A0A077ZLS7_TRITR Loading...

ATP synthase subunit alpha

Produces ATP from ADP in the presence of a proton gradient across the membrane.

AlphaFold DB , UniProt , Accession A0A077ZLS7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 508 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	40.5	Very low	69.4	Low	240 Å²	240	112.9 Å²	112.9	100%	1.182	63%	0.633	S	S	*	*				0	129	0	-73.1	177.2	-159.2	0	0	107.5	I3	M1-I3 PolarHBondContact O-N 3.22Å
2	A	52.2	Low	70.5	Confident	99 Å²	99	110.5 Å²	110.5	82%	0.818	62%	0.616	S	S	*	*			trans	-68.8	115	173.1	0	0	0	0	0	108	K4	A2-K4 PolarHBondContact O-N 2.62Å
3	I	54.8	Low	71.5	Confident	120 Å²	120	112.2 Å²	112.2	62%	0.615	61%	0.613	S	S	*	*			trans	-57.5	124.8	174.9	-61.7	173.4	0	0	0	107.2	M1 A5 I8	M1-I3 PolarHBondContact O-N 3.22Å; I3-A5 PolarHBondContact O-N 3.17Å; I3-I8 HydrophobicContact CB-CD1 4.41Å; I3-I8 HydrophobicContact CG2-CD1 3.71Å; I3-I8 HydrophobicContact CG2-CG1 3.52Å
4	K	64.7	Low	72.5	Confident	136 Å²	136	111.7 Å²	111.7	59%	0.591	61%	0.605	S	S	*	*			trans	-70.4	132.3	179.3	-71	177.3	178.3	176.5	0	108.3	A2 E6 E7	A2-K4 PolarHBondContact O-N 2.62Å; K4-E6 PolarHBondContact O-N 2.93Å; K4-E7 HydrophobicContact CB-CG 4.4Å; K4-E7 PolarHBondContact O-N 2.94Å
5	A	74.8	Confident	73	Confident	73 Å²	73	113.6 Å²	113.6	60%	0.603	61%	0.608	S	S	*	*	H	α-helix	trans	-54.5	-26	178.8	0	0	0	0	0	113.3	I3 S9	I3-A5 PolarHBondContact O-N 3.17Å; A5-S9 WeakPolarHBondContact O-CB 3.42Å; A5-S9 PolarHBondContact O-N 3.16Å; A5-S9 VanDerWaalsContact O-N 3.08Å; A5-S9 PolarHBondContact O-OG 3.22Å
6	E	75.5	Confident	73.7	Confident	154 Å²	154	113.9 Å²	113.9	72%	0.72	61%	0.608	S	S	*	*	H	α-helix	trans	-64.7	-39.5	174.9	-66.6	174.3	171.6	0	0	112.8	K4 S9 A10	K4-E6 PolarHBondContact O-N 2.93Å; E6-S9 PolarHBondContact O-N 2.98Å; E6-A10 WeakPolarHBondContact O-CB 3.46Å; E6-A10 PolarHBondContact O-N 2.8Å
7	E	76.7	Confident	74	Confident	106 Å²	106	115.3 Å²	115.3	50%	0.495	61%	0.61	S	S	.	*	H	α-helix	trans	-68.8	-42.3	179.5	-69.7	168.5	180	0	0	111.2	K4 S9 A10 L11	K4-E7 HydrophobicContact CB-CG 4.4Å; K4-E7 PolarHBondContact O-N 2.94Å; E7-S9 VanDerWaalsContact C-N 3.33Å; E7-S9 PolarHBondContact O-N 3.2Å; E7-A10 PolarHBondContact O-N 3.44Å; E7-L11 WeakPolarHBondContact O-CG 3.43Å; E7-L11 PolarHBondContact O-N 2.99Å
8	I	78.8	Confident	74.3	Confident	78 Å²	78	115.3 Å²	115.3	40%	0.4	61%	0.61	S	S	.	*	H	α-helix	trans	-62.5	-44.3	175.9	-60	174.2	0	0	0	110.1	I3 A10 L11 I12	I3-I8 HydrophobicContact CB-CD1 4.41Å; I3-I8 HydrophobicContact CG2-CD1 3.71Å; I3-I8 HydrophobicContact CG2-CG1 3.52Å; I8-A10 VanDerWaalsContact C-N 3.32Å; I8-A10 PolarHBondContact O-N 2.95Å; I8-L11 PolarHBondContact O-N 3.47Å; I8-I12 HydrophobicContact CG2-CD1 3.72Å; I8-I12 HydrophobicContact CG2-CG1 4.38Å; I8-I12 VanDerWaalsContact O-CG1 3.31Å; I8-I12 WeakPolarHBondContact O-CG1 3.09Å; I8-I12 PolarHBondContact O-N 3.36Å
9	S	79.9	Confident	74.5	Confident	77 Å²	77	118.1 Å²	118.1	54%	0.538	61%	0.613	S	S	.	*	H	α-helix	trans	-64.4	-38.2	179.6	-59.8	0	0	0	0	111.8	A5 E6 E7 K13	A5-S9 WeakPolarHBondContact O-CB 3.42Å; A5-S9 PolarHBondContact O-N 3.16Å; A5-S9 VanDerWaalsContact O-N 3.08Å; A5-S9 PolarHBondContact O-OG 3.22Å; E6-S9 PolarHBondContact O-N 2.98Å; E7-S9 VanDerWaalsContact C-N 3.33Å; E7-S9 PolarHBondContact O-N 3.2Å; S9-K13 WeakPolarHBondContact O-CB 3.27Å; S9-K13 PolarHBondContact O-N 2.97Å
10	A	84	Confident	74.1	Confident	56 Å²	56	118 Å²	118	46%	0.463	61%	0.613	S	S	.	*	H	α-helix	trans	-65.8	-46.7	175.7	0	0	0	0	0	111.9	E6 E7 I8 K13 E14	E6-A10 WeakPolarHBondContact O-CB 3.46Å; E6-A10 PolarHBondContact O-N 2.8Å; E7-A10 PolarHBondContact O-N 3.44Å; I8-A10 VanDerWaalsContact C-N 3.32Å; I8-A10 PolarHBondContact O-N 2.95Å; A10-K13 PolarHBondContact O-N 3.31Å; A10-E14 WeakPolarHBondContact O-CB 3.45Å; A10-E14 PolarHBondContact O-N 3.3Å
11	L	81.5	Confident	73.4	Confident	103 Å²	103	117.9 Å²	117.9	54%	0.539	61%	0.613	S	S	.	*	H	α-helix	trans	-61.1	-46.2	177.8	-75.2	166.8	0	0	0	112.2	E7 I8 K13 E14 Q15	E7-L11 WeakPolarHBondContact O-CG 3.43Å; E7-L11 PolarHBondContact O-N 2.99Å; I8-L11 PolarHBondContact O-N 3.47Å; L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.02Å; L11-E14 PolarHBondContact O-N 3.12Å; L11-Q15 WeakPolarHBondContact O-CG 3.32Å; L11-Q15 PolarHBondContact O-N 3.37Å
12	I	83	Confident	74.3	Confident	84 Å²	84	114.1 Å²	114.1	43%	0.431	59%	0.591	S	S	.	*	H	α-helix	trans	-63.7	-41.4	177	-66.3	170.8	0	0	0	110.3	I8 E14 Q15 I16	I8-I12 HydrophobicContact CG2-CD1 3.72Å; I8-I12 HydrophobicContact CG2-CG1 4.38Å; I8-I12 VanDerWaalsContact O-CG1 3.31Å; I8-I12 WeakPolarHBondContact O-CG1 3.09Å; I8-I12 PolarHBondContact O-N 3.36Å; I12-E14 VanDerWaalsContact C-N 3.34Å; I12-E14 PolarHBondContact O-N 3.46Å; I12-Q15 PolarHBondContact O-N 3.34Å; I12-I16 HydrophobicContact CG2-CD1 3.78Å; I12-I16 HydrophobicContact CG2-CG1 4.38Å; I12-I16 VanDerWaalsContact O-CG1 3.26Å; I12-I16 WeakPolarHBondContact O-CG1 3.09Å; I12-I16 PolarHBondContact O-N 2.97Å
13	K	83.3	Confident	74.5	Confident	132 Å²	132	117.8 Å²	117.8	57%	0.574	60%	0.595	S	S	*	*	H	α-helix	trans	-62.8	-41.9	177.6	-173.6	179	-178.3	-177.5	0	111.6	S9 A10 L11 I16 Q17	S9-K13 WeakPolarHBondContact O-CB 3.27Å; S9-K13 PolarHBondContact O-N 2.97Å; A10-K13 PolarHBondContact O-N 3.31Å; L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.02Å; K13-I16 PolarHBondContact O-N 2.82Å; K13-Q17 WeakPolarHBondContact O-CB 3.37Å; K13-Q17 VanDerWaalsContact O-CG 3.29Å; K13-Q17 WeakPolarHBondContact O-CG 3.49Å; K13-Q17 PolarHBondContact O-N 2.91Å
14	E	85.2	Confident	74.9	Confident	106 Å²	106	115.7 Å²	115.7	50%	0.495	59%	0.592	S	S	.	*	H	α-helix	trans	-63.4	-44.7	175.1	-176	176.4	-175.4	0	0	111.5	A10 L11 I12 I16 Q17 N18	A10-E14 WeakPolarHBondContact O-CB 3.45Å; A10-E14 PolarHBondContact O-N 3.3Å; L11-E14 PolarHBondContact O-N 3.12Å; I12-E14 VanDerWaalsContact C-N 3.34Å; I12-E14 PolarHBondContact O-N 3.46Å; E14-I16 VanDerWaalsContact C-N 3.33Å; E14-I16 PolarHBondContact O-N 3.3Å; E14-Q17 PolarHBondContact O-N 2.88Å; E14-N18 WeakPolarHBondContact O-CB 3.38Å; E14-N18 PolarHBondContact O-N 3.49Å; E14-N18 PolarHBondContact O-ND2 2.91Å
15	Q	80.2	Confident	75	Confident	140 Å²	140	116.7 Å²	116.7	65%	0.654	61%	0.609	S	S	*	*	H	α-helix	trans	-60.6	-40.2	174.9	-74.5	-178.9	-12.9	0	0	112.5	L11 I12 Y19	L11-Q15 WeakPolarHBondContact O-CG 3.32Å; L11-Q15 PolarHBondContact O-N 3.37Å; I12-Q15 PolarHBondContact O-N 3.34Å; Q15-Y19 PolarHBondContact O-N 3.44Å; Q15-Y19 VanDerWaalsContact O-N 3.09Å
16	I	83.5	Confident	75	Confident	118 Å²	118	117.4 Å²	117.4	61%	0.605	60%	0.6	S	S	*	*	H	α-helix	trans	-67.8	-40.8	175.4	-67.8	167.5	0	0	0	111	I12 K13 E14 N18 Y19	I12-I16 HydrophobicContact CG2-CD1 3.78Å; I12-I16 HydrophobicContact CG2-CG1 4.38Å; I12-I16 VanDerWaalsContact O-CG1 3.26Å; I12-I16 WeakPolarHBondContact O-CG1 3.09Å; I12-I16 PolarHBondContact O-N 2.97Å; K13-I16 PolarHBondContact O-N 2.82Å; E14-I16 VanDerWaalsContact C-N 3.33Å; E14-I16 PolarHBondContact O-N 3.3Å; I16-N18 VanDerWaalsContact C-N 3.34Å; I16-Y19 WeakPolarHBondContact O-CB 3.27Å; I16-Y19 PolarHBondContact O-N 3.23Å
17	Q	79.8	Confident	75.4	Confident	138 Å²	138	112.4 Å²	112.4	65%	0.645	58%	0.576	S	S	*	*	H	α-helix	trans	-65.8	-37.4	178	-78.2	179.2	-22.2	0	0	112.3	K13 E14 Y19	K13-Q17 WeakPolarHBondContact O-CB 3.37Å; K13-Q17 VanDerWaalsContact O-CG 3.29Å; K13-Q17 WeakPolarHBondContact O-CG 3.49Å; K13-Q17 PolarHBondContact O-N 2.91Å; E14-Q17 PolarHBondContact O-N 2.88Å; Q17-Y19 VanDerWaalsContact C-N 3.28Å
18	N	79.7	Confident	76	Confident	115 Å²	115	110.7 Å²	110.7	62%	0.615	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	0.5	178.5	-66.9	-24.7	0	0	0	113.1	E14 I16 D20	E14-N18 WeakPolarHBondContact O-CB 3.38Å; E14-N18 PolarHBondContact O-N 3.49Å; E14-N18 PolarHBondContact O-ND2 2.91Å; I16-N18 VanDerWaalsContact C-N 3.34Å; N18-D20 VanDerWaalsContact C-N 3.27Å; N18-D20 PolarHBondContact O-N 3.25Å
19	Y	77	Confident	76.6	Confident	169 Å²	169	107 Å²	107	66%	0.663	55%	0.551	S	S	*	*			trans	-73.2	83.8	174.1	-170.6	-94.6	0	0	0	109.8	Q15 I16 Q17 N21	Q15-Y19 PolarHBondContact O-N 3.44Å; Q15-Y19 VanDerWaalsContact O-N 3.09Å; I16-Y19 WeakPolarHBondContact O-CB 3.27Å; I16-Y19 PolarHBondContact O-N 3.23Å; Q17-Y19 VanDerWaalsContact C-N 3.28Å; Y19-N21 HydrophobicContact CE1-CB 4.14Å
20	D	67	Low	77.3	Confident	116 Å²	116	106.6 Å²	106.6	62%	0.62	55%	0.545	S	S	*	.			trans	-92.6	109.8	173	-169.1	16.7	0	0	0	109	N18 K22	N18-D20 VanDerWaalsContact C-N 3.27Å; N18-D20 PolarHBondContact O-N 3.25Å; D20-K22 PolarHBondContact O-N 3.28Å; D20-K22 WeakPolarHBondContact OD2-CE 3.2Å
21	N	60.4	Low	77.9	Confident	115 Å²	115	104 Å²	104	62%	0.615	52%	0.523	S	S	*	.			trans	-80.8	74.2	180	-153.7	12.9	0	0	0	109.1	Y19 L23	Y19-N21 HydrophobicContact CE1-CB 4.14Å; N21-L23 PolarHBondContact O-N 3.31Å
22	K	58.3	Low	78.4	Confident	161 Å²	161	101.9 Å²	101.9	70%	0.7	52%	0.515	S	S	*	.			trans	-65.8	104.2	176.1	-72.2	-176.7	-179.4	174.4	0	109.1	D20 S24	D20-K22 PolarHBondContact O-N 3.28Å; D20-K22 WeakPolarHBondContact OD2-CE 3.2Å; K22-S24 VanDerWaalsContact C-N 3.31Å; K22-S24 PolarHBondContact O-N 3.49Å
23	L	55.8	Low	78.8	Confident	176 Å²	176	103.6 Å²	103.6	92%	0.921	52%	0.517	S	S	*	.			trans	-62.9	93.5	168	-74.8	162.8	0	0	0	108.5	N21	N21-L23 PolarHBondContact O-N 3.31Å
24	S	64.6	Low	79.2	Confident	77 Å²	77	99.3 Å²	99.3	54%	0.538	50%	0.502	S	S	.	.			trans	-98.8	141.9	169.5	78.2	0	0	0	0	109.2	K22 E26	K22-S24 VanDerWaalsContact C-N 3.31Å; K22-S24 PolarHBondContact O-N 3.49Å; S24-E26 VanDerWaalsContact C-N 3.34Å; S24-E26 PolarHBondContact O-N 2.94Å; S24-E26 WeakPolarHBondContact OG-CG 3.25Å
25	V	66	Low	79.3	Confident	157 Å²	157	95 Å²	95	95%	0.952	49%	0.486	S	S	*	.			trans	-76.6	94.4	172.8	-179.5	0	0	0	0	106.5
26	E	75	Confident	79.4	Confident	88 Å²	88	93.3 Å²	93.3	41%	0.411	48%	0.482	S	S	.	.			trans	-81.7	134.9	177.2	-66.1	174.4	179.2	0	0	109.9	S24 K89	S24-E26 VanDerWaalsContact C-N 3.34Å; S24-E26 PolarHBondContact O-N 2.94Å; S24-E26 WeakPolarHBondContact OG-CG 3.25Å; E26-K89 VanDerWaalsContact OE2-CD 3.26Å; E26-K89 WeakPolarHBondContact OE2-CD 3.47Å; E26-K89 WeakPolarHBondContact OE2-CE 3.29Å; E26-K89 IonicContact OE2-NZ 3.25Å; E26-K89 PolarHBondContact OE2-NZ 3.38Å
27	E	83.2	Confident	79.5	Confident	48 Å²	48	87.8 Å²	87.8	22%	0.224	45%	0.453	C	S	.	.			trans	-80.2	123.4	171	-173	175.7	-179	0	0	109.5	L44 E45 N46 R90	E27-L44 VanDerWaalsContact OE1-C 3.23Å; E27-L44 WeakPolarHBondContact OE1-CA 3.34Å; E27-E45 WeakPolarHBondContact OE1-CA 3.44Å; E27-E45 PolarHBondContact OE1-N 2.86Å; E27-N46 PolarHBondContact OE1-N 3.14Å; E27-N46 PolarHBondContact OE1-ND2 2.87Å; E27-N46 WeakPolarHBondContact OE2-CB 3.39Å; E27-N46 PolarHBondContact OE2-ND2 3.5Å; E27-N46 VanDerWaalsContact OE2-ND2 3.11Å; E27-R90 HydrophobicContact CB-CG 4.49Å; E27-R90 PolarHBondContact O-N 2.69Å; E27-R90 WeakPolarHBondContact OE2-CD 3.25Å; E27-R90 IonicContact OE2-CZ 3.5Å; E27-R90 IonicContact OE2-NE 2.69Å; E27-R90 IonicContact OE2-NH1 3.96Å; E27-R90 PolarHBondContact OE2-NH1 3.49Å
28	I	89.5	Confident	80	Confident	71 Å²	71	81.5 Å²	81.5	36%	0.364	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133	-172.5	-59.6	174	0	0	0	109.1	K87 V88 K89	I28-K87 HydrophobicContact CG2-CB 3.89Å; I28-K87 HydrophobicContact CG2-CD 4.11Å; I28-K87 HydrophobicContact CG2-CG 3.92Å; I28-V88 CarbonylContact C-O 3.56Å; I28-V88 WeakPolarHBondContact CA-O 3.3Å; I28-K89 HydrophobicContact CG1-CG 4.35Å
29	G	92.4	Very high	80.6	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	163.3	165.2	0	0	0	0	0	111.8	H42 K87 V88	G29-H42 CarbonylContact C-O 3.55Å; G29-H42 WeakPolarHBondContact CA-O 3.2Å; G29-K87 WeakPolarHBondContact O-CA 3.43Å; G29-V88 PolarHBondContact N-O 3.33Å; G29-V88 PolarHBondContact O-N 3.47Å
30	T	94.8	Very high	81.4	Confident	68 Å²	68	71 Å²	71	42%	0.417	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.3	173.3	-57	0	0	0	0	109.4	T32 A41 H42 D86	T30-T32 PolarHBondContact O-N 3.46Å; T30-A41 CarbonylContact O-C 3.5Å; T30-A41 VanDerWaalsContact O-CA 3.24Å; T30-A41 WeakPolarHBondContact O-CA 3.28Å; T30-H42 PolarHBondContact N-O 2.87Å; T30-H42 PolarHBondContact O-N 3.31Å; T30-D86 WeakPolarHBondContact CA-O 3.29Å
31	V	95.2	Very high	82.7	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	122.7	178.7	178.3	0	0	0	0	109.3	Y33 V34 A39 R40 F55 I82 G85 D86	V31-Y33 WeakPolarHBondContact CG1-O 3.46Å; V31-V34 HydrophobicContact CG1-CB 4.45Å; V31-A39 HydrophobicContact CG1-CB 4.42Å; V31-R40 CarbonylContact C-O 3.57Å; V31-R40 WeakPolarHBondContact CA-O 3.23Å; V31-F55 HydrophobicContact CG2-CD1 4.05Å; V31-F55 HydrophobicContact CG2-CE1 3.81Å; V31-I82 HydrophobicContact CG1-CG2 4.32Å; V31-I82 HydrophobicContact CG2-CG2 4.31Å; V31-G85 PolarHBondContact O-N 3.17Å; V31-D86 HydrophobicContact CG2-CB 4.28Å; V31-D86 WeakPolarHBondContact CG2-O 3.45Å; V31-D86 PolarHBondContact N-O 3.32Å
32	T	93.7	Very high	84.2	Confident	59 Å²	59	65.4 Å²	65.4	36%	0.362	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-20.7	178.3	54.2	0	0	0	0	112.5	T30 R40 H42	T30-T32 PolarHBondContact O-N 3.46Å; T32-R40 PolarHBondContact N-O 3.49Å; T32-R40 WeakPolarHBondContact OG1-CB 3.46Å; T32-R40 PolarHBondContact OG1-O 2.8Å; T32-H42 HydrophobicContact CG2-CB 3.85Å
33	Y	91.2	Very high	85.8	Confident	120 Å²	120	58.9 Å²	58.9	47%	0.471	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	145.1	178.4	172.3	-97.8	0	0	0	109.5	V31 A39 R40	V31-Y33 WeakPolarHBondContact CG1-O 3.46Å; Y33-A39 CarbonylContact O-C 3.54Å; Y33-A39 WeakPolarHBondContact O-CA 3.39Å; Y33-R40 HydrophobicContact CD1-CG 4.43Å; Y33-R40 PolarHBondContact N-O 2.68Å; Y33-R40 PolarHBondContact O-N 3.37Å
34	V	90.9	Very high	87.4	Confident	42 Å²	42	50.7 Å²	50.7	26%	0.255	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	135.5	169.9	60.1	0	0	0	0	109.2	V31 I38 I82	V31-V34 HydrophobicContact CG1-CB 4.45Å; V34-I38 CarbonylContact C-O 3.57Å; V34-I38 WeakPolarHBondContact CA-O 3.37Å; V34-I82 HydrophobicContact CB-CG2 4.41Å; V34-I82 HydrophobicContact CG2-CB 4.17Å; V34-I82 HydrophobicContact CG2-CG2 4.18Å
35	G	86.5	Confident	88.4	Confident	17 Å²	17	55.4 Å²	55.4	18%	0.175	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.1	138.6	177.1	0	0	0	0	0	111.2	G37 I38	G35-G37 VanDerWaalsContact C-N 3.26Å; G35-G37 PolarHBondContact O-N 3.29Å; G35-G37 VanDerWaalsContact O-N 3.13Å; G35-I38 PolarHBondContact N-O 2.8Å; G35-I38 PolarHBondContact O-N 3.05Å
36	D	83.2	Confident	89.5	Confident	104 Å²	104	53 Å²	53	56%	0.556	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	40.9	173.6	-54.8	-35.9	0	0	0	114.3	I38 L276	D36-I38 VanDerWaalsContact C-N 3.29Å; D36-I38 PolarHBondContact O-N 3.5Å; D36-L276 HydrophobicContact CB-CD1 3.72Å; D36-L276 HydrophobicContact CB-CD2 3.75Å; D36-L276 HydrophobicContact CB-CG 4.38Å; D36-L276 WeakPolarHBondContact O-CD1 3.47Å
37	G	86	Confident	90.2	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.01	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	10.9	-179.4	0	0	0	0	0	115.2	G35 V75	G35-G37 VanDerWaalsContact C-N 3.26Å; G35-G37 PolarHBondContact O-N 3.29Å; G35-G37 VanDerWaalsContact O-N 3.13Å; G37-V75 WeakPolarHBondContact O-CB 3.35Å; G37-V75 PolarHBondContact O-N 3.01Å
38	I	89.8	Confident	90.5	Very high	7 Å²	7	50.6 Å²	50.6	4%	0.036	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.9	172.3	-57.4	-161.8	0	0	0	109.6	V34 G35 D36 I73 L276 L277	V34-I38 CarbonylContact C-O 3.57Å; V34-I38 WeakPolarHBondContact CA-O 3.37Å; G35-I38 PolarHBondContact N-O 2.8Å; G35-I38 PolarHBondContact O-N 3.05Å; D36-I38 VanDerWaalsContact C-N 3.29Å; D36-I38 PolarHBondContact O-N 3.5Å; I38-I73 WeakPolarHBondContact CA-O 3.38Å; I38-L276 HydrophobicContact CD1-CB 3.28Å; I38-L276 HydrophobicContact CD1-CD1 4.44Å; I38-L276 HydrophobicContact CD1-CG 4.49Å; I38-L276 HydrophobicContact CG1-CB 4.1Å; I38-L276 HydrophobicContact CG1-CD1 4.5Å; I38-L277 HydrophobicContact CD1-CB 4.42Å; I38-L277 HydrophobicContact CD1-CD2 3.68Å; I38-L277 HydrophobicContact CD1-CG 3.6Å; I38-L277 HydrophobicContact CG2-CD2 4.03Å
39	A	92.6	Very high	90.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	149.5	167.5	0	0	0	0	0	110.4	V31 Y33 F55 I73 V75	V31-A39 HydrophobicContact CG1-CB 4.42Å; Y33-A39 CarbonylContact O-C 3.54Å; Y33-A39 WeakPolarHBondContact O-CA 3.39Å; A39-F55 HydrophobicContact CB-CE1 3.87Å; A39-F55 HydrophobicContact CB-CZ 3.77Å; A39-I73 HydrophobicContact CB-CB 4.35Å; A39-I73 PolarHBondContact N-O 3.03Å; A39-I73 PolarHBondContact O-N 2.89Å; A39-V75 HydrophobicContact CB-CG2 4.18Å
40	R	93.2	Very high	90.2	Very high	63 Å²	63	51.9 Å²	51.9	24%	0.238	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138.5	162.3	-66.2	176.3	168.9	-116.6	-8.6	107.9	V31 T32 Y33 E67 D70 V71	V31-R40 CarbonylContact C-O 3.57Å; V31-R40 WeakPolarHBondContact CA-O 3.23Å; T32-R40 PolarHBondContact N-O 3.49Å; T32-R40 WeakPolarHBondContact OG1-CB 3.46Å; T32-R40 PolarHBondContact OG1-O 2.8Å; Y33-R40 HydrophobicContact CD1-CG 4.43Å; Y33-R40 PolarHBondContact N-O 2.68Å; Y33-R40 PolarHBondContact O-N 3.37Å; R40-E67 IonicContact CZ-OE1 2.95Å; R40-E67 IonicContact NH1-OE1 2.82Å; R40-E67 PolarHBondContact NH1-OE1 3.22Å; R40-E67 IonicContact NH1-OE2 2.74Å; R40-E67 PolarHBondContact NH1-OE2 2.9Å; R40-E67 IonicContact NH2-OE1 3.4Å; R40-E67 PolarHBondContact NH2-OE1 3.42Å; R40-E67 VanDerWaalsContact NH2-OE1 3.09Å; R40-D70 WeakPolarHBondContact CD-OD2 3.33Å; R40-D70 IonicContact CZ-OD2 2.58Å; R40-D70 IonicContact NH1-OD1 3.71Å; R40-D70 IonicContact NH1-OD2 3.63Å; R40-D70 PolarHBondContact NH1-OD2 3.42Å; R40-V71 WeakPolarHBondContact CA-O 3.47Å
41	A	93.9	Very high	90.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.5	175.6	0	0	0	0	0	111.1	T30 L44 D70 V71 I73 V88	T30-A41 CarbonylContact O-C 3.5Å; T30-A41 VanDerWaalsContact O-CA 3.24Å; T30-A41 WeakPolarHBondContact O-CA 3.28Å; A41-L44 HydrophobicContact CB-CD1 4.21Å; A41-D70 CarbonylContact O-C 3.45Å; A41-D70 WeakPolarHBondContact O-CA 3.48Å; A41-V71 PolarHBondContact N-O 3.3Å; A41-V71 PolarHBondContact O-N 2.82Å; A41-I73 HydrophobicContact CB-CD1 3.68Å; A41-V88 HydrophobicContact CB-CG1 3.51Å
42	H	93.6	Very high	89.9	Confident	114 Å²	114	49.9 Å²	49.9	53%	0.528	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	146.1	169.6	-176	-79.8	0	0	0	109.9	G29 T30 T32 N69	G29-H42 CarbonylContact C-O 3.55Å; G29-H42 WeakPolarHBondContact CA-O 3.2Å; T30-H42 PolarHBondContact N-O 2.87Å; T30-H42 PolarHBondContact O-N 3.31Å; T32-H42 HydrophobicContact CG2-CB 3.85Å; H42-N69 PolarHBondContact CD2-O 3.16Å
43	G	90	Very high	89.8	Confident	23 Å²	23	47.1 Å²	47.1	24%	0.237	25%	0.25	C	S	.	.			trans	96	-146	-171.9	0	0	0	0	0	110.8	E45	G43-E45 PolarHBondContact O-N 2.87Å
44	L	90	Very high	89.9	Confident	4 Å²	4	45 Å²	45	2%	0.021	25%	0.245	C	C	.	.			trans	51.3	41.7	-177	-49.7	172.1	0	0	0	112.4	E27 A41 N46 A47 L53 V71 I73 V88 R90	E27-L44 VanDerWaalsContact OE1-C 3.23Å; E27-L44 WeakPolarHBondContact OE1-CA 3.34Å; A41-L44 HydrophobicContact CB-CD1 4.21Å; L44-N46 PolarHBondContact O-N 3.05Å; L44-N46 VanDerWaalsContact O-N 3.09Å; L44-A47 HydrophobicContact CB-CB 3.96Å; L44-A47 VanDerWaalsContact O-CB 3.23Å; L44-A47 WeakPolarHBondContact O-CB 3.49Å; L44-A47 PolarHBondContact O-N 3.37Å; L44-L53 HydrophobicContact CD1-CD1 3.86Å; L44-L53 HydrophobicContact CD1-CD2 4.39Å; L44-V71 HydrophobicContact CB-CG2 4.16Å; L44-V71 HydrophobicContact CD1-CB 4.35Å; L44-V71 HydrophobicContact CD1-CG2 4.41Å; L44-I73 HydrophobicContact CD1-CD1 4.18Å; L44-V88 HydrophobicContact CD1-CG1 3.86Å; L44-V88 HydrophobicContact CD2-CG1 4.37Å; L44-V88 HydrophobicContact CG-CG1 4.38Å; L44-R90 HydrophobicContact CD2-CG 3.47Å; L44-R90 VanDerWaalsContact CD2-CG 3.47Å
45	E	86.4	Confident	90.1	Very high	176 Å²	176	43.1 Å²	43.1	82%	0.822	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-32.6	-175.2	-62.9	-176.4	176	0	0	113	E27 G43	E27-E45 WeakPolarHBondContact OE1-CA 3.44Å; E27-E45 PolarHBondContact OE1-N 2.86Å; G43-E45 PolarHBondContact O-N 2.87Å
46	N	89.2	Confident	90.3	Very high	106 Å²	106	46 Å²	46	57%	0.567	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	14	179.8	-51.9	-76.6	0	0	0	113.7	E27 L44 M48 R90	E27-N46 PolarHBondContact OE1-N 3.14Å; E27-N46 PolarHBondContact OE1-ND2 2.87Å; E27-N46 WeakPolarHBondContact OE2-CB 3.39Å; E27-N46 PolarHBondContact OE2-ND2 3.5Å; E27-N46 VanDerWaalsContact OE2-ND2 3.11Å; L44-N46 PolarHBondContact O-N 3.05Å; L44-N46 VanDerWaalsContact O-N 3.09Å; N46-M48 PolarHBondContact O-N 3.37Å; N46-R90 VanDerWaalsContact CB-NH1 3.27Å; N46-R90 PolarHBondContact O-NH1 2.96Å; N46-R90 PolarHBondContact O-NH2 2.9Å
47	A	89	Confident	90.5	Very high	11 Å²	11	43.7 Å²	43.7	9%	0.091	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-60.2	134.5	177.6	0	0	0	0	0	112.2	L44 E51 L66	L44-A47 HydrophobicContact CB-CB 3.96Å; L44-A47 VanDerWaalsContact O-CB 3.23Å; L44-A47 WeakPolarHBondContact O-CB 3.49Å; L44-A47 PolarHBondContact O-N 3.37Å; A47-E51 WeakPolarHBondContact CA-OE2 3.38Å; A47-L66 HydrophobicContact CB-CD2 4.17Å; A47-L66 WeakPolarHBondContact O-CD1 3.44Å
48	M	89.5	Confident	90.7	Very high	76 Å²	76	45.6 Å²	45.6	37%	0.374	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-86.7	148.9	174.5	-58.7	177.3	-72	0	0	110.4	N46 G50 E51 I94	N46-M48 PolarHBondContact O-N 3.37Å; M48-G50 PolarHBondContact O-N 2.7Å; M48-E51 HydrophobicContact CB-CB 4.12Å; M48-E51 HydrophobicContact CE-CG 4.13Å; M48-E51 PolarHBondContact N-OE2 2.95Å; M48-E51 WeakPolarHBondContact O-CB 2.93Å; M48-E51 PolarHBondContact O-N 3.41Å; M48-I94 HydrophobicContact CB-CD1 3.95Å; M48-I94 HydrophobicContact CE-CD1 4.06Å; M48-I94 HydrophobicContact SD-CD1 4.27Å
49	S	88.9	Confident	90.7	Very high	81 Å²	81	46 Å²	46	57%	0.566	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	125.5	169.6	179.7	0	0	0	0	109.4	E51	S49-E51 VanDerWaalsContact C-N 3.35Å
50	G	87.6	Confident	90.6	Very high	16 Å²	16	49.6 Å²	49.6	17%	0.165	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	10	-174.6	0	0	0	0	0	114.5	M48 A63 M95	M48-G50 PolarHBondContact O-N 2.7Å; G50-A63 WeakPolarHBondContact CA-O 3.33Å; G50-A63 PolarHBondContact N-O 3.2Å; G50-M95 PolarHBondContact O-N 3.26Å
51	E	91.6	Very high	90.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	138.8	175.1	-161.7	-179.9	150.7	0	0	111.1	A47 M48 S49 M62 A63 R90 G92 K93	A47-E51 WeakPolarHBondContact CA-OE2 3.38Å; M48-E51 HydrophobicContact CB-CB 4.12Å; M48-E51 HydrophobicContact CE-CG 4.13Å; M48-E51 PolarHBondContact N-OE2 2.95Å; M48-E51 WeakPolarHBondContact O-CB 2.93Å; M48-E51 PolarHBondContact O-N 3.41Å; S49-E51 VanDerWaalsContact C-N 3.35Å; E51-M62 WeakPolarHBondContact O-CA 3.43Å; E51-A63 HydrophobicContact CB-CB 4.44Å; E51-A63 PolarHBondContact O-N 3.23Å; E51-R90 VanDerWaalsContact OE1-CB 3.31Å; E51-R90 WeakPolarHBondContact OE1-CB 3.36Å; E51-R90 IonicContact OE1-CZ 3.52Å; E51-R90 IonicContact OE1-NE 3.89Å; E51-R90 PolarHBondContact OE1-NE 2.97Å; E51-R90 VanDerWaalsContact OE1-NE 3.11Å; E51-R90 IonicContact OE1-NH2 2.65Å; E51-R90 PolarHBondContact OE1-NH2 3.19Å; E51-R90 IonicContact OE2-CZ 2.78Å; E51-R90 IonicContact OE2-NE 3.11Å; E51-R90 PolarHBondContact OE2-NE 2.66Å; E51-R90 VanDerWaalsContact OE2-NE 3.08Å; E51-R90 IonicContact OE2-NH2 3.98Å; E51-R90 PolarHBondContact OE2-NH2 3.13Å; E51-G92 WeakPolarHBondContact OE1-CA 3.31Å; E51-G92 PolarHBondContact OE1-N 3.48Å; E51-K93 VanDerWaalsContact CG-O 3.31Å; E51-K93 WeakPolarHBondContact CG-O 3.35Å
52	L	90.9	Very high	90.4	Very high	28 Å²	28	47.1 Å²	47.1	15%	0.147	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131.3	169.9	-167.8	73.5	0	0	0	109.1	Y60 G61 L76 T91 K93 M95	L52-Y60 HydrophobicContact CD1-CD1 4.02Å; L52-Y60 HydrophobicContact CD1-CG 4.22Å; L52-Y60 HydrophobicContact CD2-CD1 3.63Å; L52-Y60 HydrophobicContact CD2-CE1 3.83Å; L52-Y60 HydrophobicContact CD2-CG 4.37Å; L52-Y60 HydrophobicContact CG-CD1 3.7Å; L52-Y60 HydrophobicContact CG-CE1 4.34Å; L52-Y60 HydrophobicContact CG-CG 4.39Å; L52-G61 CarbonylContact C-O 3.49Å; L52-G61 WeakPolarHBondContact CA-O 3.07Å; L52-L76 HydrophobicContact CD1-CD1 3.91Å; L52-T91 HydrophobicContact CB-CG2 4.34Å; L52-T91 HydrophobicContact CD2-CG2 4.41Å; L52-T91 HydrophobicContact CG-CG2 4.33Å; L52-T91 WeakPolarHBondContact O-CB 3.44Å; L52-T91 VanDerWaalsContact O-CG2 3.22Å; L52-T91 WeakPolarHBondContact O-CG2 3.41Å; L52-T91 PolarHBondContact O-N 3.38Å; L52-T91 PolarHBondContact O-OG1 2.78Å; L52-K93 PolarHBondContact N-O 3.2Å; L52-M95 HydrophobicContact CD1-CG 4.46Å
53	L	93	Very high	90.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	148.9	178.6	-59.1	179.3	0	0	0	109.3	L44 Y60 G61 A63 I73 V88 K89 R90	L44-L53 HydrophobicContact CD1-CD1 3.86Å; L44-L53 HydrophobicContact CD1-CD2 4.39Å; L53-Y60 CarbonylContact O-C 3.58Å; L53-Y60 VanDerWaalsContact O-CA 3.28Å; L53-Y60 WeakPolarHBondContact O-CA 3.42Å; L53-G61 PolarHBondContact N-O 3.44Å; L53-G61 PolarHBondContact O-N 2.92Å; L53-A63 HydrophobicContact CD1-CB 4.05Å; L53-A63 HydrophobicContact CG-CB 4.45Å; L53-I73 HydrophobicContact CD1-CB 4.4Å; L53-I73 HydrophobicContact CD1-CD1 3.44Å; L53-I73 VanDerWaalsContact CD1-CD1 3.44Å; L53-I73 HydrophobicContact CD1-CG1 3.57Å; L53-I73 HydrophobicContact CD1-CG2 3.97Å; L53-V88 HydrophobicContact CB-CG2 3.76Å; L53-V88 HydrophobicContact CD1-CG2 4.18Å; L53-V88 HydrophobicContact CG-CG2 4.49Å; L53-K89 CarbonylContact C-O 3.54Å; L53-K89 WeakPolarHBondContact CA-O 3.39Å; L53-R90 HydrophobicContact CD2-CB 4.45Å; L53-R90 HydrophobicContact CD2-CG 4.01Å
54	E	93.1	Very high	90.2	Very high	76 Å²	76	42.5 Å²	42.5	36%	0.355	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123	178.8	-171.7	-176.6	174.2	0	0	109.9	Y60 V88 K89 T91	E54-Y60 HydrophobicContact CB-CE1 4.42Å; E54-Y60 HydrophobicContact CG-CE1 4.43Å; E54-V88 CarbonylContact O-C 3.56Å; E54-V88 WeakPolarHBondContact O-CA 3.1Å; E54-K89 PolarHBondContact N-O 2.9Å; E54-K89 PolarHBondContact O-N 3.49Å; E54-T91 HydrophobicContact CB-CG2 4.43Å
55	F	93.8	Very high	90	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.013	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	157.7	174.5	-69.7	-87.2	0	0	0	110.8	V31 A39 N57 G58 S59 I73 V75 I82 V88	V31-F55 HydrophobicContact CG2-CD1 4.05Å; V31-F55 HydrophobicContact CG2-CE1 3.81Å; A39-F55 HydrophobicContact CB-CE1 3.87Å; A39-F55 HydrophobicContact CB-CZ 3.77Å; F55-N57 VanDerWaalsContact CB-OD1 3.22Å; F55-N57 WeakPolarHBondContact CB-OD1 3.46Å; F55-N57 PolarHBondContact O-N 3.2Å; F55-G58 PolarHBondContact O-N 3.31Å; F55-S59 WeakPolarHBondContact CD2-O 3.4Å; F55-S59 PolarHBondContact N-O 3.08Å; F55-I73 HydrophobicContact CE2-CG2 3.97Å; F55-I73 HydrophobicContact CZ-CB 4.29Å; F55-I73 HydrophobicContact CZ-CD1 4.28Å; F55-I73 HydrophobicContact CZ-CG2 3.71Å; F55-V75 HydrophobicContact CE2-CG1 4.38Å; F55-V75 HydrophobicContact CE2-CG2 4.01Å; F55-V75 HydrophobicContact CZ-CG2 3.97Å; F55-I82 HydrophobicContact CB-CD1 4.24Å; F55-I82 HydrophobicContact CB-CG1 4.48Å; F55-I82 HydrophobicContact CD1-CD1 3.78Å; F55-I82 HydrophobicContact CD1-CG1 4.33Å; F55-I82 HydrophobicContact CD1-CG2 4.03Å; F55-I82 HydrophobicContact CD2-CD1 3.86Å; F55-I82 HydrophobicContact CE1-CD1 4.02Å; F55-I82 HydrophobicContact CE1-CG2 4.22Å; F55-I82 HydrophobicContact CE2-CD1 4.09Å; F55-I82 HydrophobicContact CG-CD1 3.7Å; F55-I82 HydrophobicContact CG-CG1 4.35Å; F55-I82 HydrophobicContact CZ-CD1 4.17Å; F55-V88 HydrophobicContact CD1-CB 4.15Å; F55-V88 HydrophobicContact CD1-CG2 4.3Å; F55-V88 HydrophobicContact CE1-CB 4.26Å; F55-V88 HydrophobicContact CE1-CG2 4.27Å
56	S	91	Very high	90.2	Very high	76 Å²	76	39.4 Å²	39.4	53%	0.531	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.9	179.4	47.2	0	0	0	0	115.3	G58 K87	S56-G58 VanDerWaalsContact C-N 3.31Å; S56-K87 PolarHBondContact N-O 2.88Å
57	N	88.6	Confident	90.1	Very high	56 Å²	56	38.8 Å²	38.8	30%	0.299	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.2	173.7	69.9	-13.2	0	0	0	113.4	F55 S59 E78 S81 I82	F55-N57 VanDerWaalsContact CB-OD1 3.22Å; F55-N57 WeakPolarHBondContact CB-OD1 3.46Å; F55-N57 PolarHBondContact O-N 3.2Å; N57-S59 VanDerWaalsContact C-N 3.34Å; N57-S59 PolarHBondContact ND2-OG 2.78Å; N57-S59 WeakPolarHBondContact OD1-CB 3.38Å; N57-S59 PolarHBondContact OD1-N 3.22Å; N57-S59 PolarHBondContact OD1-OG 2.99Å; N57-E78 PolarHBondContact ND2-O 3.35Å; N57-S81 PolarHBondContact ND2-OG 3.28Å; N57-I82 WeakPolarHBondContact ND2-CG1 3.13Å
58	G	88.9	Confident	90	Very high	41 Å²	41	43.7 Å²	43.7	42%	0.423	26%	0.255	S	S	.	.	S	Bend	trans	84.4	1	-175.4	0	0	0	0	0	114.7	F55 S56	F55-G58 PolarHBondContact O-N 3.31Å; S56-G58 VanDerWaalsContact C-N 3.31Å
59	S	89.5	Confident	89.9	Confident	16 Å²	16	45.6 Å²	45.6	11%	0.112	27%	0.267	C	S	.	.			trans	-72.1	146.1	170.9	-67.3	0	0	0	0	110.3	F55 N57 E78	F55-S59 WeakPolarHBondContact CD2-O 3.4Å; F55-S59 PolarHBondContact N-O 3.08Å; N57-S59 VanDerWaalsContact C-N 3.34Å; N57-S59 PolarHBondContact ND2-OG 2.78Å; N57-S59 WeakPolarHBondContact OD1-CB 3.38Å; N57-S59 PolarHBondContact OD1-N 3.22Å; N57-S59 PolarHBondContact OD1-OG 2.99Å; S59-E78 PolarHBondContact OG-O 2.72Å
60	Y	91.2	Very high	89.9	Confident	75 Å²	75	43 Å²	43	29%	0.294	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	156.9	172	-70.5	-76.2	0	0	0	111.3	L52 L53 E54 L76 L111	L52-Y60 HydrophobicContact CD1-CD1 4.02Å; L52-Y60 HydrophobicContact CD1-CG 4.22Å; L52-Y60 HydrophobicContact CD2-CD1 3.63Å; L52-Y60 HydrophobicContact CD2-CE1 3.83Å; L52-Y60 HydrophobicContact CD2-CG 4.37Å; L52-Y60 HydrophobicContact CG-CD1 3.7Å; L52-Y60 HydrophobicContact CG-CE1 4.34Å; L52-Y60 HydrophobicContact CG-CG 4.39Å; L53-Y60 CarbonylContact O-C 3.58Å; L53-Y60 VanDerWaalsContact O-CA 3.28Å; L53-Y60 WeakPolarHBondContact O-CA 3.42Å; E54-Y60 HydrophobicContact CB-CE1 4.42Å; E54-Y60 HydrophobicContact CG-CE1 4.43Å; Y60-L76 WeakPolarHBondContact O-CA 3.39Å; Y60-L76 PolarHBondContact O-N 3.23Å; Y60-L111 HydrophobicContact CD2-CD1 4.24Å
61	G	91.9	Very high	90.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	166.1	167.8	0	0	0	0	0	111.3	L52 L53 I74	L52-G61 CarbonylContact C-O 3.49Å; L52-G61 WeakPolarHBondContact CA-O 3.07Å; L53-G61 PolarHBondContact N-O 3.44Å; L53-G61 PolarHBondContact O-N 2.92Å; G61-I74 CarbonylContact C-O 3.58Å; G61-I74 WeakPolarHBondContact CA-O 3.48Å
62	M	91.2	Very high	90.2	Very high	11 Å²	11	42.7 Å²	42.7	5%	0.054	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.5	174.5	-172.5	-179.2	65.2	0	0	109.6	E51 Q64 I73 I74 L76 M95 F236	E51-M62 WeakPolarHBondContact O-CA 3.43Å; M62-Q64 PolarHBondContact O-N 3.29Å; M62-I73 WeakPolarHBondContact O-CA 3.28Å; M62-I74 HydrophobicContact CE-CD1 4.25Å; M62-I74 PolarHBondContact N-O 3.47Å; M62-I74 PolarHBondContact O-N 3Å; M62-L76 HydrophobicContact CB-CD1 4.24Å; M62-M95 HydrophobicContact SD-CB 4.43Å; M62-M95 HydrophobicContact SD-SD 3.88Å; M62-F236 HydrophobicContact CE-CE1 3.91Å
63	A	92	Very high	90.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	112	173.3	0	0	0	0	0	109.6	G50 E51 L53 L66 V71	G50-A63 WeakPolarHBondContact CA-O 3.33Å; G50-A63 PolarHBondContact N-O 3.2Å; E51-A63 HydrophobicContact CB-CB 4.44Å; E51-A63 PolarHBondContact O-N 3.23Å; L53-A63 HydrophobicContact CD1-CB 4.05Å; L53-A63 HydrophobicContact CG-CB 4.45Å; A63-L66 HydrophobicContact CB-CD2 4.5Å; A63-V71 HydrophobicContact CB-CG1 3.93Å
64	Q	87.2	Confident	90.2	Very high	40 Å²	40	41.5 Å²	41.5	19%	0.187	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-48	-175.2	-175.4	67.9	60.6	0	0	112.9	M62 G72 I74 L277	M62-Q64 PolarHBondContact O-N 3.29Å; Q64-G72 PolarHBondContact N-O 3.49Å; Q64-I74 HydrophobicContact CB-CD1 3.73Å; Q64-I74 HydrophobicContact CB-CG1 3.86Å; Q64-I74 HydrophobicContact CG-CD1 3.75Å; Q64-I74 HydrophobicContact CG-CG1 4.37Å; Q64-L277 HydrophobicContact CB-CD1 4.39Å; Q64-L277 HydrophobicContact CG-CD1 3.82Å
65	N	85.9	Confident	90.1	Very high	27 Å²	27	37.9 Å²	37.9	14%	0.144	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128.2	178.5	-68.7	-8.9	0	0	0	108.2	V71 G72 R279	N65-V71 CarbonylContact O-C 3.56Å; N65-V71 WeakPolarHBondContact O-CA 3.34Å; N65-G72 PolarHBondContact N-O 2.8Å; N65-G72 PolarHBondContact O-N 2.63Å; N65-R279 PolarHBondContact OD1-NH2 2.86Å
66	L	90.1	Very high	89.8	Confident	88 Å²	88	38 Å²	38	46%	0.461	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	96.5	171.8	-56.7	176.3	0	0	0	106.9	A47 A63 V71	A47-L66 HydrophobicContact CB-CD2 4.17Å; A47-L66 WeakPolarHBondContact O-CD1 3.44Å; A63-L66 HydrophobicContact CB-CD2 4.5Å; L66-V71 HydrophobicContact CD2-CB 4.41Å; L66-V71 HydrophobicContact CD2-CG1 3.82Å; L66-V71 HydrophobicContact CD2-CG2 3.86Å
67	E	87.8	Confident	89.5	Confident	93 Å²	93	35.2 Å²	35.2	44%	0.435	20%	0.203	S	C	.	.			trans	-85.3	176.5	173.9	-54.7	-174	-168.6	0	0	109.3	R40 N69 D70	R40-E67 IonicContact CZ-OE1 2.95Å; R40-E67 IonicContact NH1-OE1 2.82Å; R40-E67 PolarHBondContact NH1-OE1 3.22Å; R40-E67 IonicContact NH1-OE2 2.74Å; R40-E67 PolarHBondContact NH1-OE2 2.9Å; R40-E67 IonicContact NH2-OE1 3.4Å; R40-E67 PolarHBondContact NH2-OE1 3.42Å; R40-E67 VanDerWaalsContact NH2-OE1 3.09Å; E67-N69 VanDerWaalsContact C-N 3.3Å; E67-N69 PolarHBondContact O-N 3.31Å; E67-D70 CarbonylContact C-O 3.38Å; E67-D70 WeakPolarHBondContact CA-O 3.36Å; E67-D70 WeakPolarHBondContact CB-O 3.43Å; E67-D70 WeakPolarHBondContact CB-OD1 3.42Å; E67-D70 VanDerWaalsContact CD-OD1 3.27Å; E67-D70 WeakPolarHBondContact CG-OD1 3.19Å; E67-D70 PolarHBondContact N-O 2.94Å
68	S	86	Confident	89.4	Confident	115 Å²	115	39.6 Å²	39.6	80%	0.804	22%	0.222	S	C	*	.	S	Bend	trans	-67.3	-30.3	-174.6	62	0	0	0	0	113.8
69	N	87.3	Confident	89.3	Confident	115 Å²	115	40.8 Å²	40.8	62%	0.615	22%	0.215	S	C	*	.	S	Bend	trans	-127.5	-9.9	-173.3	-60.6	-13.4	0	0	0	113.3	H42 E67	H42-N69 PolarHBondContact CD2-O 3.16Å; E67-N69 VanDerWaalsContact C-N 3.3Å; E67-N69 PolarHBondContact O-N 3.31Å
70	D	90.2	Very high	89.2	Confident	28 Å²	28	48.4 Å²	48.4	15%	0.15	25%	0.249	C	C	.	.			trans	-142	158.6	178	71.8	21.7	0	0	0	111.5	R40 A41 E67	R40-D70 WeakPolarHBondContact CD-OD2 3.33Å; R40-D70 IonicContact CZ-OD2 2.58Å; R40-D70 IonicContact NH1-OD1 3.71Å; R40-D70 IonicContact NH1-OD2 3.63Å; R40-D70 PolarHBondContact NH1-OD2 3.42Å; A41-D70 CarbonylContact O-C 3.45Å; A41-D70 WeakPolarHBondContact O-CA 3.48Å; E67-D70 CarbonylContact C-O 3.38Å; E67-D70 WeakPolarHBondContact CA-O 3.36Å; E67-D70 WeakPolarHBondContact CB-O 3.43Å; E67-D70 WeakPolarHBondContact CB-OD1 3.42Å; E67-D70 VanDerWaalsContact CD-OD1 3.27Å; E67-D70 WeakPolarHBondContact CG-OD1 3.19Å; E67-D70 PolarHBondContact N-O 2.94Å
71	V	92.2	Very high	89.2	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.9	172.4	177.4	0	0	0	0	107.7	R40 A41 L44 A63 N65 L66 I73	R40-V71 WeakPolarHBondContact CA-O 3.47Å; A41-V71 PolarHBondContact N-O 3.3Å; A41-V71 PolarHBondContact O-N 2.82Å; L44-V71 HydrophobicContact CB-CG2 4.16Å; L44-V71 HydrophobicContact CD1-CB 4.35Å; L44-V71 HydrophobicContact CD1-CG2 4.41Å; A63-V71 HydrophobicContact CB-CG1 3.93Å; N65-V71 CarbonylContact O-C 3.56Å; N65-V71 WeakPolarHBondContact O-CA 3.34Å; L66-V71 HydrophobicContact CD2-CB 4.41Å; L66-V71 HydrophobicContact CD2-CG1 3.82Å; L66-V71 HydrophobicContact CD2-CG2 3.86Å; V71-I73 HydrophobicContact CB-CG1 4.42Å; V71-I73 HydrophobicContact CG1-CG1 3.83Å; V71-I73 PolarHBondContact O-N 3.34Å
72	G	91.9	Very high	89.2	Confident	2 Å²	2	47.7 Å²	47.7	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	112.9	169.1	0	0	0	0	0	110.1	Q64 N65	Q64-G72 PolarHBondContact N-O 3.49Å; N65-G72 PolarHBondContact N-O 2.8Å; N65-G72 PolarHBondContact O-N 2.63Å
73	I	92.7	Very high	89.3	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.5	-174.4	-52.5	169.1	0	0	0	108.8	I38 A39 A41 L44 L53 F55 M62 V71 V88	I38-I73 WeakPolarHBondContact CA-O 3.38Å; A39-I73 HydrophobicContact CB-CB 4.35Å; A39-I73 PolarHBondContact N-O 3.03Å; A39-I73 PolarHBondContact O-N 2.89Å; A41-I73 HydrophobicContact CB-CD1 3.68Å; L44-I73 HydrophobicContact CD1-CD1 4.18Å; L53-I73 HydrophobicContact CD1-CB 4.4Å; L53-I73 HydrophobicContact CD1-CD1 3.44Å; L53-I73 VanDerWaalsContact CD1-CD1 3.44Å; L53-I73 HydrophobicContact CD1-CG1 3.57Å; L53-I73 HydrophobicContact CD1-CG2 3.97Å; F55-I73 HydrophobicContact CE2-CG2 3.97Å; F55-I73 HydrophobicContact CZ-CB 4.29Å; F55-I73 HydrophobicContact CZ-CD1 4.28Å; F55-I73 HydrophobicContact CZ-CG2 3.71Å; M62-I73 WeakPolarHBondContact O-CA 3.28Å; V71-I73 HydrophobicContact CB-CG1 4.42Å; V71-I73 HydrophobicContact CG1-CG1 3.83Å; V71-I73 PolarHBondContact O-N 3.34Å; I73-V88 HydrophobicContact CD1-CG1 4.26Å; I73-V88 HydrophobicContact CD1-CG2 4.09Å
74	I	91.3	Very high	89.4	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.015	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	122.9	171.3	-63.2	-179	0	0	0	108.3	G61 M62 Q64 P233 L273 L277	G61-I74 CarbonylContact C-O 3.58Å; G61-I74 WeakPolarHBondContact CA-O 3.48Å; M62-I74 HydrophobicContact CE-CD1 4.25Å; M62-I74 PolarHBondContact N-O 3.47Å; M62-I74 PolarHBondContact O-N 3Å; Q64-I74 HydrophobicContact CB-CD1 3.73Å; Q64-I74 HydrophobicContact CB-CG1 3.86Å; Q64-I74 HydrophobicContact CG-CD1 3.75Å; Q64-I74 HydrophobicContact CG-CG1 4.37Å; I74-P233 HydrophobicContact CB-CG 4.5Å; I74-P233 HydrophobicContact CG2-CB 3.27Å; I74-P233 HydrophobicContact CG2-CG 3.02Å; I74-L273 HydrophobicContact CD1-CD1 4.48Å; I74-L273 HydrophobicContact CG2-CD2 4.16Å; I74-L277 HydrophobicContact CD1-CD1 4.25Å; I74-L277 HydrophobicContact CG1-CD1 4.42Å
75	V	92.1	Very high	89.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	120.9	-177	-174	0	0	0	0	110.9	G37 A39 F55 G77 F79 I82 P233	G37-V75 WeakPolarHBondContact O-CB 3.35Å; G37-V75 PolarHBondContact O-N 3.01Å; A39-V75 HydrophobicContact CB-CG2 4.18Å; F55-V75 HydrophobicContact CE2-CG1 4.38Å; F55-V75 HydrophobicContact CE2-CG2 4.01Å; F55-V75 HydrophobicContact CZ-CG2 3.97Å; V75-G77 VanDerWaalsContact C-N 3.33Å; V75-G77 PolarHBondContact O-N 3.43Å; V75-F79 HydrophobicContact CB-CB 4.16Å; V75-F79 HydrophobicContact CG1-CB 3.94Å; V75-F79 HydrophobicContact CG2-CB 4.37Å; V75-I82 HydrophobicContact CG1-CD1 3.7Å; V75-I82 HydrophobicContact CG2-CD1 3.99Å; V75-P233 WeakPolarHBondContact O-CG 3.5Å
76	L	87.6	Confident	90.1	Very high	5 Å²	5	64 Å²	64	3%	0.026	34%	0.336	C	S	.	.	S	Bend	trans	-95.2	41.1	-177.5	-57.3	177	0	0	0	111.9	L52 Y60 M62 M95 L111 P233 L234 I237	L52-L76 HydrophobicContact CD1-CD1 3.91Å; Y60-L76 WeakPolarHBondContact O-CA 3.39Å; Y60-L76 PolarHBondContact O-N 3.23Å; M62-L76 HydrophobicContact CB-CD1 4.24Å; L76-M95 HydrophobicContact CD1-CE 4.03Å; L76-M95 HydrophobicContact CD1-SD 3.95Å; L76-L111 HydrophobicContact CB-CD2 4.34Å; L76-L111 HydrophobicContact CD1-CD2 3.98Å; L76-P233 HydrophobicContact CD2-CB 3.55Å; L76-L234 HydrophobicContact CB-CD2 4.03Å; L76-L234 HydrophobicContact CD2-CD2 4.29Å; L76-I237 HydrophobicContact CD2-CD1 4.02Å
77	G	85.2	Confident	90.3	Very high	17 Å²	17	65.7 Å²	65.7	18%	0.175	34%	0.339	C	S	.	.	S	Bend	trans	177.8	-152.5	-173.8	0	0	0	0	0	113.5	V75 F79	V75-G77 VanDerWaalsContact C-N 3.33Å; V75-G77 PolarHBondContact O-N 3.43Å; G77-F79 PolarHBondContact O-N 3.35Å
78	E	84.9	Confident	90.5	Very high	149 Å²	149	61.3 Å²	61.3	70%	0.696	32%	0.319	S	S	*	.			trans	-72.6	98.6	-178.9	-66.5	-175.7	177.7	0	0	111	N57 S59 S81	N57-E78 PolarHBondContact ND2-O 3.35Å; S59-E78 PolarHBondContact OG-O 2.72Å; E78-S81 PolarHBondContact O-OG 3.24Å
79	F	88.1	Confident	90.9	Very high	66 Å²	66	59.3 Å²	59.3	29%	0.289	30%	0.296	S	S	.	.			trans	-80.2	-18.6	179	63	-92.8	0	0	0	113.5	V75 G77 S81 I82 P231	V75-F79 HydrophobicContact CB-CB 4.16Å; V75-F79 HydrophobicContact CG1-CB 3.94Å; V75-F79 HydrophobicContact CG2-CB 4.37Å; G77-F79 PolarHBondContact O-N 3.35Å; F79-S81 PolarHBondContact O-N 2.7Å; F79-I82 PolarHBondContact O-N 2.74Å; F79-P231 HydrophobicContact CD1-CB 4.38Å; F79-P231 HydrophobicContact CE1-CB 4.35Å
80	E	87.7	Confident	91.1	Very high	175 Å²	175	56.5 Å²	56.5	82%	0.818	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.9	-177.5	-63	-175.4	172.4	0	0	113.6
81	S	90.6	Very high	91	Very high	54 Å²	54	57.3 Å²	57.3	38%	0.378	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.8	179.8	55.6	0	0	0	0	113.7	N57 E78 F79	N57-S81 PolarHBondContact ND2-OG 3.28Å; E78-S81 PolarHBondContact O-OG 3.24Å; F79-S81 PolarHBondContact O-N 2.7Å
82	I	92.2	Very high	90.8	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.036	30%	0.302	C	S	.	.			trans	-82	135.5	176.9	-57.3	173.6	0	0	0	109.1	V31 V34 F55 N57 V75 F79	V31-I82 HydrophobicContact CG1-CG2 4.32Å; V31-I82 HydrophobicContact CG2-CG2 4.31Å; V34-I82 HydrophobicContact CB-CG2 4.41Å; V34-I82 HydrophobicContact CG2-CB 4.17Å; V34-I82 HydrophobicContact CG2-CG2 4.18Å; F55-I82 HydrophobicContact CB-CD1 4.24Å; F55-I82 HydrophobicContact CB-CG1 4.48Å; F55-I82 HydrophobicContact CD1-CD1 3.78Å; F55-I82 HydrophobicContact CD1-CG1 4.33Å; F55-I82 HydrophobicContact CD1-CG2 4.03Å; F55-I82 HydrophobicContact CD2-CD1 3.86Å; F55-I82 HydrophobicContact CE1-CD1 4.02Å; F55-I82 HydrophobicContact CE1-CG2 4.22Å; F55-I82 HydrophobicContact CE2-CD1 4.09Å; F55-I82 HydrophobicContact CG-CD1 3.7Å; F55-I82 HydrophobicContact CG-CG1 4.35Å; F55-I82 HydrophobicContact CZ-CD1 4.17Å; N57-I82 WeakPolarHBondContact ND2-CG1 3.13Å; V75-I82 HydrophobicContact CG1-CD1 3.7Å; V75-I82 HydrophobicContact CG2-CD1 3.99Å; F79-I82 PolarHBondContact O-N 2.74Å
83	R	93.4	Very high	90.5	Very high	184 Å²	184	65 Å²	65	69%	0.694	33%	0.327	S	S	*	.			trans	-124.2	157.7	178.6	-61.2	-177.2	-179.1	-175.5	0.6	111.7	G85 D86	R83-G85 PolarHBondContact O-N 3.44Å; R83-D86 PolarHBondContact N-OD2 3.04Å; R83-D86 VanDerWaalsContact O-CB 3.25Å; R83-D86 WeakPolarHBondContact O-CB 3.37Å; R83-D86 PolarHBondContact O-N 3.4Å; R83-D86 VanDerWaalsContact O-N 3.13Å
84	E	93.5	Very high	90.3	Very high	150 Å²	150	67.7 Å²	67.7	70%	0.701	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	135.3	166.6	-171.4	-176.7	166.5	0	0	109.9
85	G	92.8	Very high	90.2	Very high	46 Å²	46	67.7 Å²	67.7	47%	0.474	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	-10.5	-173.9	0	0	0	0	0	114.7	V31 R83	V31-G85 PolarHBondContact O-N 3.17Å; R83-G85 PolarHBondContact O-N 3.44Å
86	D	94.2	Very high	90.1	Very high	41 Å²	41	71 Å²	71	22%	0.219	36%	0.356	C	S	.	.			trans	-64.5	153.9	175.8	-77.5	-11.1	0	0	0	111.6	T30 V31 R83	T30-D86 WeakPolarHBondContact CA-O 3.29Å; V31-D86 HydrophobicContact CG2-CB 4.28Å; V31-D86 WeakPolarHBondContact CG2-O 3.45Å; V31-D86 PolarHBondContact N-O 3.32Å; R83-D86 PolarHBondContact N-OD2 3.04Å; R83-D86 VanDerWaalsContact O-CB 3.25Å; R83-D86 WeakPolarHBondContact O-CB 3.37Å; R83-D86 PolarHBondContact O-N 3.4Å; R83-D86 VanDerWaalsContact O-N 3.13Å
87	K	93.7	Very high	90.5	Very high	123 Å²	123	70.7 Å²	70.7	54%	0.535	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	138.2	179	-69.3	-179.7	178.8	-177.2	0	110	I28 G29 S56	I28-K87 HydrophobicContact CG2-CB 3.89Å; I28-K87 HydrophobicContact CG2-CD 4.11Å; I28-K87 HydrophobicContact CG2-CG 3.92Å; G29-K87 WeakPolarHBondContact O-CA 3.43Å; S56-K87 PolarHBondContact N-O 2.88Å
88	V	93.8	Very high	91	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137.5	168.8	57.7	0	0	0	0	109.2	I28 G29 A41 L44 L53 E54 F55 I73	I28-V88 CarbonylContact C-O 3.56Å; I28-V88 WeakPolarHBondContact CA-O 3.3Å; G29-V88 PolarHBondContact N-O 3.33Å; G29-V88 PolarHBondContact O-N 3.47Å; A41-V88 HydrophobicContact CB-CG1 3.51Å; L44-V88 HydrophobicContact CD1-CG1 3.86Å; L44-V88 HydrophobicContact CD2-CG1 4.37Å; L44-V88 HydrophobicContact CG-CG1 4.38Å; L53-V88 HydrophobicContact CB-CG2 3.76Å; L53-V88 HydrophobicContact CD1-CG2 4.18Å; L53-V88 HydrophobicContact CG-CG2 4.49Å; E54-V88 CarbonylContact O-C 3.56Å; E54-V88 WeakPolarHBondContact O-CA 3.1Å; F55-V88 HydrophobicContact CD1-CB 4.15Å; F55-V88 HydrophobicContact CD1-CG2 4.3Å; F55-V88 HydrophobicContact CE1-CB 4.26Å; F55-V88 HydrophobicContact CE1-CG2 4.27Å; I73-V88 HydrophobicContact CD1-CG1 4.26Å; I73-V88 HydrophobicContact CD1-CG2 4.09Å
89	K	93.3	Very high	91.6	Very high	74 Å²	74	64.1 Å²	64.1	32%	0.322	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	145.7	-176.2	-65.5	176.9	169.5	-157.7	0	110.5	E26 I28 L53 E54	E26-K89 VanDerWaalsContact OE2-CD 3.26Å; E26-K89 WeakPolarHBondContact OE2-CD 3.47Å; E26-K89 WeakPolarHBondContact OE2-CE 3.29Å; E26-K89 IonicContact OE2-NZ 3.25Å; E26-K89 PolarHBondContact OE2-NZ 3.38Å; I28-K89 HydrophobicContact CG1-CG 4.35Å; L53-K89 CarbonylContact C-O 3.54Å; L53-K89 WeakPolarHBondContact CA-O 3.39Å; E54-K89 PolarHBondContact N-O 2.9Å; E54-K89 PolarHBondContact O-N 3.49Å
90	R	92.5	Very high	91.9	Very high	56 Å²	56	61.8 Å²	61.8	21%	0.211	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	135.2	169.5	-67.3	-170.2	56.7	-138.3	0	110.5	E27 L44 N46 E51 L53	E27-R90 HydrophobicContact CB-CG 4.49Å; E27-R90 PolarHBondContact O-N 2.69Å; E27-R90 WeakPolarHBondContact OE2-CD 3.25Å; E27-R90 IonicContact OE2-CZ 3.5Å; E27-R90 IonicContact OE2-NE 2.69Å; E27-R90 IonicContact OE2-NH1 3.96Å; E27-R90 PolarHBondContact OE2-NH1 3.49Å; L44-R90 HydrophobicContact CD2-CG 3.47Å; L44-R90 VanDerWaalsContact CD2-CG 3.47Å; N46-R90 VanDerWaalsContact CB-NH1 3.27Å; N46-R90 PolarHBondContact O-NH1 2.96Å; N46-R90 PolarHBondContact O-NH2 2.9Å; E51-R90 VanDerWaalsContact OE1-CB 3.31Å; E51-R90 WeakPolarHBondContact OE1-CB 3.36Å; E51-R90 IonicContact OE1-CZ 3.52Å; E51-R90 IonicContact OE1-NE 3.89Å; E51-R90 PolarHBondContact OE1-NE 2.97Å; E51-R90 VanDerWaalsContact OE1-NE 3.11Å; E51-R90 IonicContact OE1-NH2 2.65Å; E51-R90 PolarHBondContact OE1-NH2 3.19Å; E51-R90 IonicContact OE2-CZ 2.78Å; E51-R90 IonicContact OE2-NE 3.11Å; E51-R90 PolarHBondContact OE2-NE 2.66Å; E51-R90 VanDerWaalsContact OE2-NE 3.08Å; E51-R90 IonicContact OE2-NH2 3.98Å; E51-R90 PolarHBondContact OE2-NH2 3.13Å; L53-R90 HydrophobicContact CD2-CB 4.45Å; L53-R90 HydrophobicContact CD2-CG 4.01Å
91	T	88.1	Confident	92.3	Very high	44 Å²	44	60.3 Å²	60.3	27%	0.27	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-16.2	171.3	68.6	0	0	0	0	112.1	L52 E54 K93	L52-T91 HydrophobicContact CB-CG2 4.34Å; L52-T91 HydrophobicContact CD2-CG2 4.41Å; L52-T91 HydrophobicContact CG-CG2 4.33Å; L52-T91 WeakPolarHBondContact O-CB 3.44Å; L52-T91 VanDerWaalsContact O-CG2 3.22Å; L52-T91 WeakPolarHBondContact O-CG2 3.41Å; L52-T91 PolarHBondContact O-N 3.38Å; L52-T91 PolarHBondContact O-OG1 2.78Å; E54-T91 HydrophobicContact CB-CG2 4.43Å; T91-K93 PolarHBondContact O-N 3.13Å; T91-K93 PolarHBondContact OG1-N 3.4Å
92	G	87.2	Confident	92.6	Very high	45 Å²	45	62.4 Å²	62.4	46%	0.464	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	71.8	3.9	-174	0	0	0	0	0	113.9	E51	E51-G92 WeakPolarHBondContact OE1-CA 3.31Å; E51-G92 PolarHBondContact OE1-N 3.48Å
93	K	85.2	Confident	92.8	Very high	127 Å²	127	62 Å²	62	55%	0.552	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	136	-178.5	-61.9	-177.3	-178.4	-176.8	0	110	E51 L52 T91	E51-K93 VanDerWaalsContact CG-O 3.31Å; E51-K93 WeakPolarHBondContact CG-O 3.35Å; L52-K93 PolarHBondContact N-O 3.2Å; T91-K93 PolarHBondContact O-N 3.13Å; T91-K93 PolarHBondContact OG1-N 3.4Å
94	I	89.2	Confident	93	Very high	56 Å²	56	55.4 Å²	55.4	29%	0.287	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	150.8	161.9	-59.6	-57.9	0	0	0	107.5	M48 E96	M48-I94 HydrophobicContact CB-CD1 3.95Å; M48-I94 HydrophobicContact CE-CD1 4.06Å; M48-I94 HydrophobicContact SD-CD1 4.27Å; I94-E96 WeakPolarHBondContact O-CG 3.47Å; I94-E96 PolarHBondContact O-N 3.38Å
95	M	88.2	Confident	93.2	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.015	27%	0.269	C	S	.	.	S	Bend	trans	-53.5	116.2	179.1	-176.1	175.8	173.5	0	0	111	G50 L52 M62 L76 L111 P128 V129 I237	G50-M95 PolarHBondContact O-N 3.26Å; L52-M95 HydrophobicContact CD1-CG 4.46Å; M62-M95 HydrophobicContact SD-CB 4.43Å; M62-M95 HydrophobicContact SD-SD 3.88Å; L76-M95 HydrophobicContact CD1-CE 4.03Å; L76-M95 HydrophobicContact CD1-SD 3.95Å; M95-L111 HydrophobicContact CE-CD2 3.91Å; M95-P128 WeakPolarHBondContact O-CA 3.42Å; M95-V129 HydrophobicContact CB-CG2 3.78Å; M95-V129 HydrophobicContact CE-CG1 4.06Å; M95-V129 HydrophobicContact CE-CG2 4.26Å; M95-V129 HydrophobicContact CG-CG1 4.1Å; M95-V129 HydrophobicContact CG-CG2 3.58Å; M95-V129 WeakPolarHBondContact O-CG2 3.42Å; M95-V129 PolarHBondContact O-N 3.47Å; M95-V129 HydrophobicContact SD-CG2 3.73Å; M95-I237 HydrophobicContact CE-CB 4.04Å; M95-I237 HydrophobicContact CE-CD1 3.14Å; M95-I237 HydrophobicContact CE-CG1 4.13Å; M95-I237 HydrophobicContact CE-CG2 4.04Å; M95-I237 HydrophobicContact SD-CD1 4.39Å; M95-I237 HydrophobicContact SD-CG2 4.08Å
96	E	91.6	Very high	93.4	Very high	68 Å²	68	48.3 Å²	48.3	32%	0.318	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	152.3	-176.6	-81	173.8	-163.2	0	0	109.9	I94 T126 R127 P128	I94-E96 WeakPolarHBondContact O-CG 3.47Å; I94-E96 PolarHBondContact O-N 3.38Å; E96-T126 WeakPolarHBondContact OE2-CB 3.47Å; E96-T126 PolarHBondContact OE2-OG1 2.89Å; E96-R127 CarbonylContact C-O 3.51Å; E96-R127 VanDerWaalsContact CA-O 3.24Å; E96-R127 WeakPolarHBondContact CA-O 3.46Å; E96-P128 HydrophobicContact CG-CB 4.46Å
97	V	94.5	Very high	93.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.7	172.9	-71.2	0	0	0	0	110.4	V99 P110 T126 R127 V129 A241 A244 M245	V97-V99 HydrophobicContact CG2-CG1 4.38Å; V97-P110 VanDerWaalsContact CG1-O 3.28Å; V97-P110 WeakPolarHBondContact CG1-O 3.44Å; V97-T126 CarbonylContact O-C 3.56Å; V97-T126 VanDerWaalsContact O-CA 3.24Å; V97-T126 WeakPolarHBondContact O-CA 3.2Å; V97-R127 PolarHBondContact N-O 3.46Å; V97-R127 PolarHBondContact O-N 3.36Å; V97-V129 HydrophobicContact CB-CG1 4.34Å; V97-V129 HydrophobicContact CG1-CG1 3.51Å; V97-V129 HydrophobicContact CG2-CG1 4.08Å; V97-A241 HydrophobicContact CG1-CB 3.98Å; V97-A244 HydrophobicContact CG2-CB 3.66Å; V97-M245 HydrophobicContact CB-CE 4.39Å
98	P	96.1	Very high	93.8	Very high	27 Å²	27	41.2 Å²	41.2	18%	0.175	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	139.7	170.8	26.6	-33.6	0	0	0	110.5	L111 T123	P98-L111 WeakPolarHBondContact CD-O 3.08Å; P98-T123 HydrophobicContact CB-CG2 4.19Å; P98-T123 WeakPolarHBondContact CB-OG1 3.43Å
99	V	97.1	Very high	93.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	158	179.8	-60.8	0	0	0	0	111	V97 T123 N125 R127 M245 E248	V97-V99 HydrophobicContact CG2-CG1 4.38Å; V99-T123 WeakPolarHBondContact O-CB 3.5Å; V99-T123 WeakPolarHBondContact O-CG2 3.03Å; V99-N125 HydrophobicContact CG2-CB 3.89Å; V99-N125 PolarHBondContact N-O 2.9Å; V99-R127 HydrophobicContact CG1-CB 4.07Å; V99-R127 HydrophobicContact CG1-CG 4.09Å; V99-R127 HydrophobicContact CG2-CG 3.87Å; V99-M245 HydrophobicContact CG1-CG 4.31Å; V99-E248 HydrophobicContact CB-CB 3.82Å; V99-E248 HydrophobicContact CB-CG 3.92Å; V99-E248 HydrophobicContact CG1-CB 4.35Å; V99-E248 HydrophobicContact CG2-CB 3.88Å; V99-E248 HydrophobicContact CG2-CG 3.61Å
100	G	95.2	Very high	93.9	Very high	16 Å²	16	38.9 Å²	38.9	17%	0.165	21%	0.211	C	C	.	.	S	Bend	trans	140.3	174.5	174.8	0	0	0	0	0	113	N102 M103 F249	G100-N102 PolarHBondContact O-N 3.47Å; G100-M103 VanDerWaalsContact O-CB 3.32Å; G100-M103 WeakPolarHBondContact O-CB 3.44Å; G100-M103 WeakPolarHBondContact O-CG 3.49Å; G100-M103 PolarHBondContact O-N 3.27Å; G100-M103 VanDerWaalsContact O-N 3.11Å; G100-F249 WeakPolarHBondContact O-CZ 3.3Å
101	E	96	Very high	93.9	Very high	145 Å²	145	37.5 Å²	37.5	68%	0.678	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-60.1	-31.3	-176.2	-65.5	-175	172.6	0	0	113.1	M103 I104 F249	E101-M103 PolarHBondContact O-N 3.32Å; E101-M103 VanDerWaalsContact O-N 3.07Å; E101-I104 VanDerWaalsContact O-CB 3.23Å; E101-I104 WeakPolarHBondContact O-CB 3.5Å; E101-I104 VanDerWaalsContact O-CG1 3.32Å; E101-I104 WeakPolarHBondContact O-CG1 3.48Å; E101-I104 PolarHBondContact O-N 3.03Å; E101-F249 HydrophobicContact CG-CE1 4.11Å
102	N	96.1	Very high	94.2	Very high	97 Å²	97	35.6 Å²	35.6	52%	0.519	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-66	-11.4	179.2	-69.5	-19.6	0	0	0	113.9	G100 I104 R106 I121 E122	G100-N102 PolarHBondContact O-N 3.47Å; N102-I104 VanDerWaalsContact C-N 3.32Å; N102-R106 WeakPolarHBondContact O-CG 3.28Å; N102-I121 HydrophobicContact CB-CG2 3.96Å; N102-I121 WeakPolarHBondContact O-CG2 3.27Å; N102-E122 WeakPolarHBondContact CB-O 3.5Å; N102-E122 PolarHBondContact ND2-O 3.18Å
103	M	96.9	Very high	94.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-75.3	-23	171.4	-60.5	-71.9	-75.6	0	0	112.1	G100 E101 G105 R106 V108 I121 T123 I222 M245	G100-M103 VanDerWaalsContact O-CB 3.32Å; G100-M103 WeakPolarHBondContact O-CB 3.44Å; G100-M103 WeakPolarHBondContact O-CG 3.49Å; G100-M103 PolarHBondContact O-N 3.27Å; G100-M103 VanDerWaalsContact O-N 3.11Å; E101-M103 PolarHBondContact O-N 3.32Å; E101-M103 VanDerWaalsContact O-N 3.07Å; M103-G105 PolarHBondContact O-N 3.43Å; M103-R106 VanDerWaalsContact O-CB 3.26Å; M103-R106 WeakPolarHBondContact O-CB 3.45Å; M103-R106 WeakPolarHBondContact O-CG 2.98Å; M103-R106 PolarHBondContact O-N 3.46Å; M103-R106 VanDerWaalsContact O-N 3.14Å; M103-V108 HydrophobicContact CE-CB 4.32Å; M103-V108 HydrophobicContact CE-CG1 3.81Å; M103-V108 HydrophobicContact CE-CG2 3.97Å; M103-V108 HydrophobicContact SD-CG1 4.43Å; M103-I121 HydrophobicContact CG-CG2 4.46Å; M103-I121 HydrophobicContact SD-CB 4.37Å; M103-I121 HydrophobicContact SD-CD1 3.72Å; M103-I121 HydrophobicContact SD-CG2 3.79Å; M103-T123 HydrophobicContact CG-CG2 4.06Å; M103-T123 HydrophobicContact SD-CG2 4.05Å; M103-I222 HydrophobicContact CB-CD1 3.69Å; M103-I222 HydrophobicContact CB-CG1 4.22Å; M103-I222 HydrophobicContact CB-CG2 4.48Å; M103-M245 HydrophobicContact CE-CE 3.46Å; M103-M245 VanDerWaalsContact CE-CE 3.46Å; M103-M245 HydrophobicContact CE-CG 4.27Å; M103-M245 HydrophobicContact CE-SD 3.62Å
104	I	97.4	Very high	95	Very high	44 Å²	44	34 Å²	34	23%	0.226	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	133.8	-179.5	-61.5	173.8	0	0	0	109.6	E101 N102 R106 I192 D219 I222 F249	E101-I104 VanDerWaalsContact O-CB 3.23Å; E101-I104 WeakPolarHBondContact O-CB 3.5Å; E101-I104 VanDerWaalsContact O-CG1 3.32Å; E101-I104 WeakPolarHBondContact O-CG1 3.48Å; E101-I104 PolarHBondContact O-N 3.03Å; N102-I104 VanDerWaalsContact C-N 3.32Å; I104-R106 VanDerWaalsContact C-N 3.26Å; I104-R106 PolarHBondContact O-N 3.35Å; I104-I192 HydrophobicContact CD1-CD1 4.19Å; I104-I192 HydrophobicContact CD1-CG1 4.45Å; I104-I192 HydrophobicContact CD1-CG2 4.49Å; I104-D219 WeakPolarHBondContact CG2-O 3.48Å; I104-I222 HydrophobicContact CG1-CD1 4.43Å; I104-I222 HydrophobicContact CG1-CG1 4.29Å; I104-F249 HydrophobicContact CD1-CE1 4.1Å; I104-F249 HydrophobicContact CD1-CZ 4.08Å; I104-F249 HydrophobicContact CG1-CZ 4.05Å
105	G	97.3	Very high	95.3	Very high	21 Å²	21	34.9 Å²	34.9	22%	0.216	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	-1.8	-176.6	0	0	0	0	0	114.6	M103 M218 T221	M103-G105 PolarHBondContact O-N 3.43Å; G105-M218 WeakPolarHBondContact CA-O 3.31Å; G105-M218 PolarHBondContact N-O 3.25Å; G105-M218 VanDerWaalsContact O-CE 3.31Å; G105-M218 WeakPolarHBondContact O-CE 3.38Å; G105-T221 WeakPolarHBondContact CA-O 3.49Å; G105-T221 PolarHBondContact N-O 3.37Å
106	R	98	Very high	95.6	Very high	27 Å²	27	36.6 Å²	36.6	10%	0.102	20%	0.201	C	C	.	.			trans	-100.1	153.8	-176.9	-51.6	-57.2	-57.7	-89.8	-7.1	112.3	N102 M103 I104 V108 P114 D116 G119 P120 I121 V223	N102-R106 WeakPolarHBondContact O-CG 3.28Å; M103-R106 VanDerWaalsContact O-CB 3.26Å; M103-R106 WeakPolarHBondContact O-CB 3.45Å; M103-R106 WeakPolarHBondContact O-CG 2.98Å; M103-R106 PolarHBondContact O-N 3.46Å; M103-R106 VanDerWaalsContact O-N 3.14Å; I104-R106 VanDerWaalsContact C-N 3.26Å; I104-R106 PolarHBondContact O-N 3.35Å; R106-V108 HydrophobicContact CB-CG1 4.23Å; R106-P114 VanDerWaalsContact NH2-CB 3.32Å; R106-D116 WeakPolarHBondContact CA-OD2 3.43Å; R106-D116 IonicContact CZ-OD1 3.23Å; R106-D116 IonicContact CZ-OD2 3.97Å; R106-D116 IonicContact NE-OD1 2.68Å; R106-D116 IonicContact NE-OD2 3.91Å; R106-D116 PolarHBondContact NE-OD2 2.96Å; R106-D116 IonicContact NH2-OD1 3.73Å; R106-D116 PolarHBondContact NH2-OD1 2.83Å; R106-D116 IonicContact NH2-OD2 3.88Å; R106-D116 PolarHBondContact NH2-OD2 3.13Å; R106-G119 PolarHBondContact NH2-O 3.12Å; R106-P120 PolarHBondContact NH1-O 2.87Å; R106-I121 HydrophobicContact CB-CD1 3.85Å; R106-I121 HydrophobicContact CG-CD1 3.92Å; R106-I121 HydrophobicContact CG-CG1 4.17Å; R106-V223 PolarHBondContact O-N 3.26Å
107	V	98.1	Very high	95.7	Very high	14 Å²	14	37 Å²	37	9%	0.085	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.8	165.3	-167.9	0	0	0	0	108	V115 D116 V209 V223 T225	V107-V115 HydrophobicContact CB-CG2 4.1Å; V107-V115 HydrophobicContact CG1-CG2 3.63Å; V107-V115 WeakPolarHBondContact O-CG2 3.36Å; V107-V115 PolarHBondContact O-N 2.95Å; V107-D116 HydrophobicContact CB-CB 3.94Å; V107-D116 HydrophobicContact CG2-CB 4.08Å; V107-D116 PolarHBondContact N-OD2 3.23Å; V107-V209 HydrophobicContact CG2-CG1 4.14Å; V107-V209 HydrophobicContact CG2-CG2 3.97Å; V107-V223 CarbonylContact C-O 3.46Å; V107-V223 WeakPolarHBondContact CA-O 3.35Å; V107-V223 HydrophobicContact CB-CB 4.44Å; V107-V223 HydrophobicContact CG1-CB 4.12Å; V107-V223 HydrophobicContact CG1-CG1 3.93Å; V107-V223 HydrophobicContact CG2-CB 4.19Å; V107-T225 HydrophobicContact CG1-CG2 3.87Å
108	V	97.7	Very high	95.6	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153	-174.9	-61.1	0	0	0	0	111.9	M103 R106 Q113 I121 I222 V223 V224 T225 M245	M103-V108 HydrophobicContact CE-CB 4.32Å; M103-V108 HydrophobicContact CE-CG1 3.81Å; M103-V108 HydrophobicContact CE-CG2 3.97Å; M103-V108 HydrophobicContact SD-CG1 4.43Å; R106-V108 HydrophobicContact CB-CG1 4.23Å; V108-Q113 CarbonylContact C-O 3.55Å; V108-Q113 VanDerWaalsContact CA-O 3.24Å; V108-Q113 WeakPolarHBondContact CA-O 3.39Å; V108-I121 HydrophobicContact CG1-CD1 3.32Å; V108-I222 HydrophobicContact CG2-CG2 4.29Å; V108-V223 PolarHBondContact N-O 3.38Å; V108-V224 HydrophobicContact CG2-CB 4.49Å; V108-V224 HydrophobicContact CG2-CG2 3.94Å; V108-V224 CarbonylContact O-C 3.58Å; V108-V224 WeakPolarHBondContact O-CA 3.42Å; V108-T225 PolarHBondContact O-N 3.29Å; V108-M245 HydrophobicContact CG2-CE 3.86Å; V108-M245 HydrophobicContact CG2-SD 4.1Å
109	N	95.1	Very high	95.5	Very high	24 Å²	24	43.4 Å²	43.4	13%	0.128	26%	0.262	C	S	.	.			trans	-78.8	174.2	166.3	75.2	8.3	0	0	0	110.6	L111 G112 Q113 V115	N109-L111 PolarHBondContact O-N 2.95Å; N109-L111 VanDerWaalsContact O-N 3.13Å; N109-L111 WeakPolarHBondContact OD1-CA 3.47Å; N109-L111 WeakPolarHBondContact OD1-CB 3.41Å; N109-L111 PolarHBondContact OD1-N 3.5Å; N109-G112 PolarHBondContact O-N 3.38Å; N109-G112 PolarHBondContact OD1-N 3.46Å; N109-Q113 PolarHBondContact N-O 3.43Å; N109-Q113 PolarHBondContact ND2-OE1 3.09Å; N109-Q113 WeakPolarHBondContact OD1-CB 3.38Å; N109-Q113 PolarHBondContact OD1-N 3.34Å; N109-V115 HydrophobicContact CB-CG1 3.95Å
110	P	95.1	Very high	95.3	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.3	-179.4	-25.6	39	0	0	0	115.4	V97 G112 T225 A226 L234 I237 A238 A241	V97-P110 VanDerWaalsContact CG1-O 3.28Å; V97-P110 WeakPolarHBondContact CG1-O 3.44Å; P110-G112 VanDerWaalsContact C-N 3.29Å; P110-T225 WeakPolarHBondContact CD-O 3.36Å; P110-A226 HydrophobicContact CG-CB 3.82Å; P110-L234 HydrophobicContact CG-CB 4.2Å; P110-L234 WeakPolarHBondContact CG-O 3.14Å; P110-I237 HydrophobicContact CB-CD1 3.53Å; P110-I237 HydrophobicContact CB-CG1 3.58Å; P110-I237 HydrophobicContact CG-CG1 4.41Å; P110-A238 HydrophobicContact CB-CB 4.23Å; P110-A238 HydrophobicContact CG-CB 3.73Å; P110-A241 HydrophobicContact CB-CB 4.33Å; P110-A241 VanDerWaalsContact O-CB 3.22Å; P110-A241 WeakPolarHBondContact O-CB 3.3Å
111	L	92.5	Very high	95.2	Very high	27 Å²	27	48.8 Å²	48.8	14%	0.141	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	0.4	171.5	-54.8	178.9	0	0	0	111.9	Y60 L76 M95 P98 N109 Q113 L234 I237	Y60-L111 HydrophobicContact CD2-CD1 4.24Å; L76-L111 HydrophobicContact CB-CD2 4.34Å; L76-L111 HydrophobicContact CD1-CD2 3.98Å; M95-L111 HydrophobicContact CE-CD2 3.91Å; P98-L111 WeakPolarHBondContact CD-O 3.08Å; N109-L111 PolarHBondContact O-N 2.95Å; N109-L111 VanDerWaalsContact O-N 3.13Å; N109-L111 WeakPolarHBondContact OD1-CA 3.47Å; N109-L111 WeakPolarHBondContact OD1-CB 3.41Å; N109-L111 PolarHBondContact OD1-N 3.5Å; L111-Q113 VanDerWaalsContact C-N 3.32Å; L111-Q113 HydrophobicContact CB-CG 4.27Å; L111-L234 HydrophobicContact CG-CD2 4.4Å; L111-I237 HydrophobicContact CD2-CD1 4.09Å
112	G	94.1	Very high	95	Very high	5 Å²	5	49.3 Å²	49.3	5%	0.052	30%	0.295	C	S	.	.	S	Bend	trans	76.7	13.8	-177.3	0	0	0	0	0	114.5	N109 P110	N109-G112 PolarHBondContact O-N 3.38Å; N109-G112 PolarHBondContact OD1-N 3.46Å; P110-G112 VanDerWaalsContact C-N 3.29Å
113	Q	93.3	Very high	94.9	Very high	89 Å²	89	46.8 Å²	46.8	42%	0.416	28%	0.283	S	S	.	.			trans	-82.7	139.2	175.8	-56.6	167.3	-20.9	0	0	110	V108 N109 L111	V108-Q113 CarbonylContact C-O 3.55Å; V108-Q113 VanDerWaalsContact CA-O 3.24Å; V108-Q113 WeakPolarHBondContact CA-O 3.39Å; N109-Q113 PolarHBondContact N-O 3.43Å; N109-Q113 PolarHBondContact ND2-OE1 3.09Å; N109-Q113 WeakPolarHBondContact OD1-CB 3.38Å; N109-Q113 PolarHBondContact OD1-N 3.34Å; L111-Q113 VanDerWaalsContact C-N 3.32Å; L111-Q113 HydrophobicContact CB-CG 4.27Å
114	P	96.2	Very high	94.6	Very high	48 Å²	48	53.2 Å²	53.2	31%	0.312	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-69.3	133.8	-179.5	27.2	-33.1	0	0	0	112	R106 G119 I121	R106-P114 VanDerWaalsContact NH2-CB 3.32Å; P114-G119 VanDerWaalsContact CG-O 3.31Å; P114-G119 WeakPolarHBondContact CG-O 3.35Å; P114-I121 HydrophobicContact CB-CD1 4.04Å; P114-I121 HydrophobicContact CB-CG1 4.04Å; P114-I121 HydrophobicContact CG-CG1 4.25Å
115	V	94.9	Very high	94.4	Very high	75 Å²	75	54.8 Å²	54.8	46%	0.455	33%	0.331	S	S	.	.			trans	-119.5	3.1	176	-61	0	0	0	0	112.9	V107 N109 T225	V107-V115 HydrophobicContact CB-CG2 4.1Å; V107-V115 HydrophobicContact CG1-CG2 3.63Å; V107-V115 WeakPolarHBondContact O-CG2 3.36Å; V107-V115 PolarHBondContact O-N 2.95Å; N109-V115 HydrophobicContact CB-CG1 3.95Å; V115-T225 HydrophobicContact CG2-CG2 3.64Å
116	D	94.7	Very high	94.3	Very high	40 Å²	40	57.5 Å²	57.5	21%	0.214	34%	0.344	C	S	.	.	S	Bend	trans	-82.6	-10	176.3	52.6	24.5	0	0	0	114.4	R106 V107 M118	R106-D116 WeakPolarHBondContact CA-OD2 3.43Å; R106-D116 IonicContact CZ-OD1 3.23Å; R106-D116 IonicContact CZ-OD2 3.97Å; R106-D116 IonicContact NE-OD1 2.68Å; R106-D116 IonicContact NE-OD2 3.91Å; R106-D116 PolarHBondContact NE-OD2 2.96Å; R106-D116 IonicContact NH2-OD1 3.73Å; R106-D116 PolarHBondContact NH2-OD1 2.83Å; R106-D116 IonicContact NH2-OD2 3.88Å; R106-D116 PolarHBondContact NH2-OD2 3.13Å; V107-D116 HydrophobicContact CB-CB 3.94Å; V107-D116 HydrophobicContact CG2-CB 4.08Å; V107-D116 PolarHBondContact N-OD2 3.23Å; D116-M118 VanDerWaalsContact C-N 3.26Å; D116-M118 HydrophobicContact CB-CG 4.17Å; D116-M118 HydrophobicContact CB-SD 4.35Å; D116-M118 PolarHBondContact O-N 3.41Å; D116-M118 WeakPolarHBondContact OD1-CB 3Å; D116-M118 PolarHBondContact OD1-N 3.44Å
117	G	92.8	Very high	94.1	Very high	77 Å²	77	58.4 Å²	58.4	79%	0.794	35%	0.347	S	S	*	.	S	Bend	trans	72	14.6	-176.5	0	0	0	0	0	114.4	G119	G117-G119 VanDerWaalsContact C-N 3.26Å; G117-G119 PolarHBondContact O-N 2.9Å
118	M	93.2	Very high	93.9	Very high	124 Å²	124	60.1 Å²	60.1	61%	0.611	36%	0.358	S	S	*	.	S	Bend	trans	-87.6	15.4	-179.5	-62.9	178.2	61.4	0	0	113.7	D116	D116-M118 VanDerWaalsContact C-N 3.26Å; D116-M118 HydrophobicContact CB-CG 4.17Å; D116-M118 HydrophobicContact CB-SD 4.35Å; D116-M118 PolarHBondContact O-N 3.41Å; D116-M118 WeakPolarHBondContact OD1-CB 3Å; D116-M118 PolarHBondContact OD1-N 3.44Å
119	G	93.2	Very high	93.7	Very high	36 Å²	36	60.2 Å²	60.2	37%	0.371	36%	0.359	S	S	.	.			trans	91	-179.2	-176.6	0	0	0	0	0	113.5	R106 P114 G117	R106-G119 PolarHBondContact NH2-O 3.12Å; P114-G119 VanDerWaalsContact CG-O 3.31Å; P114-G119 WeakPolarHBondContact CG-O 3.35Å; G117-G119 VanDerWaalsContact C-N 3.26Å; G117-G119 PolarHBondContact O-N 2.9Å
120	P	92.7	Very high	93.4	Very high	106 Å²	106	62.7 Å²	62.7	69%	0.688	37%	0.37	S	S	*	.			trans	-62.5	162.1	178.8	26.9	-33.9	0	0	0	112.2	R106	R106-P120 PolarHBondContact NH1-O 2.87Å
121	I	94	Very high	93.2	Very high	24 Å²	24	63.8 Å²	63.8	12%	0.123	38%	0.379	C	S	.	.			trans	-108.9	113.4	170.5	-52.4	171.3	0	0	0	107.5	N102 M103 R106 V108 P114 T123	N102-I121 HydrophobicContact CB-CG2 3.96Å; N102-I121 WeakPolarHBondContact O-CG2 3.27Å; M103-I121 HydrophobicContact CG-CG2 4.46Å; M103-I121 HydrophobicContact SD-CB 4.37Å; M103-I121 HydrophobicContact SD-CD1 3.72Å; M103-I121 HydrophobicContact SD-CG2 3.79Å; R106-I121 HydrophobicContact CB-CD1 3.85Å; R106-I121 HydrophobicContact CG-CD1 3.92Å; R106-I121 HydrophobicContact CG-CG1 4.17Å; V108-I121 HydrophobicContact CG1-CD1 3.32Å; P114-I121 HydrophobicContact CB-CD1 4.04Å; P114-I121 HydrophobicContact CB-CG1 4.04Å; P114-I121 HydrophobicContact CG-CG1 4.25Å; I121-T123 HydrophobicContact CG2-CG2 3.89Å; I121-T123 PolarHBondContact O-N 2.84Å
122	E	92.3	Very high	93.3	Very high	157 Å²	157	70.7 Å²	70.7	73%	0.734	41%	0.412	S	S	*	.			trans	-80.4	106.8	176.2	-64.1	-177.7	177.8	0	0	108.9	N102	N102-E122 WeakPolarHBondContact CB-O 3.5Å; N102-E122 PolarHBondContact ND2-O 3.18Å
123	T	92.5	Very high	93.5	Very high	44 Å²	44	72.2 Å²	72.2	27%	0.27	43%	0.425	S	S	.	.			trans	-121.8	147.2	174.7	51.8	0	0	0	0	109.1	P98 V99 M103 I121	P98-T123 HydrophobicContact CB-CG2 4.19Å; P98-T123 WeakPolarHBondContact CB-OG1 3.43Å; V99-T123 WeakPolarHBondContact O-CB 3.5Å; V99-T123 WeakPolarHBondContact O-CG2 3.03Å; M103-T123 HydrophobicContact CG-CG2 4.06Å; M103-T123 HydrophobicContact SD-CG2 4.05Å; I121-T123 HydrophobicContact CG2-CG2 3.89Å; I121-T123 PolarHBondContact O-N 2.84Å
124	T	90.6	Very high	93.6	Very high	135 Å²	135	68 Å²	68	83%	0.828	41%	0.405	S	S	*	.	S	Bend	trans	-99.1	-24.6	179.5	55.6	0	0	0	0	112.6
125	N	93.7	Very high	93.6	Very high	77 Å²	77	67.3 Å²	67.3	41%	0.412	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150.9	-171.8	-62.6	-8.5	0	0	0	110.3	V99 E248	V99-N125 HydrophobicContact CG2-CB 3.89Å; V99-N125 PolarHBondContact N-O 2.9Å; N125-E248 PolarHBondContact ND2-OE1 2.85Å; N125-E248 VanDerWaalsContact ND2-OE1 3.08Å
126	T	95.1	Very high	93.6	Very high	77 Å²	77	69.5 Å²	69.5	47%	0.472	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	155.9	170.5	55.9	0	0	0	0	109.5	E96 V97	E96-T126 WeakPolarHBondContact OE2-CB 3.47Å; E96-T126 PolarHBondContact OE2-OG1 2.89Å; V97-T126 CarbonylContact O-C 3.56Å; V97-T126 VanDerWaalsContact O-CA 3.24Å; V97-T126 WeakPolarHBondContact O-CA 3.2Å
127	R	95	Very high	93.7	Very high	47 Å²	47	75.3 Å²	75.3	18%	0.177	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	144.7	169.8	-71.4	-176.7	84.5	92.6	2.5	111.5	E96 V97 V99 V129 A244 E247 E248	E96-R127 CarbonylContact C-O 3.51Å; E96-R127 VanDerWaalsContact CA-O 3.24Å; E96-R127 WeakPolarHBondContact CA-O 3.46Å; V97-R127 PolarHBondContact N-O 3.46Å; V97-R127 PolarHBondContact O-N 3.36Å; V99-R127 HydrophobicContact CG1-CB 4.07Å; V99-R127 HydrophobicContact CG1-CG 4.09Å; V99-R127 HydrophobicContact CG2-CG 3.87Å; R127-V129 PolarHBondContact O-N 2.83Å; R127-A244 HydrophobicContact CB-CB 4.25Å; R127-A244 WeakPolarHBondContact CD-O 3.08Å; R127-E247 IonicContact NE-OE2 3.64Å; R127-E247 IonicContact NH2-OE2 3.74Å; R127-E248 WeakPolarHBondContact CD-OE2 3.22Å; R127-E248 IonicContact CZ-OE2 3.54Å; R127-E248 IonicContact NH1-OE2 3.42Å; R127-E248 PolarHBondContact NH1-OE2 3.34Å
128	P	93.9	Very high	93.9	Very high	49 Å²	49	75.6 Å²	75.6	32%	0.318	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	136.3	173.6	26.5	-33.2	0	0	0	109.9	M95 E96 E130 A131	M95-P128 WeakPolarHBondContact O-CA 3.42Å; E96-P128 HydrophobicContact CG-CB 4.46Å; P128-E130 PolarHBondContact O-N 3.02Å; P128-A131 HydrophobicContact CG-CB 4.36Å
129	V	92.8	Very high	94.1	Very high	3 Å²	3	73.1 Å²	73.1	2%	0.018	41%	0.412	C	S	.	.	S	Bend	trans	-67.8	-30.4	175.9	-60.5	0	0	0	0	111.2	M95 V97 R127 R300	M95-V129 HydrophobicContact CB-CG2 3.78Å; M95-V129 HydrophobicContact CE-CG1 4.06Å; M95-V129 HydrophobicContact CE-CG2 4.26Å; M95-V129 HydrophobicContact CG-CG1 4.1Å; M95-V129 HydrophobicContact CG-CG2 3.58Å; M95-V129 WeakPolarHBondContact O-CG2 3.42Å; M95-V129 PolarHBondContact O-N 3.47Å; M95-V129 HydrophobicContact SD-CG2 3.73Å; V97-V129 HydrophobicContact CB-CG1 4.34Å; V97-V129 HydrophobicContact CG1-CG1 3.51Å; V97-V129 HydrophobicContact CG2-CG1 4.08Å; R127-V129 PolarHBondContact O-N 2.83Å; V129-R300 PolarHBondContact O-NH1 3.42Å
130	E	88.7	Confident	94.2	Very high	75 Å²	75	75.1 Å²	75.1	35%	0.35	41%	0.411	S	S	.	.	S	Bend	trans	-104	87.5	174.7	-74.5	-79.8	-164.9	0	0	108.9	P128 R296	P128-E130 PolarHBondContact O-N 3.02Å; E130-R296 IonicContact OE1-CZ 2.76Å; E130-R296 IonicContact OE1-NH1 3.23Å; E130-R296 PolarHBondContact OE1-NH1 3.26Å; E130-R296 WeakPolarHBondContact OE2-CD 3.29Å; E130-R296 IonicContact OE2-NH1 2.67Å
131	A	91.9	Very high	94.4	Very high	24 Å²	24	74.8 Å²	74.8	20%	0.198	41%	0.411	C	S	.	.			trans	-104.5	151.5	175	0	0	0	0	0	110.7	P128	P128-A131 HydrophobicContact CG-CB 4.36Å
132	M	94.5	Very high	94.6	Very high	172 Å²	172	74.9 Å²	74.9	85%	0.847	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-69.3	138.1	171.7	-67	-168.5	-63.6	0	0	110.5
133	A	96.7	Very high	94.6	Very high	37 Å²	37	70.8 Å²	70.8	31%	0.306	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-65.6	152.5	173.3	0	0	0	0	0	111.8	G135 E299 R300	A133-G135 PolarHBondContact O-N 3.36Å; A133-E299 HydrophobicContact CB-CB 4.13Å; A133-E299 WeakPolarHBondContact CB-O 3.38Å; A133-R300 HydrophobicContact CB-CG 4.02Å
134	P	96.5	Very high	94.7	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.006	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-61.8	128.7	172.6	25.6	-32.7	0	0	0	110.2	Q138 R139 M250 A302 L304	P134-Q138 HydrophobicContact CB-CB 4.09Å; P134-R139 HydrophobicContact CB-CG 4.4Å; P134-R139 HydrophobicContact CG-CG 4.5Å; P134-R139 PolarHBondContact O-NE 2.92Å; P134-R139 PolarHBondContact O-NH2 2.91Å; P134-R139 VanDerWaalsContact O-NH2 3.08Å; P134-M250 HydrophobicContact CG-CE 4.25Å; P134-A302 HydrophobicContact CG-CB 3.83Å; P134-L304 HydrophobicContact CB-CD2 3.95Å; P134-L304 HydrophobicContact CG-CD2 4.33Å
135	G	96.2	Very high	95	Very high	34 Å²	34	66.6 Å²	66.6	35%	0.351	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-68.8	170.5	178.1	0	0	0	0	0	112.8	A133 M137 Q138	A133-G135 PolarHBondContact O-N 3.36Å; G135-M137 VanDerWaalsContact C-N 3.31Å; G135-M137 PolarHBondContact O-N 2.81Å; G135-Q138 WeakPolarHBondContact O-CB 3.34Å; G135-Q138 PolarHBondContact O-N 3.48Å
136	V	95.8	Very high	95.2	Very high	120 Å²	120	63 Å²	63	73%	0.727	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-56.3	-41.3	-173.4	-175	0	0	0	0	112.9	Q138 R139	V136-Q138 VanDerWaalsContact C-N 3.28Å; V136-Q138 PolarHBondContact O-N 3.21Å; V136-R139 PolarHBondContact O-N 2.73Å
137	M	95.8	Very high	95.3	Very high	163 Å²	163	60.3 Å²	60.3	80%	0.803	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-75.1	-16.1	179.9	-59.9	-63.2	95.9	0	0	113.6	G135 R139	G135-M137 VanDerWaalsContact C-N 3.31Å; G135-M137 PolarHBondContact O-N 2.81Å; M137-R139 VanDerWaalsContact C-N 3.3Å
138	Q	96.7	Very high	95.5	Very high	83 Å²	83	58.1 Å²	58.1	39%	0.388	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-87.5	-3.1	179	-66.2	179.8	-50.9	0	0	112.2	P134 G135 V136 L304 S305 L308	P134-Q138 HydrophobicContact CB-CB 4.09Å; G135-Q138 WeakPolarHBondContact O-CB 3.34Å; G135-Q138 PolarHBondContact O-N 3.48Å; V136-Q138 VanDerWaalsContact C-N 3.28Å; V136-Q138 PolarHBondContact O-N 3.21Å; Q138-L304 CarbonylContact O-C 3.57Å; Q138-L304 WeakPolarHBondContact O-CA 3.44Å; Q138-S305 PolarHBondContact O-N 3.39Å; Q138-L308 HydrophobicContact CB-CD1 3.58Å; Q138-L308 HydrophobicContact CG-CD1 3.83Å
139	R	97.3	Very high	95.6	Very high	72 Å²	72	55.8 Å²	55.8	27%	0.272	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-102.6	156.3	-177.7	-62.4	-178.4	-171.1	-165.6	1.9	111.5	P134 V136 M137 E299 A302 K303	P134-R139 HydrophobicContact CB-CG 4.4Å; P134-R139 HydrophobicContact CG-CG 4.5Å; P134-R139 PolarHBondContact O-NE 2.92Å; P134-R139 PolarHBondContact O-NH2 2.91Å; P134-R139 VanDerWaalsContact O-NH2 3.08Å; V136-R139 PolarHBondContact O-N 2.73Å; M137-R139 VanDerWaalsContact C-N 3.3Å; R139-E299 IonicContact CZ-OE2 3.61Å; R139-E299 VanDerWaalsContact CZ-OE2 3.25Å; R139-E299 IonicContact NH1-OE2 2.71Å; R139-E299 PolarHBondContact NH1-OE2 2.83Å; R139-E299 PolarHBondContact NH2-O 2.96Å; R139-E299 IonicContact NH2-OE2 3.34Å; R139-E299 PolarHBondContact NH2-OE2 3.23Å; R139-A302 HydrophobicContact CG-CB 4.03Å; R139-K303 CarbonylContact C-O 3.54Å; R139-K303 VanDerWaalsContact CA-O 3.26Å; R139-K303 WeakPolarHBondContact CA-O 3.34Å
140	K	96	Very high	95.9	Very high	77 Å²	77	55.7 Å²	55.7	34%	0.335	31%	0.311	S	S	.	.			trans	-121.2	150.6	169.4	-177.6	168.3	176.2	169.9	0	109.5	K303 L304 D306	K140-K303 HydrophobicContact CB-CG 4.41Å; K140-K303 PolarHBondContact N-O 3.14Å; K140-L304 VanDerWaalsContact CB-O 3.32Å; K140-L304 WeakPolarHBondContact CB-O 3.41Å; K140-D306 IonicContact NZ-OD1 3.08Å; K140-D306 PolarHBondContact NZ-OD1 3.27Å; K140-D306 IonicContact NZ-OD2 2.71Å; K140-D306 PolarHBondContact NZ-OD2 2.84Å
141	S	96.9	Very high	96.3	Very high	99 Å²	99	52.2 Å²	52.2	69%	0.692	29%	0.294	S	S	*	.			trans	-58.3	140.4	175.8	-59	0	0	0	0	111.4	S143	S141-S143 PolarHBondContact O-N 3Å
142	V	97	Very high	96.4	Very high	27 Å²	27	51.2 Å²	51.2	16%	0.164	29%	0.287	C	S	.	.			trans	-75.7	107.9	175.8	179.6	0	0	0	0	109.1	G160 Q163 V366	V142-G160 VanDerWaalsContact CG1-CA 3.48Å; V142-Q163 HydrophobicContact CG1-CB 4.45Å; V142-V366 HydrophobicContact CB-CG1 4.1Å; V142-V366 HydrophobicContact CB-CG2 4.49Å; V142-V366 HydrophobicContact CG1-CG1 4Å
143	S	93.4	Very high	96.6	Very high	71 Å²	71	43 Å²	43	50%	0.497	25%	0.246	S	C	.	.			trans	-131.7	1.2	-178.6	64.2	0	0	0	0	114	S141 S369	S141-S143 PolarHBondContact O-N 3Å; S143-S369 CarbonylContact C-O 3.36Å; S143-S369 WeakPolarHBondContact CA-O 3.46Å
144	E	94.9	Very high	96.6	Very high	61 Å²	61	41.5 Å²	41.5	29%	0.285	23%	0.233	S	C	.	.	S	Bend	trans	-108.4	129.7	179.4	-71.2	163.3	-156.7	0	0	108.5	G160 R161 H255 K303	E144-G160 CarbonylContact O-C 3.58Å; E144-G160 WeakPolarHBondContact O-CA 3.27Å; E144-R161 HydrophobicContact CB-CB 4.15Å; E144-R161 HydrophobicContact CB-CG 4.09Å; E144-R161 PolarHBondContact O-N 3.27Å; E144-H255 IonicContact OE2-CE1 2.91Å; E144-H255 PolarHBondContact OE2-CE1 2.89Å; E144-H255 VanDerWaalsContact OE2-CE1 3.29Å; E144-H255 IonicContact OE2-ND1 3.39Å; E144-K303 VanDerWaalsContact CD-CE 3.48Å; E144-K303 VanDerWaalsContact OE1-CE 3.23Å; E144-K303 WeakPolarHBondContact OE1-CE 3.19Å; E144-K303 IonicContact OE1-NZ 2.66Å; E144-K303 PolarHBondContact OE1-NZ 2.88Å; E144-K303 WeakPolarHBondContact OE2-CE 3.45Å; E144-K303 IonicContact OE2-NZ 3.09Å; E144-K303 PolarHBondContact OE2-NZ 2.89Å
145	P	97	Very high	96.5	Very high	30 Å²	30	41.7 Å²	41.7	20%	0.195	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-69.6	143.7	177.7	28.6	-35.1	0	0	0	111.7	R161 A370 I372	P145-R161 PolarHBondContact O-NE 3.07Å; P145-A370 WeakPolarHBondContact CA-O 3.21Å; P145-A370 VanDerWaalsContact CB-O 3.26Å; P145-A370 WeakPolarHBondContact CB-O 3.44Å; P145-I372 HydrophobicContact CG-CG2 3.97Å
146	M	97.6	Very high	96.4	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.221	C	C	.	.			trans	-106	101.1	160.9	-170.7	-76.9	-67	0	0	106.8	T148 I159 R161 T182 M191 L257 T314 L316	M146-T148 HydrophobicContact CE-CG2 4Å; M146-T148 PolarHBondContact O-N 3.12Å; M146-T148 HydrophobicContact SD-CG2 4.48Å; M146-I159 HydrophobicContact CB-CG2 4.37Å; M146-I159 HydrophobicContact CE-CB 3.91Å; M146-I159 HydrophobicContact CE-CD1 4.04Å; M146-I159 HydrophobicContact CE-CG2 3.56Å; M146-I159 PolarHBondContact N-O 3.46Å; M146-R161 HydrophobicContact CB-CG 4.18Å; M146-T182 HydrophobicContact CE-CG2 3.84Å; M146-T182 HydrophobicContact SD-CG2 3.71Å; M146-M191 HydrophobicContact CG-CE 4.04Å; M146-L257 HydrophobicContact CE-CD1 4.06Å; M146-L257 HydrophobicContact SD-CD1 4.48Å; M146-L257 HydrophobicContact SD-CD2 4.38Å; M146-T314 HydrophobicContact CE-CG2 4.27Å; M146-T314 HydrophobicContact CG-CG2 4.42Å; M146-L316 HydrophobicContact CE-CD1 4.31Å
147	Q	97.4	Very high	96.4	Very high	21 Å²	21	35 Å²	35	10%	0.098	19%	0.187	C	C	.	.			trans	-74.3	118.3	-172.9	-63.5	-65.9	-18.6	0	0	109.7	N185 Q186	Q147-N185 PolarHBondContact O-ND2 2.9Å; Q147-Q186 PolarHBondContact O-NE2 3.36Å
148	T	97.8	Very high	96.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.151	C	C	.	.			trans	-80.2	-23	176.6	65.1	0	0	0	0	112.6	M146 L150 I153 D154 I159 T182 N185	M146-T148 HydrophobicContact CE-CG2 4Å; M146-T148 PolarHBondContact O-N 3.12Å; M146-T148 HydrophobicContact SD-CG2 4.48Å; T148-L150 PolarHBondContact O-N 3.27Å; T148-L150 PolarHBondContact OG1-N 3.07Å; T148-L150 VanDerWaalsContact OG1-N 3.16Å; T148-I153 HydrophobicContact CG2-CB 4.44Å; T148-I153 HydrophobicContact CG2-CG2 3.81Å; T148-D154 WeakPolarHBondContact CB-OD1 3.49Å; T148-D154 PolarHBondContact N-OD1 2.79Å; T148-D154 PolarHBondContact N-OD2 2.97Å; T148-D154 PolarHBondContact OG1-OD1 3.09Å; T148-D154 PolarHBondContact OG1-OD2 2.82Å; T148-I159 HydrophobicContact CG2-CD1 3.8Å; T148-T182 HydrophobicContact CG2-CG2 4.04Å; T148-N185 WeakPolarHBondContact O-CB 3.22Å
149	G	97.2	Very high	96.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	80.5	2.9	-172	0	0	0	0	0	112.4	D154 N185 Q422 P427 L428 Q433	G149-D154 WeakPolarHBondContact CA-OD2 3.3Å; G149-D154 PolarHBondContact N-OD2 3.28Å; G149-N185 WeakPolarHBondContact CA-ND2 3.36Å; G149-N185 PolarHBondContact N-ND2 2.91Å; G149-N185 VanDerWaalsContact N-ND2 3.15Å; G149-Q422 PolarHBondContact O-NE2 3.44Å; G149-P427 WeakPolarHBondContact O-CA 3.44Å; G149-L428 WeakPolarHBondContact CA-O 3.31Å; G149-L428 PolarHBondContact O-N 3.45Å; G149-Q433 VanDerWaalsContact CA-NE2 3.35Å
150	L	97.7	Very high	96.5	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	12%	0.12	C	C	.	.			trans	-107	111.9	-177.9	-62.2	173.6	0	0	0	109.5	T148 A152 I153 D154 I178 D181 P355	T148-L150 PolarHBondContact O-N 3.27Å; T148-L150 PolarHBondContact OG1-N 3.07Å; T148-L150 VanDerWaalsContact OG1-N 3.16Å; L150-A152 PolarHBondContact O-N 2.83Å; L150-I153 HydrophobicContact CB-CB 4.31Å; L150-I153 HydrophobicContact CB-CD1 4.15Å; L150-I153 HydrophobicContact CB-CG1 4.29Å; L150-I153 HydrophobicContact CD1-CD1 3.7Å; L150-I153 PolarHBondContact O-N 2.99Å; L150-D154 PolarHBondContact N-OD2 3.33Å; L150-D154 PolarHBondContact O-N 3.16Å; L150-I178 HydrophobicContact CD1-CB 4.15Å; L150-I178 HydrophobicContact CD1-CG1 4.05Å; L150-I178 HydrophobicContact CD1-CG2 3.82Å; L150-D181 HydrophobicContact CD1-CB 4.47Å; L150-D181 HydrophobicContact CD2-CB 4.32Å; L150-P355 HydrophobicContact CD1-CG 4.4Å; L150-P355 HydrophobicContact CD2-CG 4.13Å
151	K	97.1	Very high	96.6	Very high	1 Å²	1	18.1 Å²	18.1	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-49.8	-45.4	-178.2	-71.3	175.3	-68.9	-172.6	0	111.6	I153 A155 V419 L420 K421 Q422 L428 Q433 I436 E457	K151-I153 VanDerWaalsContact C-N 3.28Å; K151-I153 PolarHBondContact O-N 2.63Å; K151-A155 WeakPolarHBondContact O-CB 3.14Å; K151-A155 PolarHBondContact O-N 3.25Å; K151-A155 VanDerWaalsContact O-N 3.08Å; K151-V419 WeakPolarHBondContact CD-O 3.28Å; K151-V419 WeakPolarHBondContact CE-O 3.45Å; K151-V419 PolarHBondContact NZ-O 3.14Å; K151-L420 HydrophobicContact CB-CD2 4.15Å; K151-K421 PolarHBondContact NZ-O 2.8Å; K151-Q422 HydrophobicContact CD-CG 4.5Å; K151-Q422 VanDerWaalsContact CE-CD 3.43Å; K151-L428 HydrophobicContact CD-CD1 3.85Å; K151-L428 HydrophobicContact CG-CD1 4.14Å; K151-Q433 HydrophobicContact CG-CB 4.23Å; K151-Q433 HydrophobicContact CG-CG 3.87Å; K151-I436 HydrophobicContact CD-CG2 3.98Å; K151-E457 IonicContact NZ-OE1 3.26Å; K151-E457 PolarHBondContact NZ-OE1 3.22Å; K151-E457 IonicContact NZ-OE2 3.13Å; K151-E457 PolarHBondContact NZ-OE2 2.91Å
152	A	95.7	Very high	96.6	Very high	4 Å²	4	13.5 Å²	13.5	3%	0.033	8%	0.077	C	C	.	.	H	α-helix	trans	-61.4	-34.3	-180	0	0	0	0	0	113.1	L150 L156 V357	L150-A152 PolarHBondContact O-N 2.83Å; A152-L156 WeakPolarHBondContact O-CB 3.19Å; A152-L156 WeakPolarHBondContact O-CG 3.32Å; A152-L156 PolarHBondContact O-N 2.93Å; A152-V357 HydrophobicContact CB-CB 4.41Å; A152-V357 HydrophobicContact CB-CG2 4.36Å
153	I	96.9	Very high	96.7	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-88	-54.8	-178.3	-60.9	174	0	0	0	109.9	T148 L150 K151 A155 L156 V157 I159 I178 I342 V357	T148-I153 HydrophobicContact CG2-CB 4.44Å; T148-I153 HydrophobicContact CG2-CG2 3.81Å; L150-I153 HydrophobicContact CB-CB 4.31Å; L150-I153 HydrophobicContact CB-CD1 4.15Å; L150-I153 HydrophobicContact CB-CG1 4.29Å; L150-I153 HydrophobicContact CD1-CD1 3.7Å; L150-I153 PolarHBondContact O-N 2.99Å; K151-I153 VanDerWaalsContact C-N 3.28Å; K151-I153 PolarHBondContact O-N 2.63Å; I153-A155 PolarHBondContact O-N 2.99Å; I153-A155 VanDerWaalsContact O-N 3.13Å; I153-L156 PolarHBondContact O-N 3.26Å; I153-V157 WeakPolarHBondContact CG2-O 3.38Å; I153-V157 CarbonylContact O-C 3.49Å; I153-V157 WeakPolarHBondContact O-CA 3.38Å; I153-V157 PolarHBondContact O-N 2.82Å; I153-V157 VanDerWaalsContact O-O 3.08Å; I153-I159 HydrophobicContact CG2-CD1 3.78Å; I153-I159 HydrophobicContact CG2-CG1 4.24Å; I153-I178 HydrophobicContact CD1-CD1 4.33Å; I153-I178 HydrophobicContact CD1-CG1 4.48Å; I153-I178 HydrophobicContact CD1-CG2 3.42Å; I153-I178 VanDerWaalsContact CD1-CG2 3.42Å; I153-I342 HydrophobicContact CD1-CD1 3.99Å; I153-I342 HydrophobicContact CG1-CD1 4.12Å; I153-I342 HydrophobicContact CG2-CD1 3.84Å; I153-V357 HydrophobicContact CG1-CG2 4.37Å
154	D	97.2	Very high	96.9	Very high	5 Å²	5	9.8 Å²	9.8	3%	0.027	5%	0.049	C	C	.	.	H	α-helix	trans	-61	-29.3	-175.6	-66.1	-20.4	0	0	0	112.3	T148 G149 L150 Q371 Q433	T148-D154 WeakPolarHBondContact CB-OD1 3.49Å; T148-D154 PolarHBondContact N-OD1 2.79Å; T148-D154 PolarHBondContact N-OD2 2.97Å; T148-D154 PolarHBondContact OG1-OD1 3.09Å; T148-D154 PolarHBondContact OG1-OD2 2.82Å; G149-D154 WeakPolarHBondContact CA-OD2 3.3Å; G149-D154 PolarHBondContact N-OD2 3.28Å; L150-D154 PolarHBondContact N-OD2 3.33Å; L150-D154 PolarHBondContact O-N 3.16Å; D154-Q371 PolarHBondContact O-NE2 2.78Å; D154-Q433 VanDerWaalsContact CB-OE1 3.29Å; D154-Q433 PolarHBondContact OD2-NE2 3.2Å; D154-Q433 PolarHBondContact OD2-OE1 3.25Å
155	A	95.6	Very high	97.1	Very high	5 Å²	5	6.9 Å²	6.9	4%	0.041	4%	0.036	C	C	.	.	H	α-helix	trans	-87.1	-48.4	176	0	0	0	0	0	113.9	K151 I153 Q371 M375 A379 L382 L437	K151-A155 WeakPolarHBondContact O-CB 3.14Å; K151-A155 PolarHBondContact O-N 3.25Å; K151-A155 VanDerWaalsContact O-N 3.08Å; I153-A155 PolarHBondContact O-N 2.99Å; I153-A155 VanDerWaalsContact O-N 3.13Å; A155-Q371 PolarHBondContact O-NE2 3.42Å; A155-M375 HydrophobicContact CB-SD 4.13Å; A155-A379 HydrophobicContact CB-CB 3.89Å; A155-L382 HydrophobicContact CB-CD2 3.96Å; A155-L437 HydrophobicContact CB-CD1 3.65Å
156	L	93.7	Very high	97.1	Very high	13 Å²	13	5.5 Å²	5.5	7%	0.068	3%	0.027	C	C	.	.	H	α-helix	trans	-93.9	-36.3	-170	-53.6	173.8	0	0	0	113.6	A152 I153 A359 L382 R383 L386 L420	A152-L156 WeakPolarHBondContact O-CB 3.19Å; A152-L156 WeakPolarHBondContact O-CG 3.32Å; A152-L156 PolarHBondContact O-N 2.93Å; I153-L156 PolarHBondContact O-N 3.26Å; L156-A359 HydrophobicContact CD1-CB 3.86Å; L156-L382 HydrophobicContact CD2-CB 4.06Å; L156-L382 HydrophobicContact CD2-CD2 3.75Å; L156-L382 HydrophobicContact CD2-CG 3.86Å; L156-R383 HydrophobicContact CD2-CB 4.18Å; L156-L386 HydrophobicContact CD1-CD2 4.1Å; L156-L420 HydrophobicContact CD1-CD1 3.92Å
157	V	95.3	Very high	97.2	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.027	C	C	.	.	S	Bend	trans	-136.2	63.3	-171.4	-166	0	0	0	0	108.8	I153 E165 I342 S362	I153-V157 WeakPolarHBondContact CG2-O 3.38Å; I153-V157 CarbonylContact O-C 3.49Å; I153-V157 WeakPolarHBondContact O-CA 3.38Å; I153-V157 PolarHBondContact O-N 2.82Å; I153-V157 VanDerWaalsContact O-O 3.08Å; V157-E165 WeakPolarHBondContact CG1-OE1 3.37Å; V157-I342 HydrophobicContact CB-CG1 4.27Å; V157-I342 HydrophobicContact CG1-CG1 3.79Å; V157-S362 VanDerWaalsContact CG2-CB 3.49Å
158	P	96.5	Very high	97.2	Very high	8 Å²	8	4.6 Å²	4.6	5%	0.052	2%	0.022	C	C	.	.			trans	-64.2	143	-171.3	28.4	-37.7	0	0	0	111.4	S364 G367 A370 Q371	P158-S364 WeakPolarHBondContact O-CB 3.39Å; P158-S364 PolarHBondContact O-OG 2.93Å; P158-G367 WeakPolarHBondContact CG-O 3.33Å; P158-A370 HydrophobicContact CB-CB 4.11Å; P158-A370 HydrophobicContact CG-CB 4.5Å; P158-Q371 HydrophobicContact CB-CG 3.43Å; P158-Q371 VanDerWaalsContact CB-CG 3.43Å; P158-Q371 HydrophobicContact CG-CG 3.76Å
159	I	98.2	Very high	97.1	Very high	3 Å²	3	4.6 Å²	4.6	2%	0.015	2%	0.022	C	C	.	.			trans	-111.2	130.1	178.1	-58.6	161.7	0	0	0	108.8	M146 T148 I153 Q163 E165 T314 L316 I342	M146-I159 HydrophobicContact CB-CG2 4.37Å; M146-I159 HydrophobicContact CE-CB 3.91Å; M146-I159 HydrophobicContact CE-CD1 4.04Å; M146-I159 HydrophobicContact CE-CG2 3.56Å; M146-I159 PolarHBondContact N-O 3.46Å; T148-I159 HydrophobicContact CG2-CD1 3.8Å; I153-I159 HydrophobicContact CG2-CD1 3.78Å; I153-I159 HydrophobicContact CG2-CG1 4.24Å; I159-Q163 HydrophobicContact CG2-CB 4.27Å; I159-E165 HydrophobicContact CD1-CB 4.09Å; I159-E165 HydrophobicContact CD1-CG 4.07Å; I159-E165 HydrophobicContact CG1-CB 3.84Å; I159-E165 HydrophobicContact CG1-CG 3.79Å; I159-E165 HydrophobicContact CG2-CB 4.38Å; I159-T314 HydrophobicContact CG2-CG2 3.76Å; I159-L316 HydrophobicContact CD1-CD2 3.8Å; I159-L316 HydrophobicContact CG2-CD2 4.48Å; I159-I342 HydrophobicContact CD1-CD1 4.06Å
160	G	97.7	Very high	97	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.027	C	C	.	.	B	Isolated β-bridge	trans	-102.9	159.6	176.4	0	0	0	0	0	113.4	V142 E144 G162 Q163 T314	V142-G160 VanDerWaalsContact CG1-CA 3.48Å; E144-G160 CarbonylContact O-C 3.58Å; E144-G160 WeakPolarHBondContact O-CA 3.27Å; G160-G162 PolarHBondContact O-N 3.44Å; G160-Q163 WeakPolarHBondContact O-CB 3.42Å; G160-Q163 PolarHBondContact O-N 2.97Å; G160-T314 WeakPolarHBondContact O-CG2 3.47Å
161	R	97.9	Very high	96.7	Very high	30 Å²	30	13.5 Å²	13.5	11%	0.113	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	114.5	176	-62.1	-169.6	177	-154.6	-10.3	110.3	E144 P145 M146 Q189 M191 H255 K303 T314	E144-R161 HydrophobicContact CB-CB 4.15Å; E144-R161 HydrophobicContact CB-CG 4.09Å; E144-R161 PolarHBondContact O-N 3.27Å; P145-R161 PolarHBondContact O-NE 3.07Å; M146-R161 HydrophobicContact CB-CG 4.18Å; R161-Q189 PolarHBondContact NH2-O 2.84Å; R161-M191 HydrophobicContact CG-CE 3.99Å; R161-H255 PolarHBondContact NH1-CD2 3.45Å; R161-H255 PolarHBondContact NH1-NE2 2.76Å; R161-K303 WeakPolarHBondContact O-CD 3.44Å; R161-T314 WeakPolarHBondContact CA-OG1 3.38Å
162	G	97.4	Very high	96.4	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.01	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.4	1.6	-173.8	0	0	0	0	0	115.1	G160 L313 T314	G160-G162 PolarHBondContact O-N 3.44Å; G162-L313 WeakPolarHBondContact CA-O 3.33Å; G162-T314 PolarHBondContact N-OG1 3.08Å
163	Q	98	Very high	96.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	9%	0.091	C	C	.	.			trans	-80.8	152.4	175	-175.4	170.5	-14.3	0	0	111.6	V142 I159 G160 E165 T314 A315 D339 S364 V366	V142-Q163 HydrophobicContact CG1-CB 4.45Å; I159-Q163 HydrophobicContact CG2-CB 4.27Å; G160-Q163 WeakPolarHBondContact O-CB 3.42Å; G160-Q163 PolarHBondContact O-N 2.97Å; Q163-E165 PolarHBondContact NE2-OE2 2.67Å; Q163-T314 WeakPolarHBondContact O-CA 3.42Å; Q163-T314 VanDerWaalsContact O-CG2 3.31Å; Q163-T314 WeakPolarHBondContact O-CG2 3.06Å; Q163-A315 PolarHBondContact O-N 2.87Å; Q163-D339 HydrophobicContact CG-CB 3.83Å; Q163-S364 PolarHBondContact NE2-OG 3.24Å; Q163-S364 VanDerWaalsContact NE2-OG 3.14Å; Q163-V366 HydrophobicContact CB-CG2 4.4Å; Q163-V366 VanDerWaalsContact CD-CG2 3.47Å; Q163-V366 HydrophobicContact CG-CG2 3.84Å
164	R	98.3	Very high	96.1	Very high	21 Å²	21	22.3 Å²	22.3	8%	0.079	10%	0.1	C	C	.	.	B	Isolated β-bridge	trans	-106	108.6	169	-60.4	164.8	-64.2	-72.9	-1.7	109.1	L298 A301 A315 T338 D339	R164-L298 WeakPolarHBondContact CD-O 3.09Å; R164-A301 HydrophobicContact CG-CB 3.93Å; R164-A301 PolarHBondContact NH1-O 3.03Å; R164-A315 CarbonylContact C-O 3.38Å; R164-A315 WeakPolarHBondContact CA-O 3.31Å; R164-A315 HydrophobicContact CG-CB 4.19Å; R164-T338 HydrophobicContact CB-CG2 4.24Å; R164-T338 WeakPolarHBondContact O-CB 3.44Å; R164-D339 IonicContact CZ-OD1 3.96Å; R164-D339 IonicContact CZ-OD2 3.73Å; R164-D339 PolarHBondContact N-OD2 2.88Å; R164-D339 IonicContact NE-OD1 2.67Å; R164-D339 IonicContact NE-OD2 3.23Å; R164-D339 IonicContact NH1-OD2 2.79Å; R164-D339 PolarHBondContact NH1-OD2 3.34Å; R164-D339 IonicContact NH2-OD1 2.83Å; R164-D339 PolarHBondContact NH2-OD1 3.41Å; R164-D339 IonicContact NH2-OD2 3.54Å; R164-D339 PolarHBondContact NH2-OD2 2.89Å; R164-D339 PolarHBondContact O-N 3.02Å
165	E	98.4	Very high	96	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	111.7	-178.7	-164.9	69.8	-165.5	0	0	111.4	V157 I159 Q163 I167 A315 L316 P317 G340 Q341 I342 V363	V157-E165 WeakPolarHBondContact CG1-OE1 3.37Å; I159-E165 HydrophobicContact CD1-CB 4.09Å; I159-E165 HydrophobicContact CD1-CG 4.07Å; I159-E165 HydrophobicContact CG1-CB 3.84Å; I159-E165 HydrophobicContact CG1-CG 3.79Å; I159-E165 HydrophobicContact CG2-CB 4.38Å; Q163-E165 PolarHBondContact NE2-OE2 2.67Å; E165-I167 PolarHBondContact O-N 2.76Å; E165-A315 PolarHBondContact N-O 3.45Å; E165-L316 HydrophobicContact CB-CD2 3.81Å; E165-L316 WeakPolarHBondContact O-CA 3.5Å; E165-P317 WeakPolarHBondContact O-CD 3.38Å; E165-G340 VanDerWaalsContact OE1-C 3.24Å; E165-G340 WeakPolarHBondContact OE1-CA 3.43Å; E165-G340 VanDerWaalsContact OE2-CA 3.3Å; E165-G340 WeakPolarHBondContact OE2-CA 3.37Å; E165-Q341 PolarHBondContact OE1-N 2.81Å; E165-I342 HydrophobicContact CG-CD1 3.85Å; E165-I342 HydrophobicContact CG-CG1 3.96Å; E165-V363 VanDerWaalsContact OE1-O 3.09Å
166	L	98.5	Very high	96.1	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	124.9	-178.5	172.1	59.8	0	0	0	111.2	I168 P317 V319 V334 I335 T338 G340 Q341 I342	L166-I168 HydrophobicContact CD1-CB 4.33Å; L166-I168 HydrophobicContact CD2-CB 4.01Å; L166-I168 HydrophobicContact CD2-CD1 4.4Å; L166-I168 HydrophobicContact CD2-CG2 4.1Å; L166-I168 HydrophobicContact CG-CB 3.89Å; L166-I168 HydrophobicContact CG-CG2 4.05Å; L166-P317 HydrophobicContact CD1-CG 4.34Å; L166-P317 WeakPolarHBondContact CD1-O 3.39Å; L166-V319 HydrophobicContact CD1-CB 3.91Å; L166-V319 HydrophobicContact CD1-CG2 3.61Å; L166-V334 HydrophobicContact CD1-CG1 3.75Å; L166-V334 HydrophobicContact CD2-CB 4.33Å; L166-V334 HydrophobicContact CD2-CG1 4.07Å; L166-V334 HydrophobicContact CG-CG1 4.38Å; L166-I335 HydrophobicContact CD2-CB 4.43Å; L166-I335 HydrophobicContact CD2-CG1 3.55Å; L166-T338 HydrophobicContact CB-CG2 3.8Å; L166-G340 WeakPolarHBondContact CB-O 3.19Å; L166-G340 PolarHBondContact N-O 3.28Å; L166-G340 VanDerWaalsContact N-O 3.11Å; L166-Q341 HydrophobicContact CB-CB 4.01Å; L166-Q341 HydrophobicContact CD2-CB 4.24Å; L166-Q341 HydrophobicContact CG-CB 4.32Å; L166-Q341 CarbonylContact O-C 2.98Å; L166-Q341 VanDerWaalsContact O-CA 3.23Å; L166-Q341 WeakPolarHBondContact O-CA 3.28Å; L166-I342 PolarHBondContact O-N 2.7Å
167	I	98.2	Very high	96.2	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	104.7	165.9	-44.6	-163.6	0	0	0	108.7	E165 K175 I178 P317 F318 V319 I342 L344	E165-I167 PolarHBondContact O-N 2.76Å; I167-K175 HydrophobicContact CG2-CB 4.22Å; I167-K175 HydrophobicContact CG2-CG 3.98Å; I167-I178 HydrophobicContact CD1-CB 4.28Å; I167-I178 HydrophobicContact CD1-CG2 3.57Å; I167-P317 PolarHBondContact N-O 3.15Å; I167-F318 HydrophobicContact CB-CD1 3.66Å; I167-F318 HydrophobicContact CB-CE1 3.79Å; I167-F318 HydrophobicContact CD1-CD1 4.36Å; I167-F318 HydrophobicContact CD1-CE1 3.64Å; I167-F318 HydrophobicContact CD1-CZ 4.44Å; I167-F318 HydrophobicContact CG1-CD1 4.07Å; I167-F318 HydrophobicContact CG1-CE1 3.85Å; I167-F318 HydrophobicContact CG2-CE1 4.45Å; I167-F318 VanDerWaalsContact O-CA 3.31Å; I167-F318 WeakPolarHBondContact O-CA 3.49Å; I167-V319 PolarHBondContact O-N 3.16Å; I167-V319 VanDerWaalsContact O-N 3.15Å; I167-I342 HydrophobicContact CG1-CD1 4.46Å; I167-L344 HydrophobicContact CG2-CD1 3.96Å; I167-L344 HydrophobicContact CG2-CG 4.23Å
168	I	97.6	Very high	96.3	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.2	-174.1	176.8	168.7	0	0	0	110	L166 V319 T321 I326 P331 I335 Q341 I342 F343 L344	L166-I168 HydrophobicContact CD1-CB 4.33Å; L166-I168 HydrophobicContact CD2-CB 4.01Å; L166-I168 HydrophobicContact CD2-CD1 4.4Å; L166-I168 HydrophobicContact CD2-CG2 4.1Å; L166-I168 HydrophobicContact CG-CB 3.89Å; L166-I168 HydrophobicContact CG-CG2 4.05Å; I168-V319 WeakPolarHBondContact CA-O 3.05Å; I168-V319 HydrophobicContact CD1-CG1 4.4Å; I168-V319 HydrophobicContact CG1-CB 4.45Å; I168-V319 HydrophobicContact CG1-CG1 4.47Å; I168-T321 HydrophobicContact CD1-CG2 3.65Å; I168-T321 HydrophobicContact CG1-CG2 3.55Å; I168-I326 HydrophobicContact CD1-CG2 4.1Å; I168-P331 HydrophobicContact CD1-CB 3.83Å; I168-I335 HydrophobicContact CD1-CD1 4.15Å; I168-Q341 HydrophobicContact CG2-CB 4.1Å; I168-I342 WeakPolarHBondContact CG2-O 3.39Å; I168-I342 PolarHBondContact N-O 2.81Å; I168-F343 HydrophobicContact CG1-CD2 4.34Å; I168-F343 HydrophobicContact CG2-CB 4.4Å; I168-F343 HydrophobicContact CG2-CD2 3.92Å; I168-F343 CarbonylContact O-C 3.52Å; I168-F343 WeakPolarHBondContact O-CA 3.32Å; I168-L344 PolarHBondContact O-N 2.93Å
169	G	96.5	Very high	96.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167	177.5	172.4	0	0	0	0	0	112.3	K175 V319 E320 T321	G169-K175 PolarHBondContact O-NZ 3.48Å; G169-V319 PolarHBondContact N-O 3.44Å; G169-E320 WeakPolarHBondContact O-CA 3.2Å; G169-T321 WeakPolarHBondContact CA-OG1 3.42Å; G169-T321 PolarHBondContact O-N 3.34Å; G169-T321 PolarHBondContact O-OG1 3.4Å
170	D	94.2	Very high	96.4	Very high	17 Å²	17	25.2 Å²	25.2	9%	0.091	12%	0.118	C	C	.	.			trans	-71.5	172.3	-174.7	-86.7	9.2	0	0	0	113	K172 T173 K175 T321 A323 G324 N346	D170-K172 PolarHBondContact O-N 2.99Å; D170-T173 HydrophobicContact CB-CG2 3.86Å; D170-T173 WeakPolarHBondContact O-CG2 3.37Å; D170-T173 PolarHBondContact O-OG1 3.04Å; D170-K175 PolarHBondContact O-NZ 3.46Å; D170-T321 PolarHBondContact N-OG1 2.88Å; D170-T321 VanDerWaalsContact N-OG1 3.14Å; D170-T321 WeakPolarHBondContact OD1-CB 3.3Å; D170-T321 PolarHBondContact OD1-OG1 3.17Å; D170-A323 WeakPolarHBondContact OD2-CA 3.44Å; D170-G324 VanDerWaalsContact CG-N 3.29Å; D170-G324 WeakPolarHBondContact OD1-CA 3.48Å; D170-G324 PolarHBondContact OD1-N 3.18Å; D170-G324 PolarHBondContact OD2-N 3.44Å; D170-N346 WeakPolarHBondContact CB-ND2 3.28Å; D170-N346 WeakPolarHBondContact CB-OD1 3.43Å; D170-N346 PolarHBondContact OD2-ND2 3.4Å
171	R	91.6	Very high	96.4	Very high	173 Å²	173	25.6 Å²	25.6	65%	0.653	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	133.9	174.8	-165	179	176.1	-170.4	2.5	110.5
172	K	91.1	Very high	96.4	Very high	170 Å²	170	24.1 Å²	24.1	74%	0.739	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	27.6	178.4	-61.1	177.9	178.7	-177.2	0	116.1	D170	D170-K172 PolarHBondContact O-N 2.99Å
173	T	91.7	Very high	96.5	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	11%	0.114	C	C	.	.	S	Bend	trans	-86.3	-4.9	173.2	53.6	0	0	0	0	115.2	D170 N346	D170-T173 HydrophobicContact CB-CG2 3.86Å; D170-T173 WeakPolarHBondContact O-CG2 3.37Å; D170-T173 PolarHBondContact O-OG1 3.04Å; T173-N346 WeakPolarHBondContact CG2-OD1 3.48Å
174	G	93.8	Very high	96.5	Very high	18 Å²	18	24.9 Å²	24.9	19%	0.186	12%	0.118	C	C	.	.	S	Bend	trans	104.1	11.6	178.4	0	0	0	0	0	116	T176 S177 I178	G174-T176 PolarHBondContact O-N 3.1Å; G174-S177 WeakPolarHBondContact O-CB 3.31Å; G174-S177 PolarHBondContact O-N 3.4Å; G174-S177 VanDerWaalsContact O-N 3.11Å; G174-I178 PolarHBondContact O-N 3.43Å
175	K	96.8	Very high	96.5	Very high	15 Å²	15	24.8 Å²	24.8	7%	0.065	12%	0.12	C	C	.	.	H	α-helix	trans	-48.6	-57.8	176.7	-62.1	-170.7	-68.9	-81.8	0	113	I167 G169 D170 S177 I178 A179 F318 L344	I167-K175 HydrophobicContact CG2-CB 4.22Å; I167-K175 HydrophobicContact CG2-CG 3.98Å; G169-K175 PolarHBondContact O-NZ 3.48Å; D170-K175 PolarHBondContact O-NZ 3.46Å; K175-S177 VanDerWaalsContact C-N 3.29Å; K175-S177 PolarHBondContact O-N 3.42Å; K175-I178 WeakPolarHBondContact O-CB 3.25Å; K175-I178 PolarHBondContact O-N 3.49Å; K175-I178 VanDerWaalsContact O-N 3.15Å; K175-A179 PolarHBondContact O-N 2.94Å; K175-F318 VanDerWaalsContact C-CZ 3.5Å; K175-F318 HydrophobicContact CB-CD2 3.92Å; K175-F318 HydrophobicContact CB-CE2 3.82Å; K175-F318 HydrophobicContact CB-CG 4.35Å; K175-F318 HydrophobicContact CB-CZ 4.15Å; K175-F318 HydrophobicContact CD-CB 4.43Å; K175-F318 HydrophobicContact CD-CG 4.49Å; K175-F318 WeakPolarHBondContact O-CZ 3.44Å; K175-L344 HydrophobicContact CB-CD1 4.27Å; K175-L344 HydrophobicContact CG-CD1 3.61Å
176	T	96.7	Very high	96.5	Very high	30 Å²	30	24.9 Å²	24.9	18%	0.184	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-37.1	179.1	-45.7	0	0	0	0	111.9	G174 I178 A179 I180 Y195 Q208 D261	G174-T176 PolarHBondContact O-N 3.1Å; T176-I178 VanDerWaalsContact C-N 3.34Å; T176-I178 PolarHBondContact O-N 3.44Å; T176-A179 PolarHBondContact O-N 3.23Å; T176-I180 HydrophobicContact CG2-CG1 4.13Å; T176-I180 WeakPolarHBondContact O-CB 3.45Å; T176-I180 VanDerWaalsContact O-CG1 3.22Å; T176-I180 WeakPolarHBondContact O-CG1 3.42Å; T176-I180 PolarHBondContact O-N 3.23Å; T176-Y195 WeakPolarHBondContact CG2-OH 3.33Å; T176-Q208 HydrophobicContact CG2-CG 4.09Å; T176-D261 WeakPolarHBondContact CG2-OD2 3.36Å; T176-D261 PolarHBondContact OG1-OD2 3.01Å
177	S	96.7	Very high	96.3	Very high	44 Å²	44	31 Å²	31	31%	0.308	15%	0.146	S	C	.	.	H	α-helix	trans	-59.9	-43.5	175.5	-62.3	0	0	0	0	112.2	G174 K175 I180 D181 L424	G174-S177 WeakPolarHBondContact O-CB 3.31Å; G174-S177 PolarHBondContact O-N 3.4Å; G174-S177 VanDerWaalsContact O-N 3.11Å; K175-S177 VanDerWaalsContact C-N 3.29Å; K175-S177 PolarHBondContact O-N 3.42Å; S177-I180 PolarHBondContact O-N 2.88Å; S177-D181 WeakPolarHBondContact O-CB 3.48Å; S177-D181 PolarHBondContact O-N 3.21Å; S177-L424 VanDerWaalsContact CB-CD1 3.43Å; S177-L424 WeakPolarHBondContact OG-CD1 3.32Å
178	I	97.5	Very high	96.1	Very high	6 Å²	6	35 Å²	35	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-61.1	-46.2	176.4	-69.6	172.4	0	0	0	111.1	L150 I153 I167 G174 K175 T176 T182 L344 P355	L150-I178 HydrophobicContact CD1-CB 4.15Å; L150-I178 HydrophobicContact CD1-CG1 4.05Å; L150-I178 HydrophobicContact CD1-CG2 3.82Å; I153-I178 HydrophobicContact CD1-CD1 4.33Å; I153-I178 HydrophobicContact CD1-CG1 4.48Å; I153-I178 HydrophobicContact CD1-CG2 3.42Å; I153-I178 VanDerWaalsContact CD1-CG2 3.42Å; I167-I178 HydrophobicContact CD1-CB 4.28Å; I167-I178 HydrophobicContact CD1-CG2 3.57Å; G174-I178 PolarHBondContact O-N 3.43Å; K175-I178 WeakPolarHBondContact O-CB 3.25Å; K175-I178 PolarHBondContact O-N 3.49Å; K175-I178 VanDerWaalsContact O-N 3.15Å; T176-I178 VanDerWaalsContact C-N 3.34Å; T176-I178 PolarHBondContact O-N 3.44Å; I178-T182 VanDerWaalsContact O-CB 3.31Å; I178-T182 WeakPolarHBondContact O-CB 3.22Å; I178-T182 PolarHBondContact O-N 3.33Å; I178-T182 PolarHBondContact O-OG1 2.76Å; I178-L344 HydrophobicContact CD1-CD1 3.76Å; I178-L344 HydrophobicContact CD1-CD2 3.6Å; I178-L344 HydrophobicContact CD1-CG 4.27Å; I178-P355 HydrophobicContact CD1-CB 4.18Å; I178-P355 HydrophobicContact CG1-CB 4.3Å
179	A	97.5	Very high	95.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-43.1	178.3	0	0	0	0	0	113	K175 T176 T182 I183 V259 F318	K175-A179 PolarHBondContact O-N 2.94Å; T176-A179 PolarHBondContact O-N 3.23Å; A179-T182 WeakPolarHBondContact O-CB 3.36Å; A179-T182 PolarHBondContact O-N 3.49Å; A179-I183 VanDerWaalsContact O-CG1 3.31Å; A179-I183 WeakPolarHBondContact O-CG1 3.29Å; A179-I183 PolarHBondContact O-N 3.32Å; A179-V259 HydrophobicContact CB-CB 4.37Å; A179-V259 HydrophobicContact CB-CG1 3.56Å; A179-V259 HydrophobicContact CB-CG2 3.92Å; A179-F318 HydrophobicContact CB-CE1 4.11Å; A179-F318 HydrophobicContact CB-CE2 4.39Å; A179-F318 HydrophobicContact CB-CZ 3.44Å; A179-F318 VanDerWaalsContact CB-CZ 3.44Å
180	I	98.1	Very high	95.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.1	-42.2	-179.3	-64.5	-68.3	0	0	0	110.5	T176 S177 T182 I183 I184 Y195 Q208 T211 L212	T176-I180 HydrophobicContact CG2-CG1 4.13Å; T176-I180 WeakPolarHBondContact O-CB 3.45Å; T176-I180 VanDerWaalsContact O-CG1 3.22Å; T176-I180 WeakPolarHBondContact O-CG1 3.42Å; T176-I180 PolarHBondContact O-N 3.23Å; S177-I180 PolarHBondContact O-N 2.88Å; I180-T182 VanDerWaalsContact C-N 3.32Å; I180-T182 PolarHBondContact O-N 2.98Å; I180-I183 PolarHBondContact O-N 3.09Å; I180-I184 HydrophobicContact CG2-CD1 3.81Å; I180-I184 HydrophobicContact CG2-CG1 4.44Å; I180-I184 WeakPolarHBondContact O-CB 3.4Å; I180-I184 WeakPolarHBondContact O-CG1 3.42Å; I180-I184 PolarHBondContact O-N 3.14Å; I180-Y195 HydrophobicContact CD1-CE2 4.42Å; I180-Q208 HydrophobicContact CD1-CB 3.93Å; I180-Q208 HydrophobicContact CD1-CG 4.27Å; I180-T211 HydrophobicContact CG2-CG2 4.01Å; I180-L212 HydrophobicContact CD1-CD1 4.22Å; I180-L212 HydrophobicContact CD1-CD2 4.01Å; I180-L212 HydrophobicContact CD1-CG 4.1Å; I180-L212 HydrophobicContact CG2-CD2 4.18Å
181	D	98.2	Very high	95.9	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-38.1	175.4	-70.5	-5.5	0	0	0	111.4	L150 S177 I184 N185 H425	L150-D181 HydrophobicContact CD1-CB 4.47Å; L150-D181 HydrophobicContact CD2-CB 4.32Å; S177-D181 WeakPolarHBondContact O-CB 3.48Å; S177-D181 PolarHBondContact O-N 3.21Å; D181-I184 PolarHBondContact O-N 2.89Å; D181-N185 WeakPolarHBondContact O-CB 2.88Å; D181-N185 PolarHBondContact O-N 3.44Å; D181-H425 WeakPolarHBondContact OD1-CA 3.37Å; D181-H425 IonicContact OD1-CE1 3.47Å; D181-H425 IonicContact OD1-CG 3.59Å; D181-H425 PolarHBondContact OD1-N 2.57Å; D181-H425 VanDerWaalsContact OD1-N 3.09Å; D181-H425 IonicContact OD1-ND1 2.8Å; D181-H425 PolarHBondContact OD1-ND1 3.37Å; D181-H425 PolarHBondContact OD2-N 2.84Å; D181-H425 VanDerWaalsContact OD2-N 3.09Å
182	T	98.4	Very high	96.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-47.3	172.9	-59.4	0	0	0	0	111.2	M146 T148 I178 A179 I180 N185 Q186 L257 L316	M146-T182 HydrophobicContact CE-CG2 3.84Å; M146-T182 HydrophobicContact SD-CG2 3.71Å; T148-T182 HydrophobicContact CG2-CG2 4.04Å; I178-T182 VanDerWaalsContact O-CB 3.31Å; I178-T182 WeakPolarHBondContact O-CB 3.22Å; I178-T182 PolarHBondContact O-N 3.33Å; I178-T182 PolarHBondContact O-OG1 2.76Å; A179-T182 WeakPolarHBondContact O-CB 3.36Å; A179-T182 PolarHBondContact O-N 3.49Å; I180-T182 VanDerWaalsContact C-N 3.32Å; I180-T182 PolarHBondContact O-N 2.98Å; T182-N185 PolarHBondContact O-N 3.14Å; T182-Q186 WeakPolarHBondContact O-CG 3.45Å; T182-Q186 PolarHBondContact O-N 3.07Å; T182-Q186 PolarHBondContact O-NE2 2.99Å; T182-L257 HydrophobicContact CG2-CD2 3.69Å; T182-L316 HydrophobicContact CG2-CD1 4.12Å
183	I	98.5	Very high	96.6	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-47.6	177.5	-69.1	168.3	0	0	0	110.1	A179 I180 N185 Q186 C193 Y195 L212 A217 Y220 T221 L257 V259	A179-I183 VanDerWaalsContact O-CG1 3.31Å; A179-I183 WeakPolarHBondContact O-CG1 3.29Å; A179-I183 PolarHBondContact O-N 3.32Å; I180-I183 PolarHBondContact O-N 3.09Å; I183-N185 PolarHBondContact O-N 3.36Å; I183-Q186 VanDerWaalsContact O-CB 3.31Å; I183-Q186 WeakPolarHBondContact O-CB 3.35Å; I183-Q186 PolarHBondContact O-N 2.95Å; I183-C193 HydrophobicContact CG1-CB 4.14Å; I183-C193 HydrophobicContact CG2-CB 3.91Å; I183-Y195 HydrophobicContact CD1-CD2 4.26Å; I183-L212 HydrophobicContact CB-CD2 4.1Å; I183-L212 HydrophobicContact CG2-CD2 3.58Å; I183-A217 HydrophobicContact CG2-CB 4.14Å; I183-Y220 HydrophobicContact CG2-CE2 4.17Å; I183-Y220 WeakPolarHBondContact O-CE2 3.41Å; I183-Y220 PolarHBondContact O-OH 2.72Å; I183-T221 HydrophobicContact CG2-CG2 4.42Å; I183-T221 WeakPolarHBondContact CG2-OG1 3.45Å; I183-L257 HydrophobicContact CG1-CD2 4.18Å; I183-V259 HydrophobicContact CD1-CG2 4.17Å; I183-V259 HydrophobicContact CG1-CG2 4.49Å
184	I	98.2	Very high	96.9	Very high	16 Å²	16	26 Å²	26	8%	0.082	16%	0.158	C	C	.	.	H	α-helix	trans	-55.8	-40.3	177.8	-70	164.9	0	0	0	111.1	I180 D181 Q186 K187 L212 F215 A217 Y220 H425 P427	I180-I184 HydrophobicContact CG2-CD1 3.81Å; I180-I184 HydrophobicContact CG2-CG1 4.44Å; I180-I184 WeakPolarHBondContact O-CB 3.4Å; I180-I184 WeakPolarHBondContact O-CG1 3.42Å; I180-I184 PolarHBondContact O-N 3.14Å; D181-I184 PolarHBondContact O-N 2.89Å; I184-Q186 PolarHBondContact O-N 2.86Å; I184-K187 PolarHBondContact O-N 2.83Å; I184-L212 HydrophobicContact CG1-CD2 4.46Å; I184-F215 HydrophobicContact CD1-CB 4.14Å; I184-F215 HydrophobicContact CD1-CD2 3.59Å; I184-F215 HydrophobicContact CD1-CE2 4.12Å; I184-F215 HydrophobicContact CD1-CG 3.84Å; I184-F215 HydrophobicContact CG1-CB 3.9Å; I184-F215 HydrophobicContact CG1-CD2 4.3Å; I184-F215 HydrophobicContact CG1-CG 4.14Å; I184-F215 HydrophobicContact CG2-CB 3.99Å; I184-F215 HydrophobicContact CG2-CD1 4.13Å; I184-F215 HydrophobicContact CG2-CG 4.12Å; I184-A217 HydrophobicContact CG1-CB 4.42Å; I184-Y220 PolarHBondContact O-OH 3.3Å; I184-H425 HydrophobicContact CD1-CB 4.49Å; I184-P427 HydrophobicContact CG2-CG 3.94Å
185	N	97.9	Very high	97.1	Very high	20 Å²	20	25.1 Å²	25.1	11%	0.107	15%	0.15	C	C	.	.	H	α-helix	trans	-67	-17.8	179.3	-163.2	56.8	0	0	0	113.5	Q147 T148 G149 D181 T182 I183 K187 Q189 P427	Q147-N185 PolarHBondContact O-ND2 2.9Å; T148-N185 WeakPolarHBondContact O-CB 3.22Å; G149-N185 WeakPolarHBondContact CA-ND2 3.36Å; G149-N185 PolarHBondContact N-ND2 2.91Å; G149-N185 VanDerWaalsContact N-ND2 3.15Å; D181-N185 WeakPolarHBondContact O-CB 2.88Å; D181-N185 PolarHBondContact O-N 3.44Å; T182-N185 PolarHBondContact O-N 3.14Å; I183-N185 PolarHBondContact O-N 3.36Å; N185-K187 PolarHBondContact O-N 2.56Å; N185-Q189 PolarHBondContact ND2-NE2 2.6Å; N185-Q189 PolarHBondContact O-NE2 3.22Å; N185-P427 HydrophobicContact CB-CB 3.85Å; N185-P427 HydrophobicContact CB-CG 4.27Å
186	Q	97.9	Very high	97.2	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.009	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-5.7	-179.9	-60.2	-37.8	-65.2	0	0	114	Q147 T182 I183 I184 G188 Q189 M191 Y220 L257	Q147-Q186 PolarHBondContact O-NE2 3.36Å; T182-Q186 WeakPolarHBondContact O-CG 3.45Å; T182-Q186 PolarHBondContact O-N 3.07Å; T182-Q186 PolarHBondContact O-NE2 2.99Å; I183-Q186 VanDerWaalsContact O-CB 3.31Å; I183-Q186 WeakPolarHBondContact O-CB 3.35Å; I183-Q186 PolarHBondContact O-N 2.95Å; I184-Q186 PolarHBondContact O-N 2.86Å; Q186-G188 PolarHBondContact O-N 3.37Å; Q186-G188 VanDerWaalsContact O-N 3.09Å; Q186-Q189 WeakPolarHBondContact O-CB 3.43Å; Q186-Q189 PolarHBondContact O-N 3.18Å; Q186-M191 HydrophobicContact CB-CB 4.08Å; Q186-M191 HydrophobicContact CB-CG 4.33Å; Q186-M191 HydrophobicContact CG-CB 4.22Å; Q186-M191 HydrophobicContact CG-CG 3.96Å; Q186-Y220 HydrophobicContact CB-CE2 3.86Å; Q186-L257 HydrophobicContact CG-CD2 4.21Å
187	K	95.8	Very high	97.3	Very high	128 Å²	128	23 Å²	23	56%	0.557	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	118.4	176.5	-169.5	174.4	-172.3	170.3	0	110.7	I184 N185 Q189 Y220	I184-K187 PolarHBondContact O-N 2.83Å; N185-K187 PolarHBondContact O-N 2.56Å; K187-Q189 VanDerWaalsContact C-N 3.31Å; K187-Q189 PolarHBondContact O-N 3.18Å; K187-Y220 HydrophobicContact CB-CE1 3.97Å; K187-Y220 HydrophobicContact CG-CE1 4.19Å; K187-Y220 PolarHBondContact N-OH 3.29Å
188	G	92.5	Very high	97.4	Very high	84 Å²	84	20.9 Å²	20.9	87%	0.866	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.7	7.8	-179.3	0	0	0	0	0	115.3	Q186	Q186-G188 PolarHBondContact O-N 3.37Å; Q186-G188 VanDerWaalsContact O-N 3.09Å
189	Q	93	Very high	97.3	Very high	49 Å²	49	21.3 Å²	21.3	23%	0.229	13%	0.129	C	C	.	.	S	Bend	trans	-96.5	10.6	179	-60.3	-158.9	33.1	0	0	114.6	R161 N185 Q186 K187 M191	R161-Q189 PolarHBondContact NH2-O 2.84Å; N185-Q189 PolarHBondContact ND2-NE2 2.6Å; N185-Q189 PolarHBondContact O-NE2 3.22Å; Q186-Q189 WeakPolarHBondContact O-CB 3.43Å; Q186-Q189 PolarHBondContact O-N 3.18Å; K187-Q189 VanDerWaalsContact C-N 3.31Å; K187-Q189 PolarHBondContact O-N 3.18Å; Q189-M191 PolarHBondContact O-N 2.75Å
190	D	94.3	Very high	97.2	Very high	99 Å²	99	22.7 Å²	22.7	53%	0.529	14%	0.135	S	C	.	.	S	Bend	trans	50.9	54.5	-174.5	-168.4	36.1	0	0	0	111.9
191	M	97.3	Very high	97.1	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.03	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124.1	-178.2	-175.7	73.6	65.3	0	0	109.4	M146 R161 Q186 Q189 H255 V256 L257	M146-M191 HydrophobicContact CG-CE 4.04Å; R161-M191 HydrophobicContact CG-CE 3.99Å; Q186-M191 HydrophobicContact CB-CB 4.08Å; Q186-M191 HydrophobicContact CB-CG 4.33Å; Q186-M191 HydrophobicContact CG-CB 4.22Å; Q186-M191 HydrophobicContact CG-CG 3.96Å; Q189-M191 PolarHBondContact O-N 2.75Å; M191-H255 WeakPolarHBondContact CA-O 3.37Å; M191-H255 HydrophobicContact CE-CB 3.75Å; M191-H255 HydrophobicContact SD-CB 3.63Å; M191-V256 PolarHBondContact SD-N 2.95Å; M191-V256 VanDerWaalsContact SD-N 3.4Å; M191-L257 HydrophobicContact CG-CB 4.06Å; M191-L257 HydrophobicContact SD-CB 4.16Å
192	I	98.5	Very high	96.9	Very high	21 Å²	21	33.1 Å²	33.1	11%	0.108	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	131.5	173.2	-63.8	171.3	0	0	0	107.9	I104 F249 K254 H255 V256 L257	I104-I192 HydrophobicContact CD1-CD1 4.19Å; I104-I192 HydrophobicContact CD1-CG1 4.45Å; I104-I192 HydrophobicContact CD1-CG2 4.49Å; I192-F249 HydrophobicContact CD1-CB 3.9Å; I192-F249 HydrophobicContact CD1-CD1 3.29Å; I192-F249 HydrophobicContact CD1-CD2 4.19Å; I192-F249 HydrophobicContact CD1-CE1 3.77Å; I192-F249 HydrophobicContact CD1-CG 3.53Å; I192-F249 HydrophobicContact CD1-CZ 4.4Å; I192-F249 HydrophobicContact CG2-CD2 4.03Å; I192-F249 HydrophobicContact CG2-CE2 4.11Å; I192-F249 HydrophobicContact CG2-CG 4.42Å; I192-K254 HydrophobicContact CD1-CB 4.35Å; I192-K254 HydrophobicContact CD1-CG 4.42Å; I192-H255 PolarHBondContact N-O 2.87Å; I192-V256 CarbonylContact O-C 3.51Å; I192-V256 WeakPolarHBondContact O-CA 3.29Å; I192-L257 PolarHBondContact O-N 3.41Å
193	C	98.7	Very high	96.8	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.7	-177.5	-65	0	0	0	0	110.7	I183 Y220 T221 I222 L257	I183-C193 HydrophobicContact CG1-CB 4.14Å; I183-C193 HydrophobicContact CG2-CB 3.91Å; C193-Y220 HydrophobicContact CB-CD2 4.26Å; C193-Y220 PolarHBondContact N-O 2.87Å; C193-T221 HydrophobicContact CB-CG2 4.02Å; C193-T221 WeakPolarHBondContact CB-OG1 3.48Å; C193-T221 CarbonylContact O-C 3.58Å; C193-T221 VanDerWaalsContact O-CA 3.24Å; C193-T221 WeakPolarHBondContact O-CA 3.21Å; C193-I222 PolarHBondContact O-N 2.84Å; C193-L257 CarbonylContact C-O 3.55Å; C193-L257 WeakPolarHBondContact CA-O 3.39Å
194	I	98.7	Very high	96.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	119.1	173.2	-54.6	-176.6	0	0	0	107.7	V196 I222 V224 G242 M245 V256 L257 V258 V259	I194-V196 HydrophobicContact CG2-CG2 3.94Å; I194-I222 CarbonylContact C-O 3.49Å; I194-I222 VanDerWaalsContact CA-O 3.3Å; I194-I222 WeakPolarHBondContact CA-O 3.38Å; I194-I222 HydrophobicContact CD1-CD1 4.36Å; I194-I222 HydrophobicContact CG1-CB 4.26Å; I194-I222 HydrophobicContact CG1-CD1 4.35Å; I194-I222 HydrophobicContact CG2-CB 4.49Å; I194-V224 HydrophobicContact CG2-CG2 4.16Å; I194-G242 WeakPolarHBondContact CD1-O 3.43Å; I194-M245 HydrophobicContact CD1-CB 3.97Å; I194-V256 HydrophobicContact CD1-CG1 4.17Å; I194-V256 HydrophobicContact CG1-CG1 4.3Å; I194-L257 PolarHBondContact N-O 2.93Å; I194-V258 HydrophobicContact CB-CG1 4.28Å; I194-V258 HydrophobicContact CB-CG2 4.19Å; I194-V258 HydrophobicContact CD1-CG2 4.34Å; I194-V258 HydrophobicContact CG2-CG1 4.41Å; I194-V258 CarbonylContact O-C 2.95Å; I194-V258 WeakPolarHBondContact O-CA 3.45Å; I194-V259 PolarHBondContact O-N 3.48Å
195	Y	98.7	Very high	96.5	Very high	1 Å²	1	39 Å²	39	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	108.6	176	180	-101.2	0	0	0	109.5	T176 I180 I183 A197 I222 V223 V224 V259 D261	T176-Y195 WeakPolarHBondContact CG2-OH 3.33Å; I180-Y195 HydrophobicContact CD1-CE2 4.42Å; I183-Y195 HydrophobicContact CD1-CD2 4.26Å; Y195-A197 HydrophobicContact CD1-CB 4.45Å; Y195-A197 HydrophobicContact CE1-CB 3.9Å; Y195-I222 PolarHBondContact N-O 2.92Å; Y195-V223 HydrophobicContact CD1-CG1 4.12Å; Y195-V223 WeakPolarHBondContact O-CA 2.93Å; Y195-V224 PolarHBondContact O-N 2.82Å; Y195-V259 HydrophobicContact CD2-CB 4Å; Y195-V259 HydrophobicContact CD2-CG1 3.9Å; Y195-V259 HydrophobicContact CE2-CG1 4.08Å; Y195-D261 HydrophobicContact CE2-CB 4.06Å; Y195-D261 PolarHBondContact OH-OD2 3.33Å
196	V	98.7	Very high	96.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	103.8	-179	-170.5	0	0	0	0	109.5	I194 I198 V224 A238 V258 V259 F260 D261	I194-V196 HydrophobicContact CG2-CG2 3.94Å; V196-I198 HydrophobicContact CG1-CD1 4.31Å; V196-I198 HydrophobicContact CG1-CG1 3.89Å; V196-V224 CarbonylContact C-O 3.46Å; V196-V224 WeakPolarHBondContact CA-O 3.45Å; V196-V224 HydrophobicContact CG1-CB 4.24Å; V196-V224 HydrophobicContact CG1-CG1 4.36Å; V196-V224 HydrophobicContact CG2-CB 4.3Å; V196-A238 HydrophobicContact CG1-CB 3.99Å; V196-V258 HydrophobicContact CG2-CG1 4.05Å; V196-V259 WeakPolarHBondContact CB-O 3.36Å; V196-V259 PolarHBondContact N-O 3.28Å; V196-F260 HydrophobicContact CB-CD1 4.02Å; V196-F260 HydrophobicContact CG1-CD1 4.45Å; V196-F260 HydrophobicContact CG2-CD1 4Å; V196-F260 HydrophobicContact CG2-CE1 4.19Å; V196-D261 PolarHBondContact O-N 3.09Å
197	A	98.3	Very high	96.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	114.5	176.4	0	0	0	0	0	110.9	Y195 Q200 V205 V224 A226	Y195-A197 HydrophobicContact CD1-CB 4.45Å; Y195-A197 HydrophobicContact CE1-CB 3.9Å; A197-Q200 HydrophobicContact CB-CB 4.22Å; A197-Q200 HydrophobicContact CB-CG 4.11Å; A197-V205 HydrophobicContact CB-CG1 4.39Å; A197-V205 HydrophobicContact CB-CG2 3.63Å; A197-V224 PolarHBondContact N-O 2.8Å; A197-A226 PolarHBondContact O-N 3.09Å
198	I	98.2	Very high	96.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.6	-172.2	-50.5	150.1	0	0	0	108.6	V196 Q200 L235 A238 P239 F260 D261 D262 L263 K265 Q266	V196-I198 HydrophobicContact CG1-CD1 4.31Å; V196-I198 HydrophobicContact CG1-CG1 3.89Å; I198-Q200 PolarHBondContact O-N 3.34Å; I198-L235 HydrophobicContact CG2-CB 4.13Å; I198-L235 HydrophobicContact CG2-CG 4.4Å; I198-A238 HydrophobicContact CG1-CB 4.46Å; I198-P239 HydrophobicContact CD1-CG 3.53Å; I198-P239 HydrophobicContact CG1-CG 4.04Å; I198-F260 HydrophobicContact CD1-CB 4.13Å; I198-D261 PolarHBondContact N-O 2.74Å; I198-D262 WeakPolarHBondContact CD1-O 3.34Å; I198-L263 HydrophobicContact CD1-CD2 4.05Å; I198-K265 HydrophobicContact CG2-CB 4.21Å; I198-K265 WeakPolarHBondContact O-CD 3.45Å; I198-Q266 HydrophobicContact CG2-CB 4.26Å
199	G	96.2	Very high	96.8	Very high	14 Å²	14	41.3 Å²	41.3	14%	0.144	21%	0.212	C	C	.	.	S	Bend	trans	62.6	20.6	-179	0	0	0	0	0	113.8	A226	G199-A226 WeakPolarHBondContact CA-O 3.43Å; G199-A226 PolarHBondContact N-O 2.92Å
200	Q	96	Very high	97	Very high	30 Å²	30	43.1 Å²	43.1	14%	0.14	22%	0.22	C	C	.	.			trans	-79	158.7	175.3	-65.5	-64.1	-23.6	0	0	110.7	A197 I198 V205 G227 A228 D261	A197-Q200 HydrophobicContact CB-CB 4.22Å; A197-Q200 HydrophobicContact CB-CG 4.11Å; I198-Q200 PolarHBondContact O-N 3.34Å; Q200-V205 HydrophobicContact CB-CG2 3.71Å; Q200-G227 WeakPolarHBondContact O-CA 3.5Å; Q200-A228 PolarHBondContact O-N 2.95Å; Q200-D261 WeakPolarHBondContact CG-O 3.36Å; Q200-D261 PolarHBondContact NE2-O 2.96Å; Q200-D261 PolarHBondContact NE2-OD1 3.37Å
201	K	95.3	Very high	97.1	Very high	138 Å²	138	39.5 Å²	39.5	60%	0.6	20%	0.202	S	C	*	.			trans	-73.8	135.6	170.6	-66.7	-177.6	175.3	-172.1	0	109.3	S203 T204 V205	K201-S203 PolarHBondContact O-N 3.17Å; K201-S203 VanDerWaalsContact O-N 3.15Å; K201-T204 WeakPolarHBondContact O-CA 3.23Å; K201-T204 WeakPolarHBondContact O-CB 3.22Å; K201-T204 PolarHBondContact O-N 2.87Å; K201-V205 PolarHBondContact O-N 3.08Å
202	E	94.3	Very high	97.2	Very high	87 Å²	87	39.2 Å²	39.2	41%	0.407	20%	0.2	S	C	.	.	H	α-helix	trans	-55.1	-35.8	178.2	-67.6	-59.5	155.5	0	0	112.8	T204 V205 R206 G227	E202-T204 VanDerWaalsContact C-N 3.29Å; E202-T204 PolarHBondContact O-N 3.45Å; E202-V205 PolarHBondContact O-N 3.14Å; E202-R206 VanDerWaalsContact O-CB 3.29Å; E202-R206 WeakPolarHBondContact O-CB 3.43Å; E202-R206 PolarHBondContact O-N 3.3Å; E202-G227 VanDerWaalsContact OE1-CA 3.31Å; E202-G227 WeakPolarHBondContact OE1-CA 3.48Å
203	S	95.7	Very high	97.1	Very high	83 Å²	83	43.5 Å²	43.5	58%	0.58	22%	0.215	S	C	*	.	H	α-helix	trans	-61.1	-37.1	173.9	60.2	0	0	0	0	113.1	K201 S207	K201-S203 PolarHBondContact O-N 3.17Å; K201-S203 VanDerWaalsContact O-N 3.15Å; S203-S207 PolarHBondContact O-N 2.72Å
204	T	95.1	Very high	97.1	Very high	52 Å²	52	51.6 Å²	51.6	32%	0.319	25%	0.25	S	S	.	.	H	α-helix	trans	-73.1	-45.4	178.6	-59.9	0	0	0	0	110.2	K201 E202 R206 S207 Q208	K201-T204 WeakPolarHBondContact O-CA 3.23Å; K201-T204 WeakPolarHBondContact O-CB 3.22Å; K201-T204 PolarHBondContact O-N 2.87Å; E202-T204 VanDerWaalsContact C-N 3.29Å; E202-T204 PolarHBondContact O-N 3.45Å; T204-R206 VanDerWaalsContact C-N 3.33Å; T204-R206 PolarHBondContact O-N 3.23Å; T204-S207 WeakPolarHBondContact O-CB 3.36Å; T204-S207 PolarHBondContact O-N 3.11Å; T204-S207 VanDerWaalsContact O-N 3.17Å; T204-Q208 WeakPolarHBondContact O-CG 3.41Å; T204-Q208 PolarHBondContact O-N 3.42Å; T204-Q208 VanDerWaalsContact O-N 3.08Å
205	V	96.5	Very high	97	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.024	26%	0.264	C	S	.	.	H	α-helix	trans	-57.4	-48.4	174.8	-179.4	0	0	0	0	110.1	A197 Q200 K201 E202 S207 Q208 V209 V223	A197-V205 HydrophobicContact CB-CG1 4.39Å; A197-V205 HydrophobicContact CB-CG2 3.63Å; Q200-V205 HydrophobicContact CB-CG2 3.71Å; K201-V205 PolarHBondContact O-N 3.08Å; E202-V205 PolarHBondContact O-N 3.14Å; V205-S207 VanDerWaalsContact C-N 3.33Å; V205-S207 PolarHBondContact O-N 3.31Å; V205-Q208 PolarHBondContact O-N 2.99Å; V205-V209 HydrophobicContact CG1-CG2 4.35Å; V205-V209 WeakPolarHBondContact O-CG2 3.47Å; V205-V209 PolarHBondContact O-N 3.39Å; V205-V223 HydrophobicContact CG1-CG1 4.15Å
206	R	96.6	Very high	96.9	Very high	177 Å²	177	55.3 Å²	55.3	67%	0.668	27%	0.271	S	S	*	.	H	α-helix	trans	-55.9	-45.1	175.4	-175.4	176.9	-179.8	176.6	1.2	112.3	E202 T204 Q208 V209 E210	E202-R206 VanDerWaalsContact O-CB 3.29Å; E202-R206 WeakPolarHBondContact O-CB 3.43Å; E202-R206 PolarHBondContact O-N 3.3Å; T204-R206 VanDerWaalsContact C-N 3.33Å; T204-R206 PolarHBondContact O-N 3.23Å; R206-Q208 VanDerWaalsContact C-N 3.27Å; R206-Q208 PolarHBondContact O-N 3.42Å; R206-V209 PolarHBondContact O-N 3.25Å; R206-E210 WeakPolarHBondContact O-CG 3.48Å; R206-E210 PolarHBondContact O-N 3.37Å
207	S	97.2	Very high	96.9	Very high	67 Å²	67	55.3 Å²	55.3	47%	0.469	27%	0.271	S	S	.	.	H	α-helix	trans	-59.6	-37.4	176.8	-172	0	0	0	0	112.7	S203 T204 V205 T211	S203-S207 PolarHBondContact O-N 2.72Å; T204-S207 WeakPolarHBondContact O-CB 3.36Å; T204-S207 PolarHBondContact O-N 3.11Å; T204-S207 VanDerWaalsContact O-N 3.17Å; V205-S207 VanDerWaalsContact C-N 3.33Å; V205-S207 PolarHBondContact O-N 3.31Å; S207-T211 PolarHBondContact O-N 3.42Å; S207-T211 VanDerWaalsContact O-N 3.14Å; S207-T211 PolarHBondContact O-OG1 2.91Å
208	Q	97.1	Very high	96.8	Very high	31 Å²	31	55.8 Å²	55.8	15%	0.145	27%	0.273	C	S	.	.	H	α-helix	trans	-71.2	-43.2	175.7	-58.2	-49.1	-18	0	0	111.6	T176 I180 T204 V205 R206 E210 T211 L212	T176-Q208 HydrophobicContact CG2-CG 4.09Å; I180-Q208 HydrophobicContact CD1-CB 3.93Å; I180-Q208 HydrophobicContact CD1-CG 4.27Å; T204-Q208 WeakPolarHBondContact O-CG 3.41Å; T204-Q208 PolarHBondContact O-N 3.42Å; T204-Q208 VanDerWaalsContact O-N 3.08Å; V205-Q208 PolarHBondContact O-N 2.99Å; R206-Q208 VanDerWaalsContact C-N 3.27Å; R206-Q208 PolarHBondContact O-N 3.42Å; Q208-E210 VanDerWaalsContact C-N 3.33Å; Q208-E210 PolarHBondContact O-N 3.11Å; Q208-T211 WeakPolarHBondContact O-CB 3.31Å; Q208-T211 PolarHBondContact O-N 2.97Å; Q208-T211 VanDerWaalsContact O-N 3.08Å; Q208-L212 WeakPolarHBondContact O-CG 3.22Å; Q208-L212 PolarHBondContact O-N 3.23Å
209	V	97.6	Very high	96.8	Very high	9 Å²	9	62 Å²	62	6%	0.055	31%	0.306	C	S	.	.	H	α-helix	trans	-57.6	-44.7	175	173.8	0	0	0	0	111.3	V107 V205 R206 T211 L212 R213 M218 V223	V107-V209 HydrophobicContact CG2-CG1 4.14Å; V107-V209 HydrophobicContact CG2-CG2 3.97Å; V205-V209 HydrophobicContact CG1-CG2 4.35Å; V205-V209 WeakPolarHBondContact O-CG2 3.47Å; V205-V209 PolarHBondContact O-N 3.39Å; R206-V209 PolarHBondContact O-N 3.25Å; V209-T211 VanDerWaalsContact C-N 3.31Å; V209-T211 PolarHBondContact O-N 3.14Å; V209-L212 PolarHBondContact O-N 3.48Å; V209-R213 WeakPolarHBondContact O-CB 3.4Å; V209-R213 PolarHBondContact O-N 3.09Å; V209-M218 HydrophobicContact CG1-SD 4.24Å; V209-V223 HydrophobicContact CG2-CB 4.45Å; V209-V223 HydrophobicContact CG2-CG1 4.17Å; V209-V223 HydrophobicContact CG2-CG2 4.12Å
210	E	97.6	Very high	96.9	Very high	87 Å²	87	62.7 Å²	62.7	41%	0.407	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-37.9	175.4	-68	-51.2	143.7	0	0	112.3	R206 Q208 R213 K214	R206-E210 WeakPolarHBondContact O-CG 3.48Å; R206-E210 PolarHBondContact O-N 3.37Å; Q208-E210 VanDerWaalsContact C-N 3.33Å; Q208-E210 PolarHBondContact O-N 3.11Å; E210-R213 PolarHBondContact O-N 3.42Å; E210-R213 IonicContact OE1-CZ 3.39Å; E210-R213 IonicContact OE1-NH1 2.7Å; E210-R213 PolarHBondContact OE1-NH1 2.96Å; E210-R213 IonicContact OE2-NH1 2.7Å; E210-R213 PolarHBondContact OE2-NH1 2.99Å; E210-K214 WeakPolarHBondContact O-CB 3.3Å; E210-K214 PolarHBondContact O-N 3.08Å
211	T	97.7	Very high	97	Very high	23 Å²	23	61.2 Å²	61.2	14%	0.141	30%	0.298	C	S	.	.	H	α-helix	trans	-65.2	-49.3	176.6	-57.5	0	0	0	0	110.6	I180 S207 Q208 V209 R213 K214 F215	I180-T211 HydrophobicContact CG2-CG2 4.01Å; S207-T211 PolarHBondContact O-N 3.42Å; S207-T211 VanDerWaalsContact O-N 3.14Å; S207-T211 PolarHBondContact O-OG1 2.91Å; Q208-T211 WeakPolarHBondContact O-CB 3.31Å; Q208-T211 PolarHBondContact O-N 2.97Å; Q208-T211 VanDerWaalsContact O-N 3.08Å; V209-T211 VanDerWaalsContact C-N 3.31Å; V209-T211 PolarHBondContact O-N 3.14Å; T211-R213 VanDerWaalsContact C-N 3.28Å; T211-R213 PolarHBondContact O-N 3.02Å; T211-K214 WeakPolarHBondContact O-CB 3.48Å; T211-K214 PolarHBondContact O-N 3.36Å; T211-K214 VanDerWaalsContact O-N 3.16Å; T211-F215 HydrophobicContact CG2-CD2 4.11Å; T211-F215 HydrophobicContact CG2-CE2 4.13Å; T211-F215 VanDerWaalsContact O-CD2 3.3Å; T211-F215 WeakPolarHBondContact O-CD2 3.17Å; T211-F215 PolarHBondContact O-N 3.49Å
212	L	98.1	Very high	97.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.6	-42.4	175.2	-67.6	174.9	0	0	0	111.3	I180 I183 I184 Q208 V209 F215 G216 A217 M218 T221 V223	I180-L212 HydrophobicContact CD1-CD1 4.22Å; I180-L212 HydrophobicContact CD1-CD2 4.01Å; I180-L212 HydrophobicContact CD1-CG 4.1Å; I180-L212 HydrophobicContact CG2-CD2 4.18Å; I183-L212 HydrophobicContact CB-CD2 4.1Å; I183-L212 HydrophobicContact CG2-CD2 3.58Å; I184-L212 HydrophobicContact CG1-CD2 4.46Å; Q208-L212 WeakPolarHBondContact O-CG 3.22Å; Q208-L212 PolarHBondContact O-N 3.23Å; V209-L212 PolarHBondContact O-N 3.48Å; L212-F215 PolarHBondContact O-N 2.88Å; L212-G216 PolarHBondContact O-N 3.46Å; L212-A217 HydrophobicContact CB-CB 4.15Å; L212-A217 HydrophobicContact CD2-CB 3.82Å; L212-A217 WeakPolarHBondContact O-CB 3.43Å; L212-A217 PolarHBondContact O-N 3.05Å; L212-M218 HydrophobicContact CB-CG 3.95Å; L212-M218 HydrophobicContact CB-SD 3.84Å; L212-M218 HydrophobicContact CD1-SD 4.11Å; L212-T221 HydrophobicContact CD1-CG2 4.13Å; L212-V223 HydrophobicContact CD1-CG2 4.39Å
213	R	97.5	Very high	97.4	Very high	111 Å²	111	50.5 Å²	50.5	42%	0.419	25%	0.25	S	S	.	.	H	α-helix	trans	-63.3	-43.8	176.6	-169.6	179	-62.8	120.1	-0.7	112	V209 E210 T211 F215 G216 M218	V209-R213 WeakPolarHBondContact O-CB 3.4Å; V209-R213 PolarHBondContact O-N 3.09Å; E210-R213 PolarHBondContact O-N 3.42Å; E210-R213 IonicContact OE1-CZ 3.39Å; E210-R213 IonicContact OE1-NH1 2.7Å; E210-R213 PolarHBondContact OE1-NH1 2.96Å; E210-R213 IonicContact OE2-NH1 2.7Å; E210-R213 PolarHBondContact OE2-NH1 2.99Å; T211-R213 VanDerWaalsContact C-N 3.28Å; T211-R213 PolarHBondContact O-N 3.02Å; R213-F215 PolarHBondContact O-N 3.09Å; R213-G216 PolarHBondContact O-N 2.66Å; R213-M218 HydrophobicContact CB-CG 4.02Å
214	K	97.4	Very high	97.5	Very high	170 Å²	170	46.6 Å²	46.6	74%	0.739	22%	0.223	S	C	*	.	H	α-helix	trans	-56.9	-37.3	177.8	178.2	-176.9	173.6	-174.8	0	112.5	E210 T211	E210-K214 WeakPolarHBondContact O-CB 3.3Å; E210-K214 PolarHBondContact O-N 3.08Å; T211-K214 WeakPolarHBondContact O-CB 3.48Å; T211-K214 PolarHBondContact O-N 3.36Å; T211-K214 VanDerWaalsContact O-N 3.16Å
215	F	97	Very high	97.7	Very high	63 Å²	63	44.4 Å²	44.4	28%	0.276	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	1.2	179.1	-72.4	-81.6	0	0	0	113.8	I184 T211 L212 R213 A217 H425	I184-F215 HydrophobicContact CD1-CB 4.14Å; I184-F215 HydrophobicContact CD1-CD2 3.59Å; I184-F215 HydrophobicContact CD1-CE2 4.12Å; I184-F215 HydrophobicContact CD1-CG 3.84Å; I184-F215 HydrophobicContact CG1-CB 3.9Å; I184-F215 HydrophobicContact CG1-CD2 4.3Å; I184-F215 HydrophobicContact CG1-CG 4.14Å; I184-F215 HydrophobicContact CG2-CB 3.99Å; I184-F215 HydrophobicContact CG2-CD1 4.13Å; I184-F215 HydrophobicContact CG2-CG 4.12Å; T211-F215 HydrophobicContact CG2-CD2 4.11Å; T211-F215 HydrophobicContact CG2-CE2 4.13Å; T211-F215 VanDerWaalsContact O-CD2 3.3Å; T211-F215 WeakPolarHBondContact O-CD2 3.17Å; T211-F215 PolarHBondContact O-N 3.49Å; L212-F215 PolarHBondContact O-N 2.88Å; R213-F215 PolarHBondContact O-N 3.09Å; F215-A217 VanDerWaalsContact C-N 3.28Å; F215-H425 HydrophobicContact CE1-CB 4.33Å; F215-H425 HydrophobicContact CE2-CB 3.69Å; F215-H425 AromaticContact CE2-CG 3.95Å; F215-H425 HydrophobicContact CZ-CB 3.48Å; F215-H425 VanDerWaalsContact CZ-CB 3.48Å
216	G	97.1	Very high	97.6	Very high	15 Å²	15	44.2 Å²	44.2	16%	0.155	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	27.8	-176.5	0	0	0	0	0	113	L212 R213	L212-G216 PolarHBondContact O-N 3.46Å; R213-G216 PolarHBondContact O-N 2.66Å
217	A	97.9	Very high	97.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.			trans	-86.5	-20	178.6	0	0	0	0	0	113.1	I183 I184 L212 F215 D219 Y220 T221	I183-A217 HydrophobicContact CG2-CB 4.14Å; I184-A217 HydrophobicContact CG1-CB 4.42Å; L212-A217 HydrophobicContact CB-CB 4.15Å; L212-A217 HydrophobicContact CD2-CB 3.82Å; L212-A217 WeakPolarHBondContact O-CB 3.43Å; L212-A217 PolarHBondContact O-N 3.05Å; F215-A217 VanDerWaalsContact C-N 3.28Å; A217-D219 PolarHBondContact O-N 3.42Å; A217-Y220 VanDerWaalsContact CA-CZ 3.49Å; A217-Y220 WeakPolarHBondContact CA-OH 3.48Å; A217-Y220 HydrophobicContact CB-CE1 4.32Å; A217-Y220 HydrophobicContact CB-CE2 4.27Å; A217-Y220 VanDerWaalsContact CB-OH 3.31Å; A217-Y220 WeakPolarHBondContact CB-OH 3.48Å; A217-Y220 PolarHBondContact O-N 2.92Å; A217-T221 VanDerWaalsContact O-CB 3.26Å; A217-T221 WeakPolarHBondContact O-CB 3.46Å; A217-T221 PolarHBondContact O-N 2.88Å; A217-T221 PolarHBondContact O-OG1 3.49Å
218	M	97.7	Very high	97.2	Very high	10 Å²	10	35.9 Å²	35.9	5%	0.049	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-62.1	-25.1	174	-72	-58.7	-56	0	0	112.4	G105 V209 L212 R213 Y220 T221 V223	G105-M218 WeakPolarHBondContact CA-O 3.31Å; G105-M218 PolarHBondContact N-O 3.25Å; G105-M218 VanDerWaalsContact O-CE 3.31Å; G105-M218 WeakPolarHBondContact O-CE 3.38Å; V209-M218 HydrophobicContact CG1-SD 4.24Å; L212-M218 HydrophobicContact CB-CG 3.95Å; L212-M218 HydrophobicContact CB-SD 3.84Å; L212-M218 HydrophobicContact CD1-SD 4.11Å; R213-M218 HydrophobicContact CB-CG 4.02Å; M218-Y220 PolarHBondContact O-N 3.48Å; M218-T221 PolarHBondContact O-N 3.08Å; M218-T221 VanDerWaalsContact O-N 3.16Å; M218-V223 HydrophobicContact CE-CG2 4.24Å; M218-V223 HydrophobicContact SD-CG2 4.2Å
219	D	97.4	Very high	96.9	Very high	130 Å²	130	39.3 Å²	39.3	70%	0.695	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-60.4	-16.4	179.9	-60.9	-13.1	0	0	0	113.8	I104 A217	I104-D219 WeakPolarHBondContact CG2-O 3.48Å; A217-D219 PolarHBondContact O-N 3.42Å
220	Y	98.2	Very high	96.4	Very high	29 Å²	29	42.8 Å²	42.8	11%	0.114	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-136.3	13.8	177.6	55.2	-93.6	0	0	0	112.6	I183 I184 Q186 K187 C193 A217 M218	I183-Y220 HydrophobicContact CG2-CE2 4.17Å; I183-Y220 WeakPolarHBondContact O-CE2 3.41Å; I183-Y220 PolarHBondContact O-OH 2.72Å; I184-Y220 PolarHBondContact O-OH 3.3Å; Q186-Y220 HydrophobicContact CB-CE2 3.86Å; K187-Y220 HydrophobicContact CB-CE1 3.97Å; K187-Y220 HydrophobicContact CG-CE1 4.19Å; K187-Y220 PolarHBondContact N-OH 3.29Å; C193-Y220 HydrophobicContact CB-CD2 4.26Å; C193-Y220 PolarHBondContact N-O 2.87Å; A217-Y220 VanDerWaalsContact CA-CZ 3.49Å; A217-Y220 WeakPolarHBondContact CA-OH 3.48Å; A217-Y220 HydrophobicContact CB-CE1 4.32Å; A217-Y220 HydrophobicContact CB-CE2 4.27Å; A217-Y220 VanDerWaalsContact CB-OH 3.31Å; A217-Y220 WeakPolarHBondContact CB-OH 3.48Å; A217-Y220 PolarHBondContact O-N 2.92Å; M218-Y220 PolarHBondContact O-N 3.48Å
221	T	98.7	Very high	96	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.5	-176.9	-55.8	0	0	0	0	112.3	G105 I183 C193 L212 A217 M218 V223	G105-T221 WeakPolarHBondContact CA-O 3.49Å; G105-T221 PolarHBondContact N-O 3.37Å; I183-T221 HydrophobicContact CG2-CG2 4.42Å; I183-T221 WeakPolarHBondContact CG2-OG1 3.45Å; C193-T221 HydrophobicContact CB-CG2 4.02Å; C193-T221 WeakPolarHBondContact CB-OG1 3.48Å; C193-T221 CarbonylContact O-C 3.58Å; C193-T221 VanDerWaalsContact O-CA 3.24Å; C193-T221 WeakPolarHBondContact O-CA 3.21Å; L212-T221 HydrophobicContact CD1-CG2 4.13Å; A217-T221 VanDerWaalsContact O-CB 3.26Å; A217-T221 WeakPolarHBondContact O-CB 3.46Å; A217-T221 PolarHBondContact O-N 2.88Å; A217-T221 PolarHBondContact O-OG1 3.49Å; M218-T221 PolarHBondContact O-N 3.08Å; M218-T221 VanDerWaalsContact O-N 3.16Å; T221-V223 HydrophobicContact CG2-CG2 4.3Å
222	I	98.5	Very high	95.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.4	166.6	-51.6	174.9	0	0	0	108	M103 I104 V108 C193 I194 Y195 V224 M245 F249	M103-I222 HydrophobicContact CB-CD1 3.69Å; M103-I222 HydrophobicContact CB-CG1 4.22Å; M103-I222 HydrophobicContact CB-CG2 4.48Å; I104-I222 HydrophobicContact CG1-CD1 4.43Å; I104-I222 HydrophobicContact CG1-CG1 4.29Å; V108-I222 HydrophobicContact CG2-CG2 4.29Å; C193-I222 PolarHBondContact O-N 2.84Å; I194-I222 CarbonylContact C-O 3.49Å; I194-I222 VanDerWaalsContact CA-O 3.3Å; I194-I222 WeakPolarHBondContact CA-O 3.38Å; I194-I222 HydrophobicContact CD1-CD1 4.36Å; I194-I222 HydrophobicContact CG1-CB 4.26Å; I194-I222 HydrophobicContact CG1-CD1 4.35Å; I194-I222 HydrophobicContact CG2-CB 4.49Å; Y195-I222 PolarHBondContact N-O 2.92Å; I222-V224 HydrophobicContact CG2-CG2 4.45Å; I222-M245 HydrophobicContact CG2-SD 4.21Å; I222-F249 HydrophobicContact CD1-CE2 3.71Å; I222-F249 HydrophobicContact CD1-CZ 4.19Å
223	V	98.6	Very high	95.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.4	173.1	178.8	0	0	0	0	109.5	R106 V107 V108 Y195 V205 V209 L212 M218 T221	R106-V223 PolarHBondContact O-N 3.26Å; V107-V223 CarbonylContact C-O 3.46Å; V107-V223 WeakPolarHBondContact CA-O 3.35Å; V107-V223 HydrophobicContact CB-CB 4.44Å; V107-V223 HydrophobicContact CG1-CB 4.12Å; V107-V223 HydrophobicContact CG1-CG1 3.93Å; V107-V223 HydrophobicContact CG2-CB 4.19Å; V108-V223 PolarHBondContact N-O 3.38Å; Y195-V223 HydrophobicContact CD1-CG1 4.12Å; Y195-V223 WeakPolarHBondContact O-CA 2.93Å; V205-V223 HydrophobicContact CG1-CG1 4.15Å; V209-V223 HydrophobicContact CG2-CB 4.45Å; V209-V223 HydrophobicContact CG2-CG1 4.17Å; V209-V223 HydrophobicContact CG2-CG2 4.12Å; L212-V223 HydrophobicContact CD1-CG2 4.39Å; M218-V223 HydrophobicContact CE-CG2 4.24Å; M218-V223 HydrophobicContact SD-CG2 4.2Å; T221-V223 HydrophobicContact CG2-CG2 4.3Å
224	V	98.5	Very high	95.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122	172.6	-176.1	0	0	0	0	107.7	V108 I194 Y195 V196 A197 I222 A238 M245	V108-V224 HydrophobicContact CG2-CB 4.49Å; V108-V224 HydrophobicContact CG2-CG2 3.94Å; V108-V224 CarbonylContact O-C 3.58Å; V108-V224 WeakPolarHBondContact O-CA 3.42Å; I194-V224 HydrophobicContact CG2-CG2 4.16Å; Y195-V224 PolarHBondContact O-N 2.82Å; V196-V224 CarbonylContact C-O 3.46Å; V196-V224 WeakPolarHBondContact CA-O 3.45Å; V196-V224 HydrophobicContact CG1-CB 4.24Å; V196-V224 HydrophobicContact CG1-CG1 4.36Å; V196-V224 HydrophobicContact CG2-CB 4.3Å; A197-V224 PolarHBondContact N-O 2.8Å; I222-V224 HydrophobicContact CG2-CG2 4.45Å; V224-A238 HydrophobicContact CG1-CB 4.45Å; V224-M245 HydrophobicContact CG2-CE 4.35Å; V224-M245 HydrophobicContact CG2-SD 3.7Å
225	T	98	Very high	95	Very high	7 Å²	7	27 Å²	27	4%	0.043	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.7	-178.7	-174.7	0	0	0	0	111.8	V107 V108 P110 V115	V107-T225 HydrophobicContact CG1-CG2 3.87Å; V108-T225 PolarHBondContact O-N 3.29Å; P110-T225 WeakPolarHBondContact CD-O 3.36Å; V115-T225 HydrophobicContact CG2-CG2 3.64Å
226	A	96.3	Very high	94.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	88.1	165.4	0	0	0	0	0	107.9	P110 A197 G199 L234 L235 A238	P110-A226 HydrophobicContact CG-CB 3.82Å; A197-A226 PolarHBondContact O-N 3.09Å; G199-A226 WeakPolarHBondContact CA-O 3.43Å; G199-A226 PolarHBondContact N-O 2.92Å; A226-L234 HydrophobicContact CB-CB 4.48Å; A226-L235 HydrophobicContact CB-CD1 4.13Å; A226-L235 HydrophobicContact CB-CG 4.23Å; A226-A238 HydrophobicContact CB-CB 3.79Å
227	G	93.4	Very high	94.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.142	C	C	.	.			trans	-63.7	159.8	-175.7	0	0	0	0	0	113.7	Q200 E202 S229 Q230	Q200-G227 WeakPolarHBondContact O-CA 3.5Å; E202-G227 VanDerWaalsContact OE1-CA 3.31Å; E202-G227 WeakPolarHBondContact OE1-CA 3.48Å; G227-S229 PolarHBondContact O-N 2.72Å; G227-Q230 VanDerWaalsContact O-CB 3.28Å; G227-Q230 WeakPolarHBondContact O-CB 3.46Å; G227-Q230 PolarHBondContact O-N 2.86Å
228	A	91.4	Very high	94.7	Very high	68 Å²	68	23.8 Å²	23.8	56%	0.562	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.9	-179.3	0	0	0	0	0	115.3	Q200	Q200-A228 PolarHBondContact O-N 2.95Å
229	S	89.7	Confident	94.8	Very high	103 Å²	103	23.3 Å²	23.3	72%	0.72	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-10.6	175.6	60.3	0	0	0	0	113.4	G227	G227-S229 PolarHBondContact O-N 2.72Å
230	Q	88.7	Confident	94.8	Very high	83 Å²	83	17.1 Å²	17.1	39%	0.388	11%	0.107	S	C	.	.	S	Bend	trans	-79.2	152.8	177.9	-64.8	-60.9	-39.1	0	0	109.8	G227 L234 L235	G227-Q230 VanDerWaalsContact O-CB 3.28Å; G227-Q230 WeakPolarHBondContact O-CB 3.46Å; G227-Q230 PolarHBondContact O-N 2.86Å; Q230-L234 HydrophobicContact CB-CB 4.29Å; Q230-L234 HydrophobicContact CB-CD1 4.12Å; Q230-L234 HydrophobicContact CG-CD1 4.37Å; Q230-L235 HydrophobicContact CB-CD1 4.08Å
231	P	88.2	Confident	94.7	Very high	21 Å²	21	15.8 Å²	15.8	14%	0.136	10%	0.102	C	C	.	.			trans	-65.6	148.9	-178.1	32.8	-39.4	0	0	0	110	F79 P233 L234	F79-P231 HydrophobicContact CD1-CB 4.38Å; F79-P231 HydrophobicContact CE1-CB 4.35Å; P231-P233 VanDerWaalsContact O-CD 3.31Å; P231-P233 WeakPolarHBondContact O-CD 3.4Å; P231-L234 HydrophobicContact CG-CD1 4.29Å; P231-L234 HydrophobicContact CG-CG 4.1Å; P231-L234 PolarHBondContact O-N 3.21Å
232	A	91.7	Very high	94.7	Very high	10 Å²	10	15.8 Å²	15.8	8%	0.083	10%	0.102	C	C	.	.	H	α-helix	trans	-44.9	-35.2	179.5	0	0	0	0	0	115.3	L234 L235 F236 A269 E272 L273	A232-L234 VanDerWaalsContact C-N 3.35Å; A232-L234 PolarHBondContact O-N 3.29Å; A232-L235 PolarHBondContact O-N 3.14Å; A232-F236 PolarHBondContact O-N 3.44Å; A232-A269 HydrophobicContact CB-CB 4.14Å; A232-A269 WeakPolarHBondContact O-CB 3.38Å; A232-E272 HydrophobicContact CB-CG 4.42Å; A232-L273 HydrophobicContact CB-CD2 3.99Å; A232-L273 HydrophobicContact CB-CG 4.09Å
233	P	91.3	Very high	94.7	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.019	10%	0.102	C	C	.	.	H	α-helix	trans	-56.3	-43.9	175.3	-30.4	42.6	0	0	0	114.2	I74 V75 L76 P231 L235 F236 I237 L273	I74-P233 HydrophobicContact CB-CG 4.5Å; I74-P233 HydrophobicContact CG2-CB 3.27Å; I74-P233 HydrophobicContact CG2-CG 3.02Å; V75-P233 WeakPolarHBondContact O-CG 3.5Å; L76-P233 HydrophobicContact CD2-CB 3.55Å; P231-P233 VanDerWaalsContact O-CD 3.31Å; P231-P233 WeakPolarHBondContact O-CD 3.4Å; P233-L235 VanDerWaalsContact C-N 3.31Å; P233-L235 PolarHBondContact O-N 3.43Å; P233-F236 WeakPolarHBondContact O-CB 3.45Å; P233-F236 PolarHBondContact O-N 3.02Å; P233-F236 VanDerWaalsContact O-N 3.16Å; P233-I237 WeakPolarHBondContact O-CG1 3.22Å; P233-I237 PolarHBondContact O-N 2.86Å; P233-L273 HydrophobicContact CG-CD1 4.37Å; P233-L273 HydrophobicContact CG-CD2 3.6Å
234	L	92.5	Very high	94.7	Very high	6 Å²	6	15.8 Å²	15.8	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-64.2	-39	-180	-66.6	-169.5	0	0	0	111	L76 P110 L111 A226 Q230 P231 A232 F236 I237 A238	L76-L234 HydrophobicContact CB-CD2 4.03Å; L76-L234 HydrophobicContact CD2-CD2 4.29Å; P110-L234 HydrophobicContact CG-CB 4.2Å; P110-L234 WeakPolarHBondContact CG-O 3.14Å; L111-L234 HydrophobicContact CG-CD2 4.4Å; A226-L234 HydrophobicContact CB-CB 4.48Å; Q230-L234 HydrophobicContact CB-CB 4.29Å; Q230-L234 HydrophobicContact CB-CD1 4.12Å; Q230-L234 HydrophobicContact CG-CD1 4.37Å; P231-L234 HydrophobicContact CG-CD1 4.29Å; P231-L234 HydrophobicContact CG-CG 4.1Å; P231-L234 PolarHBondContact O-N 3.21Å; A232-L234 VanDerWaalsContact C-N 3.35Å; A232-L234 PolarHBondContact O-N 3.29Å; L234-F236 VanDerWaalsContact C-N 3.33Å; L234-I237 HydrophobicContact CD2-CD1 3.77Å; L234-I237 HydrophobicContact CD2-CG1 4.47Å; L234-I237 WeakPolarHBondContact O-CG1 3.43Å; L234-I237 PolarHBondContact O-N 3.15Å; L234-A238 WeakPolarHBondContact O-CB 3.47Å; L234-A238 PolarHBondContact O-N 2.98Å
235	L	95.3	Very high	94.6	Very high	20 Å²	20	15.9 Å²	15.9	11%	0.105	10%	0.102	C	C	.	.	H	α-helix	trans	-65.5	-38	175	-77.9	68.6	0	0	0	111.6	I198 A226 Q230 A232 P233 A269	I198-L235 HydrophobicContact CG2-CB 4.13Å; I198-L235 HydrophobicContact CG2-CG 4.4Å; A226-L235 HydrophobicContact CB-CD1 4.13Å; A226-L235 HydrophobicContact CB-CG 4.23Å; Q230-L235 HydrophobicContact CB-CD1 4.08Å; A232-L235 PolarHBondContact O-N 3.14Å; P233-L235 VanDerWaalsContact C-N 3.31Å; P233-L235 PolarHBondContact O-N 3.43Å; L235-A269 HydrophobicContact CB-CB 3.74Å; L235-A269 HydrophobicContact CD2-CB 4.46Å
236	F	94.2	Very high	94.6	Very high	7 Å²	7	15.5 Å²	15.5	3%	0.031	10%	0.1	C	C	.	.	H	α-helix	trans	-65.1	-44.3	177.1	154	-107.3	0	0	0	112.2	M62 A232 P233 L234 Y240 Q266 Y270 L273 L293	M62-F236 HydrophobicContact CE-CE1 3.91Å; A232-F236 PolarHBondContact O-N 3.44Å; P233-F236 WeakPolarHBondContact O-CB 3.45Å; P233-F236 PolarHBondContact O-N 3.02Å; P233-F236 VanDerWaalsContact O-N 3.16Å; L234-F236 VanDerWaalsContact C-N 3.33Å; F236-Y240 HydrophobicContact CD2-CE2 4.39Å; F236-Y240 AromaticContact CE2-CE2 3.84Å; F236-Y240 HydrophobicContact CE2-CE2 3.84Å; F236-Y240 HydrophobicContact CZ-CE2 4.24Å; F236-Q266 PolarHBondContact O-NE2 2.67Å; F236-Y270 AromaticContact CD2-CD2 3.58Å; F236-Y270 HydrophobicContact CD2-CD2 3.58Å; F236-Y270 HydrophobicContact CD2-CE2 4.28Å; F236-Y270 HydrophobicContact CD2-CG 4.24Å; F236-Y270 AromaticContact CE2-CD2 3.68Å; F236-Y270 HydrophobicContact CE2-CD2 3.68Å; F236-Y270 AromaticContact CE2-CE2 3.92Å; F236-Y270 HydrophobicContact CE2-CE2 3.92Å; F236-Y270 HydrophobicContact CG-CD2 4.32Å; F236-Y270 HydrophobicContact CZ-CE2 4.45Å; F236-L273 HydrophobicContact CB-CD1 3.8Å; F236-L273 HydrophobicContact CD1-CD1 4.16Å; F236-L273 HydrophobicContact CG-CD1 4.07Å; F236-L293 HydrophobicContact CD2-CD1 3.73Å; F236-L293 HydrophobicContact CE2-CD1 3.34Å
237	I	94.3	Very high	94.7	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-81.8	-21.5	-176.9	62.3	167.7	0	0	0	114.2	L76 M95 P110 L111 P233 L234 P239 Y240 A241	L76-I237 HydrophobicContact CD2-CD1 4.02Å; M95-I237 HydrophobicContact CE-CB 4.04Å; M95-I237 HydrophobicContact CE-CD1 3.14Å; M95-I237 HydrophobicContact CE-CG1 4.13Å; M95-I237 HydrophobicContact CE-CG2 4.04Å; M95-I237 HydrophobicContact SD-CD1 4.39Å; M95-I237 HydrophobicContact SD-CG2 4.08Å; P110-I237 HydrophobicContact CB-CD1 3.53Å; P110-I237 HydrophobicContact CB-CG1 3.58Å; P110-I237 HydrophobicContact CG-CG1 4.41Å; L111-I237 HydrophobicContact CD2-CD1 4.09Å; P233-I237 WeakPolarHBondContact O-CG1 3.22Å; P233-I237 PolarHBondContact O-N 2.86Å; L234-I237 HydrophobicContact CD2-CD1 3.77Å; L234-I237 HydrophobicContact CD2-CG1 4.47Å; L234-I237 WeakPolarHBondContact O-CG1 3.43Å; L234-I237 PolarHBondContact O-N 3.15Å; I237-P239 VanDerWaalsContact C-N 3.34Å; I237-Y240 WeakPolarHBondContact O-CA 3.32Å; I237-Y240 WeakPolarHBondContact O-CB 3.41Å; I237-Y240 PolarHBondContact O-N 3.2Å; I237-A241 PolarHBondContact O-N 3Å
238	A	97.1	Very high	94.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-52.5	-43.3	-173.4	0	0	0	0	0	114	P110 V196 I198 V224 A226 L234 Y240 A241 G242	P110-A238 HydrophobicContact CB-CB 4.23Å; P110-A238 HydrophobicContact CG-CB 3.73Å; V196-A238 HydrophobicContact CG1-CB 3.99Å; I198-A238 HydrophobicContact CG1-CB 4.46Å; V224-A238 HydrophobicContact CG1-CB 4.45Å; A226-A238 HydrophobicContact CB-CB 3.79Å; L234-A238 WeakPolarHBondContact O-CB 3.47Å; L234-A238 PolarHBondContact O-N 2.98Å; A238-Y240 PolarHBondContact O-N 3.47Å; A238-A241 PolarHBondContact O-N 3.15Å; A238-G242 PolarHBondContact O-N 3.39Å
239	P	98.2	Very high	95.2	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65.2	-37	176.6	-26.7	41.3	0	0	0	113.4	I198 I237 T243 F260 L263 Q266 L297	I198-P239 HydrophobicContact CD1-CG 3.53Å; I198-P239 HydrophobicContact CG1-CG 4.04Å; I237-P239 VanDerWaalsContact C-N 3.34Å; P239-T243 WeakPolarHBondContact O-CB 3.36Å; P239-T243 PolarHBondContact O-N 2.85Å; P239-T243 PolarHBondContact O-OG1 3.28Å; P239-F260 HydrophobicContact CB-CD1 3.75Å; P239-F260 HydrophobicContact CB-CE1 3.82Å; P239-F260 HydrophobicContact CG-CD1 4.4Å; P239-L263 HydrophobicContact CB-CD2 4.27Å; P239-L263 HydrophobicContact CG-CD2 4.07Å; P239-Q266 HydrophobicContact CG-CB 4.41Å; P239-Q266 HydrophobicContact CG-CG 4.01Å; P239-L297 HydrophobicContact CB-CD1 3.72Å; P239-L297 HydrophobicContact CB-CD2 3.49Å; P239-L297 VanDerWaalsContact CB-CD2 3.49Å; P239-L297 HydrophobicContact CB-CG 4.26Å; P239-L297 HydrophobicContact CG-CD2 4.45Å; P239-L297 WeakPolarHBondContact O-CD1 3.31Å
240	Y	97.5	Very high	95.6	Very high	1 Å²	1	8.7 Å²	8.7	0%	0.004	5%	0.045	C	C	.	.	H	α-helix	trans	-68.1	-41.9	176.7	-66.1	-65.4	0	0	0	111.8	F236 I237 A238 T243 A244 L293 R296 L297	F236-Y240 HydrophobicContact CD2-CE2 4.39Å; F236-Y240 AromaticContact CE2-CE2 3.84Å; F236-Y240 HydrophobicContact CE2-CE2 3.84Å; F236-Y240 HydrophobicContact CZ-CE2 4.24Å; I237-Y240 WeakPolarHBondContact O-CA 3.32Å; I237-Y240 WeakPolarHBondContact O-CB 3.41Å; I237-Y240 PolarHBondContact O-N 3.2Å; A238-Y240 PolarHBondContact O-N 3.47Å; Y240-T243 PolarHBondContact O-N 3.34Å; Y240-A244 WeakPolarHBondContact O-CB 3.41Å; Y240-A244 PolarHBondContact O-N 3.13Å; Y240-L293 HydrophobicContact CE2-CD1 3.96Å; Y240-L293 WeakPolarHBondContact OH-CD1 3.41Å; Y240-L293 PolarHBondContact OH-O 2.85Å; Y240-R296 HydrophobicContact CE1-CG 3.65Å; Y240-R296 WeakPolarHBondContact OH-CD 3.37Å; Y240-R296 WeakPolarHBondContact OH-CG 3.42Å; Y240-R296 PolarHBondContact OH-NE 2.82Å; Y240-L297 HydrophobicContact CD1-CB 4.44Å; Y240-L297 HydrophobicContact CD1-CD1 3.89Å; Y240-L297 HydrophobicContact CE1-CB 3.76Å; Y240-L297 HydrophobicContact CE1-CD1 4.06Å; Y240-L297 HydrophobicContact CG-CD1 4.46Å
241	A	97.3	Very high	96.1	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-60.9	-48.6	174.2	0	0	0	0	0	111.6	V97 P110 I237 A238 T243 A244 M245	V97-A241 HydrophobicContact CG1-CB 3.98Å; P110-A241 HydrophobicContact CB-CB 4.33Å; P110-A241 VanDerWaalsContact O-CB 3.22Å; P110-A241 WeakPolarHBondContact O-CB 3.3Å; I237-A241 PolarHBondContact O-N 3Å; A238-A241 PolarHBondContact O-N 3.15Å; A241-T243 VanDerWaalsContact C-N 3.3Å; A241-T243 PolarHBondContact O-N 3.19Å; A241-A244 PolarHBondContact O-N 2.64Å; A241-M245 WeakPolarHBondContact O-CG 3.45Å; A241-M245 PolarHBondContact O-N 2.91Å
242	G	98	Very high	96.4	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61.8	-37.2	176.4	0	0	0	0	0	113	I194 A238 M245 G246	I194-G242 WeakPolarHBondContact CD1-O 3.43Å; A238-G242 PolarHBondContact O-N 3.39Å; G242-M245 PolarHBondContact O-N 2.58Å; G242-G246 PolarHBondContact O-N 2.89Å
243	T	98.3	Very high	96.7	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.006	7%	0.068	C	C	.	.	H	α-helix	trans	-67.8	-43.3	175.3	-55.2	0	0	0	0	111.5	P239 Y240 A241 M245 G246 E247 L297 R300 L313	P239-T243 WeakPolarHBondContact O-CB 3.36Å; P239-T243 PolarHBondContact O-N 2.85Å; P239-T243 PolarHBondContact O-OG1 3.28Å; Y240-T243 PolarHBondContact O-N 3.34Å; A241-T243 VanDerWaalsContact C-N 3.3Å; A241-T243 PolarHBondContact O-N 3.19Å; T243-M245 VanDerWaalsContact C-N 3.34Å; T243-M245 PolarHBondContact O-N 3.44Å; T243-G246 CarbonylContact O-C 3.56Å; T243-G246 PolarHBondContact O-N 3.31Å; T243-G246 VanDerWaalsContact O-N 3.12Å; T243-E247 HydrophobicContact CG2-CG 4.41Å; T243-E247 WeakPolarHBondContact O-CG 3.32Å; T243-E247 PolarHBondContact O-N 3.15Å; T243-L297 VanDerWaalsContact OG1-CD1 3.28Å; T243-L297 WeakPolarHBondContact OG1-CD1 3.43Å; T243-R300 HydrophobicContact CG2-CB 3.74Å; T243-L313 HydrophobicContact CG2-CD1 4.33Å
244	A	97.9	Very high	97	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.6	-41.4	176	0	0	0	0	0	111.9	V97 R127 Y240 A241 G246 E247 E248	V97-A244 HydrophobicContact CG2-CB 3.66Å; R127-A244 HydrophobicContact CB-CB 4.25Å; R127-A244 WeakPolarHBondContact CD-O 3.08Å; Y240-A244 WeakPolarHBondContact O-CB 3.41Å; Y240-A244 PolarHBondContact O-N 3.13Å; A241-A244 PolarHBondContact O-N 2.64Å; A244-G246 VanDerWaalsContact C-N 3.31Å; A244-G246 PolarHBondContact O-N 3.16Å; A244-E247 PolarHBondContact O-N 2.9Å; A244-E248 PolarHBondContact O-N 2.7Å
245	M	98.1	Very high	97.3	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-60.4	-41.2	172.6	-67.2	171.5	-166.7	0	0	111.8	V97 V99 M103 V108 I194 I222 V224 A241 G242 T243 F249	V97-M245 HydrophobicContact CB-CE 4.39Å; V99-M245 HydrophobicContact CG1-CG 4.31Å; M103-M245 HydrophobicContact CE-CE 3.46Å; M103-M245 VanDerWaalsContact CE-CE 3.46Å; M103-M245 HydrophobicContact CE-CG 4.27Å; M103-M245 HydrophobicContact CE-SD 3.62Å; V108-M245 HydrophobicContact CG2-CE 3.86Å; V108-M245 HydrophobicContact CG2-SD 4.1Å; I194-M245 HydrophobicContact CD1-CB 3.97Å; I222-M245 HydrophobicContact CG2-SD 4.21Å; V224-M245 HydrophobicContact CG2-CE 4.35Å; V224-M245 HydrophobicContact CG2-SD 3.7Å; A241-M245 WeakPolarHBondContact O-CG 3.45Å; A241-M245 PolarHBondContact O-N 2.91Å; G242-M245 PolarHBondContact O-N 2.58Å; T243-M245 VanDerWaalsContact C-N 3.34Å; T243-M245 PolarHBondContact O-N 3.44Å; M245-F249 WeakPolarHBondContact O-CD2 3.35Å; M245-F249 WeakPolarHBondContact O-CE2 3.42Å
246	G	98	Very high	97.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-68	-38.3	176.4	0	0	0	0	0	113.5	G242 T243 A244 E248 F249 M250 V256	G242-G246 PolarHBondContact O-N 2.89Å; T243-G246 CarbonylContact O-C 3.56Å; T243-G246 PolarHBondContact O-N 3.31Å; T243-G246 VanDerWaalsContact O-N 3.12Å; A244-G246 VanDerWaalsContact C-N 3.31Å; A244-G246 PolarHBondContact O-N 3.16Å; G246-E248 VanDerWaalsContact C-N 3.28Å; G246-E248 PolarHBondContact O-N 3.49Å; G246-F249 PolarHBondContact O-N 3.38Å; G246-F249 VanDerWaalsContact O-N 3.17Å; G246-M250 PolarHBondContact O-N 2.86Å; G246-V256 WeakPolarHBondContact O-CG2 3.4Å
247	E	98.2	Very high	97.6	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-62.1	-35.1	179.8	-82.2	179.8	171	0	0	112.9	R127 T243 A244 F249 M250 Y251 R300 L313	R127-E247 IonicContact NE-OE2 3.64Å; R127-E247 IonicContact NH2-OE2 3.74Å; T243-E247 HydrophobicContact CG2-CG 4.41Å; T243-E247 WeakPolarHBondContact O-CG 3.32Å; T243-E247 PolarHBondContact O-N 3.15Å; A244-E247 PolarHBondContact O-N 2.9Å; E247-F249 PolarHBondContact O-N 2.9Å; E247-M250 PolarHBondContact O-N 3.44Å; E247-Y251 HydrophobicContact CB-CD2 4.12Å; E247-Y251 HydrophobicContact CB-CE2 4.25Å; E247-Y251 HydrophobicContact CG-CE2 4.28Å; E247-Y251 VanDerWaalsContact O-CD2 3.24Å; E247-Y251 WeakPolarHBondContact O-CD2 2.97Å; E247-Y251 PolarHBondContact O-N 3.45Å; E247-R300 WeakPolarHBondContact OE1-CB 3.1Å; E247-R300 IonicContact OE1-CZ 2.79Å; E247-R300 IonicContact OE1-NE 2.97Å; E247-R300 PolarHBondContact OE1-NE 3.22Å; E247-R300 IonicContact OE1-NH2 3.9Å; E247-R300 PolarHBondContact OE1-NH2 3.07Å; E247-R300 IonicContact OE2-CZ 2.9Å; E247-R300 IonicContact OE2-NE 3.09Å; E247-R300 IonicContact OE2-NH2 2.69Å; E247-R300 PolarHBondContact OE2-NH2 2.78Å; E247-L313 HydrophobicContact CG-CD1 4.32Å
248	E	97.6	Very high	97.8	Very high	20 Å²	20	16 Å²	16	9%	0.093	8%	0.081	C	C	.	.	H	α-helix	trans	-55	-45.9	175.4	-174.2	65.4	178	0	0	111	V99 N125 R127 A244 G246 N252	V99-E248 HydrophobicContact CB-CB 3.82Å; V99-E248 HydrophobicContact CB-CG 3.92Å; V99-E248 HydrophobicContact CG1-CB 4.35Å; V99-E248 HydrophobicContact CG2-CB 3.88Å; V99-E248 HydrophobicContact CG2-CG 3.61Å; N125-E248 PolarHBondContact ND2-OE1 2.85Å; N125-E248 VanDerWaalsContact ND2-OE1 3.08Å; R127-E248 WeakPolarHBondContact CD-OE2 3.22Å; R127-E248 IonicContact CZ-OE2 3.54Å; R127-E248 IonicContact NH1-OE2 3.42Å; R127-E248 PolarHBondContact NH1-OE2 3.34Å; A244-E248 PolarHBondContact O-N 2.7Å; G246-E248 VanDerWaalsContact C-N 3.28Å; G246-E248 PolarHBondContact O-N 3.49Å; E248-N252 WeakPolarHBondContact O-CB 3.45Å; E248-N252 PolarHBondContact O-N 2.88Å; E248-N252 PolarHBondContact O-ND2 3.38Å
249	F	97.8	Very high	97.9	Very high	7 Å²	7	16 Å²	16	3%	0.031	8%	0.081	C	C	.	.	H	α-helix	trans	-71.7	-41	177.3	-57.5	-68.7	0	0	0	112.3	G100 E101 I104 I192 I222 M245 G246 E247 Y251 N252 G253 K254 V256	G100-F249 WeakPolarHBondContact O-CZ 3.3Å; E101-F249 HydrophobicContact CG-CE1 4.11Å; I104-F249 HydrophobicContact CD1-CE1 4.1Å; I104-F249 HydrophobicContact CD1-CZ 4.08Å; I104-F249 HydrophobicContact CG1-CZ 4.05Å; I192-F249 HydrophobicContact CD1-CB 3.9Å; I192-F249 HydrophobicContact CD1-CD1 3.29Å; I192-F249 HydrophobicContact CD1-CD2 4.19Å; I192-F249 HydrophobicContact CD1-CE1 3.77Å; I192-F249 HydrophobicContact CD1-CG 3.53Å; I192-F249 HydrophobicContact CD1-CZ 4.4Å; I192-F249 HydrophobicContact CG2-CD2 4.03Å; I192-F249 HydrophobicContact CG2-CE2 4.11Å; I192-F249 HydrophobicContact CG2-CG 4.42Å; I222-F249 HydrophobicContact CD1-CE2 3.71Å; I222-F249 HydrophobicContact CD1-CZ 4.19Å; M245-F249 WeakPolarHBondContact O-CD2 3.35Å; M245-F249 WeakPolarHBondContact O-CE2 3.42Å; G246-F249 PolarHBondContact O-N 3.38Å; G246-F249 VanDerWaalsContact O-N 3.17Å; E247-F249 PolarHBondContact O-N 2.9Å; F249-Y251 PolarHBondContact O-N 3.2Å; F249-N252 CarbonylContact O-C 3.6Å; F249-N252 PolarHBondContact O-N 3.15Å; F249-N252 VanDerWaalsContact O-N 3.14Å; F249-G253 PolarHBondContact O-N 3.07Å; F249-K254 HydrophobicContact CB-CB 4.06Å; F249-K254 VanDerWaalsContact O-CB 3.28Å; F249-K254 WeakPolarHBondContact O-CB 3.4Å; F249-K254 PolarHBondContact O-N 3.2Å; F249-V256 HydrophobicContact CB-CG2 3.59Å
250	M	98	Very high	97.9	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58.8	-47.1	178.3	175.5	-177.7	163.1	0	0	112	P134 G246 E247 N252 G253 A302 L304 G311 L313	P134-M250 HydrophobicContact CG-CE 4.25Å; G246-M250 PolarHBondContact O-N 2.86Å; E247-M250 PolarHBondContact O-N 3.44Å; M250-N252 VanDerWaalsContact C-N 3.26Å; M250-N252 PolarHBondContact O-N 3.03Å; M250-G253 PolarHBondContact O-N 3.33Å; M250-G253 VanDerWaalsContact O-N 3.12Å; M250-A302 HydrophobicContact CE-CB 4.25Å; M250-A302 WeakPolarHBondContact CE-O 3.31Å; M250-L304 HydrophobicContact CE-CD1 4Å; M250-L304 HydrophobicContact CE-CD2 3.42Å; M250-L304 VanDerWaalsContact CE-CD2 3.42Å; M250-L304 HydrophobicContact CE-CG 3.43Å; M250-L304 VanDerWaalsContact CE-CG 3.43Å; M250-L304 HydrophobicContact CG-CD1 3.87Å; M250-L304 HydrophobicContact CG-CG 4.14Å; M250-G311 WeakPolarHBondContact O-CA 3.47Å; M250-L313 HydrophobicContact CB-CB 4.39Å; M250-L313 HydrophobicContact CG-CB 4.26Å; M250-L313 HydrophobicContact SD-CB 3.35Å; M250-L313 WeakPolarHBondContact SD-CB 3.3Å; M250-L313 HydrophobicContact SD-CD1 4.27Å; M250-L313 HydrophobicContact SD-CG 4.46Å
251	Y	97.6	Very high	98	Very high	69 Å²	69	16.2 Å²	16.2	27%	0.271	8%	0.082	S	C	.	.	H	α-helix	trans	-72.4	-19.4	177.8	-77.7	-73.3	0	0	0	113.1	E247 F249 G253 L304	E247-Y251 HydrophobicContact CB-CD2 4.12Å; E247-Y251 HydrophobicContact CB-CE2 4.25Å; E247-Y251 HydrophobicContact CG-CE2 4.28Å; E247-Y251 VanDerWaalsContact O-CD2 3.24Å; E247-Y251 WeakPolarHBondContact O-CD2 2.97Å; E247-Y251 PolarHBondContact O-N 3.45Å; F249-Y251 PolarHBondContact O-N 3.2Å; Y251-G253 PolarHBondContact O-N 3.44Å; Y251-L304 HydrophobicContact CD1-CD1 3.7Å; Y251-L304 HydrophobicContact CE1-CD1 3.9Å; Y251-L304 HydrophobicContact CE1-CD2 4.27Å; Y251-L304 HydrophobicContact CG-CD1 4.26Å
252	N	96.2	Very high	97.8	Very high	105 Å²	105	16.3 Å²	16.3	56%	0.561	8%	0.083	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	12.7	169.6	-68.6	-21.5	0	0	0	113.1	E248 F249 M250 K254	E248-N252 WeakPolarHBondContact O-CB 3.45Å; E248-N252 PolarHBondContact O-N 2.88Å; E248-N252 PolarHBondContact O-ND2 3.38Å; F249-N252 CarbonylContact O-C 3.6Å; F249-N252 PolarHBondContact O-N 3.15Å; F249-N252 VanDerWaalsContact O-N 3.14Å; M250-N252 VanDerWaalsContact C-N 3.26Å; M250-N252 PolarHBondContact O-N 3.03Å; N252-K254 VanDerWaalsContact C-N 3.33Å; N252-K254 PolarHBondContact O-N 2.74Å
253	G	96.6	Very high	97.8	Very high	25 Å²	25	16.3 Å²	16.3	26%	0.258	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	7.4	176.4	0	0	0	0	0	114.8	F249 M250 Y251	F249-G253 PolarHBondContact O-N 3.07Å; M250-G253 PolarHBondContact O-N 3.33Å; M250-G253 VanDerWaalsContact O-N 3.12Å; Y251-G253 PolarHBondContact O-N 3.44Å
254	K	97.7	Very high	97.7	Very high	80 Å²	80	17 Å²	17	35%	0.348	9%	0.088	S	C	.	.			trans	-84.2	165.3	177.3	-57.7	-62.4	-169.6	171.8	0	111.7	I192 F249 N252 G311 S312	I192-K254 HydrophobicContact CD1-CB 4.35Å; I192-K254 HydrophobicContact CD1-CG 4.42Å; F249-K254 HydrophobicContact CB-CB 4.06Å; F249-K254 VanDerWaalsContact O-CB 3.28Å; F249-K254 WeakPolarHBondContact O-CB 3.4Å; F249-K254 PolarHBondContact O-N 3.2Å; N252-K254 VanDerWaalsContact C-N 3.33Å; N252-K254 PolarHBondContact O-N 2.74Å; K254-G311 WeakPolarHBondContact O-CA 3.32Å; K254-S312 PolarHBondContact O-N 3.35Å
255	H	98.5	Very high	97.6	Very high	26 Å²	26	19.4 Å²	19.4	12%	0.12	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.7	171.8	-55.3	-81.6	0	0	0	110.1	E144 R161 M191 I192 S312	E144-H255 IonicContact OE2-CE1 2.91Å; E144-H255 PolarHBondContact OE2-CE1 2.89Å; E144-H255 VanDerWaalsContact OE2-CE1 3.29Å; E144-H255 IonicContact OE2-ND1 3.39Å; R161-H255 PolarHBondContact NH1-CD2 3.45Å; R161-H255 PolarHBondContact NH1-NE2 2.76Å; M191-H255 WeakPolarHBondContact CA-O 3.37Å; M191-H255 HydrophobicContact CE-CB 3.75Å; M191-H255 HydrophobicContact SD-CB 3.63Å; I192-H255 PolarHBondContact N-O 2.87Å; H255-S312 CarbonylContact C-O 3.58Å; H255-S312 WeakPolarHBondContact CA-O 3.48Å; H255-S312 PolarHBondContact ND1-OG 3.38Å
256	V	98.7	Very high	97.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.5	-175.5	-172	0	0	0	0	110.2	M191 I192 I194 G246 F249 V258 S312 L313 T314	M191-V256 PolarHBondContact SD-N 2.95Å; M191-V256 VanDerWaalsContact SD-N 3.4Å; I192-V256 CarbonylContact O-C 3.51Å; I192-V256 WeakPolarHBondContact O-CA 3.29Å; I194-V256 HydrophobicContact CD1-CG1 4.17Å; I194-V256 HydrophobicContact CG1-CG1 4.3Å; G246-V256 WeakPolarHBondContact O-CG2 3.4Å; F249-V256 HydrophobicContact CB-CG2 3.59Å; V256-V258 HydrophobicContact CG1-CG2 3.87Å; V256-S312 PolarHBondContact N-O 2.91Å; V256-L313 HydrophobicContact CB-CB 4.46Å; V256-L313 HydrophobicContact CB-CG 4.27Å; V256-L313 HydrophobicContact CG1-CG 4.37Å; V256-L313 WeakPolarHBondContact O-CA 3.44Å; V256-T314 PolarHBondContact O-N 3.24Å; V256-T314 PolarHBondContact O-OG1 2.84Å
257	L	98.8	Very high	97.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.9	167.6	173	63.9	0	0	0	108.7	M146 T182 I183 Q186 M191 I192 C193 I194 V259 T314 L316	M146-L257 HydrophobicContact CE-CD1 4.06Å; M146-L257 HydrophobicContact SD-CD1 4.48Å; M146-L257 HydrophobicContact SD-CD2 4.38Å; T182-L257 HydrophobicContact CG2-CD2 3.69Å; I183-L257 HydrophobicContact CG1-CD2 4.18Å; Q186-L257 HydrophobicContact CG-CD2 4.21Å; M191-L257 HydrophobicContact CG-CB 4.06Å; M191-L257 HydrophobicContact SD-CB 4.16Å; I192-L257 PolarHBondContact O-N 3.41Å; C193-L257 CarbonylContact C-O 3.55Å; C193-L257 WeakPolarHBondContact CA-O 3.39Å; I194-L257 PolarHBondContact N-O 2.93Å; L257-V259 HydrophobicContact CG-CG2 4.49Å; L257-T314 CarbonylContact C-O 3.44Å; L257-T314 WeakPolarHBondContact CA-O 3.4Å; L257-T314 HydrophobicContact CD1-CG2 4.24Å; L257-L316 HydrophobicContact CD1-CD1 3.81Å; L257-L316 HydrophobicContact CD1-CG 3.82Å
258	V	98.7	Very high	97.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.3	175.3	-171.9	0	0	0	0	109.7	I194 V196 V256 F260 L313 T314 A315 L316	I194-V258 HydrophobicContact CB-CG1 4.28Å; I194-V258 HydrophobicContact CB-CG2 4.19Å; I194-V258 HydrophobicContact CD1-CG2 4.34Å; I194-V258 HydrophobicContact CG2-CG1 4.41Å; I194-V258 CarbonylContact O-C 2.95Å; I194-V258 WeakPolarHBondContact O-CA 3.45Å; V196-V258 HydrophobicContact CG2-CG1 4.05Å; V256-V258 HydrophobicContact CG1-CG2 3.87Å; V258-F260 HydrophobicContact CB-CE2 4.48Å; V258-F260 HydrophobicContact CB-CZ 4.19Å; V258-F260 HydrophobicContact CG1-CD1 4.13Å; V258-F260 HydrophobicContact CG1-CE1 3.49Å; V258-F260 VanDerWaalsContact CG1-CE1 3.49Å; V258-F260 HydrophobicContact CG1-CE2 4.04Å; V258-F260 HydrophobicContact CG1-CZ 3.45Å; V258-F260 VanDerWaalsContact CG1-CZ 3.45Å; V258-L313 HydrophobicContact CB-CD2 4.22Å; V258-L313 HydrophobicContact CG2-CD1 4.08Å; V258-L313 HydrophobicContact CG2-CD2 3.67Å; V258-L313 HydrophobicContact CG2-CG 3.82Å; V258-T314 PolarHBondContact N-O 3.4Å; V258-A315 CarbonylContact O-C 3.49Å; V258-A315 WeakPolarHBondContact O-CA 3.41Å; V258-L316 PolarHBondContact O-N 3.39Å
259	V	98.8	Very high	97.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.7	175.1	179.4	0	0	0	0	108.8	A179 I183 I194 Y195 V196 L257 L316 F318	A179-V259 HydrophobicContact CB-CB 4.37Å; A179-V259 HydrophobicContact CB-CG1 3.56Å; A179-V259 HydrophobicContact CB-CG2 3.92Å; I183-V259 HydrophobicContact CD1-CG2 4.17Å; I183-V259 HydrophobicContact CG1-CG2 4.49Å; I194-V259 PolarHBondContact O-N 3.48Å; Y195-V259 HydrophobicContact CD2-CB 4Å; Y195-V259 HydrophobicContact CD2-CG1 3.9Å; Y195-V259 HydrophobicContact CE2-CG1 4.08Å; V196-V259 WeakPolarHBondContact CB-O 3.36Å; V196-V259 PolarHBondContact N-O 3.28Å; L257-V259 HydrophobicContact CG-CG2 4.49Å; V259-L316 WeakPolarHBondContact CA-O 3.41Å; V259-L316 HydrophobicContact CG2-CB 4.24Å; V259-L316 HydrophobicContact CG2-CD1 4.33Å; V259-F318 HydrophobicContact CG1-CE1 3.95Å; V259-F318 HydrophobicContact CG1-CE2 4.37Å; V259-F318 HydrophobicContact CG1-CZ 3.86Å
260	F	98.6	Very high	97.2	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.009	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	108.4	175.3	-50.8	-77.3	0	0	0	110.6	V196 I198 P239 V258 D262 L263 L297 L298 A315 L316 P317 F318	V196-F260 HydrophobicContact CB-CD1 4.02Å; V196-F260 HydrophobicContact CG1-CD1 4.45Å; V196-F260 HydrophobicContact CG2-CD1 4Å; V196-F260 HydrophobicContact CG2-CE1 4.19Å; I198-F260 HydrophobicContact CD1-CB 4.13Å; P239-F260 HydrophobicContact CB-CD1 3.75Å; P239-F260 HydrophobicContact CB-CE1 3.82Å; P239-F260 HydrophobicContact CG-CD1 4.4Å; V258-F260 HydrophobicContact CB-CE2 4.48Å; V258-F260 HydrophobicContact CB-CZ 4.19Å; V258-F260 HydrophobicContact CG1-CD1 4.13Å; V258-F260 HydrophobicContact CG1-CE1 3.49Å; V258-F260 VanDerWaalsContact CG1-CE1 3.49Å; V258-F260 HydrophobicContact CG1-CE2 4.04Å; V258-F260 HydrophobicContact CG1-CZ 3.45Å; V258-F260 VanDerWaalsContact CG1-CZ 3.45Å; F260-D262 WeakPolarHBondContact O-CA 3.38Å; F260-L263 HydrophobicContact CB-CD2 3.52Å; F260-L263 HydrophobicContact CB-CG 3.87Å; F260-L263 HydrophobicContact CD1-CD2 4.31Å; F260-L263 HydrophobicContact CD2-CD2 4.44Å; F260-L263 HydrophobicContact CG-CD2 3.87Å; F260-L263 HydrophobicContact CG-CG 4.44Å; F260-L297 HydrophobicContact CE1-CD1 4.26Å; F260-L297 HydrophobicContact CE1-CD2 4.5Å; F260-L297 HydrophobicContact CZ-CD1 4.18Å; F260-L297 HydrophobicContact CZ-CD2 4.47Å; F260-L297 HydrophobicContact CZ-CG 4.39Å; F260-L298 HydrophobicContact CD2-CD2 4.4Å; F260-L298 HydrophobicContact CE2-CD2 4.04Å; F260-A315 HydrophobicContact CE2-CB 4.04Å; F260-L316 PolarHBondContact N-O 3.3Å; F260-P317 HydrophobicContact CD2-CB 4.09Å; F260-F318 VanDerWaalsContact O-CB 3.22Å; F260-F318 WeakPolarHBondContact O-CB 3.28Å; F260-F318 WeakPolarHBondContact O-CG 3.31Å; F260-F318 PolarHBondContact O-N 2.85Å
261	D	97.8	Very high	97.1	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.016	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	82.7	-176.2	-170.1	-5.2	0	0	0	111.8	T176 Y195 V196 I198 Q200 F318	T176-D261 WeakPolarHBondContact CG2-OD2 3.36Å; T176-D261 PolarHBondContact OG1-OD2 3.01Å; Y195-D261 HydrophobicContact CE2-CB 4.06Å; Y195-D261 PolarHBondContact OH-OD2 3.33Å; V196-D261 PolarHBondContact O-N 3.09Å; I198-D261 PolarHBondContact N-O 2.74Å; Q200-D261 WeakPolarHBondContact CG-O 3.36Å; Q200-D261 PolarHBondContact NE2-O 2.96Å; Q200-D261 PolarHBondContact NE2-OD1 3.37Å; D261-F318 HydrophobicContact CB-CD2 3.66Å; D261-F318 HydrophobicContact CB-CE2 3.86Å; D261-F318 VanDerWaalsContact CG-CD2 3.44Å; D261-F318 WeakPolarHBondContact OD1-CD2 3.47Å
262	D	94	Very high	96.9	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.011	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	cis	-139.6	159.9	2.9	63.3	41.6	0	0	0	113.7	I198 F260 S264 K265 Q266 F318	I198-D262 WeakPolarHBondContact CD1-O 3.34Å; F260-D262 WeakPolarHBondContact O-CA 3.38Å; D262-S264 VanDerWaalsContact C-N 3.26Å; D262-S264 PolarHBondContact O-N 3.44Å; D262-S264 WeakPolarHBondContact OD1-CB 3.47Å; D262-S264 PolarHBondContact OD1-N 3.45Å; D262-K265 VanDerWaalsContact CG-NZ 3.31Å; D262-K265 PolarHBondContact O-N 3.08Å; D262-K265 WeakPolarHBondContact OD1-CB 3.22Å; D262-K265 WeakPolarHBondContact OD1-CG 3.42Å; D262-K265 PolarHBondContact OD1-N 3.37Å; D262-K265 IonicContact OD1-NZ 2.66Å; D262-K265 PolarHBondContact OD1-NZ 3.06Å; D262-K265 IonicContact OD2-NZ 3.9Å; D262-K265 PolarHBondContact OD2-NZ 3.07Å; D262-Q266 PolarHBondContact O-N 3.14Å; D262-F318 HydrophobicContact CB-CB 3.59Å
263	L	97.7	Very high	96.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-73.8	-19.1	-178.6	-63.2	-167.8	0	0	0	112.6	I198 P239 F260 K265 Q266 A267 H294 L297 L298 P317 F318	I198-L263 HydrophobicContact CD1-CD2 4.05Å; P239-L263 HydrophobicContact CB-CD2 4.27Å; P239-L263 HydrophobicContact CG-CD2 4.07Å; F260-L263 HydrophobicContact CB-CD2 3.52Å; F260-L263 HydrophobicContact CB-CG 3.87Å; F260-L263 HydrophobicContact CD1-CD2 4.31Å; F260-L263 HydrophobicContact CD2-CD2 4.44Å; F260-L263 HydrophobicContact CG-CD2 3.87Å; F260-L263 HydrophobicContact CG-CG 4.44Å; L263-K265 VanDerWaalsContact C-N 3.32Å; L263-K265 PolarHBondContact O-N 2.84Å; L263-Q266 WeakPolarHBondContact O-CB 3.45Å; L263-Q266 PolarHBondContact O-N 2.8Å; L263-A267 PolarHBondContact O-N 2.74Å; L263-H294 PolarHBondContact O-CE1 3.22Å; L263-L297 HydrophobicContact CD1-CD2 4.2Å; L263-L297 HydrophobicContact CD2-CD2 3.77Å; L263-L298 HydrophobicContact CD1-CD1 4.32Å; L263-L298 HydrophobicContact CD1-CD2 4.35Å; L263-L298 HydrophobicContact CD1-CG 4.49Å; L263-P317 HydrophobicContact CD1-CB 3.42Å; L263-P317 VanDerWaalsContact CD1-CB 3.42Å; L263-P317 HydrophobicContact CG-CB 3.98Å; L263-F318 PolarHBondContact N-O 2.9Å
264	S	96.3	Very high	96.4	Very high	16 Å²	16	20 Å²	20	11%	0.112	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-42.5	171.4	-61.7	0	0	0	0	111.1	D262 A267 V268 V319 E320	D262-S264 VanDerWaalsContact C-N 3.26Å; D262-S264 PolarHBondContact O-N 3.44Å; D262-S264 WeakPolarHBondContact OD1-CB 3.47Å; D262-S264 PolarHBondContact OD1-N 3.45Å; S264-A267 PolarHBondContact O-N 3.12Å; S264-V268 WeakPolarHBondContact O-CG2 3.29Å; S264-V268 PolarHBondContact O-N 3.23Å; S264-V268 VanDerWaalsContact O-N 3.09Å; S264-V319 WeakPolarHBondContact OG-CA 3.26Å; S264-V319 WeakPolarHBondContact OG-CG1 3.38Å; S264-E320 PolarHBondContact OG-N 3.17Å
265	K	96.8	Very high	96.1	Very high	51 Å²	51	20 Å²	20	22%	0.222	10%	0.098	C	C	.	.	H	α-helix	trans	-69.5	-34.5	175.5	-71.9	168.9	-172.8	74.8	0	112.1	I198 D262 L263 V268 A269 E320	I198-K265 HydrophobicContact CG2-CB 4.21Å; I198-K265 WeakPolarHBondContact O-CD 3.45Å; D262-K265 VanDerWaalsContact CG-NZ 3.31Å; D262-K265 PolarHBondContact O-N 3.08Å; D262-K265 WeakPolarHBondContact OD1-CB 3.22Å; D262-K265 WeakPolarHBondContact OD1-CG 3.42Å; D262-K265 PolarHBondContact OD1-N 3.37Å; D262-K265 IonicContact OD1-NZ 2.66Å; D262-K265 PolarHBondContact OD1-NZ 3.06Å; D262-K265 IonicContact OD2-NZ 3.9Å; D262-K265 PolarHBondContact OD2-NZ 3.07Å; L263-K265 VanDerWaalsContact C-N 3.32Å; L263-K265 PolarHBondContact O-N 2.84Å; K265-V268 PolarHBondContact O-N 3.08Å; K265-A269 PolarHBondContact O-N 3.35Å; K265-E320 IonicContact NZ-OE2 3.59Å; K265-E320 PolarHBondContact NZ-OE2 2.88Å
266	Q	97.5	Very high	95.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-46.2	170.4	-167.7	-162.8	14.8	0	0	111.2	I198 F236 P239 D262 L263 V268 A269 Y270	I198-Q266 HydrophobicContact CG2-CB 4.26Å; F236-Q266 PolarHBondContact O-NE2 2.67Å; P239-Q266 HydrophobicContact CG-CB 4.41Å; P239-Q266 HydrophobicContact CG-CG 4.01Å; D262-Q266 PolarHBondContact O-N 3.14Å; L263-Q266 WeakPolarHBondContact O-CB 3.45Å; L263-Q266 PolarHBondContact O-N 2.8Å; Q266-V268 VanDerWaalsContact C-N 3.32Å; Q266-V268 PolarHBondContact O-N 3.18Å; Q266-A269 PolarHBondContact O-N 3.03Å; Q266-Y270 PolarHBondContact O-N 3.16Å
267	A	97.1	Very high	95	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-41.5	178.5	0	0	0	0	0	111.6	L263 S264 Y270 R271 Y286 V290 I330	L263-A267 PolarHBondContact O-N 2.74Å; S264-A267 PolarHBondContact O-N 3.12Å; A267-Y270 PolarHBondContact O-N 3.23Å; A267-R271 WeakPolarHBondContact O-CB 3.48Å; A267-R271 PolarHBondContact O-N 2.75Å; A267-Y286 HydrophobicContact CB-CD1 4.3Å; A267-Y286 HydrophobicContact CB-CE1 3.67Å; A267-Y286 WeakPolarHBondContact O-CE1 3.37Å; A267-V290 HydrophobicContact CB-CG2 4.31Å; A267-I330 HydrophobicContact CB-CD1 3.84Å; A267-I330 HydrophobicContact CB-CG1 4.11Å; A267-I330 HydrophobicContact CB-CG2 4.35Å
268	V	96.2	Very high	94.4	Very high	59 Å²	59	32.6 Å²	32.6	36%	0.358	15%	0.15	S	C	.	.	H	α-helix	trans	-63.1	-44.9	177	171.8	0	0	0	0	111.2	S264 K265 Q266 Y270 R271 E272	S264-V268 WeakPolarHBondContact O-CG2 3.29Å; S264-V268 PolarHBondContact O-N 3.23Å; S264-V268 VanDerWaalsContact O-N 3.09Å; K265-V268 PolarHBondContact O-N 3.08Å; Q266-V268 VanDerWaalsContact C-N 3.32Å; Q266-V268 PolarHBondContact O-N 3.18Å; V268-Y270 PolarHBondContact O-N 2.75Å; V268-R271 WeakPolarHBondContact O-CB 3.17Å; V268-R271 PolarHBondContact O-N 3.09Å; V268-E272 PolarHBondContact O-N 3.48Å
269	A	95	Very high	93.9	Very high	2 Å²	2	35.5 Å²	35.5	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-60.5	-44	174.2	0	0	0	0	0	111.7	A232 L235 K265 Q266 R271 E272 L273	A232-A269 HydrophobicContact CB-CB 4.14Å; A232-A269 WeakPolarHBondContact O-CB 3.38Å; L235-A269 HydrophobicContact CB-CB 3.74Å; L235-A269 HydrophobicContact CD2-CB 4.46Å; K265-A269 PolarHBondContact O-N 3.35Å; Q266-A269 PolarHBondContact O-N 3.03Å; A269-R271 VanDerWaalsContact C-N 3.32Å; A269-R271 PolarHBondContact O-N 3.27Å; A269-E272 WeakPolarHBondContact O-CB 3.34Å; A269-E272 PolarHBondContact O-N 3.04Å; A269-L273 VanDerWaalsContact O-CG 3.3Å; A269-L273 WeakPolarHBondContact O-CG 3.49Å; A269-L273 PolarHBondContact O-N 3.31Å
270	Y	94.8	Very high	93.5	Very high	10 Å²	10	40.7 Å²	40.7	4%	0.039	19%	0.194	C	C	.	.	H	α-helix	trans	-65.9	-34.9	178	-170.6	-121.1	0	0	0	113.1	F236 Q266 A267 V268 S274 R279 P287 D289 L293	F236-Y270 AromaticContact CD2-CD2 3.58Å; F236-Y270 HydrophobicContact CD2-CD2 3.58Å; F236-Y270 HydrophobicContact CD2-CE2 4.28Å; F236-Y270 HydrophobicContact CD2-CG 4.24Å; F236-Y270 AromaticContact CE2-CD2 3.68Å; F236-Y270 HydrophobicContact CE2-CD2 3.68Å; F236-Y270 AromaticContact CE2-CE2 3.92Å; F236-Y270 HydrophobicContact CE2-CE2 3.92Å; F236-Y270 HydrophobicContact CG-CD2 4.32Å; F236-Y270 HydrophobicContact CZ-CE2 4.45Å; Q266-Y270 PolarHBondContact O-N 3.16Å; A267-Y270 PolarHBondContact O-N 3.23Å; V268-Y270 PolarHBondContact O-N 2.75Å; Y270-S274 VanDerWaalsContact O-CB 3.31Å; Y270-S274 WeakPolarHBondContact O-CB 3.12Å; Y270-S274 PolarHBondContact O-N 3.18Å; Y270-S274 PolarHBondContact O-OG 3.26Å; Y270-R279 PolarHBondContact OH-NH1 2.73Å; Y270-P287 HydrophobicContact CD1-CG 3.5Å; Y270-P287 HydrophobicContact CE1-CB 4.35Å; Y270-P287 HydrophobicContact CE1-CG 3.36Å; Y270-D289 PolarHBondContact OH-OD1 3.09Å; Y270-D289 PolarHBondContact OH-OD2 2.98Å; Y270-L293 HydrophobicContact CD1-CB 4.44Å; Y270-L293 HydrophobicContact CD1-CD1 4.29Å; Y270-L293 HydrophobicContact CD1-CD2 3.75Å; Y270-L293 HydrophobicContact CD1-CG 4.41Å; Y270-L293 HydrophobicContact CD2-CD1 4.29Å; Y270-L293 HydrophobicContact CE1-CB 4.48Å; Y270-L293 HydrophobicContact CG-CD1 4.17Å; Y270-L293 HydrophobicContact CG-CD2 3.83Å
271	R	95.5	Very high	93.3	Very high	70 Å²	70	44.6 Å²	44.6	26%	0.264	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-48.3	171.8	178.8	176	68.5	-172.6	-1.8	111.5	A267 V268 A269 S274 L275 E284 A285 Y286	A267-R271 WeakPolarHBondContact O-CB 3.48Å; A267-R271 PolarHBondContact O-N 2.75Å; V268-R271 WeakPolarHBondContact O-CB 3.17Å; V268-R271 PolarHBondContact O-N 3.09Å; A269-R271 VanDerWaalsContact C-N 3.32Å; A269-R271 PolarHBondContact O-N 3.27Å; R271-S274 PolarHBondContact O-N 3.01Å; R271-L275 HydrophobicContact CG-CD1 3.98Å; R271-L275 HydrophobicContact CG-CG 4.46Å; R271-L275 VanDerWaalsContact O-CG 3.29Å; R271-L275 WeakPolarHBondContact O-CG 3.36Å; R271-L275 PolarHBondContact O-N 2.97Å; R271-E284 PolarHBondContact NH1-O 3.38Å; R271-E284 VanDerWaalsContact NH1-O 3.09Å; R271-A285 VanDerWaalsContact CG-O 3.29Å; R271-A285 WeakPolarHBondContact CG-O 3.44Å; R271-Y286 HydrophobicContact CB-CD1 3.74Å; R271-Y286 HydrophobicContact CB-CE1 4Å; R271-Y286 HydrophobicContact CG-CD1 4.27Å
272	E	93.7	Very high	93.1	Very high	92 Å²	92	46.5 Å²	46.5	43%	0.43	24%	0.24	S	C	.	.	H	α-helix	trans	-56.5	-51.8	177.1	-177.6	-179.4	157.1	0	0	111.1	A232 V268 A269 S274 L275 L276	A232-E272 HydrophobicContact CB-CG 4.42Å; V268-E272 PolarHBondContact O-N 3.48Å; A269-E272 WeakPolarHBondContact O-CB 3.34Å; A269-E272 PolarHBondContact O-N 3.04Å; E272-S274 VanDerWaalsContact C-N 3.32Å; E272-S274 PolarHBondContact O-N 2.78Å; E272-L275 PolarHBondContact O-N 2.82Å; E272-L276 HydrophobicContact CG-CD1 3.95Å; E272-L276 WeakPolarHBondContact O-CB 3.45Å; E272-L276 VanDerWaalsContact O-CG 3.32Å; E272-L276 WeakPolarHBondContact O-CG 3.36Å; E272-L276 PolarHBondContact O-N 3.14Å
273	L	90.7	Very high	93.1	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-58.5	-43.1	178.1	-63.7	172.1	0	0	0	112.5	I74 A232 P233 F236 A269 L276 L277	I74-L273 HydrophobicContact CD1-CD1 4.48Å; I74-L273 HydrophobicContact CG2-CD2 4.16Å; A232-L273 HydrophobicContact CB-CD2 3.99Å; A232-L273 HydrophobicContact CB-CG 4.09Å; P233-L273 HydrophobicContact CG-CD1 4.37Å; P233-L273 HydrophobicContact CG-CD2 3.6Å; F236-L273 HydrophobicContact CB-CD1 3.8Å; F236-L273 HydrophobicContact CD1-CD1 4.16Å; F236-L273 HydrophobicContact CG-CD1 4.07Å; A269-L273 VanDerWaalsContact O-CG 3.3Å; A269-L273 WeakPolarHBondContact O-CG 3.49Å; A269-L273 PolarHBondContact O-N 3.31Å; L273-L276 PolarHBondContact O-N 2.71Å; L273-L277 WeakPolarHBondContact O-CB 3.37Å; L273-L277 VanDerWaalsContact O-CG 3.28Å; L273-L277 WeakPolarHBondContact O-CG 3.42Å; L273-L277 PolarHBondContact O-N 3.22Å
274	S	90.9	Very high	92.8	Very high	5 Å²	5	57.8 Å²	57.8	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-40.7	-179.8	-63.6	0	0	0	0	112.2	Y270 R271 E272 L277 R278 R279 P287	Y270-S274 VanDerWaalsContact O-CB 3.31Å; Y270-S274 WeakPolarHBondContact O-CB 3.12Å; Y270-S274 PolarHBondContact O-N 3.18Å; Y270-S274 PolarHBondContact O-OG 3.26Å; R271-S274 PolarHBondContact O-N 3.01Å; E272-S274 VanDerWaalsContact C-N 3.32Å; E272-S274 PolarHBondContact O-N 2.78Å; S274-L277 CarbonylContact O-C 3.58Å; S274-L277 PolarHBondContact O-N 2.71Å; S274-R278 PolarHBondContact O-N 2.99Å; S274-R279 WeakPolarHBondContact O-CB 3.4Å; S274-R279 PolarHBondContact O-N 3.34Å; S274-P287 WeakPolarHBondContact OG-CG 3.31Å
275	L	91.9	Very high	92.8	Very high	79 Å²	79	58.9 Å²	58.9	41%	0.414	30%	0.297	S	S	.	.	H	α-helix	trans	-67.8	-41.9	177.1	-70.7	173.4	0	0	0	111.8	R271 E272 L277 R278 P281	R271-L275 HydrophobicContact CG-CD1 3.98Å; R271-L275 HydrophobicContact CG-CG 4.46Å; R271-L275 VanDerWaalsContact O-CG 3.29Å; R271-L275 WeakPolarHBondContact O-CG 3.36Å; R271-L275 PolarHBondContact O-N 2.97Å; E272-L275 PolarHBondContact O-N 2.82Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L275-R278 WeakPolarHBondContact O-CA 3.19Å; L275-R278 PolarHBondContact O-N 2.77Å; L275-P281 HydrophobicContact CD2-CB 3.94Å; L275-P281 HydrophobicContact CD2-CG 4.25Å
276	L	89.3	Confident	92.7	Very high	58 Å²	58	57.4 Å²	57.4	30%	0.304	29%	0.29	S	S	.	.	H	α-helix	trans	-66.2	-36.2	176.5	-69.4	172.9	0	0	0	111.8	D36 I38 E272 L273 R278	D36-L276 HydrophobicContact CB-CD1 3.72Å; D36-L276 HydrophobicContact CB-CD2 3.75Å; D36-L276 HydrophobicContact CB-CG 4.38Å; D36-L276 WeakPolarHBondContact O-CD1 3.47Å; I38-L276 HydrophobicContact CD1-CB 3.28Å; I38-L276 HydrophobicContact CD1-CD1 4.44Å; I38-L276 HydrophobicContact CD1-CG 4.49Å; I38-L276 HydrophobicContact CG1-CB 4.1Å; I38-L276 HydrophobicContact CG1-CD1 4.5Å; E272-L276 HydrophobicContact CG-CD1 3.95Å; E272-L276 WeakPolarHBondContact O-CB 3.45Å; E272-L276 VanDerWaalsContact O-CG 3.32Å; E272-L276 WeakPolarHBondContact O-CG 3.36Å; E272-L276 PolarHBondContact O-N 3.14Å; L273-L276 PolarHBondContact O-N 2.71Å; L276-R278 PolarHBondContact O-N 2.93Å
277	L	85.5	Confident	92.6	Very high	16 Å²	16	57.5 Å²	57.5	8%	0.084	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	2.8	169.2	-71.4	173.8	0	0	0	113.5	I38 Q64 I74 L273 S274 L275 R279	I38-L277 HydrophobicContact CD1-CB 4.42Å; I38-L277 HydrophobicContact CD1-CD2 3.68Å; I38-L277 HydrophobicContact CD1-CG 3.6Å; I38-L277 HydrophobicContact CG2-CD2 4.03Å; Q64-L277 HydrophobicContact CB-CD1 4.39Å; Q64-L277 HydrophobicContact CG-CD1 3.82Å; I74-L277 HydrophobicContact CD1-CD1 4.25Å; I74-L277 HydrophobicContact CG1-CD1 4.42Å; L273-L277 WeakPolarHBondContact O-CB 3.37Å; L273-L277 VanDerWaalsContact O-CG 3.28Å; L273-L277 WeakPolarHBondContact O-CG 3.42Å; L273-L277 PolarHBondContact O-N 3.22Å; S274-L277 CarbonylContact O-C 3.58Å; S274-L277 PolarHBondContact O-N 2.71Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L277-R279 HydrophobicContact CB-CG 4.31Å; L277-R279 PolarHBondContact O-N 3.11Å
278	R	85.9	Confident	92.4	Very high	218 Å²	218	60.9 Å²	60.9	82%	0.823	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	31.6	-178.6	-56.3	-172.5	176.2	-162.7	-0.3	114	S274 L275 L276	S274-R278 PolarHBondContact O-N 2.99Å; L275-R278 WeakPolarHBondContact O-CA 3.19Å; L275-R278 PolarHBondContact O-N 2.77Å; L276-R278 PolarHBondContact O-N 2.93Å
279	R	87.4	Confident	92.3	Very high	61 Å²	61	60.5 Å²	60.5	23%	0.23	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-71.6	143.4	169.2	-65.7	-176.3	174.6	-167	-1.5	109.5	N65 Y270 S274 L277 D289	N65-R279 PolarHBondContact OD1-NH2 2.86Å; Y270-R279 PolarHBondContact OH-NH1 2.73Å; S274-R279 WeakPolarHBondContact O-CB 3.4Å; S274-R279 PolarHBondContact O-N 3.34Å; L277-R279 HydrophobicContact CB-CG 4.31Å; L277-R279 PolarHBondContact O-N 3.11Å; R279-D289 IonicContact NH1-OD2 2.75Å
280	P	92	Very high	92.3	Very high	109 Å²	109	60.4 Å²	60.4	71%	0.708	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-63.2	128.5	179.9	24.9	-33.2	0	0	0	111
281	P	94.3	Very high	92.4	Very high	83 Å²	83	64 Å²	64	54%	0.539	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-79.2	156.7	177.1	31	-33.8	0	0	0	112.5	L275 A285	L275-P281 HydrophobicContact CD2-CB 3.94Å; L275-P281 HydrophobicContact CD2-CG 4.25Å; P281-A285 HydrophobicContact CB-CB 4.39Å
282	G	93.7	Very high	92.4	Very high	43 Å²	43	67 Å²	67	44%	0.443	35%	0.349	S	S	.	.			trans	-116.4	-141.9	173.5	0	0	0	0	0	112.9	A285 Y286	G282-A285 PolarHBondContact O-N 3.01Å; G282-Y286 WeakPolarHBondContact CA-O 3.33Å; G282-Y286 PolarHBondContact N-O 3.25Å
283	R	92.6	Very high	92.5	Very high	150 Å²	150	62.7 Å²	62.7	57%	0.566	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-61.9	135	-179.8	-176.3	174.7	174.6	179.1	-2.6	110.8	A285 Y286 Y329	R283-A285 PolarHBondContact O-N 3.3Å; R283-A285 VanDerWaalsContact O-N 3.08Å; R283-Y286 PolarHBondContact O-N 3.5Å; R283-Y286 VanDerWaalsContact O-N 3.12Å; R283-Y329 HydrophobicContact CB-CD1 4.16Å; R283-Y329 HydrophobicContact CB-CE1 4.24Å; R283-Y329 HydrophobicContact CB-CG 4.4Å; R283-Y329 HydrophobicContact CG-CD1 4.37Å; R283-Y329 HydrophobicContact CG-CG 4.22Å
284	E	92.3	Very high	92.9	Very high	89 Å²	89	62.7 Å²	62.7	42%	0.416	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	53.7	27.4	-176.8	-65	166.7	-144.4	0	0	113.4	R271 Y286 Y329	R271-E284 PolarHBondContact NH1-O 3.38Å; R271-E284 VanDerWaalsContact NH1-O 3.09Å; E284-Y286 HydrophobicContact CB-CD2 3.76Å; E284-Y286 HydrophobicContact CB-CE2 3.83Å; E284-Y286 PolarHBondContact O-N 3.34Å; E284-Y329 VanDerWaalsContact OE1-CB 3.29Å; E284-Y329 WeakPolarHBondContact OE1-CB 3.23Å; E284-Y329 PolarHBondContact OE1-N 2.67Å
285	A	95.3	Very high	93.2	Very high	40 Å²	40	63.4 Å²	63.4	33%	0.331	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	63.4	7.9	-176.2	0	0	0	0	0	116.3	R271 P281 G282 R283	R271-A285 VanDerWaalsContact CG-O 3.29Å; R271-A285 WeakPolarHBondContact CG-O 3.44Å; P281-A285 HydrophobicContact CB-CB 4.39Å; G282-A285 PolarHBondContact O-N 3.01Å; R283-A285 PolarHBondContact O-N 3.3Å; R283-A285 VanDerWaalsContact O-N 3.08Å
286	Y	95.9	Very high	93.4	Very high	19 Å²	19	61.7 Å²	61.7	8%	0.075	32%	0.322	C	S	.	.			trans	-69.8	149.9	173.1	-68.5	-79.1	0	0	0	111.6	A267 R271 G282 R283 E284 V290 Y329 I330	A267-Y286 HydrophobicContact CB-CD1 4.3Å; A267-Y286 HydrophobicContact CB-CE1 3.67Å; A267-Y286 WeakPolarHBondContact O-CE1 3.37Å; R271-Y286 HydrophobicContact CB-CD1 3.74Å; R271-Y286 HydrophobicContact CB-CE1 4Å; R271-Y286 HydrophobicContact CG-CD1 4.27Å; G282-Y286 WeakPolarHBondContact CA-O 3.33Å; G282-Y286 PolarHBondContact N-O 3.25Å; R283-Y286 PolarHBondContact O-N 3.5Å; R283-Y286 VanDerWaalsContact O-N 3.12Å; E284-Y286 HydrophobicContact CB-CD2 3.76Å; E284-Y286 HydrophobicContact CB-CE2 3.83Å; E284-Y286 PolarHBondContact O-N 3.34Å; Y286-V290 HydrophobicContact CD1-CG2 4Å; Y286-V290 HydrophobicContact CG-CG2 4.39Å; Y286-Y329 AromaticContact CD2-CD1 3.91Å; Y286-Y329 HydrophobicContact CD2-CD1 3.91Å; Y286-Y329 HydrophobicContact CD2-CE1 4.48Å; Y286-Y329 HydrophobicContact CG-CD1 4.45Å; Y286-I330 HydrophobicContact CD1-CD1 4.04Å; Y286-I330 HydrophobicContact CD2-CD1 4.12Å; Y286-I330 HydrophobicContact CD2-CG1 4.32Å; Y286-I330 HydrophobicContact CE1-CD1 3.94Å; Y286-I330 HydrophobicContact CE1-CG1 4.07Å; Y286-I330 HydrophobicContact CE2-CD1 4Å; Y286-I330 HydrophobicContact CE2-CG1 3.72Å; Y286-I330 HydrophobicContact CG-CD1 4.14Å
287	P	93.9	Very high	93.8	Very high	3 Å²	3	59 Å²	59	2%	0.019	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-67.1	156.9	174.6	32.7	-38.7	0	0	0	111.1	Y270 S274 D289 V290	Y270-P287 HydrophobicContact CD1-CG 3.5Å; Y270-P287 HydrophobicContact CE1-CB 4.35Å; Y270-P287 HydrophobicContact CE1-CG 3.36Å; S274-P287 WeakPolarHBondContact OG-CG 3.31Å; P287-D289 WeakPolarHBondContact CB-OD1 3.31Å; P287-D289 PolarHBondContact O-N 3.41Å; P287-D289 VanDerWaalsContact O-N 3.12Å; P287-V290 HydrophobicContact CG-CB 4.35Å; P287-V290 WeakPolarHBondContact O-CB 3.41Å; P287-V290 WeakPolarHBondContact O-CG1 3.22Å; P287-V290 PolarHBondContact O-N 3.33Å; P287-V290 VanDerWaalsContact O-N 3.13Å
288	G	92.6	Very high	94.4	Very high	70 Å²	70	58.3 Å²	58.3	72%	0.722	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.9	-176.1	0	0	0	0	0	114.9
289	D	94.5	Very high	95	Very high	51 Å²	51	50.7 Å²	50.7	27%	0.273	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	13.5	179.9	63.5	-18.7	0	0	0	113.6	Y270 R279 P287 F291 Y292 L293	Y270-D289 PolarHBondContact OH-OD1 3.09Å; Y270-D289 PolarHBondContact OH-OD2 2.98Å; R279-D289 IonicContact NH1-OD2 2.75Å; P287-D289 WeakPolarHBondContact CB-OD1 3.31Å; P287-D289 PolarHBondContact O-N 3.41Å; P287-D289 VanDerWaalsContact O-N 3.12Å; D289-F291 PolarHBondContact O-N 3.38Å; D289-Y292 CarbonylContact O-C 3.57Å; D289-Y292 WeakPolarHBondContact O-CA 3.38Å; D289-Y292 WeakPolarHBondContact O-CB 3.31Å; D289-Y292 PolarHBondContact O-N 3.42Å; D289-L293 PolarHBondContact O-N 2.82Å
290	V	95.6	Very high	95.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.9	-29.9	175.2	71.7	0	0	0	0	112.5	A267 Y286 P287 L293 H294 Y329 I330	A267-V290 HydrophobicContact CB-CG2 4.31Å; Y286-V290 HydrophobicContact CD1-CG2 4Å; Y286-V290 HydrophobicContact CG-CG2 4.39Å; P287-V290 HydrophobicContact CG-CB 4.35Å; P287-V290 WeakPolarHBondContact O-CB 3.41Å; P287-V290 WeakPolarHBondContact O-CG1 3.22Å; P287-V290 PolarHBondContact O-N 3.33Å; P287-V290 VanDerWaalsContact O-N 3.13Å; V290-L293 WeakPolarHBondContact O-CB 3.35Å; V290-H294 PolarHBondContact O-CD2 3.29Å; V290-H294 VanDerWaalsContact O-CD2 3.29Å; V290-H294 PolarHBondContact O-N 2.95Å; V290-Y329 HydrophobicContact CG1-CD1 4.46Å; V290-Y329 HydrophobicContact CG1-CE1 3.55Å; V290-I330 HydrophobicContact CG1-CD1 4.38Å; V290-I330 HydrophobicContact CG2-CD1 3.74Å
291	F	97.1	Very high	95.8	Very high	85 Å²	85	42.8 Å²	42.8	37%	0.373	23%	0.234	S	C	.	.	H	α-helix	trans	-64	-46.8	171	179.7	-88.5	0	0	0	111	D289 L293 H294 S295 N333 S336 I337	D289-F291 PolarHBondContact O-N 3.38Å; F291-L293 VanDerWaalsContact C-N 3.28Å; F291-L293 PolarHBondContact O-N 3.5Å; F291-H294 PolarHBondContact O-N 2.84Å; F291-S295 WeakPolarHBondContact O-CB 3.5Å; F291-S295 PolarHBondContact O-N 3.34Å; F291-S295 PolarHBondContact O-OG 3.38Å; F291-N333 HydrophobicContact CD2-CB 4.02Å; F291-S336 WeakPolarHBondContact CE2-OG 3.38Å; F291-I337 HydrophobicContact CD2-CD1 4.04Å; F291-I337 HydrophobicContact CD2-CG1 4.39Å; F291-I337 HydrophobicContact CE2-CD1 3.77Å; F291-I337 HydrophobicContact CE2-CG1 3.61Å; F291-I337 HydrophobicContact CZ-CD1 4.11Å; F291-I337 HydrophobicContact CZ-CG1 3.69Å
292	Y	96.4	Very high	95.9	Very high	135 Å²	135	39 Å²	39	53%	0.529	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-31.5	179.8	-179.5	-113.4	0	0	0	112.6	D289 S295 R296	D289-Y292 CarbonylContact O-C 3.57Å; D289-Y292 WeakPolarHBondContact O-CA 3.38Å; D289-Y292 WeakPolarHBondContact O-CB 3.31Å; D289-Y292 PolarHBondContact O-N 3.42Å; Y292-S295 WeakPolarHBondContact CA-OG 3.37Å; Y292-S295 PolarHBondContact O-OG 2.95Å; Y292-R296 HydrophobicContact CD2-CB 4.48Å; Y292-R296 HydrophobicContact CE2-CB 4.12Å; Y292-R296 VanDerWaalsContact O-CB 3.23Å; Y292-R296 WeakPolarHBondContact O-CB 3.45Å; Y292-R296 WeakPolarHBondContact O-CG 3.29Å; Y292-R296 PolarHBondContact O-N 2.87Å; Y292-R296 PolarHBondContact O-NE 3.05Å
293	L	95.4	Very high	96.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-52.9	-57.2	169.3	178.2	80.1	0	0	0	111.4	F236 Y240 Y270 D289 V290 F291 L297	F236-L293 HydrophobicContact CD2-CD1 3.73Å; F236-L293 HydrophobicContact CE2-CD1 3.34Å; Y240-L293 HydrophobicContact CE2-CD1 3.96Å; Y240-L293 WeakPolarHBondContact OH-CD1 3.41Å; Y240-L293 PolarHBondContact OH-O 2.85Å; Y270-L293 HydrophobicContact CD1-CB 4.44Å; Y270-L293 HydrophobicContact CD1-CD1 4.29Å; Y270-L293 HydrophobicContact CD1-CD2 3.75Å; Y270-L293 HydrophobicContact CD1-CG 4.41Å; Y270-L293 HydrophobicContact CD2-CD1 4.29Å; Y270-L293 HydrophobicContact CE1-CB 4.48Å; Y270-L293 HydrophobicContact CG-CD1 4.17Å; Y270-L293 HydrophobicContact CG-CD2 3.83Å; D289-L293 PolarHBondContact O-N 2.82Å; V290-L293 WeakPolarHBondContact O-CB 3.35Å; F291-L293 VanDerWaalsContact C-N 3.28Å; F291-L293 PolarHBondContact O-N 3.5Å; L293-L297 PolarHBondContact O-N 2.85Å
294	H	98	Very high	96.4	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-74.5	-35.5	-176.1	-69.7	-118.2	0	0	0	111.9	L263 V290 F291 L297 L298 V334 I337	L263-H294 PolarHBondContact O-CE1 3.22Å; V290-H294 PolarHBondContact O-CD2 3.29Å; V290-H294 VanDerWaalsContact O-CD2 3.29Å; V290-H294 PolarHBondContact O-N 2.95Å; F291-H294 PolarHBondContact O-N 2.84Å; H294-L297 PolarHBondContact O-N 3.33Å; H294-L298 WeakPolarHBondContact O-CB 3.37Å; H294-L298 WeakPolarHBondContact O-CG 3.38Å; H294-L298 PolarHBondContact O-N 3.15Å; H294-V334 WeakPolarHBondContact ND1-CG2 3.36Å; H294-I337 HydrophobicContact CB-CD1 3.75Å
295	S	97.4	Very high	96.7	Very high	21 Å²	21	26.6 Å²	26.6	15%	0.147	15%	0.148	C	C	.	.	H	α-helix	trans	-68	-44.1	179.8	74.8	0	0	0	0	111.4	F291 Y292 L297 L298 E299	F291-S295 WeakPolarHBondContact O-CB 3.5Å; F291-S295 PolarHBondContact O-N 3.34Å; F291-S295 PolarHBondContact O-OG 3.38Å; Y292-S295 WeakPolarHBondContact CA-OG 3.37Å; Y292-S295 PolarHBondContact O-OG 2.95Å; S295-L297 PolarHBondContact O-N 3Å; S295-L298 PolarHBondContact O-N 2.63Å; S295-E299 WeakPolarHBondContact O-CB 3.47Å; S295-E299 VanDerWaalsContact O-CG 3.3Å; S295-E299 WeakPolarHBondContact O-CG 3.49Å; S295-E299 PolarHBondContact O-N 3.17Å
296	R	96.4	Very high	96.7	Very high	43 Å²	43	30 Å²	30	16%	0.162	16%	0.161	C	C	.	.	H	α-helix	trans	-63.2	-32.7	177.9	93	-176.6	87.8	162.1	2.1	111.8	E130 Y240 Y292 R300	E130-R296 IonicContact OE1-CZ 2.76Å; E130-R296 IonicContact OE1-NH1 3.23Å; E130-R296 PolarHBondContact OE1-NH1 3.26Å; E130-R296 WeakPolarHBondContact OE2-CD 3.29Å; E130-R296 IonicContact OE2-NH1 2.67Å; Y240-R296 HydrophobicContact CE1-CG 3.65Å; Y240-R296 WeakPolarHBondContact OH-CD 3.37Å; Y240-R296 WeakPolarHBondContact OH-CG 3.42Å; Y240-R296 PolarHBondContact OH-NE 2.82Å; Y292-R296 HydrophobicContact CD2-CB 4.48Å; Y292-R296 HydrophobicContact CE2-CB 4.12Å; Y292-R296 VanDerWaalsContact O-CB 3.23Å; Y292-R296 WeakPolarHBondContact O-CB 3.45Å; Y292-R296 WeakPolarHBondContact O-CG 3.29Å; Y292-R296 PolarHBondContact O-N 2.87Å; Y292-R296 PolarHBondContact O-NE 3.05Å; R296-R300 WeakPolarHBondContact O-CD 3.37Å; R296-R300 WeakPolarHBondContact O-CG 3.47Å
297	L	98	Very high	96.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-70.1	-57.4	176.1	172.4	68.5	0	0	0	110.5	P239 Y240 T243 F260 L263 L293 H294 S295 E299 R300	P239-L297 HydrophobicContact CB-CD1 3.72Å; P239-L297 HydrophobicContact CB-CD2 3.49Å; P239-L297 VanDerWaalsContact CB-CD2 3.49Å; P239-L297 HydrophobicContact CB-CG 4.26Å; P239-L297 HydrophobicContact CG-CD2 4.45Å; P239-L297 WeakPolarHBondContact O-CD1 3.31Å; Y240-L297 HydrophobicContact CD1-CB 4.44Å; Y240-L297 HydrophobicContact CD1-CD1 3.89Å; Y240-L297 HydrophobicContact CE1-CB 3.76Å; Y240-L297 HydrophobicContact CE1-CD1 4.06Å; Y240-L297 HydrophobicContact CG-CD1 4.46Å; T243-L297 VanDerWaalsContact OG1-CD1 3.28Å; T243-L297 WeakPolarHBondContact OG1-CD1 3.43Å; F260-L297 HydrophobicContact CE1-CD1 4.26Å; F260-L297 HydrophobicContact CE1-CD2 4.5Å; F260-L297 HydrophobicContact CZ-CD1 4.18Å; F260-L297 HydrophobicContact CZ-CD2 4.47Å; F260-L297 HydrophobicContact CZ-CG 4.39Å; L263-L297 HydrophobicContact CD1-CD2 4.2Å; L263-L297 HydrophobicContact CD2-CD2 3.77Å; L293-L297 PolarHBondContact O-N 2.85Å; H294-L297 PolarHBondContact O-N 3.33Å; S295-L297 PolarHBondContact O-N 3Å; L297-E299 PolarHBondContact O-N 2.8Å; L297-R300 WeakPolarHBondContact O-CB 3.37Å; L297-R300 PolarHBondContact O-N 2.9Å
298	L	98.2	Very high	96.8	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-71.3	-33.5	-170.5	-70.3	175.1	0	0	0	112.1	R164 F260 L263 H294 S295 R300 A301 A315 P317 V334 I337 T338	R164-L298 WeakPolarHBondContact CD-O 3.09Å; F260-L298 HydrophobicContact CD2-CD2 4.4Å; F260-L298 HydrophobicContact CE2-CD2 4.04Å; L263-L298 HydrophobicContact CD1-CD1 4.32Å; L263-L298 HydrophobicContact CD1-CD2 4.35Å; L263-L298 HydrophobicContact CD1-CG 4.49Å; H294-L298 WeakPolarHBondContact O-CB 3.37Å; H294-L298 WeakPolarHBondContact O-CG 3.38Å; H294-L298 PolarHBondContact O-N 3.15Å; S295-L298 PolarHBondContact O-N 2.63Å; L298-R300 PolarHBondContact O-N 3.49Å; L298-R300 VanDerWaalsContact O-N 3.11Å; L298-A301 VanDerWaalsContact O-CB 3.27Å; L298-A301 WeakPolarHBondContact O-CB 3.4Å; L298-A301 PolarHBondContact O-N 2.84Å; L298-A315 HydrophobicContact CD2-CB 4.24Å; L298-P317 HydrophobicContact CD1-CG 4.26Å; L298-P317 HydrophobicContact CD2-CB 4.02Å; L298-P317 HydrophobicContact CD2-CG 3.85Å; L298-V334 HydrophobicContact CD1-CG1 4.11Å; L298-I337 HydrophobicContact CB-CG2 3.71Å; L298-I337 HydrophobicContact CD1-CB 4.3Å; L298-I337 HydrophobicContact CD1-CG2 3.63Å; L298-I337 HydrophobicContact CG-CG2 4.28Å; L298-T338 HydrophobicContact CD1-CG2 4.03Å
299	E	97.7	Very high	96.9	Very high	59 Å²	59	39.3 Å²	39.3	28%	0.276	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.3	177.3	-76.3	-63.2	149.8	0	0	114.5	A133 R139 S295 L297 A301	A133-E299 HydrophobicContact CB-CB 4.13Å; A133-E299 WeakPolarHBondContact CB-O 3.38Å; R139-E299 IonicContact CZ-OE2 3.61Å; R139-E299 VanDerWaalsContact CZ-OE2 3.25Å; R139-E299 IonicContact NH1-OE2 2.71Å; R139-E299 PolarHBondContact NH1-OE2 2.83Å; R139-E299 PolarHBondContact NH2-O 2.96Å; R139-E299 IonicContact NH2-OE2 3.34Å; R139-E299 PolarHBondContact NH2-OE2 3.23Å; S295-E299 WeakPolarHBondContact O-CB 3.47Å; S295-E299 VanDerWaalsContact O-CG 3.3Å; S295-E299 WeakPolarHBondContact O-CG 3.49Å; S295-E299 PolarHBondContact O-N 3.17Å; L297-E299 PolarHBondContact O-N 2.8Å; E299-A301 VanDerWaalsContact C-N 3.27Å
300	R	98.1	Very high	97	Very high	1 Å²	1	37.3 Å²	37.3	0%	0.004	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-21.4	170.5	-68.3	169.7	65.3	179.3	2.8	112.5	V129 A133 T243 E247 R296 L297 L298 A302	V129-R300 PolarHBondContact O-NH1 3.42Å; A133-R300 HydrophobicContact CB-CG 4.02Å; T243-R300 HydrophobicContact CG2-CB 3.74Å; E247-R300 WeakPolarHBondContact OE1-CB 3.1Å; E247-R300 IonicContact OE1-CZ 2.79Å; E247-R300 IonicContact OE1-NE 2.97Å; E247-R300 PolarHBondContact OE1-NE 3.22Å; E247-R300 IonicContact OE1-NH2 3.9Å; E247-R300 PolarHBondContact OE1-NH2 3.07Å; E247-R300 IonicContact OE2-CZ 2.9Å; E247-R300 IonicContact OE2-NE 3.09Å; E247-R300 IonicContact OE2-NH2 2.69Å; E247-R300 PolarHBondContact OE2-NH2 2.78Å; R296-R300 WeakPolarHBondContact O-CD 3.37Å; R296-R300 WeakPolarHBondContact O-CG 3.47Å; L297-R300 WeakPolarHBondContact O-CB 3.37Å; L297-R300 PolarHBondContact O-N 2.9Å; L298-R300 PolarHBondContact O-N 3.49Å; L298-R300 VanDerWaalsContact O-N 3.11Å; R300-A302 PolarHBondContact O-N 2.85Å
301	A	97.8	Very high	97.1	Very high	3 Å²	3	37.3 Å²	37.3	3%	0.025	19%	0.192	C	C	.	.			trans	-80.4	106.7	173.6	0	0	0	0	0	110.8	R164 L298 E299 L313 A315	R164-A301 HydrophobicContact CG-CB 3.93Å; R164-A301 PolarHBondContact NH1-O 3.03Å; L298-A301 VanDerWaalsContact O-CB 3.27Å; L298-A301 WeakPolarHBondContact O-CB 3.4Å; L298-A301 PolarHBondContact O-N 2.84Å; E299-A301 VanDerWaalsContact C-N 3.27Å; A301-L313 CarbonylContact C-O 3.57Å; A301-L313 WeakPolarHBondContact CA-O 3.39Å; A301-L313 HydrophobicContact CB-CD2 3.42Å; A301-L313 VanDerWaalsContact CB-CD2 3.42Å; A301-L313 WeakPolarHBondContact CB-O 3.41Å; A301-A315 HydrophobicContact CB-CB 3.59Å
302	A	97.9	Very high	97.2	Very high	2 Å²	2	33.3 Å²	33.3	2%	0.017	17%	0.174	C	C	.	.			trans	-149.9	170.2	179.6	0	0	0	0	0	111.7	P134 R139 M250 R300 S312 L313	P134-A302 HydrophobicContact CG-CB 3.83Å; R139-A302 HydrophobicContact CG-CB 4.03Å; M250-A302 HydrophobicContact CE-CB 4.25Å; M250-A302 WeakPolarHBondContact CE-O 3.31Å; R300-A302 PolarHBondContact O-N 2.85Å; A302-S312 CarbonylContact O-C 3.56Å; A302-S312 WeakPolarHBondContact O-CA 3.16Å; A302-L313 PolarHBondContact N-O 3.25Å; A302-L313 PolarHBondContact O-N 3.3Å
303	K	98.2	Very high	97.3	Very high	7 Å²	7	26.9 Å²	26.9	3%	0.03	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-97	124.9	161.2	-175.9	150.5	167.8	80.5	0	109.3	R139 K140 E144 R161 G310	R139-K303 CarbonylContact C-O 3.54Å; R139-K303 VanDerWaalsContact CA-O 3.26Å; R139-K303 WeakPolarHBondContact CA-O 3.34Å; K140-K303 HydrophobicContact CB-CG 4.41Å; K140-K303 PolarHBondContact N-O 3.14Å; E144-K303 VanDerWaalsContact CD-CE 3.48Å; E144-K303 VanDerWaalsContact OE1-CE 3.23Å; E144-K303 WeakPolarHBondContact OE1-CE 3.19Å; E144-K303 IonicContact OE1-NZ 2.66Å; E144-K303 PolarHBondContact OE1-NZ 2.88Å; E144-K303 WeakPolarHBondContact OE2-CE 3.45Å; E144-K303 IonicContact OE2-NZ 3.09Å; E144-K303 PolarHBondContact OE2-NZ 2.89Å; R161-K303 WeakPolarHBondContact O-CD 3.44Å; K303-G310 PolarHBondContact NZ-O 2.96Å
304	L	98.2	Very high	97.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-73.8	155.8	-179.1	-67.1	-179.5	0	0	0	111.6	P134 Q138 K140 M250 Y251 L308 G311	P134-L304 HydrophobicContact CB-CD2 3.95Å; P134-L304 HydrophobicContact CG-CD2 4.33Å; Q138-L304 CarbonylContact O-C 3.57Å; Q138-L304 WeakPolarHBondContact O-CA 3.44Å; K140-L304 VanDerWaalsContact CB-O 3.32Å; K140-L304 WeakPolarHBondContact CB-O 3.41Å; M250-L304 HydrophobicContact CE-CD1 4Å; M250-L304 HydrophobicContact CE-CD2 3.42Å; M250-L304 VanDerWaalsContact CE-CD2 3.42Å; M250-L304 HydrophobicContact CE-CG 3.43Å; M250-L304 VanDerWaalsContact CE-CG 3.43Å; M250-L304 HydrophobicContact CG-CD1 3.87Å; M250-L304 HydrophobicContact CG-CG 4.14Å; Y251-L304 HydrophobicContact CD1-CD1 3.7Å; Y251-L304 HydrophobicContact CE1-CD1 3.9Å; Y251-L304 HydrophobicContact CE1-CD2 4.27Å; Y251-L304 HydrophobicContact CG-CD1 4.26Å; L304-L308 HydrophobicContact CB-CB 4.03Å; L304-L308 HydrophobicContact CD1-CB 4.11Å; L304-L308 HydrophobicContact CD2-CD1 4.06Å; L304-L308 HydrophobicContact CG-CB 4.46Å; L304-G311 WeakPolarHBondContact CB-O 3.35Å; L304-G311 PolarHBondContact N-O 3.27Å
305	S	97.4	Very high	97.5	Very high	15 Å²	15	26.8 Å²	26.8	11%	0.105	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-62	159.2	168.1	65.1	0	0	0	0	111.3	Q138 E307 L308 G309 G310	Q138-S305 PolarHBondContact O-N 3.39Å; S305-E307 PolarHBondContact O-N 2.71Å; S305-L308 CarbonylContact O-C 3.55Å; S305-L308 PolarHBondContact O-N 2.9Å; S305-G309 PolarHBondContact O-N 3.42Å; S305-G310 PolarHBondContact O-N 2.76Å
306	D	95.9	Very high	97.5	Very high	112 Å²	112	25.9 Å²	25.9	60%	0.599	14%	0.142	S	C	*	.	G	3₁₀ helix	trans	-62.9	-28.2	177.2	-61	-33	0	0	0	111.3	K140 L308 G309	K140-D306 IonicContact NZ-OD1 3.08Å; K140-D306 PolarHBondContact NZ-OD1 3.27Å; K140-D306 IonicContact NZ-OD2 2.71Å; K140-D306 PolarHBondContact NZ-OD2 2.84Å; D306-L308 VanDerWaalsContact C-N 3.26Å; D306-L308 PolarHBondContact O-N 3.15Å; D306-G309 PolarHBondContact O-N 3.25Å; D306-G309 VanDerWaalsContact O-N 3.15Å
307	E	96	Very high	97.6	Very high	184 Å²	184	23.8 Å²	23.8	86%	0.86	13%	0.134	S	C	*	.	G	3₁₀ helix	trans	-64	-28.4	173.8	-63.1	179.1	176.6	0	0	113.3	S305	S305-E307 PolarHBondContact O-N 2.71Å
308	L	96.1	Very high	97.6	Very high	55 Å²	55	23.8 Å²	23.8	29%	0.288	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-99.9	20.1	176.6	-65.9	178.2	0	0	0	112.2	Q138 L304 S305 D306	Q138-L308 HydrophobicContact CB-CD1 3.58Å; Q138-L308 HydrophobicContact CG-CD1 3.83Å; L304-L308 HydrophobicContact CB-CB 4.03Å; L304-L308 HydrophobicContact CD1-CB 4.11Å; L304-L308 HydrophobicContact CD2-CD1 4.06Å; L304-L308 HydrophobicContact CG-CB 4.46Å; S305-L308 CarbonylContact O-C 3.55Å; S305-L308 PolarHBondContact O-N 2.9Å; D306-L308 VanDerWaalsContact C-N 3.26Å; D306-L308 PolarHBondContact O-N 3.15Å
309	G	95.4	Very high	97.6	Very high	48 Å²	48	23.7 Å²	23.7	50%	0.495	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	-1.4	175.5	0	0	0	0	0	115.4	S305 D306 G311	S305-G309 PolarHBondContact O-N 3.42Å; D306-G309 PolarHBondContact O-N 3.25Å; D306-G309 VanDerWaalsContact O-N 3.15Å; G309-G311 PolarHBondContact O-N 3.02Å; G309-G311 VanDerWaalsContact O-N 3.14Å
310	G	96.2	Very high	97.5	Very high	10 Å²	10	23 Å²	23	10%	0.103	13%	0.13	C	C	.	.	S	Bend	trans	70.1	6.7	172.5	0	0	0	0	0	116.2	K303 S305	K303-G310 PolarHBondContact NZ-O 2.96Å; S305-G310 PolarHBondContact O-N 2.76Å
311	G	97.9	Very high	97.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.			trans	-63.2	164.3	176.9	0	0	0	0	0	112.6	M250 K254 L304 G309	M250-G311 WeakPolarHBondContact O-CA 3.47Å; K254-G311 WeakPolarHBondContact O-CA 3.32Å; L304-G311 WeakPolarHBondContact CB-O 3.35Å; L304-G311 PolarHBondContact N-O 3.27Å; G309-G311 PolarHBondContact O-N 3.02Å; G309-G311 VanDerWaalsContact O-N 3.14Å
312	S	98.4	Very high	97	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	143.8	-176.1	65.6	0	0	0	0	112.4	K254 H255 V256 A302	K254-S312 PolarHBondContact O-N 3.35Å; H255-S312 CarbonylContact C-O 3.58Å; H255-S312 WeakPolarHBondContact CA-O 3.48Å; H255-S312 PolarHBondContact ND1-OG 3.38Å; V256-S312 PolarHBondContact N-O 2.91Å; A302-S312 CarbonylContact O-C 3.56Å; A302-S312 WeakPolarHBondContact O-CA 3.16Å
313	L	98.6	Very high	96.6	Very high	1 Å²	1	34 Å²	34	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.2	168.7	-168.7	159.6	0	0	0	108.9	G162 T243 E247 M250 V256 V258 A301 A302	G162-L313 WeakPolarHBondContact CA-O 3.33Å; T243-L313 HydrophobicContact CG2-CD1 4.33Å; E247-L313 HydrophobicContact CG-CD1 4.32Å; M250-L313 HydrophobicContact CB-CB 4.39Å; M250-L313 HydrophobicContact CG-CB 4.26Å; M250-L313 HydrophobicContact SD-CB 3.35Å; M250-L313 WeakPolarHBondContact SD-CB 3.3Å; M250-L313 HydrophobicContact SD-CD1 4.27Å; M250-L313 HydrophobicContact SD-CG 4.46Å; V256-L313 HydrophobicContact CB-CB 4.46Å; V256-L313 HydrophobicContact CB-CG 4.27Å; V256-L313 HydrophobicContact CG1-CG 4.37Å; V256-L313 WeakPolarHBondContact O-CA 3.44Å; V258-L313 HydrophobicContact CB-CD2 4.22Å; V258-L313 HydrophobicContact CG2-CD1 4.08Å; V258-L313 HydrophobicContact CG2-CD2 3.67Å; V258-L313 HydrophobicContact CG2-CG 3.82Å; A301-L313 CarbonylContact C-O 3.57Å; A301-L313 WeakPolarHBondContact CA-O 3.39Å; A301-L313 HydrophobicContact CB-CD2 3.42Å; A301-L313 VanDerWaalsContact CB-CD2 3.42Å; A301-L313 WeakPolarHBondContact CB-O 3.41Å; A302-L313 PolarHBondContact N-O 3.25Å; A302-L313 PolarHBondContact O-N 3.3Å
314	T	98.7	Very high	96	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.2	176.5	-45.6	0	0	0	0	108.3	M146 I159 G160 R161 G162 Q163 V256 L257 V258	M146-T314 HydrophobicContact CE-CG2 4.27Å; M146-T314 HydrophobicContact CG-CG2 4.42Å; I159-T314 HydrophobicContact CG2-CG2 3.76Å; G160-T314 WeakPolarHBondContact O-CG2 3.47Å; R161-T314 WeakPolarHBondContact CA-OG1 3.38Å; G162-T314 PolarHBondContact N-OG1 3.08Å; Q163-T314 WeakPolarHBondContact O-CA 3.42Å; Q163-T314 VanDerWaalsContact O-CG2 3.31Å; Q163-T314 WeakPolarHBondContact O-CG2 3.06Å; V256-T314 PolarHBondContact O-N 3.24Å; V256-T314 PolarHBondContact O-OG1 2.84Å; L257-T314 CarbonylContact C-O 3.44Å; L257-T314 WeakPolarHBondContact CA-O 3.4Å; L257-T314 HydrophobicContact CD1-CG2 4.24Å; V258-T314 PolarHBondContact N-O 3.4Å
315	A	98.6	Very high	95.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130	-177.4	0	0	0	0	0	111.7	Q163 R164 E165 V258 F260 L298 A301 P317	Q163-A315 PolarHBondContact O-N 2.87Å; R164-A315 CarbonylContact C-O 3.38Å; R164-A315 WeakPolarHBondContact CA-O 3.31Å; R164-A315 HydrophobicContact CG-CB 4.19Å; E165-A315 PolarHBondContact N-O 3.45Å; V258-A315 CarbonylContact O-C 3.49Å; V258-A315 WeakPolarHBondContact O-CA 3.41Å; F260-A315 HydrophobicContact CE2-CB 4.04Å; L298-A315 HydrophobicContact CD2-CB 4.24Å; A301-A315 HydrophobicContact CB-CB 3.59Å; A315-P317 VanDerWaalsContact C-CD 3.43Å; A315-P317 VanDerWaalsContact O-CD 3.29Å; A315-P317 WeakPolarHBondContact O-CD 3.36Å
316	L	98.6	Very high	95.2	Very high	1 Å²	1	41 Å²	41	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	79.2	171	-60.5	-176.8	0	0	0	109.9	M146 I159 E165 T182 L257 V258 V259 F260	M146-L316 HydrophobicContact CE-CD1 4.31Å; I159-L316 HydrophobicContact CD1-CD2 3.8Å; I159-L316 HydrophobicContact CG2-CD2 4.48Å; E165-L316 HydrophobicContact CB-CD2 3.81Å; E165-L316 WeakPolarHBondContact O-CA 3.5Å; T182-L316 HydrophobicContact CG2-CD1 4.12Å; L257-L316 HydrophobicContact CD1-CD1 3.81Å; L257-L316 HydrophobicContact CD1-CG 3.82Å; V258-L316 PolarHBondContact O-N 3.39Å; V259-L316 WeakPolarHBondContact CA-O 3.41Å; V259-L316 HydrophobicContact CG2-CB 4.24Å; V259-L316 HydrophobicContact CG2-CD1 4.33Å; F260-L316 PolarHBondContact N-O 3.3Å
317	P	98.5	Very high	95	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	140.2	174.4	28.2	-33.1	0	0	0	111.6	E165 L166 I167 F260 L263 L298 A315 T338	E165-P317 WeakPolarHBondContact O-CD 3.38Å; L166-P317 HydrophobicContact CD1-CG 4.34Å; L166-P317 WeakPolarHBondContact CD1-O 3.39Å; I167-P317 PolarHBondContact N-O 3.15Å; F260-P317 HydrophobicContact CD2-CB 4.09Å; L263-P317 HydrophobicContact CD1-CB 3.42Å; L263-P317 VanDerWaalsContact CD1-CB 3.42Å; L263-P317 HydrophobicContact CG-CB 3.98Å; L298-P317 HydrophobicContact CD1-CG 4.26Å; L298-P317 HydrophobicContact CD2-CB 4.02Å; L298-P317 HydrophobicContact CD2-CG 3.85Å; A315-P317 VanDerWaalsContact C-CD 3.43Å; A315-P317 VanDerWaalsContact O-CD 3.29Å; A315-P317 WeakPolarHBondContact O-CD 3.36Å; P317-T338 HydrophobicContact CG-CG2 3.72Å
318	F	98.2	Very high	94.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	143.3	169.9	-64.5	-1.2	0	0	0	111.2	I167 K175 A179 V259 F260 D261 D262 L263	I167-F318 HydrophobicContact CB-CD1 3.66Å; I167-F318 HydrophobicContact CB-CE1 3.79Å; I167-F318 HydrophobicContact CD1-CD1 4.36Å; I167-F318 HydrophobicContact CD1-CE1 3.64Å; I167-F318 HydrophobicContact CD1-CZ 4.44Å; I167-F318 HydrophobicContact CG1-CD1 4.07Å; I167-F318 HydrophobicContact CG1-CE1 3.85Å; I167-F318 HydrophobicContact CG2-CE1 4.45Å; I167-F318 VanDerWaalsContact O-CA 3.31Å; I167-F318 WeakPolarHBondContact O-CA 3.49Å; K175-F318 VanDerWaalsContact C-CZ 3.5Å; K175-F318 HydrophobicContact CB-CD2 3.92Å; K175-F318 HydrophobicContact CB-CE2 3.82Å; K175-F318 HydrophobicContact CB-CG 4.35Å; K175-F318 HydrophobicContact CB-CZ 4.15Å; K175-F318 HydrophobicContact CD-CB 4.43Å; K175-F318 HydrophobicContact CD-CG 4.49Å; K175-F318 WeakPolarHBondContact O-CZ 3.44Å; A179-F318 HydrophobicContact CB-CE1 4.11Å; A179-F318 HydrophobicContact CB-CE2 4.39Å; A179-F318 HydrophobicContact CB-CZ 3.44Å; A179-F318 VanDerWaalsContact CB-CZ 3.44Å; V259-F318 HydrophobicContact CG1-CE1 3.95Å; V259-F318 HydrophobicContact CG1-CE2 4.37Å; V259-F318 HydrophobicContact CG1-CZ 3.86Å; F260-F318 VanDerWaalsContact O-CB 3.22Å; F260-F318 WeakPolarHBondContact O-CB 3.28Å; F260-F318 WeakPolarHBondContact O-CG 3.31Å; F260-F318 PolarHBondContact O-N 2.85Å; D261-F318 HydrophobicContact CB-CD2 3.66Å; D261-F318 HydrophobicContact CB-CE2 3.86Å; D261-F318 VanDerWaalsContact CG-CD2 3.44Å; D261-F318 WeakPolarHBondContact OD1-CD2 3.47Å; D262-F318 HydrophobicContact CB-CB 3.59Å; L263-F318 PolarHBondContact N-O 2.9Å
319	V	97.5	Very high	94.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.8	166.6	170.2	0	0	0	0	108.7	L166 I167 I168 G169 S264 P331 V334	L166-V319 HydrophobicContact CD1-CB 3.91Å; L166-V319 HydrophobicContact CD1-CG2 3.61Å; I167-V319 PolarHBondContact O-N 3.16Å; I167-V319 VanDerWaalsContact O-N 3.15Å; I168-V319 WeakPolarHBondContact CA-O 3.05Å; I168-V319 HydrophobicContact CD1-CG1 4.4Å; I168-V319 HydrophobicContact CG1-CB 4.45Å; I168-V319 HydrophobicContact CG1-CG1 4.47Å; G169-V319 PolarHBondContact N-O 3.44Å; S264-V319 WeakPolarHBondContact OG-CA 3.26Å; S264-V319 WeakPolarHBondContact OG-CG1 3.38Å; V319-P331 HydrophobicContact CG1-CB 4.22Å; V319-P331 HydrophobicContact CG1-CG 3.75Å; V319-V334 HydrophobicContact CG2-CB 3.95Å; V319-V334 HydrophobicContact CG2-CG1 4.04Å; V319-V334 HydrophobicContact CG2-CG2 3.88Å
320	E	96.2	Very high	94.8	Very high	43 Å²	43	28.9 Å²	28.9	20%	0.201	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	115.1	172.8	-173	177.4	161.6	0	0	109	G169 S264 K265	G169-E320 WeakPolarHBondContact O-CA 3.2Å; S264-E320 PolarHBondContact OG-N 3.17Å; K265-E320 IonicContact NZ-OE2 3.59Å; K265-E320 PolarHBondContact NZ-OE2 2.88Å
321	T	94.1	Very high	94.8	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.018	17%	0.174	C	C	.	.			trans	-80.4	157.7	170.1	46.6	0	0	0	0	110.7	I168 G169 D170 I326 P331	I168-T321 HydrophobicContact CD1-CG2 3.65Å; I168-T321 HydrophobicContact CG1-CG2 3.55Å; G169-T321 WeakPolarHBondContact CA-OG1 3.42Å; G169-T321 PolarHBondContact O-N 3.34Å; G169-T321 PolarHBondContact O-OG1 3.4Å; D170-T321 PolarHBondContact N-OG1 2.88Å; D170-T321 VanDerWaalsContact N-OG1 3.14Å; D170-T321 WeakPolarHBondContact OD1-CB 3.3Å; D170-T321 PolarHBondContact OD1-OG1 3.17Å; T321-I326 HydrophobicContact CG2-CG2 4.35Å; T321-P331 HydrophobicContact CG2-CG 4.17Å
322	Q	90.3	Very high	94.7	Very high	136 Å²	136	31.8 Å²	31.8	64%	0.636	19%	0.193	S	C	*	.	S	Bend	trans	-108.3	115.8	172.9	-61.5	-60	-53.6	0	0	108	G324 D325	Q322-G324 PolarHBondContact O-N 3.35Å; Q322-D325 WeakPolarHBondContact O-CB 3.26Å; Q322-D325 PolarHBondContact O-N 3.03Å; Q322-D325 VanDerWaalsContact O-N 3.12Å
323	A	89	Confident	94.6	Very high	100 Å²	100	32.8 Å²	32.8	83%	0.826	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	38.9	-178.4	0	0	0	0	0	113.8	D170 D325	D170-A323 WeakPolarHBondContact OD2-CA 3.44Å; A323-D325 PolarHBondContact O-N 3.28Å
324	G	86.6	Confident	94.5	Very high	31 Å²	31	32.7 Å²	32.7	32%	0.32	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	6.1	179.4	0	0	0	0	0	115.1	D170 Q322 I326	D170-G324 VanDerWaalsContact CG-N 3.29Å; D170-G324 WeakPolarHBondContact OD1-CA 3.48Å; D170-G324 PolarHBondContact OD1-N 3.18Å; D170-G324 PolarHBondContact OD2-N 3.44Å; Q322-G324 PolarHBondContact O-N 3.35Å; G324-I326 PolarHBondContact O-N 2.69Å
325	D	90.2	Very high	94.4	Very high	70 Å²	70	34.8 Å²	34.8	37%	0.374	21%	0.209	S	C	.	.			trans	-73.5	96.7	-177	-174.4	11.5	0	0	0	112.3	Q322 A323 S327 A328	Q322-D325 WeakPolarHBondContact O-CB 3.26Å; Q322-D325 PolarHBondContact O-N 3.03Å; Q322-D325 VanDerWaalsContact O-N 3.12Å; A323-D325 PolarHBondContact O-N 3.28Å; D325-S327 VanDerWaalsContact C-N 3.27Å; D325-S327 WeakPolarHBondContact OD1-CA 3.46Å; D325-S327 VanDerWaalsContact OD1-CB 3.32Å; D325-S327 WeakPolarHBondContact OD1-CB 3.31Å; D325-S327 PolarHBondContact OD1-N 2.79Å; D325-S327 PolarHBondContact OD1-OG 3.37Å; D325-A328 PolarHBondContact OD1-N 3.2Å
326	I	89.1	Confident	94.4	Very high	66 Å²	66	38.1 Å²	38.1	34%	0.338	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.6	172.8	61.2	173.3	0	0	0	113.5	I168 T321 G324 T332 F343	I168-I326 HydrophobicContact CD1-CG2 4.1Å; T321-I326 HydrophobicContact CG2-CG2 4.35Å; G324-I326 PolarHBondContact O-N 2.69Å; I326-T332 PolarHBondContact O-OG1 3.13Å; I326-F343 HydrophobicContact CG2-CD2 3.79Å; I326-F343 HydrophobicContact CG2-CE2 3.13Å; I326-F343 HydrophobicContact CG2-CZ 3.76Å
327	S	90.6	Very high	94.3	Very high	74 Å²	74	38.6 Å²	38.6	52%	0.517	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.7	-178.2	77.8	0	0	0	0	113.4	D325 T332	D325-S327 VanDerWaalsContact C-N 3.27Å; D325-S327 WeakPolarHBondContact OD1-CA 3.46Å; D325-S327 VanDerWaalsContact OD1-CB 3.32Å; D325-S327 WeakPolarHBondContact OD1-CB 3.31Å; D325-S327 PolarHBondContact OD1-N 2.79Å; D325-S327 PolarHBondContact OD1-OG 3.37Å; S327-T332 PolarHBondContact O-OG1 3.12Å
328	A	93.3	Very high	94.3	Very high	21 Å²	21	38.6 Å²	38.6	17%	0.174	23%	0.234	C	C	.	.	S	Bend	trans	-60	158.8	172.1	0	0	0	0	0	111.7	D325 I330 P331 T332	D325-A328 PolarHBondContact OD1-N 3.2Å; A328-I330 PolarHBondContact O-N 3.29Å; A328-P331 HydrophobicContact CB-CG 4.03Å; A328-P331 WeakPolarHBondContact O-CD 3.39Å; A328-T332 WeakPolarHBondContact O-CB 3.46Å; A328-T332 PolarHBondContact O-N 3.41Å; A328-T332 VanDerWaalsContact O-N 3.08Å; A328-T332 PolarHBondContact O-OG1 2.89Å
329	Y	93.9	Very high	94.2	Very high	45 Å²	45	40 Å²	40	18%	0.176	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-49.1	-167	-175.8	-138.8	0	0	0	113.6	R283 E284 Y286 V290 T332 N333	R283-Y329 HydrophobicContact CB-CD1 4.16Å; R283-Y329 HydrophobicContact CB-CE1 4.24Å; R283-Y329 HydrophobicContact CB-CG 4.4Å; R283-Y329 HydrophobicContact CG-CD1 4.37Å; R283-Y329 HydrophobicContact CG-CG 4.22Å; E284-Y329 VanDerWaalsContact OE1-CB 3.29Å; E284-Y329 WeakPolarHBondContact OE1-CB 3.23Å; E284-Y329 PolarHBondContact OE1-N 2.67Å; Y286-Y329 AromaticContact CD2-CD1 3.91Å; Y286-Y329 HydrophobicContact CD2-CD1 3.91Å; Y286-Y329 HydrophobicContact CD2-CE1 4.48Å; Y286-Y329 HydrophobicContact CG-CD1 4.45Å; V290-Y329 HydrophobicContact CG1-CD1 4.46Å; V290-Y329 HydrophobicContact CG1-CE1 3.55Å; Y329-T332 PolarHBondContact O-N 3.03Å; Y329-N333 WeakPolarHBondContact CE2-ND2 3.41Å; Y329-N333 VanDerWaalsContact O-CG 3.26Å; Y329-N333 PolarHBondContact O-N 3.22Å; Y329-N333 VanDerWaalsContact O-N 3.09Å
330	I	96.2	Very high	94.2	Very high	5 Å²	5	40 Å²	40	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-48.7	-179.5	-58.6	-57.5	0	0	0	112.5	A267 Y286 V290 A328 T332 N333 V334	A267-I330 HydrophobicContact CB-CD1 3.84Å; A267-I330 HydrophobicContact CB-CG1 4.11Å; A267-I330 HydrophobicContact CB-CG2 4.35Å; Y286-I330 HydrophobicContact CD1-CD1 4.04Å; Y286-I330 HydrophobicContact CD2-CD1 4.12Å; Y286-I330 HydrophobicContact CD2-CG1 4.32Å; Y286-I330 HydrophobicContact CE1-CD1 3.94Å; Y286-I330 HydrophobicContact CE1-CG1 4.07Å; Y286-I330 HydrophobicContact CE2-CD1 4Å; Y286-I330 HydrophobicContact CE2-CG1 3.72Å; Y286-I330 HydrophobicContact CG-CD1 4.14Å; V290-I330 HydrophobicContact CG1-CD1 4.38Å; V290-I330 HydrophobicContact CG2-CD1 3.74Å; A328-I330 PolarHBondContact O-N 3.29Å; I330-T332 VanDerWaalsContact C-N 3.33Å; I330-T332 PolarHBondContact O-N 2.65Å; I330-N333 PolarHBondContact O-N 3.22Å; I330-V334 HydrophobicContact CG2-CG2 4.32Å; I330-V334 WeakPolarHBondContact O-CG2 3.44Å; I330-V334 PolarHBondContact O-N 2.82Å
331	P	95.8	Very high	94.2	Very high	7 Å²	7	39.5 Å²	39.5	5%	0.045	24%	0.24	C	C	.	.	H	α-helix	trans	-49.1	-50.9	171.1	-32.2	37.8	0	0	0	113.9	I168 V319 T321 A328 N333 V334 I335	I168-P331 HydrophobicContact CD1-CB 3.83Å; V319-P331 HydrophobicContact CG1-CB 4.22Å; V319-P331 HydrophobicContact CG1-CG 3.75Å; T321-P331 HydrophobicContact CG2-CG 4.17Å; A328-P331 HydrophobicContact CB-CG 4.03Å; A328-P331 WeakPolarHBondContact O-CD 3.39Å; P331-N333 VanDerWaalsContact C-N 3.33Å; P331-N333 PolarHBondContact O-N 3.48Å; P331-V334 PolarHBondContact O-N 2.97Å; P331-I335 WeakPolarHBondContact O-CB 3.38Å; P331-I335 WeakPolarHBondContact O-CD1 3.22Å; P331-I335 WeakPolarHBondContact O-CG1 3.3Å; P331-I335 PolarHBondContact O-N 3.5Å
332	T	95.9	Very high	94.4	Very high	65 Å²	65	39.3 Å²	39.3	40%	0.399	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-43.6	-179	-56.9	0	0	0	0	111.7	I326 S327 A328 Y329 I330 S336	I326-T332 PolarHBondContact O-OG1 3.13Å; S327-T332 PolarHBondContact O-OG1 3.12Å; A328-T332 WeakPolarHBondContact O-CB 3.46Å; A328-T332 PolarHBondContact O-N 3.41Å; A328-T332 VanDerWaalsContact O-N 3.08Å; A328-T332 PolarHBondContact O-OG1 2.89Å; Y329-T332 PolarHBondContact O-N 3.03Å; I330-T332 VanDerWaalsContact C-N 3.33Å; I330-T332 PolarHBondContact O-N 2.65Å; T332-S336 PolarHBondContact O-N 2.94Å
333	N	96.8	Very high	94.6	Very high	20 Å²	20	33.7 Å²	33.7	11%	0.107	21%	0.212	C	C	.	.	H	α-helix	trans	-60	-51.9	177.1	-72.4	-14.1	0	0	0	111.1	F291 Y329 I330 P331 I335 S336 I337	F291-N333 HydrophobicContact CD2-CB 4.02Å; Y329-N333 WeakPolarHBondContact CE2-ND2 3.41Å; Y329-N333 VanDerWaalsContact O-CG 3.26Å; Y329-N333 PolarHBondContact O-N 3.22Å; Y329-N333 VanDerWaalsContact O-N 3.09Å; I330-N333 PolarHBondContact O-N 3.22Å; P331-N333 VanDerWaalsContact C-N 3.33Å; P331-N333 PolarHBondContact O-N 3.48Å; N333-I335 PolarHBondContact O-N 2.95Å; N333-S336 PolarHBondContact O-N 2.98Å; N333-S336 VanDerWaalsContact O-N 3.16Å; N333-S336 PolarHBondContact O-OG 2.9Å; N333-I337 WeakPolarHBondContact O-CD1 3.18Å; N333-I337 WeakPolarHBondContact O-CG1 3.33Å; N333-I337 PolarHBondContact O-N 3.31Å
334	V	97	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.6	-37.5	-175.1	-174.8	0	0	0	0	111.7	L166 H294 L298 V319 I330 P331 S336 I337 T338	L166-V334 HydrophobicContact CD1-CG1 3.75Å; L166-V334 HydrophobicContact CD2-CB 4.33Å; L166-V334 HydrophobicContact CD2-CG1 4.07Å; L166-V334 HydrophobicContact CG-CG1 4.38Å; H294-V334 WeakPolarHBondContact ND1-CG2 3.36Å; L298-V334 HydrophobicContact CD1-CG1 4.11Å; V319-V334 HydrophobicContact CG2-CB 3.95Å; V319-V334 HydrophobicContact CG2-CG1 4.04Å; V319-V334 HydrophobicContact CG2-CG2 3.88Å; I330-V334 HydrophobicContact CG2-CG2 4.32Å; I330-V334 WeakPolarHBondContact O-CG2 3.44Å; I330-V334 PolarHBondContact O-N 2.82Å; P331-V334 PolarHBondContact O-N 2.97Å; V334-S336 PolarHBondContact O-N 3.39Å; V334-I337 PolarHBondContact O-N 2.91Å; V334-T338 HydrophobicContact CG1-CG2 4.08Å; V334-T338 PolarHBondContact O-N 2.79Å; V334-T338 PolarHBondContact O-OG1 2.95Å
335	I	96.8	Very high	95.3	Very high	44 Å²	44	29.7 Å²	29.7	23%	0.226	17%	0.168	C	C	.	.	H	α-helix	trans	-55.2	-42.4	172.4	-71	165.4	0	0	0	110.6	L166 I168 P331 N333 I337 R365	L166-I335 HydrophobicContact CD2-CB 4.43Å; L166-I335 HydrophobicContact CD2-CG1 3.55Å; I168-I335 HydrophobicContact CD1-CD1 4.15Å; P331-I335 WeakPolarHBondContact O-CB 3.38Å; P331-I335 WeakPolarHBondContact O-CD1 3.22Å; P331-I335 WeakPolarHBondContact O-CG1 3.3Å; P331-I335 PolarHBondContact O-N 3.5Å; N333-I335 PolarHBondContact O-N 2.95Å; I335-I337 VanDerWaalsContact C-N 3.27Å; I335-I337 PolarHBondContact O-N 3.01Å; I335-R365 PolarHBondContact O-NH2 3.33Å
336	S	97.1	Very high	95.4	Very high	70 Å²	70	28.4 Å²	28.4	49%	0.49	16%	0.161	S	C	.	.	H	α-helix	trans	-71.9	-18.7	179.9	71.9	0	0	0	0	114.4	F291 T332 N333 V334	F291-S336 WeakPolarHBondContact CE2-OG 3.38Å; T332-S336 PolarHBondContact O-N 2.94Å; N333-S336 PolarHBondContact O-N 2.98Å; N333-S336 VanDerWaalsContact O-N 3.16Å; N333-S336 PolarHBondContact O-OG 2.9Å; V334-S336 PolarHBondContact O-N 3.39Å
337	I	97.5	Very high	95.5	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.051	18%	0.177	C	C	.	.	H	α-helix	trans	-93.2	-39.1	-178.2	-65.2	161.1	0	0	0	112.3	F291 H294 L298 N333 V334 I335	F291-I337 HydrophobicContact CD2-CD1 4.04Å; F291-I337 HydrophobicContact CD2-CG1 4.39Å; F291-I337 HydrophobicContact CE2-CD1 3.77Å; F291-I337 HydrophobicContact CE2-CG1 3.61Å; F291-I337 HydrophobicContact CZ-CD1 4.11Å; F291-I337 HydrophobicContact CZ-CG1 3.69Å; H294-I337 HydrophobicContact CB-CD1 3.75Å; L298-I337 HydrophobicContact CB-CG2 3.71Å; L298-I337 HydrophobicContact CD1-CB 4.3Å; L298-I337 HydrophobicContact CD1-CG2 3.63Å; L298-I337 HydrophobicContact CG-CG2 4.28Å; N333-I337 WeakPolarHBondContact O-CD1 3.18Å; N333-I337 WeakPolarHBondContact O-CG1 3.33Å; N333-I337 PolarHBondContact O-N 3.31Å; V334-I337 PolarHBondContact O-N 2.91Å; I335-I337 VanDerWaalsContact C-N 3.27Å; I335-I337 PolarHBondContact O-N 3.01Å
338	T	98.1	Very high	95.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-68.1	177.5	-179.3	53.6	0	0	0	0	111.6	R164 L166 L298 P317 V334 G340 R365	R164-T338 HydrophobicContact CB-CG2 4.24Å; R164-T338 WeakPolarHBondContact O-CB 3.44Å; L166-T338 HydrophobicContact CB-CG2 3.8Å; L298-T338 HydrophobicContact CD1-CG2 4.03Å; P317-T338 HydrophobicContact CG-CG2 3.72Å; V334-T338 HydrophobicContact CG1-CG2 4.08Å; V334-T338 PolarHBondContact O-N 2.79Å; V334-T338 PolarHBondContact O-OG1 2.95Å; T338-G340 WeakPolarHBondContact CB-O 3.43Å; T338-G340 PolarHBondContact OG1-O 3.43Å; T338-R365 VanDerWaalsContact C-NH2 3.27Å; T338-R365 PolarHBondContact O-NH1 2.95Å; T338-R365 PolarHBondContact O-NH2 3.31Å
339	D	97.2	Very high	95.6	Very high	30 Å²	30	29.5 Å²	29.5	16%	0.16	16%	0.157	C	C	.	.	S	Bend	trans	-96	1.6	171.5	-61.6	-48.7	0	0	0	112	Q163 R164 R365 V366	Q163-D339 HydrophobicContact CG-CB 3.83Å; R164-D339 IonicContact CZ-OD1 3.96Å; R164-D339 IonicContact CZ-OD2 3.73Å; R164-D339 PolarHBondContact N-OD2 2.88Å; R164-D339 IonicContact NE-OD1 2.67Å; R164-D339 IonicContact NE-OD2 3.23Å; R164-D339 IonicContact NH1-OD2 2.79Å; R164-D339 PolarHBondContact NH1-OD2 3.34Å; R164-D339 IonicContact NH2-OD1 2.83Å; R164-D339 PolarHBondContact NH2-OD1 3.41Å; R164-D339 IonicContact NH2-OD2 3.54Å; R164-D339 PolarHBondContact NH2-OD2 2.89Å; R164-D339 PolarHBondContact O-N 3.02Å; D339-R365 WeakPolarHBondContact O-CA 3.42Å; D339-R365 WeakPolarHBondContact O-CB 3.27Å; D339-R365 WeakPolarHBondContact O-CD 3.41Å; D339-R365 WeakPolarHBondContact O-CG 3.36Å; D339-R365 PolarHBondContact O-N 3.24Å; D339-R365 PolarHBondContact O-NE 3.41Å; D339-V366 HydrophobicContact CB-CG2 4.35Å
340	G	96.4	Very high	95.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.5	177.8	-175.6	0	0	0	0	0	110.9	E165 L166 T338 V363	E165-G340 VanDerWaalsContact OE1-C 3.24Å; E165-G340 WeakPolarHBondContact OE1-CA 3.43Å; E165-G340 VanDerWaalsContact OE2-CA 3.3Å; E165-G340 WeakPolarHBondContact OE2-CA 3.37Å; L166-G340 WeakPolarHBondContact CB-O 3.19Å; L166-G340 PolarHBondContact N-O 3.28Å; L166-G340 VanDerWaalsContact N-O 3.11Å; T338-G340 WeakPolarHBondContact CB-O 3.43Å; T338-G340 PolarHBondContact OG1-O 3.43Å; G340-V363 CarbonylContact C-O 3.59Å; G340-V363 WeakPolarHBondContact CA-O 3.34Å
341	Q	97.1	Very high	95.3	Very high	32 Å²	32	38.7 Å²	38.7	15%	0.15	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	143.7	176.3	70	-79.4	-6.1	0	0	111.3	E165 L166 I168 L361 S362 V363	E165-Q341 PolarHBondContact OE1-N 2.81Å; L166-Q341 HydrophobicContact CB-CB 4.01Å; L166-Q341 HydrophobicContact CD2-CB 4.24Å; L166-Q341 HydrophobicContact CG-CB 4.32Å; L166-Q341 CarbonylContact O-C 2.98Å; L166-Q341 VanDerWaalsContact O-CA 3.23Å; L166-Q341 WeakPolarHBondContact O-CA 3.28Å; I168-Q341 HydrophobicContact CG2-CB 4.1Å; Q341-L361 PolarHBondContact NE2-O 2.69Å; Q341-L361 VanDerWaalsContact NE2-O 3.09Å; Q341-S362 CarbonylContact O-C 3.54Å; Q341-S362 WeakPolarHBondContact O-CA 3.45Å; Q341-S362 VanDerWaalsContact O-CB 3.31Å; Q341-S362 WeakPolarHBondContact O-CB 3.31Å; Q341-V363 PolarHBondContact N-O 3Å; Q341-V363 PolarHBondContact O-N 2.79Å
342	I	97.2	Very high	95.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	109.7	168.7	-62.2	168	0	0	0	106	I153 V157 I159 E165 L166 I167 I168 L344 V357	I153-I342 HydrophobicContact CD1-CD1 3.99Å; I153-I342 HydrophobicContact CG1-CD1 4.12Å; I153-I342 HydrophobicContact CG2-CD1 3.84Å; V157-I342 HydrophobicContact CB-CG1 4.27Å; V157-I342 HydrophobicContact CG1-CG1 3.79Å; I159-I342 HydrophobicContact CD1-CD1 4.06Å; E165-I342 HydrophobicContact CG-CD1 3.85Å; E165-I342 HydrophobicContact CG-CG1 3.96Å; L166-I342 PolarHBondContact O-N 2.7Å; I167-I342 HydrophobicContact CG1-CD1 4.46Å; I168-I342 WeakPolarHBondContact CG2-O 3.39Å; I168-I342 PolarHBondContact N-O 2.81Å; I342-L344 HydrophobicContact CG2-CD2 3.97Å; I342-V357 HydrophobicContact CG2-CG1 4.08Å; I342-V357 HydrophobicContact CG2-CG2 3.84Å
343	F	95.8	Very high	95	Very high	17 Å²	17	38 Å²	38	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123	179.7	-170.8	-111.7	0	0	0	110.4	I168 I326 E345 D358 L361 S362	I168-F343 HydrophobicContact CG1-CD2 4.34Å; I168-F343 HydrophobicContact CG2-CB 4.4Å; I168-F343 HydrophobicContact CG2-CD2 3.92Å; I168-F343 CarbonylContact O-C 3.52Å; I168-F343 WeakPolarHBondContact O-CA 3.32Å; I326-F343 HydrophobicContact CG2-CD2 3.79Å; I326-F343 HydrophobicContact CG2-CE2 3.13Å; I326-F343 HydrophobicContact CG2-CZ 3.76Å; F343-E345 HydrophobicContact CD1-CG 3.61Å; F343-E345 HydrophobicContact CE1-CG 3.35Å; F343-E345 WeakPolarHBondContact CE1-OE1 3.49Å; F343-E345 HydrophobicContact CZ-CG 4.38Å; F343-D358 HydrophobicContact CD1-CB 4.06Å; F343-D358 PolarHBondContact O-N 2.87Å; F343-L361 HydrophobicContact CB-CB 4.03Å; F343-L361 HydrophobicContact CD1-CB 4.03Å; F343-L361 HydrophobicContact CD1-CD1 3.46Å; F343-L361 VanDerWaalsContact CD1-CD1 3.46Å; F343-L361 HydrophobicContact CD1-CG 4.38Å; F343-L361 HydrophobicContact CE1-CD1 3.55Å; F343-L361 HydrophobicContact CG-CB 4.23Å; F343-L361 HydrophobicContact CG-CD1 4.28Å; F343-L361 HydrophobicContact CZ-CD1 4.48Å; F343-S362 PolarHBondContact N-OG 3.25Å
344	L	96.6	Very high	94.9	Very high	2 Å²	2	43 Å²	43	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.9	178.5	-54.4	-175.7	0	0	0	111.4	I167 I168 K175 I178 I342 A356 V357	I167-L344 HydrophobicContact CG2-CD1 3.96Å; I167-L344 HydrophobicContact CG2-CG 4.23Å; I168-L344 PolarHBondContact O-N 2.93Å; K175-L344 HydrophobicContact CB-CD1 4.27Å; K175-L344 HydrophobicContact CG-CD1 3.61Å; I178-L344 HydrophobicContact CD1-CD1 3.76Å; I178-L344 HydrophobicContact CD1-CD2 3.6Å; I178-L344 HydrophobicContact CD1-CG 4.27Å; I342-L344 HydrophobicContact CG2-CD2 3.97Å; L344-A356 VanDerWaalsContact CA-O 3.28Å; L344-A356 WeakPolarHBondContact CA-O 3.46Å; L344-V357 HydrophobicContact CD2-CB 4.48Å; L344-V357 HydrophobicContact CD2-CG2 3.75Å
345	E	92.3	Very high	94.8	Very high	46 Å²	46	44 Å²	44	22%	0.215	23%	0.232	C	C	.	.			trans	-99.7	139.8	-177.3	-71.8	-172.9	176.8	0	0	113.1	F343 D347 L348 F349 A356 D358	F343-E345 HydrophobicContact CD1-CG 3.61Å; F343-E345 HydrophobicContact CE1-CG 3.35Å; F343-E345 WeakPolarHBondContact CE1-OE1 3.49Å; F343-E345 HydrophobicContact CZ-CG 4.38Å; E345-D347 VanDerWaalsContact C-N 3.35Å; E345-L348 HydrophobicContact CB-CB 4.19Å; E345-L348 HydrophobicContact CB-CD1 4.03Å; E345-L348 HydrophobicContact CB-CG 3.87Å; E345-L348 HydrophobicContact CG-CD1 4.46Å; E345-F349 WeakPolarHBondContact O-CB 3.34Å; E345-F349 PolarHBondContact O-N 3.22Å; E345-A356 PolarHBondContact N-O 3.48Å; E345-A356 VanDerWaalsContact N-O 3.09Å; E345-A356 WeakPolarHBondContact O-CB 3.41Å; E345-D358 HydrophobicContact CG-CB 4.1Å
346	N	92.3	Very high	94.7	Very high	43 Å²	43	42 Å²	42	23%	0.23	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-42.3	173	-69.2	-35	0	0	0	111.4	D170 T173 L348 F349 Y350	D170-N346 WeakPolarHBondContact CB-ND2 3.28Å; D170-N346 WeakPolarHBondContact CB-OD1 3.43Å; D170-N346 PolarHBondContact OD2-ND2 3.4Å; T173-N346 WeakPolarHBondContact CG2-OD1 3.48Å; N346-L348 PolarHBondContact O-N 3.16Å; N346-F349 WeakPolarHBondContact O-CB 3.45Å; N346-F349 PolarHBondContact O-N 3.44Å; N346-F349 VanDerWaalsContact O-N 3.13Å; N346-Y350 HydrophobicContact CB-CD2 4.22Å; N346-Y350 HydrophobicContact CB-CE2 3.88Å; N346-Y350 WeakPolarHBondContact O-CD2 3.23Å; N346-Y350 PolarHBondContact O-N 3.19Å
347	D	91.6	Very high	94.6	Very high	125 Å²	125	39.3 Å²	39.3	67%	0.668	20%	0.203	S	C	*	.	H	α-helix	trans	-64.8	-42.7	-174.7	-67.2	-16.8	0	0	0	111.4	E345 F349 Y350 A351	E345-D347 VanDerWaalsContact C-N 3.35Å; D347-F349 VanDerWaalsContact C-N 3.34Å; D347-F349 PolarHBondContact O-N 3.38Å; D347-Y350 PolarHBondContact O-N 2.97Å; D347-A351 VanDerWaalsContact O-CB 3.28Å; D347-A351 WeakPolarHBondContact O-CB 3.28Å; D347-A351 PolarHBondContact O-N 2.99Å
348	L	92.5	Very high	94.3	Very high	12 Å²	12	40 Å²	40	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-44.4	172	-61.9	-176.4	0	0	0	111.7	E345 N346 Y350 A351 G352 I353 A356 D358	E345-L348 HydrophobicContact CB-CB 4.19Å; E345-L348 HydrophobicContact CB-CD1 4.03Å; E345-L348 HydrophobicContact CB-CG 3.87Å; E345-L348 HydrophobicContact CG-CD1 4.46Å; N346-L348 PolarHBondContact O-N 3.16Å; L348-Y350 VanDerWaalsContact C-N 3.34Å; L348-Y350 PolarHBondContact O-N 2.84Å; L348-A351 PolarHBondContact O-N 2.81Å; L348-G352 PolarHBondContact O-N 2.97Å; L348-I353 HydrophobicContact CB-CB 4.29Å; L348-I353 HydrophobicContact CD2-CD1 3.83Å; L348-I353 WeakPolarHBondContact O-CB 3.49Å; L348-I353 PolarHBondContact O-N 2.87Å; L348-A356 HydrophobicContact CB-CB 4.07Å; L348-D358 HydrophobicContact CD1-CB 4.13Å
349	F	92.7	Very high	93.8	Very high	47 Å²	47	40.5 Å²	40.5	21%	0.206	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-40.5	179.8	-172.8	-89.3	0	0	0	112.6	E345 N346 D347 G352 R354 A356	E345-F349 WeakPolarHBondContact O-CB 3.34Å; E345-F349 PolarHBondContact O-N 3.22Å; N346-F349 WeakPolarHBondContact O-CB 3.45Å; N346-F349 PolarHBondContact O-N 3.44Å; N346-F349 VanDerWaalsContact O-N 3.13Å; D347-F349 VanDerWaalsContact C-N 3.34Å; D347-F349 PolarHBondContact O-N 3.38Å; F349-G352 PolarHBondContact O-N 3.05Å; F349-R354 HydrophobicContact CD2-CG 4.1Å; F349-R354 HydrophobicContact CE2-CG 4.17Å; F349-R354 PolarHBondContact O-NE 2.84Å; F349-A356 HydrophobicContact CB-CB 3.74Å; F349-A356 HydrophobicContact CD2-CB 4.18Å; F349-A356 HydrophobicContact CG-CB 4.49Å
350	Y	92	Very high	93.4	Very high	171 Å²	171	41.2 Å²	41.2	67%	0.671	23%	0.225	S	C	*	.	H	α-helix	trans	-76.1	-29.5	177.6	-65	-47.6	0	0	0	113.1	N346 D347 L348 G352	N346-Y350 HydrophobicContact CB-CD2 4.22Å; N346-Y350 HydrophobicContact CB-CE2 3.88Å; N346-Y350 WeakPolarHBondContact O-CD2 3.23Å; N346-Y350 PolarHBondContact O-N 3.19Å; D347-Y350 PolarHBondContact O-N 2.97Å; L348-Y350 VanDerWaalsContact C-N 3.34Å; L348-Y350 PolarHBondContact O-N 2.84Å; Y350-G352 PolarHBondContact O-N 2.76Å
351	A	91.7	Very high	93.1	Very high	72 Å²	72	45 Å²	45	60%	0.595	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-0	170.4	0	0	0	0	0	113.6	D347 L348	D347-A351 VanDerWaalsContact O-CB 3.28Å; D347-A351 WeakPolarHBondContact O-CB 3.28Å; D347-A351 PolarHBondContact O-N 2.99Å; L348-A351 PolarHBondContact O-N 2.81Å
352	G	92.4	Very high	92.9	Very high	33 Å²	33	43.4 Å²	43.4	34%	0.34	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	12.1	178.5	0	0	0	0	0	114.4	L348 F349 Y350 R354 K421	L348-G352 PolarHBondContact O-N 2.97Å; F349-G352 PolarHBondContact O-N 3.05Å; Y350-G352 PolarHBondContact O-N 2.76Å; G352-R354 PolarHBondContact O-N 2.89Å; G352-K421 WeakPolarHBondContact O-CE 3.4Å
353	I	93.4	Very high	92.8	Very high	24 Å²	24	45.6 Å²	45.6	12%	0.123	25%	0.251	C	S	.	.			trans	-86.1	108.1	173.6	-58	169.8	0	0	0	107.8	L348 A356 V417	L348-I353 HydrophobicContact CB-CB 4.29Å; L348-I353 HydrophobicContact CD2-CD1 3.83Å; L348-I353 WeakPolarHBondContact O-CB 3.49Å; L348-I353 PolarHBondContact O-N 2.87Å; I353-A356 WeakPolarHBondContact O-CA 3.35Å; I353-V417 HydrophobicContact CD1-CG1 3.68Å; I353-V417 HydrophobicContact CG1-CG1 3.78Å
354	R	95	Very high	92.7	Very high	125 Å²	125	45.4 Å²	45.4	47%	0.472	25%	0.252	S	S	.	.	S	Bend	trans	-136.4	122.6	-177	-62.6	-177.9	-173.7	167.8	4.6	109	F349 G352 K421 Q422	F349-R354 HydrophobicContact CD2-CG 4.1Å; F349-R354 HydrophobicContact CE2-CG 4.17Å; F349-R354 PolarHBondContact O-NE 2.84Å; G352-R354 PolarHBondContact O-N 2.89Å; R354-K421 CarbonylContact O-C 3.6Å; R354-K421 WeakPolarHBondContact O-CA 3.38Å; R354-Q422 PolarHBondContact O-N 2.87Å
355	P	95.3	Very high	92.5	Very high	21 Å²	21	51.3 Å²	51.3	14%	0.136	27%	0.274	C	S	.	.	S	Bend	cis	-61.6	144.1	-1.1	-22.1	34.5	0	0	0	113.9	L150 I178 V357	L150-P355 HydrophobicContact CD1-CG 4.4Å; L150-P355 HydrophobicContact CD2-CG 4.13Å; I178-P355 HydrophobicContact CD1-CB 4.18Å; I178-P355 HydrophobicContact CG1-CB 4.3Å; P355-V357 HydrophobicContact CB-CG2 4.03Å; P355-V357 PolarHBondContact O-N 2.79Å
356	A	94.9	Very high	92.6	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.008	27%	0.273	C	S	.	.			trans	-83.3	44.8	-172.9	0	0	0	0	0	113.1	L344 E345 L348 F349 I353	L344-A356 VanDerWaalsContact CA-O 3.28Å; L344-A356 WeakPolarHBondContact CA-O 3.46Å; E345-A356 PolarHBondContact N-O 3.48Å; E345-A356 VanDerWaalsContact N-O 3.09Å; E345-A356 WeakPolarHBondContact O-CB 3.41Å; L348-A356 HydrophobicContact CB-CB 4.07Å; F349-A356 HydrophobicContact CB-CB 3.74Å; F349-A356 HydrophobicContact CD2-CB 4.18Å; F349-A356 HydrophobicContact CG-CB 4.49Å; I353-A356 WeakPolarHBondContact O-CA 3.35Å
357	V	94.7	Very high	92.5	Very high	14 Å²	14	49.7 Å²	49.7	9%	0.085	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-78.5	121.3	-174.6	178.2	0	0	0	0	110.2	A152 I153 I342 L344 P355 A359	A152-V357 HydrophobicContact CB-CB 4.41Å; A152-V357 HydrophobicContact CB-CG2 4.36Å; I153-V357 HydrophobicContact CG1-CG2 4.37Å; I342-V357 HydrophobicContact CG2-CG1 4.08Å; I342-V357 HydrophobicContact CG2-CG2 3.84Å; L344-V357 HydrophobicContact CD2-CB 4.48Å; L344-V357 HydrophobicContact CD2-CG2 3.75Å; P355-V357 HydrophobicContact CB-CG2 4.03Å; P355-V357 PolarHBondContact O-N 2.79Å; V357-A359 PolarHBondContact O-N 2.91Å
358	D	92.2	Very high	92.5	Very high	26 Å²	26	45 Å²	45	14%	0.139	25%	0.254	C	S	.	.			trans	-78.6	115.5	169.4	-174.9	-82	0	0	0	110.4	F343 E345 L348 G360 L361 S362	F343-D358 HydrophobicContact CD1-CB 4.06Å; F343-D358 PolarHBondContact O-N 2.87Å; E345-D358 HydrophobicContact CG-CB 4.1Å; L348-D358 HydrophobicContact CD1-CB 4.13Å; D358-G360 VanDerWaalsContact C-N 3.29Å; D358-G360 PolarHBondContact O-N 3.39Å; D358-G360 VanDerWaalsContact OD1-CA 3.29Å; D358-G360 WeakPolarHBondContact OD1-CA 3.45Å; D358-G360 PolarHBondContact OD1-N 3.49Å; D358-L361 HydrophobicContact CB-CB 4.42Å; D358-L361 PolarHBondContact OD1-N 3.09Å; D358-S362 WeakPolarHBondContact O-CB 3.33Å; D358-S362 PolarHBondContact O-N 3.34Å; D358-S362 VanDerWaalsContact O-N 3.07Å; D358-S362 PolarHBondContact O-OG 3.26Å
359	A	87.6	Confident	92.5	Very high	9 Å²	9	47.8 Å²	47.8	7%	0.074	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-17.2	-176.1	0	0	0	0	0	114.4	L156 V357 R383 L386	L156-A359 HydrophobicContact CD1-CB 3.86Å; V357-A359 PolarHBondContact O-N 2.91Å; A359-R383 PolarHBondContact O-NE 2.95Å; A359-L386 HydrophobicContact CB-CD2 3.45Å; A359-L386 VanDerWaalsContact CB-CD2 3.45Å; A359-L386 HydrophobicContact CB-CG 4.15Å
360	G	86.8	Confident	92.6	Very high	46 Å²	46	45.7 Å²	45.7	47%	0.474	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-55.9	178.3	0	0	0	0	0	111.2	D358 R383	D358-G360 VanDerWaalsContact C-N 3.29Å; D358-G360 PolarHBondContact O-N 3.39Å; D358-G360 VanDerWaalsContact OD1-CA 3.29Å; D358-G360 WeakPolarHBondContact OD1-CA 3.45Å; D358-G360 PolarHBondContact OD1-N 3.49Å; G360-R383 PolarHBondContact O-NH2 3.27Å
361	L	90.3	Very high	92.7	Very high	78 Å²	78	38.9 Å²	38.9	41%	0.408	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-26.8	-176	-64.4	178.1	0	0	0	113.3	Q341 F343 D358	Q341-L361 PolarHBondContact NE2-O 2.69Å; Q341-L361 VanDerWaalsContact NE2-O 3.09Å; F343-L361 HydrophobicContact CB-CB 4.03Å; F343-L361 HydrophobicContact CD1-CB 4.03Å; F343-L361 HydrophobicContact CD1-CD1 3.46Å; F343-L361 VanDerWaalsContact CD1-CD1 3.46Å; F343-L361 HydrophobicContact CD1-CG 4.38Å; F343-L361 HydrophobicContact CE1-CD1 3.55Å; F343-L361 HydrophobicContact CG-CB 4.23Å; F343-L361 HydrophobicContact CG-CD1 4.28Å; F343-L361 HydrophobicContact CZ-CD1 4.48Å; D358-L361 HydrophobicContact CB-CB 4.42Å; D358-L361 PolarHBondContact OD1-N 3.09Å
362	S	93.8	Very high	92.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.216	C	C	.	.			trans	-75.4	136.5	175.1	-52.9	0	0	0	0	111.4	V157 Q341 F343 D358 R383	V157-S362 VanDerWaalsContact CG2-CB 3.49Å; Q341-S362 CarbonylContact O-C 3.54Å; Q341-S362 WeakPolarHBondContact O-CA 3.45Å; Q341-S362 VanDerWaalsContact O-CB 3.31Å; Q341-S362 WeakPolarHBondContact O-CB 3.31Å; F343-S362 PolarHBondContact N-OG 3.25Å; D358-S362 WeakPolarHBondContact O-CB 3.33Å; D358-S362 PolarHBondContact O-N 3.34Å; D358-S362 VanDerWaalsContact O-N 3.07Å; D358-S362 PolarHBondContact O-OG 3.26Å; S362-R383 PolarHBondContact O-NH2 3.25Å
363	V	94	Very high	93.1	Very high	45 Å²	45	40.7 Å²	40.7	27%	0.273	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	132.1	-173.5	177.1	0	0	0	0	109.3	E165 G340 Q341 R365	E165-V363 VanDerWaalsContact OE1-O 3.09Å; G340-V363 CarbonylContact C-O 3.59Å; G340-V363 WeakPolarHBondContact CA-O 3.34Å; Q341-V363 PolarHBondContact N-O 3Å; Q341-V363 PolarHBondContact O-N 2.79Å; V363-R365 HydrophobicContact CG1-CG 4.49Å
364	S	94.3	Very high	93.2	Very high	14 Å²	14	39.5 Å²	39.5	10%	0.098	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	115.7	164.6	169	0	0	0	0	108.6	P158 Q163 V366 G367	P158-S364 WeakPolarHBondContact O-CB 3.39Å; P158-S364 PolarHBondContact O-OG 2.93Å; Q163-S364 PolarHBondContact NE2-OG 3.24Å; Q163-S364 VanDerWaalsContact NE2-OG 3.14Å; S364-V366 VanDerWaalsContact C-N 3.32Å; S364-G367 PolarHBondContact O-N 3.46Å; S364-G367 PolarHBondContact OG-N 2.96Å
365	R	93.6	Very high	93.3	Very high	126 Å²	126	33.8 Å²	33.8	48%	0.475	20%	0.198	S	C	.	.	S	Bend	trans	-74.6	-23.8	179	-63.5	166.4	-113.7	-175.6	-8.4	112.5	I335 T338 D339 V363 G367	I335-R365 PolarHBondContact O-NH2 3.33Å; T338-R365 VanDerWaalsContact C-NH2 3.27Å; T338-R365 PolarHBondContact O-NH1 2.95Å; T338-R365 PolarHBondContact O-NH2 3.31Å; D339-R365 WeakPolarHBondContact O-CA 3.42Å; D339-R365 WeakPolarHBondContact O-CB 3.27Å; D339-R365 WeakPolarHBondContact O-CD 3.41Å; D339-R365 WeakPolarHBondContact O-CG 3.36Å; D339-R365 PolarHBondContact O-N 3.24Å; D339-R365 PolarHBondContact O-NE 3.41Å; V363-R365 HydrophobicContact CG1-CG 4.49Å; R365-G367 VanDerWaalsContact C-N 3.3Å
366	V	93.1	Very high	93.3	Very high	33 Å²	33	38.5 Å²	38.5	20%	0.2	22%	0.217	C	C	.	.	S	Bend	trans	-68.4	-36.5	170.6	179.6	0	0	0	0	110.2	V142 Q163 D339 S364 A370	V142-V366 HydrophobicContact CB-CG1 4.1Å; V142-V366 HydrophobicContact CB-CG2 4.49Å; V142-V366 HydrophobicContact CG1-CG1 4Å; Q163-V366 HydrophobicContact CB-CG2 4.4Å; Q163-V366 VanDerWaalsContact CD-CG2 3.47Å; Q163-V366 HydrophobicContact CG-CG2 3.84Å; D339-V366 HydrophobicContact CB-CG2 4.35Å; S364-V366 VanDerWaalsContact C-N 3.32Å; V366-A370 HydrophobicContact CG1-CB 3.87Å
367	G	91	Very high	93.2	Very high	21 Å²	21	45.4 Å²	45.4	22%	0.216	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	62.5	-147.5	173.9	0	0	0	0	0	112.9	P158 S364 R365 S369 A370	P158-G367 WeakPolarHBondContact CG-O 3.33Å; S364-G367 PolarHBondContact O-N 3.46Å; S364-G367 PolarHBondContact OG-N 2.96Å; R365-G367 VanDerWaalsContact C-N 3.3Å; G367-S369 PolarHBondContact O-N 2.92Å; G367-A370 PolarHBondContact O-N 3.41Å
368	G	90.7	Very high	93.2	Very high	26 Å²	26	45 Å²	45	27%	0.268	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-64	-3.7	-174.2	0	0	0	0	0	115.9	Q371	G368-Q371 PolarHBondContact O-N 2.79Å
369	S	93.2	Very high	93.2	Very high	72 Å²	72	44 Å²	44	50%	0.503	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-68.4	-23.7	168.7	-59.2	0	0	0	0	112.2	S143 G367 Q371	S143-S369 CarbonylContact C-O 3.36Å; S143-S369 WeakPolarHBondContact CA-O 3.46Å; G367-S369 PolarHBondContact O-N 2.92Å; S369-Q371 VanDerWaalsContact C-N 3.3Å
370	A	94.2	Very high	93.2	Very high	3 Å²	3	46.2 Å²	46.2	3%	0.025	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-89.5	14.6	174.3	0	0	0	0	0	113.2	P145 P158 V366 G367	P145-A370 WeakPolarHBondContact CA-O 3.21Å; P145-A370 VanDerWaalsContact CB-O 3.26Å; P145-A370 WeakPolarHBondContact CB-O 3.44Å; P158-A370 HydrophobicContact CB-CB 4.11Å; P158-A370 HydrophobicContact CG-CB 4.5Å; V366-A370 HydrophobicContact CG1-CB 3.87Å; G367-A370 PolarHBondContact O-N 3.41Å
371	Q	95.4	Very high	93.2	Very high	28 Å²	28	47.6 Å²	47.6	13%	0.131	26%	0.263	C	S	.	.	S	Bend	trans	-118.3	149	178.3	-72.2	176.8	-33.3	0	0	111.1	D154 A155 P158 G368 S369 M375 K376	D154-Q371 PolarHBondContact O-NE2 2.78Å; A155-Q371 PolarHBondContact O-NE2 3.42Å; P158-Q371 HydrophobicContact CB-CG 3.43Å; P158-Q371 VanDerWaalsContact CB-CG 3.43Å; P158-Q371 HydrophobicContact CG-CG 3.76Å; G368-Q371 PolarHBondContact O-N 2.79Å; S369-Q371 VanDerWaalsContact C-N 3.3Å; Q371-M375 HydrophobicContact CB-CB 4.31Å; Q371-M375 HydrophobicContact CB-CG 4.38Å; Q371-M375 HydrophobicContact CG-CG 4.12Å; Q371-K376 HydrophobicContact CB-CB 4.43Å
372	I	95.8	Very high	93.2	Very high	15 Å²	15	43.9 Å²	43.9	8%	0.077	24%	0.243	C	C	.	.			trans	-66.4	153.8	164.2	64.7	170	0	0	0	109.9	P145 A374 M375 K376 V430 V434 I475 K479	P145-I372 HydrophobicContact CG-CG2 3.97Å; I372-A374 HydrophobicContact CD1-CB 4.01Å; I372-A374 HydrophobicContact CG1-CB 4.27Å; I372-A374 PolarHBondContact O-N 3.23Å; I372-M375 HydrophobicContact CG1-CB 3.78Å; I372-M375 PolarHBondContact O-N 2.88Å; I372-M375 VanDerWaalsContact O-N 3.15Å; I372-K376 PolarHBondContact O-N 3.2Å; I372-V430 HydrophobicContact CD1-CG1 4.08Å; I372-V430 HydrophobicContact CD1-CG2 3.6Å; I372-V430 HydrophobicContact CG1-CG2 4.12Å; I372-V434 HydrophobicContact CD1-CG2 4.39Å; I372-I475 HydrophobicContact CD1-CG2 4.15Å; I372-K479 HydrophobicContact CB-CB 4.1Å; I372-K479 HydrophobicContact CG2-CB 4.19Å; I372-K479 HydrophobicContact CG2-CD 4.42Å; I372-K479 HydrophobicContact CG2-CG 4.33Å
373	K	95.4	Very high	92.8	Very high	127 Å²	127	47.7 Å²	47.7	55%	0.552	26%	0.258	S	S	*	.	H	α-helix	trans	-56.5	-38	-178.2	-71.5	176.9	177.5	178.2	0	112.1	K376 K377 K479 E480	K373-K376 PolarHBondContact O-N 3.46Å; K373-K377 WeakPolarHBondContact O-CG 3.38Å; K373-K377 PolarHBondContact O-N 3.34Å; K373-K377 VanDerWaalsContact O-N 3.14Å; K373-K479 PolarHBondContact N-O 2.86Å; K373-E480 HydrophobicContact CB-CG 4.19Å; K373-E480 HydrophobicContact CD-CG 3.81Å; K373-E480 VanDerWaalsContact CD-OE1 3.22Å; K373-E480 WeakPolarHBondContact CD-OE1 3.31Å; K373-E480 IonicContact NZ-OE1 3.09Å; K373-E480 PolarHBondContact NZ-OE1 3.08Å
374	A	96.2	Very high	92.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-51.4	177	0	0	0	0	0	112.3	I372 K376 K377 V378 V434 I475 K479 L481	I372-A374 HydrophobicContact CD1-CB 4.01Å; I372-A374 HydrophobicContact CG1-CB 4.27Å; I372-A374 PolarHBondContact O-N 3.23Å; A374-K376 PolarHBondContact O-N 3.41Å; A374-K377 PolarHBondContact O-N 3.32Å; A374-V378 PolarHBondContact O-N 2.77Å; A374-V434 HydrophobicContact CB-CG1 4.01Å; A374-V434 HydrophobicContact CB-CG2 4.16Å; A374-I475 HydrophobicContact CB-CG2 4.18Å; A374-K479 PolarHBondContact N-O 3.23Å; A374-L481 HydrophobicContact CB-CD2 4.18Å; A374-L481 HydrophobicContact CB-CG 4.15Å
375	M	97.2	Very high	92.1	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.02	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-44	177.4	-176.7	58.9	77.9	0	0	111.6	A155 Q371 I372 K377 V378 A379 V430 Q433 V434 L437	A155-M375 HydrophobicContact CB-SD 4.13Å; Q371-M375 HydrophobicContact CB-CB 4.31Å; Q371-M375 HydrophobicContact CB-CG 4.38Å; Q371-M375 HydrophobicContact CG-CG 4.12Å; I372-M375 HydrophobicContact CG1-CB 3.78Å; I372-M375 PolarHBondContact O-N 2.88Å; I372-M375 VanDerWaalsContact O-N 3.15Å; M375-K377 VanDerWaalsContact C-N 3.28Å; M375-K377 PolarHBondContact O-N 3.24Å; M375-V378 WeakPolarHBondContact O-CG2 3.24Å; M375-V378 PolarHBondContact O-N 3.35Å; M375-V378 HydrophobicContact SD-CG2 4.14Å; M375-A379 HydrophobicContact CG-CB 4.4Å; M375-A379 VanDerWaalsContact O-CB 3.28Å; M375-A379 WeakPolarHBondContact O-CB 3.33Å; M375-A379 PolarHBondContact O-N 3.11Å; M375-A379 HydrophobicContact SD-CB 3.98Å; M375-V430 HydrophobicContact CE-CG2 4.21Å; M375-Q433 HydrophobicContact CE-CB 3.79Å; M375-V434 HydrophobicContact CB-CG2 4.16Å; M375-V434 HydrophobicContact CE-CG2 3.9Å; M375-V434 HydrophobicContact SD-CG2 4.43Å; M375-L437 HydrophobicContact CE-CD1 4.05Å; M375-L437 HydrophobicContact SD-CD1 3.6Å
376	K	94.6	Very high	91.9	Very high	120 Å²	120	49.1 Å²	49.1	52%	0.522	27%	0.271	S	S	.	.	H	α-helix	trans	-60	-36.5	178.7	-172.4	175.4	-179.1	175.1	0	112.8	Q371 I372 K373 A374 G380	Q371-K376 HydrophobicContact CB-CB 4.43Å; I372-K376 PolarHBondContact O-N 3.2Å; K373-K376 PolarHBondContact O-N 3.46Å; A374-K376 PolarHBondContact O-N 3.41Å; K376-G380 PolarHBondContact O-N 3.31Å
377	K	93.7	Very high	91.5	Very high	147 Å²	147	49.9 Å²	49.9	64%	0.639	28%	0.281	S	S	*	.	H	α-helix	trans	-68.6	-37.7	177.7	-75.5	-177.2	177.8	-177.9	0	112.4	K373 A374 M375 L481	K373-K377 WeakPolarHBondContact O-CG 3.38Å; K373-K377 PolarHBondContact O-N 3.34Å; K373-K377 VanDerWaalsContact O-N 3.14Å; A374-K377 PolarHBondContact O-N 3.32Å; M375-K377 VanDerWaalsContact C-N 3.28Å; M375-K377 PolarHBondContact O-N 3.24Å; K377-L481 HydrophobicContact CB-CD1 3.88Å; K377-L481 HydrophobicContact CD-CD1 3.83Å; K377-L481 HydrophobicContact CD-CG 4.44Å
378	V	93.9	Very high	91.3	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-90.9	-27.8	-176.1	-57.6	0	0	0	0	113.6	A374 M375 V434 L437 Y438 T441 L481	A374-V378 PolarHBondContact O-N 2.77Å; M375-V378 WeakPolarHBondContact O-CG2 3.24Å; M375-V378 PolarHBondContact O-N 3.35Å; M375-V378 HydrophobicContact SD-CG2 4.14Å; V378-V434 HydrophobicContact CG1-CG1 4.35Å; V378-V434 HydrophobicContact CG2-CG1 4.28Å; V378-L437 HydrophobicContact CB-CB 4.26Å; V378-L437 HydrophobicContact CG2-CB 3.9Å; V378-L437 HydrophobicContact CG2-CD1 4.45Å; V378-Y438 HydrophobicContact CG1-CD2 3.9Å; V378-Y438 HydrophobicContact CG1-CG 4.4Å; V378-T441 WeakPolarHBondContact O-CG2 3.35Å; V378-L481 HydrophobicContact CG1-CD1 4.09Å; V378-L481 HydrophobicContact CG1-CD2 4.04Å
379	A	92.6	Very high	91.3	Very high	6 Å²	6	50 Å²	50	5%	0.05	27%	0.272	C	S	.	.	H	α-helix	trans	-97.5	-8.7	-177.2	0	0	0	0	0	113.9	A155 M375 T381 L382	A155-A379 HydrophobicContact CB-CB 3.89Å; M375-A379 HydrophobicContact CG-CB 4.4Å; M375-A379 VanDerWaalsContact O-CB 3.28Å; M375-A379 WeakPolarHBondContact O-CB 3.33Å; M375-A379 PolarHBondContact O-N 3.11Å; M375-A379 HydrophobicContact SD-CB 3.98Å; A379-T381 VanDerWaalsContact C-N 3.28Å; A379-T381 PolarHBondContact O-N 3.49Å; A379-T381 VanDerWaalsContact O-N 3.14Å; A379-L382 VanDerWaalsContact O-CB 3.27Å; A379-L382 WeakPolarHBondContact O-CB 3.24Å; A379-L382 PolarHBondContact O-N 2.95Å
380	G	87	Confident	91	Very high	56 Å²	56	50.5 Å²	50.5	58%	0.577	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-32.3	-169.7	0	0	0	0	0	115.4	K376	K376-G380 PolarHBondContact O-N 3.31Å
381	T	86.2	Confident	90.5	Very high	74 Å²	74	56.1 Å²	56.1	45%	0.454	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-14.5	176.5	65.9	0	0	0	0	113.2	A379 R383 L384 D385	A379-T381 VanDerWaalsContact C-N 3.28Å; A379-T381 PolarHBondContact O-N 3.49Å; A379-T381 VanDerWaalsContact O-N 3.14Å; T381-R383 VanDerWaalsContact C-N 3.28Å; T381-R383 PolarHBondContact O-N 3.37Å; T381-R383 VanDerWaalsContact O-N 3.14Å; T381-L384 WeakPolarHBondContact O-CB 3.26Å; T381-L384 PolarHBondContact O-N 2.86Å; T381-D385 WeakPolarHBondContact CB-OD2 3.43Å; T381-D385 VanDerWaalsContact O-CG 3.28Å; T381-D385 PolarHBondContact O-N 2.9Å; T381-D385 PolarHBondContact OG1-OD2 2.93Å
382	L	90.7	Very high	90.2	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-58.3	-38.7	-165.9	-165.7	69	0	0	0	112.9	A155 L156 A379 L386 T416 L420 L437 L440	A155-L382 HydrophobicContact CB-CD2 3.96Å; L156-L382 HydrophobicContact CD2-CB 4.06Å; L156-L382 HydrophobicContact CD2-CD2 3.75Å; L156-L382 HydrophobicContact CD2-CG 3.86Å; A379-L382 VanDerWaalsContact O-CB 3.27Å; A379-L382 WeakPolarHBondContact O-CB 3.24Å; A379-L382 PolarHBondContact O-N 2.95Å; L382-L386 VanDerWaalsContact O-CB 3.31Å; L382-L386 WeakPolarHBondContact O-CB 3.44Å; L382-L386 PolarHBondContact O-N 2.73Å; L382-T416 HydrophobicContact CD1-CG2 3.69Å; L382-T416 HydrophobicContact CG-CG2 4.33Å; L382-L420 HydrophobicContact CD2-CD2 4.31Å; L382-L437 HydrophobicContact CD2-CD2 3.73Å; L382-L440 HydrophobicContact CD1-CD2 3.78Å
383	R	86.2	Confident	89.8	Confident	80 Å²	80	58.3 Å²	58.3	30%	0.302	30%	0.3	S	S	.	.	H	α-helix	trans	-67.4	-41	177.4	-172.2	177.4	178.9	-173.8	-3.5	112.4	L156 A359 G360 S362 T381 A387	L156-R383 HydrophobicContact CD2-CB 4.18Å; A359-R383 PolarHBondContact O-NE 2.95Å; G360-R383 PolarHBondContact O-NH2 3.27Å; S362-R383 PolarHBondContact O-NH2 3.25Å; T381-R383 VanDerWaalsContact C-N 3.28Å; T381-R383 PolarHBondContact O-N 3.37Å; T381-R383 VanDerWaalsContact O-N 3.14Å; R383-A387 WeakPolarHBondContact O-CB 3.16Å; R383-A387 PolarHBondContact O-N 2.75Å
384	L	85.8	Confident	89.2	Confident	129 Å²	129	54.7 Å²	54.7	68%	0.675	29%	0.294	S	S	*	.	H	α-helix	trans	-68.2	-41	177.1	-65.1	174.7	0	0	0	110.7	T381 L386 A387 S388	T381-L384 WeakPolarHBondContact O-CB 3.26Å; T381-L384 PolarHBondContact O-N 2.86Å; L384-L386 VanDerWaalsContact C-N 3.34Å; L384-L386 PolarHBondContact O-N 2.79Å; L384-A387 PolarHBondContact O-N 2.93Å; L384-S388 WeakPolarHBondContact O-CB 3.44Å; L384-S388 PolarHBondContact O-N 2.94Å
385	D	87.5	Confident	88.6	Confident	72 Å²	72	61.1 Å²	61.1	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-42.2	177.6	-63.7	-33.1	0	0	0	111.1	T381 S388 Y389	T381-D385 WeakPolarHBondContact CB-OD2 3.43Å; T381-D385 VanDerWaalsContact O-CG 3.28Å; T381-D385 PolarHBondContact O-N 2.9Å; T381-D385 PolarHBondContact OG1-OD2 2.93Å; D385-S388 PolarHBondContact O-N 3.37Å; D385-Y389 WeakPolarHBondContact O-CB 3.44Å; D385-Y389 PolarHBondContact O-N 3.29Å
386	L	89.6	Confident	88	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.073	33%	0.331	C	S	.	.	H	α-helix	trans	-71.6	-36.6	178.2	-167.9	59.4	0	0	0	112.6	L156 A359 L382 L384 Y389 R390 T416 V417 L420	L156-L386 HydrophobicContact CD1-CD2 4.1Å; A359-L386 HydrophobicContact CB-CD2 3.45Å; A359-L386 VanDerWaalsContact CB-CD2 3.45Å; A359-L386 HydrophobicContact CB-CG 4.15Å; L382-L386 VanDerWaalsContact O-CB 3.31Å; L382-L386 WeakPolarHBondContact O-CB 3.44Å; L382-L386 PolarHBondContact O-N 2.73Å; L384-L386 VanDerWaalsContact C-N 3.34Å; L384-L386 PolarHBondContact O-N 2.79Å; L386-Y389 HydrophobicContact CD1-CD1 4.11Å; L386-Y389 WeakPolarHBondContact O-CB 3.1Å; L386-Y389 PolarHBondContact O-N 2.83Å; L386-R390 WeakPolarHBondContact O-CG 3.41Å; L386-R390 PolarHBondContact O-N 2.9Å; L386-T416 HydrophobicContact CD1-CG2 4.19Å; L386-V417 HydrophobicContact CD1-CG2 3.81Å; L386-L420 HydrophobicContact CD2-CD1 3.9Å
387	A	85.3	Confident	87.3	Confident	48 Å²	48	64.1 Å²	64.1	40%	0.397	34%	0.34	S	S	.	.	H	α-helix	trans	-64	-45.8	172.7	0	0	0	0	0	111.4	R383 L384 Y389 R390 E391	R383-A387 WeakPolarHBondContact O-CB 3.16Å; R383-A387 PolarHBondContact O-N 2.75Å; L384-A387 PolarHBondContact O-N 2.93Å; A387-Y389 VanDerWaalsContact C-N 3.31Å; A387-Y389 PolarHBondContact O-N 2.9Å; A387-R390 PolarHBondContact O-N 3.39Å; A387-E391 PolarHBondContact O-N 2.87Å
388	S	86.1	Confident	86.4	Confident	37 Å²	37	65.7 Å²	65.7	26%	0.259	35%	0.347	S	S	.	.	H	α-helix	trans	-63.2	-38.3	175.5	-176.4	0	0	0	0	111.7	L384 D385 E391 L392	L384-S388 WeakPolarHBondContact O-CB 3.44Å; L384-S388 PolarHBondContact O-N 2.94Å; D385-S388 PolarHBondContact O-N 3.37Å; S388-E391 PolarHBondContact O-N 2.85Å; S388-L392 WeakPolarHBondContact O-CB 3.26Å; S388-L392 VanDerWaalsContact O-CG 3.25Å; S388-L392 WeakPolarHBondContact O-CG 3.32Å; S388-L392 PolarHBondContact O-N 3.03Å
389	Y	90.5	Very high	85.3	Confident	12 Å²	12	67.6 Å²	67.6	5%	0.047	37%	0.368	C	S	.	.	H	α-helix	trans	-58.4	-48.3	173.4	168.3	-103.4	0	0	0	112	D385 L386 A387 L392 E393 L410 G413 R414 V417	D385-Y389 WeakPolarHBondContact O-CB 3.44Å; D385-Y389 PolarHBondContact O-N 3.29Å; L386-Y389 HydrophobicContact CD1-CD1 4.11Å; L386-Y389 WeakPolarHBondContact O-CB 3.1Å; L386-Y389 PolarHBondContact O-N 2.83Å; A387-Y389 VanDerWaalsContact C-N 3.31Å; A387-Y389 PolarHBondContact O-N 2.9Å; Y389-L392 PolarHBondContact O-N 2.92Å; Y389-E393 VanDerWaalsContact O-CB 3.29Å; Y389-E393 WeakPolarHBondContact O-CB 3.4Å; Y389-E393 PolarHBondContact O-N 3.47Å; Y389-E393 PolarHBondContact OH-OE1 3.46Å; Y389-L410 HydrophobicContact CD2-CD2 4.08Å; Y389-L410 HydrophobicContact CE2-CD2 4.03Å; Y389-L410 WeakPolarHBondContact CE2-O 3.48Å; Y389-G413 VanDerWaalsContact CD2-CA 3.4Å; Y389-R414 HydrophobicContact CE2-CG 3.96Å; Y389-R414 WeakPolarHBondContact OH-CG 3.37Å; Y389-V417 HydrophobicContact CD1-CG2 4.31Å; Y389-V417 HydrophobicContact CE1-CG2 3.93Å
390	R	86.2	Confident	84.4	Confident	83 Å²	83	72.7 Å²	72.7	31%	0.313	40%	0.403	S	S	.	.	H	α-helix	trans	-63.7	-41.8	-179.2	-74.3	-68.8	-173.7	-166.1	7.2	112.8	L386 A387 E393 A394	L386-R390 WeakPolarHBondContact O-CG 3.41Å; L386-R390 PolarHBondContact O-N 2.9Å; A387-R390 PolarHBondContact O-N 3.39Å; R390-E393 IonicContact CZ-OE2 2.78Å; R390-E393 IonicContact NH1-OE2 2.79Å; R390-E393 PolarHBondContact NH1-OE2 2.94Å; R390-E393 PolarHBondContact O-N 2.96Å; R390-A394 PolarHBondContact O-N 3.39Å; R390-A394 VanDerWaalsContact O-N 3.17Å
391	E	85.2	Confident	84	Confident	122 Å²	122	77.3 Å²	77.3	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-59.4	-50.4	174.2	-176.4	177.8	-167.7	0	0	110.6	A387 S388 E393 A394 F395	A387-E391 PolarHBondContact O-N 2.87Å; S388-E391 PolarHBondContact O-N 2.85Å; E391-E393 PolarHBondContact O-N 3.13Å; E391-A394 PolarHBondContact O-N 2.96Å; E391-F395 HydrophobicContact CG-CD2 4.16Å; E391-F395 HydrophobicContact CG-CE2 3.72Å; E391-F395 WeakPolarHBondContact O-CD2 3.49Å; E391-F395 PolarHBondContact O-N 2.99Å
392	L	88.4	Confident	83.7	Confident	33 Å²	33	76.5 Å²	76.5	17%	0.173	41%	0.407	C	S	.	.	H	α-helix	trans	-63.7	-41.4	179	-69.3	173.8	0	0	0	112.6	S388 Y389 A394 F395 T396 T406 K409 L410	S388-L392 WeakPolarHBondContact O-CB 3.26Å; S388-L392 VanDerWaalsContact O-CG 3.25Å; S388-L392 WeakPolarHBondContact O-CG 3.32Å; S388-L392 PolarHBondContact O-N 3.03Å; Y389-L392 PolarHBondContact O-N 2.92Å; L392-A394 VanDerWaalsContact C-N 3.28Å; L392-A394 PolarHBondContact O-N 2.97Å; L392-F395 PolarHBondContact O-N 3.39Å; L392-F395 VanDerWaalsContact O-N 3.12Å; L392-T396 WeakPolarHBondContact O-CG2 3.45Å; L392-T396 PolarHBondContact O-N 2.82Å; L392-T406 HydrophobicContact CD2-CG2 4.14Å; L392-K409 HydrophobicContact CD1-CB 3.83Å; L392-K409 HydrophobicContact CD1-CD 3.93Å; L392-L410 HydrophobicContact CB-CD2 3.78Å; L392-L410 HydrophobicContact CB-CG 4.33Å
393	E	86.8	Confident	83.6	Confident	55 Å²	55	80.8 Å²	80.8	26%	0.257	43%	0.43	S	S	.	.	H	α-helix	trans	-56.3	-43.6	178	-177.7	174.3	-128.2	0	0	110.7	Y389 R390 E391 F395 T396 L410	Y389-E393 VanDerWaalsContact O-CB 3.29Å; Y389-E393 WeakPolarHBondContact O-CB 3.4Å; Y389-E393 PolarHBondContact O-N 3.47Å; Y389-E393 PolarHBondContact OH-OE1 3.46Å; R390-E393 IonicContact CZ-OE2 2.78Å; R390-E393 IonicContact NH1-OE2 2.79Å; R390-E393 PolarHBondContact NH1-OE2 2.94Å; R390-E393 PolarHBondContact O-N 2.96Å; E391-E393 PolarHBondContact O-N 3.13Å; E393-F395 PolarHBondContact O-N 3.33Å; E393-T396 PolarHBondContact O-N 3.4Å; E393-T396 PolarHBondContact O-OG1 2.88Å; E393-L410 HydrophobicContact CB-CD2 4.41Å
394	A	84.4	Confident	83.8	Confident	51 Å²	51	80.9 Å²	80.9	42%	0.421	45%	0.448	S	S	.	.	H	α-helix	trans	-62.6	-40.3	176.4	0	0	0	0	0	112.7	R390 E391 L392 F398	R390-A394 PolarHBondContact O-N 3.39Å; R390-A394 VanDerWaalsContact O-N 3.17Å; E391-A394 PolarHBondContact O-N 2.96Å; L392-A394 VanDerWaalsContact C-N 3.28Å; L392-A394 PolarHBondContact O-N 2.97Å; A394-F398 WeakPolarHBondContact O-CD2 3.45Å; A394-F398 WeakPolarHBondContact O-CE2 3.42Å
395	F	83	Confident	83.9	Confident	135 Å²	135	77.7 Å²	77.7	59%	0.592	44%	0.44	S	S	*	.	H	α-helix	trans	-68.7	-33.8	176.7	-75.3	-70.7	0	0	0	113.3	E391 L392 E393 Q397 F398	E391-F395 HydrophobicContact CG-CD2 4.16Å; E391-F395 HydrophobicContact CG-CE2 3.72Å; E391-F395 WeakPolarHBondContact O-CD2 3.49Å; E391-F395 PolarHBondContact O-N 2.99Å; L392-F395 PolarHBondContact O-N 3.39Å; L392-F395 VanDerWaalsContact O-N 3.12Å; E393-F395 PolarHBondContact O-N 3.33Å; F395-Q397 PolarHBondContact O-N 3.02Å; F395-F398 PolarHBondContact O-N 3.49Å
396	T	84.5	Confident	84	Confident	35 Å²	35	75.5 Å²	75.5	22%	0.215	43%	0.429	C	S	.	.	H	α-helix	trans	-68.7	-16.3	-177.6	66.9	0	0	0	0	114	L392 E393 F398 L402 L410	L392-T396 WeakPolarHBondContact O-CG2 3.45Å; L392-T396 PolarHBondContact O-N 2.82Å; E393-T396 PolarHBondContact O-N 3.4Å; E393-T396 PolarHBondContact O-OG1 2.88Å; T396-F398 PolarHBondContact O-N 2.98Å; T396-L402 HydrophobicContact CG2-CD1 3.68Å; T396-L402 HydrophobicContact CG2-CD2 3.64Å; T396-L402 HydrophobicContact CG2-CG 4.3Å; T396-L410 HydrophobicContact CG2-CD1 3.36Å; T396-L410 HydrophobicContact CG2-CD2 4.14Å; T396-L410 HydrophobicContact CG2-CG 4.37Å
397	Q	79.2	Confident	83.9	Confident	152 Å²	152	79.5 Å²	79.5	71%	0.71	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.1	174.2	-62.2	-171.5	-1.5	0	0	112.9	F395	F395-Q397 PolarHBondContact O-N 3.02Å
398	F	75.6	Confident	84.1	Confident	180 Å²	180	80 Å²	80	79%	0.789	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-2.1	-173.6	-58.2	-76.7	0	0	0	115.1	A394 F395 T396	A394-F398 WeakPolarHBondContact O-CD2 3.45Å; A394-F398 WeakPolarHBondContact O-CE2 3.42Å; F395-F398 PolarHBondContact O-N 3.49Å; T396-F398 PolarHBondContact O-N 2.98Å
399	G	70.2	Confident	84.3	Confident	44 Å²	44	84 Å²	84	45%	0.454	47%	0.465	S	S	.	.			trans	-147.4	146.1	-175	0	0	0	0	0	113.9
400	S	73.3	Confident	84.3	Confident	113 Å²	113	83.9 Å²	83.9	79%	0.79	46%	0.464	S	S	*	.	S	Bend	trans	-92.2	-24.9	-175.1	52.5	0	0	0	0	114.8
401	D	78.5	Confident	84.6	Confident	154 Å²	154	83.1 Å²	83.1	82%	0.824	47%	0.466	S	S	*	.			trans	-112.7	108.5	-174.8	-67.6	-33.6	0	0	0	111
402	L	81.8	Confident	84.9	Confident	56 Å²	56	80.4 Å²	80.4	29%	0.293	45%	0.451	S	S	.	.			trans	-105.6	135.3	175.5	-59	165.9	0	0	0	108.9	T396 T406 Q407 L410	T396-L402 HydrophobicContact CG2-CD1 3.68Å; T396-L402 HydrophobicContact CG2-CD2 3.64Å; T396-L402 HydrophobicContact CG2-CG 4.3Å; L402-T406 HydrophobicContact CB-CG2 4.34Å; L402-T406 HydrophobicContact CD2-CG2 3.95Å; L402-Q407 HydrophobicContact CB-CG 3.69Å; L402-Q407 HydrophobicContact CD1-CG 4.44Å; L402-Q407 PolarHBondContact O-NE2 3.14Å; L402-L410 HydrophobicContact CD1-CD1 3.64Å
403	D	88.3	Confident	85.2	Confident	92 Å²	92	79 Å²	79	49%	0.492	44%	0.444	S	S	.	.			trans	-64.6	159	172.5	70.1	88.3	0	0	0	111.5	A405 T406 Q407	D403-A405 PolarHBondContact O-N 2.91Å; D403-A405 WeakPolarHBondContact OD1-CA 3.21Å; D403-A405 WeakPolarHBondContact OD1-CB 3.39Å; D403-A405 PolarHBondContact OD1-N 3.06Å; D403-T406 PolarHBondContact O-N 2.84Å; D403-T406 VanDerWaalsContact O-N 3.16Å; D403-T406 PolarHBondContact OD1-N 2.82Å; D403-T406 PolarHBondContact OD1-OG1 3.01Å; D403-T406 VanDerWaalsContact OD2-CB 3.27Å; D403-T406 WeakPolarHBondContact OD2-CB 3.46Å; D403-T406 PolarHBondContact OD2-OG1 3.37Å; D403-Q407 WeakPolarHBondContact O-CG 3.4Å; D403-Q407 PolarHBondContact O-N 3.49Å
404	A	89.4	Confident	85.5	Confident	82 Å²	82	82.1 Å²	82.1	68%	0.678	45%	0.454	S	S	*	.	H	α-helix	trans	-59.5	-32.4	-174.7	0	0	0	0	0	113.6	A408	A404-A408 WeakPolarHBondContact O-CB 3.2Å; A404-A408 PolarHBondContact O-N 3.48Å
405	A	89	Confident	86	Confident	61 Å²	61	80.9 Å²	80.9	50%	0.504	44%	0.438	S	S	.	.	H	α-helix	trans	-73.2	-41	179.2	0	0	0	0	0	110.9	D403 A408 K409	D403-A405 PolarHBondContact O-N 2.91Å; D403-A405 WeakPolarHBondContact OD1-CA 3.21Å; D403-A405 WeakPolarHBondContact OD1-CB 3.39Å; D403-A405 PolarHBondContact OD1-N 3.06Å; A405-A408 PolarHBondContact O-N 2.88Å; A405-K409 WeakPolarHBondContact O-CG 3.33Å; A405-K409 PolarHBondContact O-N 3.13Å
406	T	88	Confident	86.6	Confident	27 Å²	27	74.6 Å²	74.6	17%	0.166	41%	0.411	C	S	.	.	H	α-helix	trans	-62.8	-43.5	173.2	-62	0	0	0	0	111.5	L392 L402 D403 A408 K409 L410	L392-T406 HydrophobicContact CD2-CG2 4.14Å; L402-T406 HydrophobicContact CB-CG2 4.34Å; L402-T406 HydrophobicContact CD2-CG2 3.95Å; D403-T406 PolarHBondContact O-N 2.84Å; D403-T406 VanDerWaalsContact O-N 3.16Å; D403-T406 PolarHBondContact OD1-N 2.82Å; D403-T406 PolarHBondContact OD1-OG1 3.01Å; D403-T406 VanDerWaalsContact OD2-CB 3.27Å; D403-T406 WeakPolarHBondContact OD2-CB 3.46Å; D403-T406 PolarHBondContact OD2-OG1 3.37Å; T406-A408 PolarHBondContact O-N 3.16Å; T406-K409 PolarHBondContact O-N 2.83Å; T406-L410 HydrophobicContact CG2-CD1 3.99Å; T406-L410 WeakPolarHBondContact O-CG 3.47Å; T406-L410 PolarHBondContact O-N 2.88Å
407	Q	88.3	Confident	87.1	Confident	98 Å²	98	73.7 Å²	73.7	46%	0.458	41%	0.405	S	S	.	.	H	α-helix	trans	-60.9	-43	174.6	-68.8	-174	14.3	0	0	112.2	L402 D403 K409 L410 N411	L402-Q407 HydrophobicContact CB-CG 3.69Å; L402-Q407 HydrophobicContact CD1-CG 4.44Å; L402-Q407 PolarHBondContact O-NE2 3.14Å; D403-Q407 WeakPolarHBondContact O-CG 3.4Å; D403-Q407 PolarHBondContact O-N 3.49Å; Q407-K409 PolarHBondContact O-N 3.27Å; Q407-L410 PolarHBondContact O-N 3Å; Q407-N411 VanDerWaalsContact O-CB 3.27Å; Q407-N411 WeakPolarHBondContact O-CB 3.34Å; Q407-N411 VanDerWaalsContact O-CG 3.26Å; Q407-N411 PolarHBondContact O-N 2.8Å; Q407-N411 PolarHBondContact O-ND2 2.8Å
408	A	89.7	Confident	87.8	Confident	58 Å²	58	68.3 Å²	68.3	48%	0.479	38%	0.38	S	S	.	.	H	α-helix	trans	-61.6	-43.2	177.1	0	0	0	0	0	112	A404 A405 T406 N411 R412	A404-A408 WeakPolarHBondContact O-CB 3.2Å; A404-A408 PolarHBondContact O-N 3.48Å; A405-A408 PolarHBondContact O-N 2.88Å; T406-A408 PolarHBondContact O-N 3.16Å; A408-N411 PolarHBondContact O-N 2.86Å; A408-R412 WeakPolarHBondContact O-CB 3.43Å; A408-R412 PolarHBondContact O-N 3.45Å
409	K	89.8	Confident	88.8	Confident	122 Å²	122	59.7 Å²	59.7	53%	0.53	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-42.7	175.8	-74.1	-175.2	177.9	-173.2	0	112.8	L392 A405 T406 Q407 N411 R412 G413	L392-K409 HydrophobicContact CD1-CB 3.83Å; L392-K409 HydrophobicContact CD1-CD 3.93Å; A405-K409 WeakPolarHBondContact O-CG 3.33Å; A405-K409 PolarHBondContact O-N 3.13Å; T406-K409 PolarHBondContact O-N 2.83Å; Q407-K409 PolarHBondContact O-N 3.27Å; K409-N411 VanDerWaalsContact C-N 3.35Å; K409-R412 PolarHBondContact O-N 3.42Å; K409-G413 PolarHBondContact O-N 3.08Å
410	L	91.7	Very high	90.1	Very high	8 Å²	8	58.2 Å²	58.2	4%	0.042	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-42.5	175.7	-71.9	164.2	0	0	0	111.7	Y389 L392 E393 T396 L402 T406 Q407 G413 R414	Y389-L410 HydrophobicContact CD2-CD2 4.08Å; Y389-L410 HydrophobicContact CE2-CD2 4.03Å; Y389-L410 WeakPolarHBondContact CE2-O 3.48Å; L392-L410 HydrophobicContact CB-CD2 3.78Å; L392-L410 HydrophobicContact CB-CG 4.33Å; E393-L410 HydrophobicContact CB-CD2 4.41Å; T396-L410 HydrophobicContact CG2-CD1 3.36Å; T396-L410 HydrophobicContact CG2-CD2 4.14Å; T396-L410 HydrophobicContact CG2-CG 4.37Å; L402-L410 HydrophobicContact CD1-CD1 3.64Å; T406-L410 HydrophobicContact CG2-CD1 3.99Å; T406-L410 WeakPolarHBondContact O-CG 3.47Å; T406-L410 PolarHBondContact O-N 2.88Å; Q407-L410 PolarHBondContact O-N 3Å; L410-G413 PolarHBondContact O-N 2.95Å; L410-R414 WeakPolarHBondContact O-CG 3.05Å; L410-R414 PolarHBondContact O-N 2.85Å
411	N	92	Very high	91.2	Very high	67 Å²	67	54.6 Å²	54.6	36%	0.358	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-39.5	176.7	-78.8	-24.1	0	0	0	112.2	Q407 A408 K409 R415	Q407-N411 VanDerWaalsContact O-CB 3.27Å; Q407-N411 WeakPolarHBondContact O-CB 3.34Å; Q407-N411 VanDerWaalsContact O-CG 3.26Å; Q407-N411 PolarHBondContact O-N 2.8Å; Q407-N411 PolarHBondContact O-ND2 2.8Å; A408-N411 PolarHBondContact O-N 2.86Å; K409-N411 VanDerWaalsContact C-N 3.35Å; N411-R415 VanDerWaalsContact O-CG 3.23Å; N411-R415 WeakPolarHBondContact O-CG 3.22Å; N411-R415 PolarHBondContact O-N 3Å; N411-R415 PolarHBondContact O-NH1 3.47Å
412	R	92	Very high	92	Very high	65 Å²	65	48.3 Å²	48.3	25%	0.245	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-49.8	171.2	174.1	75.1	81.5	-144.5	-17.6	110.4	A408 K409 R414 R415 T416 L440 G443 D446	A408-R412 WeakPolarHBondContact O-CB 3.43Å; A408-R412 PolarHBondContact O-N 3.45Å; K409-R412 PolarHBondContact O-N 3.42Å; R412-R414 PolarHBondContact O-N 3.09Å; R412-R415 WeakPolarHBondContact O-CA 3.35Å; R412-R415 WeakPolarHBondContact O-CB 3.35Å; R412-R415 PolarHBondContact O-N 3.39Å; R412-T416 PolarHBondContact O-N 3.43Å; R412-T416 PolarHBondContact O-OG1 3.43Å; R412-L440 PolarHBondContact NH1-O 3.07Å; R412-G443 VanDerWaalsContact NH1-CA 3.27Å; R412-D446 IonicContact CZ-OD1 3.29Å; R412-D446 IonicContact CZ-OD2 3.86Å; R412-D446 VanDerWaalsContact CZ-OD2 3.29Å; R412-D446 IonicContact NE-OD1 2.8Å; R412-D446 VanDerWaalsContact NH1-CG 3.27Å; R412-D446 IonicContact NH1-OD1 3.66Å; R412-D446 PolarHBondContact NH1-OD1 3.04Å; R412-D446 IonicContact NH1-OD2 2.94Å; R412-D446 PolarHBondContact NH1-OD2 3.15Å; R412-D446 IonicContact NH2-OD1 3.98Å; R412-D446 PolarHBondContact NH2-OD1 3.27Å; R412-D446 IonicContact NH2-OD2 2.93Å; R412-D446 PolarHBondContact NH2-OD2 3Å
413	G	93.1	Very high	92.7	Very high	3 Å²	3	53.7 Å²	53.7	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-36.8	-176.8	0	0	0	0	0	113.9	Y389 K409 L410 R415 T416 V417	Y389-G413 VanDerWaalsContact CD2-CA 3.4Å; K409-G413 PolarHBondContact O-N 3.08Å; L410-G413 PolarHBondContact O-N 2.95Å; G413-R415 VanDerWaalsContact C-N 3.28Å; G413-R415 PolarHBondContact O-N 3Å; G413-T416 WeakPolarHBondContact O-CB 3.35Å; G413-T416 PolarHBondContact O-N 2.92Å; G413-V417 WeakPolarHBondContact O-CG2 3.12Å; G413-V417 PolarHBondContact O-N 2.96Å
414	R	93.6	Very high	92.9	Very high	121 Å²	121	54.2 Å²	54.2	46%	0.457	28%	0.283	S	S	.	.	H	α-helix	trans	-57.4	-42	169.9	-75.2	174.7	-179.5	174.6	-0.1	111.9	Y389 L410 R412 V417 E418 V450	Y389-R414 HydrophobicContact CE2-CG 3.96Å; Y389-R414 WeakPolarHBondContact OH-CG 3.37Å; L410-R414 WeakPolarHBondContact O-CG 3.05Å; L410-R414 PolarHBondContact O-N 2.85Å; R412-R414 PolarHBondContact O-N 3.09Å; R414-V417 PolarHBondContact O-N 3.39Å; R414-E418 PolarHBondContact O-N 3.23Å; R414-E418 VanDerWaalsContact O-N 3.13Å; R414-V450 HydrophobicContact CB-CG2 4.26Å
415	R	95.2	Very high	93.2	Very high	25 Å²	25	52.7 Å²	52.7	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-68.1	-40.9	176.6	-62.7	175	163.5	74.3	-0.5	111.4	N411 R412 G413 V417 E418 V419 L440 L445 D446 I448 V450 I453	N411-R415 VanDerWaalsContact O-CG 3.23Å; N411-R415 WeakPolarHBondContact O-CG 3.22Å; N411-R415 PolarHBondContact O-N 3Å; N411-R415 PolarHBondContact O-NH1 3.47Å; R412-R415 WeakPolarHBondContact O-CA 3.35Å; R412-R415 WeakPolarHBondContact O-CB 3.35Å; R412-R415 PolarHBondContact O-N 3.39Å; G413-R415 VanDerWaalsContact C-N 3.28Å; G413-R415 PolarHBondContact O-N 3Å; R415-V417 VanDerWaalsContact C-N 3.34Å; R415-V417 PolarHBondContact O-N 2.71Å; R415-E418 PolarHBondContact O-N 3.05Å; R415-V419 WeakPolarHBondContact O-CG2 3.22Å; R415-V419 PolarHBondContact O-N 2.79Å; R415-L440 HydrophobicContact CB-CD1 4.09Å; R415-L445 WeakPolarHBondContact CD-O 3.28Å; R415-L445 PolarHBondContact NE-O 2.84Å; R415-D446 VanDerWaalsContact CZ-O 3.26Å; R415-D446 PolarHBondContact NE-O 3.38Å; R415-D446 PolarHBondContact NH2-O 2.83Å; R415-I448 PolarHBondContact NE-O 2.83Å; R415-I448 PolarHBondContact NH2-O 2.67Å; R415-V450 HydrophobicContact CG-CG2 4.34Å; R415-I453 HydrophobicContact CB-CD1 3.74Å; R415-I453 HydrophobicContact CG-CD1 3.66Å
416	T	95	Very high	93.5	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-57.5	-46.4	173.9	-58.3	0	0	0	0	111.4	L382 L386 R412 G413 E418 V419 L420 L440	L382-T416 HydrophobicContact CD1-CG2 3.69Å; L382-T416 HydrophobicContact CG-CG2 4.33Å; L386-T416 HydrophobicContact CD1-CG2 4.19Å; R412-T416 PolarHBondContact O-N 3.43Å; R412-T416 PolarHBondContact O-OG1 3.43Å; G413-T416 WeakPolarHBondContact O-CB 3.35Å; G413-T416 PolarHBondContact O-N 2.92Å; T416-E418 PolarHBondContact O-N 3.12Å; T416-V419 PolarHBondContact O-N 2.75Å; T416-L420 HydrophobicContact CG2-CD1 4.08Å; T416-L420 VanDerWaalsContact O-CG 3.28Å; T416-L420 WeakPolarHBondContact O-CG 3.46Å; T416-L420 PolarHBondContact O-N 2.67Å; T416-L440 HydrophobicContact CG2-CD2 4Å
417	V	94.6	Very high	94	Very high	16 Å²	16	51.9 Å²	51.9	10%	0.097	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-45.3	177.4	171.4	0	0	0	0	111.3	I353 L386 Y389 G413 R414 R415 L420 K421	I353-V417 HydrophobicContact CD1-CG1 3.68Å; I353-V417 HydrophobicContact CG1-CG1 3.78Å; L386-V417 HydrophobicContact CD1-CG2 3.81Å; Y389-V417 HydrophobicContact CD1-CG2 4.31Å; Y389-V417 HydrophobicContact CE1-CG2 3.93Å; G413-V417 WeakPolarHBondContact O-CG2 3.12Å; G413-V417 PolarHBondContact O-N 2.96Å; R414-V417 PolarHBondContact O-N 3.39Å; R415-V417 VanDerWaalsContact C-N 3.34Å; R415-V417 PolarHBondContact O-N 2.71Å; V417-L420 PolarHBondContact O-N 3.23Å; V417-K421 PolarHBondContact O-N 2.68Å
418	E	95.8	Very high	94.3	Very high	39 Å²	39	48.5 Å²	48.5	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-64.5	-43.5	176.9	-68.5	-53.4	140.6	0	0	112.7	R414 R415 T416 L420 K421 V450 I453 L454	R414-E418 PolarHBondContact O-N 3.23Å; R414-E418 VanDerWaalsContact O-N 3.13Å; R415-E418 PolarHBondContact O-N 3.05Å; T416-E418 PolarHBondContact O-N 3.12Å; E418-L420 PolarHBondContact O-N 2.85Å; E418-K421 WeakPolarHBondContact O-CB 3.45Å; E418-K421 PolarHBondContact O-N 3.43Å; E418-K421 VanDerWaalsContact O-N 3.09Å; E418-K421 IonicContact OE1-NZ 3.8Å; E418-K421 PolarHBondContact OE1-NZ 2.97Å; E418-K421 WeakPolarHBondContact OE2-CD 3.4Å; E418-K421 WeakPolarHBondContact OE2-CE 3.41Å; E418-K421 IonicContact OE2-NZ 2.8Å; E418-K421 PolarHBondContact OE2-NZ 3.25Å; E418-V450 HydrophobicContact CG-CG1 3.38Å; E418-I453 HydrophobicContact CB-CB 4.13Å; E418-I453 HydrophobicContact CB-CD1 3.84Å; E418-I453 HydrophobicContact CB-CG2 4.04Å; E418-I453 HydrophobicContact CG-CD1 4.25Å; E418-L454 WeakPolarHBondContact O-CD2 3.38Å
419	V	96.5	Very high	94.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-34.1	176.3	167.3	0	0	0	0	111.4	K151 R415 T416 K421 I436 L437 L440 L445 I453	K151-V419 WeakPolarHBondContact CD-O 3.28Å; K151-V419 WeakPolarHBondContact CE-O 3.45Å; K151-V419 PolarHBondContact NZ-O 3.14Å; R415-V419 WeakPolarHBondContact O-CG2 3.22Å; R415-V419 PolarHBondContact O-N 2.79Å; T416-V419 PolarHBondContact O-N 2.75Å; V419-K421 VanDerWaalsContact C-N 3.29Å; V419-K421 PolarHBondContact O-N 2.85Å; V419-I436 HydrophobicContact CG1-CG1 3.83Å; V419-I436 HydrophobicContact CG1-CG2 4.38Å; V419-I436 HydrophobicContact CG2-CG1 4.36Å; V419-L437 HydrophobicContact CG1-CD2 4.2Å; V419-L440 HydrophobicContact CB-CD2 4.23Å; V419-L440 HydrophobicContact CG1-CD2 4.18Å; V419-L440 HydrophobicContact CG2-CD1 4.29Å; V419-L440 HydrophobicContact CG2-CD2 4.41Å; V419-L445 HydrophobicContact CG2-CD1 3.46Å; V419-L445 VanDerWaalsContact CG2-CD1 3.46Å; V419-I453 HydrophobicContact CG2-CG2 3.63Å
420	L	95.8	Very high	95	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.063	22%	0.215	C	C	.	.	H	α-helix	trans	-78.6	-9.7	-179.9	-68.7	177.8	0	0	0	113.9	K151 L156 L382 L386 T416 V417 E418 L437	K151-L420 HydrophobicContact CB-CD2 4.15Å; L156-L420 HydrophobicContact CD1-CD1 3.92Å; L382-L420 HydrophobicContact CD2-CD2 4.31Å; L386-L420 HydrophobicContact CD2-CD1 3.9Å; T416-L420 HydrophobicContact CG2-CD1 4.08Å; T416-L420 VanDerWaalsContact O-CG 3.28Å; T416-L420 WeakPolarHBondContact O-CG 3.46Å; T416-L420 PolarHBondContact O-N 2.67Å; V417-L420 PolarHBondContact O-N 3.23Å; E418-L420 PolarHBondContact O-N 2.85Å; L420-L437 HydrophobicContact CD2-CD2 4.47Å
421	K	96.4	Very high	95.2	Very high	37 Å²	37	43.8 Å²	43.8	16%	0.161	22%	0.216	C	C	.	.			trans	-72.2	142.4	174.3	-66.5	178.3	-170.3	170	0	111	K151 G352 R354 V417 E418 V419 L454	K151-K421 PolarHBondContact NZ-O 2.8Å; G352-K421 WeakPolarHBondContact O-CE 3.4Å; R354-K421 CarbonylContact O-C 3.6Å; R354-K421 WeakPolarHBondContact O-CA 3.38Å; V417-K421 PolarHBondContact O-N 2.68Å; E418-K421 WeakPolarHBondContact O-CB 3.45Å; E418-K421 PolarHBondContact O-N 3.43Å; E418-K421 VanDerWaalsContact O-N 3.09Å; E418-K421 IonicContact OE1-NZ 3.8Å; E418-K421 PolarHBondContact OE1-NZ 2.97Å; E418-K421 WeakPolarHBondContact OE2-CD 3.4Å; E418-K421 WeakPolarHBondContact OE2-CE 3.41Å; E418-K421 IonicContact OE2-NZ 2.8Å; E418-K421 PolarHBondContact OE2-NZ 3.25Å; V419-K421 VanDerWaalsContact C-N 3.29Å; V419-K421 PolarHBondContact O-N 2.85Å; K421-L454 HydrophobicContact CB-CD2 4.44Å
422	Q	96.4	Very high	95.4	Very high	22 Å²	22	42 Å²	42	10%	0.103	21%	0.205	C	C	.	.			trans	-140.6	147.4	173.5	-74.7	174.4	-74.6	0	0	111.2	G149 K151 R354	G149-Q422 PolarHBondContact O-NE2 3.44Å; K151-Q422 HydrophobicContact CD-CG 4.5Å; K151-Q422 VanDerWaalsContact CE-CD 3.43Å; R354-Q422 PolarHBondContact O-N 2.87Å
423	K	95.2	Very high	95.7	Very high	170 Å²	170	39 Å²	39	74%	0.739	19%	0.194	S	C	*	.			trans	-73.5	153	172.5	-65.1	177.5	-177.7	172.2	0	109.6	A426	K423-A426 HydrophobicContact CB-CB 4.18Å; K423-A426 PolarHBondContact O-N 3.12Å
424	L	94.2	Very high	95.9	Very high	102 Å²	102	38.8 Å²	38.8	53%	0.534	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	136.3	175.5	-176.9	66.2	0	0	0	110.7	S177 A426	S177-L424 VanDerWaalsContact CB-CD1 3.43Å; S177-L424 WeakPolarHBondContact OG-CD1 3.32Å; L424-A426 PolarHBondContact O-N 3.45Å
425	H	95.7	Very high	96	Very high	50 Å²	50	33 Å²	33	23%	0.231	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	30.2	179.7	-47.6	-39.3	0	0	0	114.3	D181 I184 F215	D181-H425 WeakPolarHBondContact OD1-CA 3.37Å; D181-H425 IonicContact OD1-CE1 3.47Å; D181-H425 IonicContact OD1-CG 3.59Å; D181-H425 PolarHBondContact OD1-N 2.57Å; D181-H425 VanDerWaalsContact OD1-N 3.09Å; D181-H425 IonicContact OD1-ND1 2.8Å; D181-H425 PolarHBondContact OD1-ND1 3.37Å; D181-H425 PolarHBondContact OD2-N 2.84Å; D181-H425 VanDerWaalsContact OD2-N 3.09Å; I184-H425 HydrophobicContact CD1-CB 4.49Å; F215-H425 HydrophobicContact CE1-CB 4.33Å; F215-H425 HydrophobicContact CE2-CB 3.69Å; F215-H425 AromaticContact CE2-CG 3.95Å; F215-H425 HydrophobicContact CZ-CB 3.48Å; F215-H425 VanDerWaalsContact CZ-CB 3.48Å
426	A	95.4	Very high	96.1	Very high	43 Å²	43	31.9 Å²	31.9	36%	0.355	17%	0.166	S	C	.	.			trans	-125.5	58.4	174.5	0	0	0	0	0	111.5	K423 L424	K423-A426 HydrophobicContact CB-CB 4.18Å; K423-A426 PolarHBondContact O-N 3.12Å; L424-A426 PolarHBondContact O-N 3.45Å
427	P	96.6	Very high	96.2	Very high	29 Å²	29	31.7 Å²	31.7	19%	0.188	17%	0.165	C	C	.	.			trans	-61.7	145.6	174.6	28.2	-33.9	0	0	0	110.6	G149 I184 N185	G149-P427 WeakPolarHBondContact O-CA 3.44Å; I184-P427 HydrophobicContact CG2-CG 3.94Å; N185-P427 HydrophobicContact CB-CB 3.85Å; N185-P427 HydrophobicContact CB-CG 4.27Å
428	L	96.4	Very high	96.3	Very high	27 Å²	27	31 Å²	31	14%	0.141	16%	0.161	C	C	.	.			trans	-108.5	134	-178.9	-67.1	176.6	0	0	0	111.1	G149 K151 Q433 E457 F461	G149-L428 WeakPolarHBondContact CA-O 3.31Å; G149-L428 PolarHBondContact O-N 3.45Å; K151-L428 HydrophobicContact CD-CD1 3.85Å; K151-L428 HydrophobicContact CG-CD1 4.14Å; L428-Q433 HydrophobicContact CB-CG 3.81Å; L428-Q433 PolarHBondContact O-NE2 3.39Å; L428-E457 WeakPolarHBondContact CD1-OE1 3.23Å; L428-F461 HydrophobicContact CD1-CE2 3.94Å; L428-F461 HydrophobicContact CD1-CZ 4.33Å; L428-F461 HydrophobicContact CD2-CE2 4.08Å
429	P	96.1	Very high	96.2	Very high	53 Å²	53	29.2 Å²	29.2	34%	0.344	15%	0.152	S	C	.	.			trans	-54	147.1	166.3	-24.5	34	0	0	0	111.8	E431 K432 Q433	P429-E431 HydrophobicContact CB-CG 4.24Å; P429-E431 WeakPolarHBondContact CB-OE2 3.23Å; P429-E431 PolarHBondContact O-N 3.33Å; P429-K432 PolarHBondContact O-N 3.32Å; P429-Q433 PolarHBondContact O-N 3.33Å
430	V	96.4	Very high	96.2	Very high	21 Å²	21	29.2 Å²	29.2	13%	0.127	15%	0.152	C	C	.	.	H	α-helix	trans	-58.8	-35.7	-172.9	67.7	0	0	0	0	112.3	I372 M375 K432 Q433 V434	I372-V430 HydrophobicContact CD1-CG1 4.08Å; I372-V430 HydrophobicContact CD1-CG2 3.6Å; I372-V430 HydrophobicContact CG1-CG2 4.12Å; M375-V430 HydrophobicContact CE-CG2 4.21Å; V430-K432 VanDerWaalsContact C-N 3.35Å; V430-K432 PolarHBondContact O-N 2.8Å; V430-Q433 WeakPolarHBondContact O-CB 3.42Å; V430-Q433 PolarHBondContact O-N 3.35Å; V430-V434 HydrophobicContact CG2-CG2 4.34Å; V430-V434 VanDerWaalsContact O-CG2 3.3Å; V430-V434 WeakPolarHBondContact O-CG2 3.42Å; V430-V434 PolarHBondContact O-N 3.14Å
431	E	96.1	Very high	96	Very high	14 Å²	14	30.7 Å²	30.7	7%	0.065	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-38.9	178.1	58.9	-94.1	-136.7	0	0	112.8	P429 V434 V435 F472 I475 R476	P429-E431 HydrophobicContact CB-CG 4.24Å; P429-E431 WeakPolarHBondContact CB-OE2 3.23Å; P429-E431 PolarHBondContact O-N 3.33Å; E431-V434 PolarHBondContact O-N 2.95Å; E431-V435 WeakPolarHBondContact O-CG2 3.32Å; E431-V435 PolarHBondContact O-N 3.24Å; E431-V435 VanDerWaalsContact O-N 3.14Å; E431-F472 HydrophobicContact CB-CB 4.35Å; E431-F472 HydrophobicContact CB-CD1 3.87Å; E431-F472 HydrophobicContact CB-CG 4.46Å; E431-F472 HydrophobicContact CG-CB 4.01Å; E431-F472 HydrophobicContact CG-CD1 3.87Å; E431-F472 HydrophobicContact CG-CG 4.11Å; E431-I475 HydrophobicContact CB-CB 3.94Å; E431-I475 HydrophobicContact CB-CD1 4.35Å; E431-I475 HydrophobicContact CB-CG2 3.92Å; E431-R476 IonicContact OE1-CZ 2.8Å; E431-R476 VanDerWaalsContact OE1-CZ 3.23Å; E431-R476 IonicContact OE1-NE 2.72Å; E431-R476 PolarHBondContact OE1-NE 3.28Å; E431-R476 IonicContact OE1-NH2 2.63Å; E431-R476 PolarHBondContact OE1-NH2 3.26Å
432	K	97.1	Very high	95.8	Very high	31 Å²	31	33.7 Å²	33.7	14%	0.135	18%	0.176	C	C	.	.	H	α-helix	trans	-68.7	-42.1	175.5	-68.9	-168.6	177.6	-172.5	0	110.7	P429 V430 V434 V435 I436 F461 E465 F472	P429-K432 PolarHBondContact O-N 3.32Å; V430-K432 VanDerWaalsContact C-N 3.35Å; V430-K432 PolarHBondContact O-N 2.8Å; K432-V434 PolarHBondContact O-N 3.46Å; K432-V435 PolarHBondContact O-N 3.17Å; K432-I436 WeakPolarHBondContact O-CG2 3.47Å; K432-I436 PolarHBondContact O-N 2.76Å; K432-I436 VanDerWaalsContact O-N 3.15Å; K432-F461 HydrophobicContact CB-CD1 4.11Å; K432-F461 HydrophobicContact CB-CD2 4.38Å; K432-F461 HydrophobicContact CB-CE1 3.87Å; K432-F461 HydrophobicContact CB-CE2 4.14Å; K432-F461 HydrophobicContact CB-CG 4.36Å; K432-F461 HydrophobicContact CB-CZ 3.88Å; K432-F461 HydrophobicContact CD-CB 4.09Å; K432-F461 HydrophobicContact CD-CD1 4.38Å; K432-F461 HydrophobicContact CD-CD2 3.91Å; K432-F461 HydrophobicContact CD-CE2 4.4Å; K432-F461 HydrophobicContact CD-CG 3.88Å; K432-F461 HydrophobicContact CG-CD1 4.22Å; K432-F461 HydrophobicContact CG-CE1 4.48Å; K432-F461 HydrophobicContact CG-CG 4.24Å; K432-F461 WeakPolarHBondContact O-CE1 3.31Å; K432-F461 WeakPolarHBondContact O-CZ 3.38Å; K432-E465 VanDerWaalsContact CE-CD 3.49Å; K432-E465 WeakPolarHBondContact CE-OE1 3.36Å; K432-E465 IonicContact NZ-OE1 3.41Å; K432-E465 PolarHBondContact NZ-OE1 3.17Å; K432-E465 IonicContact NZ-OE2 3.63Å; K432-E465 PolarHBondContact NZ-OE2 2.87Å; K432-E465 VanDerWaalsContact NZ-OE2 3.09Å; K432-F472 HydrophobicContact CG-CE1 4.16Å; K432-F472 HydrophobicContact CG-CZ 4.09Å
433	Q	97.5	Very high	95.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-45	175.9	-57.4	-175.3	32.7	0	0	111.8	G149 K151 D154 M375 L428 P429 V430 V435 I436 L437	G149-Q433 VanDerWaalsContact CA-NE2 3.35Å; K151-Q433 HydrophobicContact CG-CB 4.23Å; K151-Q433 HydrophobicContact CG-CG 3.87Å; D154-Q433 VanDerWaalsContact CB-OE1 3.29Å; D154-Q433 PolarHBondContact OD2-NE2 3.2Å; D154-Q433 PolarHBondContact OD2-OE1 3.25Å; M375-Q433 HydrophobicContact CE-CB 3.79Å; L428-Q433 HydrophobicContact CB-CG 3.81Å; L428-Q433 PolarHBondContact O-NE2 3.39Å; P429-Q433 PolarHBondContact O-N 3.33Å; V430-Q433 WeakPolarHBondContact O-CB 3.42Å; V430-Q433 PolarHBondContact O-N 3.35Å; Q433-V435 VanDerWaalsContact C-N 3.34Å; Q433-V435 PolarHBondContact O-N 2.96Å; Q433-I436 VanDerWaalsContact O-CG2 3.31Å; Q433-I436 WeakPolarHBondContact O-CG2 3.33Å; Q433-L437 WeakPolarHBondContact O-CB 3.49Å; Q433-L437 WeakPolarHBondContact O-CG 3.34Å; Q433-L437 PolarHBondContact O-N 2.99Å; Q433-L437 VanDerWaalsContact O-N 3.07Å
434	V	97.1	Very high	95.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-44.7	179	168.3	0	0	0	0	111	I372 A374 M375 V378 V430 E431 K432 L437 Y438 I475 L481	I372-V434 HydrophobicContact CD1-CG2 4.39Å; A374-V434 HydrophobicContact CB-CG1 4.01Å; A374-V434 HydrophobicContact CB-CG2 4.16Å; M375-V434 HydrophobicContact CB-CG2 4.16Å; M375-V434 HydrophobicContact CE-CG2 3.9Å; M375-V434 HydrophobicContact SD-CG2 4.43Å; V378-V434 HydrophobicContact CG1-CG1 4.35Å; V378-V434 HydrophobicContact CG2-CG1 4.28Å; V430-V434 HydrophobicContact CG2-CG2 4.34Å; V430-V434 VanDerWaalsContact O-CG2 3.3Å; V430-V434 WeakPolarHBondContact O-CG2 3.42Å; V430-V434 PolarHBondContact O-N 3.14Å; E431-V434 PolarHBondContact O-N 2.95Å; K432-V434 PolarHBondContact O-N 3.46Å; V434-L437 PolarHBondContact O-N 3.17Å; V434-Y438 VanDerWaalsContact O-CB 3.25Å; V434-Y438 WeakPolarHBondContact O-CB 3.45Å; V434-Y438 PolarHBondContact O-N 3.39Å; V434-I475 HydrophobicContact CB-CD1 4.38Å; V434-I475 HydrophobicContact CG1-CD1 4.04Å; V434-I475 HydrophobicContact CG2-CG2 4.44Å; V434-L481 HydrophobicContact CG1-CD2 3.49Å; V434-L481 VanDerWaalsContact CG1-CD2 3.49Å
435	V	96.7	Very high	95.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66	-45.1	-178.1	169	0	0	0	0	112.5	E431 K432 Q433 L437 Y438 A439 L460 L464 F472 I475 L487 I491	E431-V435 WeakPolarHBondContact O-CG2 3.32Å; E431-V435 PolarHBondContact O-N 3.24Å; E431-V435 VanDerWaalsContact O-N 3.14Å; K432-V435 PolarHBondContact O-N 3.17Å; Q433-V435 VanDerWaalsContact C-N 3.34Å; Q433-V435 PolarHBondContact O-N 2.96Å; V435-L437 VanDerWaalsContact C-N 3.32Å; V435-L437 PolarHBondContact O-N 2.8Å; V435-Y438 WeakPolarHBondContact O-CB 3.41Å; V435-Y438 PolarHBondContact O-N 2.79Å; V435-A439 PolarHBondContact O-N 3.38Å; V435-L460 HydrophobicContact CG1-CD2 4.17Å; V435-L464 HydrophobicContact CG1-CD1 3.52Å; V435-F472 HydrophobicContact CB-CE1 4.14Å; V435-F472 HydrophobicContact CG2-CD1 4.16Å; V435-F472 HydrophobicContact CG2-CE1 3.66Å; V435-I475 HydrophobicContact CG2-CD1 3.86Å; V435-L487 HydrophobicContact CG2-CD1 4.17Å; V435-I491 HydrophobicContact CG1-CD1 4.24Å
436	I	97.1	Very high	95.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.4	-36.3	178.9	-171.2	61.6	0	0	0	111.8	K151 V419 K432 Q433 A439 L440 L445 E457 L460 F461	K151-I436 HydrophobicContact CD-CG2 3.98Å; V419-I436 HydrophobicContact CG1-CG1 3.83Å; V419-I436 HydrophobicContact CG1-CG2 4.38Å; V419-I436 HydrophobicContact CG2-CG1 4.36Å; K432-I436 WeakPolarHBondContact O-CG2 3.47Å; K432-I436 PolarHBondContact O-N 2.76Å; K432-I436 VanDerWaalsContact O-N 3.15Å; Q433-I436 VanDerWaalsContact O-CG2 3.31Å; Q433-I436 WeakPolarHBondContact O-CG2 3.33Å; I436-A439 PolarHBondContact O-N 3.17Å; I436-L440 WeakPolarHBondContact O-CB 3.24Å; I436-L440 PolarHBondContact O-N 2.89Å; I436-L445 HydrophobicContact CD1-CD1 4.33Å; I436-E457 HydrophobicContact CB-CG 4.45Å; I436-E457 HydrophobicContact CD1-CB 4Å; I436-E457 HydrophobicContact CD1-CG 4.07Å; I436-E457 HydrophobicContact CG1-CB 4.35Å; I436-E457 HydrophobicContact CG1-CG 3.95Å; I436-L460 HydrophobicContact CD1-CD2 4.41Å; I436-F461 HydrophobicContact CB-CE1 3.95Å; I436-F461 HydrophobicContact CB-CZ 3.9Å; I436-F461 HydrophobicContact CG2-CE1 4.37Å; I436-F461 HydrophobicContact CG2-CZ 3.95Å
437	L	96.7	Very high	95.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.9	-38	174.4	-68.9	173.9	0	0	0	111.5	A155 M375 V378 L382 V419 L420 Q433 V434 V435 L440 T441	A155-L437 HydrophobicContact CB-CD1 3.65Å; M375-L437 HydrophobicContact CE-CD1 4.05Å; M375-L437 HydrophobicContact SD-CD1 3.6Å; V378-L437 HydrophobicContact CB-CB 4.26Å; V378-L437 HydrophobicContact CG2-CB 3.9Å; V378-L437 HydrophobicContact CG2-CD1 4.45Å; L382-L437 HydrophobicContact CD2-CD2 3.73Å; V419-L437 HydrophobicContact CG1-CD2 4.2Å; L420-L437 HydrophobicContact CD2-CD2 4.47Å; Q433-L437 WeakPolarHBondContact O-CB 3.49Å; Q433-L437 WeakPolarHBondContact O-CG 3.34Å; Q433-L437 PolarHBondContact O-N 2.99Å; Q433-L437 VanDerWaalsContact O-N 3.07Å; V434-L437 PolarHBondContact O-N 3.17Å; V435-L437 VanDerWaalsContact C-N 3.32Å; V435-L437 PolarHBondContact O-N 2.8Å; L437-L440 HydrophobicContact CD2-CD2 4.36Å; L437-L440 WeakPolarHBondContact O-CB 3.24Å; L437-L440 PolarHBondContact O-N 2.9Å; L437-T441 WeakPolarHBondContact O-CG2 3.41Å; L437-T441 PolarHBondContact O-N 3.11Å; L437-T441 PolarHBondContact O-OG1 2.76Å
438	Y	96.1	Very high	94.9	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-48.8	172.7	-177.9	-85.3	0	0	0	111.2	V378 V434 V435 L440 T441 H442 L481 T484 L487 D488 I491	V378-Y438 HydrophobicContact CG1-CD2 3.9Å; V378-Y438 HydrophobicContact CG1-CG 4.4Å; V434-Y438 VanDerWaalsContact O-CB 3.25Å; V434-Y438 WeakPolarHBondContact O-CB 3.45Å; V434-Y438 PolarHBondContact O-N 3.39Å; V435-Y438 WeakPolarHBondContact O-CB 3.41Å; V435-Y438 PolarHBondContact O-N 2.79Å; Y438-L440 VanDerWaalsContact C-N 3.26Å; Y438-L440 PolarHBondContact O-N 2.94Å; Y438-T441 PolarHBondContact O-N 3.23Å; Y438-T441 PolarHBondContact O-OG1 3.22Å; Y438-H442 AromaticContact CD1-ND1 3.74Å; Y438-H442 AromaticContact CD2-CE1 3.27Å; Y438-H442 WeakPolarHBondContact CD2-CE1 3.4Å; Y438-H442 AromaticContact CD2-ND1 3.53Å; Y438-H442 HydrophobicContact CE1-CB 4.44Å; Y438-H442 AromaticContact CE1-CG 3.9Å; Y438-H442 AromaticContact CE1-ND1 3.72Å; Y438-H442 AromaticContact CE2-CE1 3.03Å; Y438-H442 WeakPolarHBondContact CE2-CE1 3.24Å; Y438-H442 AromaticContact CE2-ND1 3.52Å; Y438-H442 AromaticContact CE2-NE2 3.5Å; Y438-H442 WeakPolarHBondContact CE2-NE2 3.33Å; Y438-H442 AromaticContact CG-CE1 3.88Å; Y438-H442 AromaticContact CG-ND1 3.63Å; Y438-H442 AromaticContact CZ-CD2 3.83Å; Y438-H442 AromaticContact CZ-CE1 3.46Å; Y438-H442 VanDerWaalsContact CZ-CE1 3.46Å; Y438-H442 AromaticContact CZ-CG 3.84Å; Y438-H442 AromaticContact CZ-ND1 3.6Å; Y438-H442 AromaticContact CZ-NE2 3.64Å; Y438-H442 WeakPolarHBondContact O-CB 3.43Å; Y438-H442 PolarHBondContact O-N 3.26Å; Y438-H442 PolarHBondContact O-ND1 3.32Å; Y438-L481 HydrophobicContact CD2-CD1 4.29Å; Y438-L481 HydrophobicContact CD2-CD2 4.27Å; Y438-L481 HydrophobicContact CE2-CD1 4.44Å; Y438-T484 HydrophobicContact CE2-CG2 4.44Å; Y438-L487 HydrophobicContact CD1-CD2 3.6Å; Y438-L487 HydrophobicContact CD1-CG 3.95Å; Y438-L487 HydrophobicContact CD2-CD2 3.8Å; Y438-L487 HydrophobicContact CE1-CB 4.5Å; Y438-L487 HydrophobicContact CE1-CD2 3.7Å; Y438-L487 HydrophobicContact CE1-CG 3.83Å; Y438-L487 HydrophobicContact CE2-CD2 3.87Å; Y438-L487 HydrophobicContact CG-CD2 3.67Å; Y438-L487 HydrophobicContact CG-CG 4.49Å; Y438-D488 WeakPolarHBondContact CE1-OD1 3.42Å; Y438-D488 VanDerWaalsContact CZ-OD1 3.26Å; Y438-D488 PolarHBondContact OH-OD1 3.27Å; Y438-I491 HydrophobicContact CD1-CD1 3.71Å; Y438-I491 HydrophobicContact CE1-CD1 4.14Å
439	A	95.7	Very high	94.8	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.5	-37.7	176.3	0	0	0	0	0	112.1	V435 I436 V444 L445 I491	V435-A439 PolarHBondContact O-N 3.38Å; I436-A439 PolarHBondContact O-N 3.17Å; A439-V444 HydrophobicContact CB-CB 4.15Å; A439-V444 HydrophobicContact CB-CG2 4.38Å; A439-V444 WeakPolarHBondContact O-CB 3.44Å; A439-V444 PolarHBondContact O-N 3.4Å; A439-V444 VanDerWaalsContact O-N 3.12Å; A439-L445 HydrophobicContact CB-CG 4.47Å; A439-I491 HydrophobicContact CB-CD1 4.31Å; A439-I491 HydrophobicContact CB-CG2 4.24Å
440	L	95	Very high	94.7	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-65.8	-46.2	175.4	175.8	67.4	0	0	0	112.3	L382 R412 R415 T416 V419 I436 L437 Y438 L445	L382-L440 HydrophobicContact CD1-CD2 3.78Å; R412-L440 PolarHBondContact NH1-O 3.07Å; R415-L440 HydrophobicContact CB-CD1 4.09Å; T416-L440 HydrophobicContact CG2-CD2 4Å; V419-L440 HydrophobicContact CB-CD2 4.23Å; V419-L440 HydrophobicContact CG1-CD2 4.18Å; V419-L440 HydrophobicContact CG2-CD1 4.29Å; V419-L440 HydrophobicContact CG2-CD2 4.41Å; I436-L440 WeakPolarHBondContact O-CB 3.24Å; I436-L440 PolarHBondContact O-N 2.89Å; L437-L440 HydrophobicContact CD2-CD2 4.36Å; L437-L440 WeakPolarHBondContact O-CB 3.24Å; L437-L440 PolarHBondContact O-N 2.9Å; Y438-L440 VanDerWaalsContact C-N 3.26Å; Y438-L440 PolarHBondContact O-N 2.94Å; L440-L445 HydrophobicContact CB-CD1 3.9Å; L440-L445 HydrophobicContact CD1-CD1 4.01Å
441	T	92.1	Very high	94.5	Very high	43 Å²	43	27.1 Å²	27.1	26%	0.264	16%	0.156	S	C	.	.	H	α-helix	trans	-75.2	-27.2	-176.4	57.8	0	0	0	0	113.4	V378 L437 Y438 G443	V378-T441 WeakPolarHBondContact O-CG2 3.35Å; L437-T441 WeakPolarHBondContact O-CG2 3.41Å; L437-T441 PolarHBondContact O-N 3.11Å; L437-T441 PolarHBondContact O-OG1 2.76Å; Y438-T441 PolarHBondContact O-N 3.23Å; Y438-T441 PolarHBondContact O-OG1 3.22Å; T441-G443 VanDerWaalsContact C-N 3.35Å
442	H	91.6	Very high	94.5	Very high	100 Å²	100	26.5 Å²	26.5	46%	0.463	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	8.5	-179.4	-67.9	78	0	0	0	114.1	Y438 V444	Y438-H442 AromaticContact CD1-ND1 3.74Å; Y438-H442 AromaticContact CD2-CE1 3.27Å; Y438-H442 WeakPolarHBondContact CD2-CE1 3.4Å; Y438-H442 AromaticContact CD2-ND1 3.53Å; Y438-H442 HydrophobicContact CE1-CB 4.44Å; Y438-H442 AromaticContact CE1-CG 3.9Å; Y438-H442 AromaticContact CE1-ND1 3.72Å; Y438-H442 AromaticContact CE2-CE1 3.03Å; Y438-H442 WeakPolarHBondContact CE2-CE1 3.24Å; Y438-H442 AromaticContact CE2-ND1 3.52Å; Y438-H442 AromaticContact CE2-NE2 3.5Å; Y438-H442 WeakPolarHBondContact CE2-NE2 3.33Å; Y438-H442 AromaticContact CG-CE1 3.88Å; Y438-H442 AromaticContact CG-ND1 3.63Å; Y438-H442 AromaticContact CZ-CD2 3.83Å; Y438-H442 AromaticContact CZ-CE1 3.46Å; Y438-H442 VanDerWaalsContact CZ-CE1 3.46Å; Y438-H442 AromaticContact CZ-CG 3.84Å; Y438-H442 AromaticContact CZ-ND1 3.6Å; Y438-H442 AromaticContact CZ-NE2 3.64Å; Y438-H442 WeakPolarHBondContact O-CB 3.43Å; Y438-H442 PolarHBondContact O-N 3.26Å; Y438-H442 PolarHBondContact O-ND1 3.32Å; H442-V444 VanDerWaalsContact C-N 3.31Å; H442-V444 HydrophobicContact CB-CG2 4.5Å; H442-V444 PolarHBondContact O-N 3.21Å
443	G	91.7	Very high	94.4	Very high	18 Å²	18	25 Å²	25	19%	0.186	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-2.9	175.4	0	0	0	0	0	115.8	R412 T441 L445 D446	R412-G443 VanDerWaalsContact NH1-CA 3.27Å; T441-G443 VanDerWaalsContact C-N 3.35Å; G443-L445 PolarHBondContact O-N 2.87Å; G443-D446 WeakPolarHBondContact CA-OD2 3.49Å; G443-D446 WeakPolarHBondContact O-CB 3.25Å; G443-D446 PolarHBondContact O-N 2.79Å; G443-D446 VanDerWaalsContact O-N 3.08Å
444	V	92.4	Very high	94.2	Very high	16 Å²	16	28 Å²	28	10%	0.097	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-57.8	-42.8	-175.4	-179.1	0	0	0	0	110.9	A439 H442 D446 F456 I491 K495	A439-V444 HydrophobicContact CB-CB 4.15Å; A439-V444 HydrophobicContact CB-CG2 4.38Å; A439-V444 WeakPolarHBondContact O-CB 3.44Å; A439-V444 PolarHBondContact O-N 3.4Å; A439-V444 VanDerWaalsContact O-N 3.12Å; H442-V444 VanDerWaalsContact C-N 3.31Å; H442-V444 HydrophobicContact CB-CG2 4.5Å; H442-V444 PolarHBondContact O-N 3.21Å; V444-D446 VanDerWaalsContact C-N 3.26Å; V444-D446 PolarHBondContact O-N 3.21Å; V444-F456 HydrophobicContact CG1-CZ 4.39Å; V444-I491 HydrophobicContact CB-CG2 4.19Å; V444-I491 HydrophobicContact CG1-CG2 3.46Å; V444-I491 VanDerWaalsContact CG1-CG2 3.46Å; V444-I491 HydrophobicContact CG2-CG2 3.94Å; V444-K495 HydrophobicContact CG1-CD 3.84Å; V444-K495 WeakPolarHBondContact O-CE 3.38Å; V444-K495 PolarHBondContact O-NZ 3.46Å
445	L	94.5	Very high	94.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-74.4	-8.8	-176.5	-58.1	-175.9	0	0	0	114.1	R415 V419 I436 A439 L440 G443 S447 I448 F456	R415-L445 WeakPolarHBondContact CD-O 3.28Å; R415-L445 PolarHBondContact NE-O 2.84Å; V419-L445 HydrophobicContact CG2-CD1 3.46Å; V419-L445 VanDerWaalsContact CG2-CD1 3.46Å; I436-L445 HydrophobicContact CD1-CD1 4.33Å; A439-L445 HydrophobicContact CB-CG 4.47Å; L440-L445 HydrophobicContact CB-CD1 3.9Å; L440-L445 HydrophobicContact CD1-CD1 4.01Å; G443-L445 PolarHBondContact O-N 2.87Å; L445-S447 VanDerWaalsContact C-N 3.25Å; L445-S447 PolarHBondContact O-N 3.46Å; L445-I448 HydrophobicContact CD2-CG1 4.45Å; L445-I448 PolarHBondContact O-N 2.92Å; L445-F456 HydrophobicContact CD2-CD1 3.51Å; L445-F456 HydrophobicContact CD2-CE1 3.36Å; L445-F456 HydrophobicContact CD2-CG 4.35Å; L445-F456 HydrophobicContact CD2-CZ 4.1Å
446	D	92.4	Very high	94	Very high	66 Å²	66	29.5 Å²	29.5	35%	0.353	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-63.4	-29.8	-172.7	-69.8	-20.6	0	0	0	113.5	R412 R415 G443 V444	R412-D446 IonicContact CZ-OD1 3.29Å; R412-D446 IonicContact CZ-OD2 3.86Å; R412-D446 VanDerWaalsContact CZ-OD2 3.29Å; R412-D446 IonicContact NE-OD1 2.8Å; R412-D446 VanDerWaalsContact NH1-CG 3.27Å; R412-D446 IonicContact NH1-OD1 3.66Å; R412-D446 PolarHBondContact NH1-OD1 3.04Å; R412-D446 IonicContact NH1-OD2 2.94Å; R412-D446 PolarHBondContact NH1-OD2 3.15Å; R412-D446 IonicContact NH2-OD1 3.98Å; R412-D446 PolarHBondContact NH2-OD1 3.27Å; R412-D446 IonicContact NH2-OD2 2.93Å; R412-D446 PolarHBondContact NH2-OD2 3Å; R415-D446 VanDerWaalsContact CZ-O 3.26Å; R415-D446 PolarHBondContact NE-O 3.38Å; R415-D446 PolarHBondContact NH2-O 2.83Å; G443-D446 WeakPolarHBondContact CA-OD2 3.49Å; G443-D446 WeakPolarHBondContact O-CB 3.25Å; G443-D446 PolarHBondContact O-N 2.79Å; G443-D446 VanDerWaalsContact O-N 3.08Å; V444-D446 VanDerWaalsContact C-N 3.26Å; V444-D446 PolarHBondContact O-N 3.21Å
447	S	91.4	Very high	94	Very high	78 Å²	78	30.1 Å²	30.1	55%	0.545	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-87.7	-11.2	176	63.3	0	0	0	0	113.7	L445 K495	L445-S447 VanDerWaalsContact C-N 3.25Å; L445-S447 PolarHBondContact O-N 3.46Å; S447-K495 WeakPolarHBondContact OG-CE 3.42Å; S447-K495 PolarHBondContact OG-NZ 3.24Å
448	I	93.7	Very high	93.9	Very high	10 Å²	10	32.9 Å²	32.9	5%	0.051	20%	0.197	C	C	.	.	S	Bend	trans	-82.8	131.7	-178.8	-53.9	-57.9	0	0	0	109.2	R415 L445 I453 F456 K495 F498	R415-I448 PolarHBondContact NE-O 2.83Å; R415-I448 PolarHBondContact NH2-O 2.67Å; L445-I448 HydrophobicContact CD2-CG1 4.45Å; L445-I448 PolarHBondContact O-N 2.92Å; I448-I453 HydrophobicContact CG2-CG1 4.36Å; I448-F456 HydrophobicContact CD1-CD2 4.01Å; I448-F456 HydrophobicContact CD1-CE2 4.09Å; I448-F456 HydrophobicContact CG1-CD2 4.12Å; I448-F456 HydrophobicContact CG1-CE2 4.26Å; I448-F456 HydrophobicContact CG2-CB 4.35Å; I448-K495 HydrophobicContact CD1-CG 4.45Å; I448-F498 HydrophobicContact CD1-CD1 4.02Å; I448-F498 HydrophobicContact CD1-CE1 4.34Å; I448-F498 HydrophobicContact CG2-CE1 4.18Å
449	P	93.6	Very high	93.9	Very high	52 Å²	52	36.2 Å²	36.2	34%	0.338	21%	0.212	S	C	.	.			trans	-59.4	140.6	173.2	-24.6	35.1	0	0	0	112.1	N451 S452 A500	P449-N451 VanDerWaalsContact C-N 3.27Å; P449-N451 WeakPolarHBondContact CB-OD1 3.22Å; P449-N451 PolarHBondContact O-N 2.85Å; P449-S452 PolarHBondContact O-N 3.48Å; P449-A500 HydrophobicContact CG-CB 4.18Å
450	V	93.3	Very high	93.9	Very high	43 Å²	43	36.2 Å²	36.2	26%	0.261	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-56.6	-40.1	-174.3	177.1	0	0	0	0	112.4	R414 R415 E418 S452 I453	R414-V450 HydrophobicContact CB-CG2 4.26Å; R415-V450 HydrophobicContact CG-CG2 4.34Å; E418-V450 HydrophobicContact CG-CG1 3.38Å; V450-S452 PolarHBondContact O-N 2.78Å; V450-I453 WeakPolarHBondContact O-CG1 3.47Å; V450-I453 PolarHBondContact O-N 3.03Å
451	N	93.7	Very high	93.9	Very high	96 Å²	96	36.7 Å²	36.7	51%	0.513	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-67.3	-17.8	177.5	52.8	-41.1	0	0	0	114.7	P449 N504	P449-N451 VanDerWaalsContact C-N 3.27Å; P449-N451 WeakPolarHBondContact CB-OD1 3.22Å; P449-N451 PolarHBondContact O-N 2.85Å; N451-N504 PolarHBondContact ND2-ND2 2.87Å; N451-N504 PolarHBondContact ND2-OD1 3.21Å
452	S	94.8	Very high	94.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-101.5	0.5	-178.2	-58.5	0	0	0	0	113.2	P449 V450 L454 D455 F456	P449-S452 PolarHBondContact O-N 3.48Å; V450-S452 PolarHBondContact O-N 2.78Å; S452-L454 PolarHBondContact O-N 2.87Å; S452-D455 PolarHBondContact O-N 3.19Å; S452-F456 WeakPolarHBondContact O-CB 3.28Å; S452-F456 PolarHBondContact O-N 2.79Å
453	I	95.3	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-43.1	-174.5	-71.6	171.5	0	0	0	112.7	R415 E418 V419 I448 V450 D455 F456 E457	R415-I453 HydrophobicContact CB-CD1 3.74Å; R415-I453 HydrophobicContact CG-CD1 3.66Å; E418-I453 HydrophobicContact CB-CB 4.13Å; E418-I453 HydrophobicContact CB-CD1 3.84Å; E418-I453 HydrophobicContact CB-CG2 4.04Å; E418-I453 HydrophobicContact CG-CD1 4.25Å; V419-I453 HydrophobicContact CG2-CG2 3.63Å; I448-I453 HydrophobicContact CG2-CG1 4.36Å; V450-I453 WeakPolarHBondContact O-CG1 3.47Å; V450-I453 PolarHBondContact O-N 3.03Å; I453-D455 VanDerWaalsContact C-N 3.25Å; I453-D455 PolarHBondContact O-N 3.03Å; I453-F456 WeakPolarHBondContact O-CB 3.44Å; I453-F456 PolarHBondContact O-N 2.93Å; I453-E457 WeakPolarHBondContact O-CB 3.24Å; I453-E457 PolarHBondContact O-N 2.89Å
454	L	93.6	Very high	94.5	Very high	62 Å²	62	36.3 Å²	36.3	33%	0.325	20%	0.204	S	C	.	.	H	α-helix	trans	-68.2	-29.8	-179.6	-66.8	178.3	0	0	0	112.1	E418 K421 S452 A458	E418-L454 WeakPolarHBondContact O-CD2 3.38Å; K421-L454 HydrophobicContact CB-CD2 4.44Å; S452-L454 PolarHBondContact O-N 2.87Å; L454-A458 PolarHBondContact O-N 3.06Å
455	D	94.2	Very high	94.6	Very high	32 Å²	32	40.3 Å²	40.3	17%	0.171	22%	0.222	C	C	.	.	H	α-helix	trans	-77	-41.1	176.4	-55.4	-36.6	0	0	0	110.1	S452 I453 E457 A458 Q459 A503 K507	S452-D455 PolarHBondContact O-N 3.19Å; I453-D455 VanDerWaalsContact C-N 3.25Å; I453-D455 PolarHBondContact O-N 3.03Å; D455-E457 VanDerWaalsContact C-N 3.33Å; D455-E457 PolarHBondContact O-N 3.48Å; D455-A458 PolarHBondContact O-N 3.3Å; D455-Q459 WeakPolarHBondContact O-CB 3.43Å; D455-Q459 WeakPolarHBondContact O-CG 3.13Å; D455-Q459 PolarHBondContact O-N 3.44Å; D455-A503 HydrophobicContact CB-CB 3.91Å; D455-K507 IonicContact OD1-NZ 3.29Å; D455-K507 PolarHBondContact OD1-NZ 3.38Å; D455-K507 IonicContact OD2-NZ 2.7Å; D455-K507 PolarHBondContact OD2-NZ 3.01Å
456	F	96.5	Very high	94.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-46.9	170.1	-179.4	-87	0	0	0	111.3	V444 L445 I448 S452 I453 L460 F494 K495 F498	V444-F456 HydrophobicContact CG1-CZ 4.39Å; L445-F456 HydrophobicContact CD2-CD1 3.51Å; L445-F456 HydrophobicContact CD2-CE1 3.36Å; L445-F456 HydrophobicContact CD2-CG 4.35Å; L445-F456 HydrophobicContact CD2-CZ 4.1Å; I448-F456 HydrophobicContact CD1-CD2 4.01Å; I448-F456 HydrophobicContact CD1-CE2 4.09Å; I448-F456 HydrophobicContact CG1-CD2 4.12Å; I448-F456 HydrophobicContact CG1-CE2 4.26Å; I448-F456 HydrophobicContact CG2-CB 4.35Å; S452-F456 WeakPolarHBondContact O-CB 3.28Å; S452-F456 PolarHBondContact O-N 2.79Å; I453-F456 WeakPolarHBondContact O-CB 3.44Å; I453-F456 PolarHBondContact O-N 2.93Å; F456-L460 HydrophobicContact CE1-CB 4.35Å; F456-L460 HydrophobicContact CE1-CD2 3.9Å; F456-L460 WeakPolarHBondContact O-CB 3.38Å; F456-L460 PolarHBondContact O-N 3.4Å; F456-F494 HydrophobicContact CD2-CD1 4.33Å; F456-F494 AromaticContact CD2-CE1 3.68Å; F456-F494 HydrophobicContact CD2-CE1 3.68Å; F456-F494 HydrophobicContact CE1-CD1 4.5Å; F456-F494 HydrophobicContact CE1-CE1 4.39Å; F456-F494 AromaticContact CE2-CD1 3.71Å; F456-F494 HydrophobicContact CE2-CD1 3.71Å; F456-F494 AromaticContact CE2-CE1 3.54Å; F456-F494 HydrophobicContact CE2-CE1 3.54Å; F456-F494 HydrophobicContact CG-CE1 4.18Å; F456-F494 AromaticContact CZ-CD1 3.8Å; F456-F494 HydrophobicContact CZ-CD1 3.8Å; F456-F494 AromaticContact CZ-CE1 3.92Å; F456-F494 HydrophobicContact CZ-CE1 3.92Å; F456-K495 HydrophobicContact CE2-CB 4.38Å; F456-K495 HydrophobicContact CE2-CG 4.49Å; F456-F498 HydrophobicContact CB-CD2 4.49Å; F456-F498 HydrophobicContact CB-CE1 4.08Å; F456-F498 HydrophobicContact CB-CE2 3.94Å; F456-F498 HydrophobicContact CB-CZ 3.69Å; F456-F498 HydrophobicContact CD2-CB 4.21Å; F456-F498 AromaticContact CD2-CD1 3.65Å; F456-F498 HydrophobicContact CD2-CD1 3.65Å; F456-F498 AromaticContact CD2-CD2 3.96Å; F456-F498 HydrophobicContact CD2-CD2 3.96Å; F456-F498 AromaticContact CD2-CE1 3.9Å; F456-F498 HydrophobicContact CD2-CE1 3.9Å; F456-F498 HydrophobicContact CD2-CE2 4.21Å; F456-F498 AromaticContact CD2-CG 3.65Å; F456-F498 HydrophobicContact CD2-CG 3.65Å; F456-F498 HydrophobicContact CD2-CZ 4.18Å; F456-F498 HydrophobicContact CE2-CB 4.32Å; F456-F498 HydrophobicContact CE2-CD1 4.38Å; F456-F498 HydrophobicContact CE2-CG 4.25Å; F456-F498 HydrophobicContact CG-CZ 4.47Å
457	E	95.7	Very high	94.7	Very high	13 Å²	13	46.4 Å²	46.4	6%	0.061	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-50.7	178.2	176.9	-176.9	161.3	0	0	111.7	K151 L428 I436 I453 D455 Q459 L460 F461	K151-E457 IonicContact NZ-OE1 3.26Å; K151-E457 PolarHBondContact NZ-OE1 3.22Å; K151-E457 IonicContact NZ-OE2 3.13Å; K151-E457 PolarHBondContact NZ-OE2 2.91Å; L428-E457 WeakPolarHBondContact CD1-OE1 3.23Å; I436-E457 HydrophobicContact CB-CG 4.45Å; I436-E457 HydrophobicContact CD1-CB 4Å; I436-E457 HydrophobicContact CD1-CG 4.07Å; I436-E457 HydrophobicContact CG1-CB 4.35Å; I436-E457 HydrophobicContact CG1-CG 3.95Å; I453-E457 WeakPolarHBondContact O-CB 3.24Å; I453-E457 PolarHBondContact O-N 2.89Å; D455-E457 VanDerWaalsContact C-N 3.33Å; D455-E457 PolarHBondContact O-N 3.48Å; E457-Q459 PolarHBondContact O-N 2.87Å; E457-L460 PolarHBondContact O-N 2.8Å; E457-F461 HydrophobicContact CG-CD2 4.09Å; E457-F461 HydrophobicContact CG-CE1 4.2Å; E457-F461 HydrophobicContact CG-CE2 3.33Å; E457-F461 HydrophobicContact CG-CZ 3.4Å; E457-F461 WeakPolarHBondContact O-CD2 3.33Å; E457-F461 WeakPolarHBondContact O-CG 3.42Å; E457-F461 PolarHBondContact O-N 3.2Å; E457-F461 VanDerWaalsContact O-N 3.1Å; E457-F461 WeakPolarHBondContact OE1-CE2 3.36Å
458	A	95	Very high	94.8	Very high	59 Å²	59	44.7 Å²	44.7	49%	0.488	24%	0.241	S	C	.	.	H	α-helix	trans	-62.3	-45.8	-178.1	0	0	0	0	0	112	L454 D455 F461 E462	L454-A458 PolarHBondContact O-N 3.06Å; D455-A458 PolarHBondContact O-N 3.3Å; A458-F461 PolarHBondContact O-N 2.79Å; A458-E462 PolarHBondContact O-N 2.86Å
459	Q	95.7	Very high	94.8	Very high	72 Å²	72	47.8 Å²	47.8	34%	0.336	26%	0.264	S	S	.	.	H	α-helix	trans	-70.5	-36	179.8	-69.7	-179.1	27.4	0	0	112.3	D455 E457 F461 E462 Y463 F494	D455-Q459 WeakPolarHBondContact O-CB 3.43Å; D455-Q459 WeakPolarHBondContact O-CG 3.13Å; D455-Q459 PolarHBondContact O-N 3.44Å; E457-Q459 PolarHBondContact O-N 2.87Å; Q459-F461 VanDerWaalsContact C-N 3.3Å; Q459-F461 PolarHBondContact O-N 3.33Å; Q459-E462 PolarHBondContact O-N 2.76Å; Q459-Y463 VanDerWaalsContact O-CB 3.3Å; Q459-Y463 WeakPolarHBondContact O-CB 3.46Å; Q459-Y463 PolarHBondContact O-N 2.9Å; Q459-F494 VanDerWaalsContact C-CZ 3.49Å; Q459-F494 HydrophobicContact CB-CE1 4.44Å; Q459-F494 HydrophobicContact CB-CE2 3.87Å; Q459-F494 HydrophobicContact CB-CZ 3.39Å
460	L	96.1	Very high	94.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-43.6	174.2	175.1	65.9	0	0	0	110.5	V435 I436 F456 E457 Y463 L464 I491 F494	V435-L460 HydrophobicContact CG1-CD2 4.17Å; I436-L460 HydrophobicContact CD1-CD2 4.41Å; F456-L460 HydrophobicContact CE1-CB 4.35Å; F456-L460 HydrophobicContact CE1-CD2 3.9Å; F456-L460 WeakPolarHBondContact O-CB 3.38Å; F456-L460 PolarHBondContact O-N 3.4Å; E457-L460 PolarHBondContact O-N 2.8Å; L460-Y463 PolarHBondContact O-N 3.41Å; L460-L464 HydrophobicContact CD1-CD1 3.83Å; L460-L464 HydrophobicContact CD1-CG 3.99Å; L460-L464 HydrophobicContact CG-CD1 3.97Å; L460-L464 HydrophobicContact CG-CG 4.44Å; L460-L464 WeakPolarHBondContact O-CB 3.19Å; L460-L464 VanDerWaalsContact O-CG 3.31Å; L460-L464 WeakPolarHBondContact O-CG 3.13Å; L460-L464 PolarHBondContact O-N 3.23Å; L460-I491 HydrophobicContact CD1-CG1 4.4Å; L460-F494 HydrophobicContact CB-CD1 3.76Å; L460-F494 HydrophobicContact CB-CE1 3.64Å; L460-F494 HydrophobicContact CB-CG 4.49Å; L460-F494 HydrophobicContact CB-CZ 4.33Å; L460-F494 HydrophobicContact CD1-CB 3.93Å; L460-F494 HydrophobicContact CD1-CD1 3.5Å; L460-F494 VanDerWaalsContact CD1-CD1 3.5Å; L460-F494 HydrophobicContact CD1-CE1 4.3Å; L460-F494 HydrophobicContact CD1-CG 3.81Å; L460-F494 HydrophobicContact CG-CD1 4.21Å
461	F	95.8	Very high	94.9	Very high	11 Å²	11	47.1 Å²	47.1	5%	0.048	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-44.9	178.5	-63.1	-22.8	0	0	0	112.2	L428 K432 I436 E457 A458 Q459 L464 E465 F472	L428-F461 HydrophobicContact CD1-CE2 3.94Å; L428-F461 HydrophobicContact CD1-CZ 4.33Å; L428-F461 HydrophobicContact CD2-CE2 4.08Å; K432-F461 HydrophobicContact CB-CD1 4.11Å; K432-F461 HydrophobicContact CB-CD2 4.38Å; K432-F461 HydrophobicContact CB-CE1 3.87Å; K432-F461 HydrophobicContact CB-CE2 4.14Å; K432-F461 HydrophobicContact CB-CG 4.36Å; K432-F461 HydrophobicContact CB-CZ 3.88Å; K432-F461 HydrophobicContact CD-CB 4.09Å; K432-F461 HydrophobicContact CD-CD1 4.38Å; K432-F461 HydrophobicContact CD-CD2 3.91Å; K432-F461 HydrophobicContact CD-CE2 4.4Å; K432-F461 HydrophobicContact CD-CG 3.88Å; K432-F461 HydrophobicContact CG-CD1 4.22Å; K432-F461 HydrophobicContact CG-CE1 4.48Å; K432-F461 HydrophobicContact CG-CG 4.24Å; K432-F461 WeakPolarHBondContact O-CE1 3.31Å; K432-F461 WeakPolarHBondContact O-CZ 3.38Å; I436-F461 HydrophobicContact CB-CE1 3.95Å; I436-F461 HydrophobicContact CB-CZ 3.9Å; I436-F461 HydrophobicContact CG2-CE1 4.37Å; I436-F461 HydrophobicContact CG2-CZ 3.95Å; E457-F461 HydrophobicContact CG-CD2 4.09Å; E457-F461 HydrophobicContact CG-CE1 4.2Å; E457-F461 HydrophobicContact CG-CE2 3.33Å; E457-F461 HydrophobicContact CG-CZ 3.4Å; E457-F461 WeakPolarHBondContact O-CD2 3.33Å; E457-F461 WeakPolarHBondContact O-CG 3.42Å; E457-F461 PolarHBondContact O-N 3.2Å; E457-F461 VanDerWaalsContact O-N 3.1Å; E457-F461 WeakPolarHBondContact OE1-CE2 3.36Å; A458-F461 PolarHBondContact O-N 2.79Å; Q459-F461 VanDerWaalsContact C-N 3.3Å; Q459-F461 PolarHBondContact O-N 3.33Å; F461-L464 PolarHBondContact O-N 3.45Å; F461-E465 WeakPolarHBondContact O-CB 3.22Å; F461-E465 WeakPolarHBondContact O-CG 3.32Å; F461-E465 PolarHBondContact O-N 2.97Å; F461-F472 HydrophobicContact CD1-CZ 4.49Å
462	E	95	Very high	95	Very high	128 Å²	128	42.9 Å²	42.9	60%	0.598	23%	0.233	S	C	*	.	H	α-helix	trans	-63.5	-42.1	177.5	-176.9	173.2	-171.2	0	0	112	A458 Q459 E465 T466	A458-E462 PolarHBondContact O-N 2.86Å; Q459-E462 PolarHBondContact O-N 2.76Å; E462-E465 PolarHBondContact O-N 3.08Å; E462-T466 WeakPolarHBondContact O-CB 3.41Å; E462-T466 PolarHBondContact O-N 3.06Å; E462-T466 PolarHBondContact O-OG1 2.99Å
463	Y	96.1	Very high	95	Very high	24 Å²	24	44.5 Å²	44.5	9%	0.094	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-48.2	176.9	176.4	-92.1	0	0	0	111.8	Q459 L460 T466 N467 H468 E493 F494 I497	Q459-Y463 VanDerWaalsContact O-CB 3.3Å; Q459-Y463 WeakPolarHBondContact O-CB 3.46Å; Q459-Y463 PolarHBondContact O-N 2.9Å; L460-Y463 PolarHBondContact O-N 3.41Å; Y463-T466 PolarHBondContact O-N 3.48Å; Y463-N467 WeakPolarHBondContact CD2-ND2 3.39Å; Y463-N467 HydrophobicContact CE1-CB 4.48Å; Y463-N467 WeakPolarHBondContact CE2-ND2 3.46Å; Y463-N467 WeakPolarHBondContact O-CB 3.32Å; Y463-N467 PolarHBondContact O-N 2.88Å; Y463-N467 PolarHBondContact O-ND2 2.93Å; Y463-H468 AromaticContact CE1-CD2 3.78Å; Y463-E493 VanDerWaalsContact OH-CG 3.3Å; Y463-E493 WeakPolarHBondContact OH-CG 3.44Å; Y463-E493 PolarHBondContact OH-OE1 2.95Å; Y463-E493 PolarHBondContact OH-OE2 3.02Å; Y463-F494 VanDerWaalsContact CB-CD2 3.49Å; Y463-F494 HydrophobicContact CD1-CB 3.67Å; Y463-F494 AromaticContact CD1-CD2 3.96Å; Y463-F494 HydrophobicContact CD1-CD2 3.96Å; Y463-F494 HydrophobicContact CD1-CG 4.12Å; Y463-F494 AromaticContact CD2-CD2 3.92Å; Y463-F494 HydrophobicContact CD2-CD2 3.92Å; Y463-F494 HydrophobicContact CE1-CB 3.88Å; Y463-F494 HydrophobicContact CG-CB 4.11Å; Y463-F494 AromaticContact CG-CD2 3.51Å; Y463-F494 HydrophobicContact CG-CD2 3.51Å; Y463-F494 HydrophobicContact CG-CE2 4.4Å; Y463-F494 HydrophobicContact CG-CG 4.14Å; Y463-I497 HydrophobicContact CD2-CD1 3.9Å; Y463-I497 HydrophobicContact CE2-CD1 3.77Å
464	L	95.5	Very high	95	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.7	-34.5	179.1	-68.9	176.7	0	0	0	112.3	V435 L460 F461 T466 H468 S469 L471 F472 A490	V435-L464 HydrophobicContact CG1-CD1 3.52Å; L460-L464 HydrophobicContact CD1-CD1 3.83Å; L460-L464 HydrophobicContact CD1-CG 3.99Å; L460-L464 HydrophobicContact CG-CD1 3.97Å; L460-L464 HydrophobicContact CG-CG 4.44Å; L460-L464 WeakPolarHBondContact O-CB 3.19Å; L460-L464 VanDerWaalsContact O-CG 3.31Å; L460-L464 WeakPolarHBondContact O-CG 3.13Å; L460-L464 PolarHBondContact O-N 3.23Å; F461-L464 PolarHBondContact O-N 3.45Å; L464-T466 VanDerWaalsContact C-N 3.26Å; L464-T466 PolarHBondContact O-N 3.13Å; L464-H468 HydrophobicContact CD2-CB 3.88Å; L464-H468 CarbonylContact O-C 3.37Å; L464-H468 WeakPolarHBondContact O-CA 3.31Å; L464-H468 PolarHBondContact O-N 2.78Å; L464-S469 PolarHBondContact O-N 2.88Å; L464-L471 HydrophobicContact CD2-CD1 4.3Å; L464-F472 HydrophobicContact CB-CD2 4.42Å; L464-F472 HydrophobicContact CB-CE2 3.52Å; L464-F472 HydrophobicContact CB-CZ 3.63Å; L464-F472 HydrophobicContact CD1-CE1 4.35Å; L464-F472 HydrophobicContact CD1-CZ 3.91Å; L464-F472 HydrophobicContact CG-CZ 4.46Å; L464-A490 HydrophobicContact CD2-CB 3.81Å
465	E	94.5	Very high	95.1	Very high	101 Å²	101	44 Å²	44	47%	0.472	25%	0.245	S	C	.	.	H	α-helix	trans	-63.1	-35.1	173.1	-79.8	-177.4	153.3	0	0	112	K432 F461 E462 F472	K432-E465 VanDerWaalsContact CE-CD 3.49Å; K432-E465 WeakPolarHBondContact CE-OE1 3.36Å; K432-E465 IonicContact NZ-OE1 3.41Å; K432-E465 PolarHBondContact NZ-OE1 3.17Å; K432-E465 IonicContact NZ-OE2 3.63Å; K432-E465 PolarHBondContact NZ-OE2 2.87Å; K432-E465 VanDerWaalsContact NZ-OE2 3.09Å; F461-E465 WeakPolarHBondContact O-CB 3.22Å; F461-E465 WeakPolarHBondContact O-CG 3.32Å; F461-E465 PolarHBondContact O-N 2.97Å; E462-E465 PolarHBondContact O-N 3.08Å; E465-F472 HydrophobicContact CG-CD2 3.93Å; E465-F472 HydrophobicContact CG-CE2 3.67Å
466	T	95	Very high	95	Very high	103 Å²	103	49.4 Å²	49.4	63%	0.632	26%	0.264	S	S	*	.	H	α-helix	trans	-82.2	-43.7	-177.6	-56.1	0	0	0	0	112.5	E462 Y463 L464	E462-T466 WeakPolarHBondContact O-CB 3.41Å; E462-T466 PolarHBondContact O-N 3.06Å; E462-T466 PolarHBondContact O-OG1 2.99Å; Y463-T466 PolarHBondContact O-N 3.48Å; L464-T466 VanDerWaalsContact C-N 3.26Å; L464-T466 PolarHBondContact O-N 3.13Å
467	N	94.7	Very high	95	Very high	90 Å²	90	55.2 Å²	55.2	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-106.5	-28.5	-168.5	-60	-58.6	0	0	0	114.2	Y463	Y463-N467 WeakPolarHBondContact CD2-ND2 3.39Å; Y463-N467 HydrophobicContact CE1-CB 4.48Å; Y463-N467 WeakPolarHBondContact CE2-ND2 3.46Å; Y463-N467 WeakPolarHBondContact O-CB 3.32Å; Y463-N467 PolarHBondContact O-N 2.88Å; Y463-N467 PolarHBondContact O-ND2 2.93Å
468	H	93.5	Very high	94.9	Very high	42 Å²	42	58.1 Å²	58.1	19%	0.194	31%	0.314	C	S	.	.			trans	-135.3	42	-172.3	-60.9	-82.8	0	0	0	112.6	Y463 L464 D470 L471 A490	Y463-H468 AromaticContact CE1-CD2 3.78Å; L464-H468 HydrophobicContact CD2-CB 3.88Å; L464-H468 CarbonylContact O-C 3.37Å; L464-H468 WeakPolarHBondContact O-CA 3.31Å; L464-H468 PolarHBondContact O-N 2.78Å; H468-D470 WeakPolarHBondContact CA-OD1 3.4Å; H468-D470 PolarHBondContact O-N 2.89Å; H468-D470 VanDerWaalsContact O-N 3.08Å; H468-L471 HydrophobicContact CB-CD1 3.75Å; H468-L471 HydrophobicContact CB-CG 4.06Å; H468-L471 WeakPolarHBondContact O-CB 3.4Å; H468-L471 PolarHBondContact O-N 3.31Å; H468-A490 HydrophobicContact CB-CB 4.45Å
469	S	92.9	Very high	94.9	Very high	75 Å²	75	61.3 Å²	61.3	52%	0.524	32%	0.316	S	S	.	.	H	α-helix	trans	-60.3	-21.3	-177.4	60	0	0	0	0	113.4	L464 L471 F472 A473	L464-S469 PolarHBondContact O-N 2.88Å; S469-L471 VanDerWaalsContact C-N 3.29Å; S469-L471 PolarHBondContact O-N 2.74Å; S469-F472 PolarHBondContact O-N 3.47Å; S469-A473 PolarHBondContact O-N 2.89Å
470	D	94.8	Very high	94.9	Very high	77 Å²	77	61.5 Å²	61.5	41%	0.412	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-31.6	173.5	64	-56.9	0	0	0	112.9	H468 A473 T474	H468-D470 WeakPolarHBondContact CA-OD1 3.4Å; H468-D470 PolarHBondContact O-N 2.89Å; H468-D470 VanDerWaalsContact O-N 3.08Å; D470-A473 PolarHBondContact O-N 3.25Å; D470-T474 WeakPolarHBondContact O-CB 3.42Å; D470-T474 PolarHBondContact O-N 3.49Å; D470-T474 PolarHBondContact O-OG1 3.36Å
471	L	94.8	Very high	94.8	Very high	4 Å²	4	62.9 Å²	62.9	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-43.9	176	-61.8	179	0	0	0	111	L464 H468 S469 T474 I475 P482 K486 L487 A490	L464-L471 HydrophobicContact CD2-CD1 4.3Å; H468-L471 HydrophobicContact CB-CD1 3.75Å; H468-L471 HydrophobicContact CB-CG 4.06Å; H468-L471 WeakPolarHBondContact O-CB 3.4Å; H468-L471 PolarHBondContact O-N 3.31Å; S469-L471 VanDerWaalsContact C-N 3.29Å; S469-L471 PolarHBondContact O-N 2.74Å; L471-T474 PolarHBondContact O-N 3.07Å; L471-I475 WeakPolarHBondContact O-CG1 3.46Å; L471-I475 PolarHBondContact O-N 3.27Å; L471-P482 HydrophobicContact CD2-CB 3.81Å; L471-P482 HydrophobicContact CD2-CG 3.94Å; L471-K486 HydrophobicContact CD2-CB 4.28Å; L471-L487 HydrophobicContact CD1-CD1 3.97Å; L471-A490 HydrophobicContact CD1-CB 3.79Å
472	F	95	Very high	94.6	Very high	8 Å²	8	62.9 Å²	62.9	4%	0.035	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-42.8	175	-71.6	-34.9	0	0	0	112.2	E431 K432 V435 F461 L464 E465 S469 T474 I475 R476	E431-F472 HydrophobicContact CB-CB 4.35Å; E431-F472 HydrophobicContact CB-CD1 3.87Å; E431-F472 HydrophobicContact CB-CG 4.46Å; E431-F472 HydrophobicContact CG-CB 4.01Å; E431-F472 HydrophobicContact CG-CD1 3.87Å; E431-F472 HydrophobicContact CG-CG 4.11Å; K432-F472 HydrophobicContact CG-CE1 4.16Å; K432-F472 HydrophobicContact CG-CZ 4.09Å; V435-F472 HydrophobicContact CB-CE1 4.14Å; V435-F472 HydrophobicContact CG2-CD1 4.16Å; V435-F472 HydrophobicContact CG2-CE1 3.66Å; F461-F472 HydrophobicContact CD1-CZ 4.49Å; L464-F472 HydrophobicContact CB-CD2 4.42Å; L464-F472 HydrophobicContact CB-CE2 3.52Å; L464-F472 HydrophobicContact CB-CZ 3.63Å; L464-F472 HydrophobicContact CD1-CE1 4.35Å; L464-F472 HydrophobicContact CD1-CZ 3.91Å; L464-F472 HydrophobicContact CG-CZ 4.46Å; E465-F472 HydrophobicContact CG-CD2 3.93Å; E465-F472 HydrophobicContact CG-CE2 3.67Å; S469-F472 PolarHBondContact O-N 3.47Å; F472-T474 VanDerWaalsContact C-N 3.32Å; F472-T474 PolarHBondContact O-N 2.85Å; F472-I475 PolarHBondContact O-N 2.82Å; F472-R476 WeakPolarHBondContact O-CB 3.31Å; F472-R476 PolarHBondContact O-N 3.08Å
473	A	94.8	Very high	94.5	Very high	34 Å²	34	60.9 Å²	60.9	28%	0.281	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-42.9	175.5	0	0	0	0	0	111.6	S469 D470 I475 R476 D477	S469-A473 PolarHBondContact O-N 2.89Å; D470-A473 PolarHBondContact O-N 3.25Å; A473-I475 PolarHBondContact O-N 2.89Å; A473-R476 PolarHBondContact O-N 2.91Å; A473-D477 WeakPolarHBondContact O-CB 3.44Å; A473-D477 VanDerWaalsContact O-CG 3.32Å; A473-D477 PolarHBondContact O-N 2.67Å
474	T	95.8	Very high	94.3	Very high	49 Å²	49	62.7 Å²	62.7	30%	0.301	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-46.2	177.8	-59.1	0	0	0	0	111.6	D470 L471 F472 R476 T478 P482	D470-T474 WeakPolarHBondContact O-CB 3.42Å; D470-T474 PolarHBondContact O-N 3.49Å; D470-T474 PolarHBondContact O-OG1 3.36Å; L471-T474 PolarHBondContact O-N 3.07Å; F472-T474 VanDerWaalsContact C-N 3.32Å; F472-T474 PolarHBondContact O-N 2.85Å; T474-R476 PolarHBondContact O-N 2.61Å; T474-T478 HydrophobicContact CG2-CG2 4.2Å; T474-T478 WeakPolarHBondContact O-CB 3.5Å; T474-T478 WeakPolarHBondContact O-CG2 3.38Å; T474-T478 PolarHBondContact O-N 2.96Å; T474-T478 PolarHBondContact O-OG1 2.79Å; T474-P482 HydrophobicContact CG2-CB 3.91Å
475	I	95.4	Very high	94.2	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-63.5	-43	178	-62.9	166.3	0	0	0	110.9	I372 A374 E431 V434 V435 L471 F472 A473 K479 P482	I372-I475 HydrophobicContact CD1-CG2 4.15Å; A374-I475 HydrophobicContact CB-CG2 4.18Å; E431-I475 HydrophobicContact CB-CB 3.94Å; E431-I475 HydrophobicContact CB-CD1 4.35Å; E431-I475 HydrophobicContact CB-CG2 3.92Å; V434-I475 HydrophobicContact CB-CD1 4.38Å; V434-I475 HydrophobicContact CG1-CD1 4.04Å; V434-I475 HydrophobicContact CG2-CG2 4.44Å; V435-I475 HydrophobicContact CG2-CD1 3.86Å; L471-I475 WeakPolarHBondContact O-CG1 3.46Å; L471-I475 PolarHBondContact O-N 3.27Å; F472-I475 PolarHBondContact O-N 2.82Å; A473-I475 PolarHBondContact O-N 2.89Å; I475-K479 WeakPolarHBondContact O-CA 3.43Å; I475-K479 PolarHBondContact O-N 3.01Å; I475-P482 HydrophobicContact CG1-CG 4.46Å
476	R	93.6	Very high	94.1	Very high	146 Å²	146	68.7 Å²	68.7	55%	0.551	36%	0.363	S	S	*	.	H	α-helix	trans	-63.5	-47.4	-178.7	-170.3	-174	-58.8	158.3	5	112.1	E431 F472 A473 T474	E431-R476 IonicContact OE1-CZ 2.8Å; E431-R476 VanDerWaalsContact OE1-CZ 3.23Å; E431-R476 IonicContact OE1-NE 2.72Å; E431-R476 PolarHBondContact OE1-NE 3.28Å; E431-R476 IonicContact OE1-NH2 2.63Å; E431-R476 PolarHBondContact OE1-NH2 3.26Å; F472-R476 WeakPolarHBondContact O-CB 3.31Å; F472-R476 PolarHBondContact O-N 3.08Å; A473-R476 PolarHBondContact O-N 2.91Å; T474-R476 PolarHBondContact O-N 2.61Å
477	D	94.6	Very high	94.1	Very high	123 Å²	123	63.8 Å²	63.8	66%	0.658	33%	0.332	S	S	*	.	H	α-helix	trans	-83.9	-42.8	-170.2	-64	-16	0	0	0	111.9	A473	A473-D477 WeakPolarHBondContact O-CB 3.44Å; A473-D477 VanDerWaalsContact O-CG 3.32Å; A473-D477 PolarHBondContact O-N 2.67Å
478	T	95.2	Very high	94.1	Very high	74 Å²	74	62.5 Å²	62.5	45%	0.454	33%	0.326	S	S	.	.	H	α-helix	trans	-88	-21.2	-177.6	73.1	0	0	0	0	113.1	T474 E480	T474-T478 HydrophobicContact CG2-CG2 4.2Å; T474-T478 WeakPolarHBondContact O-CB 3.5Å; T474-T478 WeakPolarHBondContact O-CG2 3.38Å; T474-T478 PolarHBondContact O-N 2.96Å; T474-T478 PolarHBondContact O-OG1 2.79Å; T478-E480 PolarHBondContact O-N 2.89Å; T478-E480 PolarHBondContact OG1-N 3.48Å; T478-E480 VanDerWaalsContact OG1-N 3.15Å
479	K	94.8	Very high	94.1	Very high	126 Å²	126	66.8 Å²	66.8	55%	0.548	35%	0.346	S	S	.	.	S	Bend	trans	62.9	11.7	-171.4	-53.1	176.2	-175.5	176.3	0	113.6	I372 K373 A374 I475	I372-K479 HydrophobicContact CB-CB 4.1Å; I372-K479 HydrophobicContact CG2-CB 4.19Å; I372-K479 HydrophobicContact CG2-CD 4.42Å; I372-K479 HydrophobicContact CG2-CG 4.33Å; K373-K479 PolarHBondContact N-O 2.86Å; A374-K479 PolarHBondContact N-O 3.23Å; I475-K479 WeakPolarHBondContact O-CA 3.43Å; I475-K479 PolarHBondContact O-N 3.01Å
480	E	95	Very high	94.2	Very high	76 Å²	76	63.2 Å²	63.2	36%	0.355	32%	0.321	S	S	.	.	S	Bend	trans	-113.4	165.9	179.3	-61.1	-167	177.3	0	0	110.7	K373 T478	K373-E480 HydrophobicContact CB-CG 4.19Å; K373-E480 HydrophobicContact CD-CG 3.81Å; K373-E480 VanDerWaalsContact CD-OE1 3.22Å; K373-E480 WeakPolarHBondContact CD-OE1 3.31Å; K373-E480 IonicContact NZ-OE1 3.09Å; K373-E480 PolarHBondContact NZ-OE1 3.08Å; T478-E480 PolarHBondContact O-N 2.89Å; T478-E480 PolarHBondContact OG1-N 3.48Å; T478-E480 VanDerWaalsContact OG1-N 3.15Å
481	L	93.6	Very high	94.2	Very high	29 Å²	29	59.6 Å²	59.6	15%	0.152	30%	0.302	C	S	.	.			trans	-69.9	142.9	172.1	-75.2	171.2	0	0	0	109	A374 K377 V378 V434 Y438	A374-L481 HydrophobicContact CB-CD2 4.18Å; A374-L481 HydrophobicContact CB-CG 4.15Å; K377-L481 HydrophobicContact CB-CD1 3.88Å; K377-L481 HydrophobicContact CD-CD1 3.83Å; K377-L481 HydrophobicContact CD-CG 4.44Å; V378-L481 HydrophobicContact CG1-CD1 4.09Å; V378-L481 HydrophobicContact CG1-CD2 4.04Å; V434-L481 HydrophobicContact CG1-CD2 3.49Å; V434-L481 VanDerWaalsContact CG1-CD2 3.49Å; Y438-L481 HydrophobicContact CD2-CD1 4.29Å; Y438-L481 HydrophobicContact CD2-CD2 4.27Å; Y438-L481 HydrophobicContact CE2-CD1 4.44Å
482	P	92.3	Very high	94.2	Very high	11 Å²	11	63.1 Å²	63.1	7%	0.071	32%	0.318	C	S	.	.			trans	-64.6	179	169.3	31.6	-35.1	0	0	0	110.3	L471 T474 I475 T484 L487	L471-P482 HydrophobicContact CD2-CB 3.81Å; L471-P482 HydrophobicContact CD2-CG 3.94Å; T474-P482 HydrophobicContact CG2-CB 3.91Å; I475-P482 HydrophobicContact CG1-CG 4.46Å; P482-T484 PolarHBondContact O-N 3.32Å; P482-T484 VanDerWaalsContact O-N 3.14Å; P482-L487 HydrophobicContact CG-CB 4.3Å; P482-L487 HydrophobicContact CG-CD2 4.15Å
483	D	92.5	Very high	94.1	Very high	85 Å²	85	67.4 Å²	67.4	46%	0.455	34%	0.338	S	S	.	.			trans	-51	120.4	169.4	-170.4	-12.4	0	0	0	110.1	D485 K486 L487	D483-D485 VanDerWaalsContact C-N 3.27Å; D483-D485 PolarHBondContact O-N 3.42Å; D483-D485 PolarHBondContact OD1-N 2.83Å; D483-K486 HydrophobicContact CB-CB 4.35Å; D483-K486 HydrophobicContact CB-CD 4.11Å; D483-K486 HydrophobicContact CB-CG 4.1Å; D483-K486 PolarHBondContact O-N 3.45Å; D483-L487 PolarHBondContact O-N 2.72Å; D483-L487 VanDerWaalsContact O-N 3.11Å
484	T	92.8	Very high	94.1	Very high	63 Å²	63	66.1 Å²	66.1	39%	0.387	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-34.7	-173.1	46.5	0	0	0	0	111.5	Y438 P482 K486 L487 D488	Y438-T484 HydrophobicContact CE2-CG2 4.44Å; P482-T484 PolarHBondContact O-N 3.32Å; P482-T484 VanDerWaalsContact O-N 3.14Å; T484-K486 VanDerWaalsContact C-N 3.32Å; T484-K486 PolarHBondContact O-N 2.94Å; T484-L487 PolarHBondContact O-N 2.91Å; T484-D488 WeakPolarHBondContact O-CB 3.15Å; T484-D488 VanDerWaalsContact O-CG 3.25Å; T484-D488 PolarHBondContact O-N 3.09Å
485	D	93	Very high	94	Very high	115 Å²	115	65.9 Å²	65.9	62%	0.615	32%	0.321	S	S	*	.	H	α-helix	trans	-64.7	-40.8	-179.1	-65.7	-12.5	0	0	0	110.6	D483 E489	D483-D485 VanDerWaalsContact C-N 3.27Å; D483-D485 PolarHBondContact O-N 3.42Å; D483-D485 PolarHBondContact OD1-N 2.83Å; D485-E489 WeakPolarHBondContact O-CB 3.32Å; D485-E489 PolarHBondContact O-N 3Å
486	K	93.2	Very high	93.8	Very high	111 Å²	111	71.5 Å²	71.5	48%	0.483	35%	0.351	S	S	.	.	H	α-helix	trans	-68.8	-38.6	176	-64.2	-173.9	-178.1	-178	0	112.5	L471 D483 T484 A490	L471-K486 HydrophobicContact CD2-CB 4.28Å; D483-K486 HydrophobicContact CB-CB 4.35Å; D483-K486 HydrophobicContact CB-CD 4.11Å; D483-K486 HydrophobicContact CB-CG 4.1Å; D483-K486 PolarHBondContact O-N 3.45Å; T484-K486 VanDerWaalsContact C-N 3.32Å; T484-K486 PolarHBondContact O-N 2.94Å; K486-A490 WeakPolarHBondContact O-CB 3.39Å; K486-A490 PolarHBondContact O-N 3.34Å
487	L	93.5	Very high	93.7	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-67.8	-42.6	178.8	-176	59.3	0	0	0	110.8	V435 Y438 L471 P482 D483 T484 I491	V435-L487 HydrophobicContact CG2-CD1 4.17Å; Y438-L487 HydrophobicContact CD1-CD2 3.6Å; Y438-L487 HydrophobicContact CD1-CG 3.95Å; Y438-L487 HydrophobicContact CD2-CD2 3.8Å; Y438-L487 HydrophobicContact CE1-CB 4.5Å; Y438-L487 HydrophobicContact CE1-CD2 3.7Å; Y438-L487 HydrophobicContact CE1-CG 3.83Å; Y438-L487 HydrophobicContact CE2-CD2 3.87Å; Y438-L487 HydrophobicContact CG-CD2 3.67Å; Y438-L487 HydrophobicContact CG-CG 4.49Å; L471-L487 HydrophobicContact CD1-CD1 3.97Å; P482-L487 HydrophobicContact CG-CB 4.3Å; P482-L487 HydrophobicContact CG-CD2 4.15Å; D483-L487 PolarHBondContact O-N 2.72Å; D483-L487 VanDerWaalsContact O-N 3.11Å; T484-L487 PolarHBondContact O-N 2.91Å; L487-I491 HydrophobicContact CD1-CD1 3.8Å; L487-I491 HydrophobicContact CD1-CG1 4.25Å; L487-I491 HydrophobicContact CG-CD1 3.84Å; L487-I491 WeakPolarHBondContact O-CB 3.26Å; L487-I491 WeakPolarHBondContact O-CD1 3.2Å; L487-I491 WeakPolarHBondContact O-CG1 3.45Å; L487-I491 PolarHBondContact O-N 3.05Å
488	D	94.8	Very high	93.6	Very high	63 Å²	63	64.8 Å²	64.8	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-46.4	174.7	-72.8	-15.6	0	0	0	111.1	Y438 T484 I491 Q492	Y438-D488 WeakPolarHBondContact CE1-OD1 3.42Å; Y438-D488 VanDerWaalsContact CZ-OD1 3.26Å; Y438-D488 PolarHBondContact OH-OD1 3.27Å; T484-D488 WeakPolarHBondContact O-CB 3.15Å; T484-D488 VanDerWaalsContact O-CG 3.25Å; T484-D488 PolarHBondContact O-N 3.09Å; D488-I491 PolarHBondContact O-N 2.76Å; D488-Q492 WeakPolarHBondContact O-CB 3.43Å; D488-Q492 PolarHBondContact O-N 2.78Å
489	E	94.4	Very high	93.1	Very high	133 Å²	133	65.3 Å²	65.3	62%	0.621	32%	0.324	S	S	*	.	H	α-helix	trans	-59	-50.4	177.1	-174.8	175.8	-163.7	0	0	111.6	D485 I491 Q492 E493	D485-E489 WeakPolarHBondContact O-CB 3.32Å; D485-E489 PolarHBondContact O-N 3Å; E489-I491 PolarHBondContact O-N 3.42Å; E489-Q492 PolarHBondContact O-N 3.11Å; E489-E493 WeakPolarHBondContact O-CB 3.26Å; E489-E493 PolarHBondContact O-N 3.27Å
490	A	94.7	Very high	92.2	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-40.3	-178.5	0	0	0	0	0	112.9	L464 H468 L471 K486 F494	L464-A490 HydrophobicContact CD2-CB 3.81Å; H468-A490 HydrophobicContact CB-CB 4.45Å; L471-A490 HydrophobicContact CD1-CB 3.79Å; K486-A490 WeakPolarHBondContact O-CB 3.39Å; K486-A490 PolarHBondContact O-N 3.34Å; A490-F494 PolarHBondContact O-N 2.88Å
491	I	94.5	Very high	90.7	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-69.4	-38.2	177	-67.3	168.2	0	0	0	110.5	V435 Y438 A439 V444 L460 L487 D488 E489 K495	V435-I491 HydrophobicContact CG1-CD1 4.24Å; Y438-I491 HydrophobicContact CD1-CD1 3.71Å; Y438-I491 HydrophobicContact CE1-CD1 4.14Å; A439-I491 HydrophobicContact CB-CD1 4.31Å; A439-I491 HydrophobicContact CB-CG2 4.24Å; V444-I491 HydrophobicContact CB-CG2 4.19Å; V444-I491 HydrophobicContact CG1-CG2 3.46Å; V444-I491 VanDerWaalsContact CG1-CG2 3.46Å; V444-I491 HydrophobicContact CG2-CG2 3.94Å; L460-I491 HydrophobicContact CD1-CG1 4.4Å; L487-I491 HydrophobicContact CD1-CD1 3.8Å; L487-I491 HydrophobicContact CD1-CG1 4.25Å; L487-I491 HydrophobicContact CG-CD1 3.84Å; L487-I491 WeakPolarHBondContact O-CB 3.26Å; L487-I491 WeakPolarHBondContact O-CD1 3.2Å; L487-I491 WeakPolarHBondContact O-CG1 3.45Å; L487-I491 PolarHBondContact O-N 3.05Å; D488-I491 PolarHBondContact O-N 2.76Å; E489-I491 PolarHBondContact O-N 3.42Å; I491-K495 WeakPolarHBondContact O-CB 3.36Å; I491-K495 PolarHBondContact O-N 3.37Å
492	Q	93.9	Very high	89.1	Confident	77 Å²	77	61.2 Å²	61.2	36%	0.36	32%	0.323	S	S	.	.	H	α-helix	trans	-70.6	-39.7	179	-174.1	56.9	40.7	0	0	111.9	D488 E489 F494 K495 D496	D488-Q492 WeakPolarHBondContact O-CB 3.43Å; D488-Q492 PolarHBondContact O-N 2.78Å; E489-Q492 PolarHBondContact O-N 3.11Å; Q492-F494 VanDerWaalsContact C-N 3.32Å; Q492-F494 PolarHBondContact O-N 2.79Å; Q492-K495 WeakPolarHBondContact O-CB 3.29Å; Q492-K495 PolarHBondContact O-N 3.39Å; Q492-K495 VanDerWaalsContact O-N 3.13Å; Q492-D496 PolarHBondContact NE2-OD1 3.32Å; Q492-D496 PolarHBondContact O-N 3.11Å
493	E	93.7	Very high	87.2	Confident	98 Å²	98	61 Å²	61	46%	0.458	32%	0.323	S	S	.	.	H	α-helix	trans	-57.8	-46.6	173.6	-171	-177.2	153.1	0	0	110.8	Y463 E489 K495 D496 I497	Y463-E493 VanDerWaalsContact OH-CG 3.3Å; Y463-E493 WeakPolarHBondContact OH-CG 3.44Å; Y463-E493 PolarHBondContact OH-OE1 2.95Å; Y463-E493 PolarHBondContact OH-OE2 3.02Å; E489-E493 WeakPolarHBondContact O-CB 3.26Å; E489-E493 PolarHBondContact O-N 3.27Å; E493-K495 PolarHBondContact O-N 2.69Å; E493-D496 PolarHBondContact O-N 2.92Å; E493-I497 PolarHBondContact O-N 2.93Å
494	F	94.7	Very high	85.3	Confident	7 Å²	7	60.1 Å²	60.1	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-62.1	-42.6	174.3	177.8	-105	0	0	0	112.4	F456 Q459 L460 Y463 A490 Q492 D496 I497 F498	F456-F494 HydrophobicContact CD2-CD1 4.33Å; F456-F494 AromaticContact CD2-CE1 3.68Å; F456-F494 HydrophobicContact CD2-CE1 3.68Å; F456-F494 HydrophobicContact CE1-CD1 4.5Å; F456-F494 HydrophobicContact CE1-CE1 4.39Å; F456-F494 AromaticContact CE2-CD1 3.71Å; F456-F494 HydrophobicContact CE2-CD1 3.71Å; F456-F494 AromaticContact CE2-CE1 3.54Å; F456-F494 HydrophobicContact CE2-CE1 3.54Å; F456-F494 HydrophobicContact CG-CE1 4.18Å; F456-F494 AromaticContact CZ-CD1 3.8Å; F456-F494 HydrophobicContact CZ-CD1 3.8Å; F456-F494 AromaticContact CZ-CE1 3.92Å; F456-F494 HydrophobicContact CZ-CE1 3.92Å; Q459-F494 VanDerWaalsContact C-CZ 3.49Å; Q459-F494 HydrophobicContact CB-CE1 4.44Å; Q459-F494 HydrophobicContact CB-CE2 3.87Å; Q459-F494 HydrophobicContact CB-CZ 3.39Å; L460-F494 HydrophobicContact CB-CD1 3.76Å; L460-F494 HydrophobicContact CB-CE1 3.64Å; L460-F494 HydrophobicContact CB-CG 4.49Å; L460-F494 HydrophobicContact CB-CZ 4.33Å; L460-F494 HydrophobicContact CD1-CB 3.93Å; L460-F494 HydrophobicContact CD1-CD1 3.5Å; L460-F494 VanDerWaalsContact CD1-CD1 3.5Å; L460-F494 HydrophobicContact CD1-CE1 4.3Å; L460-F494 HydrophobicContact CD1-CG 3.81Å; L460-F494 HydrophobicContact CG-CD1 4.21Å; Y463-F494 VanDerWaalsContact CB-CD2 3.49Å; Y463-F494 HydrophobicContact CD1-CB 3.67Å; Y463-F494 AromaticContact CD1-CD2 3.96Å; Y463-F494 HydrophobicContact CD1-CD2 3.96Å; Y463-F494 HydrophobicContact CD1-CG 4.12Å; Y463-F494 AromaticContact CD2-CD2 3.92Å; Y463-F494 HydrophobicContact CD2-CD2 3.92Å; Y463-F494 HydrophobicContact CE1-CB 3.88Å; Y463-F494 HydrophobicContact CG-CB 4.11Å; Y463-F494 AromaticContact CG-CD2 3.51Å; Y463-F494 HydrophobicContact CG-CD2 3.51Å; Y463-F494 HydrophobicContact CG-CE2 4.4Å; Y463-F494 HydrophobicContact CG-CG 4.14Å; A490-F494 PolarHBondContact O-N 2.88Å; Q492-F494 VanDerWaalsContact C-N 3.32Å; Q492-F494 PolarHBondContact O-N 2.79Å; F494-D496 VanDerWaalsContact C-N 3.27Å; F494-D496 PolarHBondContact O-N 3.48Å; F494-I497 HydrophobicContact CD2-CD1 4.13Å; F494-I497 HydrophobicContact CD2-CG1 4.19Å; F494-I497 WeakPolarHBondContact O-CG1 3.38Å; F494-I497 PolarHBondContact O-N 2.97Å; F494-F498 HydrophobicContact CE1-CB 4.23Å; F494-F498 HydrophobicContact CE1-CD2 4.13Å; F494-F498 HydrophobicContact CE1-CG 4.42Å; F494-F498 HydrophobicContact CZ-CB 4.25Å; F494-F498 AromaticContact CZ-CD2 3.79Å; F494-F498 HydrophobicContact CZ-CD2 3.79Å; F494-F498 HydrophobicContact CZ-CG 4.4Å; F494-F498 PolarHBondContact O-N 3.33Å
495	K	93	Very high	82.8	Confident	44 Å²	44	64.5 Å²	64.5	19%	0.191	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-37.7	179.6	-177	-174.9	175.1	171.5	0	112.2	V444 S447 I448 F456 I491 Q492 E493 I497 F498	V444-K495 HydrophobicContact CG1-CD 3.84Å; V444-K495 WeakPolarHBondContact O-CE 3.38Å; V444-K495 PolarHBondContact O-NZ 3.46Å; S447-K495 WeakPolarHBondContact OG-CE 3.42Å; S447-K495 PolarHBondContact OG-NZ 3.24Å; I448-K495 HydrophobicContact CD1-CG 4.45Å; F456-K495 HydrophobicContact CE2-CB 4.38Å; F456-K495 HydrophobicContact CE2-CG 4.49Å; I491-K495 WeakPolarHBondContact O-CB 3.36Å; I491-K495 PolarHBondContact O-N 3.37Å; Q492-K495 WeakPolarHBondContact O-CB 3.29Å; Q492-K495 PolarHBondContact O-N 3.39Å; Q492-K495 VanDerWaalsContact O-N 3.13Å; E493-K495 PolarHBondContact O-N 2.69Å; K495-I497 VanDerWaalsContact C-N 3.3Å; K495-I497 PolarHBondContact O-N 3Å; K495-F498 PolarHBondContact O-N 3.37Å
496	D	91.7	Very high	80.5	Confident	119 Å²	119	67.7 Å²	67.7	64%	0.636	35%	0.345	S	S	*	.	H	α-helix	trans	-70.5	-26	-179	-69.8	-21.6	0	0	0	112.8	Q492 E493 F494	Q492-D496 PolarHBondContact NE2-OD1 3.32Å; Q492-D496 PolarHBondContact O-N 3.11Å; E493-D496 PolarHBondContact O-N 2.92Å; F494-D496 VanDerWaalsContact C-N 3.27Å; F494-D496 PolarHBondContact O-N 3.48Å
497	I	92.3	Very high	78.4	Confident	109 Å²	109	68.9 Å²	68.9	56%	0.559	35%	0.35	S	S	*	.	H	α-helix	trans	-93	-11.8	175	64.7	172.2	0	0	0	113.6	Y463 E493 F494 K495 D499	Y463-I497 HydrophobicContact CD2-CD1 3.9Å; Y463-I497 HydrophobicContact CE2-CD1 3.77Å; E493-I497 PolarHBondContact O-N 2.93Å; F494-I497 HydrophobicContact CD2-CD1 4.13Å; F494-I497 HydrophobicContact CD2-CG1 4.19Å; F494-I497 WeakPolarHBondContact O-CG1 3.38Å; F494-I497 PolarHBondContact O-N 2.97Å; K495-I497 VanDerWaalsContact C-N 3.3Å; K495-I497 PolarHBondContact O-N 3Å; I497-D499 PolarHBondContact O-N 2.97Å
498	F	92.5	Very high	75.7	Confident	20 Å²	20	75.7 Å²	75.7	9%	0.088	41%	0.407	C	S	.	.			trans	-74.7	112.2	-178	179.8	-100.9	0	0	0	111.9	I448 F456 F494 K495 A500	I448-F498 HydrophobicContact CD1-CD1 4.02Å; I448-F498 HydrophobicContact CD1-CE1 4.34Å; I448-F498 HydrophobicContact CG2-CE1 4.18Å; F456-F498 HydrophobicContact CB-CD2 4.49Å; F456-F498 HydrophobicContact CB-CE1 4.08Å; F456-F498 HydrophobicContact CB-CE2 3.94Å; F456-F498 HydrophobicContact CB-CZ 3.69Å; F456-F498 HydrophobicContact CD2-CB 4.21Å; F456-F498 AromaticContact CD2-CD1 3.65Å; F456-F498 HydrophobicContact CD2-CD1 3.65Å; F456-F498 AromaticContact CD2-CD2 3.96Å; F456-F498 HydrophobicContact CD2-CD2 3.96Å; F456-F498 AromaticContact CD2-CE1 3.9Å; F456-F498 HydrophobicContact CD2-CE1 3.9Å; F456-F498 HydrophobicContact CD2-CE2 4.21Å; F456-F498 AromaticContact CD2-CG 3.65Å; F456-F498 HydrophobicContact CD2-CG 3.65Å; F456-F498 HydrophobicContact CD2-CZ 4.18Å; F456-F498 HydrophobicContact CE2-CB 4.32Å; F456-F498 HydrophobicContact CE2-CD1 4.38Å; F456-F498 HydrophobicContact CE2-CG 4.25Å; F456-F498 HydrophobicContact CG-CZ 4.47Å; F494-F498 HydrophobicContact CE1-CB 4.23Å; F494-F498 HydrophobicContact CE1-CD2 4.13Å; F494-F498 HydrophobicContact CE1-CG 4.42Å; F494-F498 HydrophobicContact CZ-CB 4.25Å; F494-F498 AromaticContact CZ-CD2 3.79Å; F494-F498 HydrophobicContact CZ-CD2 3.79Å; F494-F498 HydrophobicContact CZ-CG 4.4Å; F494-F498 PolarHBondContact O-N 3.33Å; K495-F498 PolarHBondContact O-N 3.37Å; F498-A500 HydrophobicContact CD1-CB 4.49Å; F498-A500 HydrophobicContact CE1-CB 3.91Å
499	D	85	Confident	74.8	Confident	84 Å²	84	76.4 Å²	76.4	45%	0.449	41%	0.41	S	S	.	.			trans	-95.4	103.4	173.4	-176.7	4	0	0	0	111.6	I497 S501 S502	I497-D499 PolarHBondContact O-N 2.97Å; D499-S501 PolarHBondContact O-N 2.87Å; D499-S501 VanDerWaalsContact O-N 3.14Å; D499-S501 VanDerWaalsContact OD1-CB 3.25Å; D499-S501 WeakPolarHBondContact OD1-CB 3.21Å; D499-S501 PolarHBondContact OD1-N 2.97Å; D499-S501 PolarHBondContact OD1-OG 3.05Å; D499-S501 PolarHBondContact OD2-OG 2.87Å; D499-S502 PolarHBondContact O-N 2.92Å; D499-S502 PolarHBondContact O-OG 2.88Å
500	A	74.2	Confident	73.7	Confident	22 Å²	22	73.4 Å²	73.4	18%	0.182	40%	0.399	C	S	.	.	H	α-helix	trans	-63.1	-18.1	177.6	0	0	0	0	0	113.8	P449 F498 N504	P449-A500 HydrophobicContact CG-CB 4.18Å; F498-A500 HydrophobicContact CD1-CB 4.49Å; F498-A500 HydrophobicContact CE1-CB 3.91Å; A500-N504 PolarHBondContact O-ND2 3.4Å
501	S	64.9	Low	72.6	Confident	66 Å²	66	77.4 Å²	77.4	46%	0.462	42%	0.421	S	S	.	.	H	α-helix	trans	-75.5	-33.4	-179.8	77.4	0	0	0	0	112.6	D499 A503	D499-S501 PolarHBondContact O-N 2.87Å; D499-S501 VanDerWaalsContact O-N 3.14Å; D499-S501 VanDerWaalsContact OD1-CB 3.25Å; D499-S501 WeakPolarHBondContact OD1-CB 3.21Å; D499-S501 PolarHBondContact OD1-N 2.97Å; D499-S501 PolarHBondContact OD1-OG 3.05Å; D499-S501 PolarHBondContact OD2-OG 2.87Å; S501-A503 VanDerWaalsContact C-N 3.35Å; S501-A503 PolarHBondContact O-N 3.09Å
502	S	58.5	Low	71.3	Confident	57 Å²	57	81.9 Å²	81.9	40%	0.399	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-39.2	176.4	68.8	0	0	0	0	112.2	D499 N504 Q505	D499-S502 PolarHBondContact O-N 2.92Å; D499-S502 PolarHBondContact O-OG 2.88Å; S502-N504 VanDerWaalsContact C-N 3.3Å; S502-N504 PolarHBondContact O-N 3.3Å; S502-Q505 PolarHBondContact O-N 3.41Å
503	A	54.1	Low	69.9	Low	7 Å²	7	82.3 Å²	82.3	6%	0.058	45%	0.451	C	S	.	.	H	α-helix	trans	-66.1	-26.5	-176.7	0	0	0	0	0	114.3	D455 S501	D455-A503 HydrophobicContact CB-CB 3.91Å; S501-A503 VanDerWaalsContact C-N 3.35Å; S501-A503 PolarHBondContact O-N 3.09Å
504	N	51.4	Low	68.3	Low	66 Å²	66	81.2 Å²	81.2	35%	0.353	45%	0.451	S	S	.	.	H	α-helix	trans	-84.7	-16.8	180	-73	-55.1	0	0	0	113.3	N451 A500 S502	N451-N504 PolarHBondContact ND2-ND2 2.87Å; N451-N504 PolarHBondContact ND2-OD1 3.21Å; A500-N504 PolarHBondContact O-ND2 3.4Å; S502-N504 VanDerWaalsContact C-N 3.3Å; S502-N504 PolarHBondContact O-N 3.3Å
505	Q	41.7	Very low	66.4	Low	155 Å²	155	86.5 Å²	86.5	72%	0.724	48%	0.481	S	S	*	.	H	α-helix	trans	-82.6	-24	-177.4	-69.6	-174.6	2.1	0	0	113.7	S502 K507	S502-Q505 PolarHBondContact O-N 3.41Å; Q505-K507 VanDerWaalsContact C-N 3.31Å; Q505-K507 PolarHBondContact O-N 2.89Å
506	E	44.6	Very low	64.4	Low	183 Å²	183	89.8 Å²	89.8	86%	0.855	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.9	176.3	-75.7	-171.5	154.1	0	0	113.9
507	K	47.6	Very low	62.1	Low	135 Å²	135	87.3 Å²	87.3	59%	0.587	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-1	-176.3	-70.1	177.2	-176	158.6	0	114.6	D455 Q505	D455-K507 IonicContact OD1-NZ 3.29Å; D455-K507 PolarHBondContact OD1-NZ 3.38Å; D455-K507 IonicContact OD2-NZ 2.7Å; D455-K507 PolarHBondContact OD2-NZ 3.01Å; Q505-K507 VanDerWaalsContact C-N 3.31Å; Q505-K507 PolarHBondContact O-N 2.89Å
508	A	38.1	Very low	59.3	Low	144 Å²	144	85.4 Å²	85.4	100%	1.19	49%	0.486	S	S	*	.			trans	-101.4	0	169.8	0	0	0	0	0	109.6

Retrieved 508 of 508 residues in 97.8 ms (Link to these results)

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