A0A3Q0KGB2_SCHMA Loading...

Putative radial spokehead-l

AlphaFold DB , UniProt , Accession A0A3Q0KGB2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 526 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	47.3	Very low	63.2	Low	213 Å²	213	109.6 Å²	109.6	100%	1.049	61%	0.608	S	S	*	*				0	-35.6	0	-73.6	-163.9	-150.7	0	0	113.5	E3 T5	M1-E3 PolarHBondContact O-N 3.5Å; M1-T5 PolarHBondContact O-N 2.8Å; M1-T5 PolarHBondContact O-OG1 3.35Å
2	S	54.5	Low	64.9	Low	84 Å²	84	109.1 Å²	109.1	59%	0.587	60%	0.602	S	S	*	*	H	α-helix	trans	-70.4	-27.3	-177.8	60.7	0	0	0	0	115	T5 K6	S2-T5 PolarHBondContact O-OG1 2.83Å; S2-K6 WeakPolarHBondContact O-CB 3.28Å; S2-K6 VanDerWaalsContact O-CG 3.28Å; S2-K6 WeakPolarHBondContact O-CG 3.26Å; S2-K6 PolarHBondContact O-N 3.16Å
3	E	55.4	Low	66.4	Low	165 Å²	165	112.4 Å²	112.4	77%	0.771	61%	0.607	S	S	*	*	H	α-helix	trans	-74.4	-39.3	175	-86	177.5	156.3	0	0	112.6	M1 K6 S7	M1-E3 PolarHBondContact O-N 3.5Å; E3-K6 PolarHBondContact O-N 3.26Å; E3-S7 PolarHBondContact O-N 3.33Å
4	A	56.3	Low	67.7	Low	57 Å²	57	112.2 Å²	112.2	47%	0.471	60%	0.6	S	S	.	*	H	α-helix	trans	-66	-41	178	0	0	0	0	0	112.1	K6 S7 D8	A4-K6 PolarHBondContact O-N 3.25Å; A4-S7 PolarHBondContact O-N 3.34Å; A4-S7 PolarHBondContact O-OG 3.1Å; A4-D8 PolarHBondContact O-N 3.02Å; A4-D8 VanDerWaalsContact O-N 3.08Å
5	T	57.3	Low	68.9	Low	97 Å²	97	109.5 Å²	109.5	60%	0.595	58%	0.581	S	S	*	*	H	α-helix	trans	-70	-32.7	176.1	52.7	0	0	0	0	112.6	M1 S2 G9	M1-T5 PolarHBondContact O-N 2.8Å; M1-T5 PolarHBondContact O-OG1 3.35Å; S2-T5 PolarHBondContact O-OG1 2.83Å; T5-G9 PolarHBondContact O-N 2.67Å
6	K	59.2	Low	69.9	Low	152 Å²	152	109.5 Å²	109.5	66%	0.661	58%	0.578	S	S	*	*	H	α-helix	trans	-68.4	-36.8	171.4	-78.1	-179.8	-179.9	-177	0	112.2	S2 E3 A4 N10	S2-K6 WeakPolarHBondContact O-CB 3.28Å; S2-K6 VanDerWaalsContact O-CG 3.28Å; S2-K6 WeakPolarHBondContact O-CG 3.26Å; S2-K6 PolarHBondContact O-N 3.16Å; E3-K6 PolarHBondContact O-N 3.26Å; A4-K6 PolarHBondContact O-N 3.25Å; K6-N10 PolarHBondContact O-N 3.04Å
7	S	62.8	Low	71	Confident	63 Å²	63	111 Å²	111	44%	0.441	58%	0.578	S	S	.	*	H	α-helix	trans	-67	-41.2	177.8	71.2	0	0	0	0	111.9	E3 A4 N10 F11	E3-S7 PolarHBondContact O-N 3.33Å; A4-S7 PolarHBondContact O-N 3.34Å; A4-S7 PolarHBondContact O-OG 3.1Å; S7-N10 PolarHBondContact O-N 3.02Å; S7-F11 PolarHBondContact O-N 3.48Å
8	D	66.6	Low	71.8	Confident	114 Å²	114	107.7 Å²	107.7	61%	0.61	56%	0.561	S	S	*	*	H	α-helix	trans	-65.9	-42.1	179.7	-78.7	-10	0	0	0	112.1	A4 N10 F11 L12	A4-D8 PolarHBondContact O-N 3.02Å; A4-D8 VanDerWaalsContact O-N 3.08Å; D8-N10 VanDerWaalsContact C-N 3.3Å; D8-N10 PolarHBondContact O-N 2.96Å; D8-F11 PolarHBondContact O-N 3.34Å; D8-L12 PolarHBondContact O-N 3.24Å; D8-L12 VanDerWaalsContact O-N 3.14Å
9	G	72.7	Confident	72.6	Confident	46 Å²	46	105.3 Å²	105.3	47%	0.474	55%	0.549	S	S	.	.	H	α-helix	trans	-60.6	-39.3	174.6	0	0	0	0	0	112.6	T5 K13	T5-G9 PolarHBondContact O-N 2.67Å; G9-K13 PolarHBondContact O-N 2.64Å
10	N	81.5	Confident	73.2	Confident	88 Å²	88	107.5 Å²	107.5	47%	0.471	56%	0.556	S	S	.	*	H	α-helix	trans	-68.9	-43	175.1	-80.7	-18.8	0	0	0	112	K6 S7 D8 L12 K13 H14	K6-N10 PolarHBondContact O-N 3.04Å; S7-N10 PolarHBondContact O-N 3.02Å; D8-N10 VanDerWaalsContact C-N 3.3Å; D8-N10 PolarHBondContact O-N 2.96Å; N10-L12 VanDerWaalsContact C-N 3.33Å; N10-L12 PolarHBondContact O-N 3.17Å; N10-K13 WeakPolarHBondContact O-CB 3.33Å; N10-K13 PolarHBondContact O-N 3.18Å; N10-K13 VanDerWaalsContact O-N 3.15Å; N10-H14 PolarHBondContact O-CD2 3.32Å; N10-H14 PolarHBondContact O-N 3.25Å
11	F	81.5	Confident	73.8	Confident	127 Å²	127	107 Å²	107	56%	0.557	55%	0.553	S	S	*	*	H	α-helix	trans	-57.7	-45.5	179.7	179	-98.9	0	0	0	112	S7 D8 K13 H14 K15	S7-F11 PolarHBondContact O-N 3.48Å; D8-F11 PolarHBondContact O-N 3.34Å; F11-K13 VanDerWaalsContact C-N 3.32Å; F11-K13 PolarHBondContact O-N 3.29Å; F11-H14 PolarHBondContact O-N 3.5Å; F11-K15 WeakPolarHBondContact O-CB 2.91Å; F11-K15 PolarHBondContact O-N 3.27Å
12	L	83.2	Confident	75.5	Confident	103 Å²	103	100.7 Å²	100.7	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-63.2	-40.1	178.6	-163.6	72	0	0	0	111.7	D8 N10 K15 M16	D8-L12 PolarHBondContact O-N 3.24Å; D8-L12 VanDerWaalsContact O-N 3.14Å; N10-L12 VanDerWaalsContact C-N 3.33Å; N10-L12 PolarHBondContact O-N 3.17Å; L12-K15 PolarHBondContact O-N 3.3Å; L12-M16 VanDerWaalsContact O-CG 3.29Å; L12-M16 WeakPolarHBondContact O-CG 3.31Å; L12-M16 PolarHBondContact O-N 3.3Å
13	K	84.9	Confident	76.5	Confident	152 Å²	152	99.2 Å²	99.2	66%	0.661	51%	0.512	S	S	*	.	H	α-helix	trans	-62.8	-42	175.6	-170.8	179.4	-179.1	179.9	0	112	G9 N10 F11 K17	G9-K13 PolarHBondContact O-N 2.64Å; N10-K13 WeakPolarHBondContact O-CB 3.33Å; N10-K13 PolarHBondContact O-N 3.18Å; N10-K13 VanDerWaalsContact O-N 3.15Å; F11-K13 VanDerWaalsContact C-N 3.32Å; F11-K13 PolarHBondContact O-N 3.29Å; K13-K17 PolarHBondContact O-N 2.87Å; K13-K17 VanDerWaalsContact O-N 3.11Å
14	H	83.9	Confident	77.4	Confident	110 Å²	110	96.6 Å²	96.6	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-67.6	-41.7	177.1	-67.2	-59.2	0	0	0	112.3	N10 F11 K17 L18	N10-H14 PolarHBondContact O-CD2 3.32Å; N10-H14 PolarHBondContact O-N 3.25Å; F11-H14 PolarHBondContact O-N 3.5Å; H14-K17 PolarHBondContact O-N 3.31Å; H14-L18 WeakPolarHBondContact O-CG 3.37Å; H14-L18 PolarHBondContact O-N 3.06Å
15	K	86.2	Confident	78	Confident	72 Å²	72	98.3 Å²	98.3	31%	0.313	51%	0.506	S	S	.	.	H	α-helix	trans	-60	-46.4	175.4	177.9	179.4	175.8	-170.5	0	111.9	F11 L12 K17 L18 L19 Y30	F11-K15 WeakPolarHBondContact O-CB 2.91Å; F11-K15 PolarHBondContact O-N 3.27Å; L12-K15 PolarHBondContact O-N 3.3Å; K15-K17 VanDerWaalsContact C-N 3.33Å; K15-K17 PolarHBondContact O-N 3.48Å; K15-L18 PolarHBondContact O-N 3.38Å; K15-L19 HydrophobicContact CG-CD1 4.08Å; K15-L19 WeakPolarHBondContact O-CG 3.32Å; K15-L19 PolarHBondContact O-N 3.15Å; K15-Y30 HydrophobicContact CB-CE2 4.32Å; K15-Y30 HydrophobicContact CD-CE2 4.21Å; K15-Y30 HydrophobicContact CG-CD2 4.08Å; K15-Y30 HydrophobicContact CG-CE1 4.42Å; K15-Y30 HydrophobicContact CG-CE2 3.71Å
16	M	85.7	Confident	78.9	Confident	109 Å²	109	96 Å²	96	54%	0.537	50%	0.502	S	S	.	.	H	α-helix	trans	-57.6	-47.4	176.3	-73.8	-85.3	171.4	0	0	110.7	L12 L18 L19 E20	L12-M16 VanDerWaalsContact O-CG 3.29Å; L12-M16 WeakPolarHBondContact O-CG 3.31Å; L12-M16 PolarHBondContact O-N 3.3Å; M16-L18 PolarHBondContact O-N 3.46Å; M16-L19 PolarHBondContact O-N 2.95Å; M16-L19 VanDerWaalsContact O-N 3.13Å; M16-E20 PolarHBondContact O-N 3.02Å; M16-E20 VanDerWaalsContact O-N 3.14Å
17	K	87.5	Confident	79.8	Confident	135 Å²	135	92.8 Å²	92.8	59%	0.587	49%	0.488	S	S	*	.	H	α-helix	trans	-59.4	-42.3	177.5	-168.2	178.7	-178.4	-176.9	0	113	K13 H14 K15 L19 E20 M21	K13-K17 PolarHBondContact O-N 2.87Å; K13-K17 VanDerWaalsContact O-N 3.11Å; H14-K17 PolarHBondContact O-N 3.31Å; K15-K17 VanDerWaalsContact C-N 3.33Å; K15-K17 PolarHBondContact O-N 3.48Å; K17-L19 VanDerWaalsContact C-N 3.31Å; K17-L19 PolarHBondContact O-N 2.9Å; K17-E20 PolarHBondContact O-N 3.2Å; K17-M21 WeakPolarHBondContact O-CG 3.22Å; K17-M21 PolarHBondContact O-N 3.3Å
18	L	86.2	Confident	80.8	Confident	51 Å²	51	91.8 Å²	91.8	27%	0.267	48%	0.478	S	S	.	.	H	α-helix	trans	-72.1	-22.8	178.8	-69.9	172.6	0	0	0	113.5	H14 K15 M16 M21 L29 Y30	H14-L18 WeakPolarHBondContact O-CG 3.37Å; H14-L18 PolarHBondContact O-N 3.06Å; K15-L18 PolarHBondContact O-N 3.38Å; M16-L18 PolarHBondContact O-N 3.46Å; L18-M21 HydrophobicContact CD2-SD 4.2Å; L18-L29 HydrophobicContact CD2-CD2 3.69Å; L18-L29 HydrophobicContact CD2-CG 4.21Å; L18-Y30 HydrophobicContact CB-CD2 4.25Å; L18-Y30 HydrophobicContact CD1-CD2 4.28Å; L18-Y30 PolarHBondContact O-N 3.28Å
19	L	86.3	Confident	81.7	Confident	62 Å²	62	89.4 Å²	89.4	33%	0.325	47%	0.465	S	S	.	.	H	α-helix	trans	-77.4	-31.7	174.1	-76.2	166.7	0	0	0	112.1	K15 M16 K17 M21 N28 Y30	K15-L19 HydrophobicContact CG-CD1 4.08Å; K15-L19 WeakPolarHBondContact O-CG 3.32Å; K15-L19 PolarHBondContact O-N 3.15Å; M16-L19 PolarHBondContact O-N 2.95Å; M16-L19 VanDerWaalsContact O-N 3.13Å; K17-L19 VanDerWaalsContact C-N 3.31Å; K17-L19 PolarHBondContact O-N 2.9Å; L19-M21 VanDerWaalsContact C-N 3.28Å; L19-N28 HydrophobicContact CD2-CB 4.4Å; L19-N28 WeakPolarHBondContact O-CB 3.38Å; L19-Y30 HydrophobicContact CD2-CD1 3.83Å; L19-Y30 HydrophobicContact CD2-CG 4.12Å; L19-Y30 HydrophobicContact CG-CD1 4.23Å; L19-Y30 HydrophobicContact CG-CG 4.18Å
20	E	85.7	Confident	82.4	Confident	149 Å²	149	89.8 Å²	89.8	70%	0.696	45%	0.452	S	S	*	.	H	α-helix	trans	-72.3	-22.4	174	-69.5	172.1	178.8	0	0	112.6	M16 K17 T22	M16-E20 PolarHBondContact O-N 3.02Å; M16-E20 VanDerWaalsContact O-N 3.14Å; K17-E20 PolarHBondContact O-N 3.2Å; E20-T22 VanDerWaalsContact C-N 3.34Å; E20-T22 PolarHBondContact O-N 3.04Å
21	M	85	Confident	82.6	Confident	98 Å²	98	89.3 Å²	89.3	48%	0.483	45%	0.447	S	S	.	.			trans	-78.7	83.6	174.3	-65.3	177.3	96.8	0	0	110	K17 L18 L19 N28 L29	K17-M21 WeakPolarHBondContact O-CG 3.22Å; K17-M21 PolarHBondContact O-N 3.3Å; L18-M21 HydrophobicContact CD2-SD 4.2Å; L19-M21 VanDerWaalsContact C-N 3.28Å; M21-N28 WeakPolarHBondContact O-CA 3.22Å; M21-L29 HydrophobicContact CB-CB 4.1Å; M21-L29 HydrophobicContact CB-CD2 4.47Å; M21-L29 PolarHBondContact O-N 2.93Å; M21-L29 HydrophobicContact SD-CD2 4.12Å
22	T	82.2	Confident	82.9	Confident	80 Å²	80	84.6 Å²	84.6	49%	0.491	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-101	146.9	173.7	54	0	0	0	0	111.6	E20 F27 N28	E20-T22 VanDerWaalsContact C-N 3.34Å; E20-T22 PolarHBondContact O-N 3.04Å; T22-F27 VanDerWaalsContact CA-O 3.32Å; T22-F27 WeakPolarHBondContact CA-O 3.35Å; T22-N28 HydrophobicContact CG2-CB 3.9Å
23	D	75.9	Confident	83.2	Confident	54 Å²	54	82.3 Å²	82.3	29%	0.289	42%	0.415	S	S	.	.			trans	-73.9	178	165.4	68.8	6.7	0	0	0	111.9	Y25 G26 F27	D23-Y25 PolarHBondContact O-N 2.94Å; D23-Y25 VanDerWaalsContact OD1-C 3.31Å; D23-Y25 WeakPolarHBondContact OD1-CA 3.37Å; D23-Y25 WeakPolarHBondContact OD1-CB 3.43Å; D23-Y25 PolarHBondContact OD1-N 2.88Å; D23-G26 PolarHBondContact O-N 3.4Å; D23-G26 PolarHBondContact OD1-N 3.42Å; D23-F27 PolarHBondContact N-O 3.14Å; D23-F27 PolarHBondContact OD1-N 2.95Å
24	S	74.4	Confident	83.3	Confident	109 Å²	109	79 Å²	79	76%	0.762	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-12.1	175.5	51.2	0	0	0	0	114
25	Y	68.8	Low	83.5	Confident	93 Å²	93	76 Å²	76	37%	0.365	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	2.6	-179.1	-52.1	-62.9	0	0	0	112.5	D23 F27	D23-Y25 PolarHBondContact O-N 2.94Å; D23-Y25 VanDerWaalsContact OD1-C 3.31Å; D23-Y25 WeakPolarHBondContact OD1-CA 3.37Å; D23-Y25 WeakPolarHBondContact OD1-CB 3.43Å; D23-Y25 PolarHBondContact OD1-N 2.88Å; Y25-F27 VanDerWaalsContact C-N 3.33Å
26	G	75.9	Confident	83.5	Confident	49 Å²	49	72.5 Å²	72.5	51%	0.505	37%	0.373	S	S	.	.	S	Bend	trans	80.6	7.6	179.4	0	0	0	0	0	114.6	D23 N28	D23-G26 PolarHBondContact O-N 3.4Å; D23-G26 PolarHBondContact OD1-N 3.42Å; G26-N28 PolarHBondContact O-N 3.38Å
27	F	78.6	Confident	83.6	Confident	85 Å²	85	71.7 Å²	71.7	37%	0.373	37%	0.37	S	S	.	.			trans	-77.2	118.7	173.2	-63.9	-74.5	0	0	0	109.5	T22 D23 Y25 T63	T22-F27 VanDerWaalsContact CA-O 3.32Å; T22-F27 WeakPolarHBondContact CA-O 3.35Å; D23-F27 PolarHBondContact N-O 3.14Å; D23-F27 PolarHBondContact OD1-N 2.95Å; Y25-F27 VanDerWaalsContact C-N 3.33Å; F27-T63 HydrophobicContact CD1-CG2 3.81Å; F27-T63 HydrophobicContact CE1-CG2 3.24Å; F27-T63 HydrophobicContact CE2-CG2 4.33Å; F27-T63 HydrophobicContact CZ-CG2 3.56Å
28	N	84.4	Confident	83.6	Confident	41 Å²	41	71.2 Å²	71.2	22%	0.219	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-80.7	143.5	177.6	63.2	69.8	0	0	0	112	L19 M21 T22 G26 Y30 Q31 H32	L19-N28 HydrophobicContact CD2-CB 4.4Å; L19-N28 WeakPolarHBondContact O-CB 3.38Å; M21-N28 WeakPolarHBondContact O-CA 3.22Å; T22-N28 HydrophobicContact CG2-CB 3.9Å; G26-N28 PolarHBondContact O-N 3.38Å; N28-Y30 VanDerWaalsContact C-N 3.26Å; N28-Y30 PolarHBondContact O-N 2.92Å; N28-Q31 PolarHBondContact O-N 3.46Å; N28-Q31 WeakPolarHBondContact OD1-CA 3.06Å; N28-Q31 WeakPolarHBondContact OD1-CB 3.41Å; N28-Q31 PolarHBondContact OD1-N 3.06Å; N28-H32 PolarHBondContact O-N 2.95Å
29	L	86	Confident	83.5	Confident	64 Å²	64	72.3 Å²	72.3	34%	0.335	37%	0.371	S	S	.	.	H	α-helix	trans	-60.5	-37.6	-179.6	179.2	59.2	0	0	0	111.8	L18 M21 Q31 H32 L33	L18-L29 HydrophobicContact CD2-CD2 3.69Å; L18-L29 HydrophobicContact CD2-CG 4.21Å; M21-L29 HydrophobicContact CB-CB 4.1Å; M21-L29 HydrophobicContact CB-CD2 4.47Å; M21-L29 PolarHBondContact O-N 2.93Å; M21-L29 HydrophobicContact SD-CD2 4.12Å; L29-Q31 PolarHBondContact O-N 2.94Å; L29-H32 PolarHBondContact O-N 3.38Å; L29-L33 HydrophobicContact CD1-CD1 4.22Å; L29-L33 HydrophobicContact CD1-CG 4.12Å; L29-L33 HydrophobicContact CG-CD1 4.01Å; L29-L33 HydrophobicContact CG-CG 4.37Å; L29-L33 WeakPolarHBondContact O-CG 3.24Å; L29-L33 PolarHBondContact O-N 3.15Å
30	Y	87.6	Confident	83.4	Confident	54 Å²	54	71.3 Å²	71.3	21%	0.212	37%	0.365	C	S	.	.	H	α-helix	trans	-57.8	-45.7	178.3	-178.4	-98.5	0	0	0	112.8	K15 L18 L19 N28 L33 K34	K15-Y30 HydrophobicContact CB-CE2 4.32Å; K15-Y30 HydrophobicContact CD-CE2 4.21Å; K15-Y30 HydrophobicContact CG-CD2 4.08Å; K15-Y30 HydrophobicContact CG-CE1 4.42Å; K15-Y30 HydrophobicContact CG-CE2 3.71Å; L18-Y30 HydrophobicContact CB-CD2 4.25Å; L18-Y30 HydrophobicContact CD1-CD2 4.28Å; L18-Y30 PolarHBondContact O-N 3.28Å; L19-Y30 HydrophobicContact CD2-CD1 3.83Å; L19-Y30 HydrophobicContact CD2-CG 4.12Å; L19-Y30 HydrophobicContact CG-CD1 4.23Å; L19-Y30 HydrophobicContact CG-CG 4.18Å; N28-Y30 VanDerWaalsContact C-N 3.26Å; N28-Y30 PolarHBondContact O-N 2.92Å; Y30-L33 PolarHBondContact O-N 3.34Å; Y30-K34 HydrophobicContact CE1-CD 4.3Å; Y30-K34 VanDerWaalsContact O-CB 3.24Å; Y30-K34 WeakPolarHBondContact O-CB 3.38Å; Y30-K34 PolarHBondContact O-N 3.16Å
31	Q	85.2	Confident	83.3	Confident	79 Å²	79	70.2 Å²	70.2	37%	0.369	36%	0.364	S	S	.	.	H	α-helix	trans	-69.7	-36.8	-179.2	-172.9	67.9	15.2	0	0	111	N28 L29 K34 N35	N28-Q31 PolarHBondContact O-N 3.46Å; N28-Q31 WeakPolarHBondContact OD1-CA 3.06Å; N28-Q31 WeakPolarHBondContact OD1-CB 3.41Å; N28-Q31 PolarHBondContact OD1-N 3.06Å; L29-Q31 PolarHBondContact O-N 2.94Å; Q31-K34 PolarHBondContact O-N 3.26Å; Q31-N35 WeakPolarHBondContact O-CB 3.49Å; Q31-N35 PolarHBondContact O-N 2.89Å; Q31-N35 PolarHBondContact O-ND2 3.01Å; Q31-N35 PolarHBondContact O-OD1 2.98Å
32	H	87.9	Confident	83.3	Confident	28 Å²	28	75.3 Å²	75.3	13%	0.13	38%	0.379	C	S	.	.	H	α-helix	trans	-61.6	-50.8	173.4	-176.2	60.1	0	0	0	111.7	N28 L29 K34 N35 C36 S56	N28-H32 PolarHBondContact O-N 2.95Å; L29-H32 PolarHBondContact O-N 3.38Å; H32-K34 VanDerWaalsContact C-N 3.32Å; H32-K34 PolarHBondContact O-N 2.79Å; H32-N35 WeakPolarHBondContact O-CB 3.39Å; H32-N35 PolarHBondContact O-N 2.81Å; H32-N35 VanDerWaalsContact O-N 3.11Å; H32-C36 PolarHBondContact NE2-SG 3.11Å; H32-C36 PolarHBondContact O-N 3.25Å; H32-C36 PolarHBondContact O-SG 3.06Å; H32-S56 PolarHBondContact CE1-O 2.92Å; H32-S56 PolarHBondContact NE2-OG 3.42Å
33	L	88.8	Confident	83.2	Confident	55 Å²	55	74.8 Å²	74.8	29%	0.288	37%	0.371	S	S	.	.	H	α-helix	trans	-60.7	-41.9	176.7	-71.2	173.6	0	0	0	111.7	L29 Y30 N35 C36 I37 F52	L29-L33 HydrophobicContact CD1-CD1 4.22Å; L29-L33 HydrophobicContact CD1-CG 4.12Å; L29-L33 HydrophobicContact CG-CD1 4.01Å; L29-L33 HydrophobicContact CG-CG 4.37Å; L29-L33 WeakPolarHBondContact O-CG 3.24Å; L29-L33 PolarHBondContact O-N 3.15Å; Y30-L33 PolarHBondContact O-N 3.34Å; L33-N35 VanDerWaalsContact C-N 3.29Å; L33-N35 PolarHBondContact O-N 3.05Å; L33-C36 WeakPolarHBondContact O-CB 3.23Å; L33-C36 PolarHBondContact O-N 2.9Å; L33-I37 WeakPolarHBondContact O-CB 3.25Å; L33-I37 VanDerWaalsContact O-CG1 3.27Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 3.39Å; L33-F52 HydrophobicContact CD2-CZ 4.07Å
34	K	87.6	Confident	83.1	Confident	82 Å²	82	80 Å²	80	36%	0.357	39%	0.393	S	S	.	.	H	α-helix	trans	-59.5	-40.7	174.7	-178.8	-177.7	176.7	-174.8	0	111.8	Y30 Q31 H32 K38	Y30-K34 HydrophobicContact CE1-CD 4.3Å; Y30-K34 VanDerWaalsContact O-CB 3.24Å; Y30-K34 WeakPolarHBondContact O-CB 3.38Å; Y30-K34 PolarHBondContact O-N 3.16Å; Q31-K34 PolarHBondContact O-N 3.26Å; H32-K34 VanDerWaalsContact C-N 3.32Å; H32-K34 PolarHBondContact O-N 2.79Å; K34-K38 WeakPolarHBondContact O-CB 3.35Å; K34-K38 VanDerWaalsContact O-CG 3.31Å; K34-K38 WeakPolarHBondContact O-CG 3.32Å; K34-K38 PolarHBondContact O-N 2.87Å
35	N	87.3	Confident	82.7	Confident	46 Å²	46	81.1 Å²	81.1	25%	0.246	38%	0.381	C	S	.	.	H	α-helix	trans	-67.9	-40.8	176.4	-71.1	-13.2	0	0	0	111.4	Q31 H32 L33 K38 H39 L59	Q31-N35 WeakPolarHBondContact O-CB 3.49Å; Q31-N35 PolarHBondContact O-N 2.89Å; Q31-N35 PolarHBondContact O-ND2 3.01Å; Q31-N35 PolarHBondContact O-OD1 2.98Å; H32-N35 WeakPolarHBondContact O-CB 3.39Å; H32-N35 PolarHBondContact O-N 2.81Å; H32-N35 VanDerWaalsContact O-N 3.11Å; L33-N35 VanDerWaalsContact C-N 3.29Å; L33-N35 PolarHBondContact O-N 3.05Å; N35-K38 PolarHBondContact O-N 3.42Å; N35-H39 WeakPolarHBondContact O-CB 3.4Å; N35-H39 PolarHBondContact O-N 2.77Å; N35-L59 HydrophobicContact CB-CD1 4.28Å
36	C	87.3	Confident	82.4	Confident	0 Å²	0	87.2 Å²	87.2	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-59.9	-52.3	175	-61.9	0	0	0	0	111.1	H32 L33 K38 H39 M40 F52 L55 L59	H32-C36 PolarHBondContact NE2-SG 3.11Å; H32-C36 PolarHBondContact O-N 3.25Å; H32-C36 PolarHBondContact O-SG 3.06Å; L33-C36 WeakPolarHBondContact O-CB 3.23Å; L33-C36 PolarHBondContact O-N 2.9Å; C36-K38 VanDerWaalsContact C-N 3.33Å; C36-K38 PolarHBondContact O-N 3.28Å; C36-H39 WeakPolarHBondContact O-CB 3.5Å; C36-H39 PolarHBondContact O-N 3.14Å; C36-M40 WeakPolarHBondContact O-CG 3.41Å; C36-M40 PolarHBondContact O-N 3.27Å; C36-F52 HydrophobicContact CB-CE2 3.8Å; C36-L55 HydrophobicContact CB-CD2 3.8Å; C36-L59 HydrophobicContact CB-CD1 4.2Å
37	I	87	Confident	82.4	Confident	91 Å²	91	88.4 Å²	88.4	47%	0.467	41%	0.405	S	S	.	.	H	α-helix	trans	-60.2	-42.7	179.5	-67	165.4	0	0	0	111	L33 H39 M40 L41	L33-I37 WeakPolarHBondContact O-CB 3.25Å; L33-I37 VanDerWaalsContact O-CG1 3.27Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 3.39Å; I37-H39 VanDerWaalsContact C-N 3.27Å; I37-H39 PolarHBondContact O-N 3.27Å; I37-M40 PolarHBondContact O-N 3.08Å; I37-L41 HydrophobicContact CG2-CD1 3.69Å; I37-L41 HydrophobicContact CG2-CG 4.18Å; I37-L41 WeakPolarHBondContact O-CB 3.37Å; I37-L41 VanDerWaalsContact O-CG 3.27Å; I37-L41 WeakPolarHBondContact O-CG 3.48Å; I37-L41 PolarHBondContact O-N 2.9Å
38	K	86.8	Confident	82.1	Confident	125 Å²	125	85.6 Å²	85.6	54%	0.543	39%	0.394	S	S	.	.	H	α-helix	trans	-59	-40.7	174.9	-83.7	-177.1	171.7	-165.1	0	112.1	K34 N35 C36 Y42	K34-K38 WeakPolarHBondContact O-CB 3.35Å; K34-K38 VanDerWaalsContact O-CG 3.31Å; K34-K38 WeakPolarHBondContact O-CG 3.32Å; K34-K38 PolarHBondContact O-N 2.87Å; N35-K38 PolarHBondContact O-N 3.42Å; C36-K38 VanDerWaalsContact C-N 3.33Å; C36-K38 PolarHBondContact O-N 3.28Å; K38-Y42 VanDerWaalsContact O-CB 3.26Å; K38-Y42 WeakPolarHBondContact O-CB 3.42Å; K38-Y42 PolarHBondContact O-N 3.36Å; K38-Y42 VanDerWaalsContact O-N 3.07Å
39	H	84.6	Confident	81.7	Confident	74 Å²	74	92.3 Å²	92.3	34%	0.343	42%	0.421	S	S	.	.	H	α-helix	trans	-68.6	-44.1	179.6	-119.8	-80.3	0	0	0	112.1	N35 C36 I37 Y42 Q43 L55	N35-H39 WeakPolarHBondContact O-CB 3.4Å; N35-H39 PolarHBondContact O-N 2.77Å; C36-H39 WeakPolarHBondContact O-CB 3.5Å; C36-H39 PolarHBondContact O-N 3.14Å; I37-H39 VanDerWaalsContact C-N 3.27Å; I37-H39 PolarHBondContact O-N 3.27Å; H39-Y42 PolarHBondContact O-N 2.9Å; H39-Q43 PolarHBondContact ND1-NE2 3.42Å; H39-Q43 WeakPolarHBondContact O-CB 3.44Å; H39-Q43 WeakPolarHBondContact O-CG 3.48Å; H39-Q43 PolarHBondContact O-N 3.04Å; H39-L55 HydrophobicContact CB-CD1 4.13Å; H39-L55 HydrophobicContact CB-CD2 4.15Å
40	M	84.1	Confident	81.5	Confident	41 Å²	41	94.4 Å²	94.4	20%	0.202	43%	0.433	C	S	.	.	H	α-helix	trans	-59.6	-51.2	175.7	-68	163.1	82.3	0	0	110.9	C36 I37 Y42 Q43 Q44 D48 F52 L55	C36-M40 WeakPolarHBondContact O-CG 3.41Å; C36-M40 PolarHBondContact O-N 3.27Å; I37-M40 PolarHBondContact O-N 3.08Å; M40-Y42 VanDerWaalsContact C-N 3.28Å; M40-Y42 PolarHBondContact O-N 3.02Å; M40-Q43 PolarHBondContact O-N 3.04Å; M40-Q44 PolarHBondContact O-N 3.4Å; M40-D48 WeakPolarHBondContact CA-OD2 3.34Å; M40-D48 VanDerWaalsContact CB-OD2 3.28Å; M40-D48 WeakPolarHBondContact CB-OD2 3.42Å; M40-D48 HydrophobicContact CE-CB 3.63Å; M40-D48 HydrophobicContact CG-CB 4.24Å; M40-F52 HydrophobicContact CE-CD2 4.41Å; M40-F52 HydrophobicContact SD-CD2 4.02Å; M40-F52 HydrophobicContact SD-CE2 4.4Å; M40-L55 HydrophobicContact CG-CD2 4.39Å
41	L	84.4	Confident	81.3	Confident	127 Å²	127	95.5 Å²	95.5	67%	0.665	44%	0.44	S	S	*	.	H	α-helix	trans	-63.2	-31.4	179.2	-70.3	173.8	0	0	0	113.4	I37	I37-L41 HydrophobicContact CG2-CD1 3.69Å; I37-L41 HydrophobicContact CG2-CG 4.18Å; I37-L41 WeakPolarHBondContact O-CB 3.37Å; I37-L41 VanDerWaalsContact O-CG 3.27Å; I37-L41 WeakPolarHBondContact O-CG 3.48Å; I37-L41 PolarHBondContact O-N 2.9Å
42	Y	85.7	Confident	81.2	Confident	205 Å²	205	94.3 Å²	94.3	80%	0.804	43%	0.434	S	S	*	.	H	α-helix	trans	-78.8	-37.7	179	-172.9	-97.4	0	0	0	112.5	K38 H39 M40	K38-Y42 VanDerWaalsContact O-CB 3.26Å; K38-Y42 WeakPolarHBondContact O-CB 3.42Å; K38-Y42 PolarHBondContact O-N 3.36Å; K38-Y42 VanDerWaalsContact O-N 3.07Å; H39-Y42 PolarHBondContact O-N 2.9Å; M40-Y42 VanDerWaalsContact C-N 3.28Å; M40-Y42 PolarHBondContact O-N 3.02Å
43	Q	79.6	Confident	81.1	Confident	68 Å²	68	98.9 Å²	98.9	32%	0.318	46%	0.455	S	S	.	.	H	α-helix	trans	-83.8	-20.5	-177.8	-69.2	-170.9	-4.7	0	0	113.7	H39 M40 R45	H39-Q43 PolarHBondContact ND1-NE2 3.42Å; H39-Q43 WeakPolarHBondContact O-CB 3.44Å; H39-Q43 WeakPolarHBondContact O-CG 3.48Å; H39-Q43 PolarHBondContact O-N 3.04Å; M40-Q43 PolarHBondContact O-N 3.04Å; Q43-R45 HydrophobicContact CB-CG 4.14Å; Q43-R45 PolarHBondContact O-N 2.68Å
44	Q	72.6	Confident	80.9	Confident	163 Å²	163	101.9 Å²	101.9	76%	0.762	47%	0.47	S	S	*	.			trans	45.5	48.1	-178.9	-66.8	-170.6	-18.5	0	0	112.6	M40	M40-Q44 PolarHBondContact O-N 3.4Å
45	R	65.9	Low	80.6	Confident	134 Å²	134	99 Å²	99	51%	0.506	46%	0.458	S	S	.	.			trans	-82.9	141.6	178.5	-74.9	179	164.2	179.8	-8	110.1	Q43 D47 D48 E51	Q43-R45 HydrophobicContact CB-CG 4.14Å; Q43-R45 PolarHBondContact O-N 2.68Å; R45-D47 PolarHBondContact O-N 2.84Å; R45-D48 WeakPolarHBondContact CB-OD1 3.37Å; R45-E51 IonicContact NH1-OE2 3.82Å
46	F	63.3	Low	80.6	Confident	220 Å²	220	97.3 Å²	97.3	97%	0.965	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-18.1	-177.7	-74.1	-84.4	0	0	0	113.4
47	D	75.7	Confident	80.3	Confident	74 Å²	74	100.3 Å²	100.3	40%	0.396	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	34.1	-174.3	-155.2	9	0	0	0	114.6	R45 F49 N50 E51	R45-D47 PolarHBondContact O-N 2.84Å; D47-F49 PolarHBondContact O-N 2.96Å; D47-F49 VanDerWaalsContact O-N 3.11Å; D47-N50 PolarHBondContact O-N 3.04Å; D47-N50 WeakPolarHBondContact OD1-CB 3.36Å; D47-N50 VanDerWaalsContact OD1-CG 3.28Å; D47-N50 PolarHBondContact OD1-ND2 2.91Å; D47-N50 PolarHBondContact OD2-ND2 2.75Å; D47-E51 PolarHBondContact O-N 2.61Å; D47-E51 VanDerWaalsContact O-N 3.11Å
48	D	72.4	Confident	80	Confident	26 Å²	26	104.9 Å²	104.9	14%	0.139	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.7	178.9	-86.6	-16.4	0	0	0	113.6	M40 R45 F52	M40-D48 WeakPolarHBondContact CA-OD2 3.34Å; M40-D48 VanDerWaalsContact CB-OD2 3.28Å; M40-D48 WeakPolarHBondContact CB-OD2 3.42Å; M40-D48 HydrophobicContact CE-CB 3.63Å; M40-D48 HydrophobicContact CG-CB 4.24Å; R45-D48 WeakPolarHBondContact CB-OD1 3.37Å; D48-F52 PolarHBondContact O-N 2.98Å
49	F	76.9	Confident	79.7	Confident	182 Å²	182	100.3 Å²	100.3	80%	0.798	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-43.7	178.5	-171.7	-95	0	0	0	112	D47	D47-F49 PolarHBondContact O-N 2.96Å; D47-F49 VanDerWaalsContact O-N 3.11Å
50	N	81.8	Confident	79.6	Confident	109 Å²	109	100.5 Å²	100.5	58%	0.583	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-28	179.2	-63.3	-34.9	0	0	0	112.2	D47	D47-N50 PolarHBondContact O-N 3.04Å; D47-N50 WeakPolarHBondContact OD1-CB 3.36Å; D47-N50 VanDerWaalsContact OD1-CG 3.28Å; D47-N50 PolarHBondContact OD1-ND2 2.91Å; D47-N50 PolarHBondContact OD2-ND2 2.75Å
51	E	81.8	Confident	78.9	Confident	77 Å²	77	105.3 Å²	105.3	36%	0.36	49%	0.49	S	S	.	.	S	Bend	trans	-89	3.7	179.1	-65.9	-166.2	169.9	0	0	114.3	R45 D47 E53 I54 L55	R45-E51 IonicContact NH1-OE2 3.82Å; D47-E51 PolarHBondContact O-N 2.61Å; D47-E51 VanDerWaalsContact O-N 3.11Å; E51-E53 VanDerWaalsContact C-N 3.35Å; E51-E53 PolarHBondContact O-N 3.4Å; E51-I54 PolarHBondContact O-N 3.23Å; E51-I54 VanDerWaalsContact O-N 3.15Å; E51-L55 PolarHBondContact O-N 2.93Å
52	F	84.6	Confident	78.1	Confident	54 Å²	54	102.2 Å²	102.2	24%	0.237	49%	0.488	C	S	.	.	H	α-helix	trans	-57.8	-44.3	-176.1	177.9	-101.6	0	0	0	112.6	L33 C36 M40 D48 I54 L55 S56	L33-F52 HydrophobicContact CD2-CZ 4.07Å; C36-F52 HydrophobicContact CB-CE2 3.8Å; M40-F52 HydrophobicContact CE-CD2 4.41Å; M40-F52 HydrophobicContact SD-CD2 4.02Å; M40-F52 HydrophobicContact SD-CE2 4.4Å; D48-F52 PolarHBondContact O-N 2.98Å; F52-I54 VanDerWaalsContact C-N 3.32Å; F52-I54 PolarHBondContact O-N 3.05Å; F52-L55 PolarHBondContact O-N 2.82Å; F52-S56 WeakPolarHBondContact O-CB 3.4Å; F52-S56 PolarHBondContact O-N 3.49Å
53	E	85.6	Confident	77.2	Confident	124 Å²	124	94.5 Å²	94.5	58%	0.579	46%	0.463	S	S	*	.	H	α-helix	trans	-60.7	-40	178.5	-90.9	55.9	-143.8	0	0	112	E51 S57	E51-E53 VanDerWaalsContact C-N 3.35Å; E51-E53 PolarHBondContact O-N 3.4Å; E53-S57 VanDerWaalsContact O-CB 3.24Å; E53-S57 WeakPolarHBondContact O-CB 3.44Å; E53-S57 PolarHBondContact O-N 2.87Å; E53-S57 PolarHBondContact O-OG 2.89Å
54	I	83.7	Confident	76	Confident	117 Å²	117	98.7 Å²	98.7	60%	0.6	48%	0.48	S	S	*	.	H	α-helix	trans	-67	-45.7	177.8	-60.9	173.3	0	0	0	109.6	E51 F52 S57 R58	E51-I54 PolarHBondContact O-N 3.23Å; E51-I54 VanDerWaalsContact O-N 3.15Å; F52-I54 VanDerWaalsContact C-N 3.32Å; F52-I54 PolarHBondContact O-N 3.05Å; I54-S57 PolarHBondContact O-N 3.46Å; I54-R58 WeakPolarHBondContact O-CB 3.49Å; I54-R58 PolarHBondContact O-N 3.45Å
55	L	82.7	Confident	75.3	Confident	21 Å²	21	95.4 Å²	95.4	11%	0.11	46%	0.461	C	S	.	.	H	α-helix	trans	-64.9	-45.2	179.2	-170.9	130.6	0	0	0	111.9	C36 H39 M40 E51 F52 S57 R58 L59	C36-L55 HydrophobicContact CB-CD2 3.8Å; H39-L55 HydrophobicContact CB-CD1 4.13Å; H39-L55 HydrophobicContact CB-CD2 4.15Å; M40-L55 HydrophobicContact CG-CD2 4.39Å; E51-L55 PolarHBondContact O-N 2.93Å; F52-L55 PolarHBondContact O-N 2.82Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 2.83Å; L55-R58 PolarHBondContact O-N 3.37Å; L55-L59 HydrophobicContact CD2-CD1 3.67Å; L55-L59 HydrophobicContact CG-CD1 4.38Å; L55-L59 WeakPolarHBondContact O-CB 3.38Å; L55-L59 WeakPolarHBondContact O-CG 3.47Å; L55-L59 PolarHBondContact O-N 2.96Å
56	S	85.8	Confident	74.3	Confident	12 Å²	12	96.3 Å²	96.3	8%	0.084	47%	0.47	C	S	.	.	H	α-helix	trans	-58.7	-45.1	174.9	-179	0	0	0	0	111	H32 F52 L59 K60	H32-S56 PolarHBondContact CE1-O 2.92Å; H32-S56 PolarHBondContact NE2-OG 3.42Å; F52-S56 WeakPolarHBondContact O-CB 3.4Å; F52-S56 PolarHBondContact O-N 3.49Å; S56-L59 PolarHBondContact O-N 2.96Å; S56-K60 WeakPolarHBondContact O-CB 3.48Å; S56-K60 VanDerWaalsContact O-CG 3.26Å; S56-K60 WeakPolarHBondContact O-CG 3.33Å; S56-K60 PolarHBondContact O-N 3.08Å
57	S	81.2	Confident	73.6	Confident	63 Å²	63	86.3 Å²	86.3	44%	0.441	43%	0.429	S	S	.	.	H	α-helix	trans	-65.1	-44.3	177	-60.7	0	0	0	0	111.8	E53 I54 L55 L59 K60 L61	E53-S57 VanDerWaalsContact O-CB 3.24Å; E53-S57 WeakPolarHBondContact O-CB 3.44Å; E53-S57 PolarHBondContact O-N 2.87Å; E53-S57 PolarHBondContact O-OG 2.89Å; I54-S57 PolarHBondContact O-N 3.46Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 2.83Å; S57-L59 PolarHBondContact O-N 3.36Å; S57-K60 WeakPolarHBondContact O-CB 3.3Å; S57-K60 PolarHBondContact O-N 2.9Å; S57-L61 WeakPolarHBondContact O-CG 3.36Å; S57-L61 PolarHBondContact O-N 3.19Å
58	R	80.8	Confident	72.1	Confident	186 Å²	186	89.3 Å²	89.3	70%	0.702	45%	0.453	S	S	*	.	H	α-helix	trans	-62.2	-42	176.6	-175.9	178	176	164.6	1.1	112.4	I54 L55 L61 G62	I54-R58 WeakPolarHBondContact O-CB 3.49Å; I54-R58 PolarHBondContact O-N 3.45Å; L55-R58 PolarHBondContact O-N 3.37Å; R58-L61 PolarHBondContact O-N 2.87Å; R58-G62 PolarHBondContact O-N 2.84Å
59	L	81.4	Confident	71	Confident	29 Å²	29	91.5 Å²	91.5	15%	0.152	48%	0.481	C	S	.	.	H	α-helix	trans	-67.6	-36.4	176.8	-74.9	174.3	0	0	0	112.1	N35 C36 L55 S56 S57 L61 G62 T63	N35-L59 HydrophobicContact CB-CD1 4.28Å; C36-L59 HydrophobicContact CB-CD1 4.2Å; L55-L59 HydrophobicContact CD2-CD1 3.67Å; L55-L59 HydrophobicContact CG-CD1 4.38Å; L55-L59 WeakPolarHBondContact O-CB 3.38Å; L55-L59 WeakPolarHBondContact O-CG 3.47Å; L55-L59 PolarHBondContact O-N 2.96Å; S56-L59 PolarHBondContact O-N 2.96Å; S57-L59 PolarHBondContact O-N 3.36Å; L59-L61 VanDerWaalsContact C-N 3.32Å; L59-G62 PolarHBondContact O-N 3.38Å; L59-T63 WeakPolarHBondContact O-CB 2.96Å; L59-T63 PolarHBondContact O-N 3.35Å; L59-T63 PolarHBondContact O-OG1 3.4Å
60	K	81.2	Confident	69.7	Low	78 Å²	78	86.1 Å²	86.1	34%	0.339	46%	0.461	S	S	.	.	H	α-helix	trans	-63.5	-37	172.1	-75.7	168	177.5	176	0	112.3	S56 S57 T63	S56-K60 WeakPolarHBondContact O-CB 3.48Å; S56-K60 VanDerWaalsContact O-CG 3.26Å; S56-K60 WeakPolarHBondContact O-CG 3.33Å; S56-K60 PolarHBondContact O-N 3.08Å; S57-K60 WeakPolarHBondContact O-CB 3.3Å; S57-K60 PolarHBondContact O-N 2.9Å; K60-T63 VanDerWaalsContact O-O 3.12Å
61	L	70.9	Confident	68.2	Low	142 Å²	142	84.6 Å²	84.6	74%	0.743	46%	0.457	S	S	*	.	H	α-helix	trans	-70.5	-43	176	-74.4	163.6	0	0	0	112.4	S57 R58 L59 T63	S57-L61 WeakPolarHBondContact O-CG 3.36Å; S57-L61 PolarHBondContact O-N 3.19Å; R58-L61 PolarHBondContact O-N 2.87Å; L59-L61 VanDerWaalsContact C-N 3.32Å; L61-T63 VanDerWaalsContact C-N 3.29Å; L61-T63 PolarHBondContact O-N 3.45Å
62	G	66.1	Low	66.8	Low	62 Å²	62	86 Å²	86	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-69.5	-28.7	179.3	0	0	0	0	0	113.2	R58 L59 K64	R58-G62 PolarHBondContact O-N 2.84Å; L59-G62 PolarHBondContact O-N 3.38Å; G62-K64 PolarHBondContact O-N 3.45Å
63	T	66.3	Low	65.4	Low	44 Å²	44	90.5 Å²	90.5	27%	0.27	50%	0.502	S	S	.	.	S	Bend	trans	-75.4	84	169.7	-47.2	0	0	0	0	107	F27 L59 K60 L61 R65	F27-T63 HydrophobicContact CD1-CG2 3.81Å; F27-T63 HydrophobicContact CE1-CG2 3.24Å; F27-T63 HydrophobicContact CE2-CG2 4.33Å; F27-T63 HydrophobicContact CZ-CG2 3.56Å; L59-T63 WeakPolarHBondContact O-CB 2.96Å; L59-T63 PolarHBondContact O-N 3.35Å; L59-T63 PolarHBondContact O-OG1 3.4Å; K60-T63 VanDerWaalsContact O-O 3.12Å; L61-T63 VanDerWaalsContact C-N 3.29Å; L61-T63 PolarHBondContact O-N 3.45Å; T63-R65 VanDerWaalsContact C-N 3.34Å; T63-R65 WeakPolarHBondContact O-CG 3.32Å; T63-R65 PolarHBondContact O-N 2.87Å
64	K	55	Low	64.1	Low	156 Å²	156	90.1 Å²	90.1	68%	0.678	50%	0.503	S	S	*	.			trans	-39.2	96.6	-180	-71.5	179.7	170.6	-168.3	0	110.5	G62 H66	G62-K64 PolarHBondContact O-N 3.45Å; K64-H66 PolarHBondContact O-N 3.29Å
65	R	57.4	Low	63.5	Low	94 Å²	94	88.7 Å²	88.7	36%	0.355	50%	0.497	S	S	.	.			trans	-73.6	80.4	174.8	-70.4	176.1	171.7	-169.4	-13.5	105.1	T63 G67 D70	T63-R65 VanDerWaalsContact C-N 3.34Å; T63-R65 WeakPolarHBondContact O-CG 3.32Å; T63-R65 PolarHBondContact O-N 2.87Å; R65-G67 PolarHBondContact O-N 3.44Å; R65-D70 WeakPolarHBondContact CB-OD2 3.17Å
66	H	45.3	Very low	63.2	Low	152 Å²	152	92.7 Å²	92.7	70%	0.704	52%	0.524	S	S	*	.			trans	-85.2	69.1	172.1	-72.2	-38.5	0	0	0	107.7	K64	K64-H66 PolarHBondContact O-N 3.29Å
67	G	48.5	Very low	62.8	Low	10 Å²	10	94.6 Å²	94.6	10%	0.103	54%	0.54	C	S	.	.			trans	-82.6	143.9	170.7	0	0	0	0	0	111.3	R65 G69 D70	R65-G67 PolarHBondContact O-N 3.44Å; G67-G69 PolarHBondContact O-N 2.89Å; G67-D70 PolarHBondContact O-N 3.21Å; G67-D70 VanDerWaalsContact O-N 3.1Å
68	P	44.1	Very low	62.6	Low	138 Å²	138	94.6 Å²	94.6	90%	0.896	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	99.9	167.3	28.7	-29.4	0	0	0	107.8
69	G	50.6	Low	62.6	Low	71 Å²	71	90.7 Å²	90.7	73%	0.732	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	130.1	-12.9	-175	0	0	0	0	0	114.2	G67 P71	G67-G69 PolarHBondContact O-N 2.89Å; G69-P71 WeakPolarHBondContact O-CD 3.34Å
70	D	48.5	Very low	62.6	Low	70 Å²	70	92.3 Å²	92.3	37%	0.374	54%	0.542	S	S	.	.	S	Bend	trans	-69.2	123.3	166.5	-118.4	-37.2	0	0	0	107.2	R65 G67 S72	R65-D70 WeakPolarHBondContact CB-OD2 3.17Å; G67-D70 PolarHBondContact O-N 3.21Å; G67-D70 VanDerWaalsContact O-N 3.1Å; D70-S72 PolarHBondContact O-N 3.24Å
71	P	50.8	Low	62.7	Low	77 Å²	77	89.8 Å²	89.8	50%	0.5	53%	0.534	S	S	.	.			trans	-68.5	82.4	-179.2	28.3	-32.2	0	0	0	107.9	G69 N73 L74	G69-P71 WeakPolarHBondContact O-CD 3.34Å; P71-N73 CarbonylContact O-C 3.56Å; P71-N73 PolarHBondContact O-N 3.3Å; P71-L74 HydrophobicContact CB-CG 4.49Å; P71-L74 HydrophobicContact CG-CD2 4.13Å; P71-L74 HydrophobicContact CG-CG 4.22Å; P71-L74 PolarHBondContact O-N 2.81Å
72	S	53.4	Low	63.2	Low	106 Å²	106	86.1 Å²	86.1	74%	0.741	52%	0.52	S	S	*	.	S	Bend	trans	-59.4	-13.6	179	36.7	0	0	0	0	112.2	D70	D70-S72 PolarHBondContact O-N 3.24Å
73	N	54.4	Low	64.1	Low	148 Å²	148	88.6 Å²	88.6	79%	0.791	51%	0.513	S	S	*	.	S	Bend	trans	-127.5	83.2	163.9	-66.5	-31.5	0	0	0	109.1	P71 N75	P71-N73 CarbonylContact O-C 3.56Å; P71-N73 PolarHBondContact O-N 3.3Å; N73-N75 VanDerWaalsContact C-N 3.34Å; N73-N75 PolarHBondContact O-N 3.29Å
74	L	58.8	Low	64.9	Low	116 Å²	116	88.7 Å²	88.7	61%	0.607	51%	0.511	S	S	*	.			trans	-57.7	106.7	157.9	-79.2	160	0	0	0	105.9	P71 P76	P71-L74 HydrophobicContact CB-CG 4.49Å; P71-L74 HydrophobicContact CG-CD2 4.13Å; P71-L74 HydrophobicContact CG-CG 4.22Å; P71-L74 PolarHBondContact O-N 2.81Å; L74-P76 VanDerWaalsContact O-CD 3.3Å; L74-P76 WeakPolarHBondContact O-CD 3.38Å
75	N	70.4	Confident	66.4	Low	88 Å²	88	83 Å²	83	47%	0.471	49%	0.487	S	S	.	.			trans	-54.9	117.2	173.6	177.8	-0.5	0	0	0	107	N73 A77 S78 F79	N73-N75 VanDerWaalsContact C-N 3.34Å; N73-N75 PolarHBondContact O-N 3.29Å; N75-A77 PolarHBondContact O-N 3.39Å; N75-A77 VanDerWaalsContact O-N 3.12Å; N75-A77 PolarHBondContact OD1-N 3.15Å; N75-S78 PolarHBondContact O-N 3.35Å; N75-F79 PolarHBondContact O-N 3.11Å; N75-F79 VanDerWaalsContact O-N 3.12Å
76	P	76.8	Confident	67.7	Low	105 Å²	105	84.9 Å²	84.9	68%	0.682	50%	0.5	S	S	*	.	H	α-helix	trans	-56.1	-32.7	-175.8	20	-31.8	0	0	0	112	L74 F79 S80	L74-P76 VanDerWaalsContact O-CD 3.3Å; L74-P76 WeakPolarHBondContact O-CD 3.38Å; P76-F79 PolarHBondContact O-N 2.88Å; P76-S80 PolarHBondContact O-N 3.01Å; P76-S80 PolarHBondContact O-OG 3.39Å
77	A	76.9	Confident	69.6	Low	52 Å²	52	84.9 Å²	84.9	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-45.8	175.5	0	0	0	0	0	112.4	N75 F79 S80 T81	N75-A77 PolarHBondContact O-N 3.39Å; N75-A77 VanDerWaalsContact O-N 3.12Å; N75-A77 PolarHBondContact OD1-N 3.15Å; A77-F79 VanDerWaalsContact C-N 3.27Å; A77-F79 PolarHBondContact O-N 3.03Å; A77-S80 WeakPolarHBondContact CA-OG 3.39Å; A77-S80 PolarHBondContact O-N 3.14Å; A77-S80 PolarHBondContact O-OG 3.13Å; A77-T81 PolarHBondContact O-N 3.37Å; A77-T81 PolarHBondContact O-OG1 3.16Å
78	S	77.2	Confident	71.2	Confident	63 Å²	63	86.4 Å²	86.4	44%	0.441	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-34	177.3	-54.9	0	0	0	0	112.1	N75 S82	N75-S78 PolarHBondContact O-N 3.35Å; S78-S82 WeakPolarHBondContact O-CB 2.97Å; S78-S82 PolarHBondContact O-N 2.84Å; S78-S82 PolarHBondContact O-OG 3.29Å
79	F	80.1	Confident	73.2	Confident	104 Å²	104	85.8 Å²	85.8	46%	0.456	49%	0.487	S	S	.	.	H	α-helix	trans	-70.6	-39.3	176	-173.3	-109	0	0	0	112.4	N75 P76 A77 S82 K83	N75-F79 PolarHBondContact O-N 3.11Å; N75-F79 VanDerWaalsContact O-N 3.12Å; P76-F79 PolarHBondContact O-N 2.88Å; A77-F79 VanDerWaalsContact C-N 3.27Å; A77-F79 PolarHBondContact O-N 3.03Å; F79-S82 PolarHBondContact O-N 3.47Å; F79-K83 HydrophobicContact CD1-CD 4.39Å; F79-K83 HydrophobicContact CE1-CD 4.03Å; F79-K83 HydrophobicContact CZ-CD 4.45Å; F79-K83 VanDerWaalsContact CZ-CE 3.49Å; F79-K83 PolarHBondContact O-N 3.34Å; F79-K83 VanDerWaalsContact O-N 3.09Å
80	S	81.6	Confident	74.6	Confident	62 Å²	62	85.4 Å²	85.4	43%	0.434	47%	0.473	S	S	.	.	H	α-helix	trans	-64.1	-46.8	174.3	47.9	0	0	0	0	111.8	P76 A77 S82 K83 I84	P76-S80 PolarHBondContact O-N 3.01Å; P76-S80 PolarHBondContact O-OG 3.39Å; A77-S80 WeakPolarHBondContact CA-OG 3.39Å; A77-S80 PolarHBondContact O-N 3.14Å; A77-S80 PolarHBondContact O-OG 3.13Å; S80-S82 VanDerWaalsContact C-N 3.31Å; S80-S82 PolarHBondContact O-N 3.06Å; S80-K83 WeakPolarHBondContact O-CB 3.42Å; S80-K83 PolarHBondContact O-N 3.3Å; S80-I84 WeakPolarHBondContact O-CG1 3.41Å; S80-I84 PolarHBondContact O-N 3.48Å; S80-I84 VanDerWaalsContact O-N 3.17Å
81	T	83.4	Confident	75.3	Confident	26 Å²	26	92 Å²	92	16%	0.16	49%	0.492	C	S	.	.	H	α-helix	trans	-54.9	-47.5	173.1	-68.5	0	0	0	0	111.4	A77 K83 I84 Q85 E235	A77-T81 PolarHBondContact O-N 3.37Å; A77-T81 PolarHBondContact O-OG1 3.16Å; T81-K83 VanDerWaalsContact C-N 3.29Å; T81-K83 PolarHBondContact O-N 3.12Å; T81-I84 WeakPolarHBondContact O-CB 2.84Å; T81-I84 PolarHBondContact O-N 2.79Å; T81-I84 VanDerWaalsContact O-N 3.1Å; T81-Q85 HydrophobicContact CG2-CG 4.4Å; T81-Q85 VanDerWaalsContact CG2-NE2 3.34Å; T81-Q85 WeakPolarHBondContact O-CG 3.47Å; T81-Q85 PolarHBondContact O-N 2.94Å; T81-E235 WeakPolarHBondContact CB-OE2 3.24Å; T81-E235 HydrophobicContact CG2-CG 4.39Å; T81-E235 WeakPolarHBondContact CG2-OE1 3.31Å; T81-E235 WeakPolarHBondContact CG2-OE2 3.17Å; T81-E235 PolarHBondContact OG1-OE1 3.32Å; T81-E235 PolarHBondContact OG1-OE2 3.01Å
82	S	82.7	Confident	75.8	Confident	64 Å²	64	91.9 Å²	91.9	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-61.7	-37	-178.9	-59.3	0	0	0	0	112.3	S78 F79 S80 Q85 Q86	S78-S82 WeakPolarHBondContact O-CB 2.97Å; S78-S82 PolarHBondContact O-N 2.84Å; S78-S82 PolarHBondContact O-OG 3.29Å; F79-S82 PolarHBondContact O-N 3.47Å; S80-S82 VanDerWaalsContact C-N 3.31Å; S80-S82 PolarHBondContact O-N 3.06Å; S82-Q85 PolarHBondContact O-N 3.24Å; S82-Q86 WeakPolarHBondContact O-CB 3.44Å; S82-Q86 PolarHBondContact O-N 2.98Å
83	K	83.8	Confident	76	Confident	114 Å²	114	92.1 Å²	92.1	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-66.9	-35.5	175.6	-80.8	-179.5	169.3	178.6	0	113	F79 S80 T81	F79-K83 HydrophobicContact CD1-CD 4.39Å; F79-K83 HydrophobicContact CE1-CD 4.03Å; F79-K83 HydrophobicContact CZ-CD 4.45Å; F79-K83 VanDerWaalsContact CZ-CE 3.49Å; F79-K83 PolarHBondContact O-N 3.34Å; F79-K83 VanDerWaalsContact O-N 3.09Å; S80-K83 WeakPolarHBondContact O-CB 3.42Å; S80-K83 PolarHBondContact O-N 3.3Å; T81-K83 VanDerWaalsContact C-N 3.29Å; T81-K83 PolarHBondContact O-N 3.12Å
84	I	84.5	Confident	76	Confident	47 Å²	47	93.9 Å²	93.9	24%	0.241	49%	0.493	C	S	.	.	H	α-helix	trans	-67	-52	175.6	-66.2	159.4	0	0	0	108.7	S80 T81 Q86 K87 G237 L238	S80-I84 WeakPolarHBondContact O-CG1 3.41Å; S80-I84 PolarHBondContact O-N 3.48Å; S80-I84 VanDerWaalsContact O-N 3.17Å; T81-I84 WeakPolarHBondContact O-CB 2.84Å; T81-I84 PolarHBondContact O-N 2.79Å; T81-I84 VanDerWaalsContact O-N 3.1Å; I84-Q86 VanDerWaalsContact C-N 3.29Å; I84-Q86 PolarHBondContact O-N 3.01Å; I84-K87 WeakPolarHBondContact O-CB 3.19Å; I84-K87 PolarHBondContact O-N 3.42Å; I84-G237 VanDerWaalsContact CG2-C 3.48Å; I84-G237 WeakPolarHBondContact CG2-O 3.48Å; I84-L238 HydrophobicContact CD1-CD2 3.92Å; I84-L238 HydrophobicContact CG2-CD2 3.97Å; I84-L238 HydrophobicContact CG2-CG 4.35Å
85	Q	85.5	Confident	75.8	Confident	36 Å²	36	92.4 Å²	92.4	17%	0.168	48%	0.483	C	S	.	.	H	α-helix	trans	-62.7	-33	179.8	-71.2	172.3	-1.5	0	0	113.1	T81 S82 K87 L88 F89 L133 P236	T81-Q85 HydrophobicContact CG2-CG 4.4Å; T81-Q85 VanDerWaalsContact CG2-NE2 3.34Å; T81-Q85 WeakPolarHBondContact O-CG 3.47Å; T81-Q85 PolarHBondContact O-N 2.94Å; S82-Q85 PolarHBondContact O-N 3.24Å; Q85-K87 PolarHBondContact O-N 2.92Å; Q85-K87 VanDerWaalsContact O-N 3.12Å; Q85-L88 VanDerWaalsContact O-CB 3.31Å; Q85-L88 WeakPolarHBondContact O-CB 3.24Å; Q85-L88 PolarHBondContact O-N 2.89Å; Q85-F89 WeakPolarHBondContact O-CD2 3.29Å; Q85-L133 HydrophobicContact CB-CD2 4.11Å; Q85-L133 VanDerWaalsContact CD-CD1 3.5Å; Q85-L133 HydrophobicContact CG-CD1 4.15Å; Q85-L133 HydrophobicContact CG-CD2 4.09Å; Q85-P236 WeakPolarHBondContact CG-O 3.49Å
86	Q	85.5	Confident	74.9	Confident	134 Å²	134	91.4 Å²	91.4	63%	0.626	48%	0.478	S	S	*	.	H	α-helix	trans	-54.4	-33	177.4	-175.3	177.8	9.9	0	0	112.5	S82 I84 L88 F89 S90	S82-Q86 WeakPolarHBondContact O-CB 3.44Å; S82-Q86 PolarHBondContact O-N 2.98Å; I84-Q86 VanDerWaalsContact C-N 3.29Å; I84-Q86 PolarHBondContact O-N 3.01Å; Q86-L88 VanDerWaalsContact C-N 3.26Å; Q86-L88 PolarHBondContact O-N 2.95Å; Q86-F89 PolarHBondContact O-N 3.07Å; Q86-S90 PolarHBondContact O-N 3.07Å
87	K	83.9	Confident	74	Confident	152 Å²	152	94.9 Å²	94.9	66%	0.661	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-66.3	-27.4	178.6	-60.2	-178.6	-179	-178.8	0	113	I84 Q85 F89 S90	I84-K87 WeakPolarHBondContact O-CB 3.19Å; I84-K87 PolarHBondContact O-N 3.42Å; Q85-K87 PolarHBondContact O-N 2.92Å; Q85-K87 VanDerWaalsContact O-N 3.12Å; K87-F89 PolarHBondContact O-N 3.21Å; K87-S90 WeakPolarHBondContact CA-OG 3.2Å; K87-S90 PolarHBondContact O-N 3.38Å; K87-S90 PolarHBondContact O-OG 3.35Å
88	L	82.8	Confident	73.1	Confident	41 Å²	41	97.1 Å²	97.1	22%	0.215	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-69.8	-23.8	176.4	-62.3	171.9	0	0	0	112.6	Q85 Q86 L133 M136 T137	Q85-L88 VanDerWaalsContact O-CB 3.31Å; Q85-L88 WeakPolarHBondContact O-CB 3.24Å; Q85-L88 PolarHBondContact O-N 2.89Å; Q86-L88 VanDerWaalsContact C-N 3.26Å; Q86-L88 PolarHBondContact O-N 2.95Å; L88-L133 HydrophobicContact CD1-CD2 4.03Å; L88-M136 HydrophobicContact CB-CB 4.28Å; L88-M136 HydrophobicContact CB-SD 4.13Å; L88-T137 HydrophobicContact CD1-CG2 3.6Å; L88-T137 HydrophobicContact CD2-CG2 3.77Å; L88-T137 HydrophobicContact CG-CG2 4.33Å
89	F	85.1	Confident	72.2	Confident	126 Å²	126	96.3 Å²	96.3	55%	0.553	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-93.2	-10.1	179.3	-59.9	-86	0	0	0	112.9	Q85 Q86 K87 L133 M136	Q85-F89 WeakPolarHBondContact O-CD2 3.29Å; Q86-F89 PolarHBondContact O-N 3.07Å; K87-F89 PolarHBondContact O-N 3.21Å; F89-L133 HydrophobicContact CE2-CD2 3.63Å; F89-L133 HydrophobicContact CZ-CD2 3.61Å; F89-M136 HydrophobicContact CD1-CE 3.87Å; F89-M136 HydrophobicContact CD1-SD 4Å; F89-M136 HydrophobicContact CE1-CE 3.57Å; F89-M136 HydrophobicContact CE1-SD 3.84Å; F89-M136 HydrophobicContact CZ-CE 4.37Å; F89-M136 HydrophobicContact CZ-SD 4.21Å
90	S	80.4	Confident	71.1	Confident	63 Å²	63	97.7 Å²	97.7	44%	0.441	50%	0.496	S	S	.	.	S	Bend	trans	-79.1	124	171.9	43.3	0	0	0	0	109.6	Q86 K87 N92	Q86-S90 PolarHBondContact O-N 3.07Å; K87-S90 WeakPolarHBondContact CA-OG 3.2Å; K87-S90 PolarHBondContact O-N 3.38Å; K87-S90 PolarHBondContact O-OG 3.35Å; S90-N92 PolarHBondContact O-N 2.89Å; S90-N92 VanDerWaalsContact O-N 3.16Å
91	R	63.5	Low	70	Confident	207 Å²	207	96.1 Å²	96.1	78%	0.781	49%	0.487	S	S	*	.			trans	-71	105.9	177.9	-170.3	173.9	-178	172.7	1.5	109.8	D96	R91-D96 IonicContact CZ-OD2 3.74Å; R91-D96 VanDerWaalsContact CZ-OD2 3.29Å; R91-D96 IonicContact NE-OD1 3.28Å; R91-D96 IonicContact NE-OD2 3.4Å; R91-D96 PolarHBondContact NE-OD2 3.27Å; R91-D96 IonicContact NH2-OD2 2.9Å; R91-D96 PolarHBondContact NH2-OD2 3.11Å
92	N	61.8	Low	68.7	Low	76 Å²	76	100.4 Å²	100.4	41%	0.406	51%	0.509	S	S	.	.			trans	-82.9	118.1	168.2	-76.7	-10.8	0	0	0	108	S90 E94 E95	S90-N92 PolarHBondContact O-N 2.89Å; S90-N92 VanDerWaalsContact O-N 3.16Å; N92-E94 PolarHBondContact O-N 3.49Å; N92-E94 VanDerWaalsContact O-N 3.09Å; N92-E95 HydrophobicContact CB-CB 4.23Å; N92-E95 HydrophobicContact CB-CG 4.1Å; N92-E95 PolarHBondContact ND2-OE1 3.09Å; N92-E95 PolarHBondContact O-N 3.16Å
93	S	56.4	Low	67.1	Low	110 Å²	110	107.4 Å²	107.4	77%	0.769	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.7	179	40.5	0	0	0	0	113.9
94	E	54.3	Low	65.7	Low	186 Å²	186	105.9 Å²	105.9	87%	0.869	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-18.9	-179.4	-65.7	174.1	-179.9	0	0	113	N92	N92-E94 PolarHBondContact O-N 3.49Å; N92-E94 VanDerWaalsContact O-N 3.09Å
95	E	54.9	Low	64.7	Low	84 Å²	84	109.9 Å²	109.9	39%	0.393	57%	0.569	S	S	.	*	S	Bend	trans	-98.7	0.8	-179.1	-68	174.7	-145.6	0	0	113.1	N92 E97 N143	N92-E95 HydrophobicContact CB-CB 4.23Å; N92-E95 HydrophobicContact CB-CG 4.1Å; N92-E95 PolarHBondContact ND2-OE1 3.09Å; N92-E95 PolarHBondContact O-N 3.16Å; E95-E97 VanDerWaalsContact C-N 3.34Å; E95-E97 PolarHBondContact O-N 3.19Å; E95-N143 PolarHBondContact O-ND2 2.88Å
96	D	53	Low	63.8	Low	68 Å²	68	114.4 Å²	114.4	36%	0.364	59%	0.59	S	S	.	*			trans	-79.9	-11.5	-172.6	-96	-7.9	0	0	0	113.5	R91 E98	R91-D96 IonicContact CZ-OD2 3.74Å; R91-D96 VanDerWaalsContact CZ-OD2 3.29Å; R91-D96 IonicContact NE-OD1 3.28Å; R91-D96 IonicContact NE-OD2 3.4Å; R91-D96 PolarHBondContact NE-OD2 3.27Å; R91-D96 IonicContact NH2-OD2 2.9Å; R91-D96 PolarHBondContact NH2-OD2 3.11Å; D96-E98 PolarHBondContact O-N 3.31Å
97	E	57.2	Low	63.4	Low	177 Å²	177	111.2 Å²	111.2	83%	0.827	58%	0.575	S	S	*	*			trans	-77.1	92	169.6	-68.5	-171.9	179	0	0	108.2	E95	E95-E97 VanDerWaalsContact C-N 3.34Å; E95-E97 PolarHBondContact O-N 3.19Å
98	E	58.9	Low	63.2	Low	99 Å²	99	104.7 Å²	104.7	46%	0.463	55%	0.548	S	S	.	.			trans	-56.4	129.6	162.9	-73.2	178.4	176.1	0	0	107.5	D96 V100 K139	D96-E98 PolarHBondContact O-N 3.31Å; E98-V100 PolarHBondContact O-N 2.77Å; E98-K139 IonicContact OE1-NZ 2.79Å; E98-K139 PolarHBondContact OE1-NZ 3.19Å
99	P	57.9	Low	63.1	Low	46 Å²	46	104 Å²	104	30%	0.299	55%	0.545	S	S	.	.			trans	-55.6	115.8	177.4	22	-32	0	0	0	107.9	A101 H107 P108 V142 N143	P99-A101 PolarHBondContact O-N 3.02Å; P99-H107 PolarHBondContact O-CD2 3.06Å; P99-H107 PolarHBondContact O-NE2 2.84Å; P99-P108 HydrophobicContact CB-CG 4.25Å; P99-P108 HydrophobicContact CG-CG 3.65Å; P99-V142 HydrophobicContact CG-CG1 3.99Å; P99-N143 WeakPolarHBondContact CD-OD1 3.43Å
100	V	56.4	Low	63	Low	133 Å²	133	99.1 Å²	99.1	81%	0.806	53%	0.525	S	S	*	.			trans	-69.2	110.6	-179.8	-175	0	0	0	0	106.3	E98 D102	E98-V100 PolarHBondContact O-N 2.77Å; V100-D102 PolarHBondContact O-N 2.92Å
101	A	57.4	Low	63.2	Low	29 Å²	29	100 Å²	100	24%	0.24	53%	0.525	C	S	.	.			trans	-62.7	133.8	168.3	0	0	0	0	0	108.6	P99 H107	P99-A101 PolarHBondContact O-N 3.02Å; A101-H107 HydrophobicContact CB-CB 4.21Å
102	D	56.1	Low	64.4	Low	116 Å²	116	90.6 Å²	90.6	62%	0.62	49%	0.491	S	S	*	.			trans	-61.3	154	174.1	-85	-24.4	0	0	0	110.3	V100 G104 E105	V100-D102 PolarHBondContact O-N 2.92Å; D102-G104 PolarHBondContact O-N 2.82Å; D102-E105 HydrophobicContact CB-CG 4.41Å; D102-E105 PolarHBondContact O-N 3.1Å
103	E	49.7	Very low	65.8	Low	211 Å²	211	91.1 Å²	91.1	99%	0.986	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	101.3	-176.5	-72.5	-171.3	167.6	0	0	111.2
104	G	55.8	Low	67.4	Low	83 Å²	83	88.3 Å²	88.3	86%	0.856	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.6	-15.9	179.9	0	0	0	0	0	114.3	D102	D102-G104 PolarHBondContact O-N 2.82Å
105	E	61.6	Low	69.2	Low	130 Å²	130	80.3 Å²	80.3	61%	0.607	43%	0.43	S	S	*	.	S	Bend	trans	-86.7	143.5	178.2	-62.8	-170.4	164.4	0	0	111.7	D102 H107	D102-E105 HydrophobicContact CB-CG 4.41Å; D102-E105 PolarHBondContact O-N 3.1Å; E105-H107 PolarHBondContact O-N 3.05Å
106	E	68.3	Low	71	Confident	132 Å²	132	77.2 Å²	77.2	62%	0.617	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-69.5	130.9	173	-69.5	-170.9	174.5	0	0	109	K327	E106-K327 IonicContact OE1-NZ 2.64Å; E106-K327 PolarHBondContact OE1-NZ 3.16Å
107	H	76.3	Confident	72.9	Confident	67 Å²	67	80.1 Å²	80.1	31%	0.31	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-59.2	132.3	178.7	-172.8	-68.3	0	0	0	110.1	P99 A101 E105 L109	P99-H107 PolarHBondContact O-CD2 3.06Å; P99-H107 PolarHBondContact O-NE2 2.84Å; A101-H107 HydrophobicContact CB-CB 4.21Å; E105-H107 PolarHBondContact O-N 3.05Å; H107-L109 VanDerWaalsContact ND1-CB 3.34Å; H107-L109 WeakPolarHBondContact ND1-CB 3.42Å; H107-L109 PolarHBondContact ND1-N 2.86Å; H107-L109 CarbonylContact O-C 3.57Å; H107-L109 PolarHBondContact O-N 2.79Å
108	P	79.3	Confident	74.6	Confident	14 Å²	14	74.3 Å²	74.3	9%	0.091	40%	0.396	C	S	.	.	S	Bend	trans	-60.7	-27.5	-172.7	23	-35.4	0	0	0	112.5	P99 P110 V142 V147 Q148 A150	P99-P108 HydrophobicContact CB-CG 4.25Å; P99-P108 HydrophobicContact CG-CG 3.65Å; P108-P110 WeakPolarHBondContact O-CD 3.5Å; P108-V142 HydrophobicContact CB-CG1 3.73Å; P108-V142 HydrophobicContact CG-CG1 3.72Å; P108-V147 WeakPolarHBondContact CB-O 3.42Å; P108-Q148 WeakPolarHBondContact CB-O 3.46Å; P108-A150 PolarHBondContact O-N 3.39Å
109	L	80.4	Confident	76.3	Confident	28 Å²	28	70.2 Å²	70.2	15%	0.147	38%	0.377	C	S	.	.	S	Bend	trans	-72.3	118.6	169	-68.4	167.2	0	0	0	113.2	H107 I138 K139 V142	H107-L109 VanDerWaalsContact ND1-CB 3.34Å; H107-L109 WeakPolarHBondContact ND1-CB 3.42Å; H107-L109 PolarHBondContact ND1-N 2.86Å; H107-L109 CarbonylContact O-C 3.57Å; H107-L109 PolarHBondContact O-N 2.79Å; L109-I138 HydrophobicContact CD2-CG2 3.96Å; L109-K139 HydrophobicContact CD1-CB 4.14Å; L109-K139 HydrophobicContact CD1-CD 4.25Å; L109-K139 HydrophobicContact CD1-CG 3.82Å; L109-K139 HydrophobicContact CD2-CB 4.08Å; L109-V142 HydrophobicContact CD2-CB 3.73Å; L109-V142 HydrophobicContact CD2-CG1 4.26Å; L109-V142 HydrophobicContact CD2-CG2 3.52Å; L109-V142 HydrophobicContact CG-CB 4.11Å; L109-V142 HydrophobicContact CG-CG1 4.1Å; L109-V142 HydrophobicContact CG-CG2 4.18Å
110	P	82.7	Confident	77.9	Confident	22 Å²	22	72.7 Å²	72.7	14%	0.143	38%	0.384	C	S	.	.			trans	-71.7	152.5	175.7	30.9	-33.7	0	0	0	110.6	P108 V112 I138 A150	P108-P110 WeakPolarHBondContact O-CD 3.5Å; P110-V112 HydrophobicContact CG-CG2 3.88Å; P110-V112 PolarHBondContact O-N 2.84Å; P110-I138 HydrophobicContact CG-CG2 4.24Å; P110-A150 WeakPolarHBondContact CB-O 3.5Å; P110-A150 WeakPolarHBondContact CD-O 3.28Å; P110-A150 WeakPolarHBondContact CG-O 3.18Å
111	N	86.2	Confident	79.5	Confident	82 Å²	82	69.3 Å²	69.3	44%	0.439	36%	0.362	S	S	.	.			trans	-77.8	69.5	173	-164.5	-9.5	0	0	0	111.6	M113 E114 N115	N111-M113 PolarHBondContact O-N 2.91Å; N111-M113 VanDerWaalsContact O-N 3.16Å; N111-E114 HydrophobicContact CB-CB 4.14Å; N111-E114 VanDerWaalsContact ND2-CB 3.32Å; N111-E114 WeakPolarHBondContact ND2-CB 3.45Å; N111-E114 PolarHBondContact ND2-OE2 2.61Å; N111-E114 PolarHBondContact O-N 2.92Å; N111-E114 VanDerWaalsContact O-N 3.16Å; N111-E114 PolarHBondContact OD1-N 2.97Å; N111-N115 PolarHBondContact O-N 3.01Å
112	V	88.2	Confident	81	Confident	10 Å²	10	68.2 Å²	68.2	6%	0.061	35%	0.353	C	S	.	.	H	α-helix	trans	-54	-38.2	-176.9	-177.3	0	0	0	0	111.9	P110 A116 T131 L134 N135 I138	P110-V112 HydrophobicContact CG-CG2 3.88Å; P110-V112 PolarHBondContact O-N 2.84Å; V112-A116 WeakPolarHBondContact O-CB 3.49Å; V112-A116 PolarHBondContact O-N 3.19Å; V112-T131 HydrophobicContact CG1-CG2 4.09Å; V112-L134 HydrophobicContact CG1-CD2 3.7Å; V112-N135 HydrophobicContact CB-CB 4.18Å; V112-N135 WeakPolarHBondContact CB-OD1 3.39Å; V112-N135 HydrophobicContact CG1-CB 4.37Å; V112-I138 HydrophobicContact CG2-CD1 3.96Å
113	M	90.4	Very high	82.7	Confident	86 Å²	86	66 Å²	66	42%	0.424	36%	0.357	S	S	.	.	H	α-helix	trans	-69.5	-40.3	-177.5	-66	-60.3	-62.7	0	0	112.4	N111 Y117 T131 V132 N135	N111-M113 PolarHBondContact O-N 2.91Å; N111-M113 VanDerWaalsContact O-N 3.16Å; M113-Y117 PolarHBondContact O-N 2.83Å; M113-Y117 VanDerWaalsContact O-N 3.15Å; M113-T131 HydrophobicContact SD-CG2 3.72Å; M113-V132 HydrophobicContact CE-CG2 3.91Å; M113-V132 HydrophobicContact SD-CG2 4.11Å; M113-N135 HydrophobicContact SD-CB 4.44Å
114	E	91	Very high	84.6	Confident	51 Å²	51	56.7 Å²	56.7	24%	0.238	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-47.5	174	-176.2	-177	168.2	0	0	110.6	N111 A116 Y117 Y118 R451	N111-E114 HydrophobicContact CB-CB 4.14Å; N111-E114 VanDerWaalsContact ND2-CB 3.32Å; N111-E114 WeakPolarHBondContact ND2-CB 3.45Å; N111-E114 PolarHBondContact ND2-OE2 2.61Å; N111-E114 PolarHBondContact O-N 2.92Å; N111-E114 VanDerWaalsContact O-N 3.16Å; N111-E114 PolarHBondContact OD1-N 2.97Å; E114-A116 VanDerWaalsContact C-N 3.3Å; E114-A116 PolarHBondContact O-N 3.45Å; E114-Y117 WeakPolarHBondContact O-CB 3.2Å; E114-Y117 PolarHBondContact O-N 2.88Å; E114-Y117 VanDerWaalsContact O-N 3.11Å; E114-Y118 HydrophobicContact CG-CD2 4.07Å; E114-Y118 HydrophobicContact CG-CE2 3.72Å; E114-Y118 VanDerWaalsContact O-CD2 3.23Å; E114-Y118 WeakPolarHBondContact O-CD2 3.07Å; E114-Y118 PolarHBondContact O-N 3.44Å; E114-R451 IonicContact OE1-NH1 2.99Å; E114-R451 PolarHBondContact OE1-NH1 3.09Å; E114-R451 IonicContact OE2-NH1 2.92Å; E114-R451 PolarHBondContact OE2-NH1 2.81Å
115	N	92.5	Very high	86	Confident	18 Å²	18	54.3 Å²	54.3	10%	0.096	29%	0.289	C	S	.	.	H	α-helix	trans	-57.7	-45.4	178.4	-68.3	-2.5	0	0	0	110.9	N111 Y117 Y118 F119 E453	N111-N115 PolarHBondContact O-N 3.01Å; N115-Y117 VanDerWaalsContact C-N 3.33Å; N115-Y117 PolarHBondContact O-N 2.71Å; N115-Y118 PolarHBondContact O-N 3.18Å; N115-F119 HydrophobicContact CB-CD2 4.47Å; N115-F119 HydrophobicContact CB-CE2 3.98Å; N115-F119 HydrophobicContact CB-CZ 4.39Å; N115-F119 VanDerWaalsContact O-CD2 3.24Å; N115-F119 WeakPolarHBondContact O-CD2 3.4Å; N115-F119 WeakPolarHBondContact O-CG 3.48Å; N115-F119 PolarHBondContact O-N 2.87Å; N115-E453 WeakPolarHBondContact ND2-CG 3.46Å; N115-E453 PolarHBondContact ND2-OE1 3.04Å
116	A	92.3	Very high	87.4	Confident	19 Å²	19	49.6 Å²	49.6	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-63.1	-35	177.6	0	0	0	0	0	113.6	V112 E114 F119 E120 T131	V112-A116 WeakPolarHBondContact O-CB 3.49Å; V112-A116 PolarHBondContact O-N 3.19Å; E114-A116 VanDerWaalsContact C-N 3.3Å; E114-A116 PolarHBondContact O-N 3.45Å; A116-F119 PolarHBondContact O-N 3.03Å; A116-E120 WeakPolarHBondContact O-CB 3.33Å; A116-E120 PolarHBondContact O-N 2.85Å; A116-T131 HydrophobicContact CB-CG2 3.3Å
117	Y	92.8	Very high	88.4	Confident	129 Å²	129	45.2 Å²	45.2	51%	0.506	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-44.9	174.3	170.1	-99.7	0	0	0	111.5	M113 E114 N115 E120 N121	M113-Y117 PolarHBondContact O-N 2.83Å; M113-Y117 VanDerWaalsContact O-N 3.15Å; E114-Y117 WeakPolarHBondContact O-CB 3.2Å; E114-Y117 PolarHBondContact O-N 2.88Å; E114-Y117 VanDerWaalsContact O-N 3.11Å; N115-Y117 VanDerWaalsContact C-N 3.33Å; N115-Y117 PolarHBondContact O-N 2.71Å; Y117-E120 PolarHBondContact O-N 3.31Å; Y117-N121 WeakPolarHBondContact CE1-ND2 3.12Å; Y117-N121 VanDerWaalsContact CZ-ND2 3.31Å; Y117-N121 VanDerWaalsContact O-CG 3.3Å; Y117-N121 PolarHBondContact O-N 2.83Å; Y117-N121 VanDerWaalsContact O-N 3.08Å; Y117-N121 PolarHBondContact O-ND2 3.32Å
118	Y	92.5	Very high	89	Confident	56 Å²	56	48.4 Å²	48.4	22%	0.22	27%	0.271	C	S	.	.	H	α-helix	trans	-73.5	-34.1	178.3	-70	-72.5	0	0	0	112.9	E114 N115 N121 A122 W448	E114-Y118 HydrophobicContact CG-CD2 4.07Å; E114-Y118 HydrophobicContact CG-CE2 3.72Å; E114-Y118 VanDerWaalsContact O-CD2 3.23Å; E114-Y118 WeakPolarHBondContact O-CD2 3.07Å; E114-Y118 PolarHBondContact O-N 3.44Å; N115-Y118 PolarHBondContact O-N 3.18Å; Y118-N121 PolarHBondContact O-N 3.03Å; Y118-A122 WeakPolarHBondContact O-CB 3.18Å; Y118-A122 PolarHBondContact O-N 3.05Å; Y118-W448 HydrophobicContact CD1-CB 3.72Å; Y118-W448 AromaticContact CD1-CD1 3.95Å; Y118-W448 AromaticContact CD1-CD2 3.95Å; Y118-W448 HydrophobicContact CD1-CD2 3.95Å; Y118-W448 HydrophobicContact CD1-CE3 4.5Å; Y118-W448 AromaticContact CD1-CG 3.59Å; Y118-W448 HydrophobicContact CD1-CG 3.59Å; Y118-W448 AromaticContact CD2-CD1 3.63Å; Y118-W448 AromaticContact CD2-CD2 3.57Å; Y118-W448 HydrophobicContact CD2-CD2 3.57Å; Y118-W448 AromaticContact CD2-CE2 3.26Å; Y118-W448 HydrophobicContact CD2-CE3 4.26Å; Y118-W448 AromaticContact CD2-CG 3.79Å; Y118-W448 HydrophobicContact CD2-CG 3.79Å; Y118-W448 HydrophobicContact CD2-CH2 4.37Å; Y118-W448 AromaticContact CD2-CZ2 3.72Å; Y118-W448 HydrophobicContact CD2-CZ2 3.72Å; Y118-W448 AromaticContact CD2-NE1 3.32Å; Y118-W448 VanDerWaalsContact CD2-NE1 3.32Å; Y118-W448 HydrophobicContact CE1-CB 3.74Å; Y118-W448 AromaticContact CE1-CD1 3.58Å; Y118-W448 HydrophobicContact CE1-CD2 4.37Å; Y118-W448 AromaticContact CE1-CG 3.62Å; Y118-W448 HydrophobicContact CE1-CG 3.62Å; Y118-W448 AromaticContact CE2-CD1 3.25Å; Y118-W448 HydrophobicContact CE2-CD2 4.04Å; Y118-W448 AromaticContact CE2-CE2 3.61Å; Y118-W448 AromaticContact CE2-CG 3.84Å; Y118-W448 HydrophobicContact CE2-CG 3.84Å; Y118-W448 HydrophobicContact CE2-CZ2 4.32Å; Y118-W448 AromaticContact CE2-NE1 3.08Å; Y118-W448 HydrophobicContact CG-CB 4.24Å; Y118-W448 AromaticContact CG-CD1 3.96Å; Y118-W448 AromaticContact CG-CD2 3.51Å; Y118-W448 HydrophobicContact CG-CD2 3.51Å; Y118-W448 AromaticContact CG-CE2 3.76Å; Y118-W448 AromaticContact CG-CE3 3.93Å; Y118-W448 HydrophobicContact CG-CE3 3.93Å; Y118-W448 AromaticContact CG-CG 3.66Å; Y118-W448 HydrophobicContact CG-CG 3.66Å; Y118-W448 HydrophobicContact CG-CZ2 4.32Å; Y118-W448 HydrophobicContact CG-CZ3 4.47Å; Y118-W448 AromaticContact CZ-CD1 3.2Å; Y118-W448 AromaticContact CZ-CG 3.74Å; Y118-W448 AromaticContact CZ-NE1 3.6Å
119	F	93.8	Very high	89.5	Confident	13 Å²	13	54.2 Å²	54.2	6%	0.057	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-47.4	170.1	-62.6	-32	0	0	0	111.1	N115 A116 N121 A122 G123 I124 V446 E453 I455	N115-F119 HydrophobicContact CB-CD2 4.47Å; N115-F119 HydrophobicContact CB-CE2 3.98Å; N115-F119 HydrophobicContact CB-CZ 4.39Å; N115-F119 VanDerWaalsContact O-CD2 3.24Å; N115-F119 WeakPolarHBondContact O-CD2 3.4Å; N115-F119 WeakPolarHBondContact O-CG 3.48Å; N115-F119 PolarHBondContact O-N 2.87Å; A116-F119 PolarHBondContact O-N 3.03Å; F119-N121 VanDerWaalsContact C-N 3.31Å; F119-N121 PolarHBondContact O-N 3.29Å; F119-A122 CarbonylContact O-C 3.59Å; F119-A122 WeakPolarHBondContact O-CA 3.41Å; F119-A122 VanDerWaalsContact O-CB 3.3Å; F119-A122 WeakPolarHBondContact O-CB 3.13Å; F119-A122 PolarHBondContact O-N 3.02Å; F119-G123 PolarHBondContact O-N 3.45Å; F119-G123 VanDerWaalsContact O-N 3.09Å; F119-I124 CarbonylContact C-O 3.48Å; F119-I124 VanDerWaalsContact CB-O 3.28Å; F119-I124 WeakPolarHBondContact CB-O 3.42Å; F119-I124 CarbonylContact O-C 3.47Å; F119-I124 PolarHBondContact O-N 2.66Å; F119-V446 HydrophobicContact CD1-CB 4.1Å; F119-V446 HydrophobicContact CD1-CG2 3.83Å; F119-V446 HydrophobicContact CE1-CB 4.13Å; F119-V446 HydrophobicContact CE1-CG2 4.1Å; F119-E453 HydrophobicContact CE1-CB 3.88Å; F119-E453 HydrophobicContact CZ-CB 3.66Å; F119-I455 HydrophobicContact CD1-CG2 4.07Å; F119-I455 HydrophobicContact CD2-CD1 3.85Å; F119-I455 HydrophobicContact CE1-CB 4.23Å; F119-I455 HydrophobicContact CE1-CG2 3.77Å; F119-I455 HydrophobicContact CE2-CB 4.05Å; F119-I455 HydrophobicContact CE2-CD1 3.74Å; F119-I455 HydrophobicContact CE2-CG1 4.4Å; F119-I455 HydrophobicContact CE2-CG2 4.24Å; F119-I455 HydrophobicContact CG-CG2 4.43Å; F119-I455 HydrophobicContact CZ-CB 3.78Å; F119-I455 HydrophobicContact CZ-CD1 4.37Å; F119-I455 HydrophobicContact CZ-CG2 3.85Å
120	E	92.6	Very high	90	Very high	97 Å²	97	55.9 Å²	55.9	45%	0.453	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-43.6	177.7	-174.4	-178.5	177	0	0	111.1	A116 Y117 A122 G123 I124 K128	A116-E120 WeakPolarHBondContact O-CB 3.33Å; A116-E120 PolarHBondContact O-N 2.85Å; Y117-E120 PolarHBondContact O-N 3.31Å; E120-A122 VanDerWaalsContact C-N 3.27Å; E120-A122 PolarHBondContact O-N 3.02Å; E120-G123 WeakPolarHBondContact O-CA 3.36Å; E120-G123 PolarHBondContact O-N 3.02Å; E120-I124 PolarHBondContact N-O 3.16Å; E120-K128 WeakPolarHBondContact OE1-CE 3.42Å; E120-K128 IonicContact OE1-NZ 2.9Å; E120-K128 PolarHBondContact OE1-NZ 3.41Å; E120-K128 WeakPolarHBondContact OE2-CE 3.43Å; E120-K128 IonicContact OE2-NZ 3.72Å; E120-K128 PolarHBondContact OE2-NZ 2.94Å
121	N	90	Very high	90.4	Very high	63 Å²	63	55.1 Å²	55.1	34%	0.337	30%	0.304	S	S	.	.	H	α-helix	trans	-61.4	-35	174.4	-71.6	-21	0	0	0	112.6	Y117 Y118 F119 G123 S423	Y117-N121 WeakPolarHBondContact CE1-ND2 3.12Å; Y117-N121 VanDerWaalsContact CZ-ND2 3.31Å; Y117-N121 VanDerWaalsContact O-CG 3.3Å; Y117-N121 PolarHBondContact O-N 2.83Å; Y117-N121 VanDerWaalsContact O-N 3.08Å; Y117-N121 PolarHBondContact O-ND2 3.32Å; Y118-N121 PolarHBondContact O-N 3.03Å; F119-N121 VanDerWaalsContact C-N 3.31Å; F119-N121 PolarHBondContact O-N 3.29Å; N121-G123 PolarHBondContact O-N 3.11Å; N121-S423 WeakPolarHBondContact O-CB 3.36Å
122	A	89.5	Confident	90.7	Very high	6 Å²	6	53.6 Å²	53.6	5%	0.05	30%	0.297	C	S	.	.	H	α-helix	trans	-74	-7.1	174.4	0	0	0	0	0	113.7	Y118 F119 E120 I124 R421 V434 V446	Y118-A122 WeakPolarHBondContact O-CB 3.18Å; Y118-A122 PolarHBondContact O-N 3.05Å; F119-A122 CarbonylContact O-C 3.59Å; F119-A122 WeakPolarHBondContact O-CA 3.41Å; F119-A122 VanDerWaalsContact O-CB 3.3Å; F119-A122 WeakPolarHBondContact O-CB 3.13Å; F119-A122 PolarHBondContact O-N 3.02Å; E120-A122 VanDerWaalsContact C-N 3.27Å; E120-A122 PolarHBondContact O-N 3.02Å; A122-I124 VanDerWaalsContact C-N 3.33Å; A122-I124 HydrophobicContact CB-CD1 4.2Å; A122-R421 PolarHBondContact O-NH2 3.11Å; A122-V434 HydrophobicContact CB-CG2 3.34Å; A122-V446 HydrophobicContact CB-CG1 4.05Å; A122-V446 HydrophobicContact CB-CG2 3.94Å
123	G	90.7	Very high	90.9	Very high	68 Å²	68	53.8 Å²	53.8	70%	0.701	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	24.3	-174.1	0	0	0	0	0	113.2	F119 E120 N121	F119-G123 PolarHBondContact O-N 3.45Å; F119-G123 VanDerWaalsContact O-N 3.09Å; E120-G123 WeakPolarHBondContact O-CA 3.36Å; E120-G123 PolarHBondContact O-N 3.02Å; N121-G123 PolarHBondContact O-N 3.11Å
124	I	90.2	Very high	90.9	Very high	16 Å²	16	49.7 Å²	49.7	8%	0.082	28%	0.278	C	S	.	.			trans	-126.1	153.6	-176.5	-66.2	157.1	0	0	0	108.3	F119 E120 A122 R421 V434 H444 V446 I455	F119-I124 CarbonylContact C-O 3.48Å; F119-I124 VanDerWaalsContact CB-O 3.28Å; F119-I124 WeakPolarHBondContact CB-O 3.42Å; F119-I124 CarbonylContact O-C 3.47Å; F119-I124 PolarHBondContact O-N 2.66Å; E120-I124 PolarHBondContact N-O 3.16Å; A122-I124 VanDerWaalsContact C-N 3.33Å; A122-I124 HydrophobicContact CB-CD1 4.2Å; I124-R421 VanDerWaalsContact CD1-NH2 3.31Å; I124-V434 HydrophobicContact CD1-CG1 3.4Å; I124-H444 HydrophobicContact CD1-CB 3.63Å; I124-H444 VanDerWaalsContact CD1-CG 3.41Å; I124-H444 HydrophobicContact CG2-CB 4.34Å; I124-H444 VanDerWaalsContact CG2-CD2 3.5Å; I124-H444 WeakPolarHBondContact CG2-CD2 3.42Å; I124-V446 HydrophobicContact CD1-CG2 4.41Å; I124-I455 HydrophobicContact CG2-CG2 3.88Å
125	G	85.2	Confident	91	Very high	33 Å²	33	49.8 Å²	49.8	34%	0.34	28%	0.28	S	S	.	.	S	Bend	trans	121.9	-164.3	169	0	0	0	0	0	113.7
126	I	89.6	Confident	90.9	Very high	32 Å²	32	51.6 Å²	51.6	16%	0.164	29%	0.288	C	S	.	.			trans	-110.7	164.6	-174.1	62.1	175.5	0	0	0	110.6	E130 L134 F152 K155	I126-E130 HydrophobicContact CB-CB 4.27Å; I126-E130 HydrophobicContact CD1-CB 4.12Å; I126-E130 HydrophobicContact CG1-CB 4.34Å; I126-L134 HydrophobicContact CD1-CB 4.38Å; I126-L134 HydrophobicContact CD1-CD1 4.17Å; I126-L134 HydrophobicContact CD1-CD2 4.48Å; I126-F152 HydrophobicContact CD1-CE1 4.3Å; I126-F152 HydrophobicContact CD1-CZ 4.41Å; I126-K155 HydrophobicContact CG2-CD 4.09Å
127	G	89.3	Confident	90.8	Very high	40 Å²	40	50.8 Å²	50.8	41%	0.412	28%	0.281	S	S	.	.			trans	-61.3	153.4	-178.5	0	0	0	0	0	112.5	N129 E130 T131	G127-N129 VanDerWaalsContact C-N 3.29Å; G127-N129 PolarHBondContact O-N 2.78Å; G127-E130 CarbonylContact O-C 3.57Å; G127-E130 WeakPolarHBondContact O-CA 3.48Å; G127-E130 WeakPolarHBondContact O-CB 3.42Å; G127-E130 PolarHBondContact O-N 3.47Å; G127-T131 PolarHBondContact O-N 3.37Å; G127-T131 PolarHBondContact O-OG1 3.29Å
128	K	90.1	Very high	90.7	Very high	134 Å²	134	44.7 Å²	44.7	58%	0.583	26%	0.258	S	S	*	.	H	α-helix	trans	-55.4	-43.5	178.5	-67.9	-177.7	178	172.7	0	112.9	E120 T131 V132	E120-K128 WeakPolarHBondContact OE1-CE 3.42Å; E120-K128 IonicContact OE1-NZ 2.9Å; E120-K128 PolarHBondContact OE1-NZ 3.41Å; E120-K128 WeakPolarHBondContact OE2-CE 3.43Å; E120-K128 IonicContact OE2-NZ 3.72Å; E120-K128 PolarHBondContact OE2-NZ 2.94Å; K128-T131 WeakPolarHBondContact O-CB 3.33Å; K128-T131 PolarHBondContact O-N 3.2Å; K128-V132 WeakPolarHBondContact O-CG2 3.4Å; K128-V132 PolarHBondContact O-N 3.46Å; K128-V132 VanDerWaalsContact O-N 3.11Å
129	N	88.8	Confident	90.5	Very high	135 Å²	135	44.6 Å²	44.6	72%	0.722	26%	0.258	S	S	*	.	H	α-helix	trans	-64.6	-42.3	176.5	-65.1	-9.6	0	0	0	111.2	G127 T131 V132 L133	G127-N129 VanDerWaalsContact C-N 3.29Å; G127-N129 PolarHBondContact O-N 2.78Å; N129-T131 VanDerWaalsContact C-N 3.32Å; N129-T131 PolarHBondContact O-N 3.34Å; N129-V132 PolarHBondContact O-N 2.74Å; N129-L133 VanDerWaalsContact O-CG 3.3Å; N129-L133 WeakPolarHBondContact O-CG 3.46Å; N129-L133 PolarHBondContact O-N 3.46Å
130	E	90.9	Very high	90.2	Very high	64 Å²	64	45.8 Å²	45.8	30%	0.299	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176.1	-63	-171.6	172.7	0	0	111	I126 G127 L133 L134 K155 Y164	I126-E130 HydrophobicContact CB-CB 4.27Å; I126-E130 HydrophobicContact CD1-CB 4.12Å; I126-E130 HydrophobicContact CG1-CB 4.34Å; G127-E130 CarbonylContact O-C 3.57Å; G127-E130 WeakPolarHBondContact O-CA 3.48Å; G127-E130 WeakPolarHBondContact O-CB 3.42Å; G127-E130 PolarHBondContact O-N 3.47Å; E130-L133 PolarHBondContact O-N 3.19Å; E130-L134 WeakPolarHBondContact O-CB 3.3Å; E130-L134 PolarHBondContact O-N 2.88Å; E130-K155 IonicContact OE1-NZ 3.6Å; E130-K155 PolarHBondContact OE1-NZ 3.27Å; E130-K155 IonicContact OE2-NZ 3.7Å; E130-K155 PolarHBondContact OE2-NZ 3.47Å; E130-Y164 PolarHBondContact OE2-OH 2.82Å
131	T	92.6	Very high	90.1	Very high	6 Å²	6	41.4 Å²	41.4	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-47.2	179.2	-54.6	0	0	0	0	111.8	V112 M113 A116 G127 K128 N129 L133 L134 N135	V112-T131 HydrophobicContact CG1-CG2 4.09Å; M113-T131 HydrophobicContact SD-CG2 3.72Å; A116-T131 HydrophobicContact CB-CG2 3.3Å; G127-T131 PolarHBondContact O-N 3.37Å; G127-T131 PolarHBondContact O-OG1 3.29Å; K128-T131 WeakPolarHBondContact O-CB 3.33Å; K128-T131 PolarHBondContact O-N 3.2Å; N129-T131 VanDerWaalsContact C-N 3.32Å; N129-T131 PolarHBondContact O-N 3.34Å; T131-L133 VanDerWaalsContact C-N 3.33Å; T131-L133 PolarHBondContact O-N 3.42Å; T131-L134 PolarHBondContact O-N 2.87Å; T131-N135 WeakPolarHBondContact O-CB 3.35Å; T131-N135 PolarHBondContact O-N 3.27Å
132	V	91.5	Very high	90	Very high	50 Å²	50	38.7 Å²	38.7	30%	0.303	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-43.9	180	171.8	0	0	0	0	110.8	M113 K128 N129 N135 M136	M113-V132 HydrophobicContact CE-CG2 3.91Å; M113-V132 HydrophobicContact SD-CG2 4.11Å; K128-V132 WeakPolarHBondContact O-CG2 3.4Å; K128-V132 PolarHBondContact O-N 3.46Å; K128-V132 VanDerWaalsContact O-N 3.11Å; N129-V132 PolarHBondContact O-N 2.74Å; V132-N135 PolarHBondContact O-N 2.78Å; V132-M136 HydrophobicContact CG1-CE 3.48Å; V132-M136 VanDerWaalsContact CG1-CE 3.48Å; V132-M136 WeakPolarHBondContact O-CG 3.42Å; V132-M136 PolarHBondContact O-N 2.86Å
133	L	92.1	Very high	89.8	Confident	14 Å²	14	40.6 Å²	40.6	7%	0.073	24%	0.243	C	C	.	.	H	α-helix	trans	-65	-42.5	176.9	-65.7	168.4	0	0	0	111.4	Q85 L88 F89 N129 E130 T131 N135 M136 T137 P236	Q85-L133 HydrophobicContact CB-CD2 4.11Å; Q85-L133 VanDerWaalsContact CD-CD1 3.5Å; Q85-L133 HydrophobicContact CG-CD1 4.15Å; Q85-L133 HydrophobicContact CG-CD2 4.09Å; L88-L133 HydrophobicContact CD1-CD2 4.03Å; F89-L133 HydrophobicContact CE2-CD2 3.63Å; F89-L133 HydrophobicContact CZ-CD2 3.61Å; N129-L133 VanDerWaalsContact O-CG 3.3Å; N129-L133 WeakPolarHBondContact O-CG 3.46Å; N129-L133 PolarHBondContact O-N 3.46Å; E130-L133 PolarHBondContact O-N 3.19Å; T131-L133 VanDerWaalsContact C-N 3.33Å; T131-L133 PolarHBondContact O-N 3.42Å; L133-N135 VanDerWaalsContact C-N 3.33Å; L133-N135 PolarHBondContact O-N 2.62Å; L133-M136 PolarHBondContact O-N 2.87Å; L133-T137 WeakPolarHBondContact O-CG2 3.44Å; L133-T137 PolarHBondContact O-N 2.88Å; L133-T137 PolarHBondContact O-OG1 2.96Å; L133-P236 HydrophobicContact CB-CB 3.59Å; L133-P236 HydrophobicContact CB-CG 4.34Å
134	L	91.9	Very high	89.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-40.9	178.7	-169.7	120.2	0	0	0	111.7	V112 I126 E130 T131 M136 T137 I138 F152 Y164	V112-L134 HydrophobicContact CG1-CD2 3.7Å; I126-L134 HydrophobicContact CD1-CB 4.38Å; I126-L134 HydrophobicContact CD1-CD1 4.17Å; I126-L134 HydrophobicContact CD1-CD2 4.48Å; E130-L134 WeakPolarHBondContact O-CB 3.3Å; E130-L134 PolarHBondContact O-N 2.88Å; T131-L134 PolarHBondContact O-N 2.87Å; L134-M136 VanDerWaalsContact C-N 3.33Å; L134-M136 PolarHBondContact O-N 3.06Å; L134-T137 WeakPolarHBondContact CA-OG1 3.45Å; L134-T137 PolarHBondContact O-N 2.85Å; L134-T137 PolarHBondContact O-OG1 3.16Å; L134-I138 HydrophobicContact CD2-CD1 3.44Å; L134-I138 VanDerWaalsContact CD2-CD1 3.44Å; L134-I138 HydrophobicContact CD2-CG1 4.43Å; L134-I138 HydrophobicContact CG-CD1 3.93Å; L134-I138 HydrophobicContact CG-CG1 4.44Å; L134-I138 WeakPolarHBondContact O-CB 3.3Å; L134-I138 VanDerWaalsContact O-CG1 3.26Å; L134-I138 WeakPolarHBondContact O-CG1 3.37Å; L134-I138 PolarHBondContact O-N 2.92Å; L134-F152 HydrophobicContact CD1-CD2 3.77Å; L134-F152 HydrophobicContact CD1-CE2 3.4Å; L134-F152 VanDerWaalsContact CD1-CE2 3.4Å; L134-F152 HydrophobicContact CD1-CG 4.48Å; L134-F152 HydrophobicContact CD1-CZ 3.82Å; L134-F152 HydrophobicContact CD2-CB 4.06Å; L134-F152 HydrophobicContact CD2-CD1 4.01Å; L134-F152 HydrophobicContact CD2-CD2 3.67Å; L134-F152 HydrophobicContact CD2-CE1 4.37Å; L134-F152 HydrophobicContact CD2-CE2 4.08Å; L134-F152 HydrophobicContact CD2-CG 3.63Å; L134-F152 HydrophobicContact CD2-CZ 4.4Å; L134-F152 HydrophobicContact CG-CD2 4.24Å; L134-F152 HydrophobicContact CG-CE2 4.34Å; L134-Y164 HydrophobicContact CD1-CD1 3.58Å; L134-Y164 HydrophobicContact CD1-CE1 4.3Å; L134-Y164 HydrophobicContact CD1-CG 4.23Å
135	N	91.7	Very high	89.3	Confident	52 Å²	52	43.5 Å²	43.5	28%	0.278	25%	0.245	S	C	.	.	H	α-helix	trans	-59.3	-43.6	174.2	-172.1	67.3	0	0	0	111.7	V112 M113 T131 V132 L133 K139	V112-N135 HydrophobicContact CB-CB 4.18Å; V112-N135 WeakPolarHBondContact CB-OD1 3.39Å; V112-N135 HydrophobicContact CG1-CB 4.37Å; M113-N135 HydrophobicContact SD-CB 4.44Å; T131-N135 WeakPolarHBondContact O-CB 3.35Å; T131-N135 PolarHBondContact O-N 3.27Å; V132-N135 PolarHBondContact O-N 2.78Å; L133-N135 VanDerWaalsContact C-N 3.33Å; L133-N135 PolarHBondContact O-N 2.62Å; N135-K139 WeakPolarHBondContact O-CB 3.32Å; N135-K139 PolarHBondContact O-N 2.65Å
136	M	90	Very high	89.1	Confident	56 Å²	56	45.1 Å²	45.1	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-66.4	-38.5	176.7	-66.2	170.9	-168	0	0	112.3	L88 F89 V132 L133 L134 K139 S140	L88-M136 HydrophobicContact CB-CB 4.28Å; L88-M136 HydrophobicContact CB-SD 4.13Å; F89-M136 HydrophobicContact CD1-CE 3.87Å; F89-M136 HydrophobicContact CD1-SD 4Å; F89-M136 HydrophobicContact CE1-CE 3.57Å; F89-M136 HydrophobicContact CE1-SD 3.84Å; F89-M136 HydrophobicContact CZ-CE 4.37Å; F89-M136 HydrophobicContact CZ-SD 4.21Å; V132-M136 HydrophobicContact CG1-CE 3.48Å; V132-M136 VanDerWaalsContact CG1-CE 3.48Å; V132-M136 WeakPolarHBondContact O-CG 3.42Å; V132-M136 PolarHBondContact O-N 2.86Å; L133-M136 PolarHBondContact O-N 2.87Å; L134-M136 VanDerWaalsContact C-N 3.33Å; L134-M136 PolarHBondContact O-N 3.06Å; M136-K139 WeakPolarHBondContact O-CB 3.49Å; M136-K139 PolarHBondContact O-N 3.25Å; M136-S140 PolarHBondContact O-N 3.21Å
137	T	90.2	Very high	89	Confident	3 Å²	3	44 Å²	44	2%	0.018	25%	0.25	C	C	.	.	H	α-helix	trans	-74.8	-33.4	-179	56.2	0	0	0	0	112.6	L88 L133 L134 S140 L141 P236 W240	L88-T137 HydrophobicContact CD1-CG2 3.6Å; L88-T137 HydrophobicContact CD2-CG2 3.77Å; L88-T137 HydrophobicContact CG-CG2 4.33Å; L133-T137 WeakPolarHBondContact O-CG2 3.44Å; L133-T137 PolarHBondContact O-N 2.88Å; L133-T137 PolarHBondContact O-OG1 2.96Å; L134-T137 WeakPolarHBondContact CA-OG1 3.45Å; L134-T137 PolarHBondContact O-N 2.85Å; L134-T137 PolarHBondContact O-OG1 3.16Å; T137-S140 PolarHBondContact O-N 3.46Å; T137-L141 PolarHBondContact O-N 3.33Å; T137-P236 HydrophobicContact CG2-CB 4Å; T137-W240 PolarHBondContact O-NE1 2.99Å
138	I	91.8	Very high	88.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-67.9	-40.3	171.8	-67.6	172.6	0	0	0	109.5	L109 P110 V112 L134 S140 L141 V142 A150 F152 V166 W240	L109-I138 HydrophobicContact CD2-CG2 3.96Å; P110-I138 HydrophobicContact CG-CG2 4.24Å; V112-I138 HydrophobicContact CG2-CD1 3.96Å; L134-I138 HydrophobicContact CD2-CD1 3.44Å; L134-I138 VanDerWaalsContact CD2-CD1 3.44Å; L134-I138 HydrophobicContact CD2-CG1 4.43Å; L134-I138 HydrophobicContact CG-CD1 3.93Å; L134-I138 HydrophobicContact CG-CG1 4.44Å; L134-I138 WeakPolarHBondContact O-CB 3.3Å; L134-I138 VanDerWaalsContact O-CG1 3.26Å; L134-I138 WeakPolarHBondContact O-CG1 3.37Å; L134-I138 PolarHBondContact O-N 2.92Å; I138-S140 PolarHBondContact O-N 3.45Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 2.91Å; I138-L141 VanDerWaalsContact O-N 3.12Å; I138-V142 HydrophobicContact CG2-CG2 4.31Å; I138-V142 WeakPolarHBondContact O-CG2 3.38Å; I138-V142 PolarHBondContact O-N 3.47Å; I138-A150 HydrophobicContact CG2-CB 4.46Å; I138-F152 HydrophobicContact CD1-CB 3.97Å; I138-V166 HydrophobicContact CD1-CG2 3.88Å; I138-V166 HydrophobicContact CG1-CG2 3.72Å; I138-W240 HydrophobicContact CG1-CZ2 4.16Å
139	K	88.8	Confident	88.8	Confident	54 Å²	54	43 Å²	43	24%	0.235	24%	0.24	C	C	.	.	H	α-helix	trans	-53.5	-50.8	170.2	-177	166.5	178.5	173.8	0	112.6	E98 L109 N135 M136 L141 V142 N143	E98-K139 IonicContact OE1-NZ 2.79Å; E98-K139 PolarHBondContact OE1-NZ 3.19Å; L109-K139 HydrophobicContact CD1-CB 4.14Å; L109-K139 HydrophobicContact CD1-CD 4.25Å; L109-K139 HydrophobicContact CD1-CG 3.82Å; L109-K139 HydrophobicContact CD2-CB 4.08Å; N135-K139 WeakPolarHBondContact O-CB 3.32Å; N135-K139 PolarHBondContact O-N 2.65Å; M136-K139 WeakPolarHBondContact O-CB 3.49Å; M136-K139 PolarHBondContact O-N 3.25Å; K139-L141 VanDerWaalsContact C-N 3.31Å; K139-L141 PolarHBondContact O-N 3.48Å; K139-V142 PolarHBondContact O-N 3.29Å; K139-N143 WeakPolarHBondContact O-CB 3.32Å; K139-N143 VanDerWaalsContact O-CG 3.22Å; K139-N143 PolarHBondContact O-N 3.44Å; K139-N143 PolarHBondContact O-OD1 2.95Å
140	S	87.5	Confident	89	Confident	37 Å²	37	36.9 Å²	36.9	26%	0.259	21%	0.208	S	C	.	.	H	α-helix	trans	-61	-38.2	176.1	-179	0	0	0	0	112.7	M136 T137 I138 N143 T144	M136-S140 PolarHBondContact O-N 3.21Å; T137-S140 PolarHBondContact O-N 3.46Å; I138-S140 PolarHBondContact O-N 3.45Å; S140-N143 PolarHBondContact O-N 3.42Å; S140-T144 WeakPolarHBondContact O-CB 3.15Å; S140-T144 PolarHBondContact O-N 2.99Å; S140-T144 PolarHBondContact O-OG1 2.81Å
141	L	89.4	Confident	89.1	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-52.2	176.7	-179.2	59.4	0	0	0	112.1	T137 I138 K139 N143 T144 Q145 V166 V168 F231 W240	T137-L141 PolarHBondContact O-N 3.33Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 2.91Å; I138-L141 VanDerWaalsContact O-N 3.12Å; K139-L141 VanDerWaalsContact C-N 3.31Å; K139-L141 PolarHBondContact O-N 3.48Å; L141-N143 VanDerWaalsContact C-N 3.26Å; L141-N143 PolarHBondContact O-N 3.33Å; L141-T144 PolarHBondContact O-N 2.93Å; L141-T144 VanDerWaalsContact O-N 3.08Å; L141-Q145 HydrophobicContact CD1-CB 4.45Å; L141-Q145 HydrophobicContact CD1-CG 3.79Å; L141-Q145 WeakPolarHBondContact O-CB 3.47Å; L141-Q145 PolarHBondContact O-N 3.02Å; L141-V166 HydrophobicContact CD2-CB 4.2Å; L141-V166 HydrophobicContact CD2-CG1 3.97Å; L141-V168 HydrophobicContact CD2-CG1 4.42Å; L141-F231 HydrophobicContact CD1-CD1 4.03Å; L141-F231 HydrophobicContact CD1-CE1 4.29Å; L141-F231 HydrophobicContact CD1-CG 4.23Å; L141-F231 HydrophobicContact CD2-CB 4.06Å; L141-F231 HydrophobicContact CD2-CG 4.23Å; L141-W240 HydrophobicContact CB-CG 4.27Å; L141-W240 HydrophobicContact CD1-CB 3.77Å; L141-W240 HydrophobicContact CD1-CG 3.81Å; L141-W240 HydrophobicContact CD2-CD2 4.01Å; L141-W240 HydrophobicContact CD2-CE3 4.49Å; L141-W240 HydrophobicContact CD2-CG 4.05Å; L141-W240 HydrophobicContact CG-CG 4.27Å
142	V	88.7	Confident	89.2	Confident	6 Å²	6	36 Å²	36	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-30.3	-179.2	175.5	0	0	0	0	111.8	P99 P108 L109 I138 K139 T144 Q145 V147 A150	P99-V142 HydrophobicContact CG-CG1 3.99Å; P108-V142 HydrophobicContact CB-CG1 3.73Å; P108-V142 HydrophobicContact CG-CG1 3.72Å; L109-V142 HydrophobicContact CD2-CB 3.73Å; L109-V142 HydrophobicContact CD2-CG1 4.26Å; L109-V142 HydrophobicContact CD2-CG2 3.52Å; L109-V142 HydrophobicContact CG-CB 4.11Å; L109-V142 HydrophobicContact CG-CG1 4.1Å; L109-V142 HydrophobicContact CG-CG2 4.18Å; I138-V142 HydrophobicContact CG2-CG2 4.31Å; I138-V142 WeakPolarHBondContact O-CG2 3.38Å; I138-V142 PolarHBondContact O-N 3.47Å; K139-V142 PolarHBondContact O-N 3.29Å; V142-T144 VanDerWaalsContact C-N 3.35Å; V142-Q145 CarbonylContact C-O 3.59Å; V142-V147 HydrophobicContact CB-CG2 4.17Å; V142-V147 HydrophobicContact CG1-CG2 3.98Å; V142-V147 HydrophobicContact CG2-CG2 3.81Å; V142-A150 HydrophobicContact CG2-CB 3.68Å
143	N	84.7	Confident	89.5	Confident	46 Å²	46	33.6 Å²	33.6	25%	0.246	19%	0.188	C	C	.	.	H	α-helix	trans	-75.3	-27.5	174.4	-69.8	3.6	0	0	0	112.2	E95 P99 K139 S140 L141	E95-N143 PolarHBondContact O-ND2 2.88Å; P99-N143 WeakPolarHBondContact CD-OD1 3.43Å; K139-N143 WeakPolarHBondContact O-CB 3.32Å; K139-N143 VanDerWaalsContact O-CG 3.22Å; K139-N143 PolarHBondContact O-N 3.44Å; K139-N143 PolarHBondContact O-OD1 2.95Å; S140-N143 PolarHBondContact O-N 3.42Å; L141-N143 VanDerWaalsContact C-N 3.26Å; L141-N143 PolarHBondContact O-N 3.33Å
144	T	85.5	Confident	89.7	Confident	101 Å²	101	33 Å²	33	62%	0.62	18%	0.184	S	C	*	.	H	α-helix	trans	-85.7	-35.4	179.3	-55.5	0	0	0	0	111.9	S140 L141 V142	S140-T144 WeakPolarHBondContact O-CB 3.15Å; S140-T144 PolarHBondContact O-N 2.99Å; S140-T144 PolarHBondContact O-OG1 2.81Å; L141-T144 PolarHBondContact O-N 2.93Å; L141-T144 VanDerWaalsContact O-N 3.08Å; V142-T144 VanDerWaalsContact C-N 3.35Å
145	Q	84.5	Confident	89.9	Confident	44 Å²	44	33.5 Å²	33.5	21%	0.206	19%	0.187	C	C	.	.	S	Bend	trans	-115.5	119.2	-177.1	-60.8	-66.1	-25.5	0	0	107.8	L141 V142 V147 F170 F231	L141-Q145 HydrophobicContact CD1-CB 4.45Å; L141-Q145 HydrophobicContact CD1-CG 3.79Å; L141-Q145 WeakPolarHBondContact O-CB 3.47Å; L141-Q145 PolarHBondContact O-N 3.02Å; V142-Q145 CarbonylContact C-O 3.59Å; Q145-V147 HydrophobicContact CB-CG1 3.9Å; Q145-V147 PolarHBondContact O-N 3.42Å; Q145-F170 HydrophobicContact CB-CE1 4.49Å; Q145-F231 HydrophobicContact CG-CZ 4.31Å
146	A	82	Confident	90.2	Very high	67 Å²	67	31 Å²	31	55%	0.554	17%	0.173	S	C	*	.			trans	-71.4	68.3	179.8	0	0	0	0	0	111.5
147	V	86.8	Confident	90.5	Very high	10 Å²	10	31.9 Å²	31.9	6%	0.061	17%	0.174	C	C	.	.			trans	-86.5	144.5	-178.2	-61.5	0	0	0	0	110.7	P108 V142 Q145 A150 V168 F170	P108-V147 WeakPolarHBondContact CB-O 3.42Å; V142-V147 HydrophobicContact CB-CG2 4.17Å; V142-V147 HydrophobicContact CG1-CG2 3.98Å; V142-V147 HydrophobicContact CG2-CG2 3.81Å; Q145-V147 HydrophobicContact CB-CG1 3.9Å; Q145-V147 PolarHBondContact O-N 3.42Å; V147-A150 HydrophobicContact CG2-CB 4.27Å; V147-V168 HydrophobicContact CB-CB 4.26Å; V147-V168 HydrophobicContact CG1-CB 3.83Å; V147-V168 HydrophobicContact CG1-CG1 4.13Å; V147-V168 HydrophobicContact CG1-CG2 4.02Å; V147-F170 HydrophobicContact CG1-CD1 4.04Å; V147-F170 HydrophobicContact CG1-CE1 3.58Å; V147-F170 HydrophobicContact CG1-CZ 3.94Å
148	Q	86.6	Confident	90.8	Very high	96 Å²	96	32.2 Å²	32.2	45%	0.449	18%	0.178	S	C	.	.	S	Bend	trans	-73.4	-45.8	174.4	-172.5	-174.8	33.8	0	0	110.9	P108 E169 P171	P108-Q148 WeakPolarHBondContact CB-O 3.46Å; Q148-E169 WeakPolarHBondContact CB-O 3.11Å; Q148-E169 PolarHBondContact N-O 2.86Å; Q148-P171 HydrophobicContact CB-CG 4.33Å
149	T	89.2	Confident	90.9	Very high	55 Å²	55	37.7 Å²	37.7	34%	0.337	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.2	176.4	69.2	0	0	0	0	110.3	V168 E169	T149-V168 VanDerWaalsContact O-CA 3.26Å; T149-V168 WeakPolarHBondContact O-CA 3.5Å; T149-E169 PolarHBondContact N-O 2.95Å; T149-E169 PolarHBondContact O-N 3.2Å; T149-E169 WeakPolarHBondContact OG1-CB 3.3Å
150	A	92.7	Very high	91.1	Very high	7 Å²	7	39.6 Å²	39.6	6%	0.058	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.5	168.7	0	0	0	0	0	109.7	P108 P110 I138 V142 V147 V166 E167 V168	P108-A150 PolarHBondContact O-N 3.39Å; P110-A150 WeakPolarHBondContact CB-O 3.5Å; P110-A150 WeakPolarHBondContact CD-O 3.28Å; P110-A150 WeakPolarHBondContact CG-O 3.18Å; I138-A150 HydrophobicContact CG2-CB 4.46Å; V142-A150 HydrophobicContact CG2-CB 3.68Å; V147-A150 HydrophobicContact CG2-CB 4.27Å; A150-V166 HydrophobicContact CB-CG1 4.23Å; A150-E167 WeakPolarHBondContact CA-O 3.45Å; A150-V168 HydrophobicContact CB-CG1 4.13Å
151	R	93.2	Very high	91.4	Very high	33 Å²	33	42.2 Å²	42.2	13%	0.125	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.2	172.5	-173.6	-175.6	72	152.2	-6	110.4	W153 V166 E167 E453 N454	R151-W153 PolarHBondContact O-N 3.44Å; R151-V166 CarbonylContact O-C 3.54Å; R151-V166 WeakPolarHBondContact O-CA 3.25Å; R151-V166 WeakPolarHBondContact O-CG1 2.94Å; R151-E167 HydrophobicContact CB-CG 3.69Å; R151-E167 IonicContact CZ-OE1 3.16Å; R151-E167 IonicContact CZ-OE2 2.75Å; R151-E167 PolarHBondContact N-O 3.36Å; R151-E167 IonicContact NE-OE1 3.95Å; R151-E167 PolarHBondContact NE-OE1 3.47Å; R151-E167 IonicContact NE-OE2 3.3Å; R151-E167 IonicContact NH2-OE1 3.41Å; R151-E167 PolarHBondContact NH2-OE1 2.78Å; R151-E167 IonicContact NH2-OE2 3.96Å; R151-E167 PolarHBondContact NH2-OE2 2.97Å; R151-E167 WeakPolarHBondContact O-CG 3.43Å; R151-E167 PolarHBondContact O-N 3.12Å; R151-E453 WeakPolarHBondContact CD-OE2 3.29Å; R151-E453 IonicContact NH1-OE2 3.27Å; R151-N454 PolarHBondContact NH1-O 3.45Å
152	F	95.3	Very high	91.7	Very high	19 Å²	19	44.2 Å²	44.2	8%	0.083	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	103.7	168.4	179.6	-121.3	0	0	0	110	I126 L134 I138 G154 Y164 I165 V166 I455	I126-F152 HydrophobicContact CD1-CE1 4.3Å; I126-F152 HydrophobicContact CD1-CZ 4.41Å; L134-F152 HydrophobicContact CD1-CD2 3.77Å; L134-F152 HydrophobicContact CD1-CE2 3.4Å; L134-F152 VanDerWaalsContact CD1-CE2 3.4Å; L134-F152 HydrophobicContact CD1-CG 4.48Å; L134-F152 HydrophobicContact CD1-CZ 3.82Å; L134-F152 HydrophobicContact CD2-CB 4.06Å; L134-F152 HydrophobicContact CD2-CD1 4.01Å; L134-F152 HydrophobicContact CD2-CD2 3.67Å; L134-F152 HydrophobicContact CD2-CE1 4.37Å; L134-F152 HydrophobicContact CD2-CE2 4.08Å; L134-F152 HydrophobicContact CD2-CG 3.63Å; L134-F152 HydrophobicContact CD2-CZ 4.4Å; L134-F152 HydrophobicContact CG-CD2 4.24Å; L134-F152 HydrophobicContact CG-CE2 4.34Å; I138-F152 HydrophobicContact CD1-CB 3.97Å; F152-G154 WeakPolarHBondContact CE2-O 3.38Å; F152-G154 VanDerWaalsContact CZ-C 3.43Å; F152-G154 WeakPolarHBondContact CZ-O 3.47Å; F152-Y164 HydrophobicContact CE2-CD1 4.27Å; F152-Y164 HydrophobicContact CZ-CD1 4.28Å; F152-I165 VanDerWaalsContact CD2-O 3.27Å; F152-I165 WeakPolarHBondContact CD2-O 3.3Å; F152-V166 HydrophobicContact CD2-CG2 4.42Å; F152-I455 HydrophobicContact CD1-CD1 4.26Å; F152-I455 HydrophobicContact CE1-CD1 3.93Å; F152-I455 HydrophobicContact CE1-CG1 4.45Å
153	W	96.4	Very high	92.1	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-41.5	-179.4	179.7	92.1	0	0	0	111.8	R151 I156 I165 E167 Y230 I287 I290 S291 Y456	R151-W153 PolarHBondContact O-N 3.44Å; W153-I156 HydrophobicContact CH2-CD1 3.98Å; W153-I156 HydrophobicContact CH2-CG1 4.46Å; W153-I156 HydrophobicContact CZ3-CD1 3.78Å; W153-I156 HydrophobicContact CZ3-CG1 3.97Å; W153-I165 HydrophobicContact CB-CB 4.38Å; W153-I165 HydrophobicContact CB-CG2 4.02Å; W153-I165 HydrophobicContact CD2-CG2 4.32Å; W153-I165 HydrophobicContact CE3-CB 3.93Å; W153-I165 HydrophobicContact CE3-CD1 3.86Å; W153-I165 HydrophobicContact CE3-CG1 4.44Å; W153-I165 HydrophobicContact CE3-CG2 4.11Å; W153-I165 HydrophobicContact CG-CG2 4.31Å; W153-I165 HydrophobicContact CZ3-CD1 3.81Å; W153-I165 PolarHBondContact N-O 3.45Å; W153-E167 HydrophobicContact CB-CB 4.4Å; W153-E167 HydrophobicContact CB-CG 4.43Å; W153-E167 VanDerWaalsContact CD1-OE2 3.32Å; W153-Y230 AromaticContact CD1-CE1 3.8Å; W153-Y230 HydrophobicContact CG-CE1 4.24Å; W153-I287 HydrophobicContact CD2-CG2 4.45Å; W153-I287 HydrophobicContact CH2-CG1 4.01Å; W153-I287 HydrophobicContact CZ2-CB 4.27Å; W153-I287 HydrophobicContact CZ2-CG1 4.17Å; W153-I287 HydrophobicContact CZ2-CG2 4.04Å; W153-I287 HydrophobicContact CZ3-CG1 4.22Å; W153-I290 HydrophobicContact CH2-CB 4.28Å; W153-I290 HydrophobicContact CH2-CD1 3.91Å; W153-I290 HydrophobicContact CH2-CG2 4.03Å; W153-I290 HydrophobicContact CZ2-CB 3.86Å; W153-I290 HydrophobicContact CZ2-CD1 4.36Å; W153-I290 HydrophobicContact CZ2-CG2 3.61Å; W153-S291 PolarHBondContact NE1-OG 3.04Å; W153-Y456 AromaticContact CH2-CD1 3.64Å; W153-Y456 HydrophobicContact CH2-CD1 3.64Å; W153-Y456 AromaticContact CH2-CG 3.65Å; W153-Y456 HydrophobicContact CH2-CG 3.65Å; W153-Y456 HydrophobicContact CZ2-CG 4.35Å; W153-Y456 AromaticContact CZ3-CD1 3.64Å; W153-Y456 HydrophobicContact CZ3-CD1 3.64Å; W153-Y456 AromaticContact CZ3-CG 3.9Å; W153-Y456 HydrophobicContact CZ3-CG 3.9Å; W153-Y456 PolarHBondContact O-N 2.82Å
154	G	96.3	Very high	92.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.2	-169.2	-178.5	0	0	0	0	0	116.9	F152 I165 Y456	F152-G154 WeakPolarHBondContact CE2-O 3.38Å; F152-G154 VanDerWaalsContact CZ-C 3.43Å; F152-G154 WeakPolarHBondContact CZ-O 3.47Å; G154-I165 PolarHBondContact N-O 3.38Å; G154-I165 PolarHBondContact O-N 3.46Å; G154-Y456 CarbonylContact C-O 3.56Å; G154-Y456 WeakPolarHBondContact CA-O 2.98Å
155	K	96.9	Very high	93.2	Very high	11 Å²	11	37.6 Å²	37.6	5%	0.048	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.2	179.1	-175.7	177.1	-175.6	168.8	0	110.3	I126 E130 Y157 N162 Y163 Y164 Y456 V457 G458	I126-K155 HydrophobicContact CG2-CD 4.09Å; E130-K155 IonicContact OE1-NZ 3.6Å; E130-K155 PolarHBondContact OE1-NZ 3.27Å; E130-K155 IonicContact OE2-NZ 3.7Å; E130-K155 PolarHBondContact OE2-NZ 3.47Å; K155-Y157 HydrophobicContact CD-CE1 4.06Å; K155-Y157 HydrophobicContact CG-CE1 4.36Å; K155-N162 HydrophobicContact CG-CB 4.44Å; K155-Y163 CarbonylContact C-O 3.56Å; K155-Y163 VanDerWaalsContact CA-O 3.25Å; K155-Y163 WeakPolarHBondContact CA-O 3.44Å; K155-Y164 HydrophobicContact CB-CD1 4.5Å; K155-Y164 HydrophobicContact CD-CD1 4.33Å; K155-Y164 HydrophobicContact CD-CE1 3.7Å; K155-Y164 WeakPolarHBondContact CE-OH 3.48Å; K155-Y164 HydrophobicContact CG-CD1 4.33Å; K155-Y164 HydrophobicContact CG-CE1 4.17Å; K155-Y164 PolarHBondContact NZ-OH 2.97Å; K155-Y456 PolarHBondContact N-O 2.88Å; K155-V457 WeakPolarHBondContact O-CA 3.44Å; K155-G458 PolarHBondContact O-N 3.31Å; K155-G458 VanDerWaalsContact O-N 3.11Å
156	I	97.8	Very high	93.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.8	170.3	-70.4	172.9	0	0	0	109	W153 N162 Y163 I165 F261 L283 I287 Y456 G458	W153-I156 HydrophobicContact CH2-CD1 3.98Å; W153-I156 HydrophobicContact CH2-CG1 4.46Å; W153-I156 HydrophobicContact CZ3-CD1 3.78Å; W153-I156 HydrophobicContact CZ3-CG1 3.97Å; I156-N162 WeakPolarHBondContact O-CA 3.48Å; I156-Y163 HydrophobicContact CG2-CD2 4.41Å; I156-Y163 PolarHBondContact N-O 3.02Å; I156-Y163 PolarHBondContact O-N 3.4Å; I156-I165 HydrophobicContact CB-CD1 4.12Å; I156-I165 HydrophobicContact CD1-CD1 3.79Å; I156-I165 HydrophobicContact CG1-CD1 3.83Å; I156-F261 HydrophobicContact CG2-CD2 3.4Å; I156-F261 HydrophobicContact CG2-CE2 3.75Å; I156-F261 HydrophobicContact CG2-CG 4.01Å; I156-L283 HydrophobicContact CB-CD1 4.46Å; I156-L283 HydrophobicContact CD1-CD1 3.46Å; I156-L283 VanDerWaalsContact CD1-CD1 3.46Å; I156-L283 HydrophobicContact CG2-CD1 4.43Å; I156-I287 HydrophobicContact CD1-CG1 4.34Å; I156-Y456 HydrophobicContact CG1-CD1 3.89Å; I156-Y456 HydrophobicContact CG1-CE1 3.82Å; I156-G458 CarbonylContact C-O 3.58Å; I156-G458 WeakPolarHBondContact CA-O 3.43Å
157	Y	97.1	Very high	94.5	Very high	75 Å²	75	33.7 Å²	33.7	29%	0.294	17%	0.172	S	C	.	.			trans	-77.3	130.5	175.6	-59	-52.7	0	0	0	110.7	K155 N162 V457 G458 W459	K155-Y157 HydrophobicContact CD-CE1 4.06Å; K155-Y157 HydrophobicContact CG-CE1 4.36Å; Y157-N162 WeakPolarHBondContact CA-OD1 2.97Å; Y157-V457 HydrophobicContact CE2-CG1 4.35Å; Y157-V457 VanDerWaalsContact OH-CG1 3.27Å; Y157-V457 WeakPolarHBondContact OH-CG1 3.3Å; Y157-G458 WeakPolarHBondContact CD2-O 3.32Å; Y157-G458 PolarHBondContact N-O 3.38Å; Y157-W459 HydrophobicContact CD2-CD2 4.15Å; Y157-W459 HydrophobicContact CD2-CG 4.4Å; Y157-W459 HydrophobicContact CD2-CZ2 4.47Å
158	G	95.4	Very high	94.8	Very high	10 Å²	10	33.3 Å²	33.3	10%	0.103	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-114.9	164.7	169.5	0	0	0	0	0	111.4	Q161 N162 F261	G158-Q161 CarbonylContact C-O 3.47Å; G158-Q161 WeakPolarHBondContact CA-O 3.4Å; G158-Q161 PolarHBondContact N-O 3.36Å; G158-N162 PolarHBondContact N-OD1 2.89Å; G158-F261 CarbonylContact C-O 3.4Å; G158-F261 VanDerWaalsContact CA-O 3.28Å; G158-F261 WeakPolarHBondContact CA-O 3.38Å
159	L	94.5	Very high	95	Very high	116 Å²	116	31 Å²	31	61%	0.607	16%	0.159	S	C	*	.	S	Bend	trans	-69.2	-33.5	-177.1	-65.8	172.9	0	0	0	112.8	L260 F261 T262	L159-L260 HydrophobicContact CD1-CB 4.49Å; L159-L260 HydrophobicContact CD2-CD1 4.1Å; L159-L260 HydrophobicContact CG-CB 4.42Å; L159-F261 WeakPolarHBondContact CG-O 3.1Å; L159-F261 PolarHBondContact N-O 3.19Å; L159-T262 PolarHBondContact N-O 3.39Å
160	T	93.1	Very high	94.8	Very high	94 Å²	94	28.8 Å²	28.8	58%	0.577	15%	0.145	S	C	*	.	S	Bend	trans	-107.2	-43.5	-180	66.1	0	0	0	0	112.2	T262	T160-T262 WeakPolarHBondContact CB-O 3.28Å; T160-T262 PolarHBondContact N-O 3.15Å; T160-T262 PolarHBondContact OG1-O 3Å
161	Q	92.6	Very high	94.2	Very high	91 Å²	91	30.7 Å²	30.7	43%	0.425	16%	0.156	S	C	.	.	S	Bend	trans	-142.4	152.7	-179.4	-65.2	-175.3	-20.4	0	0	109.2	G158 H234 G263	G158-Q161 CarbonylContact C-O 3.47Å; G158-Q161 WeakPolarHBondContact CA-O 3.4Å; G158-Q161 PolarHBondContact N-O 3.36Å; Q161-H234 HydrophobicContact CB-CB 4.44Å; Q161-H234 VanDerWaalsContact OE1-CG 3.3Å; Q161-H234 PolarHBondContact OE1-ND1 2.55Å; Q161-G263 VanDerWaalsContact O-CA 3.31Å; Q161-G263 WeakPolarHBondContact O-CA 3.42Å
162	N	95.4	Very high	93.1	Very high	48 Å²	48	38.4 Å²	38.4	26%	0.257	19%	0.194	S	C	.	.			trans	-88.8	164.6	175.4	-58.5	-44.6	0	0	0	110	K155 I156 Y157 G158 H234	K155-N162 HydrophobicContact CG-CB 4.44Å; I156-N162 WeakPolarHBondContact O-CA 3.48Å; Y157-N162 WeakPolarHBondContact CA-OD1 2.97Å; G158-N162 PolarHBondContact N-OD1 2.89Å; N162-H234 VanDerWaalsContact O-CA 3.3Å; N162-H234 WeakPolarHBondContact O-CA 3.39Å
163	Y	97.4	Very high	91.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.4	171.8	-66.4	-60	0	0	0	109.5	K155 I156 V232 H234 F261 G263 I264 L265 E279 L283	K155-Y163 CarbonylContact C-O 3.56Å; K155-Y163 VanDerWaalsContact CA-O 3.25Å; K155-Y163 WeakPolarHBondContact CA-O 3.44Å; I156-Y163 HydrophobicContact CG2-CD2 4.41Å; I156-Y163 PolarHBondContact N-O 3.02Å; I156-Y163 PolarHBondContact O-N 3.4Å; Y163-V232 HydrophobicContact CD1-CG2 3.36Å; Y163-V232 HydrophobicContact CE1-CG2 4.19Å; Y163-V232 HydrophobicContact CG-CG2 3.9Å; Y163-H234 AromaticContact CD1-CE1 3.93Å; Y163-H234 AromaticContact CD1-ND1 3.75Å; Y163-H234 AromaticContact CE1-CE1 3.27Å; Y163-H234 WeakPolarHBondContact CE1-CE1 3.41Å; Y163-H234 AromaticContact CE1-ND1 3.52Å; Y163-F261 HydrophobicContact CD2-CB 4.45Å; Y163-F261 HydrophobicContact CE2-CB 4.05Å; Y163-F261 HydrophobicContact CE2-CD1 4.04Å; Y163-F261 HydrophobicContact CE2-CG 4.28Å; Y163-G263 WeakPolarHBondContact OH-CA 3.14Å; Y163-I264 VanDerWaalsContact OH-C 3.23Å; Y163-I264 PolarHBondContact OH-N 3.2Å; Y163-L265 HydrophobicContact CD1-CD2 4.35Å; Y163-L265 HydrophobicContact CE1-CD2 3.49Å; Y163-L265 VanDerWaalsContact CE1-CD2 3.49Å; Y163-L265 HydrophobicContact CE1-CG 3.87Å; Y163-L265 PolarHBondContact OH-N 2.96Å; Y163-E279 WeakPolarHBondContact CE2-OE1 3.24Å; Y163-E279 PolarHBondContact OH-OE1 2.92Å; Y163-L283 HydrophobicContact CD1-CD2 4.11Å; Y163-L283 HydrophobicContact CD2-CD1 4.14Å; Y163-L283 HydrophobicContact CD2-CD2 3.91Å; Y163-L283 HydrophobicContact CE1-CD2 4.31Å; Y163-L283 HydrophobicContact CE2-CD2 4.17Å; Y163-L283 HydrophobicContact CG-CD2 3.85Å
164	Y	97.1	Very high	90.2	Very high	13 Å²	13	46.6 Å²	46.6	5%	0.051	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.5	164.9	-62.7	-91.7	0	0	0	107.5	E130 L134 F152 K155 V232 C233 H234 P236 W240	E130-Y164 PolarHBondContact OE2-OH 2.82Å; L134-Y164 HydrophobicContact CD1-CD1 3.58Å; L134-Y164 HydrophobicContact CD1-CE1 4.3Å; L134-Y164 HydrophobicContact CD1-CG 4.23Å; F152-Y164 HydrophobicContact CE2-CD1 4.27Å; F152-Y164 HydrophobicContact CZ-CD1 4.28Å; K155-Y164 HydrophobicContact CB-CD1 4.5Å; K155-Y164 HydrophobicContact CD-CD1 4.33Å; K155-Y164 HydrophobicContact CD-CE1 3.7Å; K155-Y164 WeakPolarHBondContact CE-OH 3.48Å; K155-Y164 HydrophobicContact CG-CD1 4.33Å; K155-Y164 HydrophobicContact CG-CE1 4.17Å; K155-Y164 PolarHBondContact NZ-OH 2.97Å; Y164-V232 CarbonylContact O-C 3.54Å; Y164-V232 WeakPolarHBondContact O-CA 3.26Å; Y164-C233 WeakPolarHBondContact CD2-O 3.2Å; Y164-C233 PolarHBondContact N-O 3.39Å; Y164-C233 PolarHBondContact O-N 2.84Å; Y164-H234 WeakPolarHBondContact CE2-O 3.45Å; Y164-P236 HydrophobicContact CE2-CG 4.3Å; Y164-W240 WeakPolarHBondContact O-CZ3 3.27Å
165	I	97.6	Very high	88.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.8	-173.1	-59	119.4	0	0	0	109.3	F152 W153 G154 I156 Y230 F231 V232 I287	F152-I165 VanDerWaalsContact CD2-O 3.27Å; F152-I165 WeakPolarHBondContact CD2-O 3.3Å; W153-I165 HydrophobicContact CB-CB 4.38Å; W153-I165 HydrophobicContact CB-CG2 4.02Å; W153-I165 HydrophobicContact CD2-CG2 4.32Å; W153-I165 HydrophobicContact CE3-CB 3.93Å; W153-I165 HydrophobicContact CE3-CD1 3.86Å; W153-I165 HydrophobicContact CE3-CG1 4.44Å; W153-I165 HydrophobicContact CE3-CG2 4.11Å; W153-I165 HydrophobicContact CG-CG2 4.31Å; W153-I165 HydrophobicContact CZ3-CD1 3.81Å; W153-I165 PolarHBondContact N-O 3.45Å; G154-I165 PolarHBondContact N-O 3.38Å; G154-I165 PolarHBondContact O-N 3.46Å; I156-I165 HydrophobicContact CB-CD1 4.12Å; I156-I165 HydrophobicContact CD1-CD1 3.79Å; I156-I165 HydrophobicContact CG1-CD1 3.83Å; I165-Y230 HydrophobicContact CG2-CD1 3.86Å; I165-F231 WeakPolarHBondContact CA-O 3.24Å; I165-V232 HydrophobicContact CG1-CG2 4.31Å; I165-I287 HydrophobicContact CD1-CD1 4.4Å; I165-I287 HydrophobicContact CG1-CD1 4.11Å; I165-I287 HydrophobicContact CG2-CD1 3.86Å
166	V	96.5	Very high	86.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128	171.5	175.6	0	0	0	0	106.9	I138 L141 A150 R151 F152 V168 Y230 F231 W240	I138-V166 HydrophobicContact CD1-CG2 3.88Å; I138-V166 HydrophobicContact CG1-CG2 3.72Å; L141-V166 HydrophobicContact CD2-CB 4.2Å; L141-V166 HydrophobicContact CD2-CG1 3.97Å; A150-V166 HydrophobicContact CB-CG1 4.23Å; R151-V166 CarbonylContact O-C 3.54Å; R151-V166 WeakPolarHBondContact O-CA 3.25Å; R151-V166 WeakPolarHBondContact O-CG1 2.94Å; F152-V166 HydrophobicContact CD2-CG2 4.42Å; V166-V168 HydrophobicContact CG1-CG1 3.84Å; V166-Y230 CarbonylContact O-C 3.43Å; V166-Y230 WeakPolarHBondContact O-CA 3.44Å; V166-F231 PolarHBondContact N-O 2.72Å; V166-F231 PolarHBondContact O-N 2.92Å; V166-W240 HydrophobicContact CB-CH2 4.31Å; V166-W240 HydrophobicContact CB-CZ3 4.2Å; V166-W240 HydrophobicContact CG2-CE3 4.5Å; V166-W240 HydrophobicContact CG2-CH2 3.3Å; V166-W240 HydrophobicContact CG2-CZ2 3.88Å; V166-W240 HydrophobicContact CG2-CZ3 3.65Å
167	E	95.4	Very high	84.1	Confident	30 Å²	30	56.2 Å²	56.2	14%	0.14	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	140.5	166.9	65.7	179	-148.3	0	0	108.6	A150 R151 W153 V229 Y230	A150-E167 WeakPolarHBondContact CA-O 3.45Å; R151-E167 HydrophobicContact CB-CG 3.69Å; R151-E167 IonicContact CZ-OE1 3.16Å; R151-E167 IonicContact CZ-OE2 2.75Å; R151-E167 PolarHBondContact N-O 3.36Å; R151-E167 IonicContact NE-OE1 3.95Å; R151-E167 PolarHBondContact NE-OE1 3.47Å; R151-E167 IonicContact NE-OE2 3.3Å; R151-E167 IonicContact NH2-OE1 3.41Å; R151-E167 PolarHBondContact NH2-OE1 2.78Å; R151-E167 IonicContact NH2-OE2 3.96Å; R151-E167 PolarHBondContact NH2-OE2 2.97Å; R151-E167 WeakPolarHBondContact O-CG 3.43Å; R151-E167 PolarHBondContact O-N 3.12Å; W153-E167 HydrophobicContact CB-CB 4.4Å; W153-E167 HydrophobicContact CB-CG 4.43Å; W153-E167 VanDerWaalsContact CD1-OE2 3.32Å; E167-V229 CarbonylContact C-O 3.59Å; E167-V229 WeakPolarHBondContact CA-O 3.42Å; E167-Y230 HydrophobicContact CB-CD1 3.72Å; E167-Y230 HydrophobicContact CB-CE1 3.52Å
168	V	93.7	Very high	81.8	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.012	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	154.1	177.4	-52.9	0	0	0	0	110.5	L141 V147 T149 A150 V166 F170 V229 F231	L141-V168 HydrophobicContact CD2-CG1 4.42Å; V147-V168 HydrophobicContact CB-CB 4.26Å; V147-V168 HydrophobicContact CG1-CB 3.83Å; V147-V168 HydrophobicContact CG1-CG1 4.13Å; V147-V168 HydrophobicContact CG1-CG2 4.02Å; T149-V168 VanDerWaalsContact O-CA 3.26Å; T149-V168 WeakPolarHBondContact O-CA 3.5Å; A150-V168 HydrophobicContact CB-CG1 4.13Å; V166-V168 HydrophobicContact CG1-CG1 3.84Å; V168-F170 HydrophobicContact CG2-CD2 4.39Å; V168-F170 HydrophobicContact CG2-CE2 3.8Å; V168-F170 HydrophobicContact CG2-CZ 4.16Å; V168-V229 HydrophobicContact CG2-CB 3.82Å; V168-V229 HydrophobicContact CG2-CG1 4.21Å; V168-V229 PolarHBondContact N-O 3.21Å; V168-V229 PolarHBondContact O-N 3.02Å; V168-F231 HydrophobicContact CG1-CD2 4.15Å; V168-F231 HydrophobicContact CG2-CD2 3.75Å; V168-F231 HydrophobicContact CG2-CE2 3.59Å
169	E	90.4	Very high	79.5	Confident	48 Å²	48	69 Å²	69	22%	0.224	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.9	169.5	-175	162.5	-130.3	0	0	108.4	Q148 T149 K228	Q148-E169 WeakPolarHBondContact CB-O 3.11Å; Q148-E169 PolarHBondContact N-O 2.86Å; T149-E169 PolarHBondContact N-O 2.95Å; T149-E169 PolarHBondContact O-N 3.2Å; T149-E169 WeakPolarHBondContact OG1-CB 3.3Å; E169-K228 HydrophobicContact CB-CD 4.25Å; E169-K228 IonicContact OE1-NZ 3.75Å; E169-K228 PolarHBondContact OE1-NZ 3.41Å; E169-K228 IonicContact OE2-NZ 2.81Å; E169-K228 PolarHBondContact OE2-NZ 3.27Å
170	F	86.6	Confident	77.1	Confident	8 Å²	8	70.8 Å²	70.8	4%	0.035	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-93.8	150.7	173	-69.5	-80.2	0	0	0	109.5	Q145 V147 V168 E174 D175 V229 F231	Q145-F170 HydrophobicContact CB-CE1 4.49Å; V147-F170 HydrophobicContact CG1-CD1 4.04Å; V147-F170 HydrophobicContact CG1-CE1 3.58Å; V147-F170 HydrophobicContact CG1-CZ 3.94Å; V168-F170 HydrophobicContact CG2-CD2 4.39Å; V168-F170 HydrophobicContact CG2-CE2 3.8Å; V168-F170 HydrophobicContact CG2-CZ 4.16Å; F170-E174 WeakPolarHBondContact CB-O 3.46Å; F170-D175 WeakPolarHBondContact CD2-OD1 3.44Å; F170-V229 HydrophobicContact CD2-CB 4.31Å; F170-V229 HydrophobicContact CD2-CG2 3.93Å; F170-V229 HydrophobicContact CE2-CB 3.94Å; F170-V229 HydrophobicContact CE2-CG1 4.04Å; F170-V229 HydrophobicContact CE2-CG2 3.91Å; F170-F231 HydrophobicContact CE2-CE2 4.36Å; F170-F231 HydrophobicContact CZ-CE2 4.14Å; F170-F231 HydrophobicContact CZ-CZ 4.3Å
171	P	79.9	Confident	74.7	Confident	46 Å²	46	67.8 Å²	67.8	30%	0.299	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-54.7	145.1	165.9	-18.9	31.2	0	0	0	110.6	Q148 G173 E174	Q148-P171 HydrophobicContact CB-CG 4.33Å; P171-G173 PolarHBondContact O-N 3.4Å; P171-E174 PolarHBondContact O-N 2.9Å; P171-E174 VanDerWaalsContact O-N 3.11Å
172	E	69.8	Low	72.6	Confident	196 Å²	196	68.9 Å²	68.9	92%	0.916	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	123.1	179.2	-66.1	-178.4	169.2	0	0	111.2
173	G	66.2	Low	70.2	Confident	77 Å²	77	71.6 Å²	71.6	79%	0.794	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	-6	179	0	0	0	0	0	116	P171	P171-G173 PolarHBondContact O-N 3.4Å
174	E	64.5	Low	67.5	Low	113 Å²	113	75.8 Å²	75.8	53%	0.528	41%	0.41	S	S	.	.			trans	-107.8	62.2	174.2	-71.1	-163.2	166.6	0	0	112.2	F170 P171	F170-E174 WeakPolarHBondContact CB-O 3.46Å; P171-E174 PolarHBondContact O-N 2.9Å; P171-E174 VanDerWaalsContact O-N 3.11Å
175	D	57.8	Low	64.3	Low	28 Å²	28	80.2 Å²	80.2	15%	0.15	44%	0.439	C	S	.	.			trans	-93.6	102.2	165.5	-111	6.5	0	0	0	108.7	F170 D177 N221 H222	F170-D175 WeakPolarHBondContact CD2-OD1 3.44Å; D175-D177 PolarHBondContact O-N 3.11Å; D175-N221 WeakPolarHBondContact OD2-CB 3.34Å; D175-N221 PolarHBondContact OD2-ND2 3.4Å; D175-H222 VanDerWaalsContact CG-CE1 3.4Å; D175-H222 IonicContact OD1-CE1 3.02Å; D175-H222 PolarHBondContact OD1-CE1 3.45Å; D175-H222 IonicContact OD1-NE2 3.12Å; D175-H222 PolarHBondContact OD1-NE2 3.17Å; D175-H222 IonicContact OD2-CD2 2.79Å; D175-H222 IonicContact OD2-CE1 3.15Å; D175-H222 IonicContact OD2-NE2 3.41Å; D175-H222 PolarHBondContact OD2-NE2 2.92Å; D175-H222 VanDerWaalsContact OD2-NE2 3.16Å
176	I	50.6	Low	61.4	Low	91 Å²	91	85 Å²	85	47%	0.467	47%	0.465	S	S	.	.	S	Bend	trans	-62.4	120.6	168.8	-55.6	170.6	0	0	0	106.1	K242	I176-K242 PolarHBondContact O-NZ 3.18Å
177	D	53.9	Low	58.5	Low	94 Å²	94	95.2 Å²	95.2	50%	0.503	50%	0.503	S	S	.	.			trans	92.4	65.3	179.1	-39.6	-44.3	0	0	0	115.7	D175 E179 K242	D175-D177 PolarHBondContact O-N 3.11Å; D177-E179 PolarHBondContact O-N 3.11Å; D177-K242 IonicContact OD2-NZ 3.6Å
178	E	50.3	Low	55.5	Low	183 Å²	183	100 Å²	100	86%	0.855	53%	0.529	S	S	*	.			trans	-62.6	43.4	146	-66.9	-179.3	162.2	0	0	111.5	E180	E178-E180 PolarHBondContact O-N 3.19Å
179	E	46.1	Very low	52.6	Low	171 Å²	171	104.2 Å²	104.2	80%	0.799	56%	0.555	S	S	*	*			trans	-71.5	89	158.4	-73.7	-164.7	179.5	0	0	105.8	D177 S181	D177-E179 PolarHBondContact O-N 3.11Å; E179-S181 PolarHBondContact O-N 2.75Å
180	E	44.3	Very low	49.8	Very low	154 Å²	154	107.1 Å²	107.1	72%	0.72	58%	0.576	S	S	*	*			trans	-43.6	104.3	164.4	-73.6	-174	150.9	0	0	107.6	E178	E178-E180 PolarHBondContact O-N 3.19Å
181	S	42.7	Very low	47.4	Very low	31 Å²	31	113 Å²	113	22%	0.217	60%	0.604	C	S	.	*			trans	-52.8	129	168.8	59.4	0	0	0	0	106.7	E179 D183 R218	E179-S181 PolarHBondContact O-N 2.75Å; S181-D183 PolarHBondContact O-N 2.79Å; S181-R218 PolarHBondContact OG-NE 2.9Å; S181-R218 PolarHBondContact OG-NH2 3.4Å
182	P	47.5	Very low	45.2	Very low	113 Å²	113	116.8 Å²	116.8	73%	0.734	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-62.8	0.7	-173.7	22.9	-32.5	0	0	0	114.4	S184 V185	P182-S184 PolarHBondContact O-N 3.38Å; P182-V185 PolarHBondContact O-N 2.71Å
183	D	45.3	Very low	43.5	Very low	105 Å²	105	113.9 Å²	113.9	56%	0.561	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-68.4	-6.8	176.6	-71.9	-32	0	0	0	114.9	S181 V185	S181-D183 PolarHBondContact O-N 2.79Å; D183-V185 PolarHBondContact O-N 3.08Å
184	S	40.6	Very low	42.1	Very low	88 Å²	88	117.6 Å²	117.6	62%	0.615	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-73.4	-12.8	171.5	62.3	0	0	0	0	113.4	P182	P182-S184 PolarHBondContact O-N 3.38Å
185	V	31.2	Very low	40.7	Very low	107 Å²	107	119.9 Å²	119.9	65%	0.648	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-135.1	50.4	-179.3	-156.8	0	0	0	0	111.6	P182 D183 R187	P182-V185 PolarHBondContact O-N 2.71Å; D183-V185 PolarHBondContact O-N 3.08Å; V185-R187 PolarHBondContact O-N 3.48Å
186	N	35.1	Very low	39.7	Very low	101 Å²	101	128 Å²	128	54%	0.54	66%	0.661	S	S	.	*			trans	-90.8	56.6	156	-108.2	-22.3	0	0	0	109.5	D188	N186-D188 PolarHBondContact O-N 3.01Å; N186-D188 VanDerWaalsContact O-N 3.1Å
187	R	36.2	Very low	39	Very low	213 Å²	213	126.8 Å²	126.8	80%	0.804	67%	0.671	S	S	*	*			trans	-77.5	69.6	151.9	-73.8	-174.1	175.4	178.2	-2.5	106.8	V185 T189	V185-R187 PolarHBondContact O-N 3.48Å; R187-T189 PolarHBondContact O-N 2.73Å
188	D	31.8	Very low	38.4	Very low	130 Å²	130	129.4 Å²	129.4	70%	0.695	69%	0.691	S	S	*	*			trans	-72.2	53	155.3	-102	-12.5	0	0	0	107.9	N186 T190	N186-D188 PolarHBondContact O-N 3.01Å; N186-D188 VanDerWaalsContact O-N 3.1Å; D188-T190 PolarHBondContact O-N 2.82Å
189	T	34.5	Very low	38	Very low	91 Å²	91	125.6 Å²	125.6	56%	0.558	67%	0.673	S	S	*	*			trans	-85	72.1	144.2	47.7	0	0	0	0	104.2	R187 E191	R187-T189 PolarHBondContact O-N 2.73Å; T189-E191 PolarHBondContact O-N 3.4Å
190	T	30.6	Very low	37.8	Very low	109 Å²	109	127 Å²	127	67%	0.669	68%	0.679	S	S	*	*			trans	-64.5	74.2	144.1	5.5	0	0	0	0	104.9	D188 I192	D188-T190 PolarHBondContact O-N 2.82Å; T190-I192 PolarHBondContact O-N 3.33Å
191	E	35.5	Very low	38	Very low	131 Å²	131	123.3 Å²	123.3	61%	0.612	68%	0.682	S	S	*	*			trans	-58.7	88.4	147.7	-76	173	-179.8	0	0	102.8	T189 D193	T189-E191 PolarHBondContact O-N 3.4Å; E191-D193 PolarHBondContact O-N 3.15Å
192	I	35	Very low	38.3	Very low	126 Å²	126	128.5 Å²	128.5	65%	0.646	70%	0.701	S	S	*	*			trans	-55.5	107.8	154.5	-66.4	170.7	0	0	0	102	T190 D194	T190-I192 PolarHBondContact O-N 3.33Å; I192-D194 PolarHBondContact O-N 3.26Å
193	D	33.7	Very low	38.7	Very low	136 Å²	136	130.6 Å²	130.6	73%	0.727	71%	0.706	S	S	*	*			trans	-49.7	88.2	166.3	-80.2	-37.6	0	0	0	107.1	E191 E195	E191-D193 PolarHBondContact O-N 3.15Å; D193-E195 PolarHBondContact O-N 2.98Å; D193-E195 VanDerWaalsContact O-N 3.16Å
194	D	37.4	Very low	39.4	Very low	154 Å²	154	132 Å²	132	82%	0.824	72%	0.718	S	S	*	*			trans	-81.6	42.8	161	-71.8	-28	0	0	0	107.8	I192	I192-D194 PolarHBondContact O-N 3.26Å
195	E	34.1	Very low	40.5	Very low	162 Å²	162	134.6 Å²	134.6	76%	0.757	72%	0.724	S	S	*	*			trans	-103	93.7	162.1	-75.7	-165.2	168.8	0	0	107	D193	D193-E195 PolarHBondContact O-N 2.98Å; D193-E195 VanDerWaalsContact O-N 3.16Å
196	E	37.6	Very low	42.2	Very low	198 Å²	198	135.4 Å²	135.4	93%	0.925	73%	0.732	S	S	*	*	S	Bend	trans	169.6	116.9	133.9	-92.3	176.6	-171.5	0	0	110
197	G	36.4	Very low	43.7	Very low	66 Å²	66	139.7 Å²	139.7	68%	0.68	75%	0.746	S	S	*	*			trans	101.6	75.6	165.6	0	0	0	0	0	114.5	E199	G197-E199 PolarHBondContact O-N 3.11Å
198	T	40.4	Very low	45.3	Very low	149 Å²	149	134.3 Å²	134.3	91%	0.914	74%	0.741	S	S	*	*			trans	-58.6	73.4	148	35.4	0	0	0	0	109.5	E200	T198-E200 PolarHBondContact O-N 3.31Å
199	E	42.2	Very low	47.2	Very low	103 Å²	103	138 Å²	138	48%	0.481	75%	0.751	S	S	.	*			trans	-77.2	99.8	161.4	-76.6	-176.1	161.7	0	0	106.7	G197 G201 K202	G197-E199 PolarHBondContact O-N 3.11Å; E199-G201 PolarHBondContact O-N 3.3Å; E199-K202 IonicContact OE2-NZ 2.78Å; E199-K202 PolarHBondContact OE2-NZ 2.93Å
200	E	41.7	Very low	48.8	Very low	201 Å²	201	142.6 Å²	142.6	94%	0.939	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.1	107.8	173.2	-64.7	-178.7	158.6	0	0	110.1	T198	T198-E200 PolarHBondContact O-N 3.31Å
201	G	48.6	Very low	50.5	Low	76 Å²	76	143.6 Å²	143.6	78%	0.784	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.4	-4	171.9	0	0	0	0	0	117.1	E199	E199-G201 PolarHBondContact O-N 3.3Å
202	K	48.1	Very low	52.2	Low	139 Å²	139	141.5 Å²	141.5	60%	0.604	75%	0.75	S	S	*	*	S	Bend	trans	-92.7	121.2	171.7	-71.3	172.3	-176.5	141.1	0	109.9	E199 V204	E199-K202 IonicContact OE2-NZ 2.78Å; E199-K202 PolarHBondContact OE2-NZ 2.93Å; K202-V204 PolarHBondContact O-N 3.2Å
203	D	56.3	Low	54	Low	158 Å²	158	140.8 Å²	140.8	85%	0.845	75%	0.754	S	S	*	*			trans	-48.9	106.1	174.9	-76.4	-37	0	0	0	110.1	L205	D203-L205 PolarHBondContact O-N 3.27Å
204	V	59.4	Low	56.1	Low	133 Å²	133	137 Å²	137	81%	0.806	74%	0.736	S	S	*	*			trans	-67.4	108.8	178.8	-177.7	0	0	0	0	107.7	K202	K202-V204 PolarHBondContact O-N 3.2Å
205	L	63.9	Low	58.2	Low	143 Å²	143	136.8 Å²	136.8	75%	0.749	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-59.8	141.4	176.9	-65.5	174.1	0	0	0	110	D203 K207	D203-L205 PolarHBondContact O-N 3.27Å; L205-K207 PolarHBondContact O-N 2.79Å
206	P	68.4	Low	60.7	Low	124 Å²	124	130.9 Å²	130.9	81%	0.805	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-61.5	124	177.8	24.1	-32.1	0	0	0	110.4	S208	P206-S208 PolarHBondContact O-N 2.89Å
207	K	66.8	Low	63.2	Low	192 Å²	192	123.9 Å²	123.9	84%	0.835	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-64	131.4	176.5	-65.7	-175.1	178.4	-174.7	0	109.9	L205 K209	L205-K207 PolarHBondContact O-N 2.79Å; K207-K209 PolarHBondContact O-N 2.99Å
208	S	69.8	Low	65.9	Low	100 Å²	100	124.7 Å²	124.7	70%	0.699	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-60.7	129.1	177.3	180	0	0	0	0	110.6	P206 W210	P206-S208 PolarHBondContact O-N 2.89Å; S208-W210 VanDerWaalsContact C-N 3.3Å; S208-W210 PolarHBondContact OG-N 3.14Å
209	K	69.9	Low	68.2	Low	208 Å²	208	117.8 Å²	117.8	90%	0.904	61%	0.614	S	S	*	*			trans	-82.9	-6	173.2	-63.1	-170.9	177.1	-166.8	0	113	K207 K211	K207-K209 PolarHBondContact O-N 2.99Å; K209-K211 PolarHBondContact O-N 3.41Å
210	W	69.7	Low	70.3	Confident	186 Å²	186	119.6 Å²	119.6	71%	0.705	62%	0.623	S	S	*	*			trans	-79.5	122.6	-178.1	-175.2	87.1	0	0	0	110.4	S208 P212	S208-W210 VanDerWaalsContact C-N 3.3Å; S208-W210 PolarHBondContact OG-N 3.14Å; W210-P212 HydrophobicContact CH2-CB 3.81Å; W210-P212 HydrophobicContact CZ3-CB 4.03Å; W210-P212 HydrophobicContact CZ3-CG 4.42Å
211	K	64.8	Low	72.5	Confident	130 Å²	130	112.6 Å²	112.6	57%	0.565	59%	0.592	S	S	*	*			trans	-113.8	135.9	171.8	-63.7	-173.9	-180	-172.1	0	109.2	K209	K209-K211 PolarHBondContact O-N 3.41Å
212	P	72.3	Confident	74.2	Confident	87 Å²	87	112 Å²	112	57%	0.565	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-62.9	150.1	174.5	26.8	-33.1	0	0	0	110.3	W210	W210-P212 HydrophobicContact CH2-CB 3.81Å; W210-P212 HydrophobicContact CZ3-CB 4.03Å; W210-P212 HydrophobicContact CZ3-CG 4.42Å
213	P	73	Confident	76	Confident	111 Å²	111	108.6 Å²	108.6	72%	0.721	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-61.1	140.1	175.9	25.6	-33	0	0	0	110.5	K215	P213-K215 PolarHBondContact O-N 3.33Å
214	V	77.3	Confident	77.6	Confident	58 Å²	58	101.8 Å²	101.8	35%	0.352	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-62.3	124.3	178.8	-179.2	0	0	0	0	109.9	V216 W363 L369	V214-V216 PolarHBondContact O-N 2.72Å; V214-W363 HydrophobicContact CG1-CH2 3.72Å; V214-W363 HydrophobicContact CG1-CZ3 4.03Å; V214-L369 HydrophobicContact CG2-CD1 3.44Å; V214-L369 VanDerWaalsContact CG2-CD1 3.44Å; V214-L369 HydrophobicContact CG2-CG 3.99Å
215	K	81.2	Confident	79.1	Confident	148 Å²	148	96 Å²	96	64%	0.643	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-71.9	118.2	176.8	-68	-174.1	178.7	-178.6	0	109.4	P213	P213-K215 PolarHBondContact O-N 3.33Å
216	V	87.5	Confident	80.5	Confident	39 Å²	39	89.5 Å²	89.5	24%	0.236	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-68.3	124.7	176.3	-178.8	0	0	0	0	108.7	V214 P248 R359 W363	V214-V216 PolarHBondContact O-N 2.72Å; V216-P248 HydrophobicContact CB-CB 4.17Å; V216-P248 HydrophobicContact CB-CG 4.46Å; V216-P248 HydrophobicContact CG1-CB 4.03Å; V216-P248 HydrophobicContact CG1-CG 4.05Å; V216-R359 VanDerWaalsContact CG1-CD 3.42Å; V216-R359 HydrophobicContact CG1-CG 4.1Å; V216-W363 HydrophobicContact CB-CE3 4.37Å; V216-W363 HydrophobicContact CB-CZ3 4.5Å; V216-W363 HydrophobicContact CG1-CE3 3.99Å; V216-W363 HydrophobicContact CG2-CE3 4.27Å; V216-W363 HydrophobicContact CG2-CZ3 4.3Å
217	P	90.1	Very high	81.6	Confident	51 Å²	51	86 Å²	86	33%	0.331	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-67.1	149.4	-176	20	-24.4	0	0	0	111.3	P248 R359 W363	P217-P248 WeakPolarHBondContact O-CG 3.27Å; P217-R359 WeakPolarHBondContact O-CD 3.34Å; P217-R359 PolarHBondContact O-NH1 3.36Å; P217-W363 VanDerWaalsContact CD-CD2 3.43Å; P217-W363 HydrophobicContact CG-CD2 3.81Å; P217-W363 VanDerWaalsContact CG-CE2 3.42Å; P217-W363 HydrophobicContact CG-CE3 4.45Å; P217-W363 HydrophobicContact CG-CG 4.09Å; P217-W363 HydrophobicContact CG-CH2 4.32Å; P217-W363 HydrophobicContact CG-CZ2 3.73Å
218	R	91.9	Very high	82.8	Confident	83 Å²	83	78.9 Å²	78.9	31%	0.313	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-64.8	149.5	175.9	71.4	179.8	-176.4	126.6	-2.7	111.8	S181 T247	S181-R218 PolarHBondContact OG-NE 2.9Å; S181-R218 PolarHBondContact OG-NH2 3.4Å; R218-T247 HydrophobicContact CB-CG2 4.38Å
219	E	89.3	Confident	84	Confident	3 Å²	3	75 Å²	75	1%	0.014	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-74.9	140.4	166.6	-69.3	174.4	138.5	0	0	109.1	T225 N226 R359 V360 Y361	E219-T225 WeakPolarHBondContact OE2-CB 3.26Å; E219-T225 WeakPolarHBondContact OE2-CG2 3.45Å; E219-T225 PolarHBondContact OE2-N 2.91Å; E219-T225 PolarHBondContact OE2-OG1 2.96Å; E219-N226 PolarHBondContact O-ND2 3.39Å; E219-R359 HydrophobicContact CG-CB 4.19Å; E219-R359 HydrophobicContact CG-CG 4Å; E219-V360 PolarHBondContact OE1-N 2.75Å; E219-V360 PolarHBondContact OE2-N 3.28Å; E219-Y361 PolarHBondContact OE1-N 3.25Å
220	E	87.1	Confident	85.3	Confident	141 Å²	141	65.8 Å²	65.8	66%	0.659	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-62.3	162.5	177.6	-66.1	175.9	-168.6	0	0	111.3	I223 N226	E220-I223 HydrophobicContact CB-CD1 4.25Å; E220-I223 PolarHBondContact O-N 3.3Å; E220-N226 WeakPolarHBondContact O-CB 3.45Å
221	N	87	Confident	86.6	Confident	54 Å²	54	57.2 Å²	57.2	29%	0.289	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	148.2	174.3	-64.1	-2.5	0	0	0	109.6	D175 I223	D175-N221 WeakPolarHBondContact OD2-CB 3.34Å; D175-N221 PolarHBondContact OD2-ND2 3.4Å; N221-I223 PolarHBondContact O-N 2.85Å; N221-I223 VanDerWaalsContact O-N 3.15Å
222	H	84.3	Confident	88.1	Confident	63 Å²	63	51.1 Å²	51.1	29%	0.292	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	0.6	-174.1	-44	-70.8	0	0	0	115.5	D175 N226 K227	D175-H222 VanDerWaalsContact CG-CE1 3.4Å; D175-H222 IonicContact OD1-CE1 3.02Å; D175-H222 PolarHBondContact OD1-CE1 3.45Å; D175-H222 IonicContact OD1-NE2 3.12Å; D175-H222 PolarHBondContact OD1-NE2 3.17Å; D175-H222 IonicContact OD2-CD2 2.79Å; D175-H222 IonicContact OD2-CE1 3.15Å; D175-H222 IonicContact OD2-NE2 3.41Å; D175-H222 PolarHBondContact OD2-NE2 2.92Å; D175-H222 VanDerWaalsContact OD2-NE2 3.16Å; H222-N226 PolarHBondContact N-O 2.96Å; H222-K227 VanDerWaalsContact C-CA 3.49Å
223	I	86.1	Confident	89.1	Confident	69 Å²	69	47 Å²	47	35%	0.354	24%	0.242	S	C	.	.	S	Bend	trans	-118.6	137.1	-179.3	-59.2	-179.9	0	0	0	111.3	E220 N221 T225 N226 K227 Y361	E220-I223 HydrophobicContact CB-CD1 4.25Å; E220-I223 PolarHBondContact O-N 3.3Å; N221-I223 PolarHBondContact O-N 2.85Å; N221-I223 VanDerWaalsContact O-N 3.15Å; I223-T225 PolarHBondContact O-N 3.4Å; I223-N226 CarbonylContact O-C 3.58Å; I223-N226 WeakPolarHBondContact O-CA 3.42Å; I223-N226 PolarHBondContact O-N 3.13Å; I223-K227 PolarHBondContact O-N 2.79Å; I223-Y361 HydrophobicContact CG2-CD2 3.78Å; I223-Y361 HydrophobicContact CG2-CE2 3.53Å
224	G	88.7	Confident	90.1	Very high	15 Å²	15	43.4 Å²	43.4	16%	0.155	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	55.4	-124.1	172.2	0	0	0	0	0	113.8	N226 K227	G224-N226 PolarHBondContact O-N 3.28Å; G224-K227 VanDerWaalsContact O-CB 3.23Å; G224-K227 WeakPolarHBondContact O-CB 3.35Å; G224-K227 PolarHBondContact O-N 3.06Å; G224-K227 VanDerWaalsContact O-N 3.09Å
225	T	92.1	Very high	90.6	Very high	12 Å²	12	43.4 Å²	43.4	7%	0.074	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-62.8	-22.4	178.7	55.5	0	0	0	0	113.7	E219 I223 I251 R284 I354 V360	E219-T225 WeakPolarHBondContact OE2-CB 3.26Å; E219-T225 WeakPolarHBondContact OE2-CG2 3.45Å; E219-T225 PolarHBondContact OE2-N 2.91Å; E219-T225 PolarHBondContact OE2-OG1 2.96Å; I223-T225 PolarHBondContact O-N 3.4Å; T225-I251 HydrophobicContact CG2-CD1 3.6Å; T225-R284 PolarHBondContact O-NH2 3.45Å; T225-I354 HydrophobicContact CG2-CD1 3.95Å; T225-I354 HydrophobicContact CG2-CG1 3.93Å; T225-I354 HydrophobicContact CG2-CG2 4.22Å; T225-V360 HydrophobicContact CG2-CG2 4.09Å
226	N	93.2	Very high	90.9	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.032	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-102.6	16.1	176.9	-69.9	-40.4	0	0	0	113	E219 E220 H222 I223 G224 K228 V246	E219-N226 PolarHBondContact O-ND2 3.39Å; E220-N226 WeakPolarHBondContact O-CB 3.45Å; H222-N226 PolarHBondContact N-O 2.96Å; I223-N226 CarbonylContact O-C 3.58Å; I223-N226 WeakPolarHBondContact O-CA 3.42Å; I223-N226 PolarHBondContact O-N 3.13Å; G224-N226 PolarHBondContact O-N 3.28Å; N226-K228 VanDerWaalsContact C-N 3.31Å; N226-K228 PolarHBondContact O-N 2.9Å; N226-V246 PolarHBondContact ND2-O 2.93Å; N226-V246 WeakPolarHBondContact OD1-CG1 3.35Å; N226-V246 PolarHBondContact OD1-N 3.06Å
227	K	90.6	Very high	90.6	Very high	50 Å²	50	35.8 Å²	35.8	22%	0.217	18%	0.182	C	C	.	.	S	Bend	trans	-55.5	-40.6	175.9	-174.3	173.1	-168.8	169.9	0	114.3	H222 I223 G224 N324	H222-K227 VanDerWaalsContact C-CA 3.49Å; I223-K227 PolarHBondContact O-N 2.79Å; G224-K227 VanDerWaalsContact O-CB 3.23Å; G224-K227 WeakPolarHBondContact O-CB 3.35Å; G224-K227 PolarHBondContact O-N 3.06Å; G224-K227 VanDerWaalsContact O-N 3.09Å; K227-N324 PolarHBondContact NZ-OD1 2.96Å
228	K	92.8	Very high	90.6	Very high	42 Å²	42	36.3 Å²	36.3	18%	0.183	18%	0.181	C	C	.	.	S	Bend	trans	-113.5	147.6	179.3	-55.7	-62.1	-172.5	-175.1	0	110.6	E169 N226 Y230 R284	E169-K228 HydrophobicContact CB-CD 4.25Å; E169-K228 IonicContact OE1-NZ 3.75Å; E169-K228 PolarHBondContact OE1-NZ 3.41Å; E169-K228 IonicContact OE2-NZ 2.81Å; E169-K228 PolarHBondContact OE2-NZ 3.27Å; N226-K228 VanDerWaalsContact C-N 3.31Å; N226-K228 PolarHBondContact O-N 2.9Å; K228-Y230 HydrophobicContact CB-CE2 3.96Å; K228-Y230 WeakPolarHBondContact O-CD2 3.33Å; K228-Y230 WeakPolarHBondContact O-CE2 3.19Å; K228-R284 PolarHBondContact O-NH2 2.95Å
229	V	94.5	Very high	90.4	Very high	19 Å²	19	40.4 Å²	40.4	12%	0.115	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	146.8	173.8	-178.6	0	0	0	0	109.1	E167 V168 F170 F231 K242	E167-V229 CarbonylContact C-O 3.59Å; E167-V229 WeakPolarHBondContact CA-O 3.42Å; V168-V229 HydrophobicContact CG2-CB 3.82Å; V168-V229 HydrophobicContact CG2-CG1 4.21Å; V168-V229 PolarHBondContact N-O 3.21Å; V168-V229 PolarHBondContact O-N 3.02Å; F170-V229 HydrophobicContact CD2-CB 4.31Å; F170-V229 HydrophobicContact CD2-CG2 3.93Å; F170-V229 HydrophobicContact CE2-CB 3.94Å; F170-V229 HydrophobicContact CE2-CG1 4.04Å; F170-V229 HydrophobicContact CE2-CG2 3.91Å; V229-F231 HydrophobicContact CG1-CD2 4.32Å; V229-F231 HydrophobicContact CG1-CE2 3.84Å; V229-K242 HydrophobicContact CG1-CD 4.38Å; V229-K242 HydrophobicContact CG1-CG 4.03Å
230	Y	96.9	Very high	90.7	Very high	15 Å²	15	41.5 Å²	41.5	6%	0.059	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.8	-176.9	-65.1	-94.7	0	0	0	110.4	W153 I165 V166 E167 K228 L243 R284 I287 S291	W153-Y230 AromaticContact CD1-CE1 3.8Å; W153-Y230 HydrophobicContact CG-CE1 4.24Å; I165-Y230 HydrophobicContact CG2-CD1 3.86Å; V166-Y230 CarbonylContact O-C 3.43Å; V166-Y230 WeakPolarHBondContact O-CA 3.44Å; E167-Y230 HydrophobicContact CB-CD1 3.72Å; E167-Y230 HydrophobicContact CB-CE1 3.52Å; K228-Y230 HydrophobicContact CB-CE2 3.96Å; K228-Y230 WeakPolarHBondContact O-CD2 3.33Å; K228-Y230 WeakPolarHBondContact O-CE2 3.19Å; Y230-L243 WeakPolarHBondContact O-CB 3.44Å; Y230-L243 PolarHBondContact O-N 2.91Å; Y230-R284 VanDerWaalsContact CD2-CZ 3.5Å; Y230-I287 HydrophobicContact CD1-CG2 3.56Å; Y230-I287 HydrophobicContact CD2-CG2 4.28Å; Y230-I287 HydrophobicContact CE1-CG2 3.26Å; Y230-I287 HydrophobicContact CE2-CG2 4.05Å; Y230-I287 HydrophobicContact CG-CG2 4.04Å; Y230-S291 PolarHBondContact OH-OG 2.82Å
231	F	96.9	Very high	91.1	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.8	173.7	-76	-97.3	0	0	0	109.8	L141 Q145 I165 V166 V168 F170 V229 W240 I241 K242	L141-F231 HydrophobicContact CD1-CD1 4.03Å; L141-F231 HydrophobicContact CD1-CE1 4.29Å; L141-F231 HydrophobicContact CD1-CG 4.23Å; L141-F231 HydrophobicContact CD2-CB 4.06Å; L141-F231 HydrophobicContact CD2-CG 4.23Å; Q145-F231 HydrophobicContact CG-CZ 4.31Å; I165-F231 WeakPolarHBondContact CA-O 3.24Å; V166-F231 PolarHBondContact N-O 2.72Å; V166-F231 PolarHBondContact O-N 2.92Å; V168-F231 HydrophobicContact CG1-CD2 4.15Å; V168-F231 HydrophobicContact CG2-CD2 3.75Å; V168-F231 HydrophobicContact CG2-CE2 3.59Å; F170-F231 HydrophobicContact CE2-CE2 4.36Å; F170-F231 HydrophobicContact CZ-CE2 4.14Å; F170-F231 HydrophobicContact CZ-CZ 4.3Å; V229-F231 HydrophobicContact CG1-CD2 4.32Å; V229-F231 HydrophobicContact CG1-CE2 3.84Å; F231-W240 HydrophobicContact CB-CB 4.31Å; F231-W240 HydrophobicContact CB-CD2 4.48Å; F231-W240 HydrophobicContact CB-CE3 3.9Å; F231-W240 HydrophobicContact CD1-CB 3.97Å; F231-I241 CarbonylContact C-O 3.56Å; F231-I241 WeakPolarHBondContact CA-O 3.47Å; F231-K242 HydrophobicContact CD1-CB 4.06Å; F231-K242 HydrophobicContact CE1-CB 3.6Å; F231-K242 HydrophobicContact CE1-CG 4.2Å; F231-K242 HydrophobicContact CE2-CG 4.44Å; F231-K242 HydrophobicContact CZ-CB 3.94Å; F231-K242 HydrophobicContact CZ-CD 4.24Å; F231-K242 HydrophobicContact CZ-CG 4.02Å
232	V	96.7	Very high	91.4	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.5	-179.4	67.8	0	0	0	0	111.5	Y163 Y164 I165 I241 L243 L265 L283	Y163-V232 HydrophobicContact CD1-CG2 3.36Å; Y163-V232 HydrophobicContact CE1-CG2 4.19Å; Y163-V232 HydrophobicContact CG-CG2 3.9Å; Y164-V232 CarbonylContact O-C 3.54Å; Y164-V232 WeakPolarHBondContact O-CA 3.26Å; I165-V232 HydrophobicContact CG1-CG2 4.31Å; V232-I241 HydrophobicContact CG1-CB 4.03Å; V232-I241 WeakPolarHBondContact CG1-O 3.42Å; V232-I241 PolarHBondContact N-O 2.95Å; V232-I241 PolarHBondContact O-N 3.06Å; V232-L243 HydrophobicContact CB-CD1 4.45Å; V232-L243 HydrophobicContact CB-CD2 4.33Å; V232-L243 HydrophobicContact CB-CG 4.28Å; V232-L243 HydrophobicContact CG1-CD2 3.69Å; V232-L243 HydrophobicContact CG1-CG 4.03Å; V232-L265 HydrophobicContact CG1-CD1 3.65Å; V232-L265 HydrophobicContact CG1-CD2 4.06Å; V232-L265 HydrophobicContact CG1-CG 4.47Å; V232-L283 HydrophobicContact CB-CD2 4.48Å; V232-L283 HydrophobicContact CG2-CD2 3.97Å
233	C	94.5	Very high	92	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.007	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.2	173.5	-176.2	0	0	0	0	109.7	Y164 E235 L238 W240	Y164-C233 WeakPolarHBondContact CD2-O 3.2Å; Y164-C233 PolarHBondContact N-O 3.39Å; Y164-C233 PolarHBondContact O-N 2.84Å; C233-E235 PolarHBondContact SG-O 3.38Å; C233-L238 PolarHBondContact SG-O 2.84Å; C233-L238 VanDerWaalsContact SG-O 3.41Å; C233-W240 HydrophobicContact CB-CD2 3.87Å; C233-W240 HydrophobicContact CB-CE3 3.47Å; C233-W240 VanDerWaalsContact CB-CE3 3.47Å; C233-W240 HydrophobicContact CB-CH2 3.9Å; C233-W240 HydrophobicContact CB-CZ2 4.28Å; C233-W240 HydrophobicContact CB-CZ3 3.49Å; C233-W240 VanDerWaalsContact CB-CZ3 3.49Å
234	H	92.9	Very high	92.5	Very high	36 Å²	36	34.9 Å²	34.9	17%	0.167	18%	0.179	C	C	.	.	S	Bend	trans	-80.3	-35.6	179.8	-62.8	-74.3	0	0	0	113.1	Q161 N162 Y163 Y164 L238 G263	Q161-H234 HydrophobicContact CB-CB 4.44Å; Q161-H234 VanDerWaalsContact OE1-CG 3.3Å; Q161-H234 PolarHBondContact OE1-ND1 2.55Å; N162-H234 VanDerWaalsContact O-CA 3.3Å; N162-H234 WeakPolarHBondContact O-CA 3.39Å; Y163-H234 AromaticContact CD1-CE1 3.93Å; Y163-H234 AromaticContact CD1-ND1 3.75Å; Y163-H234 AromaticContact CE1-CE1 3.27Å; Y163-H234 WeakPolarHBondContact CE1-CE1 3.41Å; Y163-H234 AromaticContact CE1-ND1 3.52Å; Y164-H234 WeakPolarHBondContact CE2-O 3.45Å; H234-L238 HydrophobicContact CB-CD1 4.16Å; H234-G263 PolarHBondContact CE1-O 3.4Å; H234-G263 PolarHBondContact ND1-O 3.13Å
235	E	88.6	Confident	92.8	Very high	57 Å²	57	36.5 Å²	36.5	27%	0.266	19%	0.187	S	C	.	.	S	Bend	trans	-149.2	129	-177.1	179.2	156.8	-126.3	0	0	109.2	T81 C233 G237 L238	T81-E235 WeakPolarHBondContact CB-OE2 3.24Å; T81-E235 HydrophobicContact CG2-CG 4.39Å; T81-E235 WeakPolarHBondContact CG2-OE1 3.31Å; T81-E235 WeakPolarHBondContact CG2-OE2 3.17Å; T81-E235 PolarHBondContact OG1-OE1 3.32Å; T81-E235 PolarHBondContact OG1-OE2 3.01Å; C233-E235 PolarHBondContact SG-O 3.38Å; E235-G237 PolarHBondContact O-N 2.88Å; E235-L238 HydrophobicContact CB-CD1 3.93Å; E235-L238 HydrophobicContact CB-CG 4.35Å; E235-L238 WeakPolarHBondContact O-CB 3.43Å; E235-L238 PolarHBondContact O-N 2.85Å
236	P	86.8	Confident	92.9	Very high	5 Å²	5	36 Å²	36	3%	0.032	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	117.7	178.2	-29.4	36.7	0	0	0	111.6	Q85 L133 T137 Y164	Q85-P236 WeakPolarHBondContact CG-O 3.49Å; L133-P236 HydrophobicContact CB-CB 3.59Å; L133-P236 HydrophobicContact CB-CG 4.34Å; T137-P236 HydrophobicContact CG2-CB 4Å; Y164-P236 HydrophobicContact CE2-CG 4.3Å
237	G	82.5	Confident	93.1	Very high	22 Å²	22	36.9 Å²	36.9	23%	0.227	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	117.7	-16	-178.1	0	0	0	0	0	113.7	I84 E235	I84-G237 VanDerWaalsContact CG2-C 3.48Å; I84-G237 WeakPolarHBondContact CG2-O 3.48Å; E235-G237 PolarHBondContact O-N 2.88Å
238	L	88.4	Confident	93.3	Very high	62 Å²	62	34.6 Å²	34.6	33%	0.325	18%	0.18	S	C	.	.	S	Bend	trans	-77.9	159.8	165.8	-63.7	176.1	0	0	0	110.7	I84 C233 H234 E235	I84-L238 HydrophobicContact CD1-CD2 3.92Å; I84-L238 HydrophobicContact CG2-CD2 3.97Å; I84-L238 HydrophobicContact CG2-CG 4.35Å; C233-L238 PolarHBondContact SG-O 2.84Å; C233-L238 VanDerWaalsContact SG-O 3.41Å; H234-L238 HydrophobicContact CB-CD1 4.16Å; E235-L238 HydrophobicContact CB-CD1 3.93Å; E235-L238 HydrophobicContact CB-CG 4.35Å; E235-L238 WeakPolarHBondContact O-CB 3.43Å; E235-L238 PolarHBondContact O-N 2.85Å
239	Q	89	Confident	93.3	Very high	170 Å²	170	37.4 Å²	37.4	79%	0.794	19%	0.193	S	C	*	.	P	Polyproline II helix	trans	-62.5	141.4	176.5	-175.2	175	-2.1	0	0	110.8
240	W	94.2	Very high	93.5	Very high	26 Å²	26	37.1 Å²	37.1	10%	0.098	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-75.4	134.8	172.3	-69.4	100.9	0	0	0	110.8	T137 I138 L141 Y164 V166 F231 C233	T137-W240 PolarHBondContact O-NE1 2.99Å; I138-W240 HydrophobicContact CG1-CZ2 4.16Å; L141-W240 HydrophobicContact CB-CG 4.27Å; L141-W240 HydrophobicContact CD1-CB 3.77Å; L141-W240 HydrophobicContact CD1-CG 3.81Å; L141-W240 HydrophobicContact CD2-CD2 4.01Å; L141-W240 HydrophobicContact CD2-CE3 4.49Å; L141-W240 HydrophobicContact CD2-CG 4.05Å; L141-W240 HydrophobicContact CG-CG 4.27Å; Y164-W240 WeakPolarHBondContact O-CZ3 3.27Å; V166-W240 HydrophobicContact CB-CH2 4.31Å; V166-W240 HydrophobicContact CB-CZ3 4.2Å; V166-W240 HydrophobicContact CG2-CE3 4.5Å; V166-W240 HydrophobicContact CG2-CH2 3.3Å; V166-W240 HydrophobicContact CG2-CZ2 3.88Å; V166-W240 HydrophobicContact CG2-CZ3 3.65Å; F231-W240 HydrophobicContact CB-CB 4.31Å; F231-W240 HydrophobicContact CB-CD2 4.48Å; F231-W240 HydrophobicContact CB-CE3 3.9Å; F231-W240 HydrophobicContact CD1-CB 3.97Å; C233-W240 HydrophobicContact CB-CD2 3.87Å; C233-W240 HydrophobicContact CB-CE3 3.47Å; C233-W240 VanDerWaalsContact CB-CE3 3.47Å; C233-W240 HydrophobicContact CB-CH2 3.9Å; C233-W240 HydrophobicContact CB-CZ2 4.28Å; C233-W240 HydrophobicContact CB-CZ3 3.49Å; C233-W240 VanDerWaalsContact CB-CZ3 3.49Å
241	I	95.3	Very high	93.4	Very high	75 Å²	75	36.4 Å²	36.4	39%	0.385	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.7	179.3	-57.6	169.4	0	0	0	107.3	F231 V232 L243 L265	F231-I241 CarbonylContact C-O 3.56Å; F231-I241 WeakPolarHBondContact CA-O 3.47Å; V232-I241 HydrophobicContact CG1-CB 4.03Å; V232-I241 WeakPolarHBondContact CG1-O 3.42Å; V232-I241 PolarHBondContact N-O 2.95Å; V232-I241 PolarHBondContact O-N 3.06Å; I241-L243 PolarHBondContact O-N 3.22Å; I241-L265 HydrophobicContact CB-CD1 4.2Å; I241-L265 HydrophobicContact CD1-CD1 3.68Å; I241-L265 HydrophobicContact CG2-CD1 3.95Å
242	K	95.2	Very high	93.3	Very high	64 Å²	64	39.4 Å²	39.4	28%	0.278	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	127.2	173.7	-174.6	176.1	172.7	-177.3	0	108.7	I176 D177 V229 F231	I176-K242 PolarHBondContact O-NZ 3.18Å; D177-K242 IonicContact OD2-NZ 3.6Å; V229-K242 HydrophobicContact CG1-CD 4.38Å; V229-K242 HydrophobicContact CG1-CG 4.03Å; F231-K242 HydrophobicContact CD1-CB 4.06Å; F231-K242 HydrophobicContact CE1-CB 3.6Å; F231-K242 HydrophobicContact CE1-CG 4.2Å; F231-K242 HydrophobicContact CE2-CG 4.44Å; F231-K242 HydrophobicContact CZ-CB 3.94Å; F231-K242 HydrophobicContact CZ-CD 4.24Å; F231-K242 HydrophobicContact CZ-CG 4.02Å
243	L	96.5	Very high	93.2	Very high	6 Å²	6	40 Å²	40	3%	0.031	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-76.8	143.3	172.5	-70.3	177.3	0	0	0	109.9	Y230 V232 I241 L265 A280 L283 R284 I287	Y230-L243 WeakPolarHBondContact O-CB 3.44Å; Y230-L243 PolarHBondContact O-N 2.91Å; V232-L243 HydrophobicContact CB-CD1 4.45Å; V232-L243 HydrophobicContact CB-CD2 4.33Å; V232-L243 HydrophobicContact CB-CG 4.28Å; V232-L243 HydrophobicContact CG1-CD2 3.69Å; V232-L243 HydrophobicContact CG1-CG 4.03Å; I241-L243 PolarHBondContact O-N 3.22Å; L243-L265 HydrophobicContact CD2-CD2 4.19Å; L243-A280 HydrophobicContact CD2-CB 4.14Å; L243-L283 HydrophobicContact CD1-CD2 4.12Å; L243-L283 HydrophobicContact CD1-CG 4.19Å; L243-L283 HydrophobicContact CD2-CD2 4.18Å; L243-R284 HydrophobicContact CB-CB 4.44Å; L243-R284 HydrophobicContact CD1-CB 4.45Å; L243-I287 HydrophobicContact CD1-CD1 3.66Å
244	P	95.4	Very high	93.2	Very high	43 Å²	43	39.9 Å²	39.9	28%	0.279	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-63.8	156.2	177	28.1	-34.9	0	0	0	110.8	A280 N281 R284	P244-A280 HydrophobicContact CG-CB 4.46Å; P244-N281 WeakPolarHBondContact CG-ND2 3.41Å; P244-R284 VanDerWaalsContact O-CG 3.28Å; P244-R284 WeakPolarHBondContact O-CG 3.16Å
245	P	94.8	Very high	93.2	Very high	49 Å²	49	42.5 Å²	42.5	32%	0.318	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-59.4	151.7	169.1	27.4	-34.2	0	0	0	110.4
246	V	95.8	Very high	93.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-93.3	143.7	-179.1	71.1	0	0	0	0	111.1	N226 Q250 I251 R284 A285	N226-V246 PolarHBondContact ND2-O 2.93Å; N226-V246 WeakPolarHBondContact OD1-CG1 3.35Å; N226-V246 PolarHBondContact OD1-N 3.06Å; V246-Q250 HydrophobicContact CG2-CB 4.07Å; V246-I251 HydrophobicContact CG1-CD1 3.83Å; V246-I251 HydrophobicContact CG1-CG1 4.45Å; V246-I251 HydrophobicContact CG2-CD1 3.98Å; V246-I251 HydrophobicContact CG2-CG1 3.68Å; V246-R284 HydrophobicContact CB-CG 3.84Å; V246-R284 HydrophobicContact CG2-CG 4.49Å; V246-A285 HydrophobicContact CG2-CB 3.94Å
247	T	95.6	Very high	93.5	Very high	26 Å²	26	40.7 Å²	40.7	16%	0.16	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-100.2	154	171.4	70.7	0	0	0	0	111.6	R218 E249 Q250 I251	R218-T247 HydrophobicContact CB-CG2 4.38Å; T247-E249 PolarHBondContact O-N 2.83Å; T247-Q250 VanDerWaalsContact N-OE1 3.11Å; T247-Q250 WeakPolarHBondContact O-CB 3.32Å; T247-Q250 PolarHBondContact O-N 3.09Å; T247-Q250 VanDerWaalsContact O-N 3.13Å; T247-Q250 VanDerWaalsContact OG1-CD 3.32Å; T247-Q250 VanDerWaalsContact OG1-CG 3.23Å; T247-Q250 WeakPolarHBondContact OG1-CG 3.28Å; T247-Q250 PolarHBondContact OG1-N 3.34Å; T247-I251 PolarHBondContact O-N 2.8Å; T247-I251 VanDerWaalsContact O-N 3.17Å
248	P	95	Very high	93.9	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-37.6	177.3	-24.7	34.7	0	0	0	112	V216 P217 Q250 I251 V252 Q357 R359	V216-P248 HydrophobicContact CB-CB 4.17Å; V216-P248 HydrophobicContact CB-CG 4.46Å; V216-P248 HydrophobicContact CG1-CB 4.03Å; V216-P248 HydrophobicContact CG1-CG 4.05Å; P217-P248 WeakPolarHBondContact O-CG 3.27Å; P248-Q250 VanDerWaalsContact C-N 3.32Å; P248-Q250 PolarHBondContact O-N 3.23Å; P248-I251 PolarHBondContact O-N 2.84Å; P248-I251 VanDerWaalsContact O-N 3.12Å; P248-V252 WeakPolarHBondContact O-CG2 3.31Å; P248-V252 PolarHBondContact O-N 2.86Å; P248-Q357 WeakPolarHBondContact CB-O 3.46Å; P248-R359 HydrophobicContact CB-CG 3.98Å; P248-R359 HydrophobicContact CG-CG 3.46Å; P248-R359 VanDerWaalsContact CG-CG 3.46Å
249	E	94.5	Very high	94	Very high	101 Å²	101	43.6 Å²	43.6	47%	0.472	22%	0.216	S	C	.	.	H	α-helix	trans	-57.8	-43.5	175.3	-162.5	-171.7	164.4	0	0	111.7	T247 I251 V252 A253 P276	T247-E249 PolarHBondContact O-N 2.83Å; E249-I251 PolarHBondContact O-N 2.91Å; E249-V252 PolarHBondContact O-N 3.5Å; E249-A253 VanDerWaalsContact O-CB 3.3Å; E249-A253 WeakPolarHBondContact O-CB 3.45Å; E249-A253 PolarHBondContact O-N 2.97Å; E249-P276 HydrophobicContact CB-CG 4.3Å; E249-P276 HydrophobicContact CG-CG 3.95Å
250	Q	96.8	Very high	94.3	Very high	13 Å²	13	38.6 Å²	38.6	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-42.4	175.1	-72.9	165.9	-1.6	0	0	111.7	V246 T247 P248 A254 F275 P276 N281 A285	V246-Q250 HydrophobicContact CG2-CB 4.07Å; T247-Q250 VanDerWaalsContact N-OE1 3.11Å; T247-Q250 WeakPolarHBondContact O-CB 3.32Å; T247-Q250 PolarHBondContact O-N 3.09Å; T247-Q250 VanDerWaalsContact O-N 3.13Å; T247-Q250 VanDerWaalsContact OG1-CD 3.32Å; T247-Q250 VanDerWaalsContact OG1-CG 3.23Å; T247-Q250 WeakPolarHBondContact OG1-CG 3.28Å; T247-Q250 PolarHBondContact OG1-N 3.34Å; P248-Q250 VanDerWaalsContact C-N 3.32Å; P248-Q250 PolarHBondContact O-N 3.23Å; Q250-A254 WeakPolarHBondContact O-CB 3.42Å; Q250-A254 PolarHBondContact O-N 3.33Å; Q250-F275 HydrophobicContact CB-CE2 4.04Å; Q250-F275 HydrophobicContact CB-CZ 3.93Å; Q250-F275 HydrophobicContact CG-CE2 4.29Å; Q250-F275 HydrophobicContact CG-CZ 3.85Å; Q250-F275 WeakPolarHBondContact O-CE2 3.49Å; Q250-P276 HydrophobicContact CG-CB 4.48Å; Q250-P276 HydrophobicContact CG-CG 3.78Å; Q250-P276 VanDerWaalsContact CG-O 3.22Å; Q250-P276 WeakPolarHBondContact CG-O 3.27Å; Q250-P276 PolarHBondContact NE2-O 3.16Å; Q250-N281 PolarHBondContact NE2-ND2 3.26Å; Q250-N281 VanDerWaalsContact NE2-ND2 3.19Å; Q250-A285 HydrophobicContact CB-CB 4.31Å
251	I	96.5	Very high	94.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-44.8	178.7	-70.5	169.1	0	0	0	110.9	T225 V246 T247 P248 E249 A254 R255 A288 R289 I354 G358	T225-I251 HydrophobicContact CG2-CD1 3.6Å; V246-I251 HydrophobicContact CG1-CD1 3.83Å; V246-I251 HydrophobicContact CG1-CG1 4.45Å; V246-I251 HydrophobicContact CG2-CD1 3.98Å; V246-I251 HydrophobicContact CG2-CG1 3.68Å; T247-I251 PolarHBondContact O-N 2.8Å; T247-I251 VanDerWaalsContact O-N 3.17Å; P248-I251 PolarHBondContact O-N 2.84Å; P248-I251 VanDerWaalsContact O-N 3.12Å; E249-I251 PolarHBondContact O-N 2.91Å; I251-A254 PolarHBondContact O-N 3.04Å; I251-R255 WeakPolarHBondContact O-CG 3.5Å; I251-R255 PolarHBondContact O-N 2.7Å; I251-R255 VanDerWaalsContact O-N 3.13Å; I251-A288 HydrophobicContact CD1-CB 4.37Å; I251-R289 HydrophobicContact CG2-CG 4.32Å; I251-I354 HydrophobicContact CD1-CD1 4.47Å; I251-I354 HydrophobicContact CG2-CG2 3.98Å; I251-G358 WeakPolarHBondContact CD1-O 3.42Å
252	V	94.8	Very high	94.5	Very high	68 Å²	68	34.8 Å²	34.8	41%	0.412	18%	0.178	S	C	.	.	H	α-helix	trans	-63.2	-48.8	178.3	173.8	0	0	0	0	110.4	P248 E249 A254 R255	P248-V252 WeakPolarHBondContact O-CG2 3.31Å; P248-V252 PolarHBondContact O-N 2.86Å; E249-V252 PolarHBondContact O-N 3.5Å; V252-A254 PolarHBondContact O-N 3.28Å; V252-R255 WeakPolarHBondContact O-CB 3.27Å; V252-R255 PolarHBondContact O-N 3Å
253	A	93.9	Very high	94.4	Very high	13 Å²	13	31.8 Å²	31.8	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-44.6	176.3	0	0	0	0	0	111.5	E249 R255 A256 I257 F275	E249-A253 VanDerWaalsContact O-CB 3.3Å; E249-A253 WeakPolarHBondContact O-CB 3.45Å; E249-A253 PolarHBondContact O-N 2.97Å; A253-R255 PolarHBondContact O-N 3.46Å; A253-A256 PolarHBondContact O-N 3.46Å; A253-I257 HydrophobicContact CB-CD1 4.5Å; A253-I257 WeakPolarHBondContact O-CD1 3.43Å; A253-I257 WeakPolarHBondContact O-CG1 3.29Å; A253-I257 PolarHBondContact O-N 3.03Å; A253-F275 HydrophobicContact CB-CD2 3.91Å; A253-F275 HydrophobicContact CB-CE2 4.44Å
254	A	95	Very high	94.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.2	-33.1	178.2	0	0	0	0	0	112.4	Q250 I251 V252 A256 I257 F275 Y282 A285 R289	Q250-A254 WeakPolarHBondContact O-CB 3.42Å; Q250-A254 PolarHBondContact O-N 3.33Å; I251-A254 PolarHBondContact O-N 3.04Å; V252-A254 PolarHBondContact O-N 3.28Å; A254-A256 PolarHBondContact O-N 2.99Å; A254-I257 PolarHBondContact O-N 3.25Å; A254-I257 VanDerWaalsContact O-N 3.12Å; A254-F275 HydrophobicContact CB-CE2 4.29Å; A254-Y282 HydrophobicContact CB-CD2 4.33Å; A254-Y282 HydrophobicContact CB-CE2 4.24Å; A254-A285 HydrophobicContact CB-CB 3.96Å; A254-R289 PolarHBondContact O-NH1 2.87Å
255	R	93.2	Very high	94.4	Very high	90 Å²	90	34.1 Å²	34.1	34%	0.34	17%	0.174	S	C	.	.	H	α-helix	trans	-59.8	-30.5	175.5	-72.4	170	173	167.5	-2	113.5	I251 V252 A253 I354 L355 P356	I251-R255 WeakPolarHBondContact O-CG 3.5Å; I251-R255 PolarHBondContact O-N 2.7Å; I251-R255 VanDerWaalsContact O-N 3.13Å; V252-R255 WeakPolarHBondContact O-CB 3.27Å; V252-R255 PolarHBondContact O-N 3Å; A253-R255 PolarHBondContact O-N 3.46Å; R255-I354 PolarHBondContact NH2-O 2.92Å; R255-L355 PolarHBondContact NH1-O 3.47Å; R255-L355 PolarHBondContact NH2-O 3.43Å; R255-P356 VanDerWaalsContact NH1-C 3.32Å; R255-P356 PolarHBondContact NH1-O 2.91Å
256	A	91.2	Very high	94.5	Very high	17 Å²	17	38.1 Å²	38.1	14%	0.14	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.5	178.8	0	0	0	0	0	113.7	A253 A254 P273 F468 Q471	A253-A256 PolarHBondContact O-N 3.46Å; A254-A256 PolarHBondContact O-N 2.99Å; A256-P273 HydrophobicContact CB-CG 3.74Å; A256-F468 VanDerWaalsContact O-CZ 3.29Å; A256-F468 WeakPolarHBondContact O-CZ 3.42Å; A256-Q471 HydrophobicContact CB-CG 4.33Å
257	I	90.1	Very high	94.4	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.041	20%	0.201	C	C	.	.			trans	-103.4	136.5	-174.7	-63.1	162.4	0	0	0	110.8	A253 A254 R259 C271 F275 Y282	A253-I257 HydrophobicContact CB-CD1 4.5Å; A253-I257 WeakPolarHBondContact O-CD1 3.43Å; A253-I257 WeakPolarHBondContact O-CG1 3.29Å; A253-I257 PolarHBondContact O-N 3.03Å; A254-I257 PolarHBondContact O-N 3.25Å; A254-I257 VanDerWaalsContact O-N 3.12Å; I257-R259 HydrophobicContact CG2-CB 3.79Å; I257-C271 WeakPolarHBondContact CD1-SG 3.4Å; I257-C271 HydrophobicContact CG1-CB 4.48Å; I257-C271 HydrophobicContact CG2-CB 4.43Å; I257-F275 HydrophobicContact CD1-CB 3.73Å; I257-F275 HydrophobicContact CD1-CD2 3.53Å; I257-F275 HydrophobicContact CD1-CG 3.99Å; I257-Y282 HydrophobicContact CB-CE2 4.11Å; I257-Y282 HydrophobicContact CD1-CE2 4.46Å; I257-Y282 HydrophobicContact CG2-CE2 3.8Å
258	H	90.9	Very high	94.4	Very high	73 Å²	73	42.7 Å²	42.7	34%	0.338	22%	0.223	S	C	.	.			trans	-128.8	74.7	172.2	-163.6	89.4	0	0	0	109.8	K462 F468	H258-K462 PolarHBondContact CE1-O 3.46Å; H258-F468 HydrophobicContact CB-CB 4.3Å; H258-F468 HydrophobicContact CB-CD1 3.93Å; H258-F468 HydrophobicContact CB-CD2 3.42Å; H258-F468 VanDerWaalsContact CB-CD2 3.42Å; H258-F468 HydrophobicContact CB-CE1 4.06Å; H258-F468 HydrophobicContact CB-CE2 3.58Å; H258-F468 HydrophobicContact CB-CG 3.6Å; H258-F468 HydrophobicContact CB-CZ 3.89Å
259	R	91.3	Very high	94.3	Very high	72 Å²	72	43.3 Å²	43.3	27%	0.272	23%	0.227	S	C	.	.			trans	-128	136.5	-175.8	-176.2	169.2	174.1	179.7	-10.6	111.6	I257 S270 Y282 L461	I257-R259 HydrophobicContact CG2-CB 3.79Å; R259-S270 PolarHBondContact NH1-O 3.46Å; R259-Y282 PolarHBondContact O-OH 2.82Å; R259-Y282 VanDerWaalsContact O-OH 3.1Å; R259-L461 WeakPolarHBondContact O-CD2 3.44Å
260	L	94.7	Very high	94	Very high	64 Å²	64	43.3 Å²	43.3	34%	0.335	24%	0.238	S	C	.	.			trans	-73.1	145.4	173.8	-64.4	172.6	0	0	0	111.1	L159 W459 L461	L159-L260 HydrophobicContact CD1-CB 4.49Å; L159-L260 HydrophobicContact CD2-CD1 4.1Å; L159-L260 HydrophobicContact CG-CB 4.42Å; L260-W459 HydrophobicContact CD2-CB 4.06Å; L260-W459 HydrophobicContact CD2-CD2 4.19Å; L260-W459 HydrophobicContact CD2-CE3 3.76Å; L260-W459 HydrophobicContact CD2-CG 4.37Å; L260-L461 HydrophobicContact CD2-CD1 3.44Å; L260-L461 VanDerWaalsContact CD2-CD1 3.44Å; L260-L461 HydrophobicContact CD2-CG 4.27Å; L260-L461 HydrophobicContact CG-CD1 4.23Å
261	F	97	Very high	93.7	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-68.6	138.8	175.4	-70.5	-80.7	0	0	0	111.4	I156 G158 L159 Y163 E279 Y282 L283 Q286	I156-F261 HydrophobicContact CG2-CD2 3.4Å; I156-F261 HydrophobicContact CG2-CE2 3.75Å; I156-F261 HydrophobicContact CG2-CG 4.01Å; G158-F261 CarbonylContact C-O 3.4Å; G158-F261 VanDerWaalsContact CA-O 3.28Å; G158-F261 WeakPolarHBondContact CA-O 3.38Å; L159-F261 WeakPolarHBondContact CG-O 3.1Å; L159-F261 PolarHBondContact N-O 3.19Å; Y163-F261 HydrophobicContact CD2-CB 4.45Å; Y163-F261 HydrophobicContact CE2-CB 4.05Å; Y163-F261 HydrophobicContact CE2-CD1 4.04Å; Y163-F261 HydrophobicContact CE2-CG 4.28Å; F261-E279 HydrophobicContact CD1-CG 3.76Å; F261-E279 HydrophobicContact CE1-CG 4.32Å; F261-Y282 HydrophobicContact CD1-CD1 4.07Å; F261-Y282 HydrophobicContact CD1-CE1 4.33Å; F261-Y282 AromaticContact CE1-CD1 3.33Å; F261-Y282 HydrophobicContact CE1-CD1 3.33Å; F261-Y282 AromaticContact CE1-CE1 3.69Å; F261-Y282 HydrophobicContact CE1-CE1 3.69Å; F261-Y282 HydrophobicContact CE1-CG 4.32Å; F261-Y282 HydrophobicContact CE2-CE1 4.14Å; F261-Y282 AromaticContact CZ-CD1 3.66Å; F261-Y282 HydrophobicContact CZ-CD1 3.66Å; F261-Y282 AromaticContact CZ-CE1 3.59Å; F261-Y282 HydrophobicContact CZ-CE1 3.59Å; F261-L283 HydrophobicContact CD1-CB 4.48Å; F261-L283 HydrophobicContact CD1-CD1 4.3Å; F261-L283 HydrophobicContact CE1-CB 3.74Å; F261-L283 HydrophobicContact CE1-CD1 3.77Å; F261-L283 HydrophobicContact CE1-CG 4.37Å; F261-L283 HydrophobicContact CE2-CD1 4.49Å; F261-L283 HydrophobicContact CZ-CB 4.38Å; F261-L283 HydrophobicContact CZ-CD1 3.86Å; F261-Q286 HydrophobicContact CE2-CG 4.26Å; F261-Q286 HydrophobicContact CZ-CB 4.03Å; F261-Q286 HydrophobicContact CZ-CG 3.7Å
262	T	95.5	Very high	93.3	Very high	21 Å²	21	48.7 Å²	48.7	13%	0.129	26%	0.264	C	S	.	.			trans	-77.9	-31.4	173.7	67.7	0	0	0	0	111.4	L159 T160 I264 E279	L159-T262 PolarHBondContact N-O 3.39Å; T160-T262 WeakPolarHBondContact CB-O 3.28Å; T160-T262 PolarHBondContact N-O 3.15Å; T160-T262 PolarHBondContact OG1-O 3Å; T262-I264 PolarHBondContact OG1-N 3.12Å; T262-E279 VanDerWaalsContact CB-OE2 3.29Å; T262-E279 WeakPolarHBondContact CB-OE2 3.2Å; T262-E279 WeakPolarHBondContact CG2-OE2 3.31Å; T262-E279 VanDerWaalsContact N-CD 3.31Å; T262-E279 PolarHBondContact N-OE1 3.39Å; T262-E279 PolarHBondContact N-OE2 3.37Å; T262-E279 VanDerWaalsContact OG1-CD 3.26Å; T262-E279 PolarHBondContact OG1-OE1 3.03Å; T262-E279 PolarHBondContact OG1-OE2 3.07Å
263	G	94.9	Very high	93.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	94.3	10.2	-171.2	0	0	0	0	0	113.4	Q161 Y163 H234 E279	Q161-G263 VanDerWaalsContact O-CA 3.31Å; Q161-G263 WeakPolarHBondContact O-CA 3.42Å; Y163-G263 WeakPolarHBondContact OH-CA 3.14Å; H234-G263 PolarHBondContact CE1-O 3.4Å; H234-G263 PolarHBondContact ND1-O 3.13Å; G263-E279 PolarHBondContact N-OE1 3.39Å
264	I	95.6	Very high	93	Very high	87 Å²	87	50.6 Å²	50.6	45%	0.446	28%	0.276	S	S	.	.			trans	-123.2	114	176.3	-59.7	166.6	0	0	0	108	Y163 T262 D266 S267 E279	Y163-I264 VanDerWaalsContact OH-C 3.23Å; Y163-I264 PolarHBondContact OH-N 3.2Å; T262-I264 PolarHBondContact OG1-N 3.12Å; I264-D266 VanDerWaalsContact C-N 3.29Å; I264-D266 PolarHBondContact O-N 3.19Å; I264-S267 VanDerWaalsContact O-CB 3.24Å; I264-S267 WeakPolarHBondContact O-CB 3.03Å; I264-S267 PolarHBondContact O-N 3.32Å; I264-S267 VanDerWaalsContact O-N 3.09Å; I264-E279 WeakPolarHBondContact O-CB 3.34Å
265	L	95.8	Very high	93	Very high	12 Å²	12	51.4 Å²	51.4	6%	0.063	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-35.2	-173	-69.1	173.6	0	0	0	113.5	Y163 V232 I241 L243 S267 N278 E279 A280 L283	Y163-L265 HydrophobicContact CD1-CD2 4.35Å; Y163-L265 HydrophobicContact CE1-CD2 3.49Å; Y163-L265 VanDerWaalsContact CE1-CD2 3.49Å; Y163-L265 HydrophobicContact CE1-CG 3.87Å; Y163-L265 PolarHBondContact OH-N 2.96Å; V232-L265 HydrophobicContact CG1-CD1 3.65Å; V232-L265 HydrophobicContact CG1-CD2 4.06Å; V232-L265 HydrophobicContact CG1-CG 4.47Å; I241-L265 HydrophobicContact CB-CD1 4.2Å; I241-L265 HydrophobicContact CD1-CD1 3.68Å; I241-L265 HydrophobicContact CG2-CD1 3.95Å; L243-L265 HydrophobicContact CD2-CD2 4.19Å; L265-S267 VanDerWaalsContact C-N 3.26Å; L265-S267 PolarHBondContact O-N 2.86Å; L265-N278 VanDerWaalsContact O-CG 3.28Å; L265-N278 PolarHBondContact O-ND2 3.31Å; L265-E279 PolarHBondContact O-N 3.21Å; L265-A280 HydrophobicContact CB-CB 4.12Å; L265-A280 HydrophobicContact CD2-CB 4.04Å; L265-A280 PolarHBondContact O-N 2.92Å; L265-L283 HydrophobicContact CD2-CD2 4.01Å
266	D	96	Very high	93	Very high	132 Å²	132	48.7 Å²	48.7	71%	0.706	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	0.7	-179.2	-56.8	-40.5	0	0	0	113.6	I264	I264-D266 VanDerWaalsContact C-N 3.29Å; I264-D266 PolarHBondContact O-N 3.19Å
267	S	95.2	Very high	93.2	Very high	26 Å²	26	49.8 Å²	49.8	18%	0.182	29%	0.287	C	S	.	.			trans	-67.4	135.3	-178.2	-161	0	0	0	0	111.3	I264 L265 E279	I264-S267 VanDerWaalsContact O-CB 3.24Å; I264-S267 WeakPolarHBondContact O-CB 3.03Å; I264-S267 PolarHBondContact O-N 3.32Å; I264-S267 VanDerWaalsContact O-N 3.09Å; L265-S267 VanDerWaalsContact C-N 3.26Å; L265-S267 PolarHBondContact O-N 2.86Å; S267-E279 PolarHBondContact O-N 2.83Å
268	P	94.8	Very high	93.5	Very high	97 Å²	97	51.5 Å²	51.5	63%	0.63	30%	0.296	S	S	*	.	B	Isolated β-bridge	trans	-72.1	136.4	175.9	28.7	-34.2	0	0	0	111.7	S270	P268-S270 VanDerWaalsContact C-N 3.34Å; P268-S270 PolarHBondContact O-N 3.46Å
269	V	92.7	Very high	93.8	Very high	15 Å²	15	48.3 Å²	48.3	9%	0.091	28%	0.281	C	S	.	.			trans	-85.9	75.6	179	-169.2	0	0	0	0	110.1	C271 F275 E279 Y282	V269-C271 PolarHBondContact O-N 2.88Å; V269-C271 PolarHBondContact O-SG 3.03Å; V269-F275 HydrophobicContact CB-CB 4.03Å; V269-F275 HydrophobicContact CB-CD1 3.99Å; V269-F275 HydrophobicContact CB-CG 4.29Å; V269-F275 HydrophobicContact CG1-CB 4.02Å; V269-F275 HydrophobicContact CG1-CD1 4.4Å; V269-F275 HydrophobicContact CG1-CG 4.3Å; V269-F275 HydrophobicContact CG2-CD1 3.96Å; V269-E279 HydrophobicContact CG2-CB 4.47Å; V269-Y282 HydrophobicContact CG2-CG 4.47Å
270	S	89.3	Confident	94.1	Very high	101 Å²	101	45.3 Å²	45.3	71%	0.706	27%	0.272	S	S	*	.			trans	-62.3	93.8	171.6	-172	0	0	0	0	113	R259 P268	R259-S270 PolarHBondContact NH1-O 3.46Å; P268-S270 VanDerWaalsContact C-N 3.34Å; P268-S270 PolarHBondContact O-N 3.46Å
271	C	90.1	Very high	94.3	Very high	37 Å²	37	43.5 Å²	43.5	25%	0.25	26%	0.262	C	S	.	.			trans	-149	173.5	177.7	61.3	0	0	0	0	111.8	I257 V269 P273	I257-C271 WeakPolarHBondContact CD1-SG 3.4Å; I257-C271 HydrophobicContact CG1-CB 4.48Å; I257-C271 HydrophobicContact CG2-CB 4.43Å; V269-C271 PolarHBondContact O-N 2.88Å; V269-C271 PolarHBondContact O-SG 3.03Å; C271-P273 CarbonylContact C-O 3.5Å; C271-P273 CarbonylContact O-C 3.59Å; C271-P273 PolarHBondContact SG-O 3.43Å
272	Y	86.6	Confident	94.3	Very high	89 Å²	89	43.6 Å²	43.6	35%	0.349	26%	0.263	S	S	.	.	S	Bend	trans	-125	130.5	168.5	-173.5	-96.9	0	0	0	109.6	Q471 Q473 P474	Y272-Q471 HydrophobicContact CD1-CB 4.33Å; Y272-Q471 WeakPolarHBondContact CD1-O 3.31Å; Y272-Q471 HydrophobicContact CE1-CB 4Å; Y272-Q471 WeakPolarHBondContact CE1-O 3.25Å; Y272-Q473 HydrophobicContact CE1-CG 4.22Å; Y272-Q473 HydrophobicContact CE2-CG 4.27Å; Y272-Q473 WeakPolarHBondContact OH-CA 3.12Å; Y272-P474 WeakPolarHBondContact OH-CD 3.5Å
273	P	90.5	Very high	94.4	Very high	22 Å²	22	42.6 Å²	42.6	14%	0.143	26%	0.257	C	S	.	.	S	Bend	cis	-61.1	157.4	-4.5	28.9	-36.2	0	0	0	112.1	A256 C271 F275	A256-P273 HydrophobicContact CB-CG 3.74Å; C271-P273 CarbonylContact C-O 3.5Å; C271-P273 CarbonylContact O-C 3.59Å; C271-P273 PolarHBondContact SG-O 3.43Å; P273-F275 PolarHBondContact O-N 2.97Å
274	P	91.9	Very high	94.5	Very high	98 Å²	98	42.9 Å²	42.9	64%	0.636	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-56	134.6	176.4	-24.1	34.7	0	0	0	110.8
275	F	95.2	Very high	94.6	Very high	18 Å²	18	38.7 Å²	38.7	8%	0.079	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-92.9	129.8	177.3	-177.1	-100.1	0	0	0	110.6	Q250 A253 A254 I257 V269 P273 G277 N281 Y282	Q250-F275 HydrophobicContact CB-CE2 4.04Å; Q250-F275 HydrophobicContact CB-CZ 3.93Å; Q250-F275 HydrophobicContact CG-CE2 4.29Å; Q250-F275 HydrophobicContact CG-CZ 3.85Å; Q250-F275 WeakPolarHBondContact O-CE2 3.49Å; A253-F275 HydrophobicContact CB-CD2 3.91Å; A253-F275 HydrophobicContact CB-CE2 4.44Å; A254-F275 HydrophobicContact CB-CE2 4.29Å; I257-F275 HydrophobicContact CD1-CB 3.73Å; I257-F275 HydrophobicContact CD1-CD2 3.53Å; I257-F275 HydrophobicContact CD1-CG 3.99Å; V269-F275 HydrophobicContact CB-CB 4.03Å; V269-F275 HydrophobicContact CB-CD1 3.99Å; V269-F275 HydrophobicContact CB-CG 4.29Å; V269-F275 HydrophobicContact CG1-CB 4.02Å; V269-F275 HydrophobicContact CG1-CD1 4.4Å; V269-F275 HydrophobicContact CG1-CG 4.3Å; V269-F275 HydrophobicContact CG2-CD1 3.96Å; P273-F275 PolarHBondContact O-N 2.97Å; F275-G277 PolarHBondContact O-N 3.41Å; F275-G277 VanDerWaalsContact O-N 3.1Å; F275-N281 HydrophobicContact CE1-CB 3.84Å; F275-N281 HydrophobicContact CZ-CB 4.16Å; F275-Y282 HydrophobicContact CD2-CD2 4.22Å; F275-Y282 AromaticContact CE2-CD2 3.95Å; F275-Y282 HydrophobicContact CE2-CD2 3.95Å; F275-Y282 HydrophobicContact CZ-CD2 4.2Å; F275-Y282 HydrophobicContact CZ-CG 4.48Å
276	P	94.2	Very high	94.7	Very high	33 Å²	33	38.2 Å²	38.2	21%	0.214	23%	0.234	C	C	.	.	S	Bend	trans	-78.4	93	177.6	30.2	-33.3	0	0	0	111.2	E249 Q250	E249-P276 HydrophobicContact CB-CG 4.3Å; E249-P276 HydrophobicContact CG-CG 3.95Å; Q250-P276 HydrophobicContact CG-CB 4.48Å; Q250-P276 HydrophobicContact CG-CG 3.78Å; Q250-P276 VanDerWaalsContact CG-O 3.22Å; Q250-P276 WeakPolarHBondContact CG-O 3.27Å; Q250-P276 PolarHBondContact NE2-O 3.16Å
277	G	95.2	Very high	94.8	Very high	40 Å²	40	31.9 Å²	31.9	41%	0.412	20%	0.2	S	C	.	.	S	Bend	trans	129.7	-168.7	174.7	0	0	0	0	0	113.7	F275	F275-G277 PolarHBondContact O-N 3.41Å; F275-G277 VanDerWaalsContact O-N 3.1Å
278	N	96.7	Very high	94.9	Very high	43 Å²	43	31 Å²	31	23%	0.23	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-99.1	-172.5	179	67.1	9.7	0	0	0	111.8	L265 A280 N281 Y282	L265-N278 VanDerWaalsContact O-CG 3.28Å; L265-N278 PolarHBondContact O-ND2 3.31Å; N278-A280 VanDerWaalsContact C-N 3.25Å; N278-A280 PolarHBondContact O-N 3.19Å; N278-A280 VanDerWaalsContact OD1-CB 3.24Å; N278-A280 WeakPolarHBondContact OD1-CB 3.27Å; N278-A280 PolarHBondContact OD1-N 3.01Å; N278-N281 PolarHBondContact N-OD1 3.35Å; N278-N281 PolarHBondContact O-N 3.31Å; N278-N281 PolarHBondContact OD1-N 2.99Å; N278-N281 PolarHBondContact OD1-OD1 3.22Å; N278-Y282 PolarHBondContact O-N 3.4Å
279	E	97.2	Very high	95	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-29.9	178.6	-172.4	164.2	142.6	0	0	112.9	Y163 F261 T262 G263 I264 L265 S267 V269 Y282 L283	Y163-E279 WeakPolarHBondContact CE2-OE1 3.24Å; Y163-E279 PolarHBondContact OH-OE1 2.92Å; F261-E279 HydrophobicContact CD1-CG 3.76Å; F261-E279 HydrophobicContact CE1-CG 4.32Å; T262-E279 VanDerWaalsContact CB-OE2 3.29Å; T262-E279 WeakPolarHBondContact CB-OE2 3.2Å; T262-E279 WeakPolarHBondContact CG2-OE2 3.31Å; T262-E279 VanDerWaalsContact N-CD 3.31Å; T262-E279 PolarHBondContact N-OE1 3.39Å; T262-E279 PolarHBondContact N-OE2 3.37Å; T262-E279 VanDerWaalsContact OG1-CD 3.26Å; T262-E279 PolarHBondContact OG1-OE1 3.03Å; T262-E279 PolarHBondContact OG1-OE2 3.07Å; G263-E279 PolarHBondContact N-OE1 3.39Å; I264-E279 WeakPolarHBondContact O-CB 3.34Å; L265-E279 PolarHBondContact O-N 3.21Å; S267-E279 PolarHBondContact O-N 2.83Å; V269-E279 HydrophobicContact CG2-CB 4.47Å; E279-Y282 PolarHBondContact O-N 2.78Å; E279-L283 VanDerWaalsContact O-CB 3.22Å; E279-L283 WeakPolarHBondContact O-CB 3.35Å; E279-L283 PolarHBondContact O-N 3.06Å
280	A	97.7	Very high	95.2	Very high	9 Å²	9	26.7 Å²	26.7	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-45.4	173.8	0	0	0	0	0	111.9	L243 P244 L265 N278 L283 R284	L243-A280 HydrophobicContact CD2-CB 4.14Å; P244-A280 HydrophobicContact CG-CB 4.46Å; L265-A280 HydrophobicContact CB-CB 4.12Å; L265-A280 HydrophobicContact CD2-CB 4.04Å; L265-A280 PolarHBondContact O-N 2.92Å; N278-A280 VanDerWaalsContact C-N 3.25Å; N278-A280 PolarHBondContact O-N 3.19Å; N278-A280 VanDerWaalsContact OD1-CB 3.24Å; N278-A280 WeakPolarHBondContact OD1-CB 3.27Å; N278-A280 PolarHBondContact OD1-N 3.01Å; A280-L283 PolarHBondContact O-N 2.79Å; A280-R284 PolarHBondContact O-N 3.47Å
281	N	97.6	Very high	95.6	Very high	26 Å²	26	22.1 Å²	22.1	14%	0.139	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-42.1	174.8	-63.9	109.5	0	0	0	111.5	P244 Q250 F275 N278 R284 A285	P244-N281 WeakPolarHBondContact CG-ND2 3.41Å; Q250-N281 PolarHBondContact NE2-ND2 3.26Å; Q250-N281 VanDerWaalsContact NE2-ND2 3.19Å; F275-N281 HydrophobicContact CE1-CB 3.84Å; F275-N281 HydrophobicContact CZ-CB 4.16Å; N278-N281 PolarHBondContact N-OD1 3.35Å; N278-N281 PolarHBondContact O-N 3.31Å; N278-N281 PolarHBondContact OD1-N 2.99Å; N278-N281 PolarHBondContact OD1-OD1 3.22Å; N281-R284 PolarHBondContact O-N 2.84Å; N281-A285 WeakPolarHBondContact O-CB 3.45Å; N281-A285 PolarHBondContact O-N 3.22Å
282	Y	97.6	Very high	95.8	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-64.8	-40.6	177	179.3	-116.3	0	0	0	111.9	A254 I257 R259 F261 V269 F275 N278 E279 A285 Q286	A254-Y282 HydrophobicContact CB-CD2 4.33Å; A254-Y282 HydrophobicContact CB-CE2 4.24Å; I257-Y282 HydrophobicContact CB-CE2 4.11Å; I257-Y282 HydrophobicContact CD1-CE2 4.46Å; I257-Y282 HydrophobicContact CG2-CE2 3.8Å; R259-Y282 PolarHBondContact O-OH 2.82Å; R259-Y282 VanDerWaalsContact O-OH 3.1Å; F261-Y282 HydrophobicContact CD1-CD1 4.07Å; F261-Y282 HydrophobicContact CD1-CE1 4.33Å; F261-Y282 AromaticContact CE1-CD1 3.33Å; F261-Y282 HydrophobicContact CE1-CD1 3.33Å; F261-Y282 AromaticContact CE1-CE1 3.69Å; F261-Y282 HydrophobicContact CE1-CE1 3.69Å; F261-Y282 HydrophobicContact CE1-CG 4.32Å; F261-Y282 HydrophobicContact CE2-CE1 4.14Å; F261-Y282 AromaticContact CZ-CD1 3.66Å; F261-Y282 HydrophobicContact CZ-CD1 3.66Å; F261-Y282 AromaticContact CZ-CE1 3.59Å; F261-Y282 HydrophobicContact CZ-CE1 3.59Å; V269-Y282 HydrophobicContact CG2-CG 4.47Å; F275-Y282 HydrophobicContact CD2-CD2 4.22Å; F275-Y282 AromaticContact CE2-CD2 3.95Å; F275-Y282 HydrophobicContact CE2-CD2 3.95Å; F275-Y282 HydrophobicContact CZ-CD2 4.2Å; F275-Y282 HydrophobicContact CZ-CG 4.48Å; N278-Y282 PolarHBondContact O-N 3.4Å; E279-Y282 PolarHBondContact O-N 2.78Å; Y282-A285 PolarHBondContact O-N 3.37Å; Y282-Q286 HydrophobicContact CD2-CG 4.37Å; Y282-Q286 HydrophobicContact CE1-CG 4.16Å; Y282-Q286 HydrophobicContact CE2-CG 3.98Å; Y282-Q286 WeakPolarHBondContact O-CG 3.44Å; Y282-Q286 PolarHBondContact O-N 3.11Å
283	L	98	Very high	96.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.1	-48.8	174.8	-179.6	61.4	0	0	0	110.6	I156 Y163 V232 L243 F261 L265 E279 A280 A285 Q286 I287	I156-L283 HydrophobicContact CB-CD1 4.46Å; I156-L283 HydrophobicContact CD1-CD1 3.46Å; I156-L283 VanDerWaalsContact CD1-CD1 3.46Å; I156-L283 HydrophobicContact CG2-CD1 4.43Å; Y163-L283 HydrophobicContact CD1-CD2 4.11Å; Y163-L283 HydrophobicContact CD2-CD1 4.14Å; Y163-L283 HydrophobicContact CD2-CD2 3.91Å; Y163-L283 HydrophobicContact CE1-CD2 4.31Å; Y163-L283 HydrophobicContact CE2-CD2 4.17Å; Y163-L283 HydrophobicContact CG-CD2 3.85Å; V232-L283 HydrophobicContact CB-CD2 4.48Å; V232-L283 HydrophobicContact CG2-CD2 3.97Å; L243-L283 HydrophobicContact CD1-CD2 4.12Å; L243-L283 HydrophobicContact CD1-CG 4.19Å; L243-L283 HydrophobicContact CD2-CD2 4.18Å; F261-L283 HydrophobicContact CD1-CB 4.48Å; F261-L283 HydrophobicContact CD1-CD1 4.3Å; F261-L283 HydrophobicContact CE1-CB 3.74Å; F261-L283 HydrophobicContact CE1-CD1 3.77Å; F261-L283 HydrophobicContact CE1-CG 4.37Å; F261-L283 HydrophobicContact CE2-CD1 4.49Å; F261-L283 HydrophobicContact CZ-CB 4.38Å; F261-L283 HydrophobicContact CZ-CD1 3.86Å; L265-L283 HydrophobicContact CD2-CD2 4.01Å; E279-L283 VanDerWaalsContact O-CB 3.22Å; E279-L283 WeakPolarHBondContact O-CB 3.35Å; E279-L283 PolarHBondContact O-N 3.06Å; A280-L283 PolarHBondContact O-N 2.79Å; L283-A285 VanDerWaalsContact C-N 3.32Å; L283-A285 PolarHBondContact O-N 3.11Å; L283-Q286 PolarHBondContact O-N 2.94Å; L283-I287 HydrophobicContact CD1-CD1 4.2Å; L283-I287 HydrophobicContact CD1-CG1 4.5Å; L283-I287 HydrophobicContact CG-CD1 3.92Å; L283-I287 WeakPolarHBondContact O-CD1 3.37Å; L283-I287 VanDerWaalsContact O-CG1 3.27Å; L283-I287 WeakPolarHBondContact O-CG1 3.23Å; L283-I287 PolarHBondContact O-N 3.46Å
284	R	97.6	Very high	96.5	Very high	5 Å²	5	18 Å²	18	2%	0.019	12%	0.117	C	C	.	.	H	α-helix	trans	-60.1	-41.5	176.7	-177.1	69.8	-175.4	74.1	-1.5	112.3	T225 K228 Y230 L243 P244 V246 A280 N281 I287 A288	T225-R284 PolarHBondContact O-NH2 3.45Å; K228-R284 PolarHBondContact O-NH2 2.95Å; Y230-R284 VanDerWaalsContact CD2-CZ 3.5Å; L243-R284 HydrophobicContact CB-CB 4.44Å; L243-R284 HydrophobicContact CD1-CB 4.45Å; P244-R284 VanDerWaalsContact O-CG 3.28Å; P244-R284 WeakPolarHBondContact O-CG 3.16Å; V246-R284 HydrophobicContact CB-CG 3.84Å; V246-R284 HydrophobicContact CG2-CG 4.49Å; A280-R284 PolarHBondContact O-N 3.47Å; N281-R284 PolarHBondContact O-N 2.84Å; R284-I287 PolarHBondContact O-N 3Å; R284-A288 PolarHBondContact O-N 2.95Å
285	A	97.5	Very high	96.7	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.9	-41.2	176.6	0	0	0	0	0	112.2	V246 Q250 A254 N281 Y282 L283 A288 R289	V246-A285 HydrophobicContact CG2-CB 3.94Å; Q250-A285 HydrophobicContact CB-CB 4.31Å; A254-A285 HydrophobicContact CB-CB 3.96Å; N281-A285 WeakPolarHBondContact O-CB 3.45Å; N281-A285 PolarHBondContact O-N 3.22Å; Y282-A285 PolarHBondContact O-N 3.37Å; L283-A285 VanDerWaalsContact C-N 3.32Å; L283-A285 PolarHBondContact O-N 3.11Å; A285-A288 PolarHBondContact O-N 3.29Å; A285-R289 VanDerWaalsContact O-CG 3.27Å; A285-R289 WeakPolarHBondContact O-CG 3.43Å; A285-R289 PolarHBondContact O-N 2.83Å
286	Q	97.4	Very high	96.8	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-41.8	174.5	-69.7	-54.9	84.2	0	0	112.1	F261 Y282 L283 A288 R289 I290 G460	F261-Q286 HydrophobicContact CE2-CG 4.26Å; F261-Q286 HydrophobicContact CZ-CB 4.03Å; F261-Q286 HydrophobicContact CZ-CG 3.7Å; Y282-Q286 HydrophobicContact CD2-CG 4.37Å; Y282-Q286 HydrophobicContact CE1-CG 4.16Å; Y282-Q286 HydrophobicContact CE2-CG 3.98Å; Y282-Q286 WeakPolarHBondContact O-CG 3.44Å; Y282-Q286 PolarHBondContact O-N 3.11Å; L283-Q286 PolarHBondContact O-N 2.94Å; Q286-A288 VanDerWaalsContact C-N 3.34Å; Q286-A288 PolarHBondContact O-N 3.19Å; Q286-R289 PolarHBondContact O-N 3.46Å; Q286-I290 WeakPolarHBondContact O-CB 3.38Å; Q286-I290 WeakPolarHBondContact O-CD1 3.35Å; Q286-I290 VanDerWaalsContact O-CG1 3.23Å; Q286-I290 WeakPolarHBondContact O-CG1 3.48Å; Q286-I290 PolarHBondContact O-N 3.5Å; Q286-G460 PolarHBondContact NE2-O 3.27Å
287	I	97.9	Very high	96.9	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-58.1	-48.1	174.7	-69.9	161.6	0	0	0	110.1	W153 I156 I165 Y230 L243 L283 R284 R289 I290 S291	W153-I287 HydrophobicContact CD2-CG2 4.45Å; W153-I287 HydrophobicContact CH2-CG1 4.01Å; W153-I287 HydrophobicContact CZ2-CB 4.27Å; W153-I287 HydrophobicContact CZ2-CG1 4.17Å; W153-I287 HydrophobicContact CZ2-CG2 4.04Å; W153-I287 HydrophobicContact CZ3-CG1 4.22Å; I156-I287 HydrophobicContact CD1-CG1 4.34Å; I165-I287 HydrophobicContact CD1-CD1 4.4Å; I165-I287 HydrophobicContact CG1-CD1 4.11Å; I165-I287 HydrophobicContact CG2-CD1 3.86Å; Y230-I287 HydrophobicContact CD1-CG2 3.56Å; Y230-I287 HydrophobicContact CD2-CG2 4.28Å; Y230-I287 HydrophobicContact CE1-CG2 3.26Å; Y230-I287 HydrophobicContact CE2-CG2 4.05Å; Y230-I287 HydrophobicContact CG-CG2 4.04Å; L243-I287 HydrophobicContact CD1-CD1 3.66Å; L283-I287 HydrophobicContact CD1-CD1 4.2Å; L283-I287 HydrophobicContact CD1-CG1 4.5Å; L283-I287 HydrophobicContact CG-CD1 3.92Å; L283-I287 WeakPolarHBondContact O-CD1 3.37Å; L283-I287 VanDerWaalsContact O-CG1 3.27Å; L283-I287 WeakPolarHBondContact O-CG1 3.23Å; L283-I287 PolarHBondContact O-N 3.46Å; R284-I287 PolarHBondContact O-N 3Å; I287-R289 VanDerWaalsContact C-N 3.35Å; I287-R289 PolarHBondContact O-N 2.82Å; I287-I290 PolarHBondContact O-N 3.32Å; I287-S291 VanDerWaalsContact O-CB 3.31Å; I287-S291 WeakPolarHBondContact O-CB 3.48Å; I287-S291 PolarHBondContact O-N 2.9Å; I287-S291 PolarHBondContact O-OG 3.39Å; I287-S291 VanDerWaalsContact O-OG 3.13Å
288	A	97.4	Very high	97	Very high	7 Å²	7	9.4 Å²	9.4	6%	0.058	6%	0.055	C	C	.	.	H	α-helix	trans	-55.9	-49	176.9	0	0	0	0	0	111.7	I251 R284 A285 Q286 I290 S291 A292 I354	I251-A288 HydrophobicContact CD1-CB 4.37Å; R284-A288 PolarHBondContact O-N 2.95Å; A285-A288 PolarHBondContact O-N 3.29Å; Q286-A288 VanDerWaalsContact C-N 3.34Å; Q286-A288 PolarHBondContact O-N 3.19Å; A288-I290 PolarHBondContact O-N 2.84Å; A288-S291 PolarHBondContact O-N 2.66Å; A288-A292 VanDerWaalsContact O-CB 3.27Å; A288-A292 WeakPolarHBondContact O-CB 3.32Å; A288-A292 PolarHBondContact O-N 3.28Å; A288-I354 HydrophobicContact CB-CD1 4.13Å
289	R	97	Very high	96.9	Very high	22 Å²	22	11.7 Å²	11.7	8%	0.083	7%	0.065	C	C	.	.	H	α-helix	trans	-64.2	-40.9	-179.3	-70.3	173.3	62.8	-161	8.4	113.2	I251 A254 A285 Q286 I287 S293 W440	I251-R289 HydrophobicContact CG2-CG 4.32Å; A254-R289 PolarHBondContact O-NH1 2.87Å; A285-R289 VanDerWaalsContact O-CG 3.27Å; A285-R289 WeakPolarHBondContact O-CG 3.43Å; A285-R289 PolarHBondContact O-N 2.83Å; Q286-R289 PolarHBondContact O-N 3.46Å; I287-R289 VanDerWaalsContact C-N 3.35Å; I287-R289 PolarHBondContact O-N 2.82Å; R289-S293 PolarHBondContact O-OG 3.39Å; R289-W440 HydrophobicContact CB-CH2 4.17Å; R289-W440 HydrophobicContact CB-CZ2 3.88Å
290	I	97.5	Very high	96.7	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-67.3	-53.6	177.3	-69.2	163.3	0	0	0	108.4	W153 Q286 I287 A288 A292 S293 T294 W440 Y456	W153-I290 HydrophobicContact CH2-CB 4.28Å; W153-I290 HydrophobicContact CH2-CD1 3.91Å; W153-I290 HydrophobicContact CH2-CG2 4.03Å; W153-I290 HydrophobicContact CZ2-CB 3.86Å; W153-I290 HydrophobicContact CZ2-CD1 4.36Å; W153-I290 HydrophobicContact CZ2-CG2 3.61Å; Q286-I290 WeakPolarHBondContact O-CB 3.38Å; Q286-I290 WeakPolarHBondContact O-CD1 3.35Å; Q286-I290 VanDerWaalsContact O-CG1 3.23Å; Q286-I290 WeakPolarHBondContact O-CG1 3.48Å; Q286-I290 PolarHBondContact O-N 3.5Å; I287-I290 PolarHBondContact O-N 3.32Å; A288-I290 PolarHBondContact O-N 2.84Å; I290-A292 VanDerWaalsContact C-N 3.34Å; I290-A292 PolarHBondContact O-N 3.04Å; I290-S293 PolarHBondContact O-N 3.48Å; I290-S293 PolarHBondContact O-OG 2.98Å; I290-T294 HydrophobicContact CG2-CG2 4.29Å; I290-T294 WeakPolarHBondContact O-CG2 3.26Å; I290-T294 PolarHBondContact O-N 2.82Å; I290-T294 PolarHBondContact O-OG1 2.7Å; I290-W440 HydrophobicContact CD1-CE3 3.98Å; I290-W440 HydrophobicContact CD1-CZ3 3.95Å; I290-W440 HydrophobicContact CG1-CD2 3.67Å; I290-W440 HydrophobicContact CG1-CE3 3.4Å; I290-W440 VanDerWaalsContact CG1-CE3 3.4Å; I290-W440 HydrophobicContact CG1-CG 4.31Å; I290-W440 HydrophobicContact CG1-CH2 3.91Å; I290-W440 HydrophobicContact CG1-CZ2 4.17Å; I290-W440 HydrophobicContact CG1-CZ3 3.52Å; I290-Y456 HydrophobicContact CD1-CD1 4.46Å; I290-Y456 HydrophobicContact CD1-CD2 4.3Å; I290-Y456 HydrophobicContact CD1-CE1 4.16Å; I290-Y456 HydrophobicContact CD1-CE2 4.01Å; I290-Y456 HydrophobicContact CG1-CE2 4.5Å; I290-Y456 HydrophobicContact CG2-CD2 3.63Å; I290-Y456 HydrophobicContact CG2-CE2 4.14Å; I290-Y456 HydrophobicContact CG2-CG 4.15Å
291	S	96.7	Very high	96.6	Very high	5 Å²	5	13.9 Å²	13.9	4%	0.035	8%	0.081	C	C	.	.	H	α-helix	trans	-52.8	-50	-179.8	-70	0	0	0	0	112.1	W153 Y230 I287 A288 S293 T294 Q295	W153-S291 PolarHBondContact NE1-OG 3.04Å; Y230-S291 PolarHBondContact OH-OG 2.82Å; I287-S291 VanDerWaalsContact O-CB 3.31Å; I287-S291 WeakPolarHBondContact O-CB 3.48Å; I287-S291 PolarHBondContact O-N 2.9Å; I287-S291 PolarHBondContact O-OG 3.39Å; I287-S291 VanDerWaalsContact O-OG 3.13Å; A288-S291 PolarHBondContact O-N 2.66Å; S291-S293 PolarHBondContact O-N 3.1Å; S291-T294 PolarHBondContact O-N 3.29Å; S291-Q295 VanDerWaalsContact O-CB 3.28Å; S291-Q295 WeakPolarHBondContact O-CB 3.42Å; S291-Q295 WeakPolarHBondContact O-CG 3.39Å; S291-Q295 PolarHBondContact O-N 3.29Å; S291-Q295 VanDerWaalsContact O-N 3.13Å
292	A	95.4	Very high	96.4	Very high	15 Å²	15	14.7 Å²	14.7	12%	0.124	8%	0.082	C	C	.	.	H	α-helix	trans	-62.5	-16.1	-179.5	0	0	0	0	0	115.3	A288 I290 S352 I354	A288-A292 VanDerWaalsContact O-CB 3.27Å; A288-A292 WeakPolarHBondContact O-CB 3.32Å; A288-A292 PolarHBondContact O-N 3.28Å; I290-A292 VanDerWaalsContact C-N 3.34Å; I290-A292 PolarHBondContact O-N 3.04Å; A292-S352 WeakPolarHBondContact CB-O 3.46Å; A292-I354 HydrophobicContact CB-CD1 3.56Å; A292-I354 HydrophobicContact CB-CG1 3.6Å
293	S	94.2	Very high	96.1	Very high	37 Å²	37	17.1 Å²	17.1	26%	0.259	10%	0.098	S	C	.	.	H	α-helix	trans	-119.2	-8.7	-177.3	58	0	0	0	0	114.4	R289 I290 S291 W418 W440	R289-S293 PolarHBondContact O-OG 3.39Å; I290-S293 PolarHBondContact O-N 3.48Å; I290-S293 PolarHBondContact O-OG 2.98Å; S291-S293 PolarHBondContact O-N 3.1Å; S293-W418 WeakPolarHBondContact O-CZ2 3.47Å; S293-W440 PolarHBondContact OG-NE1 2.94Å
294	T	96	Very high	95.4	Very high	8 Å²	8	20.1 Å²	20.1	5%	0.049	11%	0.111	C	C	.	.	H	α-helix	trans	-127.2	-9.6	-174.2	71.8	0	0	0	0	114.7	I290 S291 I296 W440 A443	I290-T294 HydrophobicContact CG2-CG2 4.29Å; I290-T294 WeakPolarHBondContact O-CG2 3.26Å; I290-T294 PolarHBondContact O-N 2.82Å; I290-T294 PolarHBondContact O-OG1 2.7Å; S291-T294 PolarHBondContact O-N 3.29Å; T294-I296 PolarHBondContact O-N 2.85Å; T294-I296 VanDerWaalsContact O-N 3.17Å; T294-W440 HydrophobicContact CG2-CB 3.69Å; T294-W440 HydrophobicContact CG2-CG 3.95Å; T294-A443 HydrophobicContact CG2-CB 3.52Å
295	Q	96.1	Very high	94.3	Very high	8 Å²	8	20.9 Å²	20.9	4%	0.037	12%	0.12	C	C	.	.			trans	-81.4	98.1	178.8	-64.1	-68.8	-10.7	0	0	109.9	S291 H350 T351 N454	S291-Q295 VanDerWaalsContact O-CB 3.28Å; S291-Q295 WeakPolarHBondContact O-CB 3.42Å; S291-Q295 WeakPolarHBondContact O-CG 3.39Å; S291-Q295 PolarHBondContact O-N 3.29Å; S291-Q295 VanDerWaalsContact O-N 3.13Å; Q295-H350 PolarHBondContact O-N 2.94Å; Q295-T351 WeakPolarHBondContact CB-OG1 3.44Å; Q295-N454 WeakPolarHBondContact CA-ND2 3.32Å; Q295-N454 PolarHBondContact OE1-ND2 3.38Å
296	I	97.4	Very high	92.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156.6	-175.3	63.9	168.4	0	0	0	110.4	T294 W347 V348 H350 I406 W418 V435 A445 F452 N454	T294-I296 PolarHBondContact O-N 2.85Å; T294-I296 VanDerWaalsContact O-N 3.17Å; I296-W347 HydrophobicContact CD1-CD2 4.34Å; I296-W347 HydrophobicContact CD1-CE3 3.76Å; I296-W347 HydrophobicContact CD1-CZ3 4.34Å; I296-W347 HydrophobicContact CG1-CE3 4.03Å; I296-W347 HydrophobicContact CG1-CZ3 4.41Å; I296-V348 CarbonylContact C-O 3.56Å; I296-V348 WeakPolarHBondContact CA-O 3.34Å; I296-V348 WeakPolarHBondContact CB-O 3.33Å; I296-H350 VanDerWaalsContact C-CE1 3.49Å; I296-H350 VanDerWaalsContact C-ND1 3.29Å; I296-H350 PolarHBondContact O-CE1 2.98Å; I296-H350 VanDerWaalsContact O-CE1 3.31Å; I296-I406 HydrophobicContact CB-CG2 4.26Å; I296-I406 HydrophobicContact CD1-CD1 4.11Å; I296-I406 HydrophobicContact CG2-CG2 3.62Å; I296-W418 HydrophobicContact CD1-CE3 4.3Å; I296-W418 HydrophobicContact CD1-CH2 3.85Å; I296-W418 HydrophobicContact CD1-CZ3 3.73Å; I296-W418 HydrophobicContact CG1-CH2 4.25Å; I296-W418 HydrophobicContact CG1-CZ3 4.47Å; I296-W418 HydrophobicContact CG2-CH2 3.63Å; I296-W418 HydrophobicContact CG2-CZ2 3.82Å; I296-V435 HydrophobicContact CD1-CB 3.92Å; I296-V435 HydrophobicContact CD1-CG1 3.58Å; I296-A445 HydrophobicContact CD1-CB 3.73Å; I296-A445 HydrophobicContact CG1-CB 3.48Å; I296-A445 VanDerWaalsContact CG1-CB 3.48Å; I296-F452 WeakPolarHBondContact O-CE2 3.24Å; I296-N454 PolarHBondContact N-ND2 3.27Å; I296-N454 PolarHBondContact O-ND2 3.14Å; I296-N454 PolarHBondContact O-OD1 2.82Å
297	S	96.9	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158	177.7	51.9	0	0	0	0	110.4	Y302 W347 V348 H350	S297-Y302 WeakPolarHBondContact OG-CD2 3.33Å; S297-W347 WeakPolarHBondContact O-CA 3.25Å; S297-V348 PolarHBondContact N-O 3.01Å; S297-V348 PolarHBondContact O-N 3.12Å; S297-H350 WeakPolarHBondContact CB-ND1 3.42Å; S297-H350 PolarHBondContact N-ND1 3.45Å; S297-H350 PolarHBondContact OG-ND1 2.84Å
298	P	97.1	Very high	89	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	142.8	166.5	-27.1	37.1	0	0	0	111.8	G300 Y301 Y331 L339 H346 W347 F452	P298-G300 PolarHBondContact O-N 2.74Å; P298-Y301 WeakPolarHBondContact O-CB 3.47Å; P298-Y301 PolarHBondContact O-N 2.69Å; P298-Y331 WeakPolarHBondContact CB-OH 3.33Å; P298-L339 HydrophobicContact CB-CD2 3.95Å; P298-L339 HydrophobicContact CG-CD2 4.23Å; P298-H346 WeakPolarHBondContact CA-O 3.42Å; P298-W347 HydrophobicContact CG-CH2 4.29Å; P298-W347 HydrophobicContact CG-CZ3 4.17Å; P298-F452 VanDerWaalsContact CD-CG 3.46Å; P298-F452 HydrophobicContact CG-CB 4.12Å; P298-F452 HydrophobicContact CG-CD1 4.33Å; P298-F452 HydrophobicContact CG-CG 4.26Å
299	Q	94.9	Very high	87.2	Confident	92 Å²	92	41.7 Å²	41.7	43%	0.43	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	132	176	-174.5	178	30.2	0	0	110.4	Y301 H346 V348	Q299-Y301 VanDerWaalsContact C-N 3.3Å; Q299-Y301 PolarHBondContact O-N 2.74Å; Q299-H346 PolarHBondContact N-O 3.18Å; Q299-H346 PolarHBondContact OE1-ND1 3Å; Q299-V348 HydrophobicContact CB-CG1 4.3Å; Q299-V348 HydrophobicContact CG-CG1 4.38Å
300	G	93.3	Very high	85.1	Confident	32 Å²	32	43.6 Å²	43.6	33%	0.33	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	-6.1	179.3	0	0	0	0	0	115.2	P298 Y302 N328 Y331	P298-G300 PolarHBondContact O-N 2.74Å; G300-Y302 VanDerWaalsContact C-N 3.34Å; G300-N328 WeakPolarHBondContact O-CB 3.41Å; G300-N328 PolarHBondContact O-ND2 3.2Å; G300-Y331 VanDerWaalsContact C-CD2 3.45Å; G300-Y331 VanDerWaalsContact O-CD2 3.31Å; G300-Y331 WeakPolarHBondContact O-CD2 3.41Å
301	Y	94.6	Very high	83.1	Confident	28 Å²	28	49.5 Å²	49.5	11%	0.11	26%	0.258	C	S	.	.	S	Bend	trans	-65.2	-40.1	174.9	-173	-79.4	0	0	0	111.9	P298 Q299 K327 N328 Y331 R450 F452	P298-Y301 WeakPolarHBondContact O-CB 3.47Å; P298-Y301 PolarHBondContact O-N 2.69Å; Q299-Y301 VanDerWaalsContact C-N 3.3Å; Q299-Y301 PolarHBondContact O-N 2.74Å; Y301-K327 HydrophobicContact CE1-CG 4.17Å; Y301-N328 WeakPolarHBondContact O-CB 3.46Å; Y301-N328 PolarHBondContact O-N 3.3Å; Y301-Y331 AromaticContact CD2-CD1 3.75Å; Y301-Y331 HydrophobicContact CD2-CD1 3.75Å; Y301-Y331 AromaticContact CD2-CE1 3.62Å; Y301-Y331 HydrophobicContact CD2-CE1 3.62Å; Y301-Y331 HydrophobicContact CD2-CG 4.3Å; Y301-Y331 HydrophobicContact CE2-CD1 4.3Å; Y301-Y331 HydrophobicContact CE2-CE1 4.32Å; Y301-R450 WeakPolarHBondContact CE2-O 3.22Å; Y301-F452 HydrophobicContact CD1-CD1 4.18Å; Y301-F452 AromaticContact CD1-CE1 3.44Å; Y301-F452 HydrophobicContact CD1-CE1 3.44Å; Y301-F452 VanDerWaalsContact CD1-CE1 3.44Å; Y301-F452 HydrophobicContact CD1-CZ 4.39Å; Y301-F452 AromaticContact CD2-CD1 3.8Å; Y301-F452 HydrophobicContact CD2-CD1 3.8Å; Y301-F452 AromaticContact CD2-CE1 3.93Å; Y301-F452 HydrophobicContact CD2-CE1 3.93Å; Y301-F452 HydrophobicContact CE1-CD1 4.22Å; Y301-F452 AromaticContact CE1-CE1 3.49Å; Y301-F452 HydrophobicContact CE1-CE1 3.49Å; Y301-F452 VanDerWaalsContact CE1-CE1 3.49Å; Y301-F452 HydrophobicContact CE1-CZ 4.46Å; Y301-F452 AromaticContact CE2-CD1 3.83Å; Y301-F452 HydrophobicContact CE2-CD1 3.83Å; Y301-F452 AromaticContact CE2-CE1 3.96Å; Y301-F452 HydrophobicContact CE2-CE1 3.96Å; Y301-F452 AromaticContact CG-CD1 3.97Å; Y301-F452 HydrophobicContact CG-CD1 3.97Å; Y301-F452 AromaticContact CG-CE1 3.67Å; Y301-F452 HydrophobicContact CG-CE1 3.67Å; Y301-F452 AromaticContact CZ-CE1 3.73Å
302	Y	94.8	Very high	81.3	Confident	43 Å²	43	55.7 Å²	55.7	17%	0.169	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.6	172.3	-63.1	-60.7	0	0	0	109.9	S297 G300 Y325 V326 K327 H350 F452	S297-Y302 WeakPolarHBondContact OG-CD2 3.33Å; G300-Y302 VanDerWaalsContact C-N 3.34Å; Y302-Y325 AromaticContact CD1-CD2 3.45Å; Y302-Y325 HydrophobicContact CD1-CD2 3.45Å; Y302-Y325 VanDerWaalsContact CD1-CD2 3.45Å; Y302-Y325 AromaticContact CD1-CE2 3.88Å; Y302-Y325 HydrophobicContact CD1-CE2 3.88Å; Y302-Y325 AromaticContact CD2-CD2 3.97Å; Y302-Y325 HydrophobicContact CD2-CD2 3.97Å; Y302-Y325 HydrophobicContact CD2-CE2 4.1Å; Y302-Y325 AromaticContact CE1-CD2 3.79Å; Y302-Y325 HydrophobicContact CE1-CD2 3.79Å; Y302-Y325 AromaticContact CE1-CE2 3.71Å; Y302-Y325 HydrophobicContact CE1-CE2 3.71Å; Y302-Y325 HydrophobicContact CE2-CD2 4.25Å; Y302-Y325 AromaticContact CE2-CE2 3.93Å; Y302-Y325 HydrophobicContact CE2-CE2 3.93Å; Y302-Y325 AromaticContact CG-CD2 3.56Å; Y302-Y325 HydrophobicContact CG-CD2 3.56Å; Y302-Y325 HydrophobicContact CG-CE2 4.08Å; Y302-Y325 HydrophobicContact CG-CG 4.35Å; Y302-Y325 AromaticContact CZ-CE2 3.75Å; Y302-V326 WeakPolarHBondContact CA-O 3.41Å; Y302-K327 HydrophobicContact CE1-CB 4.46Å; Y302-H350 HydrophobicContact CD2-CB 3.75Å; Y302-H350 HydrophobicContact CE2-CB 4.06Å; Y302-H350 AromaticContact CE2-CG 3.79Å; Y302-H350 AromaticContact CE2-ND1 3.84Å; Y302-F452 HydrophobicContact CE2-CE1 4.02Å; Y302-F452 AromaticContact CE2-CZ 3.64Å; Y302-F452 HydrophobicContact CE2-CZ 3.64Å; Y302-F452 AromaticContact CZ-CZ 3.98Å
303	T	90.5	Very high	79.4	Confident	55 Å²	55	56.4 Å²	56.4	34%	0.337	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	163.1	171.1	52	0	0	0	0	109.1	Y325 V326 N328	T303-Y325 WeakPolarHBondContact O-CA 3.39Å; T303-V326 PolarHBondContact N-O 3.26Å; T303-V326 PolarHBondContact O-N 2.83Å; T303-N328 HydrophobicContact CG2-CB 3.91Å
304	F	84.2	Confident	77.5	Confident	64 Å²	64	58.3 Å²	58.3	28%	0.281	29%	0.294	S	S	.	.			trans	-63.4	150.2	162.3	-56	-72.8	0	0	0	108.5	R322 I402 L403	F304-R322 HydrophobicContact CD1-CB 4.48Å; F304-R322 HydrophobicContact CE1-CB 4.18Å; F304-I402 HydrophobicContact CD1-CD1 4.3Å; F304-I402 HydrophobicContact CE1-CD1 3.72Å; F304-I402 HydrophobicContact CE1-CG1 3.54Å; F304-I402 HydrophobicContact CZ-CG1 4.1Å; F304-L403 HydrophobicContact CD2-CD1 4.3Å; F304-L403 HydrophobicContact CE1-CD1 4.25Å; F304-L403 HydrophobicContact CE2-CD1 3.88Å; F304-L403 HydrophobicContact CZ-CB 4.39Å; F304-L403 HydrophobicContact CZ-CD1 3.85Å; F304-L403 HydrophobicContact CZ-CG 4.22Å
305	G	73.3	Confident	75.4	Confident	21 Å²	21	65.7 Å²	65.7	22%	0.216	33%	0.328	C	S	.	.			trans	-65.3	-162.7	-174.5	0	0	0	0	0	114.2	E309	G305-E309 WeakPolarHBondContact CA-OE2 3.49Å
306	S	65.3	Low	73.4	Confident	55 Å²	55	70.2 Å²	70.2	39%	0.385	35%	0.352	S	S	.	.			trans	-61.8	158.9	177.4	66.1	0	0	0	0	111.8	E308 E309 E310	S306-E308 PolarHBondContact O-N 3.21Å; S306-E309 PolarHBondContact N-OE1 3.41Å; S306-E309 WeakPolarHBondContact O-CB 3.45Å; S306-E309 PolarHBondContact O-N 3.06Å; S306-E309 PolarHBondContact OG-OE1 2.91Å; S306-E310 WeakPolarHBondContact O-CG 3.36Å; S306-E310 PolarHBondContact O-N 3.4Å
307	K	58.7	Low	71	Confident	159 Å²	159	74.1 Å²	74.1	69%	0.691	37%	0.37	S	S	*	.	H	α-helix	trans	-53.9	-28.5	176.4	-89.5	-174.7	174	-175.2	0	113.8	E310 E311	K307-E310 WeakPolarHBondContact O-CB 3.31Å; K307-E310 PolarHBondContact O-N 3Å; K307-E311 WeakPolarHBondContact O-CG 3.37Å; K307-E311 PolarHBondContact O-N 2.77Å
308	E	58.2	Low	68.7	Low	149 Å²	149	83.4 Å²	83.4	70%	0.696	41%	0.413	S	S	*	.	H	α-helix	trans	-69.6	-46	177.6	-66.2	176.9	176.8	0	0	110.1	S306 E310 E311 E312	S306-E308 PolarHBondContact O-N 3.21Å; E308-E310 VanDerWaalsContact C-N 3.28Å; E308-E310 PolarHBondContact O-N 2.94Å; E308-E311 PolarHBondContact O-N 3.41Å; E308-E312 PolarHBondContact O-N 2.67Å
309	E	60	Low	66.4	Low	82 Å²	82	89.4 Å²	89.4	38%	0.383	44%	0.441	S	S	.	.	H	α-helix	trans	-62.8	-35.2	170.1	-67.5	157.3	-113.8	0	0	111.8	G305 S306 E313	G305-E309 WeakPolarHBondContact CA-OE2 3.49Å; S306-E309 PolarHBondContact N-OE1 3.41Å; S306-E309 WeakPolarHBondContact O-CB 3.45Å; S306-E309 PolarHBondContact O-N 3.06Å; S306-E309 PolarHBondContact OG-OE1 2.91Å; E309-E313 WeakPolarHBondContact O-CB 3.4Å; E309-E313 WeakPolarHBondContact O-CG 3.26Å; E309-E313 PolarHBondContact O-N 3.31Å
310	E	52.9	Low	64.3	Low	61 Å²	61	85.8 Å²	85.8	29%	0.285	43%	0.429	S	S	.	.	H	α-helix	trans	-64.2	-40.9	174	-66.3	-177.4	154.5	0	0	112	S306 K307 E308 L314	S306-E310 WeakPolarHBondContact O-CG 3.36Å; S306-E310 PolarHBondContact O-N 3.4Å; K307-E310 WeakPolarHBondContact O-CB 3.31Å; K307-E310 PolarHBondContact O-N 3Å; E308-E310 VanDerWaalsContact C-N 3.28Å; E308-E310 PolarHBondContact O-N 2.94Å; E310-L314 WeakPolarHBondContact O-CB 3.36Å; E310-L314 WeakPolarHBondContact O-CD1 3.48Å; E310-L314 WeakPolarHBondContact O-CG 3.5Å; E310-L314 PolarHBondContact O-N 3.09Å
311	E	55.3	Low	62.6	Low	125 Å²	125	86.8 Å²	86.8	58%	0.584	43%	0.425	S	S	*	.	H	α-helix	trans	-67.9	-42.4	177.8	-77.5	177.1	-169.4	0	0	111.2	K307 E308 L314 E315	K307-E311 WeakPolarHBondContact O-CG 3.37Å; K307-E311 PolarHBondContact O-N 2.77Å; E308-E311 PolarHBondContact O-N 3.41Å; E311-L314 PolarHBondContact O-N 3.36Å; E311-E315 WeakPolarHBondContact O-CG 3.2Å; E311-E315 PolarHBondContact O-N 3.1Å; E311-E315 VanDerWaalsContact O-N 3.07Å
312	E	58.1	Low	61.3	Low	134 Å²	134	88.6 Å²	88.6	63%	0.626	43%	0.432	S	S	*	.	H	α-helix	trans	-65.8	-36.7	175.5	-70.3	-174.9	179.5	0	0	112.8	E308 N316	E308-E312 PolarHBondContact O-N 2.67Å; E312-N316 PolarHBondContact O-ND2 3.38Å
313	E	55.6	Low	60.2	Low	30 Å²	30	87.2 Å²	87.2	14%	0.14	43%	0.427	C	S	.	.	H	α-helix	trans	-73.4	-36.9	173.8	-75.2	-166.4	160.6	0	0	112.6	E309 E315 N316 E317 R322 N324	E309-E313 WeakPolarHBondContact O-CB 3.4Å; E309-E313 WeakPolarHBondContact O-CG 3.26Å; E309-E313 PolarHBondContact O-N 3.31Å; E313-E315 VanDerWaalsContact C-N 3.31Å; E313-E315 PolarHBondContact O-N 3.47Å; E313-N316 CarbonylContact O-C 2.83Å; E313-N316 WeakPolarHBondContact O-CA 3.17Å; E313-N316 PolarHBondContact O-N 2.94Å; E313-E317 PolarHBondContact O-N 2.88Å; E313-R322 HydrophobicContact CB-CG 4.48Å; E313-R322 WeakPolarHBondContact OE2-CB 3.08Å; E313-R322 WeakPolarHBondContact OE2-CG 3.27Å; E313-N324 WeakPolarHBondContact OE1-CB 3.36Å; E313-N324 PolarHBondContact OE1-N 2.93Å; E313-N324 VanDerWaalsContact OE1-N 3.16Å; E313-N324 PolarHBondContact OE1-ND2 3Å
314	L	53.9	Low	59.7	Low	78 Å²	78	87.9 Å²	87.9	41%	0.408	43%	0.429	S	S	.	.	H	α-helix	trans	-61.6	-37.7	175.8	-83.1	165.8	0	0	0	112.1	E310 E311 N316 E317 R322	E310-L314 WeakPolarHBondContact O-CB 3.36Å; E310-L314 WeakPolarHBondContact O-CD1 3.48Å; E310-L314 WeakPolarHBondContact O-CG 3.5Å; E310-L314 PolarHBondContact O-N 3.09Å; E311-L314 PolarHBondContact O-N 3.36Å; L314-N316 PolarHBondContact O-N 3.34Å; L314-E317 WeakPolarHBondContact CD2-OE1 3.26Å; L314-E317 WeakPolarHBondContact CD2-OE2 3.27Å; L314-E317 WeakPolarHBondContact O-CB 3.36Å; L314-E317 PolarHBondContact O-N 2.94Å; L314-R322 VanDerWaalsContact CD2-NH2 3.29Å
315	E	52.9	Low	59.9	Low	163 Å²	163	87.6 Å²	87.6	76%	0.762	43%	0.426	S	S	*	.	H	α-helix	trans	-64.7	-30.5	173.8	-72.7	-176.1	179.1	0	0	111.8	E311 E313	E311-E315 WeakPolarHBondContact O-CG 3.2Å; E311-E315 PolarHBondContact O-N 3.1Å; E311-E315 VanDerWaalsContact O-N 3.07Å; E313-E315 VanDerWaalsContact C-N 3.31Å; E313-E315 PolarHBondContact O-N 3.47Å
316	N	53.3	Low	60.7	Low	103 Å²	103	89.8 Å²	89.8	55%	0.551	44%	0.435	S	S	*	.	H	α-helix	trans	-86.2	-7.2	174.6	-70	-50.6	0	0	0	113.9	E312 E313 L314 E318 E319 G320	E312-N316 PolarHBondContact O-ND2 3.38Å; E313-N316 CarbonylContact O-C 2.83Å; E313-N316 WeakPolarHBondContact O-CA 3.17Å; E313-N316 PolarHBondContact O-N 2.94Å; L314-N316 PolarHBondContact O-N 3.34Å; N316-E318 PolarHBondContact O-N 2.92Å; N316-E319 CarbonylContact O-C 3.51Å; N316-E319 WeakPolarHBondContact O-CA 3.44Å; N316-E319 PolarHBondContact O-N 3Å; N316-G320 PolarHBondContact O-N 3.46Å
317	E	47.1	Very low	61.9	Low	82 Å²	82	91.9 Å²	91.9	38%	0.383	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.8	179.7	-85	-177.5	-171.1	0	0	112.5	E313 L314 E319 G320 R322	E313-E317 PolarHBondContact O-N 2.88Å; L314-E317 WeakPolarHBondContact CD2-OE1 3.26Å; L314-E317 WeakPolarHBondContact CD2-OE2 3.27Å; L314-E317 WeakPolarHBondContact O-CB 3.36Å; L314-E317 PolarHBondContact O-N 2.94Å; E317-E319 PolarHBondContact O-N 2.86Å; E317-G320 WeakPolarHBondContact CA-O 3.43Å; E317-R322 IonicContact OE1-CZ 2.68Å; E317-R322 IonicContact OE1-NE 2.91Å; E317-R322 PolarHBondContact OE1-NE 2.66Å; E317-R322 IonicContact OE1-NH2 3.29Å; E317-R322 PolarHBondContact OE1-NH2 3.49Å; E317-R322 VanDerWaalsContact OE1-NH2 3.12Å
318	E	48	Very low	63.4	Low	194 Å²	194	86.1 Å²	86.1	91%	0.907	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.4	170	-71.6	-166	170.2	0	0	112.2	N316	N316-E318 PolarHBondContact O-N 2.92Å
319	E	49.9	Very low	64.9	Low	127 Å²	127	88.3 Å²	88.3	59%	0.593	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-11.2	179.2	-61.7	-158.7	142.6	0	0	114.8	N316 E317 K367	N316-E319 CarbonylContact O-C 3.51Å; N316-E319 WeakPolarHBondContact O-CA 3.44Å; N316-E319 PolarHBondContact O-N 3Å; E317-E319 PolarHBondContact O-N 2.86Å; E319-K367 IonicContact OE1-NZ 2.66Å; E319-K367 PolarHBondContact OE1-NZ 3.36Å
320	G	50.5	Low	66.2	Low	17 Å²	17	92.6 Å²	92.6	18%	0.175	44%	0.444	C	S	.	.			trans	-177.8	138.7	176.2	0	0	0	0	0	116.5	N316 E317	N316-G320 PolarHBondContact O-N 3.46Å; E317-G320 WeakPolarHBondContact CA-O 3.43Å
321	E	58.2	Low	68.1	Low	52 Å²	52	90.8 Å²	90.8	24%	0.243	44%	0.435	C	S	.	.			trans	-57.8	146.4	173.4	-68.1	167	-170.6	0	0	112.2	Q323 H398 G399	E321-Q323 VanDerWaalsContact O-CD 3.31Å; E321-Q323 WeakPolarHBondContact O-CG 3.47Å; E321-Q323 PolarHBondContact O-N 2.88Å; E321-Q323 PolarHBondContact O-NE2 3.21Å; E321-H398 WeakPolarHBondContact OE1-CB 3.28Å; E321-H398 IonicContact OE1-CG 2.77Å; E321-H398 IonicContact OE1-ND1 3.73Å; E321-H398 PolarHBondContact OE1-ND1 2.88Å; E321-G399 PolarHBondContact OE1-N 3.17Å; E321-G399 VanDerWaalsContact OE1-O 3.09Å; E321-G399 VanDerWaalsContact OE2-C 3.31Å; E321-G399 PolarHBondContact OE2-N 3.21Å
322	R	67	Low	69.8	Low	66 Å²	66	92.8 Å²	92.8	25%	0.249	44%	0.444	C	S	.	.			trans	-48.2	128.4	179.4	-59.6	-178.2	-161.1	-163.1	-5.8	113.3	F304 E313 L314 E317	F304-R322 HydrophobicContact CD1-CB 4.48Å; F304-R322 HydrophobicContact CE1-CB 4.18Å; E313-R322 HydrophobicContact CB-CG 4.48Å; E313-R322 WeakPolarHBondContact OE2-CB 3.08Å; E313-R322 WeakPolarHBondContact OE2-CG 3.27Å; L314-R322 VanDerWaalsContact CD2-NH2 3.29Å; E317-R322 IonicContact OE1-CZ 2.68Å; E317-R322 IonicContact OE1-NE 2.91Å; E317-R322 PolarHBondContact OE1-NE 2.66Å; E317-R322 IonicContact OE1-NH2 3.29Å; E317-R322 PolarHBondContact OE1-NH2 3.49Å; E317-R322 VanDerWaalsContact OE1-NH2 3.12Å
323	Q	70.6	Confident	71.4	Confident	14 Å²	14	88.9 Å²	88.9	7%	0.065	43%	0.43	C	S	.	.			trans	-126.8	-10.6	-177	-56.5	-53	-28	0	0	114.8	E321 S352 V360 Y361	E321-Q323 VanDerWaalsContact O-CD 3.31Å; E321-Q323 WeakPolarHBondContact O-CG 3.47Å; E321-Q323 PolarHBondContact O-N 2.88Å; E321-Q323 PolarHBondContact O-NE2 3.21Å; Q323-S352 PolarHBondContact OE1-OG 3.16Å; Q323-V360 HydrophobicContact CG-CG1 3.86Å; Q323-Y361 HydrophobicContact CG-CE1 4.27Å
324	N	80.5	Confident	73.1	Confident	70 Å²	70	89.4 Å²	89.4	37%	0.374	43%	0.434	S	S	.	.			trans	-93.4	146.7	176.7	-57.8	-51.3	0	0	0	111.9	K227 E313 I402	K227-N324 PolarHBondContact NZ-OD1 2.96Å; E313-N324 WeakPolarHBondContact OE1-CB 3.36Å; E313-N324 PolarHBondContact OE1-N 2.93Å; E313-N324 VanDerWaalsContact OE1-N 3.16Å; E313-N324 PolarHBondContact OE1-ND2 3Å; N324-I402 WeakPolarHBondContact O-CD1 3.27Å
325	Y	88.7	Confident	74.9	Confident	58 Å²	58	88.1 Å²	88.1	23%	0.227	43%	0.432	C	S	.	.			trans	-143.5	146.5	179	60.3	-95.6	0	0	0	108.6	Y302 T303 H350 I402	Y302-Y325 AromaticContact CD1-CD2 3.45Å; Y302-Y325 HydrophobicContact CD1-CD2 3.45Å; Y302-Y325 VanDerWaalsContact CD1-CD2 3.45Å; Y302-Y325 AromaticContact CD1-CE2 3.88Å; Y302-Y325 HydrophobicContact CD1-CE2 3.88Å; Y302-Y325 AromaticContact CD2-CD2 3.97Å; Y302-Y325 HydrophobicContact CD2-CD2 3.97Å; Y302-Y325 HydrophobicContact CD2-CE2 4.1Å; Y302-Y325 AromaticContact CE1-CD2 3.79Å; Y302-Y325 HydrophobicContact CE1-CD2 3.79Å; Y302-Y325 AromaticContact CE1-CE2 3.71Å; Y302-Y325 HydrophobicContact CE1-CE2 3.71Å; Y302-Y325 HydrophobicContact CE2-CD2 4.25Å; Y302-Y325 AromaticContact CE2-CE2 3.93Å; Y302-Y325 HydrophobicContact CE2-CE2 3.93Å; Y302-Y325 AromaticContact CG-CD2 3.56Å; Y302-Y325 HydrophobicContact CG-CD2 3.56Å; Y302-Y325 HydrophobicContact CG-CE2 4.08Å; Y302-Y325 HydrophobicContact CG-CG 4.35Å; Y302-Y325 AromaticContact CZ-CE2 3.75Å; T303-Y325 WeakPolarHBondContact O-CA 3.39Å; Y325-H350 HydrophobicContact CD1-CB 4.48Å; Y325-H350 VanDerWaalsContact CD1-O 3.24Å; Y325-H350 WeakPolarHBondContact CD1-O 3.45Å; Y325-H350 HydrophobicContact CE1-CB 4.3Å; Y325-H350 WeakPolarHBondContact CE1-O 3.49Å; Y325-H350 AromaticContact CZ-CD2 3.79Å; Y325-H350 PolarHBondContact OH-CD2 3.2Å; Y325-I402 HydrophobicContact CD1-CD1 4.22Å
326	V	90.4	Very high	76.7	Confident	66 Å²	66	82.2 Å²	82.2	40%	0.4	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	148.8	179.4	-176	0	0	0	0	108.4	Y302 T303 N328	Y302-V326 WeakPolarHBondContact CA-O 3.41Å; T303-V326 PolarHBondContact N-O 3.26Å; T303-V326 PolarHBondContact O-N 2.83Å; V326-N328 PolarHBondContact O-N 3.41Å
327	K	90	Very high	78.5	Confident	99 Å²	99	83.3 Å²	83.3	43%	0.43	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	127.4	174.9	-176.7	179.8	178.2	-170.9	0	109.5	E106 Y301 Y302 E329	E106-K327 IonicContact OE1-NZ 2.64Å; E106-K327 PolarHBondContact OE1-NZ 3.16Å; Y301-K327 HydrophobicContact CE1-CG 4.17Å; Y302-K327 HydrophobicContact CE1-CB 4.46Å; K327-E329 PolarHBondContact O-N 2.74Å
328	N	91.2	Very high	80.7	Confident	38 Å²	38	83.5 Å²	83.5	20%	0.203	41%	0.411	C	S	.	.			trans	-76.6	109.2	177.2	-178.5	6.5	0	0	0	110.2	G300 Y301 T303 V326 E330 Y331	G300-N328 WeakPolarHBondContact O-CB 3.41Å; G300-N328 PolarHBondContact O-ND2 3.2Å; Y301-N328 WeakPolarHBondContact O-CB 3.46Å; Y301-N328 PolarHBondContact O-N 3.3Å; T303-N328 HydrophobicContact CG2-CB 3.91Å; V326-N328 PolarHBondContact O-N 3.41Å; N328-E330 PolarHBondContact O-N 3.42Å; N328-E330 PolarHBondContact OD1-N 2.97Å; N328-Y331 WeakPolarHBondContact O-CB 3.23Å; N328-Y331 PolarHBondContact O-N 2.79Å; N328-Y331 VanDerWaalsContact O-N 3.17Å
329	E	88.1	Confident	82.9	Confident	196 Å²	196	74.5 Å²	74.5	92%	0.916	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.3	177.9	-60.5	-168.1	157.9	0	0	112.7	K327 Y331	K327-E329 PolarHBondContact O-N 2.74Å; E329-Y331 VanDerWaalsContact C-N 3.29Å; E329-Y331 PolarHBondContact O-N 2.87Å
330	E	89	Confident	84.9	Confident	171 Å²	171	69.2 Å²	69.2	80%	0.799	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	15.9	178	-57.7	-172.6	166.7	0	0	112.5	N328 E332	N328-E330 PolarHBondContact O-N 3.42Å; N328-E330 PolarHBondContact OD1-N 2.97Å; E330-E332 PolarHBondContact O-N 2.87Å; E330-E332 VanDerWaalsContact O-N 3.1Å
331	Y	91.7	Very high	87	Confident	24 Å²	24	71 Å²	71	9%	0.094	35%	0.353	C	S	.	.			trans	-60.7	115.2	-178.4	174.8	-116.9	0	0	0	112.6	P298 G300 Y301 N328 E329 P333	P298-Y331 WeakPolarHBondContact CB-OH 3.33Å; G300-Y331 VanDerWaalsContact C-CD2 3.45Å; G300-Y331 VanDerWaalsContact O-CD2 3.31Å; G300-Y331 WeakPolarHBondContact O-CD2 3.41Å; Y301-Y331 AromaticContact CD2-CD1 3.75Å; Y301-Y331 HydrophobicContact CD2-CD1 3.75Å; Y301-Y331 AromaticContact CD2-CE1 3.62Å; Y301-Y331 HydrophobicContact CD2-CE1 3.62Å; Y301-Y331 HydrophobicContact CD2-CG 4.3Å; Y301-Y331 HydrophobicContact CE2-CD1 4.3Å; Y301-Y331 HydrophobicContact CE2-CE1 4.32Å; N328-Y331 WeakPolarHBondContact O-CB 3.23Å; N328-Y331 PolarHBondContact O-N 2.79Å; N328-Y331 VanDerWaalsContact O-N 3.17Å; E329-Y331 VanDerWaalsContact C-N 3.29Å; E329-Y331 PolarHBondContact O-N 2.87Å; Y331-P333 HydrophobicContact CE1-CB 4.3Å
332	E	92.1	Very high	88.7	Confident	166 Å²	166	73.8 Å²	73.8	78%	0.776	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-90.3	120.5	168.9	-65.9	-165.5	157.2	0	0	110.3	E330 L334	E330-E332 PolarHBondContact O-N 2.87Å; E330-E332 VanDerWaalsContact O-N 3.1Å; E332-L334 PolarHBondContact O-N 2.87Å
333	P	90.8	Very high	89.9	Confident	52 Å²	52	73 Å²	73	34%	0.338	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-67.3	128.7	-177.9	28.7	-35.6	0	0	0	111.1	Y331 G449 R450	Y331-P333 HydrophobicContact CE1-CB 4.3Å; P333-G449 WeakPolarHBondContact CB-O 3.38Å; P333-R450 HydrophobicContact CB-CG 3.9Å; P333-R450 HydrophobicContact CG-CG 3.69Å
334	L	92.1	Very high	91.1	Very high	41 Å²	41	73.5 Å²	73.5	22%	0.215	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-63.3	148.4	170.2	-65.8	173.6	0	0	0	110.9	E332 E338 L339 H346	E332-L334 PolarHBondContact O-N 2.87Å; L334-E338 HydrophobicContact CB-CB 4.34Å; L334-L339 HydrophobicContact CB-CD1 4.44Å; L334-L339 HydrophobicContact CB-CD2 3.93Å; L334-L339 HydrophobicContact CB-CG 3.79Å; L334-L339 HydrophobicContact CD1-CD2 3.92Å; L334-H346 HydrophobicContact CD1-CB 3.78Å
335	S	91.7	Very high	91.8	Very high	52 Å²	52	73.8 Å²	73.8	36%	0.364	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-66.3	154.5	175	71.6	0	0	0	0	110.8	N337 E338 L339	S335-N337 PolarHBondContact O-N 3.4Å; S335-N337 VanDerWaalsContact O-N 3.14Å; S335-E338 VanDerWaalsContact CB-OE2 3.26Å; S335-E338 WeakPolarHBondContact CB-OE2 3.49Å; S335-E338 PolarHBondContact N-OE2 2.91Å; S335-E338 PolarHBondContact O-N 3.48Å; S335-E338 VanDerWaalsContact OG-CD 3.25Å; S335-E338 WeakPolarHBondContact OG-CG 3.25Å; S335-E338 PolarHBondContact OG-N 2.76Å; S335-E338 PolarHBondContact OG-OE2 3.21Å; S335-L339 PolarHBondContact O-N 3.24Å
336	I	90.6	Very high	92.1	Very high	38 Å²	38	72.5 Å²	72.5	20%	0.195	38%	0.381	C	S	.	.	H	α-helix	trans	-58.2	-31.5	178.5	-68.7	167.8	0	0	0	111.5	A340 I422 P428 A431 V433	I336-A340 WeakPolarHBondContact O-CB 3.47Å; I336-A340 PolarHBondContact O-N 2.85Å; I336-I422 HydrophobicContact CG2-CD1 4.2Å; I336-I422 HydrophobicContact CG2-CG1 4.45Å; I336-I422 HydrophobicContact CG2-CG2 4.28Å; I336-P428 WeakPolarHBondContact CD1-O 3.4Å; I336-A431 VanDerWaalsContact CD1-O 3.32Å; I336-A431 WeakPolarHBondContact CD1-O 3.31Å; I336-V433 HydrophobicContact CB-CG2 4.45Å; I336-V433 HydrophobicContact CG2-CG2 3.86Å
337	N	90.1	Very high	92.5	Very high	127 Å²	127	69.4 Å²	69.4	68%	0.679	36%	0.361	S	S	*	.	H	α-helix	trans	-70.7	-37.5	177.6	-67.9	-33.6	0	0	0	112.5	S335 D341	S335-N337 PolarHBondContact O-N 3.4Å; S335-N337 VanDerWaalsContact O-N 3.14Å; N337-D341 PolarHBondContact O-N 3.32Å
338	E	93.2	Very high	92.8	Very high	85 Å²	85	65 Å²	65	40%	0.397	34%	0.343	S	S	.	.	H	α-helix	trans	-70.3	-49.3	174.8	-70.5	160	144	0	0	110	L334 S335 A340 D341 H346	L334-E338 HydrophobicContact CB-CB 4.34Å; S335-E338 VanDerWaalsContact CB-OE2 3.26Å; S335-E338 WeakPolarHBondContact CB-OE2 3.49Å; S335-E338 PolarHBondContact N-OE2 2.91Å; S335-E338 PolarHBondContact O-N 3.48Å; S335-E338 VanDerWaalsContact OG-CD 3.25Å; S335-E338 WeakPolarHBondContact OG-CG 3.25Å; S335-E338 PolarHBondContact OG-N 2.76Å; S335-E338 PolarHBondContact OG-OE2 3.21Å; E338-A340 PolarHBondContact O-N 2.91Å; E338-D341 WeakPolarHBondContact O-CB 3.3Å; E338-D341 PolarHBondContact O-N 3.18Å; E338-H346 PolarHBondContact O-CD2 3.12Å
339	L	93.9	Very high	93	Very high	5 Å²	5	64.2 Å²	64.2	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-58.3	-35.5	177.2	-73.8	175.3	0	0	0	112.2	P298 L334 S335 D341 W347 I420 V433	P298-L339 HydrophobicContact CB-CD2 3.95Å; P298-L339 HydrophobicContact CG-CD2 4.23Å; L334-L339 HydrophobicContact CB-CD1 4.44Å; L334-L339 HydrophobicContact CB-CD2 3.93Å; L334-L339 HydrophobicContact CB-CG 3.79Å; L334-L339 HydrophobicContact CD1-CD2 3.92Å; S335-L339 PolarHBondContact O-N 3.24Å; L339-D341 VanDerWaalsContact C-N 3.33Å; L339-W347 HydrophobicContact CD2-CZ2 4.31Å; L339-W347 PolarHBondContact O-NE1 2.89Å; L339-I420 WeakPolarHBondContact O-CD1 3.44Å; L339-V433 HydrophobicContact CB-CB 4.19Å; L339-V433 HydrophobicContact CB-CG1 4.21Å; L339-V433 HydrophobicContact CB-CG2 3.79Å
340	A	93.6	Very high	93.3	Very high	17 Å²	17	55.2 Å²	55.2	14%	0.14	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	8.8	179.3	0	0	0	0	0	114.5	I336 E338 P342 I422 V433	I336-A340 WeakPolarHBondContact O-CB 3.47Å; I336-A340 PolarHBondContact O-N 2.85Å; E338-A340 PolarHBondContact O-N 2.91Å; A340-P342 WeakPolarHBondContact O-CD 3.27Å; A340-I422 HydrophobicContact CB-CD1 3.59Å; A340-I422 HydrophobicContact CB-CG1 3.5Å; A340-I422 VanDerWaalsContact CB-CG1 3.5Å; A340-V433 HydrophobicContact CB-CG1 4.27Å; A340-V433 HydrophobicContact CB-CG2 4.18Å
341	D	94.2	Very high	93.5	Very high	53 Å²	53	49 Å²	49	28%	0.283	27%	0.27	S	S	.	.			trans	-58	124.4	178.6	-177.2	-0.5	0	0	0	110.5	N337 E338 L339 S343 L344	N337-D341 PolarHBondContact O-N 3.32Å; E338-D341 WeakPolarHBondContact O-CB 3.3Å; E338-D341 PolarHBondContact O-N 3.18Å; L339-D341 VanDerWaalsContact C-N 3.33Å; D341-S343 PolarHBondContact O-N 3.4Å; D341-S343 PolarHBondContact OD1-N 3.4Å; D341-S343 PolarHBondContact OD1-OG 3.41Å; D341-S343 WeakPolarHBondContact OD2-CB 3.49Å; D341-S343 PolarHBondContact OD2-OG 2.77Å; D341-L344 PolarHBondContact O-N 2.9Å
342	P	92.6	Very high	93.4	Very high	112 Å²	112	48.6 Å²	48.6	73%	0.727	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-15.8	174.3	-26.3	35.2	0	0	0	115.4	A340 L344	A340-P342 WeakPolarHBondContact O-CD 3.27Å; P342-L344 VanDerWaalsContact C-N 3.3Å
343	S	93.5	Very high	93.5	Very high	50 Å²	50	45.6 Å²	45.6	35%	0.35	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-21.1	175.3	78.4	0	0	0	0	113.8	D341 I345 S407	D341-S343 PolarHBondContact O-N 3.4Å; D341-S343 PolarHBondContact OD1-N 3.4Å; D341-S343 PolarHBondContact OD1-OG 3.41Å; D341-S343 WeakPolarHBondContact OD2-CB 3.49Å; D341-S343 PolarHBondContact OD2-OG 2.77Å; S343-I345 PolarHBondContact O-N 3.3Å; S343-I345 WeakPolarHBondContact OG-CG1 3.46Å; S343-I345 WeakPolarHBondContact OG-CG2 2.9Å; S343-S407 WeakPolarHBondContact O-CB 3.3Å
344	L	94.2	Very high	93.7	Very high	24 Å²	24	43.6 Å²	43.6	13%	0.126	24%	0.239	C	C	.	.			trans	59.5	19.4	-179.3	-57.8	170.1	0	0	0	115.4	D341 P342 H346 I406 W418 I420	D341-L344 PolarHBondContact O-N 2.9Å; P342-L344 VanDerWaalsContact C-N 3.3Å; L344-H346 VanDerWaalsContact C-N 3.26Å; L344-H346 PolarHBondContact O-N 3Å; L344-I406 HydrophobicContact CB-CD1 4.12Å; L344-I406 HydrophobicContact CB-CG1 3.91Å; L344-I406 HydrophobicContact CD1-CD1 4.47Å; L344-I406 HydrophobicContact CD2-CD1 4.23Å; L344-W418 HydrophobicContact CD1-CB 3.64Å; L344-I420 HydrophobicContact CD2-CB 3.79Å; L344-I420 HydrophobicContact CD2-CD1 3.85Å; L344-I420 HydrophobicContact CD2-CG1 4.45Å; L344-I420 HydrophobicContact CD2-CG2 3.92Å
345	I	95.2	Very high	93.7	Very high	75 Å²	75	41.9 Å²	41.9	39%	0.385	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22	-178.2	63.5	-177.7	0	0	0	113.6	S343 W347	S343-I345 PolarHBondContact O-N 3.3Å; S343-I345 WeakPolarHBondContact OG-CG1 3.46Å; S343-I345 WeakPolarHBondContact OG-CG2 2.9Å; I345-W347 VanDerWaalsContact C-N 3.3Å; I345-W347 PolarHBondContact O-N 2.81Å
346	H	96.2	Very high	93.8	Very high	32 Å²	32	42.7 Å²	42.7	15%	0.148	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	10.9	-174.2	-65.7	-56.1	0	0	0	114.1	P298 Q299 L334 E338 L344	P298-H346 WeakPolarHBondContact CA-O 3.42Å; Q299-H346 PolarHBondContact N-O 3.18Å; Q299-H346 PolarHBondContact OE1-ND1 3Å; L334-H346 HydrophobicContact CD1-CB 3.78Å; E338-H346 PolarHBondContact O-CD2 3.12Å; L344-H346 VanDerWaalsContact C-N 3.26Å; L344-H346 PolarHBondContact O-N 3Å
347	W	97.7	Very high	93.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.7	177.7	-70.6	87.8	0	0	0	109.2	I296 S297 P298 L339 I345 P405 I406 V433 V435 A445	I296-W347 HydrophobicContact CD1-CD2 4.34Å; I296-W347 HydrophobicContact CD1-CE3 3.76Å; I296-W347 HydrophobicContact CD1-CZ3 4.34Å; I296-W347 HydrophobicContact CG1-CE3 4.03Å; I296-W347 HydrophobicContact CG1-CZ3 4.41Å; S297-W347 WeakPolarHBondContact O-CA 3.25Å; P298-W347 HydrophobicContact CG-CH2 4.29Å; P298-W347 HydrophobicContact CG-CZ3 4.17Å; L339-W347 HydrophobicContact CD2-CZ2 4.31Å; L339-W347 PolarHBondContact O-NE1 2.89Å; I345-W347 VanDerWaalsContact C-N 3.3Å; I345-W347 PolarHBondContact O-N 2.81Å; W347-P405 CarbonylContact O-C 3.58Å; W347-P405 VanDerWaalsContact O-CA 3.3Å; W347-P405 WeakPolarHBondContact O-CA 3.31Å; W347-I406 HydrophobicContact CB-CD1 3.47Å; W347-I406 VanDerWaalsContact CB-CD1 3.47Å; W347-I406 HydrophobicContact CB-CG1 3.78Å; W347-I406 HydrophobicContact CB-CG2 4.37Å; W347-I406 HydrophobicContact CG-CD1 4.19Å; W347-I406 PolarHBondContact O-N 3.28Å; W347-V433 HydrophobicContact CZ2-CB 4.46Å; W347-V433 HydrophobicContact CZ2-CG1 4.06Å; W347-V435 HydrophobicContact CD2-CG2 3.76Å; W347-V435 HydrophobicContact CE3-CG2 4.32Å; W347-V435 HydrophobicContact CG-CG2 4.16Å; W347-V435 HydrophobicContact CH2-CG2 4.16Å; W347-V435 HydrophobicContact CZ2-CG2 3.61Å; W347-V435 HydrophobicContact CZ3-CG2 4.5Å; W347-A445 HydrophobicContact CH2-CB 4.38Å; W347-A445 HydrophobicContact CZ3-CB 3.85Å
348	V	96.9	Very high	93.9	Very high	6 Å²	6	35.6 Å²	35.6	4%	0.036	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	149.3	-175.6	-58.9	0	0	0	0	110.7	I296 S297 Q299 L403 T404 P405	I296-V348 CarbonylContact C-O 3.56Å; I296-V348 WeakPolarHBondContact CA-O 3.34Å; I296-V348 WeakPolarHBondContact CB-O 3.33Å; S297-V348 PolarHBondContact N-O 3.01Å; S297-V348 PolarHBondContact O-N 3.12Å; Q299-V348 HydrophobicContact CB-CG1 4.3Å; Q299-V348 HydrophobicContact CG-CG1 4.38Å; V348-L403 WeakPolarHBondContact CG1-O 3.39Å; V348-L403 HydrophobicContact CG2-CB 4.43Å; V348-L403 HydrophobicContact CG2-CD2 3.99Å; V348-T404 WeakPolarHBondContact CA-O 3.45Å; V348-P405 HydrophobicContact CG1-CG 4.43Å
349	H	96	Very high	93.9	Very high	23 Å²	23	33.1 Å²	33.1	11%	0.106	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.4	168.9	-66.8	-81.6	0	0	0	109.3	L403 T404 D409 W418	H349-L403 VanDerWaalsContact O-CA 3.25Å; H349-L403 WeakPolarHBondContact O-CA 3.38Å; H349-L403 PolarHBondContact O-N 3.05Å; H349-T404 PolarHBondContact N-O 3.34Å; H349-D409 IonicContact CD2-OD1 3.21Å; H349-D409 IonicContact CE1-OD2 3.38Å; H349-D409 PolarHBondContact CE1-OD2 3.01Å; H349-D409 VanDerWaalsContact NE2-CG 3.33Å; H349-D409 IonicContact NE2-OD1 3.58Å; H349-D409 PolarHBondContact NE2-OD1 3.3Å; H349-D409 IonicContact NE2-OD2 3.91Å; H349-D409 PolarHBondContact NE2-OD2 2.99Å; H349-W418 AromaticContact CE1-CZ2 3.78Å
350	H	94.4	Very high	93.7	Very high	7 Å²	7	33.4 Å²	33.4	3%	0.032	19%	0.185	C	C	.	.			trans	-105.3	-12.4	173.8	60.6	-102.4	0	0	0	113	Q295 I296 S297 Y302 Y325 L403 F452	Q295-H350 PolarHBondContact O-N 2.94Å; I296-H350 VanDerWaalsContact C-CE1 3.49Å; I296-H350 VanDerWaalsContact C-ND1 3.29Å; I296-H350 PolarHBondContact O-CE1 2.98Å; I296-H350 VanDerWaalsContact O-CE1 3.31Å; S297-H350 WeakPolarHBondContact CB-ND1 3.42Å; S297-H350 PolarHBondContact N-ND1 3.45Å; S297-H350 PolarHBondContact OG-ND1 2.84Å; Y302-H350 HydrophobicContact CD2-CB 3.75Å; Y302-H350 HydrophobicContact CE2-CB 4.06Å; Y302-H350 AromaticContact CE2-CG 3.79Å; Y302-H350 AromaticContact CE2-ND1 3.84Å; Y325-H350 HydrophobicContact CD1-CB 4.48Å; Y325-H350 VanDerWaalsContact CD1-O 3.24Å; Y325-H350 WeakPolarHBondContact CD1-O 3.45Å; Y325-H350 HydrophobicContact CE1-CB 4.3Å; Y325-H350 WeakPolarHBondContact CE1-O 3.49Å; Y325-H350 AromaticContact CZ-CD2 3.79Å; Y325-H350 PolarHBondContact OH-CD2 3.2Å; H350-L403 HydrophobicContact CB-CD2 4.22Å; H350-F452 AromaticContact CE1-CE2 3.93Å
351	T	92.4	Very high	93.4	Very high	41 Å²	41	35.8 Å²	35.8	25%	0.252	19%	0.191	S	C	.	.	S	Bend	trans	-93.4	144.4	172.1	-59.3	0	0	0	0	110.7	Q295	Q295-T351 WeakPolarHBondContact CB-OG1 3.44Å
352	S	91.2	Very high	93	Very high	14 Å²	14	36.2 Å²	36.2	10%	0.098	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-56.8	141.5	178	-46.6	0	0	0	0	113.8	A292 Q323	A292-S352 WeakPolarHBondContact CB-O 3.46Å; Q323-S352 PolarHBondContact OE1-OG 3.16Å
353	Y	92.5	Very high	92.7	Very high	103 Å²	103	33 Å²	33	40%	0.404	16%	0.162	S	C	.	.	P	Polyproline II helix	trans	-71.6	139.1	169.4	176.6	-100.6	0	0	0	110.9	L355 P400	Y353-L355 HydrophobicContact CD1-CD2 4.1Å; Y353-L355 HydrophobicContact CE1-CD2 4.19Å; Y353-P400 HydrophobicContact CD2-CG 4.48Å; Y353-P400 HydrophobicContact CG-CG 4.32Å
354	I	94.6	Very high	92.2	Very high	10 Å²	10	32.5 Å²	32.5	5%	0.051	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-93.8	119.3	173.7	-56.6	170.7	0	0	0	108.9	T225 I251 R255 A288 A292 V360	T225-I354 HydrophobicContact CG2-CD1 3.95Å; T225-I354 HydrophobicContact CG2-CG1 3.93Å; T225-I354 HydrophobicContact CG2-CG2 4.22Å; I251-I354 HydrophobicContact CD1-CD1 4.47Å; I251-I354 HydrophobicContact CG2-CG2 3.98Å; R255-I354 PolarHBondContact NH2-O 2.92Å; A288-I354 HydrophobicContact CB-CD1 4.13Å; A292-I354 HydrophobicContact CB-CD1 3.56Å; A292-I354 HydrophobicContact CB-CG1 3.6Å; I354-V360 HydrophobicContact CG1-CG2 4.46Å
355	L	94	Very high	91.5	Very high	5 Å²	5	33 Å²	33	3%	0.026	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-61.5	160.6	-179.1	-62	174.9	0	0	0	112.9	R255 Y353 Q357 G358 R359 V360 W362 E397	R255-L355 PolarHBondContact NH1-O 3.47Å; R255-L355 PolarHBondContact NH2-O 3.43Å; Y353-L355 HydrophobicContact CD1-CD2 4.1Å; Y353-L355 HydrophobicContact CE1-CD2 4.19Å; L355-Q357 HydrophobicContact CB-CG 4.07Å; L355-Q357 PolarHBondContact O-N 2.97Å; L355-G358 PolarHBondContact O-N 3.36Å; L355-R359 VanDerWaalsContact CB-O 3.3Å; L355-R359 WeakPolarHBondContact CB-O 3.46Å; L355-R359 PolarHBondContact N-O 3.28Å; L355-V360 VanDerWaalsContact CD1-O 3.31Å; L355-V360 WeakPolarHBondContact CD1-O 3.45Å; L355-W362 HydrophobicContact CD1-CB 3.85Å; L355-E397 HydrophobicContact CB-CB 4.37Å; L355-E397 WeakPolarHBondContact CB-OE2 3.42Å; L355-E397 HydrophobicContact CD1-CB 4.21Å; L355-E397 HydrophobicContact CD2-CB 4.03Å; L355-E397 HydrophobicContact CG-CB 4.44Å
356	P	91.9	Very high	90.4	Very high	69 Å²	69	32.3 Å²	32.3	45%	0.448	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-37.6	170.8	-28.1	32.5	0	0	0	114.2	R255 G358 E397	R255-P356 VanDerWaalsContact NH1-C 3.32Å; R255-P356 PolarHBondContact NH1-O 2.91Å; P356-G358 PolarHBondContact O-N 2.99Å; P356-E397 WeakPolarHBondContact CB-OE2 3.32Å; P356-E397 WeakPolarHBondContact CD-OE2 3.35Å
357	Q	90.7	Very high	89	Confident	17 Å²	17	37.3 Å²	37.3	8%	0.079	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-13.6	175.5	74.8	175.2	22.7	0	0	115.7	P248 L355 R359 Y361 W363 E397	P248-Q357 WeakPolarHBondContact CB-O 3.46Å; L355-Q357 HydrophobicContact CB-CG 4.07Å; L355-Q357 PolarHBondContact O-N 2.97Å; Q357-R359 HydrophobicContact CG-CB 4.09Å; Q357-R359 HydrophobicContact CG-CG 4.41Å; Q357-Y361 PolarHBondContact NE2-O 3.01Å; Q357-W363 PolarHBondContact OE1-O 3.46Å; Q357-E397 PolarHBondContact N-OE2 3.33Å
358	G	92.5	Very high	87.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	92.5	7.5	179.7	0	0	0	0	0	115.4	I251 L355 P356	I251-G358 WeakPolarHBondContact CD1-O 3.42Å; L355-G358 PolarHBondContact O-N 3.36Å; P356-G358 PolarHBondContact O-N 2.99Å
359	R	93.1	Very high	85.2	Confident	33 Å²	33	41.7 Å²	41.7	13%	0.125	21%	0.208	C	C	.	.			trans	-111.4	165.8	173.2	-64.5	175.5	55.2	137.4	-3.2	110.8	V216 P217 E219 P248 L355 Q357 Y361	V216-R359 VanDerWaalsContact CG1-CD 3.42Å; V216-R359 HydrophobicContact CG1-CG 4.1Å; P217-R359 WeakPolarHBondContact O-CD 3.34Å; P217-R359 PolarHBondContact O-NH1 3.36Å; E219-R359 HydrophobicContact CG-CB 4.19Å; E219-R359 HydrophobicContact CG-CG 4Å; P248-R359 HydrophobicContact CB-CG 3.98Å; P248-R359 HydrophobicContact CG-CG 3.46Å; P248-R359 VanDerWaalsContact CG-CG 3.46Å; L355-R359 VanDerWaalsContact CB-O 3.3Å; L355-R359 WeakPolarHBondContact CB-O 3.46Å; L355-R359 PolarHBondContact N-O 3.28Å; Q357-R359 HydrophobicContact CG-CB 4.09Å; Q357-R359 HydrophobicContact CG-CG 4.41Å; R359-Y361 VanDerWaalsContact CB-O 3.25Å; R359-Y361 WeakPolarHBondContact CB-O 3.45Å; R359-Y361 PolarHBondContact NE-O 2.77Å
360	V	91	Very high	83.2	Confident	11 Å²	11	42.5 Å²	42.5	7%	0.067	22%	0.222	C	C	.	.	S	Bend	trans	-82.2	-47.3	165.7	171.9	0	0	0	0	109.7	E219 T225 Q323 I354 L355	E219-V360 PolarHBondContact OE1-N 2.75Å; E219-V360 PolarHBondContact OE2-N 3.28Å; T225-V360 HydrophobicContact CG2-CG2 4.09Å; Q323-V360 HydrophobicContact CG-CG1 3.86Å; I354-V360 HydrophobicContact CG1-CG2 4.46Å; L355-V360 VanDerWaalsContact CD1-O 3.31Å; L355-V360 WeakPolarHBondContact CD1-O 3.45Å
361	Y	87.7	Confident	81.1	Confident	66 Å²	66	48.5 Å²	48.5	26%	0.259	26%	0.255	S	S	.	.	S	Bend	trans	-85.1	130.6	176.8	-64.4	-78.8	0	0	0	110.7	E219 I223 Q323 Q357 R359	E219-Y361 PolarHBondContact OE1-N 3.25Å; I223-Y361 HydrophobicContact CG2-CD2 3.78Å; I223-Y361 HydrophobicContact CG2-CE2 3.53Å; Q323-Y361 HydrophobicContact CG-CE1 4.27Å; Q357-Y361 PolarHBondContact NE2-O 3.01Å; R359-Y361 VanDerWaalsContact CB-O 3.25Å; R359-Y361 WeakPolarHBondContact CB-O 3.45Å; R359-Y361 PolarHBondContact NE-O 2.77Å
362	W	85.8	Confident	79	Confident	62 Å²	62	52.9 Å²	52.9	24%	0.235	27%	0.267	C	S	.	.			trans	-63.2	139.2	176.7	-176.3	70.9	0	0	0	109.9	L355 N364 I394 P396	L355-W362 HydrophobicContact CD1-CB 3.85Å; W362-N364 HydrophobicContact CE3-CB 4.41Å; W362-N364 HydrophobicContact CH2-CB 3.38Å; W362-N364 VanDerWaalsContact CH2-CG 3.5Å; W362-N364 HydrophobicContact CZ2-CB 4.02Å; W362-N364 HydrophobicContact CZ3-CB 3.6Å; W362-I394 HydrophobicContact CZ2-CG2 4.42Å; W362-P396 HydrophobicContact CD2-CB 3.92Å; W362-P396 HydrophobicContact CE3-CB 4.05Å; W362-P396 HydrophobicContact CE3-CG 4.41Å; W362-P396 HydrophobicContact CG-CB 4.43Å; W362-P396 HydrophobicContact CH2-CB 4.28Å; W362-P396 HydrophobicContact CH2-CG 3.97Å; W362-P396 HydrophobicContact CZ2-CB 4.2Å; W362-P396 HydrophobicContact CZ2-CG 4.24Å; W362-P396 HydrophobicContact CZ3-CB 4.21Å; W362-P396 HydrophobicContact CZ3-CG 4.07Å
363	W	84.7	Confident	76.9	Confident	44 Å²	44	54.2 Å²	54.2	17%	0.167	27%	0.272	C	S	.	.			trans	-129.8	116.1	-179.7	177.4	82.1	0	0	0	106.9	V214 V216 P217 Q357 P365	V214-W363 HydrophobicContact CG1-CH2 3.72Å; V214-W363 HydrophobicContact CG1-CZ3 4.03Å; V216-W363 HydrophobicContact CB-CE3 4.37Å; V216-W363 HydrophobicContact CB-CZ3 4.5Å; V216-W363 HydrophobicContact CG1-CE3 3.99Å; V216-W363 HydrophobicContact CG2-CE3 4.27Å; V216-W363 HydrophobicContact CG2-CZ3 4.3Å; P217-W363 VanDerWaalsContact CD-CD2 3.43Å; P217-W363 HydrophobicContact CG-CD2 3.81Å; P217-W363 VanDerWaalsContact CG-CE2 3.42Å; P217-W363 HydrophobicContact CG-CE3 4.45Å; P217-W363 HydrophobicContact CG-CG 4.09Å; P217-W363 HydrophobicContact CG-CH2 4.32Å; P217-W363 HydrophobicContact CG-CZ2 3.73Å; Q357-W363 PolarHBondContact OE1-O 3.46Å; W363-P365 HydrophobicContact CZ3-CB 4.25Å; W363-P365 WeakPolarHBondContact O-CD 3.49Å; W363-P365 VanDerWaalsContact O-N 3.13Å
364	N	83.4	Confident	74.9	Confident	41 Å²	41	54 Å²	54	22%	0.219	28%	0.278	C	S	.	.			trans	-64.9	113.7	-177.9	-172.5	-14	0	0	0	110.1	W362 K366 K367	W362-N364 HydrophobicContact CE3-CB 4.41Å; W362-N364 HydrophobicContact CH2-CB 3.38Å; W362-N364 VanDerWaalsContact CH2-CG 3.5Å; W362-N364 HydrophobicContact CZ2-CB 4.02Å; W362-N364 HydrophobicContact CZ3-CB 3.6Å; N364-K366 PolarHBondContact O-N 2.82Å; N364-K366 VanDerWaalsContact O-N 3.09Å; N364-K366 VanDerWaalsContact OD1-CB 3.29Å; N364-K366 WeakPolarHBondContact OD1-CB 3.4Å; N364-K366 WeakPolarHBondContact OD1-CG 3.39Å; N364-K366 PolarHBondContact OD1-N 3.32Å; N364-K367 HydrophobicContact CB-CD 4.33Å; N364-K367 HydrophobicContact CB-CG 4.1Å; N364-K367 WeakPolarHBondContact O-CB 3.44Å; N364-K367 PolarHBondContact O-N 3.48Å
365	P	79.3	Confident	72.6	Confident	34 Å²	34	59.1 Å²	59.1	22%	0.221	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-60.1	-24.8	179.6	-23.4	36.2	0	0	0	113.3	W363 G368 I394	W363-P365 HydrophobicContact CZ3-CB 4.25Å; W363-P365 WeakPolarHBondContact O-CD 3.49Å; W363-P365 VanDerWaalsContact O-N 3.13Å; P365-G368 PolarHBondContact O-N 3.18Å; P365-I394 HydrophobicContact CB-CD1 4.09Å; P365-I394 HydrophobicContact CG-CD1 4.19Å
366	K	72.4	Confident	70.4	Confident	61 Å²	61	61.4 Å²	61.4	27%	0.265	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-64.9	-36.2	174.9	-61.8	-170.1	173.4	-166	0	112.9	N364 G368 L369 N392 I394	N364-K366 PolarHBondContact O-N 2.82Å; N364-K366 VanDerWaalsContact O-N 3.09Å; N364-K366 VanDerWaalsContact OD1-CB 3.29Å; N364-K366 WeakPolarHBondContact OD1-CB 3.4Å; N364-K366 WeakPolarHBondContact OD1-CG 3.39Å; N364-K366 PolarHBondContact OD1-N 3.32Å; K366-G368 PolarHBondContact O-N 2.87Å; K366-L369 PolarHBondContact O-N 3.37Å; K366-N392 WeakPolarHBondContact CE-O 3.47Å; K366-N392 PolarHBondContact NZ-O 3.31Å; K366-I394 HydrophobicContact CG-CD1 3.94Å
367	K	67	Low	68.2	Low	137 Å²	137	59.9 Å²	59.9	60%	0.596	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-59	-29.8	176.1	-75.5	-176.5	177.6	-179.5	0	110.9	E319 N364 G370	E319-K367 IonicContact OE1-NZ 2.66Å; E319-K367 PolarHBondContact OE1-NZ 3.36Å; N364-K367 HydrophobicContact CB-CD 4.33Å; N364-K367 HydrophobicContact CB-CG 4.1Å; N364-K367 WeakPolarHBondContact O-CB 3.44Å; N364-K367 PolarHBondContact O-N 3.48Å; K367-G370 PolarHBondContact O-N 3.39Å
368	G	59.2	Low	66.3	Low	40 Å²	40	64.7 Å²	64.7	41%	0.412	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-76	-19.8	177.5	0	0	0	0	0	115.6	P365 K366	P365-G368 PolarHBondContact O-N 3.18Å; K366-G368 PolarHBondContact O-N 2.87Å
369	L	56.5	Low	64.2	Low	58 Å²	58	72.4 Å²	72.4	30%	0.304	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-19.7	173.2	-86.5	105.5	0	0	0	112.6	V214 K366 F373	V214-L369 HydrophobicContact CG2-CD1 3.44Å; V214-L369 VanDerWaalsContact CG2-CD1 3.44Å; V214-L369 HydrophobicContact CG2-CG 3.99Å; K366-L369 PolarHBondContact O-N 3.37Å; L369-F373 HydrophobicContact CB-CB 4.24Å; L369-F373 HydrophobicContact CD2-CD2 4.32Å
370	G	52.3	Low	62.1	Low	40 Å²	40	76 Å²	76	41%	0.412	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-162.4	-171.9	0	0	0	0	0	112.8	K367 Y372 F373	K367-G370 PolarHBondContact O-N 3.39Å; G370-Y372 PolarHBondContact O-N 3.13Å; G370-F373 PolarHBondContact O-N 3.19Å
371	D	51.4	Low	59.9	Low	132 Å²	132	80.5 Å²	80.5	71%	0.706	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-11.8	-179.4	-59.6	-20	0	0	0	113.7	F373 D374 E375	D371-F373 VanDerWaalsContact C-N 3.29Å; D371-F373 PolarHBondContact O-N 2.7Å; D371-D374 PolarHBondContact O-N 3.1Å; D371-D374 VanDerWaalsContact O-N 3.14Å; D371-E375 PolarHBondContact O-N 3.19Å; D371-E375 VanDerWaalsContact O-N 3.14Å
372	Y	47.4	Very low	58	Low	133 Å²	133	81.4 Å²	81.4	52%	0.522	43%	0.427	S	S	.	.	H	α-helix	trans	-64.8	-26.1	174.9	-95	-80.3	0	0	0	114.3	G370 I376	G370-Y372 PolarHBondContact O-N 3.13Å; Y372-I376 PolarHBondContact O-N 3.32Å
373	F	47.3	Very low	56.1	Low	43 Å²	43	86.3 Å²	86.3	19%	0.189	45%	0.452	C	S	.	.	H	α-helix	trans	-75.1	-33.3	173.4	-166.1	-88.3	0	0	0	110.9	L369 G370 D371 E375 I376 N377 N392	L369-F373 HydrophobicContact CB-CB 4.24Å; L369-F373 HydrophobicContact CD2-CD2 4.32Å; G370-F373 PolarHBondContact O-N 3.19Å; D371-F373 VanDerWaalsContact C-N 3.29Å; D371-F373 PolarHBondContact O-N 2.7Å; F373-E375 VanDerWaalsContact C-N 3.31Å; F373-I376 PolarHBondContact O-N 3.12Å; F373-N377 HydrophobicContact CE1-CB 4.38Å; F373-N377 VanDerWaalsContact O-CB 3.3Å; F373-N377 WeakPolarHBondContact O-CB 3.15Å; F373-N377 PolarHBondContact O-N 3.27Å; F373-N392 HydrophobicContact CZ-CB 4.4Å
374	D	49.9	Very low	53.9	Low	99 Å²	99	91.3 Å²	91.3	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-37.8	175.1	-67.6	-21.6	0	0	0	110	D371 N377 D378	D371-D374 PolarHBondContact O-N 3.1Å; D371-D374 VanDerWaalsContact O-N 3.14Å; D374-N377 PolarHBondContact O-N 2.87Å; D374-D378 WeakPolarHBondContact O-CB 3.5Å; D374-D378 VanDerWaalsContact O-CG 3.3Å; D374-D378 PolarHBondContact O-N 3.42Å
375	E	47.6	Very low	52.1	Low	116 Å²	116	95.7 Å²	95.7	54%	0.542	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-41.3	173.8	-72.6	-176.1	170.5	0	0	114	D371 F373 D378 E379	D371-E375 PolarHBondContact O-N 3.19Å; D371-E375 VanDerWaalsContact O-N 3.14Å; F373-E375 VanDerWaalsContact C-N 3.31Å; E375-D378 PolarHBondContact O-N 2.87Å; E375-E379 PolarHBondContact O-N 3.38Å
376	I	47.1	Very low	50.5	Low	53 Å²	53	101.9 Å²	101.9	27%	0.272	53%	0.526	S	S	.	.	H	α-helix	trans	-68.6	-39.7	176	-70.5	164.4	0	0	0	110.5	Y372 F373 D378 E379 D380	Y372-I376 PolarHBondContact O-N 3.32Å; F373-I376 PolarHBondContact O-N 3.12Å; I376-D378 VanDerWaalsContact C-N 3.26Å; I376-D378 PolarHBondContact O-N 3.44Å; I376-E379 PolarHBondContact O-N 2.89Å; I376-D380 VanDerWaalsContact CG2-OD2 3.25Å; I376-D380 WeakPolarHBondContact CG2-OD2 3.34Å; I376-D380 VanDerWaalsContact O-CB 3.31Å; I376-D380 WeakPolarHBondContact O-CB 3.4Å; I376-D380 PolarHBondContact O-N 3.41Å
377	N	46.4	Very low	49.4	Very low	38 Å²	38	104.3 Å²	104.3	20%	0.203	54%	0.543	C	S	.	.	H	α-helix	trans	-67.2	-34.2	179	-148.6	50.9	0	0	0	109.7	F373 D374 E381	F373-N377 HydrophobicContact CE1-CB 4.38Å; F373-N377 VanDerWaalsContact O-CB 3.3Å; F373-N377 WeakPolarHBondContact O-CB 3.15Å; F373-N377 PolarHBondContact O-N 3.27Å; D374-N377 PolarHBondContact O-N 2.87Å; N377-E381 PolarHBondContact ND2-OE1 2.84Å; N377-E381 WeakPolarHBondContact O-CA 3.12Å; N377-E381 WeakPolarHBondContact O-CB 3.27Å; N377-E381 WeakPolarHBondContact O-CG 3.41Å; N377-E381 PolarHBondContact O-N 3.12Å
378	D	50.1	Low	48.5	Very low	118 Å²	118	99.5 Å²	99.5	63%	0.631	53%	0.526	S	S	*	.	H	α-helix	trans	-68.7	-34	173.1	-74.8	-22.9	0	0	0	113.3	D374 E375 I376	D374-D378 WeakPolarHBondContact O-CB 3.5Å; D374-D378 VanDerWaalsContact O-CG 3.3Å; D374-D378 PolarHBondContact O-N 3.42Å; E375-D378 PolarHBondContact O-N 2.87Å; I376-D378 VanDerWaalsContact C-N 3.26Å; I376-D378 PolarHBondContact O-N 3.44Å
379	E	48.4	Very low	47.6	Very low	161 Å²	161	103.1 Å²	103.1	75%	0.752	53%	0.532	S	S	*	.	H	α-helix	trans	-78.4	-38.1	175.6	-74	-168.9	162.2	0	0	113.2	E375 I376	E375-E379 PolarHBondContact O-N 3.38Å; I376-E379 PolarHBondContact O-N 2.89Å
380	D	48.5	Very low	46.6	Very low	109 Å²	109	107.2 Å²	107.2	58%	0.583	55%	0.552	S	S	*	*	H	α-helix	trans	-86.7	-19.6	-179.4	-72.4	-25.9	0	0	0	112.8	I376 A382 E383	I376-D380 VanDerWaalsContact CG2-OD2 3.25Å; I376-D380 WeakPolarHBondContact CG2-OD2 3.34Å; I376-D380 VanDerWaalsContact O-CB 3.31Å; I376-D380 WeakPolarHBondContact O-CB 3.4Å; I376-D380 PolarHBondContact O-N 3.41Å; D380-A382 PolarHBondContact O-N 2.59Å; D380-E383 CarbonylContact O-C 3.43Å; D380-E383 PolarHBondContact O-N 3.48Å
381	E	45.7	Very low	46.5	Very low	106 Å²	106	113.4 Å²	113.4	50%	0.495	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.6	-17.6	173.7	-86.5	-176.4	-168.6	0	0	112.6	N377 E383	N377-E381 PolarHBondContact ND2-OE1 2.84Å; N377-E381 WeakPolarHBondContact O-CA 3.12Å; N377-E381 WeakPolarHBondContact O-CB 3.27Å; N377-E381 WeakPolarHBondContact O-CG 3.41Å; N377-E381 PolarHBondContact O-N 3.12Å; E381-E383 PolarHBondContact O-N 3.17Å
382	A	48.5	Very low	46.6	Very low	85 Å²	85	110.2 Å²	110.2	70%	0.702	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-25.5	174.9	0	0	0	0	0	112.6	D380	D380-A382 PolarHBondContact O-N 2.59Å
383	E	45.3	Very low	47	Very low	164 Å²	164	108.6 Å²	108.6	77%	0.766	55%	0.554	S	S	*	*	S	Bend	trans	-147.7	83.6	-178.4	-67.4	-171.2	174.4	0	0	111	D380 E381	D380-E383 CarbonylContact O-C 3.43Å; D380-E383 PolarHBondContact O-N 3.48Å; E381-E383 PolarHBondContact O-N 3.17Å
384	E	39.3	Very low	48.1	Very low	149 Å²	149	110.3 Å²	110.3	70%	0.696	56%	0.564	S	S	*	*			trans	169.8	128.1	131.7	-90.9	170.6	-171.5	0	0	113.4
385	N	44	Very low	49.4	Very low	133 Å²	133	113.3 Å²	113.3	71%	0.711	58%	0.575	S	S	*	*			trans	-12	150.8	170.5	-63.6	-48.7	0	0	0	119.6	D387 S388	N385-D387 PolarHBondContact O-N 2.98Å; N385-S388 PolarHBondContact O-N 3.34Å
386	E	47.3	Very low	51.2	Low	164 Å²	164	111 Å²	111	77%	0.766	57%	0.57	S	S	*	*	H	α-helix	trans	-40.4	-24.2	176.1	-65.1	177.4	163.5	0	0	116.1	M390	E386-M390 PolarHBondContact O-N 2.84Å
387	D	48.9	Very low	52.9	Low	113 Å²	113	111.4 Å²	111.4	60%	0.604	57%	0.571	S	S	*	*	H	α-helix	trans	-68.1	-27.9	174.1	-73.4	-28.8	0	0	0	114.1	N385 K391	N385-D387 PolarHBondContact O-N 2.98Å; D387-K391 PolarHBondContact O-N 2.96Å
388	S	47	Very low	54.7	Low	36 Å²	36	116 Å²	116	25%	0.252	59%	0.591	S	S	.	*	H	α-helix	trans	-76	-36.8	177	-64.7	0	0	0	0	111.4	N385 M390 K391 N392	N385-S388 PolarHBondContact O-N 3.34Å; S388-M390 VanDerWaalsContact C-N 3.32Å; S388-M390 PolarHBondContact O-N 2.85Å; S388-K391 PolarHBondContact O-N 2.84Å; S388-K391 VanDerWaalsContact O-N 3.11Å; S388-N392 PolarHBondContact O-N 2.97Å
389	Q	40.2	Very low	56.3	Low	116 Å²	116	111.1 Å²	111.1	54%	0.542	57%	0.568	S	S	.	*	H	α-helix	trans	-61.8	-37.6	174.9	-73.4	-176	-16.9	0	0	112.2	N392	Q389-N392 PolarHBondContact O-N 3.09Å
390	M	36.7	Very low	58.2	Low	144 Å²	144	106.6 Å²	106.6	71%	0.709	55%	0.553	S	S	*	*	H	α-helix	trans	-69.8	-29.1	174.9	-98.8	-167.7	-75.9	0	0	113.6	E386 S388 N392	E386-M390 PolarHBondContact O-N 2.84Å; S388-M390 VanDerWaalsContact C-N 3.32Å; S388-M390 PolarHBondContact O-N 2.85Å; M390-N392 VanDerWaalsContact C-N 3.29Å; M390-N392 PolarHBondContact O-N 2.61Å
391	K	49.4	Very low	60.1	Low	169 Å²	169	104.8 Å²	104.8	74%	0.735	55%	0.547	S	S	*	.	H	α-helix	trans	-72.6	-23	178.1	-75	175.9	-175.5	168.5	0	113	D387 S388	D387-K391 PolarHBondContact O-N 2.96Å; S388-K391 PolarHBondContact O-N 2.84Å; S388-K391 VanDerWaalsContact O-N 3.11Å
392	N	53	Low	62.3	Low	66 Å²	66	100.1 Å²	100.1	35%	0.353	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-4.8	-176.3	-73.3	-9.2	0	0	0	113.9	K366 F373 S388 Q389 M390 I394	K366-N392 WeakPolarHBondContact CE-O 3.47Å; K366-N392 PolarHBondContact NZ-O 3.31Å; F373-N392 HydrophobicContact CZ-CB 4.4Å; S388-N392 PolarHBondContact O-N 2.97Å; Q389-N392 PolarHBondContact O-N 3.09Å; M390-N392 VanDerWaalsContact C-N 3.29Å; M390-N392 PolarHBondContact O-N 2.61Å; N392-I394 PolarHBondContact O-N 3.4Å
393	V	57	Low	64.3	Low	99 Å²	99	97.7 Å²	97.7	60%	0.6	50%	0.501	S	S	*	.			trans	-86.4	100.7	176.5	-173.8	0	0	0	0	110	Q395	V393-Q395 PolarHBondContact O-N 3.33Å
394	I	70.7	Confident	66.6	Low	79 Å²	79	91 Å²	91	41%	0.405	47%	0.471	S	S	.	.			trans	-67.7	113.9	170.5	-54.8	179.5	0	0	0	107.6	W362 P365 K366 N392	W362-I394 HydrophobicContact CZ2-CG2 4.42Å; P365-I394 HydrophobicContact CB-CD1 4.09Å; P365-I394 HydrophobicContact CG-CD1 4.19Å; K366-I394 HydrophobicContact CG-CD1 3.94Å; N392-I394 PolarHBondContact O-N 3.4Å
395	Q	77.4	Confident	69.3	Low	162 Å²	162	86.1 Å²	86.1	76%	0.757	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-71.4	132.8	177.3	-66.3	179	17	0	0	109.8	V393 E397	V393-Q395 PolarHBondContact O-N 3.33Å; Q395-E397 PolarHBondContact O-N 3.13Å
396	P	83.9	Confident	71.8	Confident	67 Å²	67	79.9 Å²	79.9	44%	0.435	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-57.2	136.9	173.8	-25.3	34.7	0	0	0	112.2	W362 H398	W362-P396 HydrophobicContact CD2-CB 3.92Å; W362-P396 HydrophobicContact CE3-CB 4.05Å; W362-P396 HydrophobicContact CE3-CG 4.41Å; W362-P396 HydrophobicContact CG-CB 4.43Å; W362-P396 HydrophobicContact CH2-CB 4.28Å; W362-P396 HydrophobicContact CH2-CG 3.97Å; W362-P396 HydrophobicContact CZ2-CB 4.2Å; W362-P396 HydrophobicContact CZ2-CG 4.24Å; W362-P396 HydrophobicContact CZ3-CB 4.21Å; W362-P396 HydrophobicContact CZ3-CG 4.07Å; P396-H398 PolarHBondContact O-CD2 3.33Å
397	E	84.3	Confident	74	Confident	61 Å²	61	74.9 Å²	74.9	29%	0.285	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-84.6	127.4	175	-55.8	-179.2	169.2	0	0	108.8	L355 P356 Q357 Q395	L355-E397 HydrophobicContact CB-CB 4.37Å; L355-E397 WeakPolarHBondContact CB-OE2 3.42Å; L355-E397 HydrophobicContact CD1-CB 4.21Å; L355-E397 HydrophobicContact CD2-CB 4.03Å; L355-E397 HydrophobicContact CG-CB 4.44Å; P356-E397 WeakPolarHBondContact CB-OE2 3.32Å; P356-E397 WeakPolarHBondContact CD-OE2 3.35Å; Q357-E397 PolarHBondContact N-OE2 3.33Å; Q395-E397 PolarHBondContact O-N 3.13Å
398	H	83.9	Confident	76.1	Confident	134 Å²	134	72.8 Å²	72.8	62%	0.62	40%	0.396	S	S	*	.			trans	-117.3	142.8	178.7	-72.8	-80.9	0	0	0	110.9	E321 P396	E321-H398 WeakPolarHBondContact OE1-CB 3.28Å; E321-H398 IonicContact OE1-CG 2.77Å; E321-H398 IonicContact OE1-ND1 3.73Å; E321-H398 PolarHBondContact OE1-ND1 2.88Å; P396-H398 PolarHBondContact O-CD2 3.33Å
399	G	83.4	Confident	78.4	Confident	16 Å²	16	73.3 Å²	73.3	17%	0.165	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-94.9	173.1	174.9	0	0	0	0	0	111.2	E321	E321-G399 PolarHBondContact OE1-N 3.17Å; E321-G399 VanDerWaalsContact OE1-O 3.09Å; E321-G399 VanDerWaalsContact OE2-C 3.31Å; E321-G399 PolarHBondContact OE2-N 3.21Å
400	P	88.5	Confident	80.7	Confident	67 Å²	67	74.7 Å²	74.7	44%	0.435	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-69.6	141.9	154.9	30.2	-31.5	0	0	0	109.1	Y353 T404	Y353-P400 HydrophobicContact CD2-CG 4.48Å; Y353-P400 HydrophobicContact CG-CG 4.32Å; P400-T404 HydrophobicContact CB-CG2 4.48Å
401	P	88.4	Confident	83.2	Confident	71 Å²	71	71.7 Å²	71.7	46%	0.461	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-64.4	156.5	175.6	26.9	-33.4	0	0	0	110.7	T404	P401-T404 VanDerWaalsContact O-CB 3.29Å; P401-T404 WeakPolarHBondContact O-CB 3.3Å; P401-T404 PolarHBondContact O-N 3.24Å; P401-T404 PolarHBondContact O-OG1 3.04Å
402	I	90.2	Very high	84.9	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.036	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	161.5	170.4	65.6	169.2	0	0	0	110.7	F304 N324 Y325 T404	F304-I402 HydrophobicContact CD1-CD1 4.3Å; F304-I402 HydrophobicContact CE1-CD1 3.72Å; F304-I402 HydrophobicContact CE1-CG1 3.54Å; F304-I402 HydrophobicContact CZ-CG1 4.1Å; N324-I402 WeakPolarHBondContact O-CD1 3.27Å; Y325-I402 HydrophobicContact CD1-CD1 4.22Å; I402-T404 PolarHBondContact O-N 3.19Å
403	L	92.3	Very high	86.2	Confident	34 Å²	34	69.8 Å²	69.8	18%	0.178	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	16	-173.5	-47.8	-178.8	0	0	0	113.9	F304 V348 H349 H350	F304-L403 HydrophobicContact CD2-CD1 4.3Å; F304-L403 HydrophobicContact CE1-CD1 4.25Å; F304-L403 HydrophobicContact CE2-CD1 3.88Å; F304-L403 HydrophobicContact CZ-CB 4.39Å; F304-L403 HydrophobicContact CZ-CD1 3.85Å; F304-L403 HydrophobicContact CZ-CG 4.22Å; V348-L403 WeakPolarHBondContact CG1-O 3.39Å; V348-L403 HydrophobicContact CG2-CB 4.43Å; V348-L403 HydrophobicContact CG2-CD2 3.99Å; H349-L403 VanDerWaalsContact O-CA 3.25Å; H349-L403 WeakPolarHBondContact O-CA 3.38Å; H349-L403 PolarHBondContact O-N 3.05Å; H350-L403 HydrophobicContact CB-CD2 4.22Å
404	T	93	Very high	87.5	Confident	25 Å²	25	68.5 Å²	68.5	15%	0.153	40%	0.396	C	S	.	.			trans	-68.9	133.1	169.1	-65.7	0	0	0	0	110.6	V348 H349 P400 P401 I402 S408	V348-T404 WeakPolarHBondContact CA-O 3.45Å; H349-T404 PolarHBondContact N-O 3.34Å; P400-T404 HydrophobicContact CB-CG2 4.48Å; P401-T404 VanDerWaalsContact O-CB 3.29Å; P401-T404 WeakPolarHBondContact O-CB 3.3Å; P401-T404 PolarHBondContact O-N 3.24Å; P401-T404 PolarHBondContact O-OG1 3.04Å; I402-T404 PolarHBondContact O-N 3.19Å; T404-S408 VanDerWaalsContact CG2-OG 3.27Å; T404-S408 WeakPolarHBondContact CG2-OG 3.08Å
405	P	95.6	Very high	88.3	Confident	45 Å²	45	67.2 Å²	67.2	29%	0.292	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-61.3	137.1	178.2	-24.9	34.6	0	0	0	113.8	W347 V348 S407 S408	W347-P405 CarbonylContact O-C 3.58Å; W347-P405 VanDerWaalsContact O-CA 3.3Å; W347-P405 WeakPolarHBondContact O-CA 3.31Å; V348-P405 HydrophobicContact CG1-CG 4.43Å; P405-S407 PolarHBondContact O-N 3.38Å; P405-S408 PolarHBondContact O-N 2.99Å; P405-S408 PolarHBondContact O-OG 2.93Å
406	I	96.1	Very high	89	Confident	3 Å²	3	67.2 Å²	67.2	2%	0.015	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-65.9	-14.9	178.6	71	175	0	0	0	112.9	I296 L344 W347 S408 D409 W418 V435	I296-I406 HydrophobicContact CB-CG2 4.26Å; I296-I406 HydrophobicContact CD1-CD1 4.11Å; I296-I406 HydrophobicContact CG2-CG2 3.62Å; L344-I406 HydrophobicContact CB-CD1 4.12Å; L344-I406 HydrophobicContact CB-CG1 3.91Å; L344-I406 HydrophobicContact CD1-CD1 4.47Å; L344-I406 HydrophobicContact CD2-CD1 4.23Å; W347-I406 HydrophobicContact CB-CD1 3.47Å; W347-I406 VanDerWaalsContact CB-CD1 3.47Å; W347-I406 HydrophobicContact CB-CG1 3.78Å; W347-I406 HydrophobicContact CB-CG2 4.37Å; W347-I406 HydrophobicContact CG-CD1 4.19Å; W347-I406 PolarHBondContact O-N 3.28Å; I406-S408 PolarHBondContact O-N 3.41Å; I406-D409 VanDerWaalsContact O-CB 3.31Å; I406-D409 WeakPolarHBondContact O-CB 3.47Å; I406-D409 PolarHBondContact O-N 3.28Å; I406-D409 VanDerWaalsContact O-N 3.14Å; I406-W418 HydrophobicContact CD1-CB 4.38Å; I406-W418 HydrophobicContact CD1-CD2 4.07Å; I406-W418 HydrophobicContact CD1-CG 3.94Å; I406-W418 HydrophobicContact CG2-CZ2 4.34Å; I406-V435 HydrophobicContact CD1-CG1 3.98Å
407	S	94.6	Very high	89.4	Confident	59 Å²	59	64.6 Å²	64.6	41%	0.413	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-64.4	-20.6	173.4	59.4	0	0	0	0	113.3	S343 P405 D409	S343-S407 WeakPolarHBondContact O-CB 3.3Å; P405-S407 PolarHBondContact O-N 3.38Å; S407-D409 VanDerWaalsContact C-N 3.31Å
408	S	93.3	Very high	90	Very high	68 Å²	68	62.2 Å²	62.2	48%	0.476	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-82.9	-5.9	173.9	58.9	0	0	0	0	113.8	T404 P405 I406 L410	T404-S408 VanDerWaalsContact CG2-OG 3.27Å; T404-S408 WeakPolarHBondContact CG2-OG 3.08Å; P405-S408 PolarHBondContact O-N 2.99Å; P405-S408 PolarHBondContact O-OG 2.93Å; I406-S408 PolarHBondContact O-N 3.41Å; S408-L410 PolarHBondContact O-N 3.09Å
409	D	94.4	Very high	90.6	Very high	48 Å²	48	58.5 Å²	58.5	26%	0.257	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-64.8	132	-178.9	-72.2	0.1	0	0	0	111.5	H349 I406 S407 P417 W418	H349-D409 IonicContact CD2-OD1 3.21Å; H349-D409 IonicContact CE1-OD2 3.38Å; H349-D409 PolarHBondContact CE1-OD2 3.01Å; H349-D409 VanDerWaalsContact NE2-CG 3.33Å; H349-D409 IonicContact NE2-OD1 3.58Å; H349-D409 PolarHBondContact NE2-OD1 3.3Å; H349-D409 IonicContact NE2-OD2 3.91Å; H349-D409 PolarHBondContact NE2-OD2 2.99Å; I406-D409 VanDerWaalsContact O-CB 3.31Å; I406-D409 WeakPolarHBondContact O-CB 3.47Å; I406-D409 PolarHBondContact O-N 3.28Å; I406-D409 VanDerWaalsContact O-N 3.14Å; S407-D409 VanDerWaalsContact C-N 3.31Å; D409-P417 HydrophobicContact CB-CB 3.96Å; D409-P417 HydrophobicContact CB-CG 3.82Å; D409-W418 PolarHBondContact OD2-NE1 3.31Å
410	L	89.3	Confident	91.2	Very high	145 Å²	145	59.7 Å²	59.7	76%	0.759	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-76.5	133.8	-177.5	-64	175.4	0	0	0	111.4	S408 I412 P417	S408-L410 PolarHBondContact O-N 3.09Å; L410-I412 PolarHBondContact O-N 3.05Å; L410-P417 WeakPolarHBondContact O-CG 3.22Å
411	P	88.6	Confident	91.5	Very high	81 Å²	81	61.4 Å²	61.4	53%	0.526	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-67.6	128.3	174.7	27.6	-33.2	0	0	0	111	Q415	P411-Q415 VanDerWaalsContact CA-O 3.27Å; P411-Q415 WeakPolarHBondContact CA-O 3.44Å; P411-Q415 VanDerWaalsContact CB-O 3.26Å; P411-Q415 WeakPolarHBondContact CB-O 3.28Å
412	I	84.4	Confident	91.7	Very high	60 Å²	60	60.4 Å²	60.4	31%	0.308	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-95.7	126.2	176.9	-51	-177.1	0	0	0	108.3	L410 G414 Q415 I439	L410-I412 PolarHBondContact O-N 3.05Å; I412-G414 PolarHBondContact O-N 3.2Å; I412-G414 VanDerWaalsContact O-N 3.16Å; I412-Q415 PolarHBondContact N-O 3.02Å; I412-Q415 WeakPolarHBondContact O-CB 3.18Å; I412-Q415 PolarHBondContact O-N 3.19Å; I412-I439 HydrophobicContact CD1-CD1 3.71Å; I412-I439 HydrophobicContact CD1-CG1 4.28Å; I412-I439 HydrophobicContact CD1-CG2 4.41Å; I412-I439 HydrophobicContact CG1-CD1 4.05Å
413	F	81.7	Confident	91.8	Very high	135 Å²	135	62 Å²	62	59%	0.592	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	33.7	-177.5	-54.3	-63.4	0	0	0	113.8	Q415 V464 T465	F413-Q415 PolarHBondContact O-N 3.18Å; F413-V464 HydrophobicContact CE2-CG1 4.48Å; F413-T465 WeakPolarHBondContact CB-OG1 3.36Å
414	G	83.9	Confident	91.6	Very high	72 Å²	72	62.2 Å²	62.2	74%	0.742	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	-0	-177.6	0	0	0	0	0	115	I412	I412-G414 PolarHBondContact O-N 3.2Å; I412-G414 VanDerWaalsContact O-N 3.16Å
415	Q	86.7	Confident	91.3	Very high	52 Å²	52	70 Å²	70	24%	0.243	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-78.7	126.9	173	-167.2	179.6	10.4	0	0	109.3	P411 I412 F413 N438 S463 T465	P411-Q415 VanDerWaalsContact CA-O 3.27Å; P411-Q415 WeakPolarHBondContact CA-O 3.44Å; P411-Q415 VanDerWaalsContact CB-O 3.26Å; P411-Q415 WeakPolarHBondContact CB-O 3.28Å; I412-Q415 PolarHBondContact N-O 3.02Å; I412-Q415 WeakPolarHBondContact O-CB 3.18Å; I412-Q415 PolarHBondContact O-N 3.19Å; F413-Q415 PolarHBondContact O-N 3.18Å; Q415-N438 HydrophobicContact CG-CB 4.2Å; Q415-N438 PolarHBondContact NE2-O 3.25Å; Q415-S463 PolarHBondContact OE1-OG 3.5Å; Q415-T465 HydrophobicContact CB-CG2 4.21Å; Q415-T465 HydrophobicContact CG-CG2 4.4Å
416	K	92	Very high	90.9	Very high	161 Å²	161	75.5 Å²	75.5	70%	0.7	41%	0.41	S	S	*	.			trans	-60	133.9	170.4	-70.4	-171	176.1	-170.3	0	109.1	W418 N438	K416-W418 VanDerWaalsContact C-N 3.25Å; K416-W418 PolarHBondContact O-N 3.42Å; K416-N438 WeakPolarHBondContact O-CB 3.12Å; K416-N438 PolarHBondContact O-ND2 3.41Å
417	P	93.9	Very high	90.5	Very high	12 Å²	12	79.8 Å²	79.8	8%	0.078	43%	0.432	C	S	.	.	S	Bend	trans	-63.4	-30.3	-176.7	-27.1	37.9	0	0	0	114.1	D409 L410 N438 I439	D409-P417 HydrophobicContact CB-CB 3.96Å; D409-P417 HydrophobicContact CB-CG 3.82Å; L410-P417 WeakPolarHBondContact O-CG 3.22Å; P417-N438 WeakPolarHBondContact O-CB 3.37Å; P417-N438 PolarHBondContact O-N 2.93Å; P417-I439 HydrophobicContact CB-CD1 3.78Å; P417-I439 HydrophobicContact CB-CG1 4.48Å; P417-I439 HydrophobicContact CG-CD1 4.29Å
418	W	96.8	Very high	89.9	Confident	12 Å²	12	80.1 Å²	80.1	5%	0.045	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.8	-171.2	-61.7	103.2	0	0	0	112.6	S293 I296 L344 H349 I406 D409 K416 V435 S436 N438	S293-W418 WeakPolarHBondContact O-CZ2 3.47Å; I296-W418 HydrophobicContact CD1-CE3 4.3Å; I296-W418 HydrophobicContact CD1-CH2 3.85Å; I296-W418 HydrophobicContact CD1-CZ3 3.73Å; I296-W418 HydrophobicContact CG1-CH2 4.25Å; I296-W418 HydrophobicContact CG1-CZ3 4.47Å; I296-W418 HydrophobicContact CG2-CH2 3.63Å; I296-W418 HydrophobicContact CG2-CZ2 3.82Å; L344-W418 HydrophobicContact CD1-CB 3.64Å; H349-W418 AromaticContact CE1-CZ2 3.78Å; I406-W418 HydrophobicContact CD1-CB 4.38Å; I406-W418 HydrophobicContact CD1-CD2 4.07Å; I406-W418 HydrophobicContact CD1-CG 3.94Å; I406-W418 HydrophobicContact CG2-CZ2 4.34Å; D409-W418 PolarHBondContact OD2-NE1 3.31Å; K416-W418 VanDerWaalsContact C-N 3.25Å; K416-W418 PolarHBondContact O-N 3.42Å; W418-V435 HydrophobicContact CD2-CG1 4.29Å; W418-V435 HydrophobicContact CE3-CG1 3.58Å; W418-V435 HydrophobicContact CZ3-CG1 4.07Å; W418-S436 WeakPolarHBondContact CA-O 3.28Å; W418-N438 PolarHBondContact O-ND2 2.77Å
419	S	95.5	Very high	89.5	Confident	56 Å²	56	84.9 Å²	84.9	39%	0.392	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141.5	170.7	-63.9	0	0	0	0	109.4	V435 S436 N438	S419-V435 CarbonylContact O-C 3.6Å; S419-V435 WeakPolarHBondContact O-CA 3.27Å; S419-S436 PolarHBondContact N-O 3.22Å; S419-S436 PolarHBondContact O-N 3.13Å; S419-N438 VanDerWaalsContact OG-CG 3.25Å; S419-N438 PolarHBondContact OG-ND2 3.47Å; S419-N438 PolarHBondContact OG-OD1 3.49Å
420	I	96.2	Very high	89	Confident	41 Å²	41	89.5 Å²	89.5	21%	0.21	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.5	179.7	-167.8	156.4	0	0	0	112.1	L339 L344 V433 V434 V435	L339-I420 WeakPolarHBondContact O-CD1 3.44Å; L344-I420 HydrophobicContact CD2-CB 3.79Å; L344-I420 HydrophobicContact CD2-CD1 3.85Å; L344-I420 HydrophobicContact CD2-CG1 4.45Å; L344-I420 HydrophobicContact CD2-CG2 3.92Å; I420-V433 HydrophobicContact CD1-CG1 3.84Å; I420-V433 HydrophobicContact CG1-CG1 3.95Å; I420-V434 WeakPolarHBondContact CA-O 3.43Å; I420-V435 HydrophobicContact CB-CG2 4.5Å; I420-V435 HydrophobicContact CD1-CG2 3.68Å; I420-V435 HydrophobicContact CG1-CG2 3.96Å
421	R	94.1	Very high	89.1	Confident	102 Å²	102	82.8 Å²	82.8	39%	0.385	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	163.5	174.5	68.1	179.4	-172.7	-88.8	4.3	111.5	A122 I124 V434 S436	A122-R421 PolarHBondContact O-NH2 3.11Å; I124-R421 VanDerWaalsContact CD1-NH2 3.31Å; R421-V434 HydrophobicContact CG-CB 3.87Å; R421-V434 HydrophobicContact CG-CG1 4.47Å; R421-V434 HydrophobicContact CG-CG2 4.5Å; R421-V434 PolarHBondContact N-O 3.37Å; R421-V434 PolarHBondContact O-N 3.48Å; R421-S436 PolarHBondContact NH1-OG 2.75Å; R421-S436 VanDerWaalsContact NH1-OG 3.1Å
422	I	93.7	Very high	89.3	Confident	50 Å²	50	78.9 Å²	78.9	26%	0.256	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	140	172.7	-57.1	171.4	0	0	0	108	I336 A340 S424 A431	I336-I422 HydrophobicContact CG2-CD1 4.2Å; I336-I422 HydrophobicContact CG2-CG1 4.45Å; I336-I422 HydrophobicContact CG2-CG2 4.28Å; A340-I422 HydrophobicContact CB-CD1 3.59Å; A340-I422 HydrophobicContact CB-CG1 3.5Å; A340-I422 VanDerWaalsContact CB-CG1 3.5Å; I422-S424 WeakPolarHBondContact CG2-O 3.14Å; I422-S424 PolarHBondContact O-N 2.99Å; I422-A431 HydrophobicContact CG2-CB 3.4Å; I422-A431 VanDerWaalsContact CG2-CB 3.4Å
423	S	91.5	Very high	89.8	Confident	40 Å²	40	76.1 Å²	76.1	28%	0.28	39%	0.393	S	S	.	.	S	Bend	trans	-62.6	-40.6	-178.7	64.2	0	0	0	0	113.2	N121 A431 S432	N121-S423 WeakPolarHBondContact O-CB 3.36Å; S423-A431 WeakPolarHBondContact OG-CA 3.49Å; S423-S432 PolarHBondContact N-O 3.47Å; S423-S432 PolarHBondContact OG-N 3.25Å; S423-S432 PolarHBondContact OG-O 2.78Å
424	S	88.9	Confident	90.5	Very high	39 Å²	39	69.7 Å²	69.7	27%	0.273	37%	0.365	S	S	.	.			trans	-138.5	126	179.5	-177.5	0	0	0	0	111.7	I422 L426 I427 A431	I422-S424 WeakPolarHBondContact CG2-O 3.14Å; I422-S424 PolarHBondContact O-N 2.99Å; S424-L426 PolarHBondContact OG-N 3.43Å; S424-I427 PolarHBondContact OG-N 2.69Å; S424-A431 WeakPolarHBondContact O-CB 3.4Å
425	K	86.6	Confident	91.1	Very high	188 Å²	188	66.2 Å²	66.2	82%	0.817	33%	0.33	S	S	*	.	S	Bend	trans	-87.1	-10.9	169.8	-61.9	-176.5	-178.5	-178.1	0	112.8
426	L	87.4	Confident	91.6	Very high	161 Å²	161	64.1 Å²	64.1	84%	0.843	32%	0.321	S	S	*	.	S	Bend	trans	-83.6	-37.3	-176.4	-65.1	175	0	0	0	111.8	S424	S424-L426 PolarHBondContact OG-N 3.43Å
427	I	87.2	Confident	91.8	Very high	94 Å²	94	56.8 Å²	56.8	48%	0.482	29%	0.29	S	S	.	.			trans	-131.4	78.3	179.2	-49.5	173.8	0	0	0	107.7	S424 E429 H430 A431	S424-I427 PolarHBondContact OG-N 2.69Å; I427-E429 PolarHBondContact O-N 3.41Å; I427-H430 HydrophobicContact CG2-CB 4.18Å; I427-H430 PolarHBondContact O-N 3.27Å; I427-A431 PolarHBondContact O-N 3.45Å
428	P	82.8	Confident	91.9	Very high	65 Å²	65	57.8 Å²	57.8	42%	0.422	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-58.8	-32.5	-178.4	-24.5	35.1	0	0	0	112.6	I336 H430 A431	I336-P428 WeakPolarHBondContact CD1-O 3.4Å; P428-H430 PolarHBondContact O-N 3.5Å; P428-H430 VanDerWaalsContact O-N 3.16Å; P428-A431 WeakPolarHBondContact O-CB 3.15Å; P428-A431 PolarHBondContact O-N 3.35Å
429	E	83.5	Confident	91.7	Very high	168 Å²	168	58.4 Å²	58.4	79%	0.785	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.7	-179	-62.6	175.7	-174.9	0	0	114.2	I427	I427-E429 PolarHBondContact O-N 3.41Å
430	H	84.9	Confident	91.7	Very high	145 Å²	145	56.1 Å²	56.1	67%	0.671	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-115.4	12.5	177.4	-63	-47.5	0	0	0	112.3	I427 P428	I427-H430 HydrophobicContact CG2-CB 4.18Å; I427-H430 PolarHBondContact O-N 3.27Å; P428-H430 PolarHBondContact O-N 3.5Å; P428-H430 VanDerWaalsContact O-N 3.16Å
431	A	90.2	Very high	91.6	Very high	4 Å²	4	58.6 Å²	58.6	3%	0.033	30%	0.298	C	S	.	.			trans	-79.9	154.1	179.6	0	0	0	0	0	111.2	I336 I422 S423 S424 I427 P428	I336-A431 VanDerWaalsContact CD1-O 3.32Å; I336-A431 WeakPolarHBondContact CD1-O 3.31Å; I422-A431 HydrophobicContact CG2-CB 3.4Å; I422-A431 VanDerWaalsContact CG2-CB 3.4Å; S423-A431 WeakPolarHBondContact OG-CA 3.49Å; S424-A431 WeakPolarHBondContact O-CB 3.4Å; I427-A431 PolarHBondContact O-N 3.45Å; P428-A431 WeakPolarHBondContact O-CB 3.15Å; P428-A431 PolarHBondContact O-N 3.35Å
432	S	92.7	Very high	91.7	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.282	C	S	.	.			trans	-110.3	143.5	172.5	-51.2	0	0	0	0	108.2	S423 S447	S423-S432 PolarHBondContact N-O 3.47Å; S423-S432 PolarHBondContact OG-N 3.25Å; S423-S432 PolarHBondContact OG-O 2.78Å; S432-S447 CarbonylContact C-O 3.57Å; S432-S447 VanDerWaalsContact CA-O 3.25Å; S432-S447 WeakPolarHBondContact CA-O 3.23Å; S432-S447 WeakPolarHBondContact CB-O 3.39Å
433	V	95.4	Very high	91.9	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	136.4	174	-178.7	0	0	0	0	108.4	I336 L339 A340 W347 I420 V446 S447	I336-V433 HydrophobicContact CB-CG2 4.45Å; I336-V433 HydrophobicContact CG2-CG2 3.86Å; L339-V433 HydrophobicContact CB-CB 4.19Å; L339-V433 HydrophobicContact CB-CG1 4.21Å; L339-V433 HydrophobicContact CB-CG2 3.79Å; A340-V433 HydrophobicContact CB-CG1 4.27Å; A340-V433 HydrophobicContact CB-CG2 4.18Å; W347-V433 HydrophobicContact CZ2-CB 4.46Å; W347-V433 HydrophobicContact CZ2-CG1 4.06Å; I420-V433 HydrophobicContact CD1-CG1 3.84Å; I420-V433 HydrophobicContact CG1-CG1 3.95Å; V433-V446 CarbonylContact O-C 3.56Å; V433-V446 VanDerWaalsContact O-CA 3.3Å; V433-V446 WeakPolarHBondContact O-CA 3.41Å; V433-S447 PolarHBondContact N-O 3.03Å; V433-S447 PolarHBondContact O-N 3.28Å
434	V	96.2	Very high	92.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	117.8	-176.4	-175.1	0	0	0	0	108.7	A122 I124 I420 R421 A445 V446	A122-V434 HydrophobicContact CB-CG2 3.34Å; I124-V434 HydrophobicContact CD1-CG1 3.4Å; I420-V434 WeakPolarHBondContact CA-O 3.43Å; R421-V434 HydrophobicContact CG-CB 3.87Å; R421-V434 HydrophobicContact CG-CG1 4.47Å; R421-V434 HydrophobicContact CG-CG2 4.5Å; R421-V434 PolarHBondContact N-O 3.37Å; R421-V434 PolarHBondContact O-N 3.48Å; V434-A445 WeakPolarHBondContact CA-O 3.38Å; V434-V446 HydrophobicContact CG1-CG2 4.28Å; V434-V446 HydrophobicContact CG2-CG1 4.42Å; V434-V446 HydrophobicContact CG2-CG2 4.32Å
435	V	97.6	Very high	92.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.8	171.8	-177	0	0	0	0	108.1	I296 W347 I406 W418 S419 I420 H444 A445	I296-V435 HydrophobicContact CD1-CB 3.92Å; I296-V435 HydrophobicContact CD1-CG1 3.58Å; W347-V435 HydrophobicContact CD2-CG2 3.76Å; W347-V435 HydrophobicContact CE3-CG2 4.32Å; W347-V435 HydrophobicContact CG-CG2 4.16Å; W347-V435 HydrophobicContact CH2-CG2 4.16Å; W347-V435 HydrophobicContact CZ2-CG2 3.61Å; W347-V435 HydrophobicContact CZ3-CG2 4.5Å; I406-V435 HydrophobicContact CD1-CG1 3.98Å; W418-V435 HydrophobicContact CD2-CG1 4.29Å; W418-V435 HydrophobicContact CE3-CG1 3.58Å; W418-V435 HydrophobicContact CZ3-CG1 4.07Å; S419-V435 CarbonylContact O-C 3.6Å; S419-V435 WeakPolarHBondContact O-CA 3.27Å; I420-V435 HydrophobicContact CB-CG2 4.5Å; I420-V435 HydrophobicContact CD1-CG2 3.68Å; I420-V435 HydrophobicContact CG1-CG2 3.96Å; V435-H444 CarbonylContact O-C 3.54Å; V435-H444 WeakPolarHBondContact O-CA 3.39Å; V435-A445 HydrophobicContact CB-CB 4.43Å; V435-A445 PolarHBondContact N-O 3.1Å; V435-A445 PolarHBondContact O-N 3.02Å
436	S	96.9	Very high	93	Very high	8 Å²	8	40.7 Å²	40.7	6%	0.056	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.7	-175.6	-58.3	0	0	0	0	110	W418 S419 R421 H444	W418-S436 WeakPolarHBondContact CA-O 3.28Å; S419-S436 PolarHBondContact N-O 3.22Å; S419-S436 PolarHBondContact O-N 3.13Å; R421-S436 PolarHBondContact NH1-OG 2.75Å; R421-S436 VanDerWaalsContact NH1-OG 3.1Å; S436-H444 VanDerWaalsContact CB-ND1 3.27Å; S436-H444 WeakPolarHBondContact CB-ND1 3.29Å; S436-H444 PolarHBondContact OG-CE1 3.34Å; S436-H444 PolarHBondContact OG-ND1 2.98Å
437	S	96.4	Very high	93.3	Very high	7 Å²	7	33.1 Å²	33.1	5%	0.049	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	129.5	171.8	-171.5	0	0	0	0	109.5	I439 W440 A443	S437-I439 PolarHBondContact OG-N 3.2Å; S437-W440 PolarHBondContact OG-N 3.14Å; S437-A443 PolarHBondContact N-O 2.86Å
438	N	94.9	Very high	93.6	Very high	33 Å²	33	29.3 Å²	29.3	18%	0.176	15%	0.154	C	C	.	.	S	Bend	trans	-88.6	-18.6	172.6	-65.3	-31.6	0	0	0	111.3	Q415 K416 P417 W418 S419 S463	Q415-N438 HydrophobicContact CG-CB 4.2Å; Q415-N438 PolarHBondContact NE2-O 3.25Å; K416-N438 WeakPolarHBondContact O-CB 3.12Å; K416-N438 PolarHBondContact O-ND2 3.41Å; P417-N438 WeakPolarHBondContact O-CB 3.37Å; P417-N438 PolarHBondContact O-N 2.93Å; W418-N438 PolarHBondContact O-ND2 2.77Å; S419-N438 VanDerWaalsContact OG-CG 3.25Å; S419-N438 PolarHBondContact OG-ND2 3.47Å; S419-N438 PolarHBondContact OG-OD1 3.49Å; N438-S463 WeakPolarHBondContact O-CB 3.34Å
439	I	93.9	Very high	93.8	Very high	25 Å²	25	29 Å²	29	13%	0.128	16%	0.163	C	C	.	.	S	Bend	trans	-82.5	-46.7	176.2	-64.9	169	0	0	0	110	I412 P417 S437 K462 S463	I412-I439 HydrophobicContact CD1-CD1 3.71Å; I412-I439 HydrophobicContact CD1-CG1 4.28Å; I412-I439 HydrophobicContact CD1-CG2 4.41Å; I412-I439 HydrophobicContact CG1-CD1 4.05Å; P417-I439 HydrophobicContact CB-CD1 3.78Å; P417-I439 HydrophobicContact CB-CG1 4.48Å; P417-I439 HydrophobicContact CG-CD1 4.29Å; S437-I439 PolarHBondContact OG-N 3.2Å; I439-K462 HydrophobicContact CG2-CD 4.18Å; I439-K462 VanDerWaalsContact CG2-CE 3.43Å; I439-K462 HydrophobicContact CG2-CG 3.73Å; I439-S463 WeakPolarHBondContact O-CB 3.39Å; I439-S463 PolarHBondContact O-N 3.16Å
440	W	95.2	Very high	94.1	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.027	16%	0.157	C	C	.	.	S	Bend	trans	-108	84.5	174.7	-70.4	106.5	0	0	0	109.5	R289 I290 S293 T294 S437 G442 A443 L461 K462	R289-W440 HydrophobicContact CB-CH2 4.17Å; R289-W440 HydrophobicContact CB-CZ2 3.88Å; I290-W440 HydrophobicContact CD1-CE3 3.98Å; I290-W440 HydrophobicContact CD1-CZ3 3.95Å; I290-W440 HydrophobicContact CG1-CD2 3.67Å; I290-W440 HydrophobicContact CG1-CE3 3.4Å; I290-W440 VanDerWaalsContact CG1-CE3 3.4Å; I290-W440 HydrophobicContact CG1-CG 4.31Å; I290-W440 HydrophobicContact CG1-CH2 3.91Å; I290-W440 HydrophobicContact CG1-CZ2 4.17Å; I290-W440 HydrophobicContact CG1-CZ3 3.52Å; S293-W440 PolarHBondContact OG-NE1 2.94Å; T294-W440 HydrophobicContact CG2-CB 3.69Å; T294-W440 HydrophobicContact CG2-CG 3.95Å; S437-W440 PolarHBondContact OG-N 3.14Å; W440-G442 PolarHBondContact O-N 3.35Å; W440-A443 HydrophobicContact CB-CB 4.14Å; W440-A443 VanDerWaalsContact O-CB 3.29Å; W440-A443 WeakPolarHBondContact O-CB 3.12Å; W440-A443 PolarHBondContact O-N 3.33Å; W440-L461 VanDerWaalsContact CZ3-C 3.47Å; W440-K462 HydrophobicContact CD2-CB 4.29Å; W440-K462 HydrophobicContact CD2-CG 4.4Å; W440-K462 HydrophobicContact CE3-CB 4.11Å; W440-K462 HydrophobicContact CH2-CB 3.82Å; W440-K462 HydrophobicContact CZ2-CB 3.96Å; W440-K462 HydrophobicContact CZ2-CD 4.2Å; W440-K462 HydrophobicContact CZ2-CG 4.18Å; W440-K462 HydrophobicContact CZ3-CB 3.89Å
441	V	94.1	Very high	94.4	Very high	93 Å²	93	28.6 Å²	28.6	56%	0.564	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	126.1	-179	-176.5	0	0	0	0	109.2	Y456	V441-Y456 PolarHBondContact O-OH 3.49Å; V441-Y456 VanDerWaalsContact O-OH 3.11Å
442	G	95.4	Very high	94.7	Very high	6 Å²	6	29 Å²	29	6%	0.062	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.4	-14.8	-173.2	0	0	0	0	0	114.1	W440 H444 Y456 V457	W440-G442 PolarHBondContact O-N 3.35Å; G442-H444 PolarHBondContact O-CD2 2.81Å; G442-H444 VanDerWaalsContact O-CD2 3.3Å; G442-Y456 CarbonylContact O-C 3.4Å; G442-Y456 WeakPolarHBondContact O-CA 3.43Å; G442-V457 WeakPolarHBondContact CA-O 3.4Å; G442-V457 PolarHBondContact O-N 3.1Å
443	A	97.4	Very high	94.8	Very high	2 Å²	2	30.7 Å²	30.7	2%	0.017	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	124.7	174.6	0	0	0	0	0	111.1	T294 S437 W440 Y456	T294-A443 HydrophobicContact CG2-CB 3.52Å; S437-A443 PolarHBondContact N-O 2.86Å; W440-A443 HydrophobicContact CB-CB 4.14Å; W440-A443 VanDerWaalsContact O-CB 3.29Å; W440-A443 WeakPolarHBondContact O-CB 3.12Å; W440-A443 PolarHBondContact O-N 3.33Å; A443-Y456 HydrophobicContact CB-CD2 3.74Å; A443-Y456 HydrophobicContact CB-CE2 4.21Å
444	H	97.3	Very high	94.8	Very high	35 Å²	35	30.8 Å²	30.8	16%	0.162	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.1	-176	-56.2	-52.2	0	0	0	111.2	I124 V435 S436 G442 N454 I455	I124-H444 HydrophobicContact CD1-CB 3.63Å; I124-H444 VanDerWaalsContact CD1-CG 3.41Å; I124-H444 HydrophobicContact CG2-CB 4.34Å; I124-H444 VanDerWaalsContact CG2-CD2 3.5Å; I124-H444 WeakPolarHBondContact CG2-CD2 3.42Å; V435-H444 CarbonylContact O-C 3.54Å; V435-H444 WeakPolarHBondContact O-CA 3.39Å; S436-H444 VanDerWaalsContact CB-ND1 3.27Å; S436-H444 WeakPolarHBondContact CB-ND1 3.29Å; S436-H444 PolarHBondContact OG-CE1 3.34Å; S436-H444 PolarHBondContact OG-ND1 2.98Å; G442-H444 PolarHBondContact O-CD2 2.81Å; G442-H444 VanDerWaalsContact O-CD2 3.3Å; H444-N454 CarbonylContact O-C 3.46Å; H444-N454 VanDerWaalsContact O-CA 3.3Å; H444-N454 WeakPolarHBondContact O-CA 3.39Å; H444-I455 HydrophobicContact CB-CG2 4.34Å; H444-I455 PolarHBondContact N-O 3.4Å; H444-I455 PolarHBondContact O-N 3.49Å
445	A	97.1	Very high	94.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	131	166.1	0	0	0	0	0	108.5	I296 W347 V434 V435 E453 N454	I296-A445 HydrophobicContact CD1-CB 3.73Å; I296-A445 HydrophobicContact CG1-CB 3.48Å; I296-A445 VanDerWaalsContact CG1-CB 3.48Å; W347-A445 HydrophobicContact CH2-CB 4.38Å; W347-A445 HydrophobicContact CZ3-CB 3.85Å; V434-A445 WeakPolarHBondContact CA-O 3.38Å; V435-A445 HydrophobicContact CB-CB 4.43Å; V435-A445 PolarHBondContact N-O 3.1Å; V435-A445 PolarHBondContact O-N 3.02Å; A445-E453 WeakPolarHBondContact CA-O 3.24Å; A445-N454 WeakPolarHBondContact CA-OD1 3.39Å; A445-N454 WeakPolarHBondContact CB-OD1 3.34Å
446	V	96	Very high	94.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.5	-179.9	-175.5	0	0	0	0	108.5	F119 A122 I124 V433 V434 W448 F452 E453	F119-V446 HydrophobicContact CD1-CB 4.1Å; F119-V446 HydrophobicContact CD1-CG2 3.83Å; F119-V446 HydrophobicContact CE1-CB 4.13Å; F119-V446 HydrophobicContact CE1-CG2 4.1Å; A122-V446 HydrophobicContact CB-CG1 4.05Å; A122-V446 HydrophobicContact CB-CG2 3.94Å; I124-V446 HydrophobicContact CD1-CG2 4.41Å; V433-V446 CarbonylContact O-C 3.56Å; V433-V446 VanDerWaalsContact O-CA 3.3Å; V433-V446 WeakPolarHBondContact O-CA 3.41Å; V434-V446 HydrophobicContact CG1-CG2 4.28Å; V434-V446 HydrophobicContact CG2-CG1 4.42Å; V434-V446 HydrophobicContact CG2-CG2 4.32Å; V446-W448 HydrophobicContact CB-CZ3 4.37Å; V446-W448 HydrophobicContact CG1-CE3 4.09Å; V446-W448 HydrophobicContact CG1-CZ3 4.31Å; V446-W448 WeakPolarHBondContact O-CZ3 3.49Å; V446-F452 CarbonylContact O-C 3.48Å; V446-F452 WeakPolarHBondContact O-CA 3.29Å; V446-E453 PolarHBondContact N-O 3.27Å; V446-E453 PolarHBondContact O-N 2.65Å
447	S	95	Very high	94.8	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.014	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139	175.6	178.7	0	0	0	0	111.6	S432 V433 R451	S432-S447 CarbonylContact C-O 3.57Å; S432-S447 VanDerWaalsContact CA-O 3.25Å; S432-S447 WeakPolarHBondContact CA-O 3.23Å; S432-S447 WeakPolarHBondContact CB-O 3.39Å; V433-S447 PolarHBondContact N-O 3.03Å; V433-S447 PolarHBondContact O-N 3.28Å; S447-R451 WeakPolarHBondContact CA-O 3.42Å; S447-R451 PolarHBondContact OG-O 2.79Å; S447-R451 VanDerWaalsContact OG-O 3.06Å
448	W	91.7	Very high	94.8	Very high	14 Å²	14	31.7 Å²	31.7	5%	0.053	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	130.1	176.2	64.2	95.1	0	0	0	110.2	Y118 V446 R450 R451 E453	Y118-W448 HydrophobicContact CD1-CB 3.72Å; Y118-W448 AromaticContact CD1-CD1 3.95Å; Y118-W448 AromaticContact CD1-CD2 3.95Å; Y118-W448 HydrophobicContact CD1-CD2 3.95Å; Y118-W448 HydrophobicContact CD1-CE3 4.5Å; Y118-W448 AromaticContact CD1-CG 3.59Å; Y118-W448 HydrophobicContact CD1-CG 3.59Å; Y118-W448 AromaticContact CD2-CD1 3.63Å; Y118-W448 AromaticContact CD2-CD2 3.57Å; Y118-W448 HydrophobicContact CD2-CD2 3.57Å; Y118-W448 AromaticContact CD2-CE2 3.26Å; Y118-W448 HydrophobicContact CD2-CE3 4.26Å; Y118-W448 AromaticContact CD2-CG 3.79Å; Y118-W448 HydrophobicContact CD2-CG 3.79Å; Y118-W448 HydrophobicContact CD2-CH2 4.37Å; Y118-W448 AromaticContact CD2-CZ2 3.72Å; Y118-W448 HydrophobicContact CD2-CZ2 3.72Å; Y118-W448 AromaticContact CD2-NE1 3.32Å; Y118-W448 VanDerWaalsContact CD2-NE1 3.32Å; Y118-W448 HydrophobicContact CE1-CB 3.74Å; Y118-W448 AromaticContact CE1-CD1 3.58Å; Y118-W448 HydrophobicContact CE1-CD2 4.37Å; Y118-W448 AromaticContact CE1-CG 3.62Å; Y118-W448 HydrophobicContact CE1-CG 3.62Å; Y118-W448 AromaticContact CE2-CD1 3.25Å; Y118-W448 HydrophobicContact CE2-CD2 4.04Å; Y118-W448 AromaticContact CE2-CE2 3.61Å; Y118-W448 AromaticContact CE2-CG 3.84Å; Y118-W448 HydrophobicContact CE2-CG 3.84Å; Y118-W448 HydrophobicContact CE2-CZ2 4.32Å; Y118-W448 AromaticContact CE2-NE1 3.08Å; Y118-W448 HydrophobicContact CG-CB 4.24Å; Y118-W448 AromaticContact CG-CD1 3.96Å; Y118-W448 AromaticContact CG-CD2 3.51Å; Y118-W448 HydrophobicContact CG-CD2 3.51Å; Y118-W448 AromaticContact CG-CE2 3.76Å; Y118-W448 AromaticContact CG-CE3 3.93Å; Y118-W448 HydrophobicContact CG-CE3 3.93Å; Y118-W448 AromaticContact CG-CG 3.66Å; Y118-W448 HydrophobicContact CG-CG 3.66Å; Y118-W448 HydrophobicContact CG-CZ2 4.32Å; Y118-W448 HydrophobicContact CG-CZ3 4.47Å; Y118-W448 AromaticContact CZ-CD1 3.2Å; Y118-W448 AromaticContact CZ-CG 3.74Å; Y118-W448 AromaticContact CZ-NE1 3.6Å; V446-W448 HydrophobicContact CB-CZ3 4.37Å; V446-W448 HydrophobicContact CG1-CE3 4.09Å; V446-W448 HydrophobicContact CG1-CZ3 4.31Å; V446-W448 WeakPolarHBondContact O-CZ3 3.49Å; W448-R450 PolarHBondContact O-N 3.4Å; W448-R451 HydrophobicContact CD2-CB 4.43Å; W448-R451 HydrophobicContact CZ2-CB 4.08Å; W448-R451 PolarHBondContact N-O 3.2Å; W448-R451 PolarHBondContact O-N 3.24Å; W448-R451 VanDerWaalsContact O-O 3.12Å; W448-E453 HydrophobicContact CH2-CB 3.81Å; W448-E453 HydrophobicContact CH2-CG 3.58Å; W448-E453 HydrophobicContact CZ2-CG 4.49Å; W448-E453 HydrophobicContact CZ3-CB 4Å; W448-E453 HydrophobicContact CZ3-CG 4.26Å
449	G	88	Confident	94.9	Very high	59 Å²	59	36.4 Å²	36.4	61%	0.608	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	-113.3	-179.3	0	0	0	0	0	112.1	P333	P333-G449 WeakPolarHBondContact CB-O 3.38Å
450	R	90.5	Very high	94.9	Very high	177 Å²	177	35.2 Å²	35.2	67%	0.668	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-2.3	178	-69.4	-177.7	-178.8	-162.5	-2.2	114.2	Y301 P333 W448	Y301-R450 WeakPolarHBondContact CE2-O 3.22Å; P333-R450 HydrophobicContact CB-CG 3.9Å; P333-R450 HydrophobicContact CG-CG 3.69Å; W448-R450 PolarHBondContact O-N 3.4Å
451	R	91.5	Very high	94.9	Very high	127 Å²	127	36.2 Å²	36.2	48%	0.479	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	158.7	-174.5	-68	-176.7	175.4	166.9	-9.4	110.8	E114 S447 W448	E114-R451 IonicContact OE1-NH1 2.99Å; E114-R451 PolarHBondContact OE1-NH1 3.09Å; E114-R451 IonicContact OE2-NH1 2.92Å; E114-R451 PolarHBondContact OE2-NH1 2.81Å; S447-R451 WeakPolarHBondContact CA-O 3.42Å; S447-R451 PolarHBondContact OG-O 2.79Å; S447-R451 VanDerWaalsContact OG-O 3.06Å; W448-R451 HydrophobicContact CD2-CB 4.43Å; W448-R451 HydrophobicContact CZ2-CB 4.08Å; W448-R451 PolarHBondContact N-O 3.2Å; W448-R451 PolarHBondContact O-N 3.24Å; W448-R451 VanDerWaalsContact O-O 3.12Å
452	F	94.5	Very high	94.8	Very high	11 Å²	11	35.5 Å²	35.5	5%	0.048	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	156.1	167.1	80.1	-79.2	0	0	0	108.7	I296 P298 Y301 Y302 H350 V446	I296-F452 WeakPolarHBondContact O-CE2 3.24Å; P298-F452 VanDerWaalsContact CD-CG 3.46Å; P298-F452 HydrophobicContact CG-CB 4.12Å; P298-F452 HydrophobicContact CG-CD1 4.33Å; P298-F452 HydrophobicContact CG-CG 4.26Å; Y301-F452 HydrophobicContact CD1-CD1 4.18Å; Y301-F452 AromaticContact CD1-CE1 3.44Å; Y301-F452 HydrophobicContact CD1-CE1 3.44Å; Y301-F452 VanDerWaalsContact CD1-CE1 3.44Å; Y301-F452 HydrophobicContact CD1-CZ 4.39Å; Y301-F452 AromaticContact CD2-CD1 3.8Å; Y301-F452 HydrophobicContact CD2-CD1 3.8Å; Y301-F452 AromaticContact CD2-CE1 3.93Å; Y301-F452 HydrophobicContact CD2-CE1 3.93Å; Y301-F452 HydrophobicContact CE1-CD1 4.22Å; Y301-F452 AromaticContact CE1-CE1 3.49Å; Y301-F452 HydrophobicContact CE1-CE1 3.49Å; Y301-F452 VanDerWaalsContact CE1-CE1 3.49Å; Y301-F452 HydrophobicContact CE1-CZ 4.46Å; Y301-F452 AromaticContact CE2-CD1 3.83Å; Y301-F452 HydrophobicContact CE2-CD1 3.83Å; Y301-F452 AromaticContact CE2-CE1 3.96Å; Y301-F452 HydrophobicContact CE2-CE1 3.96Å; Y301-F452 AromaticContact CG-CD1 3.97Å; Y301-F452 HydrophobicContact CG-CD1 3.97Å; Y301-F452 AromaticContact CG-CE1 3.67Å; Y301-F452 HydrophobicContact CG-CE1 3.67Å; Y301-F452 AromaticContact CZ-CE1 3.73Å; Y302-F452 HydrophobicContact CE2-CE1 4.02Å; Y302-F452 AromaticContact CE2-CZ 3.64Å; Y302-F452 HydrophobicContact CE2-CZ 3.64Å; Y302-F452 AromaticContact CZ-CZ 3.98Å; H350-F452 AromaticContact CE1-CE2 3.93Å; V446-F452 CarbonylContact O-C 3.48Å; V446-F452 WeakPolarHBondContact O-CA 3.29Å
453	E	95.2	Very high	94.6	Very high	37 Å²	37	36.8 Å²	36.8	17%	0.173	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	148.4	174.1	-79	-70.5	-163.6	0	0	111.5	N115 F119 R151 A445 V446 W448	N115-E453 WeakPolarHBondContact ND2-CG 3.46Å; N115-E453 PolarHBondContact ND2-OE1 3.04Å; F119-E453 HydrophobicContact CE1-CB 3.88Å; F119-E453 HydrophobicContact CZ-CB 3.66Å; R151-E453 WeakPolarHBondContact CD-OE2 3.29Å; R151-E453 IonicContact NH1-OE2 3.27Å; A445-E453 WeakPolarHBondContact CA-O 3.24Å; V446-E453 PolarHBondContact N-O 3.27Å; V446-E453 PolarHBondContact O-N 2.65Å; W448-E453 HydrophobicContact CH2-CB 3.81Å; W448-E453 HydrophobicContact CH2-CG 3.58Å; W448-E453 HydrophobicContact CZ2-CG 4.49Å; W448-E453 HydrophobicContact CZ3-CB 4Å; W448-E453 HydrophobicContact CZ3-CG 4.26Å
454	N	96.4	Very high	93.9	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	141	177.2	-56.3	-16.3	0	0	0	109.6	R151 Q295 I296 H444 A445	R151-N454 PolarHBondContact NH1-O 3.45Å; Q295-N454 WeakPolarHBondContact CA-ND2 3.32Å; Q295-N454 PolarHBondContact OE1-ND2 3.38Å; I296-N454 PolarHBondContact N-ND2 3.27Å; I296-N454 PolarHBondContact O-ND2 3.14Å; I296-N454 PolarHBondContact O-OD1 2.82Å; H444-N454 CarbonylContact O-C 3.46Å; H444-N454 VanDerWaalsContact O-CA 3.3Å; H444-N454 WeakPolarHBondContact O-CA 3.39Å; A445-N454 WeakPolarHBondContact CA-OD1 3.39Å; A445-N454 WeakPolarHBondContact CB-OD1 3.34Å
455	I	96.4	Very high	92.8	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139	-179.8	-172.5	175.1	0	0	0	109.8	F119 I124 F152 H444 V457	F119-I455 HydrophobicContact CD1-CG2 4.07Å; F119-I455 HydrophobicContact CD2-CD1 3.85Å; F119-I455 HydrophobicContact CE1-CB 4.23Å; F119-I455 HydrophobicContact CE1-CG2 3.77Å; F119-I455 HydrophobicContact CE2-CB 4.05Å; F119-I455 HydrophobicContact CE2-CD1 3.74Å; F119-I455 HydrophobicContact CE2-CG1 4.4Å; F119-I455 HydrophobicContact CE2-CG2 4.24Å; F119-I455 HydrophobicContact CG-CG2 4.43Å; F119-I455 HydrophobicContact CZ-CB 3.78Å; F119-I455 HydrophobicContact CZ-CD1 4.37Å; F119-I455 HydrophobicContact CZ-CG2 3.85Å; I124-I455 HydrophobicContact CG2-CG2 3.88Å; F152-I455 HydrophobicContact CD1-CD1 4.26Å; F152-I455 HydrophobicContact CE1-CD1 3.93Å; F152-I455 HydrophobicContact CE1-CG1 4.45Å; H444-I455 HydrophobicContact CB-CG2 4.34Å; H444-I455 PolarHBondContact N-O 3.4Å; H444-I455 PolarHBondContact O-N 3.49Å; I455-V457 HydrophobicContact CD1-CG2 3.82Å; I455-V457 HydrophobicContact CG1-CG2 3.93Å
456	Y	97.6	Very high	91.7	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.016	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.1	168.3	-172.3	-95.3	0	0	0	111.1	W153 G154 K155 I156 I290 V441 G442 A443 W459 G460	W153-Y456 AromaticContact CH2-CD1 3.64Å; W153-Y456 HydrophobicContact CH2-CD1 3.64Å; W153-Y456 AromaticContact CH2-CG 3.65Å; W153-Y456 HydrophobicContact CH2-CG 3.65Å; W153-Y456 HydrophobicContact CZ2-CG 4.35Å; W153-Y456 AromaticContact CZ3-CD1 3.64Å; W153-Y456 HydrophobicContact CZ3-CD1 3.64Å; W153-Y456 AromaticContact CZ3-CG 3.9Å; W153-Y456 HydrophobicContact CZ3-CG 3.9Å; W153-Y456 PolarHBondContact O-N 2.82Å; G154-Y456 CarbonylContact C-O 3.56Å; G154-Y456 WeakPolarHBondContact CA-O 2.98Å; K155-Y456 PolarHBondContact N-O 2.88Å; I156-Y456 HydrophobicContact CG1-CD1 3.89Å; I156-Y456 HydrophobicContact CG1-CE1 3.82Å; I290-Y456 HydrophobicContact CD1-CD1 4.46Å; I290-Y456 HydrophobicContact CD1-CD2 4.3Å; I290-Y456 HydrophobicContact CD1-CE1 4.16Å; I290-Y456 HydrophobicContact CD1-CE2 4.01Å; I290-Y456 HydrophobicContact CG1-CE2 4.5Å; I290-Y456 HydrophobicContact CG2-CD2 3.63Å; I290-Y456 HydrophobicContact CG2-CE2 4.14Å; I290-Y456 HydrophobicContact CG2-CG 4.15Å; V441-Y456 PolarHBondContact O-OH 3.49Å; V441-Y456 VanDerWaalsContact O-OH 3.11Å; G442-Y456 CarbonylContact O-C 3.4Å; G442-Y456 WeakPolarHBondContact O-CA 3.43Å; A443-Y456 HydrophobicContact CB-CD2 3.74Å; A443-Y456 HydrophobicContact CB-CE2 4.21Å; Y456-W459 PolarHBondContact OH-N 2.85Å; Y456-G460 VanDerWaalsContact OH-CA 3.28Å; Y456-G460 WeakPolarHBondContact OH-CA 3.3Å; Y456-G460 PolarHBondContact OH-N 2.98Å
457	V	96.8	Very high	90.9	Very high	19 Å²	19	46.5 Å²	46.5	12%	0.115	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	101.1	170.9	-175.4	0	0	0	0	109	K155 Y157 G442 I455	K155-V457 WeakPolarHBondContact O-CA 3.44Å; Y157-V457 HydrophobicContact CE2-CG1 4.35Å; Y157-V457 VanDerWaalsContact OH-CG1 3.27Å; Y157-V457 WeakPolarHBondContact OH-CG1 3.3Å; G442-V457 WeakPolarHBondContact CA-O 3.4Å; G442-V457 PolarHBondContact O-N 3.1Å; I455-V457 HydrophobicContact CD1-CG2 3.82Å; I455-V457 HydrophobicContact CG1-CG2 3.93Å
458	G	96.5	Very high	90.2	Very high	5 Å²	5	50.3 Å²	50.3	5%	0.052	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	-164	-173.4	0	0	0	0	0	115.1	K155 I156 Y157	K155-G458 PolarHBondContact O-N 3.31Å; K155-G458 VanDerWaalsContact O-N 3.11Å; I156-G458 CarbonylContact C-O 3.58Å; I156-G458 WeakPolarHBondContact CA-O 3.43Å; Y157-G458 WeakPolarHBondContact CD2-O 3.32Å; Y157-G458 PolarHBondContact N-O 3.38Å
459	W	95.8	Very high	89.8	Confident	131 Å²	131	57.1 Å²	57.1	50%	0.496	30%	0.297	S	S	.	.			trans	-89.9	-0.4	-174.4	-65.3	98.5	0	0	0	114.3	Y157 L260 Y456 L461	Y157-W459 HydrophobicContact CD2-CD2 4.15Å; Y157-W459 HydrophobicContact CD2-CG 4.4Å; Y157-W459 HydrophobicContact CD2-CZ2 4.47Å; L260-W459 HydrophobicContact CD2-CB 4.06Å; L260-W459 HydrophobicContact CD2-CD2 4.19Å; L260-W459 HydrophobicContact CD2-CE3 3.76Å; L260-W459 HydrophobicContact CD2-CG 4.37Å; Y456-W459 PolarHBondContact OH-N 2.85Å; W459-L461 VanDerWaalsContact C-N 3.28Å; W459-L461 HydrophobicContact CB-CD1 4.49Å; W459-L461 HydrophobicContact CB-CG 4.47Å; W459-L461 PolarHBondContact O-N 3.37Å
460	G	95.2	Very high	89.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	67.2	26.7	-176.3	0	0	0	0	0	113.5	Q286 Y456	Q286-G460 PolarHBondContact NE2-O 3.27Å; Y456-G460 VanDerWaalsContact OH-CA 3.28Å; Y456-G460 WeakPolarHBondContact OH-CA 3.3Å; Y456-G460 PolarHBondContact OH-N 2.98Å
461	L	93.7	Very high	89.1	Confident	28 Å²	28	54.1 Å²	54.1	15%	0.147	28%	0.281	C	S	.	.			trans	-115	137	-177.5	-69	177.9	0	0	0	111.8	R259 L260 W440 W459	R259-L461 WeakPolarHBondContact O-CD2 3.44Å; L260-L461 HydrophobicContact CD2-CD1 3.44Å; L260-L461 VanDerWaalsContact CD2-CD1 3.44Å; L260-L461 HydrophobicContact CD2-CG 4.27Å; L260-L461 HydrophobicContact CG-CD1 4.23Å; W440-L461 VanDerWaalsContact CZ3-C 3.47Å; W459-L461 VanDerWaalsContact C-N 3.28Å; W459-L461 HydrophobicContact CB-CD1 4.49Å; W459-L461 HydrophobicContact CB-CG 4.47Å; W459-L461 PolarHBondContact O-N 3.37Å
462	K	92.6	Very high	88.7	Confident	79 Å²	79	54.1 Å²	54.1	34%	0.343	29%	0.294	S	S	.	.			trans	-73.3	133.2	170.9	-165.9	174.6	-178.3	178.6	0	109	H258 I439 W440 V464	H258-K462 PolarHBondContact CE1-O 3.46Å; I439-K462 HydrophobicContact CG2-CD 4.18Å; I439-K462 VanDerWaalsContact CG2-CE 3.43Å; I439-K462 HydrophobicContact CG2-CG 3.73Å; W440-K462 HydrophobicContact CD2-CB 4.29Å; W440-K462 HydrophobicContact CD2-CG 4.4Å; W440-K462 HydrophobicContact CE3-CB 4.11Å; W440-K462 HydrophobicContact CH2-CB 3.82Å; W440-K462 HydrophobicContact CZ2-CB 3.96Å; W440-K462 HydrophobicContact CZ2-CD 4.2Å; W440-K462 HydrophobicContact CZ2-CG 4.18Å; W440-K462 HydrophobicContact CZ3-CB 3.89Å; K462-V464 WeakPolarHBondContact O-CG2 3.03Å; K462-V464 PolarHBondContact O-N 2.71Å
463	S	90.3	Very high	88	Confident	33 Å²	33	60.4 Å²	60.4	23%	0.231	32%	0.324	C	S	.	.			trans	-57.6	128.1	176.9	-178.8	0	0	0	0	110.1	Q415 N438 I439	Q415-S463 PolarHBondContact OE1-OG 3.5Å; N438-S463 WeakPolarHBondContact O-CB 3.34Å; I439-S463 WeakPolarHBondContact O-CB 3.39Å; I439-S463 PolarHBondContact O-N 3.16Å
464	V	83.9	Confident	87.3	Confident	43 Å²	43	63.4 Å²	63.4	26%	0.261	35%	0.347	S	S	.	.			trans	-124.5	87.7	172.8	-155.8	0	0	0	0	107.9	F413 K462 S466 G467 F468	F413-V464 HydrophobicContact CE2-CG1 4.48Å; K462-V464 WeakPolarHBondContact O-CG2 3.03Å; K462-V464 PolarHBondContact O-N 2.71Å; V464-S466 VanDerWaalsContact C-N 3.3Å; V464-S466 PolarHBondContact O-N 3.22Å; V464-G467 VanDerWaalsContact CG1-C 3.46Å; V464-G467 WeakPolarHBondContact CG1-O 3.35Å; V464-G467 PolarHBondContact O-N 3.16Å; V464-G467 VanDerWaalsContact O-N 3.13Å; V464-F468 HydrophobicContact CG2-CB 4.49Å
465	T	74.4	Confident	86.6	Confident	72 Å²	72	70 Å²	70	44%	0.442	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-35.3	-174	49.2	0	0	0	0	113.2	F413 Q415 G467	F413-T465 WeakPolarHBondContact CB-OG1 3.36Å; Q415-T465 HydrophobicContact CB-CG2 4.21Å; Q415-T465 HydrophobicContact CG-CG2 4.4Å; T465-G467 VanDerWaalsContact C-N 3.27Å; T465-G467 PolarHBondContact O-N 3.41Å
466	S	74.4	Confident	85.8	Confident	86 Å²	86	78 Å²	78	60%	0.601	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	1.1	178.1	56.9	0	0	0	0	114	V464	V464-S466 VanDerWaalsContact C-N 3.3Å; V464-S466 PolarHBondContact O-N 3.22Å
467	G	77.6	Confident	85	Confident	40 Å²	40	86.2 Å²	86.2	41%	0.412	46%	0.464	S	S	.	.			trans	86.8	147.7	-167.8	0	0	0	0	0	112.4	V464 T465 Q469	V464-G467 VanDerWaalsContact CG1-C 3.46Å; V464-G467 WeakPolarHBondContact CG1-O 3.35Å; V464-G467 PolarHBondContact O-N 3.16Å; V464-G467 VanDerWaalsContact O-N 3.13Å; T465-G467 VanDerWaalsContact C-N 3.27Å; T465-G467 PolarHBondContact O-N 3.41Å; G467-Q469 PolarHBondContact O-N 3.06Å
468	F	81.8	Confident	84.2	Confident	82 Å²	82	92.9 Å²	92.9	36%	0.36	50%	0.5	S	S	.	.			trans	-70.7	125	179	175.9	-110	0	0	0	111.1	A256 H258 V464 P470	A256-F468 VanDerWaalsContact O-CZ 3.29Å; A256-F468 WeakPolarHBondContact O-CZ 3.42Å; H258-F468 HydrophobicContact CB-CB 4.3Å; H258-F468 HydrophobicContact CB-CD1 3.93Å; H258-F468 HydrophobicContact CB-CD2 3.42Å; H258-F468 VanDerWaalsContact CB-CD2 3.42Å; H258-F468 HydrophobicContact CB-CE1 4.06Å; H258-F468 HydrophobicContact CB-CE2 3.58Å; H258-F468 HydrophobicContact CB-CG 3.6Å; H258-F468 HydrophobicContact CB-CZ 3.89Å; V464-F468 HydrophobicContact CG2-CB 4.49Å; F468-P470 HydrophobicContact CE1-CB 3.85Å; F468-P470 HydrophobicContact CZ-CB 4.42Å; F468-P470 WeakPolarHBondContact O-CD 2.99Å
469	Q	82	Confident	83.2	Confident	157 Å²	157	101.1 Å²	101.1	73%	0.734	54%	0.537	S	S	*	.			trans	-101.8	105.2	173.7	-173.1	61.4	41.5	0	0	108.7	G467	G467-Q469 PolarHBondContact O-N 3.06Å
470	P	81.1	Confident	82.1	Confident	68 Å²	68	102.9 Å²	102.9	44%	0.442	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-64	149	178.5	26.8	-33.4	0	0	0	110.6	F468 V472	F468-P470 HydrophobicContact CE1-CB 3.85Å; F468-P470 HydrophobicContact CZ-CB 4.42Å; F468-P470 WeakPolarHBondContact O-CD 2.99Å; P470-V472 PolarHBondContact O-N 2.96Å
471	Q	82.4	Confident	80.9	Confident	106 Å²	106	110.9 Å²	110.9	50%	0.495	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-62.4	137.2	170.6	-71.6	-168.9	-27.3	0	0	109.7	A256 Y272	A256-Q471 HydrophobicContact CB-CG 4.33Å; Y272-Q471 HydrophobicContact CD1-CB 4.33Å; Y272-Q471 WeakPolarHBondContact CD1-O 3.31Å; Y272-Q471 HydrophobicContact CE1-CB 4Å; Y272-Q471 WeakPolarHBondContact CE1-O 3.25Å
472	V	83.1	Confident	79.6	Confident	126 Å²	126	117.6 Å²	117.6	76%	0.764	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-77.8	145.8	174.4	-170.5	0	0	0	0	107.8	P470	P470-V472 PolarHBondContact O-N 2.96Å
473	Q	81.1	Confident	78.4	Confident	143 Å²	143	117.5 Å²	117.5	67%	0.668	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-58.5	148.4	171.8	-68	-168.7	1	0	0	110.5	Y272	Y272-Q473 HydrophobicContact CE1-CG 4.22Å; Y272-Q473 HydrophobicContact CE2-CG 4.27Å; Y272-Q473 WeakPolarHBondContact OH-CA 3.12Å
474	P	80.1	Confident	77.1	Confident	101 Å²	101	121.9 Å²	121.9	66%	0.656	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-55.8	147.5	175.2	25.5	-35.7	0	0	0	109.8	Y272 E476	Y272-P474 WeakPolarHBondContact OH-CD 3.5Å; P474-E476 PolarHBondContact O-N 2.75Å
475	V	82.3	Confident	76.3	Confident	140 Å²	140	123.4 Å²	123.4	85%	0.848	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-60.7	129.3	174.2	-176.5	0	0	0	0	107.7	M477	V475-M477 PolarHBondContact O-N 3.28Å
476	E	79.9	Confident	75.8	Confident	174 Å²	174	126.5 Å²	126.5	81%	0.813	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-53.3	134.1	173.6	-65.9	174.3	176.4	0	0	108.9	P474	P474-E476 PolarHBondContact O-N 2.75Å
477	M	80.7	Confident	75.7	Confident	177 Å²	177	129.3 Å²	129.3	87%	0.872	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-62.7	142	175	-67.1	-166.1	-65.6	0	0	108.8	V475 E479	V475-M477 PolarHBondContact O-N 3.28Å; M477-E479 PolarHBondContact O-N 2.76Å
478	N	79.3	Confident	75.4	Confident	160 Å²	160	136.6 Å²	136.6	86%	0.856	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-58.5	137.9	174.2	-66	-37.5	0	0	0	109.1
479	E	76.3	Confident	75.2	Confident	178 Å²	178	138.3 Å²	138.3	83%	0.832	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-56	148.3	168.4	64.4	-171.4	175.7	0	0	110.1	M477 Q481	M477-E479 PolarHBondContact O-N 2.76Å; E479-Q481 PolarHBondContact O-N 3.39Å; E479-Q481 VanDerWaalsContact O-N 3.16Å
480	Y	71.9	Confident	75.2	Confident	167 Å²	167	137.4 Å²	137.4	66%	0.655	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-58.4	122.4	174	179.4	-99.4	0	0	0	108.6	E482 V483 F486	Y480-E482 PolarHBondContact O-N 3.16Å; Y480-E482 VanDerWaalsContact O-N 3.16Å; Y480-V483 HydrophobicContact CE1-CG2 4.31Å; Y480-F486 HydrophobicContact CE1-CD2 4.45Å
481	Q	70.9	Confident	75.2	Confident	168 Å²	168	141.1 Å²	141.1	79%	0.785	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-65	119.3	176.5	-73.4	-177.4	-9.2	0	0	108.3	E479 V483	E479-Q481 PolarHBondContact O-N 3.39Å; E479-Q481 VanDerWaalsContact O-N 3.16Å; Q481-V483 VanDerWaalsContact C-N 3.33Å; Q481-V483 WeakPolarHBondContact O-CG2 3.49Å; Q481-V483 PolarHBondContact O-N 2.77Å
482	E	65.3	Low	75.1	Confident	170 Å²	170	140 Å²	140	79%	0.794	75%	0.753	S	S	*	*			trans	-55.2	96.4	174.1	-72.2	-178.5	179.4	0	0	109.7	Y480 S484	Y480-E482 PolarHBondContact O-N 3.16Å; Y480-E482 VanDerWaalsContact O-N 3.16Å; E482-S484 PolarHBondContact O-N 3.01Å
483	V	67	Low	75.2	Confident	77 Å²	77	136.9 Å²	136.9	47%	0.467	73%	0.734	S	S	.	*			trans	-69.9	125.7	170	-171.7	0	0	0	0	106.1	Y480 Q481 G485 F486	Y480-V483 HydrophobicContact CE1-CG2 4.31Å; Q481-V483 VanDerWaalsContact C-N 3.33Å; Q481-V483 WeakPolarHBondContact O-CG2 3.49Å; Q481-V483 PolarHBondContact O-N 2.77Å; V483-G485 PolarHBondContact O-N 2.86Å; V483-F486 HydrophobicContact CB-CD2 4.12Å; V483-F486 HydrophobicContact CB-CE2 4.14Å; V483-F486 WeakPolarHBondContact O-CD2 3.47Å; V483-F486 PolarHBondContact O-N 3.27Å
484	S	63	Low	75.3	Confident	125 Å²	125	135 Å²	135	87%	0.874	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	104.2	179.5	53.6	0	0	0	0	110.6	E482	E482-S484 PolarHBondContact O-N 3.01Å
485	G	68.5	Low	75.5	Confident	74 Å²	74	137.6 Å²	137.6	76%	0.763	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.9	-25	-174.1	0	0	0	0	0	114.3	V483	V483-G485 PolarHBondContact O-N 2.86Å
486	F	63.8	Low	75.6	Confident	138 Å²	138	136.3 Å²	136.3	61%	0.605	72%	0.723	S	S	*	*			trans	-95.9	120	174.5	-60.1	-80.7	0	0	0	109.7	Y480 V483	Y480-F486 HydrophobicContact CE1-CD2 4.45Å; V483-F486 HydrophobicContact CB-CD2 4.12Å; V483-F486 HydrophobicContact CB-CE2 4.14Å; V483-F486 WeakPolarHBondContact O-CD2 3.47Å; V483-F486 PolarHBondContact O-N 3.27Å
487	N	71.9	Confident	75.6	Confident	144 Å²	144	132.1 Å²	132.1	77%	0.77	70%	0.703	S	S	*	*			trans	-102.7	129.9	168.2	-74.5	-15.7	0	0	0	107.7	T489	N487-T489 PolarHBondContact O-N 3.09Å; N487-T489 VanDerWaalsContact O-N 3.09Å
488	E	72	Confident	75.6	Confident	193 Å²	193	126.4 Å²	126.4	90%	0.902	68%	0.684	S	S	*	*			trans	-61.2	113.8	169.9	-168	-179.1	-172.9	0	0	108.7
489	T	77.5	Confident	75.8	Confident	118 Å²	118	121.7 Å²	121.7	72%	0.724	67%	0.667	S	S	*	*			trans	-114.9	142.9	174	27.6	0	0	0	0	108.9	N487 D491	N487-T489 PolarHBondContact O-N 3.09Å; N487-T489 VanDerWaalsContact O-N 3.09Å; T489-D491 PolarHBondContact O-N 3.42Å
490	T	81.5	Confident	76	Confident	138 Å²	138	118.4 Å²	118.4	85%	0.847	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-56.9	134.1	173.4	-46.6	0	0	0	0	109.9
491	D	81.9	Confident	76.3	Confident	146 Å²	146	118.3 Å²	118.3	78%	0.781	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-52	129.3	175	-67.9	-29.4	0	0	0	110.1	T489	T489-D491 PolarHBondContact O-N 3.42Å
492	P	80.1	Confident	76.7	Confident	83 Å²	83	113.3 Å²	113.3	54%	0.539	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-62.1	143.4	-179.3	25.3	-32.7	0	0	0	110.1	E496	P492-E496 HydrophobicContact CB-CB 4.16Å
493	T	85.1	Confident	77.3	Confident	60 Å²	60	111.9 Å²	111.9	37%	0.368	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-66	153.2	176	58.7	0	0	0	0	110.3	Q495 E496 E497	T493-Q495 PolarHBondContact O-N 2.87Å; T493-E496 PolarHBondContact N-OE2 3Å; T493-E496 WeakPolarHBondContact O-CA 3.47Å; T493-E496 WeakPolarHBondContact O-CB 3.49Å; T493-E496 PolarHBondContact O-N 2.95Å; T493-E496 VanDerWaalsContact OG1-CD 3.22Å; T493-E496 WeakPolarHBondContact OG1-CG 3.33Å; T493-E496 PolarHBondContact OG1-OE2 3.1Å; T493-E497 PolarHBondContact O-N 2.85Å
494	P	83.3	Confident	77.7	Confident	104 Å²	104	113.7 Å²	113.7	68%	0.675	64%	0.644	S	S	*	*	H	α-helix	trans	-55.5	-25.6	-179.9	-27.3	34.4	0	0	0	113.9	A498	P494-A498 VanDerWaalsContact O-CB 3.27Å; P494-A498 WeakPolarHBondContact O-CB 3.49Å; P494-A498 PolarHBondContact O-N 2.88Å
495	Q	82.8	Confident	78.2	Confident	155 Å²	155	112.4 Å²	112.4	72%	0.724	63%	0.627	S	S	*	*	H	α-helix	trans	-73.1	-40.3	175.9	-66.8	137.3	7.5	0	0	112	T493 A499	T493-Q495 PolarHBondContact O-N 2.87Å; Q495-A499 WeakPolarHBondContact O-CB 3.48Å; Q495-A499 PolarHBondContact O-N 3.46Å
496	E	85	Confident	77.9	Confident	113 Å²	113	112.9 Å²	112.9	53%	0.528	62%	0.617	S	S	.	*	H	α-helix	trans	-68.8	-39.4	175.4	-71.2	163.6	154.9	0	0	110.8	P492 T493 A499 L500	P492-E496 HydrophobicContact CB-CB 4.16Å; T493-E496 PolarHBondContact N-OE2 3Å; T493-E496 WeakPolarHBondContact O-CA 3.47Å; T493-E496 WeakPolarHBondContact O-CB 3.49Å; T493-E496 PolarHBondContact O-N 2.95Å; T493-E496 VanDerWaalsContact OG1-CD 3.22Å; T493-E496 WeakPolarHBondContact OG1-CG 3.33Å; T493-E496 PolarHBondContact OG1-OE2 3.1Å; E496-A499 PolarHBondContact O-N 2.83Å; E496-L500 WeakPolarHBondContact O-CB 3.32Å; E496-L500 PolarHBondContact O-N 3.29Å
497	E	80.9	Confident	77.7	Confident	87 Å²	87	112.1 Å²	112.1	41%	0.407	63%	0.626	S	S	.	*	H	α-helix	trans	-65	-43.5	174.6	-164.6	-168.9	163.9	0	0	111.6	T493 A499 L500 R501	T493-E497 PolarHBondContact O-N 2.85Å; E497-A499 VanDerWaalsContact C-N 3.35Å; E497-A499 PolarHBondContact O-N 3.44Å; E497-L500 PolarHBondContact O-N 2.84Å; E497-R501 WeakPolarHBondContact O-CB 3.46Å; E497-R501 PolarHBondContact O-N 3Å; E497-R501 IonicContact OE1-CZ 3.57Å; E497-R501 IonicContact OE1-NH1 2.65Å; E497-R501 IonicContact OE1-NH2 2.62Å
498	A	80.2	Confident	77	Confident	57 Å²	57	114 Å²	114	47%	0.471	63%	0.63	S	S	.	*	H	α-helix	trans	-63.5	-40.2	175.4	0	0	0	0	0	112.1	P494 R501 A502	P494-A498 VanDerWaalsContact O-CB 3.27Å; P494-A498 WeakPolarHBondContact O-CB 3.49Å; P494-A498 PolarHBondContact O-N 2.88Å; A498-R501 PolarHBondContact O-N 2.9Å; A498-A502 WeakPolarHBondContact O-CB 3.27Å; A498-A502 PolarHBondContact O-N 3.34Å
499	A	83	Confident	76	Confident	61 Å²	61	109.2 Å²	109.2	50%	0.504	62%	0.623	S	S	.	*	H	α-helix	trans	-65.5	-41.6	175.1	0	0	0	0	0	111.6	Q495 E496 E497 A502 L503	Q495-A499 WeakPolarHBondContact O-CB 3.48Å; Q495-A499 PolarHBondContact O-N 3.46Å; E496-A499 PolarHBondContact O-N 2.83Å; E497-A499 VanDerWaalsContact C-N 3.35Å; E497-A499 PolarHBondContact O-N 3.44Å; A499-A502 PolarHBondContact O-N 2.95Å; A499-L503 WeakPolarHBondContact O-CB 3.11Å; A499-L503 PolarHBondContact O-N 3.37Å
500	L	79.5	Confident	74.4	Confident	108 Å²	108	112.3 Å²	112.3	57%	0.565	63%	0.63	S	S	*	*	H	α-helix	trans	-63.6	-44.7	175.6	-162.7	88.2	0	0	0	110.8	E496 E497 A502 L503 L504	E496-L500 WeakPolarHBondContact O-CB 3.32Å; E496-L500 PolarHBondContact O-N 3.29Å; E497-L500 PolarHBondContact O-N 2.84Å; L500-A502 PolarHBondContact O-N 3.48Å; L500-L503 PolarHBondContact O-N 3.38Å; L500-L503 VanDerWaalsContact O-N 3.1Å; L500-L504 HydrophobicContact CD2-CD1 3.9Å; L500-L504 HydrophobicContact CG-CD1 3.83Å; L500-L504 WeakPolarHBondContact O-CB 3.44Å; L500-L504 WeakPolarHBondContact O-CD1 3.33Å; L500-L504 PolarHBondContact O-N 2.94Å
501	R	79.5	Confident	72.7	Confident	166 Å²	166	112.1 Å²	112.1	63%	0.626	62%	0.623	S	S	*	*	H	α-helix	trans	-57.8	-45.6	174.1	-90.3	-172.5	176.7	141.9	5.1	112.1	E497 A498 L503 L504 N505	E497-R501 WeakPolarHBondContact O-CB 3.46Å; E497-R501 PolarHBondContact O-N 3Å; E497-R501 IonicContact OE1-CZ 3.57Å; E497-R501 IonicContact OE1-NH1 2.65Å; E497-R501 IonicContact OE1-NH2 2.62Å; A498-R501 PolarHBondContact O-N 2.9Å; R501-L503 PolarHBondContact O-N 3.38Å; R501-L504 PolarHBondContact O-N 3.09Å; R501-N505 PolarHBondContact O-N 3.06Å
502	A	78.7	Confident	71	Confident	62 Å²	62	113 Å²	113	51%	0.512	62%	0.623	S	S	.	*	H	α-helix	trans	-65.4	-26.8	177.5	0	0	0	0	0	113	A498 A499 L500 N505	A498-A502 WeakPolarHBondContact O-CB 3.27Å; A498-A502 PolarHBondContact O-N 3.34Å; A499-A502 PolarHBondContact O-N 2.95Å; L500-A502 PolarHBondContact O-N 3.48Å; A502-N505 CarbonylContact O-C 3.48Å
503	L	77.3	Confident	69.4	Low	141 Å²	141	114.8 Å²	114.8	74%	0.738	63%	0.628	S	S	*	*	H	α-helix	trans	-83.2	-34.2	179	-152.7	148.7	0	0	0	112.1	A499 L500 R501	A499-L503 WeakPolarHBondContact O-CB 3.11Å; A499-L503 PolarHBondContact O-N 3.37Å; L500-L503 PolarHBondContact O-N 3.38Å; L500-L503 VanDerWaalsContact O-N 3.1Å; R501-L503 PolarHBondContact O-N 3.38Å
504	L	75.7	Confident	67.7	Low	115 Å²	115	116.8 Å²	116.8	60%	0.602	64%	0.64	S	S	*	*	H	α-helix	trans	-73.6	-38.5	174.2	-82.7	150.3	0	0	0	112.1	L500 R501 P506	L500-L504 HydrophobicContact CD2-CD1 3.9Å; L500-L504 HydrophobicContact CG-CD1 3.83Å; L500-L504 WeakPolarHBondContact O-CB 3.44Å; L500-L504 WeakPolarHBondContact O-CD1 3.33Å; L500-L504 PolarHBondContact O-N 2.94Å; R501-L504 PolarHBondContact O-N 3.09Å; L504-P506 WeakPolarHBondContact O-CD 3.39Å
505	N	74.5	Confident	66	Low	97 Å²	97	115.1 Å²	115.1	52%	0.519	64%	0.635	S	S	.	*	S	Bend	trans	-114.1	69.5	176.7	-66.5	10.2	0	0	0	109.2	R501 A502	R501-N505 PolarHBondContact O-N 3.06Å; A502-N505 CarbonylContact O-C 3.48Å
506	P	61.3	Low	64.2	Low	85 Å²	85	114.5 Å²	114.5	55%	0.552	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-59.8	136.4	171.8	26.4	-30.5	0	0	0	107.8	L504 E508	L504-P506 WeakPolarHBondContact O-CD 3.39Å; P506-E508 PolarHBondContact O-N 2.86Å; P506-E508 VanDerWaalsContact O-N 3.09Å
507	P	59.7	Low	62.3	Low	121 Å²	121	117.1 Å²	117.1	79%	0.786	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-56.6	123.6	179.4	23	-31.6	0	0	0	108.2	A509	P507-A509 PolarHBondContact O-N 3.43Å
508	E	57.8	Low	60.7	Low	184 Å²	184	121 Å²	121	86%	0.86	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-50.2	117.7	172.9	-66.5	178.5	161.6	0	0	106.9	P506 E510	P506-E508 PolarHBondContact O-N 2.86Å; P506-E508 VanDerWaalsContact O-N 3.09Å; E508-E510 VanDerWaalsContact C-N 3.34Å; E508-E510 PolarHBondContact O-N 3.13Å
509	A	50	Low	59.2	Low	92 Å²	92	126.2 Å²	126.2	76%	0.76	68%	0.675	S	S	*	*			trans	-61.2	103.8	177.2	0	0	0	0	0	106.3	P507 D511	P507-A509 PolarHBondContact O-N 3.43Å; A509-D511 PolarHBondContact O-N 3.11Å; A509-D511 VanDerWaalsContact O-N 3.13Å
510	E	45.6	Very low	57.4	Low	184 Å²	184	131.9 Å²	131.9	86%	0.86	69%	0.691	S	S	*	*			trans	-42.9	121.6	175.5	-67.5	179.3	161.6	0	0	108.5	E508 E512	E508-E510 VanDerWaalsContact C-N 3.34Å; E508-E510 PolarHBondContact O-N 3.13Å; E510-E512 PolarHBondContact O-N 2.87Å
511	D	44.1	Very low	55.9	Low	133 Å²	133	135.6 Å²	135.6	71%	0.711	71%	0.705	S	S	*	*			trans	-50.1	92.2	-174.2	-61.8	-65.6	0	0	0	112	A509 D513 V514	A509-D511 PolarHBondContact O-N 3.11Å; A509-D511 VanDerWaalsContact O-N 3.13Å; D511-D513 PolarHBondContact O-N 3.48Å; D511-D513 VanDerWaalsContact O-N 3.11Å; D511-V514 HydrophobicContact CB-CG2 4.22Å; D511-V514 PolarHBondContact O-N 3.04Å
512	E	46.3	Very low	54.4	Low	166 Å²	166	136.3 Å²	136.3	78%	0.776	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-1.3	165.2	-93.3	-167.2	170.5	0	0	112.4	E510	E510-E512 PolarHBondContact O-N 2.87Å
513	D	47.6	Very low	52.7	Low	119 Å²	119	143 Å²	143	64%	0.636	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-11.3	177.4	-79.4	-26.2	0	0	0	114.1	D511 A515	D511-D513 PolarHBondContact O-N 3.48Å; D511-D513 VanDerWaalsContact O-N 3.11Å; D513-A515 VanDerWaalsContact C-N 3.34Å
514	V	48.9	Very low	51	Low	102 Å²	102	139.3 Å²	139.3	62%	0.618	73%	0.733	S	S	*	*	H	α-helix	trans	-79.9	-19.7	170.5	-172.9	0	0	0	0	111.8	D511 K516	D511-V514 HydrophobicContact CB-CG2 4.22Å; D511-V514 PolarHBondContact O-N 3.04Å; V514-K516 VanDerWaalsContact C-N 3.33Å; V514-K516 PolarHBondContact O-N 2.81Å
515	A	47.2	Very low	49.3	Very low	69 Å²	69	141.6 Å²	141.6	57%	0.57	75%	0.745	S	S	*	*	H	α-helix	trans	-80.9	-8.8	177	0	0	0	0	0	114.1	D513	D513-A515 VanDerWaalsContact C-N 3.34Å
516	K	46	Very low	47.9	Very low	142 Å²	142	148.7 Å²	148.7	62%	0.617	78%	0.784	S	S	*	*	H	α-helix	trans	-99.5	-16.6	179.1	-81.4	-179.8	-174.6	152.6	0	115	V514	V514-K516 VanDerWaalsContact C-N 3.33Å; V514-K516 PolarHBondContact O-N 2.81Å
517	E	45.5	Very low	47.2	Very low	169 Å²	169	151.9 Å²	151.9	79%	0.79	80%	0.795	S	S	*	*	H	α-helix	trans	-86.5	-14.5	175	-70	-166.7	161	0	0	113.1
518	E	47.4	Very low	46.6	Very low	167 Å²	167	153.5 Å²	153.5	78%	0.78	80%	0.796	S	S	*	*	S	Bend	trans	-87.3	-10.2	174.3	-71.8	-167.8	162.2	0	0	114.5
519	E	46.7	Very low	45.9	Very low	168 Å²	168	151.8 Å²	151.8	79%	0.785	79%	0.792	S	S	*	*	S	Bend	trans	-94	-7.3	178.1	-77.5	-166.1	163.7	0	0	114.9
520	E	47.1	Very low	45.7	Very low	179 Å²	179	155.4 Å²	155.4	84%	0.836	79%	0.794	S	S	*	*	S	Bend	trans	-98.2	-1.3	-179.7	-72	-162.2	171.6	0	0	115.6
521	E	47.1	Very low	45.7	Very low	187 Å²	187	153.6 Å²	153.6	87%	0.874	79%	0.79	S	S	*	*	S	Bend	trans	-97.5	0.8	175.1	-74	-157	162.5	0	0	115.6
522	E	47.3	Very low	45.8	Very low	181 Å²	181	154.9 Å²	154.9	85%	0.846	80%	0.795	S	S	*	*	S	Bend	trans	-108.1	40.1	173.8	-81.5	-159.9	167.8	0	0	114.2
523	E	44	Very low	45.8	Very low	201 Å²	201	154.1 Å²	154.1	94%	0.939	80%	0.796	S	S	*	*			trans	-139	76.2	160.1	-75.9	-158.4	173.5	0	0	111.1
524	G	41.8	Very low	45.6	Very low	65 Å²	65	156.8 Å²	156.8	67%	0.67	81%	0.809	S	S	*	*			trans	-160.4	37.6	179.8	0	0	0	0	0	115
525	D	38.8	Very low	45.4	Very low	162 Å²	162	161.4 Å²	161.4	87%	0.866	83%	0.825	S	S	*	*			trans	-142.7	79.4	170.9	-92.7	-24.5	0	0	0	110.6
526	D	45.5	Very low	45.2	Very low	247 Å²	247	169.8 Å²	169.8	100%	1.321	85%	0.848	S	S	*	*			trans	171.2	0	146.3	-90.1	-22.7	0	0	0	109.4

Retrieved 526 of 526 residues in 130.2 ms (Link to these results)

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