O-CD1 3.19Å; L265-I269 VanDerWaalsContact O-CG1 3.23Å; L265-I269 WeakPolarHBondContact O-CG1 3.48Å; L265-I269 PolarHBondContact O-N 3.26Å
266	A	96.4	Very high	94.8	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-60.8	-39.9	175.4	0	0	0	0	0	111.8	T249 L250 L253 A262 I269 H270 L277	T249-A266 HydrophobicContact CG2-CB 4.04Å; L250-A266 HydrophobicContact CB-CB 3.95Å; L253-A266 HydrophobicContact CD1-CB 4.23Å; A262-A266 WeakPolarHBondContact O-CB 2.93Å; A262-A266 PolarHBondContact O-N 2.94Å; A266-I269 PolarHBondContact O-N 2.87Å; A266-H270 PolarHBondContact O-CD2 3.01Å; A266-H270 VanDerWaalsContact O-CD2 3.28Å; A266-H270 PolarHBondContact O-N 3.32Å; A266-H270 VanDerWaalsContact O-N 3.14Å; A266-L277 HydrophobicContact CB-CD1 3.78Å
267	A	95.5	Very high	94.6	Very high	7 Å²	7	65.6 Å²	65.6	6%	0.058	35%	0.352	C	S	.	.	H	α-helix	trans	-60.4	-44.9	173.7	0	0	0	0	0	112.8	A263 A264 L265 G271 V272 K274 L277	A263-A267 WeakPolarHBondContact O-CB 3.5Å; A263-A267 PolarHBondContact O-N 2.96Å; A264-A267 WeakPolarHBondContact O-CB 3.44Å; A264-A267 PolarHBondContact O-N 3.04Å; L265-A267 VanDerWaalsContact C-N 3.29Å; L265-A267 PolarHBondContact O-N 2.87Å; A267-G271 WeakPolarHBondContact O-CA 3.26Å; A267-G271 PolarHBondContact O-N 3.37Å; A267-V272 HydrophobicContact CB-CG2 4.4Å; A267-V272 WeakPolarHBondContact CB-O 3.4Å; A267-V272 PolarHBondContact O-N 3.04Å; A267-K274 HydrophobicContact CB-CB 3.85Å; A267-L277 HydrophobicContact CB-CD1 3.96Å
268	E	95.8	Very high	94.4	Very high	156 Å²	156	67.5 Å²	67.5	73%	0.729	36%	0.357	S	S	*	.	H	α-helix	trans	-66.6	-42.4	179.5	-171.4	174	-179.8	0	0	112.2	A264 L265 H270	A264-E268 PolarHBondContact O-N 3.28Å; L265-E268 PolarHBondContact O-N 3.48Å; E268-H270 VanDerWaalsContact C-N 3.32Å; E268-H270 PolarHBondContact O-N 2.83Å
269	I	96.1	Very high	94.2	Very high	109 Å²	109	69 Å²	69	56%	0.559	35%	0.354	S	S	*	.	H	α-helix	trans	-61.7	-40.5	178.1	-69.3	163.9	0	0	0	111.5	T249 L253 L265 A266	T249-I269 HydrophobicContact CG2-CD1 3.84Å; L253-I269 HydrophobicContact CD1-CD1 4.48Å; L265-I269 WeakPolarHBondContact O-CD1 3.19Å; L265-I269 VanDerWaalsContact O-CG1 3.23Å; L265-I269 WeakPolarHBondContact O-CG1 3.48Å; L265-I269 PolarHBondContact O-N 3.26Å; A266-I269 PolarHBondContact O-N 2.87Å
270	H	93.6	Very high	94	Very high	59 Å²	59	71.6 Å²	71.6	27%	0.273	36%	0.362	S	S	.	.	H	α-helix	trans	-104.9	2.9	-171.4	-66.1	-74.1	0	0	0	114.5	D245 A246 T249 A266 E268 V272	D245-H270 PolarHBondContact O-NE2 3.36Å; A246-H270 WeakPolarHBondContact CA-CD2 3.48Å; A246-H270 HydrophobicContact CB-CB 3.75Å; T249-H270 VanDerWaalsContact CB-NE2 3.33Å; T249-H270 WeakPolarHBondContact CB-NE2 3.32Å; T249-H270 PolarHBondContact OG1-NE2 2.91Å; A266-H270 PolarHBondContact O-CD2 3.01Å; A266-H270 VanDerWaalsContact O-CD2 3.28Å; A266-H270 PolarHBondContact O-N 3.32Å; A266-H270 VanDerWaalsContact O-N 3.14Å; E268-H270 VanDerWaalsContact C-N 3.32Å; E268-H270 PolarHBondContact O-N 2.83Å; H270-V272 VanDerWaalsContact C-N 3.27Å; H270-V272 HydrophobicContact CB-CG1 4.49Å; H270-V272 HydrophobicContact CB-CG2 4.41Å; H270-V272 PolarHBondContact O-N 3.37Å
271	G	91.6	Very high	93.8	Very high	73 Å²	73	65 Å²	65	75%	0.753	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	25.9	-179.9	0	0	0	0	0	114.5	A267	A267-G271 WeakPolarHBondContact O-CA 3.26Å; A267-G271 PolarHBondContact O-N 3.37Å
272	V	90.7	Very high	93.5	Very high	34 Å²	34	63 Å²	63	21%	0.206	33%	0.329	C	S	.	.			trans	-105.7	163.5	-178.5	-60.2	0	0	0	0	113	P243 A246 A267 H270 K274 L277	P243-V272 HydrophobicContact CG-CG1 3.66Å; A246-V272 HydrophobicContact CB-CG2 4.11Å; A267-V272 HydrophobicContact CB-CG2 4.4Å; A267-V272 WeakPolarHBondContact CB-O 3.4Å; A267-V272 PolarHBondContact O-N 3.04Å; H270-V272 VanDerWaalsContact C-N 3.27Å; H270-V272 HydrophobicContact CB-CG1 4.49Å; H270-V272 HydrophobicContact CB-CG2 4.41Å; H270-V272 PolarHBondContact O-N 3.37Å; V272-K274 PolarHBondContact O-N 3.15Å; V272-L277 HydrophobicContact CG2-CD1 3.48Å; V272-L277 VanDerWaalsContact CG2-CD1 3.48Å; V272-L277 HydrophobicContact CG2-CD2 4.43Å; V272-L277 HydrophobicContact CG2-CG 3.85Å
273	K	91.6	Very high	93.2	Very high	171 Å²	171	68.4 Å²	68.4	74%	0.743	35%	0.354	S	S	*	.			trans	-69.7	117.7	179.6	-66.8	177.9	-176.5	169.4	0	110.5	N275 A276 L277	K273-N275 PolarHBondContact O-N 3.06Å; K273-N275 VanDerWaalsContact O-N 3.14Å; K273-A276 HydrophobicContact CB-CB 4.24Å; K273-A276 WeakPolarHBondContact O-CB 3.42Å; K273-A276 PolarHBondContact O-N 2.9Å; K273-L277 PolarHBondContact O-N 3.48Å
274	K	92.3	Very high	92.6	Very high	80 Å²	80	74.3 Å²	74.3	35%	0.348	38%	0.382	S	S	.	.	H	α-helix	trans	-46.2	-44.4	173.1	174.4	-172	164.6	-172	0	113.9	A264 A267 V272 A276 L277 Y278	A264-K274 HydrophobicContact CB-CD 3.91Å; A264-K274 HydrophobicContact CB-CG 4.38Å; A267-K274 HydrophobicContact CB-CB 3.85Å; V272-K274 PolarHBondContact O-N 3.15Å; K274-A276 VanDerWaalsContact C-N 3.26Å; K274-A276 PolarHBondContact O-N 3.42Å; K274-L277 PolarHBondContact O-N 3.29Å; K274-Y278 WeakPolarHBondContact O-CB 3.32Å; K274-Y278 PolarHBondContact O-N 3.22Å
275	N	92.8	Very high	91.7	Very high	126 Å²	126	78.8 Å²	78.8	67%	0.674	40%	0.397	S	S	*	.	H	α-helix	trans	-65.1	-32.1	-177.6	-70.3	-7.3	0	0	0	112.3	K273 K279	K273-N275 PolarHBondContact O-N 3.06Å; K273-N275 VanDerWaalsContact O-N 3.14Å; N275-K279 VanDerWaalsContact O-CB 3.24Å; N275-K279 WeakPolarHBondContact O-CB 3.43Å; N275-K279 PolarHBondContact O-N 3.41Å
276	A	91.5	Very high	89.9	Confident	40 Å²	40	81.9 Å²	81.9	33%	0.331	44%	0.443	S	S	.	.	H	α-helix	trans	-68.8	-48.3	176.8	0	0	0	0	0	110.7	L242 K273 K274 Y278 K279 Y280	L242-A276 HydrophobicContact CD2-CB 3.78Å; L242-A276 HydrophobicContact CG-CB 4.5Å; K273-A276 HydrophobicContact CB-CB 4.24Å; K273-A276 WeakPolarHBondContact O-CB 3.42Å; K273-A276 PolarHBondContact O-N 2.9Å; K274-A276 VanDerWaalsContact C-N 3.26Å; K274-A276 PolarHBondContact O-N 3.42Å; A276-Y278 VanDerWaalsContact C-N 3.35Å; A276-Y278 PolarHBondContact O-N 3.4Å; A276-K279 PolarHBondContact O-N 3.02Å; A276-Y280 WeakPolarHBondContact O-CB 3.46Å; A276-Y280 PolarHBondContact O-N 3.15Å
277	L	92	Very high	89.6	Confident	0 Å²	0	86 Å²	86	0%	0	47%	0.466	C	S	.	.	H	α-helix	trans	-60.9	-41.1	174.6	-76.4	176.4	0	0	0	112.9	L242 A246 L247 L250 A263 A266 A267 V272 K273 K274 A281	L242-L277 HydrophobicContact CD1-CD2 4.07Å; L242-L277 HydrophobicContact CD2-CD2 3.91Å; L242-L277 HydrophobicContact CD2-CG 4.04Å; L242-L277 HydrophobicContact CG-CD2 4.41Å; A246-L277 HydrophobicContact CB-CD1 4.5Å; A246-L277 HydrophobicContact CB-CD2 4.05Å; L247-L277 HydrophobicContact CD2-CD2 3.88Å; L250-L277 HydrophobicContact CD2-CB 4.12Å; L250-L277 HydrophobicContact CD2-CD2 3.94Å; A263-L277 HydrophobicContact CB-CB 4.34Å; A266-L277 HydrophobicContact CB-CD1 3.78Å; A267-L277 HydrophobicContact CB-CD1 3.96Å; V272-L277 HydrophobicContact CG2-CD1 3.48Å; V272-L277 VanDerWaalsContact CG2-CD1 3.48Å; V272-L277 HydrophobicContact CG2-CD2 4.43Å; V272-L277 HydrophobicContact CG2-CG 3.85Å; K273-L277 PolarHBondContact O-N 3.48Å; K274-L277 PolarHBondContact O-N 3.29Å; L277-A281 PolarHBondContact O-N 3.36Å
278	Y	92.7	Very high	89.3	Confident	84 Å²	84	90.2 Å²	90.2	33%	0.329	49%	0.487	S	S	.	.	H	α-helix	trans	-66.4	-42.8	178.9	-174	-101.1	0	0	0	111.9	L259 K260 A263 K274 A276 A281 L282	L259-Y278 HydrophobicContact CB-CE2 4.45Å; L259-Y278 HydrophobicContact CD2-CD2 4.18Å; L259-Y278 HydrophobicContact CD2-CE2 3.79Å; L259-Y278 HydrophobicContact CG-CD2 3.86Å; L259-Y278 HydrophobicContact CG-CE2 3.68Å; K260-Y278 HydrophobicContact CB-CE2 4.13Å; A263-Y278 HydrophobicContact CB-CD2 4.19Å; K274-Y278 WeakPolarHBondContact O-CB 3.32Å; K274-Y278 PolarHBondContact O-N 3.22Å; A276-Y278 VanDerWaalsContact C-N 3.35Å; A276-Y278 PolarHBondContact O-N 3.4Å; Y278-A281 PolarHBondContact O-N 3.34Å; Y278-L282 HydrophobicContact CD1-CD1 3.95Å; Y278-L282 HydrophobicContact CE1-CD1 3.49Å; Y278-L282 VanDerWaalsContact CE1-CD1 3.49Å; Y278-L282 HydrophobicContact CE1-CG 4.21Å; Y278-L282 PolarHBondContact O-N 3.09Å; Y278-L282 VanDerWaalsContact O-N 3.15Å
279	K	92.5	Very high	88.9	Confident	129 Å²	129	86.5 Å²	86.5	56%	0.561	47%	0.474	S	S	*	.	H	α-helix	trans	-61.8	-49.2	175.6	-177.7	-177.7	169	-169.8	0	110.9	N275 A276 A281 L282 E283	N275-K279 VanDerWaalsContact O-CB 3.24Å; N275-K279 WeakPolarHBondContact O-CB 3.43Å; N275-K279 PolarHBondContact O-N 3.41Å; A276-K279 PolarHBondContact O-N 3.02Å; K279-A281 VanDerWaalsContact C-N 3.31Å; K279-A281 PolarHBondContact O-N 2.83Å; K279-L282 PolarHBondContact O-N 3.36Å; K279-L282 VanDerWaalsContact O-N 3.15Å; K279-E283 WeakPolarHBondContact CE-OE1 3.48Å; K279-E283 IonicContact NZ-OE1 3.86Å; K279-E283 WeakPolarHBondContact O-CG 3.36Å; K279-E283 PolarHBondContact O-N 3.38Å
280	Y	90.6	Very high	88.5	Confident	80 Å²	80	85.2 Å²	85.2	31%	0.314	47%	0.469	S	S	.	.	H	α-helix	trans	-54.3	-46.6	176.2	174.8	-88.8	0	0	0	112.1	L242 L247 A276 L282 E283 Q284	L242-Y280 VanDerWaalsContact CD1-CB 3.46Å; L242-Y280 HydrophobicContact CD1-CD2 4.12Å; L242-Y280 HydrophobicContact CD1-CG 3.82Å; L247-Y280 HydrophobicContact CD1-CE1 4.19Å; L247-Y280 HydrophobicContact CD1-CE2 4.16Å; L247-Y280 HydrophobicContact CD2-CD1 3.47Å; L247-Y280 VanDerWaalsContact CD2-CD1 3.47Å; L247-Y280 HydrophobicContact CD2-CD2 4.33Å; L247-Y280 HydrophobicContact CD2-CE1 3.45Å; L247-Y280 VanDerWaalsContact CD2-CE1 3.45Å; L247-Y280 HydrophobicContact CD2-CE2 4.3Å; L247-Y280 HydrophobicContact CD2-CG 3.94Å; L247-Y280 HydrophobicContact CG-CE1 4.31Å; A276-Y280 WeakPolarHBondContact O-CB 3.46Å; A276-Y280 PolarHBondContact O-N 3.15Å; Y280-L282 VanDerWaalsContact C-N 3.35Å; Y280-L282 PolarHBondContact O-N 3.41Å; Y280-E283 PolarHBondContact O-N 3.27Å; Y280-Q284 HydrophobicContact CD1-CG 4.15Å; Y280-Q284 HydrophobicContact CE1-CG 3.69Å; Y280-Q284 HydrophobicContact CE2-CG 4.35Å; Y280-Q284 WeakPolarHBondContact O-CG 3.34Å; Y280-Q284 PolarHBondContact O-N 3.45Å; Y280-Q284 VanDerWaalsContact O-N 3.09Å
281	A	90.3	Very high	88.2	Confident	3 Å²	3	86.8 Å²	86.8	3%	0.025	48%	0.481	C	S	.	.	H	α-helix	trans	-64.9	-35.7	179.7	0	0	0	0	0	114	L250 L259 L277 Y278 K279 E283 Q284 Q285	L250-A281 HydrophobicContact CD2-CB 4.19Å; L259-A281 HydrophobicContact CD1-CB 3.31Å; L259-A281 HydrophobicContact CD2-CB 4.11Å; L259-A281 HydrophobicContact CG-CB 4.3Å; L277-A281 PolarHBondContact O-N 3.36Å; Y278-A281 PolarHBondContact O-N 3.34Å; K279-A281 VanDerWaalsContact C-N 3.31Å; K279-A281 PolarHBondContact O-N 2.83Å; A281-E283 VanDerWaalsContact C-N 3.34Å; A281-Q284 PolarHBondContact O-N 3.36Å; A281-Q285 WeakPolarHBondContact O-CG 3.46Å; A281-Q285 PolarHBondContact O-N 3.14Å
282	L	91	Very high	87.9	Confident	82 Å²	82	87.7 Å²	87.7	43%	0.429	46%	0.463	S	S	.	.	H	α-helix	trans	-66.2	-39.6	174.8	-74.8	175.4	0	0	0	111.3	L259 Y278 K279 Y280 Q284 Q285	L259-L282 HydrophobicContact CD2-CD2 3.9Å; L259-L282 HydrophobicContact CD2-CG 4.2Å; Y278-L282 HydrophobicContact CD1-CD1 3.95Å; Y278-L282 HydrophobicContact CE1-CD1 3.49Å; Y278-L282 VanDerWaalsContact CE1-CD1 3.49Å; Y278-L282 HydrophobicContact CE1-CG 4.21Å; Y278-L282 PolarHBondContact O-N 3.09Å; Y278-L282 VanDerWaalsContact O-N 3.15Å; K279-L282 PolarHBondContact O-N 3.36Å; K279-L282 VanDerWaalsContact O-N 3.15Å; Y280-L282 VanDerWaalsContact C-N 3.35Å; Y280-L282 PolarHBondContact O-N 3.41Å; L282-Q284 VanDerWaalsContact C-N 3.27Å; L282-Q284 PolarHBondContact O-N 3.46Å; L282-Q285 PolarHBondContact O-N 3.42Å
283	E	90	Very high	87.7	Confident	112 Å²	112	91.6 Å²	91.6	52%	0.523	48%	0.481	S	S	.	.	H	α-helix	trans	-66.6	-27.3	176.9	-70.6	170.5	173.7	0	0	112.6	K279 Y280 A281	K279-E283 WeakPolarHBondContact CE-OE1 3.48Å; K279-E283 IonicContact NZ-OE1 3.86Å; K279-E283 WeakPolarHBondContact O-CG 3.36Å; K279-E283 PolarHBondContact O-N 3.38Å; Y280-E283 PolarHBondContact O-N 3.27Å; A281-E283 VanDerWaalsContact C-N 3.34Å
284	Q	83.3	Confident	87.4	Confident	125 Å²	125	85.5 Å²	85.5	58%	0.584	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-11.9	175.9	-65	-64.9	-35.3	0	0	114.2	Y280 A281 L282	Y280-Q284 HydrophobicContact CD1-CG 4.15Å; Y280-Q284 HydrophobicContact CE1-CG 3.69Å; Y280-Q284 HydrophobicContact CE2-CG 4.35Å; Y280-Q284 WeakPolarHBondContact O-CG 3.34Å; Y280-Q284 PolarHBondContact O-N 3.45Å; Y280-Q284 VanDerWaalsContact O-N 3.09Å; A281-Q284 PolarHBondContact O-N 3.36Å; L282-Q284 VanDerWaalsContact C-N 3.27Å; L282-Q284 PolarHBondContact O-N 3.46Å
285	Q	78.2	Confident	87	Confident	125 Å²	125	85.9 Å²	85.9	58%	0.584	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-17.3	177.6	-74.9	-179.6	-1	0	0	113.5	A281 L282	A281-Q285 WeakPolarHBondContact O-CG 3.46Å; A281-Q285 PolarHBondContact O-N 3.14Å; L282-Q285 PolarHBondContact O-N 3.42Å
286	G	59.5	Low	86.5	Confident	125 Å²	125	82.3 Å²	82.3	100%	1.289	45%	0.452	S	S	*	.			trans	-88.9	0	177.1	0	0	0	0	0	111.9

Retrieved 286 of 286 residues in 489.1 ms (Link to these results)

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