A0A093GUB7_STRCA Loading...

Kelch-like 38

AlphaFold DB , UniProt , Accession A0A093GUB7, Species STRCA (Struthio camelus australis), Gene n/a, Length 580 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	41.5	Very low	65.5	Low	244 Å²	244	174.9 Å²	174.9	100%	1.202	86%	0.864	S	S	*	*				0	92.8	0	-86.4	173	159	0	0	105.8
2	E	44.8	Very low	67.4	Low	197 Å²	197	173.6 Å²	173.6	92%	0.921	85%	0.85	S	S	*	*			trans	-80.7	121.6	177	-74.1	172.8	156	0	0	108.4	R4	E2-R4 PolarHBondContact O-N 3.3Å
3	E	49.5	Very low	69.3	Low	195 Å²	195	166.5 Å²	166.5	91%	0.911	82%	0.818	S	S	*	*			trans	-67.6	113.3	169.9	-76.7	175.9	148.4	0	0	109	S5	E3-S5 PolarHBondContact O-N 3.19Å
4	R	54.4	Low	70.9	Confident	246 Å²	246	167.1 Å²	167.1	93%	0.928	82%	0.818	S	S	*	*			trans	-69.6	103.8	166.6	-78.6	177.6	170.9	176.4	-3.9	108.5	E2 A6	E2-R4 PolarHBondContact O-N 3.3Å; R4-A6 PolarHBondContact O-N 3.29Å
5	S	55.7	Low	72.2	Confident	111 Å²	111	163.4 Å²	163.4	78%	0.776	80%	0.803	S	S	*	*			trans	-69.6	113.2	160.7	64.8	0	0	0	0	107.9	E3 E7	E3-S5 PolarHBondContact O-N 3.19Å; S5-E7 PolarHBondContact O-N 2.61Å
6	A	63.4	Low	73.5	Confident	82 Å²	82	161.4 Å²	161.4	68%	0.678	79%	0.789	S	S	*	*			trans	-59.3	128.9	175.4	0	0	0	0	0	110	R4 E8	R4-A6 PolarHBondContact O-N 3.29Å; A6-E8 PolarHBondContact O-N 2.74Å; A6-E8 VanDerWaalsContact O-N 3.09Å
7	E	69.8	Low	74.4	Confident	200 Å²	200	156.3 Å²	156.3	94%	0.935	77%	0.773	S	S	*	*			trans	-71	99	169.8	-70.9	179.6	163.7	0	0	108.4	S5	S5-E7 PolarHBondContact O-N 2.61Å
8	E	81.3	Confident	75.1	Confident	186 Å²	186	150.3 Å²	150.3	87%	0.869	75%	0.749	S	S	*	*			trans	-78.7	125.6	176.9	-65.1	-177.9	171	0	0	110.7	A6	A6-E8 PolarHBondContact O-N 2.74Å; A6-E8 VanDerWaalsContact O-N 3.09Å
9	L	83.9	Confident	75.9	Confident	161 Å²	161	146.7 Å²	146.7	84%	0.843	73%	0.73	S	S	*	*			trans	-97.7	116.1	171.7	-177.1	92.8	0	0	0	110.2	F11	L9-F11 PolarHBondContact O-N 3.31Å
10	L	84.8	Confident	76.8	Confident	140 Å²	140	143.7 Å²	143.7	73%	0.733	72%	0.716	S	S	*	*			trans	-84.3	97.4	170.7	-177.6	63.3	0	0	0	110.7	K12	L10-K12 HydrophobicContact CG-CG 4.33Å
11	F	90.9	Very high	77.5	Confident	162 Å²	162	139.9 Å²	139.9	71%	0.711	70%	0.698	S	S	*	*			trans	-76.5	127.2	171.6	176.6	-105.6	0	0	0	111	L9 D13	L9-F11 PolarHBondContact O-N 3.31Å; F11-D13 HydrophobicContact CE1-CB 3.82Å; F11-D13 HydrophobicContact CZ-CB 4Å
12	K	88.3	Confident	79.9	Confident	159 Å²	159	134.2 Å²	134.2	69%	0.691	67%	0.666	S	S	*	*			trans	-124.8	105.8	174.3	-68	-174.6	-177.5	179.2	0	109.6	L10 Q14	L10-K12 HydrophobicContact CG-CG 4.33Å; K12-Q14 PolarHBondContact O-N 3.22Å
13	D	92.3	Very high	82.2	Confident	81 Å²	81	130.3 Å²	130.3	43%	0.433	65%	0.648	S	S	.	*			trans	-75.8	116.6	168.4	-173.8	-19.9	0	0	0	109.2	F11 D15 F16	F11-D13 HydrophobicContact CE1-CB 3.82Å; F11-D13 HydrophobicContact CZ-CB 4Å; D13-D15 PolarHBondContact OD1-N 2.64Å; D13-F16 HydrophobicContact CB-CB 3.86Å; D13-F16 PolarHBondContact OD1-N 3.5Å
14	Q	91.7	Very high	84.4	Confident	175 Å²	175	122.8 Å²	122.8	82%	0.818	61%	0.614	S	S	*	*	S	Bend	trans	-76.8	-25	-177.7	-63	-169.6	8.6	0	0	112.4	K12	K12-Q14 PolarHBondContact O-N 3.22Å
15	D	91.3	Very high	86.3	Confident	112 Å²	112	111.9 Å²	111.9	60%	0.599	57%	0.574	S	S	*	*	S	Bend	trans	-98.4	-18	-173.5	-65.3	-42.5	0	0	0	112.6	D13 S17 S18 E19	D13-D15 PolarHBondContact OD1-N 2.64Å; D15-S17 PolarHBondContact O-N 3.23Å; D15-S17 VanDerWaalsContact O-N 3.08Å; D15-S18 PolarHBondContact O-N 3.27Å; D15-S18 PolarHBondContact O-OG 3.16Å; D15-E19 PolarHBondContact O-N 3.04Å
16	F	92.1	Very high	88.1	Confident	131 Å²	131	108.1 Å²	108.1	58%	0.575	55%	0.553	S	S	*	*	H	α-helix	trans	-46.4	-45.9	-179.2	179.8	-102.1	0	0	0	113.6	D13 L20	D13-F16 HydrophobicContact CB-CB 3.86Å; D13-F16 PolarHBondContact OD1-N 3.5Å; F16-L20 HydrophobicContact CE1-CD2 4.31Å; F16-L20 WeakPolarHBondContact O-CB 3.47Å; F16-L20 PolarHBondContact O-N 3.4Å
17	S	88.3	Confident	89.5	Confident	75 Å²	75	107.1 Å²	107.1	52%	0.524	54%	0.536	S	S	.	.	H	α-helix	trans	-67.8	-36.2	-178.3	64.3	0	0	0	0	113.6	D15 L21	D15-S17 PolarHBondContact O-N 3.23Å; D15-S17 VanDerWaalsContact O-N 3.08Å; S17-L21 PolarHBondContact O-N 3.39Å
18	S	87.7	Confident	90.7	Very high	48 Å²	48	98.1 Å²	98.1	34%	0.336	49%	0.493	S	S	.	.	H	α-helix	trans	-76.8	-39.6	179.2	73.2	0	0	0	0	111	D15 L21 K22	D15-S18 PolarHBondContact O-N 3.27Å; D15-S18 PolarHBondContact O-OG 3.16Å; S18-L21 PolarHBondContact O-N 2.8Å; S18-K22 WeakPolarHBondContact O-CG 3.26Å; S18-K22 PolarHBondContact O-N 3.28Å
19	E	90.8	Very high	91.3	Very high	83 Å²	83	95.5 Å²	95.5	39%	0.388	48%	0.481	S	S	.	.	H	α-helix	trans	-68	-41.1	177.2	-167	55.8	-142.8	0	0	111.5	D15 L21 K22 Q23	D15-E19 PolarHBondContact O-N 3.04Å; E19-L21 VanDerWaalsContact C-N 3.34Å; E19-L21 PolarHBondContact O-N 2.56Å; E19-K22 WeakPolarHBondContact O-CB 3.48Å; E19-K22 PolarHBondContact O-N 3.49Å; E19-K22 IonicContact OE2-NZ 2.64Å; E19-Q23 WeakPolarHBondContact O-CG 3.3Å; E19-Q23 PolarHBondContact O-N 3.33Å; E19-Q23 PolarHBondContact OE1-NE2 2.94Å
20	L	93.1	Very high	91.7	Very high	86 Å²	86	91.5 Å²	91.5	45%	0.45	47%	0.467	S	S	.	.	H	α-helix	trans	-56.7	-46.3	173.8	178.2	63.6	0	0	0	111.9	F16 Q23 L24	F16-L20 HydrophobicContact CE1-CD2 4.31Å; F16-L20 WeakPolarHBondContact O-CB 3.47Å; F16-L20 PolarHBondContact O-N 3.4Å; L20-Q23 PolarHBondContact O-N 2.89Å; L20-L24 HydrophobicContact CG-CD1 4.27Å; L20-L24 WeakPolarHBondContact O-CG 3.19Å; L20-L24 PolarHBondContact O-N 2.84Å
21	L	92.1	Very high	92	Very high	63 Å²	63	86.6 Å²	86.6	33%	0.33	45%	0.45	S	S	.	.	H	α-helix	trans	-64.4	-39.1	178	-80.7	171.9	0	0	0	112.3	S17 S18 E19 L24 N25	S17-L21 PolarHBondContact O-N 3.39Å; S18-L21 PolarHBondContact O-N 2.8Å; E19-L21 VanDerWaalsContact C-N 3.34Å; E19-L21 PolarHBondContact O-N 2.56Å; L21-L24 PolarHBondContact O-N 2.88Å; L21-N25 PolarHBondContact O-N 2.84Å
22	K	91.9	Very high	92	Very high	125 Å²	125	82.1 Å²	82.1	54%	0.543	44%	0.436	S	S	.	.	H	α-helix	trans	-60.2	-46.4	173.1	-73.4	173.4	-174.1	168.3	0	112	S18 E19 N25 G26	S18-K22 WeakPolarHBondContact O-CG 3.26Å; S18-K22 PolarHBondContact O-N 3.28Å; E19-K22 WeakPolarHBondContact O-CB 3.48Å; E19-K22 PolarHBondContact O-N 3.49Å; E19-K22 IonicContact OE2-NZ 2.64Å; K22-N25 WeakPolarHBondContact O-CB 3.15Å; K22-N25 PolarHBondContact O-N 2.91Å; K22-G26 PolarHBondContact O-N 3.49Å
23	Q	93.5	Very high	92.1	Very high	115 Å²	115	81 Å²	81	54%	0.537	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-41.8	177.6	-63.1	-56.8	-36.1	0	0	111.5	E19 L20 N25 G26 L27	E19-Q23 WeakPolarHBondContact O-CG 3.3Å; E19-Q23 PolarHBondContact O-N 3.33Å; E19-Q23 PolarHBondContact OE1-NE2 2.94Å; L20-Q23 PolarHBondContact O-N 2.89Å; Q23-N25 VanDerWaalsContact C-N 3.3Å; Q23-N25 PolarHBondContact O-N 3.27Å; Q23-G26 PolarHBondContact O-N 3.19Å; Q23-G26 VanDerWaalsContact O-N 3.12Å; Q23-L27 PolarHBondContact O-N 3.37Å
24	L	94.3	Very high	92.2	Very high	38 Å²	38	79.2 Å²	79.2	20%	0.199	43%	0.429	C	S	.	.	H	α-helix	trans	-61.1	-36.3	173.8	-73.9	174.6	0	0	0	112.8	L20 L21 L27 R28 V51 Y93	L20-L24 HydrophobicContact CG-CD1 4.27Å; L20-L24 WeakPolarHBondContact O-CG 3.19Å; L20-L24 PolarHBondContact O-N 2.84Å; L21-L24 PolarHBondContact O-N 2.88Å; L24-L27 HydrophobicContact CD2-CD1 4.44Å; L24-L27 PolarHBondContact O-N 3.22Å; L24-R28 PolarHBondContact O-N 2.9Å; L24-V51 HydrophobicContact CD1-CG2 4.05Å; L24-Y93 HydrophobicContact CB-CD1 4.18Å; L24-Y93 HydrophobicContact CB-CE1 4.17Å
25	N	94.2	Very high	92.2	Very high	16 Å²	16	74.6 Å²	74.6	9%	0.086	41%	0.41	C	S	.	.	H	α-helix	trans	-66.2	-40	173.5	-161.4	22.4	0	0	0	111.7	L21 K22 Q23 R28 Q29 Y93	L21-N25 PolarHBondContact O-N 2.84Å; K22-N25 WeakPolarHBondContact O-CB 3.15Å; K22-N25 PolarHBondContact O-N 2.91Å; Q23-N25 VanDerWaalsContact C-N 3.3Å; Q23-N25 PolarHBondContact O-N 3.27Å; N25-R28 WeakPolarHBondContact O-CB 3.48Å; N25-R28 PolarHBondContact O-N 2.93Å; N25-R28 PolarHBondContact OD1-NE 3.07Å; N25-R28 VanDerWaalsContact OD1-NE 3.1Å; N25-R28 PolarHBondContact OD1-NH2 3.27Å; N25-Q29 WeakPolarHBondContact O-CG 3.05Å; N25-Q29 PolarHBondContact O-N 2.77Å; N25-Y93 HydrophobicContact CB-CD1 4.22Å; N25-Y93 HydrophobicContact CB-CG 4.32Å
26	G	93.9	Very high	92.3	Very high	33 Å²	33	69.3 Å²	69.3	34%	0.34	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-41.5	175.2	0	0	0	0	0	112.9	K22 Q23 Q29 S30	K22-G26 PolarHBondContact O-N 3.49Å; Q23-G26 PolarHBondContact O-N 3.19Å; Q23-G26 VanDerWaalsContact O-N 3.12Å; G26-Q29 PolarHBondContact O-N 3.12Å; G26-S30 PolarHBondContact O-N 3.42Å; G26-S30 VanDerWaalsContact O-N 3.16Å; G26-S30 PolarHBondContact O-OG 3.34Å
27	L	94.3	Very high	92.3	Very high	60 Å²	60	64.7 Å²	64.7	31%	0.314	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-43	172.8	-66.4	176.2	0	0	0	111.8	Q23 L24 Q29 S30 G31 V32	Q23-L27 PolarHBondContact O-N 3.37Å; L24-L27 HydrophobicContact CD2-CD1 4.44Å; L24-L27 PolarHBondContact O-N 3.22Å; L27-Q29 PolarHBondContact O-N 2.86Å; L27-S30 WeakPolarHBondContact CA-OG 3.48Å; L27-S30 CarbonylContact O-C 3.51Å; L27-S30 PolarHBondContact O-N 2.88Å; L27-S30 PolarHBondContact O-OG 2.57Å; L27-G31 PolarHBondContact O-N 3.44Å; L27-G31 VanDerWaalsContact O-N 3.1Å; L27-V32 HydrophobicContact CD2-CB 4.12Å; L27-V32 HydrophobicContact CD2-CG1 3.93Å; L27-V32 PolarHBondContact O-N 3.36Å
28	R	94.6	Very high	92.6	Very high	11 Å²	11	61.1 Å²	61.1	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-47.7	176.7	-173.2	-169.3	65.6	84.8	-0.5	111.9	L24 N25 S30 G31 T34 P46 Y93	L24-R28 PolarHBondContact O-N 2.9Å; N25-R28 WeakPolarHBondContact O-CB 3.48Å; N25-R28 PolarHBondContact O-N 2.93Å; N25-R28 PolarHBondContact OD1-NE 3.07Å; N25-R28 VanDerWaalsContact OD1-NE 3.1Å; N25-R28 PolarHBondContact OD1-NH2 3.27Å; R28-S30 PolarHBondContact O-N 3.49Å; R28-G31 PolarHBondContact O-N 2.75Å; R28-T34 HydrophobicContact CG-CG2 4.44Å; R28-P46 WeakPolarHBondContact CD-O 3.37Å; R28-P46 WeakPolarHBondContact CG-O 3.45Å; R28-Y93 VanDerWaalsContact CD-CE2 3.41Å
29	Q	92.7	Very high	92.8	Very high	131 Å²	131	59 Å²	59	61%	0.612	32%	0.324	S	S	*	.	H	α-helix	trans	-63.8	-30	-179.4	-73.2	176.4	-6.5	0	0	112.8	N25 G26 L27 G31	N25-Q29 WeakPolarHBondContact O-CG 3.05Å; N25-Q29 PolarHBondContact O-N 2.77Å; G26-Q29 PolarHBondContact O-N 3.12Å; L27-Q29 PolarHBondContact O-N 2.86Å; Q29-G31 VanDerWaalsContact C-N 3.35Å
30	S	92.6	Very high	92.7	Very high	78 Å²	78	55.3 Å²	55.3	55%	0.545	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.8	174.8	53.4	0	0	0	0	113.8	G26 L27 R28 V32	G26-S30 PolarHBondContact O-N 3.42Å; G26-S30 VanDerWaalsContact O-N 3.16Å; G26-S30 PolarHBondContact O-OG 3.34Å; L27-S30 WeakPolarHBondContact CA-OG 3.48Å; L27-S30 CarbonylContact O-C 3.51Å; L27-S30 PolarHBondContact O-N 2.88Å; L27-S30 PolarHBondContact O-OG 2.57Å; R28-S30 PolarHBondContact O-N 3.49Å; S30-V32 PolarHBondContact O-N 3.05Å; S30-V32 WeakPolarHBondContact OG-CG2 3.3Å
31	G	90.8	Very high	92.2	Very high	37 Å²	37	54.3 Å²	54.3	38%	0.381	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	10.2	-177.5	0	0	0	0	0	114.3	L27 R28 Q29 T34	L27-G31 PolarHBondContact O-N 3.44Å; L27-G31 VanDerWaalsContact O-N 3.1Å; R28-G31 PolarHBondContact O-N 2.75Å; Q29-G31 VanDerWaalsContact C-N 3.35Å; G31-T34 PolarHBondContact O-OG1 2.83Å
32	V	91.4	Very high	91.7	Very high	67 Å²	67	59.3 Å²	59.3	41%	0.406	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	129.5	-175.1	176.6	0	0	0	0	109.7	L27 S30 T34 H48	L27-V32 HydrophobicContact CD2-CB 4.12Å; L27-V32 HydrophobicContact CD2-CG1 3.93Å; L27-V32 PolarHBondContact O-N 3.36Å; S30-V32 PolarHBondContact O-N 3.05Å; S30-V32 WeakPolarHBondContact OG-CG2 3.3Å; V32-T34 PolarHBondContact O-N 3.04Å; V32-T34 VanDerWaalsContact O-N 3.14Å; V32-H48 PolarHBondContact O-NE2 3.22Å
33	L	91.8	Very high	91.6	Very high	136 Å²	136	59.7 Å²	59.7	71%	0.712	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	14.7	-179.8	-58.9	171.5	0	0	0	115.4	H48	L33-H48 PolarHBondContact O-CD2 3.44Å
34	T	92.4	Very high	91.6	Very high	43 Å²	43	59.5 Å²	59.5	26%	0.264	35%	0.346	S	S	.	.			trans	-73.6	129.9	173.3	61.1	0	0	0	0	110.8	R28 G31 V32 P46 C47	R28-T34 HydrophobicContact CG-CG2 4.44Å; G31-T34 PolarHBondContact O-OG1 2.83Å; V32-T34 PolarHBondContact O-N 3.04Å; V32-T34 VanDerWaalsContact O-N 3.14Å; T34-P46 HydrophobicContact CG2-CB 4.15Å; T34-C47 WeakPolarHBondContact CA-O 3.49Å; T34-C47 WeakPolarHBondContact CB-O 3.34Å
35	D	92.4	Very high	91.5	Very high	78 Å²	78	58 Å²	58	42%	0.417	34%	0.338	S	S	.	.			trans	-122	2.4	-170.6	65	-17.2	0	0	0	113.2	C47 H48 R49	D35-C47 PolarHBondContact N-O 3.16Å; D35-H48 VanDerWaalsContact OD1-CA 3.29Å; D35-H48 WeakPolarHBondContact OD1-CA 3.33Å; D35-R49 PolarHBondContact O-NE 3.33Å; D35-R49 PolarHBondContact O-NH2 3.4Å; D35-R49 WeakPolarHBondContact OD1-CG 3.43Å; D35-R49 PolarHBondContact OD1-N 3.38Å; D35-R49 WeakPolarHBondContact OD2-CB 3.18Å; D35-R49 WeakPolarHBondContact OD2-CD 3.46Å; D35-R49 WeakPolarHBondContact OD2-CG 3.45Å
36	V	93.2	Very high	91.5	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	144.6	172.1	66	0	0	0	0	110.9	C47 R49 L52 F63 P73 V75	V36-C47 HydrophobicContact CG1-CB 3.98Å; V36-C47 PolarHBondContact N-O 3.18Å; V36-C47 PolarHBondContact O-N 3.36Å; V36-C47 VanDerWaalsContact O-O 3.11Å; V36-R49 HydrophobicContact CB-CG 3.74Å; V36-R49 HydrophobicContact CG1-CG 3.61Å; V36-L52 HydrophobicContact CG1-CD1 4.2Å; V36-F63 HydrophobicContact CG1-CZ 4.39Å; V36-F63 HydrophobicContact CG2-CE1 4.27Å; V36-F63 HydrophobicContact CG2-CZ 4.11Å; V36-P73 CarbonylContact C-O 3.59Å; V36-P73 WeakPolarHBondContact CA-O 3.41Å; V36-V75 HydrophobicContact CG2-CG2 3.95Å
37	T	93.6	Very high	91.6	Very high	34 Å²	34	57.7 Å²	57.7	21%	0.209	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.9	169.9	-56.8	0	0	0	0	109.2	E44 I45 P73 K74 V75	T37-E44 HydrophobicContact CG2-CB 3.74Å; T37-E44 HydrophobicContact CG2-CG 4.29Å; T37-I45 WeakPolarHBondContact CA-O 3.37Å; T37-P73 PolarHBondContact N-O 2.97Å; T37-K74 CarbonylContact O-C 3.55Å; T37-K74 WeakPolarHBondContact O-CA 3.41Å; T37-V75 PolarHBondContact O-N 3.23Å
38	L	93.4	Very high	91.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	137.4	173.1	-63	-177.8	0	0	0	109.7	I45 L52 F59 V75 L77 L85 I89	L38-I45 PolarHBondContact N-O 3.48Å; L38-I45 PolarHBondContact O-N 3.03Å; L38-L52 HydrophobicContact CD1-CD1 3.87Å; L38-L52 HydrophobicContact CD2-CD1 4.5Å; L38-L52 HydrophobicContact CG-CD1 4.28Å; L38-F59 HydrophobicContact CD1-CE1 4.19Å; L38-F59 HydrophobicContact CD1-CZ 3.98Å; L38-F59 HydrophobicContact CD2-CE1 4.21Å; L38-V75 CarbonylContact C-O 3.6Å; L38-V75 HydrophobicContact CD2-CB 4.09Å; L38-V75 HydrophobicContact CD2-CG1 4.4Å; L38-L77 HydrophobicContact CD1-CD1 4.31Å; L38-L77 HydrophobicContact CD2-CD1 4.44Å; L38-L85 HydrophobicContact CB-CD2 4.38Å; L38-I89 HydrophobicContact CD1-CD1 3.59Å; L38-I89 HydrophobicContact CD1-CG1 4.32Å
39	C	91.4	Very high	91.5	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.02	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.5	-176.5	-57.7	0	0	0	0	111.4	F43 K74 V75 I76 L77	C39-F43 VanDerWaalsContact CA-O 3.29Å; C39-F43 WeakPolarHBondContact CA-O 3.32Å; C39-K74 WeakPolarHBondContact SG-CE 3.25Å; C39-K74 WeakPolarHBondContact SG-CG 3.33Å; C39-V75 PolarHBondContact N-O 3.48Å; C39-I76 HydrophobicContact CB-CG1 4.17Å; C39-I76 WeakPolarHBondContact O-CA 3.1Å; C39-L77 PolarHBondContact O-N 3.01Å
40	S	89.7	Confident	91.5	Very high	5 Å²	5	54.9 Å²	54.9	4%	0.035	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	108.9	171.6	176.8	0	0	0	0	107.8	D42 F43 V80 S82	S40-D42 PolarHBondContact O-N 3.26Å; S40-F43 PolarHBondContact N-O 3.11Å; S40-F43 VanDerWaalsContact N-O 3.12Å; S40-F43 PolarHBondContact O-N 2.8Å; S40-F43 VanDerWaalsContact O-N 3.07Å; S40-V80 PolarHBondContact OG-O 2.98Å; S40-S82 WeakPolarHBondContact CB-OG 3.3Å; S40-S82 PolarHBondContact O-OG 3.01Å; S40-S82 PolarHBondContact OG-N 3.4Å; S40-S82 PolarHBondContact OG-OG 3.03Å
41	G	82.9	Confident	91.6	Very high	66 Å²	66	51.9 Å²	51.9	68%	0.68	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	-124.2	-167.4	0	0	0	0	0	111.3
42	D	81.8	Confident	91.8	Very high	168 Å²	168	50.1 Å²	50.1	90%	0.898	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-2.9	179.1	-60.6	-37.1	0	0	0	113.7	S40	S40-D42 PolarHBondContact O-N 3.26Å
43	F	89.3	Confident	91.9	Very high	132 Å²	132	47.5 Å²	47.5	58%	0.579	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.4	179.4	-97.7	-98.1	0	0	0	111.6	C39 S40	C39-F43 VanDerWaalsContact CA-O 3.29Å; C39-F43 WeakPolarHBondContact CA-O 3.32Å; S40-F43 PolarHBondContact N-O 3.11Å; S40-F43 VanDerWaalsContact N-O 3.12Å; S40-F43 PolarHBondContact O-N 2.8Å; S40-F43 VanDerWaalsContact O-N 3.07Å
44	E	92.6	Very high	91.9	Very high	112 Å²	112	46 Å²	46	52%	0.523	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.5	179	-65.2	-169.9	-171.5	0	0	110.9	T37 K74	T37-E44 HydrophobicContact CG2-CB 3.74Å; T37-E44 HydrophobicContact CG2-CG 4.29Å; E44-K74 VanDerWaalsContact OE1-CE 3.3Å; E44-K74 WeakPolarHBondContact OE1-CE 3.48Å; E44-K74 IonicContact OE1-NZ 2.56Å; E44-K74 PolarHBondContact OE1-NZ 3.03Å
45	I	93.6	Very high	92	Very high	6 Å²	6	46 Å²	46	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	107.7	-177.9	-52.5	174	0	0	0	108.8	T37 L38 L85 Y86 I89	T37-I45 WeakPolarHBondContact CA-O 3.37Å; L38-I45 PolarHBondContact N-O 3.48Å; L38-I45 PolarHBondContact O-N 3.03Å; I45-L85 HydrophobicContact CD1-CB 4.44Å; I45-L85 HydrophobicContact CD1-CD2 4.1Å; I45-L85 HydrophobicContact CD1-CG 3.99Å; I45-Y86 HydrophobicContact CD1-CD2 4.33Å; I45-I89 HydrophobicContact CG2-CB 4.49Å; I45-I89 HydrophobicContact CG2-CG2 4.05Å
46	P	94.3	Very high	92.1	Very high	43 Å²	43	42.4 Å²	42.4	28%	0.279	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	136.5	176	30.6	-34.2	0	0	0	110.2	R28 T34	R28-P46 WeakPolarHBondContact CD-O 3.37Å; R28-P46 WeakPolarHBondContact CG-O 3.45Å; T34-P46 HydrophobicContact CG2-CB 4.15Å
47	C	95.1	Very high	92.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	170.2	-171.9	-69.8	0	0	0	0	111.4	T34 D35 V36 L52	T34-C47 WeakPolarHBondContact CA-O 3.49Å; T34-C47 WeakPolarHBondContact CB-O 3.34Å; D35-C47 PolarHBondContact N-O 3.16Å; V36-C47 HydrophobicContact CG1-CB 3.98Å; V36-C47 PolarHBondContact N-O 3.18Å; V36-C47 PolarHBondContact O-N 3.36Å; V36-C47 VanDerWaalsContact O-O 3.11Å; C47-L52 HydrophobicContact CB-CD1 3.74Å; C47-L52 HydrophobicContact CB-CG 4.36Å
48	H	94.6	Very high	92.2	Very high	8 Å²	8	47.3 Å²	47.3	4%	0.037	27%	0.272	C	S	.	.			trans	-107.5	123.2	172.3	-51.6	90.5	0	0	0	110	V32 L33 D35 N50 V51 L52 Y93	V32-H48 PolarHBondContact O-NE2 3.22Å; L33-H48 PolarHBondContact O-CD2 3.44Å; D35-H48 VanDerWaalsContact OD1-CA 3.29Å; D35-H48 WeakPolarHBondContact OD1-CA 3.33Å; H48-N50 VanDerWaalsContact C-N 3.28Å; H48-N50 WeakPolarHBondContact CB-OD1 3.4Å; H48-N50 PolarHBondContact O-N 3.21Å; H48-V51 HydrophobicContact CB-CB 4.27Å; H48-V51 HydrophobicContact CB-CG2 3.93Å; H48-V51 PolarHBondContact O-N 3.14Å; H48-L52 PolarHBondContact O-N 2.66Å; H48-L52 VanDerWaalsContact O-N 3.15Å; H48-Y93 WeakPolarHBondContact CB-OH 3.31Å; H48-Y93 PolarHBondContact N-OH 3.15Å; H48-Y93 AromaticContact ND1-CE1 3.72Å; H48-Y93 AromaticContact ND1-CZ 3.69Å; H48-Y93 PolarHBondContact ND1-OH 3.5Å
49	R	92.4	Very high	92.2	Very high	36 Å²	36	47.3 Å²	47.3	14%	0.136	27%	0.272	C	S	.	.	H	α-helix	trans	-57.6	-41.7	-179.1	-70.5	176.3	-173.4	-91.6	-6.6	112.2	D35 V36 V51 L52 A53 F63 E69 S70 Q72	D35-R49 PolarHBondContact O-NE 3.33Å; D35-R49 PolarHBondContact O-NH2 3.4Å; D35-R49 WeakPolarHBondContact OD1-CG 3.43Å; D35-R49 PolarHBondContact OD1-N 3.38Å; D35-R49 WeakPolarHBondContact OD2-CB 3.18Å; D35-R49 WeakPolarHBondContact OD2-CD 3.46Å; D35-R49 WeakPolarHBondContact OD2-CG 3.45Å; V36-R49 HydrophobicContact CB-CG 3.74Å; V36-R49 HydrophobicContact CG1-CG 3.61Å; R49-V51 VanDerWaalsContact C-N 3.32Å; R49-V51 PolarHBondContact O-N 2.95Å; R49-L52 PolarHBondContact O-N 2.79Å; R49-A53 WeakPolarHBondContact O-CB 3.29Å; R49-A53 PolarHBondContact O-N 3.43Å; R49-F63 HydrophobicContact CB-CD2 4.17Å; R49-F63 HydrophobicContact CB-CE2 4.5Å; R49-F63 HydrophobicContact CB-CG 4.46Å; R49-F63 HydrophobicContact CG-CD1 4.47Å; R49-F63 HydrophobicContact CG-CD2 4.27Å; R49-F63 HydrophobicContact CG-CE2 4.33Å; R49-F63 HydrophobicContact CG-CG 4.34Å; R49-F63 HydrophobicContact CG-CZ 4.45Å; R49-F63 VanDerWaalsContact NH1-CE1 3.33Å; R49-E69 PolarHBondContact NH1-O 3.1Å; R49-S70 PolarHBondContact NH1-O 3.16Å; R49-S70 VanDerWaalsContact NH1-O 3.16Å; R49-Q72 PolarHBondContact NH2-O 3.29Å
50	N	92.6	Very high	92.3	Very high	98 Å²	98	53 Å²	53	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-39.7	-179	64.4	-19.4	0	0	0	112	H48 S54	H48-N50 VanDerWaalsContact C-N 3.28Å; H48-N50 WeakPolarHBondContact CB-OD1 3.4Å; H48-N50 PolarHBondContact O-N 3.21Å; N50-S54 VanDerWaalsContact O-CB 3.23Å; N50-S54 WeakPolarHBondContact O-CB 3.29Å; N50-S54 PolarHBondContact O-N 2.97Å; N50-S54 PolarHBondContact O-OG 2.91Å
51	V	94.4	Very high	92.3	Very high	15 Å²	15	54.6 Å²	54.6	9%	0.091	31%	0.31	C	S	.	.	H	α-helix	trans	-67.5	-49.3	177.2	-180	0	0	0	0	109.7	L24 H48 R49 A53 S54 S55 V92 Y93	L24-V51 HydrophobicContact CD1-CG2 4.05Å; H48-V51 HydrophobicContact CB-CB 4.27Å; H48-V51 HydrophobicContact CB-CG2 3.93Å; H48-V51 PolarHBondContact O-N 3.14Å; R49-V51 VanDerWaalsContact C-N 3.32Å; R49-V51 PolarHBondContact O-N 2.95Å; V51-A53 PolarHBondContact O-N 3.07Å; V51-S54 PolarHBondContact O-N 2.92Å; V51-S55 WeakPolarHBondContact O-CB 3.47Å; V51-S55 PolarHBondContact O-N 3.25Å; V51-S55 PolarHBondContact O-OG 2.72Å; V51-V92 HydrophobicContact CG1-CG1 3.63Å; V51-Y93 HydrophobicContact CB-CE1 4.13Å; V51-Y93 HydrophobicContact CG1-CD1 4.3Å; V51-Y93 HydrophobicContact CG1-CE1 3.78Å; V51-Y93 HydrophobicContact CG1-CE2 4.26Å; V51-Y93 HydrophobicContact CG2-CE1 3.95Å
52	L	94.3	Very high	92.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-44.8	178.8	-65.5	176.9	0	0	0	112.8	V36 L38 C47 H48 R49 S54 S55 S56 F59 F63 I89 V92	V36-L52 HydrophobicContact CG1-CD1 4.2Å; L38-L52 HydrophobicContact CD1-CD1 3.87Å; L38-L52 HydrophobicContact CD2-CD1 4.5Å; L38-L52 HydrophobicContact CG-CD1 4.28Å; C47-L52 HydrophobicContact CB-CD1 3.74Å; C47-L52 HydrophobicContact CB-CG 4.36Å; H48-L52 PolarHBondContact O-N 2.66Å; H48-L52 VanDerWaalsContact O-N 3.15Å; R49-L52 PolarHBondContact O-N 2.79Å; L52-S54 PolarHBondContact O-N 3.47Å; L52-S55 WeakPolarHBondContact CA-OG 3.47Å; L52-S55 PolarHBondContact O-N 3.02Å; L52-S55 PolarHBondContact O-OG 3.46Å; L52-S56 PolarHBondContact O-N 3.27Å; L52-S56 VanDerWaalsContact O-N 3.11Å; L52-F59 HydrophobicContact CB-CB 3.94Å; L52-F59 HydrophobicContact CB-CD2 4.03Å; L52-F59 HydrophobicContact CB-CG 3.94Å; L52-F59 HydrophobicContact CD2-CD2 4.23Å; L52-F59 HydrophobicContact CD2-CE2 4.21Å; L52-F59 WeakPolarHBondContact O-CB 3.34Å; L52-F63 HydrophobicContact CB-CE2 4.01Å; L52-F63 HydrophobicContact CD1-CE2 3.99Å; L52-F63 HydrophobicContact CD1-CZ 4.44Å; L52-I89 HydrophobicContact CD2-CD1 3.56Å; L52-V92 HydrophobicContact CD2-CG1 4.4Å
53	A	93.5	Very high	93	Very high	12 Å²	12	45.4 Å²	45.4	10%	0.099	24%	0.244	C	C	.	.	H	α-helix	trans	-66.8	-27.1	177.6	0	0	0	0	0	112.6	R49 V51 K60 F63	R49-A53 WeakPolarHBondContact O-CB 3.29Å; R49-A53 PolarHBondContact O-N 3.43Å; V51-A53 PolarHBondContact O-N 3.07Å; A53-K60 HydrophobicContact CB-CB 4.5Å; A53-K60 VanDerWaalsContact O-CB 3.31Å; A53-K60 WeakPolarHBondContact O-CB 3.5Å; A53-F63 HydrophobicContact CB-CD2 4.45Å
54	S	93.2	Very high	92.8	Very high	106 Å²	106	43.1 Å²	43.1	74%	0.741	24%	0.243	S	C	*	.	H	α-helix	trans	-81.5	-29.8	175.1	-58.8	0	0	0	0	112.3	N50 V51 L52	N50-S54 VanDerWaalsContact O-CB 3.23Å; N50-S54 WeakPolarHBondContact O-CB 3.29Å; N50-S54 PolarHBondContact O-N 2.97Å; N50-S54 PolarHBondContact O-OG 2.91Å; V51-S54 PolarHBondContact O-N 2.92Å; L52-S54 PolarHBondContact O-N 3.47Å
55	S	93.9	Very high	92.1	Very high	43 Å²	43	41.9 Å²	41.9	30%	0.301	24%	0.24	S	C	.	.	H	α-helix	trans	-84.5	-28.9	-175.8	67.8	0	0	0	0	113.9	V51 L52 Y116	V51-S55 WeakPolarHBondContact O-CB 3.47Å; V51-S55 PolarHBondContact O-N 3.25Å; V51-S55 PolarHBondContact O-OG 2.72Å; L52-S55 WeakPolarHBondContact CA-OG 3.47Å; L52-S55 PolarHBondContact O-N 3.02Å; L52-S55 PolarHBondContact O-OG 3.46Å; S55-Y116 WeakPolarHBondContact O-CE1 3.43Å; S55-Y116 PolarHBondContact OG-OH 2.95Å
56	S	95.4	Very high	91.2	Very high	2 Å²	2	50 Å²	50	1%	0.014	28%	0.283	C	S	.	.			trans	-139.4	135.5	-174.5	157.8	0	0	0	0	112.9	L52 Y58 F59 K60 L114	L52-S56 PolarHBondContact O-N 3.27Å; L52-S56 VanDerWaalsContact O-N 3.11Å; S56-Y58 PolarHBondContact O-N 3.44Å; S56-Y58 WeakPolarHBondContact OG-CB 3.43Å; S56-Y58 PolarHBondContact OG-N 3.18Å; S56-F59 PolarHBondContact O-N 3.32Å; S56-F59 PolarHBondContact OG-N 2.87Å; S56-K60 WeakPolarHBondContact O-CB 3.48Å; S56-K60 PolarHBondContact O-N 3Å; S56-L114 WeakPolarHBondContact CB-O 3.48Å; S56-L114 PolarHBondContact OG-O 3.32Å
57	P	94.7	Very high	90.3	Very high	71 Å²	71	53.1 Å²	53.1	46%	0.461	29%	0.293	S	S	.	.	H	α-helix	trans	-65.3	-26.2	173.5	-8.2	20.1	0	0	0	113.4	K60 A61 Q115	P57-K60 PolarHBondContact O-N 2.8Å; P57-A61 WeakPolarHBondContact O-CB 3.43Å; P57-A61 PolarHBondContact O-N 3Å; P57-Q115 HydrophobicContact CG-CB 4.34Å
58	Y	93.6	Very high	89.2	Confident	67 Å²	67	61.4 Å²	61.4	26%	0.263	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-52.2	173.9	174.3	-90.6	0	0	0	111	S56 K60 A61 M62 L77 M113 L114	S56-Y58 PolarHBondContact O-N 3.44Å; S56-Y58 WeakPolarHBondContact OG-CB 3.43Å; S56-Y58 PolarHBondContact OG-N 3.18Å; Y58-K60 VanDerWaalsContact C-N 3.33Å; Y58-K60 PolarHBondContact O-N 3.13Å; Y58-A61 PolarHBondContact O-N 3.46Å; Y58-M62 HydrophobicContact CD1-CE 4.33Å; Y58-M62 HydrophobicContact CE1-CE 3.35Å; Y58-M62 WeakPolarHBondContact O-CB 3.4Å; Y58-M62 PolarHBondContact O-N 2.83Å; Y58-M62 VanDerWaalsContact OH-CE 3.32Å; Y58-M62 WeakPolarHBondContact OH-CE 3.23Å; Y58-L77 HydrophobicContact CE1-CD2 4.26Å; Y58-M113 WeakPolarHBondContact CD2-O 3.43Å; Y58-L114 HydrophobicContact CD1-CD2 3.58Å; Y58-L114 HydrophobicContact CE1-CD2 3.55Å; Y58-L114 HydrophobicContact CG-CD2 4.26Å
59	F	93.2	Very high	88.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-69.4	-33.4	178	-72.2	-57	0	0	0	112.1	L38 L52 S56 A61 M62 F63 L77 L114 Y116	L38-F59 HydrophobicContact CD1-CE1 4.19Å; L38-F59 HydrophobicContact CD1-CZ 3.98Å; L38-F59 HydrophobicContact CD2-CE1 4.21Å; L52-F59 HydrophobicContact CB-CB 3.94Å; L52-F59 HydrophobicContact CB-CD2 4.03Å; L52-F59 HydrophobicContact CB-CG 3.94Å; L52-F59 HydrophobicContact CD2-CD2 4.23Å; L52-F59 HydrophobicContact CD2-CE2 4.21Å; L52-F59 WeakPolarHBondContact O-CB 3.34Å; S56-F59 PolarHBondContact O-N 3.32Å; S56-F59 PolarHBondContact OG-N 2.87Å; F59-A61 VanDerWaalsContact C-N 3.34Å; F59-A61 PolarHBondContact O-N 3.46Å; F59-M62 HydrophobicContact CD1-SD 4.18Å; F59-M62 HydrophobicContact CE1-SD 4.49Å; F59-M62 PolarHBondContact O-N 3.33Å; F59-F63 HydrophobicContact CB-CD2 4.2Å; F59-F63 HydrophobicContact CB-CE2 4.1Å; F59-F63 AromaticContact CD1-CE2 3.89Å; F59-F63 HydrophobicContact CD1-CE2 3.89Å; F59-F63 HydrophobicContact CD1-CZ 4.21Å; F59-F63 HydrophobicContact CG-CE2 4.31Å; F59-F63 WeakPolarHBondContact O-CD2 3.47Å; F59-F63 PolarHBondContact O-N 3.28Å; F59-L77 HydrophobicContact CE1-CD1 4.44Å; F59-L77 HydrophobicContact CZ-CD1 4.28Å; F59-L114 HydrophobicContact CE2-CD1 4.26Å; F59-L114 HydrophobicContact CE2-CD2 4.26Å; F59-L114 HydrophobicContact CZ-CD1 4.26Å; F59-L114 HydrophobicContact CZ-CD2 3.92Å; F59-Y116 HydrophobicContact CE2-CE2 4.35Å
60	K	92.5	Very high	87.4	Confident	124 Å²	124	64.2 Å²	64.2	54%	0.539	35%	0.347	S	S	.	.	H	α-helix	trans	-58.2	-47.9	171.5	-166	173.5	179	174.3	0	111.2	A53 S56 P57 Y58 C64	A53-K60 HydrophobicContact CB-CB 4.5Å; A53-K60 VanDerWaalsContact O-CB 3.31Å; A53-K60 WeakPolarHBondContact O-CB 3.5Å; S56-K60 WeakPolarHBondContact O-CB 3.48Å; S56-K60 PolarHBondContact O-N 3Å; P57-K60 PolarHBondContact O-N 2.8Å; Y58-K60 VanDerWaalsContact C-N 3.33Å; Y58-K60 PolarHBondContact O-N 3.13Å; K60-C64 WeakPolarHBondContact O-CA 3.44Å; K60-C64 WeakPolarHBondContact O-CB 3.39Å; K60-C64 PolarHBondContact O-N 2.96Å
61	A	90.4	Very high	86.5	Confident	37 Å²	37	64.9 Å²	64.9	31%	0.306	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-43.6	176.7	0	0	0	0	0	111.2	P57 Y58 F59 F63 N65 F67	P57-A61 WeakPolarHBondContact O-CB 3.43Å; P57-A61 PolarHBondContact O-N 3Å; Y58-A61 PolarHBondContact O-N 3.46Å; F59-A61 VanDerWaalsContact C-N 3.34Å; F59-A61 PolarHBondContact O-N 3.46Å; A61-F63 PolarHBondContact O-N 2.9Å; A61-N65 WeakPolarHBondContact O-CB 3.2Å; A61-N65 PolarHBondContact O-N 3.28Å; A61-N65 PolarHBondContact O-ND2 3.45Å; A61-F67 VanDerWaalsContact O-CD2 3.26Å; A61-F67 WeakPolarHBondContact O-CD2 3.26Å
62	M	89.4	Confident	86	Confident	18 Å²	18	68.2 Å²	68.2	9%	0.089	37%	0.373	C	S	.	.	H	α-helix	trans	-62	-43	-179.7	-177.1	-177.2	-75.3	0	0	113.3	Y58 F59 E69 V75 L77	Y58-M62 HydrophobicContact CD1-CE 4.33Å; Y58-M62 HydrophobicContact CE1-CE 3.35Å; Y58-M62 WeakPolarHBondContact O-CB 3.4Å; Y58-M62 PolarHBondContact O-N 2.83Å; Y58-M62 VanDerWaalsContact OH-CE 3.32Å; Y58-M62 WeakPolarHBondContact OH-CE 3.23Å; F59-M62 HydrophobicContact CD1-SD 4.18Å; F59-M62 HydrophobicContact CE1-SD 4.49Å; F59-M62 PolarHBondContact O-N 3.33Å; M62-E69 HydrophobicContact CG-CB 3.75Å; M62-E69 HydrophobicContact CG-CG 4.41Å; M62-E69 HydrophobicContact SD-CB 4.27Å; M62-V75 HydrophobicContact CE-CG1 4.35Å; M62-V75 HydrophobicContact SD-CG1 3.85Å; M62-L77 HydrophobicContact CE-CD2 4.18Å
63	F	89.5	Confident	85.4	Confident	23 Å²	23	72.9 Å²	72.9	10%	0.101	40%	0.403	C	S	.	.	H	α-helix	trans	-96.9	-27.3	-172.8	-60.6	-41.2	0	0	0	114.5	V36 R49 L52 A53 F59 A61 V75	V36-F63 HydrophobicContact CG1-CZ 4.39Å; V36-F63 HydrophobicContact CG2-CE1 4.27Å; V36-F63 HydrophobicContact CG2-CZ 4.11Å; R49-F63 HydrophobicContact CB-CD2 4.17Å; R49-F63 HydrophobicContact CB-CE2 4.5Å; R49-F63 HydrophobicContact CB-CG 4.46Å; R49-F63 HydrophobicContact CG-CD1 4.47Å; R49-F63 HydrophobicContact CG-CD2 4.27Å; R49-F63 HydrophobicContact CG-CE2 4.33Å; R49-F63 HydrophobicContact CG-CG 4.34Å; R49-F63 HydrophobicContact CG-CZ 4.45Å; R49-F63 VanDerWaalsContact NH1-CE1 3.33Å; L52-F63 HydrophobicContact CB-CE2 4.01Å; L52-F63 HydrophobicContact CD1-CE2 3.99Å; L52-F63 HydrophobicContact CD1-CZ 4.44Å; A53-F63 HydrophobicContact CB-CD2 4.45Å; F59-F63 HydrophobicContact CB-CD2 4.2Å; F59-F63 HydrophobicContact CB-CE2 4.1Å; F59-F63 AromaticContact CD1-CE2 3.89Å; F59-F63 HydrophobicContact CD1-CE2 3.89Å; F59-F63 HydrophobicContact CD1-CZ 4.21Å; F59-F63 HydrophobicContact CG-CE2 4.31Å; F59-F63 WeakPolarHBondContact O-CD2 3.47Å; F59-F63 PolarHBondContact O-N 3.28Å; A61-F63 PolarHBondContact O-N 2.9Å; F63-V75 HydrophobicContact CE1-CG2 4.26Å
64	C	85.1	Confident	85.3	Confident	84 Å²	84	76.9 Å²	76.9	57%	0.568	42%	0.419	S	S	*	.	H	α-helix	trans	-99.6	-10	-177.4	-56.4	0	0	0	0	113.9	K60	K60-C64 WeakPolarHBondContact O-CA 3.44Å; K60-C64 WeakPolarHBondContact O-CB 3.39Å; K60-C64 PolarHBondContact O-N 2.96Å
65	N	78.9	Confident	85.1	Confident	86 Å²	86	72 Å²	72	46%	0.46	38%	0.384	S	S	.	.	S	Bend	trans	-100.4	164.7	170.6	-57.7	-26	0	0	0	110.4	A61 F67	A61-N65 WeakPolarHBondContact O-CB 3.2Å; A61-N65 PolarHBondContact O-N 3.28Å; A61-N65 PolarHBondContact O-ND2 3.45Å; N65-F67 HydrophobicContact CB-CD2 3.76Å; N65-F67 HydrophobicContact CB-CE2 3.84Å; N65-F67 PolarHBondContact O-N 3.1Å
66	N	73.4	Confident	84.9	Confident	176 Å²	176	75.5 Å²	75.5	94%	0.941	40%	0.399	S	S	*	.	S	Bend	trans	-70.3	42.6	-177.4	-67.8	-15.4	0	0	0	114.1
67	F	76.9	Confident	84.6	Confident	109 Å²	109	75.7 Å²	75.7	48%	0.478	40%	0.399	S	S	.	.			trans	-80.2	156.3	171.5	-72.3	-72.4	0	0	0	111.1	A61 N65 E69 S70	A61-F67 VanDerWaalsContact O-CD2 3.26Å; A61-F67 WeakPolarHBondContact O-CD2 3.26Å; N65-F67 HydrophobicContact CB-CD2 3.76Å; N65-F67 HydrophobicContact CB-CE2 3.84Å; N65-F67 PolarHBondContact O-N 3.1Å; F67-E69 WeakPolarHBondContact CB-OE2 3.41Å; F67-E69 PolarHBondContact O-N 3.34Å; F67-S70 VanDerWaalsContact O-CB 3.3Å; F67-S70 WeakPolarHBondContact O-CB 3.44Å; F67-S70 PolarHBondContact O-N 2.93Å; F67-S70 PolarHBondContact O-OG 3.44Å
68	K	72.1	Confident	84.2	Confident	174 Å²	174	81.1 Å²	81.1	76%	0.757	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-64.4	-31.7	-178.5	-71.4	-177.7	177.9	178.5	0	111.8	S70 C71 Q72	K68-S70 PolarHBondContact O-N 3.48Å; K68-C71 PolarHBondContact O-N 3.04Å; K68-Q72 WeakPolarHBondContact O-CG 3.42Å
69	E	75.1	Confident	83.7	Confident	67 Å²	67	81.9 Å²	81.9	31%	0.313	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-65.4	-20.9	179.8	-64	79.5	177.9	0	0	112.3	R49 M62 F67 C71 Q72 V75	R49-E69 PolarHBondContact NH1-O 3.1Å; M62-E69 HydrophobicContact CG-CB 3.75Å; M62-E69 HydrophobicContact CG-CG 4.41Å; M62-E69 HydrophobicContact SD-CB 4.27Å; F67-E69 WeakPolarHBondContact CB-OE2 3.41Å; F67-E69 PolarHBondContact O-N 3.34Å; E69-C71 PolarHBondContact O-N 3.28Å; E69-Q72 PolarHBondContact O-N 3.31Å; E69-V75 HydrophobicContact CB-CG2 4.31Å; E69-V75 HydrophobicContact CG-CG1 4.36Å
70	S	73.6	Confident	83.6	Confident	36 Å²	36	82.4 Å²	82.4	25%	0.252	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-60.8	-29.9	175.6	67.2	0	0	0	0	112.8	R49 F67 K68	R49-S70 PolarHBondContact NH1-O 3.16Å; R49-S70 VanDerWaalsContact NH1-O 3.16Å; F67-S70 VanDerWaalsContact O-CB 3.3Å; F67-S70 WeakPolarHBondContact O-CB 3.44Å; F67-S70 PolarHBondContact O-N 2.93Å; F67-S70 PolarHBondContact O-OG 3.44Å; K68-S70 PolarHBondContact O-N 3.48Å
71	C	72.9	Confident	83.5	Confident	112 Å²	112	80.5 Å²	80.5	76%	0.757	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-107.2	-1	-179.8	-58	0	0	0	0	114	K68 E69	K68-C71 PolarHBondContact O-N 3.04Å; E69-C71 PolarHBondContact O-N 3.28Å
72	Q	83.3	Confident	83.6	Confident	85 Å²	85	79.9 Å²	79.9	40%	0.397	44%	0.437	S	S	.	.			trans	-91.7	124	-175.7	-74.7	-178.8	-2.6	0	0	111.7	R49 K68 E69 K74	R49-Q72 PolarHBondContact NH2-O 3.29Å; K68-Q72 WeakPolarHBondContact O-CG 3.42Å; E69-Q72 PolarHBondContact O-N 3.31Å; Q72-K74 PolarHBondContact O-N 2.91Å
73	P	83.1	Confident	83.7	Confident	98 Å²	98	84 Å²	84	64%	0.636	46%	0.456	S	S	*	.	S	Bend	trans	-66.8	-21.3	179.4	28	-35	0	0	0	113	V36 T37	V36-P73 CarbonylContact C-O 3.59Å; V36-P73 WeakPolarHBondContact CA-O 3.41Å; T37-P73 PolarHBondContact N-O 2.97Å
74	K	90	Very high	84	Confident	96 Å²	96	83.3 Å²	83.3	42%	0.417	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123.9	-178.4	-167.7	175.1	178.9	177.7	0	109.7	T37 C39 E44 Q72	T37-K74 CarbonylContact O-C 3.55Å; T37-K74 WeakPolarHBondContact O-CA 3.41Å; C39-K74 WeakPolarHBondContact SG-CE 3.25Å; C39-K74 WeakPolarHBondContact SG-CG 3.33Å; E44-K74 VanDerWaalsContact OE1-CE 3.3Å; E44-K74 WeakPolarHBondContact OE1-CE 3.48Å; E44-K74 IonicContact OE1-NZ 2.56Å; E44-K74 PolarHBondContact OE1-NZ 3.03Å; Q72-K74 PolarHBondContact O-N 2.91Å
75	V	90.6	Very high	84.4	Confident	3 Å²	3	79.3 Å²	79.3	2%	0.018	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.4	-176.4	177.3	0	0	0	0	109.8	V36 T37 L38 C39 M62 F63 E69	V36-V75 HydrophobicContact CG2-CG2 3.95Å; T37-V75 PolarHBondContact O-N 3.23Å; L38-V75 CarbonylContact C-O 3.6Å; L38-V75 HydrophobicContact CD2-CB 4.09Å; L38-V75 HydrophobicContact CD2-CG1 4.4Å; C39-V75 PolarHBondContact N-O 3.48Å; M62-V75 HydrophobicContact CE-CG1 4.35Å; M62-V75 HydrophobicContact SD-CG1 3.85Å; F63-V75 HydrophobicContact CE1-CG2 4.26Å; E69-V75 HydrophobicContact CB-CG2 4.31Å; E69-V75 HydrophobicContact CG-CG1 4.36Å
76	I	89.1	Confident	85.1	Confident	118 Å²	118	79.6 Å²	79.6	61%	0.605	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.4	-178.5	-56.5	171.9	0	0	0	109.5	C39	C39-I76 HydrophobicContact CB-CG1 4.17Å; C39-I76 WeakPolarHBondContact O-CA 3.1Å
77	L	89.3	Confident	86.1	Confident	6 Å²	6	73.4 Å²	73.4	3%	0.031	39%	0.386	C	S	.	.			trans	-88.3	114.4	173.4	-64.3	176.6	0	0	0	108.9	L38 C39 Y58 F59 M62 V80 L85	L38-L77 HydrophobicContact CD1-CD1 4.31Å; L38-L77 HydrophobicContact CD2-CD1 4.44Å; C39-L77 PolarHBondContact O-N 3.01Å; Y58-L77 HydrophobicContact CE1-CD2 4.26Å; F59-L77 HydrophobicContact CE1-CD1 4.44Å; F59-L77 HydrophobicContact CZ-CD1 4.28Å; M62-L77 HydrophobicContact CE-CD2 4.18Å; L77-V80 HydrophobicContact CB-CG2 4.32Å; L77-L85 HydrophobicContact CD1-CD1 3.69Å; L77-L85 HydrophobicContact CD1-CD2 3.98Å
78	K	86	Confident	87	Confident	184 Å²	184	68.2 Å²	68.2	80%	0.8	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	138.5	177.1	-64.5	-176.9	179.2	-179.3	0	110
79	G	84.1	Confident	88.1	Confident	83 Å²	83	59.9 Å²	59.9	86%	0.856	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	16.2	174	0	0	0	0	0	115
80	V	89.9	Confident	89	Confident	12 Å²	12	58.7 Å²	58.7	7%	0.073	32%	0.323	C	S	.	.			trans	-111.7	140.2	171.6	-171.9	0	0	0	0	108.1	S40 L77 L85 T110 M113	S40-V80 PolarHBondContact OG-O 2.98Å; L77-V80 HydrophobicContact CB-CG2 4.32Å; V80-L85 HydrophobicContact CG1-CB 3.84Å; V80-L85 HydrophobicContact CG1-CD1 4.39Å; V80-T110 HydrophobicContact CB-CG2 4.49Å; V80-T110 HydrophobicContact CG1-CG2 3.5Å; V80-T110 VanDerWaalsContact CG1-CG2 3.5Å; V80-T110 HydrophobicContact CG2-CG2 4.17Å; V80-M113 HydrophobicContact CG2-CE 3.23Å; V80-M113 HydrophobicContact CG2-SD 4.09Å
81	D	90.8	Very high	90	Very high	83 Å²	83	59.2 Å²	59.2	44%	0.444	32%	0.32	S	S	.	.			trans	-75.9	141.6	171.3	176.3	-91.8	0	0	0	110.8	E83 I84 L85	D81-E83 PolarHBondContact O-N 2.89Å; D81-E83 WeakPolarHBondContact OD1-CA 3.39Å; D81-E83 WeakPolarHBondContact OD1-CB 3.33Å; D81-E83 PolarHBondContact OD1-N 3.42Å; D81-I84 HydrophobicContact CB-CB 4.08Å; D81-I84 HydrophobicContact CB-CG1 3.85Å; D81-I84 PolarHBondContact O-N 3.27Å; D81-I84 PolarHBondContact OD1-N 3.35Å; D81-I84 VanDerWaalsContact OD1-N 3.17Å; D81-L85 WeakPolarHBondContact O-CB 3.39Å; D81-L85 PolarHBondContact O-N 3.31Å
82	S	91.9	Very high	91.1	Very high	25 Å²	25	54.5 Å²	54.5	18%	0.175	29%	0.288	C	S	.	.	H	α-helix	trans	-66.7	-36	-173.1	-55.1	0	0	0	0	113.4	S40 Y86	S40-S82 WeakPolarHBondContact CB-OG 3.3Å; S40-S82 PolarHBondContact O-OG 3.01Å; S40-S82 PolarHBondContact OG-N 3.4Å; S40-S82 PolarHBondContact OG-OG 3.03Å; S82-Y86 WeakPolarHBondContact O-CB 3.44Å; S82-Y86 PolarHBondContact O-N 3.4Å
83	E	92.7	Very high	91.6	Very high	105 Å²	105	50.5 Å²	50.5	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-70.1	-44.3	176.3	-177.3	57.2	-143.4	0	0	109.9	D81 L85 Y86 Q87	D81-E83 PolarHBondContact O-N 2.89Å; D81-E83 WeakPolarHBondContact OD1-CA 3.39Å; D81-E83 WeakPolarHBondContact OD1-CB 3.33Å; D81-E83 PolarHBondContact OD1-N 3.42Å; E83-L85 VanDerWaalsContact C-N 3.34Å; E83-L85 PolarHBondContact O-N 3.08Å; E83-Y86 WeakPolarHBondContact O-CB 3.38Å; E83-Y86 PolarHBondContact O-N 3.22Å; E83-Y86 VanDerWaalsContact O-N 3.14Å; E83-Q87 VanDerWaalsContact O-CG 3.32Å; E83-Q87 WeakPolarHBondContact O-CG 3.04Å; E83-Q87 PolarHBondContact O-N 3.22Å; E83-Q87 PolarHBondContact OE1-NE2 2.83Å
84	I	94.6	Very high	92	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-42.6	177.9	-60.6	-66.2	0	0	0	111.6	D81 Y86 Q87 I88 N103 L107 T110	D81-I84 HydrophobicContact CB-CB 4.08Å; D81-I84 HydrophobicContact CB-CG1 3.85Å; D81-I84 PolarHBondContact O-N 3.27Å; D81-I84 PolarHBondContact OD1-N 3.35Å; D81-I84 VanDerWaalsContact OD1-N 3.17Å; I84-Y86 VanDerWaalsContact C-N 3.33Å; I84-Y86 PolarHBondContact O-N 3.15Å; I84-Q87 PolarHBondContact O-N 3.06Å; I84-I88 HydrophobicContact CG2-CD1 4.07Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 3.22Å; I84-N103 HydrophobicContact CD1-CB 3.9Å; I84-L107 HydrophobicContact CD1-CD2 4.36Å; I84-L107 HydrophobicContact CD1-CG 4.12Å; I84-L107 HydrophobicContact CG2-CD2 3.96Å; I84-L107 HydrophobicContact CG2-CG 4.48Å; I84-T110 HydrophobicContact CG2-CG2 4.31Å
85	L	94.1	Very high	92.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.2	-45.9	174.6	-177	61.2	0	0	0	110.5	L38 I45 L77 V80 D81 E83 Q87 I88 I89 L114	L38-L85 HydrophobicContact CB-CD2 4.38Å; I45-L85 HydrophobicContact CD1-CB 4.44Å; I45-L85 HydrophobicContact CD1-CD2 4.1Å; I45-L85 HydrophobicContact CD1-CG 3.99Å; L77-L85 HydrophobicContact CD1-CD1 3.69Å; L77-L85 HydrophobicContact CD1-CD2 3.98Å; V80-L85 HydrophobicContact CG1-CB 3.84Å; V80-L85 HydrophobicContact CG1-CD1 4.39Å; D81-L85 WeakPolarHBondContact O-CB 3.39Å; D81-L85 PolarHBondContact O-N 3.31Å; E83-L85 VanDerWaalsContact C-N 3.34Å; E83-L85 PolarHBondContact O-N 3.08Å; L85-Q87 PolarHBondContact O-N 3.11Å; L85-I88 PolarHBondContact O-N 2.97Å; L85-I89 HydrophobicContact CD1-CG1 4.29Å; L85-I89 HydrophobicContact CG-CG1 4.43Å; L85-I89 VanDerWaalsContact O-CG1 3.25Å; L85-I89 WeakPolarHBondContact O-CG1 3.34Å; L85-I89 PolarHBondContact O-N 3.35Å; L85-L114 HydrophobicContact CD1-CD1 4.39Å
86	Y	93.5	Very high	92.2	Very high	91 Å²	91	53 Å²	53	36%	0.357	29%	0.291	S	S	.	.	H	α-helix	trans	-59.1	-45.2	177.4	178.9	-100.8	0	0	0	112.3	I45 S82 E83 I84 I88 I89 L90	I45-Y86 HydrophobicContact CD1-CD2 4.33Å; S82-Y86 WeakPolarHBondContact O-CB 3.44Å; S82-Y86 PolarHBondContact O-N 3.4Å; E83-Y86 WeakPolarHBondContact O-CB 3.38Å; E83-Y86 PolarHBondContact O-N 3.22Å; E83-Y86 VanDerWaalsContact O-N 3.14Å; I84-Y86 VanDerWaalsContact C-N 3.33Å; I84-Y86 PolarHBondContact O-N 3.15Å; Y86-I88 PolarHBondContact O-N 2.96Å; Y86-I89 PolarHBondContact O-N 3.41Å; Y86-L90 WeakPolarHBondContact O-CB 3.41Å; Y86-L90 PolarHBondContact O-N 3.02Å
87	Q	95.1	Very high	92.5	Very high	46 Å²	46	49.4 Å²	49.4	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-41.5	176.9	-65.9	-63.7	-32.6	0	0	112.4	E83 I84 L85 L90 Y91 I97	E83-Q87 VanDerWaalsContact O-CG 3.32Å; E83-Q87 WeakPolarHBondContact O-CG 3.04Å; E83-Q87 PolarHBondContact O-N 3.22Å; E83-Q87 PolarHBondContact OE1-NE2 2.83Å; I84-Q87 PolarHBondContact O-N 3.06Å; L85-Q87 PolarHBondContact O-N 3.11Å; Q87-L90 PolarHBondContact O-N 3.02Å; Q87-Y91 WeakPolarHBondContact O-CB 3.46Å; Q87-Y91 PolarHBondContact O-N 3.23Å; Q87-I97 HydrophobicContact CB-CD1 4.1Å; Q87-I97 HydrophobicContact CB-CG1 4.39Å
88	I	95.4	Very high	92.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-39.6	176.6	-70.9	172.3	0	0	0	111.2	I84 L85 Y86 Y91 V92 I97 L107 T110 L114 Y116 L119	I84-I88 HydrophobicContact CG2-CD1 4.07Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 3.22Å; L85-I88 PolarHBondContact O-N 2.97Å; Y86-I88 PolarHBondContact O-N 2.96Å; I88-Y91 WeakPolarHBondContact O-CB 3.26Å; I88-Y91 PolarHBondContact O-N 3.02Å; I88-V92 WeakPolarHBondContact O-CG2 3.21Å; I88-V92 PolarHBondContact O-N 3.42Å; I88-I97 HydrophobicContact CG1-CD1 4.4Å; I88-L107 HydrophobicContact CD1-CD2 4.34Å; I88-L107 HydrophobicContact CG1-CD2 4.04Å; I88-T110 HydrophobicContact CD1-CG2 3.35Å; I88-L114 HydrophobicContact CD1-CD1 4.49Å; I88-L114 HydrophobicContact CG2-CD1 4.29Å; I88-Y116 HydrophobicContact CG2-CD2 3.87Å; I88-Y116 HydrophobicContact CG2-CE2 3.54Å; I88-L119 HydrophobicContact CD1-CD2 4.44Å; I88-L119 HydrophobicContact CG1-CD2 3.97Å
89	I	94.2	Very high	93.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.7	-42.9	175.5	-64.2	-63.1	0	0	0	110	L38 I45 L52 L85 Y86 Y91 V92 Y93	L38-I89 HydrophobicContact CD1-CD1 3.59Å; L38-I89 HydrophobicContact CD1-CG1 4.32Å; I45-I89 HydrophobicContact CG2-CB 4.49Å; I45-I89 HydrophobicContact CG2-CG2 4.05Å; L52-I89 HydrophobicContact CD2-CD1 3.56Å; L85-I89 HydrophobicContact CD1-CG1 4.29Å; L85-I89 HydrophobicContact CG-CG1 4.43Å; L85-I89 VanDerWaalsContact O-CG1 3.25Å; L85-I89 WeakPolarHBondContact O-CG1 3.34Å; L85-I89 PolarHBondContact O-N 3.35Å; Y86-I89 PolarHBondContact O-N 3.41Å; I89-Y91 VanDerWaalsContact C-N 3.29Å; I89-Y91 PolarHBondContact O-N 3.43Å; I89-V92 WeakPolarHBondContact O-CB 3.35Å; I89-V92 PolarHBondContact O-N 3.07Å; I89-V92 VanDerWaalsContact O-N 3.12Å; I89-Y93 HydrophobicContact CG2-CD2 4.13Å; I89-Y93 HydrophobicContact CG2-CE2 4.09Å; I89-Y93 VanDerWaalsContact O-CD2 3.3Å; I89-Y93 WeakPolarHBondContact O-CD2 3.11Å; I89-Y93 PolarHBondContact O-N 3.09Å
90	L	94	Very high	93.8	Very high	42 Å²	42	46 Å²	46	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-56.7	-47.2	173.9	-171.6	65.4	0	0	0	110.7	Y86 Q87 V92 Y93 T94	Y86-L90 WeakPolarHBondContact O-CB 3.41Å; Y86-L90 PolarHBondContact O-N 3.02Å; Q87-L90 PolarHBondContact O-N 3.02Å; L90-V92 VanDerWaalsContact C-N 3.31Å; L90-V92 PolarHBondContact O-N 3.37Å; L90-Y93 CarbonylContact O-C 3.59Å; L90-Y93 PolarHBondContact O-N 3.16Å; L90-T94 HydrophobicContact CD1-CG2 3.89Å; L90-T94 HydrophobicContact CG-CG2 4.15Å; L90-T94 WeakPolarHBondContact O-CG2 3.21Å; L90-T94 PolarHBondContact O-N 3.26Å; L90-T94 PolarHBondContact O-OG1 2.8Å
91	Y	95.4	Very high	93.8	Very high	47 Å²	47	50 Å²	50	18%	0.184	27%	0.271	C	S	.	.	H	α-helix	trans	-54.9	-40.6	174.3	167.5	-102.3	0	0	0	113.7	Q87 I88 I89 Y93 T94 G95 E96 I97 Y116 L119	Q87-Y91 WeakPolarHBondContact O-CB 3.46Å; Q87-Y91 PolarHBondContact O-N 3.23Å; I88-Y91 WeakPolarHBondContact O-CB 3.26Å; I88-Y91 PolarHBondContact O-N 3.02Å; I89-Y91 VanDerWaalsContact C-N 3.29Å; I89-Y91 PolarHBondContact O-N 3.43Å; Y91-Y93 PolarHBondContact O-N 3.24Å; Y91-T94 PolarHBondContact O-N 3.05Å; Y91-G95 VanDerWaalsContact O-CA 3.28Å; Y91-G95 WeakPolarHBondContact O-CA 3.24Å; Y91-G95 PolarHBondContact O-N 3.36Å; Y91-E96 WeakPolarHBondContact CA-O 3.45Å; Y91-I97 HydrophobicContact CD2-CB 4.1Å; Y91-I97 HydrophobicContact CD2-CG2 4.02Å; Y91-I97 HydrophobicContact CG-CB 4.4Å; Y91-Y116 HydrophobicContact CE1-CD1 4.41Å; Y91-L119 HydrophobicContact CD1-CD2 4.36Å; Y91-L119 HydrophobicContact CE1-CB 4.42Å
92	V	95.2	Very high	93.8	Very high	13 Å²	13	54.1 Å²	54.1	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-33.8	177.4	167.8	0	0	0	0	111.9	V51 L52 I88 I89 L90 Y116	V51-V92 HydrophobicContact CG1-CG1 3.63Å; L52-V92 HydrophobicContact CD2-CG1 4.4Å; I88-V92 WeakPolarHBondContact O-CG2 3.21Å; I88-V92 PolarHBondContact O-N 3.42Å; I89-V92 WeakPolarHBondContact O-CB 3.35Å; I89-V92 PolarHBondContact O-N 3.07Å; I89-V92 VanDerWaalsContact O-N 3.12Å; L90-V92 VanDerWaalsContact C-N 3.31Å; L90-V92 PolarHBondContact O-N 3.37Å; V92-Y116 HydrophobicContact CG2-CE1 3.87Å; V92-Y116 HydrophobicContact CG2-CE2 4.47Å; V92-Y116 WeakPolarHBondContact CG2-OH 3.28Å
93	Y	94.1	Very high	93.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-94.9	-20.5	-178	-76.1	-85.2	0	0	0	114.1	L24 N25 R28 H48 V51 I89 L90 Y91	L24-Y93 HydrophobicContact CB-CD1 4.18Å; L24-Y93 HydrophobicContact CB-CE1 4.17Å; N25-Y93 HydrophobicContact CB-CD1 4.22Å; N25-Y93 HydrophobicContact CB-CG 4.32Å; R28-Y93 VanDerWaalsContact CD-CE2 3.41Å; H48-Y93 WeakPolarHBondContact CB-OH 3.31Å; H48-Y93 PolarHBondContact N-OH 3.15Å; H48-Y93 AromaticContact ND1-CE1 3.72Å; H48-Y93 AromaticContact ND1-CZ 3.69Å; H48-Y93 PolarHBondContact ND1-OH 3.5Å; V51-Y93 HydrophobicContact CB-CE1 4.13Å; V51-Y93 HydrophobicContact CG1-CD1 4.3Å; V51-Y93 HydrophobicContact CG1-CE1 3.78Å; V51-Y93 HydrophobicContact CG1-CE2 4.26Å; V51-Y93 HydrophobicContact CG2-CE1 3.95Å; I89-Y93 HydrophobicContact CG2-CD2 4.13Å; I89-Y93 HydrophobicContact CG2-CE2 4.09Å; I89-Y93 VanDerWaalsContact O-CD2 3.3Å; I89-Y93 WeakPolarHBondContact O-CD2 3.11Å; I89-Y93 PolarHBondContact O-N 3.09Å; L90-Y93 CarbonylContact O-C 3.59Å; L90-Y93 PolarHBondContact O-N 3.16Å; Y91-Y93 PolarHBondContact O-N 3.24Å
94	T	92.6	Very high	94	Very high	51 Å²	51	49.5 Å²	49.5	31%	0.313	26%	0.264	S	S	.	.	H	α-helix	trans	-112.6	-25	-177.2	62.9	0	0	0	0	113.7	L90 Y91 E96	L90-T94 HydrophobicContact CD1-CG2 3.89Å; L90-T94 HydrophobicContact CG-CG2 4.15Å; L90-T94 WeakPolarHBondContact O-CG2 3.21Å; L90-T94 PolarHBondContact O-N 3.26Å; L90-T94 PolarHBondContact O-OG1 2.8Å; Y91-T94 PolarHBondContact O-N 3.05Å; T94-E96 PolarHBondContact OG1-N 3.45Å; T94-E96 VanDerWaalsContact OG1-N 3.13Å; T94-E96 PolarHBondContact OG1-O 2.89Å
95	G	90.9	Very high	93.8	Very high	52 Å²	52	52.3 Å²	52.3	54%	0.536	28%	0.279	S	S	.	.	S	Bend	trans	76.8	3.8	-168.2	0	0	0	0	0	114.2	Y91	Y91-G95 VanDerWaalsContact O-CA 3.28Å; Y91-G95 WeakPolarHBondContact O-CA 3.24Å; Y91-G95 PolarHBondContact O-N 3.36Å
96	E	93.1	Very high	93.8	Very high	147 Å²	147	58.6 Å²	58.6	69%	0.687	30%	0.304	S	S	*	.			trans	-120.2	140	-172.4	-63.6	179.2	176.5	0	0	111.5	Y91 T94	Y91-E96 WeakPolarHBondContact CA-O 3.45Å; T94-E96 PolarHBondContact OG1-N 3.45Å; T94-E96 VanDerWaalsContact OG1-N 3.13Å; T94-E96 PolarHBondContact OG1-O 2.89Å
97	I	95.6	Very high	93.9	Very high	42 Å²	42	54.3 Å²	54.3	22%	0.215	29%	0.287	C	S	.	.			trans	-153.7	142.5	174.7	-164.8	165.5	0	0	0	110.7	Q87 I88 Y91 I99 L107 L119	Q87-I97 HydrophobicContact CB-CD1 4.1Å; Q87-I97 HydrophobicContact CB-CG1 4.39Å; I88-I97 HydrophobicContact CG1-CD1 4.4Å; Y91-I97 HydrophobicContact CD2-CB 4.1Å; Y91-I97 HydrophobicContact CD2-CG2 4.02Å; Y91-I97 HydrophobicContact CG-CB 4.4Å; I97-I99 HydrophobicContact CG2-CG1 4.47Å; I97-L107 HydrophobicContact CD1-CD1 4.33Å; I97-L107 HydrophobicContact CD1-CD2 3.57Å; I97-L119 HydrophobicContact CD1-CD1 4.3Å; I97-L119 HydrophobicContact CD1-CD2 4.12Å; I97-L119 HydrophobicContact CG2-CD1 3.6Å
98	L	95.6	Very high	93.8	Very high	134 Å²	134	52.1 Å²	52.1	70%	0.702	28%	0.277	S	S	*	.			trans	-91.9	120.1	176.9	-173.9	69.1	0	0	0	110.2	N103	L98-N103 PolarHBondContact O-ND2 2.92Å
99	I	96	Very high	93.7	Very high	37 Å²	37	56.4 Å²	56.4	19%	0.19	30%	0.297	C	S	.	.			trans	-99.8	123.6	175	-55.7	173.8	0	0	0	108.7	I97 V104 L107 A122 Y126	I97-I99 HydrophobicContact CG2-CG1 4.47Å; I99-V104 HydrophobicContact CG2-CB 3.92Å; I99-V104 HydrophobicContact CG2-CG2 3.81Å; I99-L107 HydrophobicContact CG1-CD1 4.34Å; I99-A122 HydrophobicContact CD1-CB 3.87Å; I99-Y126 HydrophobicContact CG2-CD1 3.99Å; I99-Y126 HydrophobicContact CG2-CD2 4.02Å; I99-Y126 HydrophobicContact CG2-CE1 4.48Å; I99-Y126 HydrophobicContact CG2-CE2 4.5Å; I99-Y126 HydrophobicContact CG2-CG 3.73Å
100	S	94.4	Very high	93.6	Very high	30 Å²	30	56.7 Å²	56.7	21%	0.21	30%	0.299	C	S	.	.			trans	-129.3	164.8	-179.3	78.8	0	0	0	0	111	E102 N103 V104	S100-E102 PolarHBondContact O-N 3.01Å; S100-E102 PolarHBondContact OG-N 3.36Å; S100-N103 PolarHBondContact N-OD1 3.35Å; S100-N103 PolarHBondContact O-N 3.08Å; S100-N103 PolarHBondContact O-OD1 3.21Å; S100-N103 VanDerWaalsContact OG-CG 3.25Å; S100-N103 PolarHBondContact OG-N 3.17Å; S100-N103 PolarHBondContact OG-OD1 2.79Å; S100-V104 VanDerWaalsContact O-CB 3.25Å; S100-V104 WeakPolarHBondContact O-CB 3.46Å; S100-V104 WeakPolarHBondContact O-CG1 3.17Å; S100-V104 PolarHBondContact O-N 2.91Å
101	P	89.8	Confident	93.7	Very high	97 Å²	97	54.7 Å²	54.7	63%	0.63	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.1	177.7	-21.4	33.3	0	0	0	113.4	Y126	P101-Y126 VanDerWaalsContact CD-OH 3.25Å; P101-Y126 WeakPolarHBondContact CD-OH 3.44Å; P101-Y126 WeakPolarHBondContact CG-OH 3.27Å
102	E	91.6	Very high	93.6	Very high	170 Å²	170	54.9 Å²	54.9	79%	0.794	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-32.5	-176.6	-63.2	174.3	-173.1	0	0	112.2	S100	S100-E102 PolarHBondContact O-N 3.01Å; S100-E102 PolarHBondContact OG-N 3.36Å
103	N	93.6	Very high	93.4	Very high	29 Å²	29	57.6 Å²	57.6	16%	0.155	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-18.4	-174.5	74.8	8.6	0	0	0	114.2	I84 L98 S100 L105 Y106 L107	I84-N103 HydrophobicContact CD1-CB 3.9Å; L98-N103 PolarHBondContact O-ND2 2.92Å; S100-N103 PolarHBondContact N-OD1 3.35Å; S100-N103 PolarHBondContact O-N 3.08Å; S100-N103 PolarHBondContact O-OD1 3.21Å; S100-N103 VanDerWaalsContact OG-CG 3.25Å; S100-N103 PolarHBondContact OG-N 3.17Å; S100-N103 PolarHBondContact OG-OD1 2.79Å; N103-L105 VanDerWaalsContact C-N 3.32Å; N103-L105 PolarHBondContact O-N 2.97Å; N103-Y106 PolarHBondContact O-N 3.22Å; N103-L107 HydrophobicContact CB-CD1 4.24Å; N103-L107 HydrophobicContact CB-CG 4.45Å; N103-L107 WeakPolarHBondContact O-CB 3.44Å; N103-L107 WeakPolarHBondContact O-CG 3.46Å; N103-L107 PolarHBondContact O-N 2.87Å; N103-L107 WeakPolarHBondContact OD1-CD1 3.33Å
104	V	94.4	Very high	93.5	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-36.5	-168.3	62.7	0	0	0	0	113.6	I99 S100 L108 C123 Y126 L127	I99-V104 HydrophobicContact CG2-CB 3.92Å; I99-V104 HydrophobicContact CG2-CG2 3.81Å; S100-V104 VanDerWaalsContact O-CB 3.25Å; S100-V104 WeakPolarHBondContact O-CB 3.46Å; S100-V104 WeakPolarHBondContact O-CG1 3.17Å; S100-V104 PolarHBondContact O-N 2.91Å; V104-L108 WeakPolarHBondContact O-CB 3.4Å; V104-L108 PolarHBondContact O-N 2.86Å; V104-C123 HydrophobicContact CG2-CB 3.96Å; V104-Y126 HydrophobicContact CB-CD1 4.29Å; V104-Y126 HydrophobicContact CG1-CD1 4.43Å; V104-Y126 HydrophobicContact CG1-CE1 4.45Å; V104-Y126 HydrophobicContact CG2-CD1 3.98Å; V104-L127 HydrophobicContact CG1-CD2 3.74Å; V104-L127 HydrophobicContact CG1-CG 4.48Å; V104-L127 HydrophobicContact CG2-CD1 4.34Å; V104-L127 HydrophobicContact CG2-CD2 4.06Å; V104-L127 HydrophobicContact CG2-CG 3.87Å
105	L	92.3	Very high	93.6	Very high	67 Å²	67	60.1 Å²	60.1	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-66.4	-50.7	179.7	-63.4	-179	0	0	0	110.9	N103 L107 L108 E109 L127 L142	N103-L105 VanDerWaalsContact C-N 3.32Å; N103-L105 PolarHBondContact O-N 2.97Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-L107 PolarHBondContact O-N 3.45Å; L105-L108 PolarHBondContact O-N 3.27Å; L105-E109 WeakPolarHBondContact O-CG 3.33Å; L105-E109 PolarHBondContact O-N 3.42Å; L105-L127 HydrophobicContact CD2-CD1 4.44Å; L105-L127 HydrophobicContact CD2-CD2 4.5Å; L105-L142 HydrophobicContact CD2-CD1 4.41Å; L105-L142 HydrophobicContact CD2-CD2 3.4Å
106	Y	93	Very high	93.8	Very high	132 Å²	132	58.3 Å²	58.3	52%	0.518	29%	0.294	S	S	.	.	H	α-helix	trans	-65.1	-37.5	177.8	-54.1	-70.4	0	0	0	112.2	N103 T110	N103-Y106 PolarHBondContact O-N 3.22Å; Y106-T110 VanDerWaalsContact O-CB 3.26Å; Y106-T110 WeakPolarHBondContact O-CB 3.5Å; Y106-T110 PolarHBondContact O-N 3.07Å; Y106-T110 PolarHBondContact O-OG1 3.03Å
107	L	95.1	Very high	93.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-44.7	173.3	-79.8	175.1	0	0	0	111.6	I84 I88 I97 I99 N103 L105 T110 A111	I84-L107 HydrophobicContact CD1-CD2 4.36Å; I84-L107 HydrophobicContact CD1-CG 4.12Å; I84-L107 HydrophobicContact CG2-CD2 3.96Å; I84-L107 HydrophobicContact CG2-CG 4.48Å; I88-L107 HydrophobicContact CD1-CD2 4.34Å; I88-L107 HydrophobicContact CG1-CD2 4.04Å; I97-L107 HydrophobicContact CD1-CD1 4.33Å; I97-L107 HydrophobicContact CD1-CD2 3.57Å; I99-L107 HydrophobicContact CG1-CD1 4.34Å; N103-L107 HydrophobicContact CB-CD1 4.24Å; N103-L107 HydrophobicContact CB-CG 4.45Å; N103-L107 WeakPolarHBondContact O-CB 3.44Å; N103-L107 WeakPolarHBondContact O-CG 3.46Å; N103-L107 PolarHBondContact O-N 2.87Å; N103-L107 WeakPolarHBondContact OD1-CD1 3.33Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-L107 PolarHBondContact O-N 3.45Å; L107-T110 PolarHBondContact O-N 3.26Å; L107-A111 WeakPolarHBondContact O-CB 3.43Å; L107-A111 PolarHBondContact O-N 3.37Å
108	L	93.3	Very high	93.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.8	-44.9	-179.7	-172.5	73.1	0	0	0	111.2	V104 L105 S112 F120 C123 L127 L142 L146	V104-L108 WeakPolarHBondContact O-CB 3.4Å; V104-L108 PolarHBondContact O-N 2.86Å; L105-L108 PolarHBondContact O-N 3.27Å; L108-S112 WeakPolarHBondContact O-CB 3.32Å; L108-S112 PolarHBondContact O-N 3.47Å; L108-F120 HydrophobicContact CD1-CD1 4.36Å; L108-F120 HydrophobicContact CD1-CD2 3.41Å; L108-F120 VanDerWaalsContact CD1-CD2 3.41Å; L108-F120 HydrophobicContact CD1-CE1 4.48Å; L108-F120 HydrophobicContact CD1-CE2 3.55Å; L108-F120 HydrophobicContact CD1-CG 3.86Å; L108-F120 HydrophobicContact CD1-CZ 4.11Å; L108-F120 VanDerWaalsContact CD1-O 3.28Å; L108-F120 WeakPolarHBondContact CD1-O 3.4Å; L108-F120 HydrophobicContact CG-CD2 3.94Å; L108-F120 HydrophobicContact CG-CE2 3.78Å; L108-F120 WeakPolarHBondContact O-CD2 3.42Å; L108-C123 HydrophobicContact CB-CB 4Å; L108-C123 HydrophobicContact CD1-CB 3.53Å; L108-C123 HydrophobicContact CG-CB 4.34Å; L108-L127 HydrophobicContact CD2-CD1 3.77Å; L108-L142 HydrophobicContact CD2-CD2 4.4Å; L108-L146 HydrophobicContact CB-CD1 4.46Å; L108-L146 HydrophobicContact CD2-CD1 3.36Å; L108-L146 HydrophobicContact CG-CD1 3.74Å
109	E	92.8	Very high	93.8	Very high	90 Å²	90	53.9 Å²	53.9	42%	0.421	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-50	175	-75.6	175.7	-176	0	0	111.6	L105 S112 M113 L146	L105-E109 WeakPolarHBondContact O-CG 3.33Å; L105-E109 PolarHBondContact O-N 3.42Å; E109-S112 WeakPolarHBondContact O-CB 3.46Å; E109-S112 PolarHBondContact O-N 2.91Å; E109-M113 PolarHBondContact O-N 3.14Å; E109-L146 HydrophobicContact CG-CD1 4.36Å; E109-L146 HydrophobicContact CG-CD2 3.96Å
110	T	93.8	Very high	93.8	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.043	28%	0.275	C	S	.	.	H	α-helix	trans	-68.8	-38.5	-178	-51.8	0	0	0	0	111.6	V80 I84 I88 Y106 L107 S112 M113 L114	V80-T110 HydrophobicContact CB-CG2 4.49Å; V80-T110 HydrophobicContact CG1-CG2 3.5Å; V80-T110 VanDerWaalsContact CG1-CG2 3.5Å; V80-T110 HydrophobicContact CG2-CG2 4.17Å; I84-T110 HydrophobicContact CG2-CG2 4.31Å; I88-T110 HydrophobicContact CD1-CG2 3.35Å; Y106-T110 VanDerWaalsContact O-CB 3.26Å; Y106-T110 WeakPolarHBondContact O-CB 3.5Å; Y106-T110 PolarHBondContact O-N 3.07Å; Y106-T110 PolarHBondContact O-OG1 3.03Å; L107-T110 PolarHBondContact O-N 3.26Å; T110-S112 VanDerWaalsContact C-N 3.3Å; T110-S112 PolarHBondContact O-N 2.97Å; T110-M113 PolarHBondContact O-N 3.34Å; T110-L114 HydrophobicContact CG2-CD1 3.7Å; T110-L114 HydrophobicContact CG2-CG 4.06Å; T110-L114 WeakPolarHBondContact O-CB 3.43Å; T110-L114 WeakPolarHBondContact O-CG 3.5Å; T110-L114 PolarHBondContact O-N 3.49Å
111	A	94.9	Very high	93.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-36.3	174.8	0	0	0	0	0	111.6	L107 Q115 Y116 L119 F120	L107-A111 WeakPolarHBondContact O-CB 3.43Å; L107-A111 PolarHBondContact O-N 3.37Å; A111-Q115 CarbonylContact O-C 3.57Å; A111-Q115 WeakPolarHBondContact O-CA 3.19Å; A111-Q115 PolarHBondContact O-N 2.78Å; A111-Y116 PolarHBondContact O-N 3.27Å; A111-L119 HydrophobicContact CB-CB 4.17Å; A111-L119 HydrophobicContact CB-CD2 4.1Å; A111-L119 HydrophobicContact CB-CG 3.96Å; A111-F120 HydrophobicContact CB-CB 4.14Å
112	S	93.1	Very high	94.1	Very high	50 Å²	50	55.9 Å²	55.9	35%	0.35	28%	0.282	S	S	.	.	H	α-helix	trans	-65.8	-49.5	172.5	-166.8	0	0	0	0	111.1	L108 E109 T110 L114 Q115	L108-S112 WeakPolarHBondContact O-CB 3.32Å; L108-S112 PolarHBondContact O-N 3.47Å; E109-S112 WeakPolarHBondContact O-CB 3.46Å; E109-S112 PolarHBondContact O-N 2.91Å; T110-S112 VanDerWaalsContact C-N 3.3Å; T110-S112 PolarHBondContact O-N 2.97Å; S112-L114 PolarHBondContact O-N 2.9Å; S112-Q115 PolarHBondContact O-N 3.36Å; S112-Q115 VanDerWaalsContact O-N 3.13Å
113	M	92.7	Very high	94.3	Very high	70 Å²	70	47.8 Å²	47.8	35%	0.345	24%	0.244	S	C	.	.	H	α-helix	trans	-59.5	-48.3	180	-169	-169.4	85	0	0	112.3	Y58 V80 E109 T110 Q115	Y58-M113 WeakPolarHBondContact CD2-O 3.43Å; V80-M113 HydrophobicContact CG2-CE 3.23Å; V80-M113 HydrophobicContact CG2-SD 4.09Å; E109-M113 PolarHBondContact O-N 3.14Å; T110-M113 PolarHBondContact O-N 3.34Å; M113-Q115 PolarHBondContact O-N 2.84Å
114	L	94.1	Very high	94.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	6	179.4	-59.2	-178.3	0	0	0	112.8	S56 Y58 F59 L85 I88 T110 S112 Y116	S56-L114 WeakPolarHBondContact CB-O 3.48Å; S56-L114 PolarHBondContact OG-O 3.32Å; Y58-L114 HydrophobicContact CD1-CD2 3.58Å; Y58-L114 HydrophobicContact CE1-CD2 3.55Å; Y58-L114 HydrophobicContact CG-CD2 4.26Å; F59-L114 HydrophobicContact CE2-CD1 4.26Å; F59-L114 HydrophobicContact CE2-CD2 4.26Å; F59-L114 HydrophobicContact CZ-CD1 4.26Å; F59-L114 HydrophobicContact CZ-CD2 3.92Å; L85-L114 HydrophobicContact CD1-CD1 4.39Å; I88-L114 HydrophobicContact CD1-CD1 4.49Å; I88-L114 HydrophobicContact CG2-CD1 4.29Å; T110-L114 HydrophobicContact CG2-CD1 3.7Å; T110-L114 HydrophobicContact CG2-CG 4.06Å; T110-L114 WeakPolarHBondContact O-CB 3.43Å; T110-L114 WeakPolarHBondContact O-CG 3.5Å; T110-L114 PolarHBondContact O-N 3.49Å; S112-L114 PolarHBondContact O-N 2.9Å; L114-Y116 VanDerWaalsContact C-N 3.34Å; L114-Y116 HydrophobicContact CB-CD2 3.7Å; L114-Y116 HydrophobicContact CB-CE2 3.77Å; L114-Y116 HydrophobicContact CD1-CE2 4.18Å; L114-Y116 PolarHBondContact O-N 3.31Å
115	Q	94.9	Very high	94.4	Very high	105 Å²	105	48.9 Å²	48.9	49%	0.491	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	37.2	175.3	-57.1	-176.7	-0.8	0	0	115.2	P57 A111 S112 M113 A117	P57-Q115 HydrophobicContact CG-CB 4.34Å; A111-Q115 CarbonylContact O-C 3.57Å; A111-Q115 WeakPolarHBondContact O-CA 3.19Å; A111-Q115 PolarHBondContact O-N 2.78Å; S112-Q115 PolarHBondContact O-N 3.36Å; S112-Q115 VanDerWaalsContact O-N 3.13Å; M113-Q115 PolarHBondContact O-N 2.84Å; Q115-A117 PolarHBondContact O-N 2.89Å
116	Y	96.2	Very high	94.6	Very high	13 Å²	13	48.6 Å²	48.6	5%	0.051	25%	0.252	C	S	.	.			trans	-87.4	79.1	170.5	-72.1	-68.6	0	0	0	111.3	S55 F59 I88 Y91 V92 A111 L114 K118 L119 F120	S55-Y116 WeakPolarHBondContact O-CE1 3.43Å; S55-Y116 PolarHBondContact OG-OH 2.95Å; F59-Y116 HydrophobicContact CE2-CE2 4.35Å; I88-Y116 HydrophobicContact CG2-CD2 3.87Å; I88-Y116 HydrophobicContact CG2-CE2 3.54Å; Y91-Y116 HydrophobicContact CE1-CD1 4.41Å; V92-Y116 HydrophobicContact CG2-CE1 3.87Å; V92-Y116 HydrophobicContact CG2-CE2 4.47Å; V92-Y116 WeakPolarHBondContact CG2-OH 3.28Å; A111-Y116 PolarHBondContact O-N 3.27Å; L114-Y116 VanDerWaalsContact C-N 3.34Å; L114-Y116 HydrophobicContact CB-CD2 3.7Å; L114-Y116 HydrophobicContact CB-CE2 3.77Å; L114-Y116 HydrophobicContact CD1-CE2 4.18Å; L114-Y116 PolarHBondContact O-N 3.31Å; Y116-K118 PolarHBondContact O-N 3.48Å; Y116-L119 PolarHBondContact O-N 3.12Å; Y116-F120 PolarHBondContact O-N 2.96Å
117	A	93.8	Very high	94.7	Very high	63 Å²	63	42.8 Å²	42.8	52%	0.521	23%	0.229	S	C	.	.	H	α-helix	trans	-56.5	-43	-173.2	0	0	0	0	0	114.3	Q115 L119 F120 E121	Q115-A117 PolarHBondContact O-N 2.89Å; A117-L119 PolarHBondContact O-N 3.19Å; A117-F120 WeakPolarHBondContact O-CB 3.4Å; A117-F120 PolarHBondContact O-N 3.3Å; A117-E121 WeakPolarHBondContact O-CG 3.07Å; A117-E121 PolarHBondContact O-N 3.31Å
118	K	94.9	Very high	94.7	Very high	164 Å²	164	44.6 Å²	44.6	71%	0.713	24%	0.238	S	C	*	.	H	α-helix	trans	-65.4	-39.1	179.6	-67.8	-174.5	179.1	-179.1	0	112.7	Y116 E121 A122	Y116-K118 PolarHBondContact O-N 3.48Å; K118-E121 PolarHBondContact O-N 3.32Å; K118-A122 PolarHBondContact O-N 2.87Å
119	L	95.7	Very high	94.8	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-68.2	-42.7	175.9	180	54.5	0	0	0	110.6	I88 Y91 I97 A111 Y116 A117 E121 A122 C123	I88-L119 HydrophobicContact CD1-CD2 4.44Å; I88-L119 HydrophobicContact CG1-CD2 3.97Å; Y91-L119 HydrophobicContact CD1-CD2 4.36Å; Y91-L119 HydrophobicContact CE1-CB 4.42Å; I97-L119 HydrophobicContact CD1-CD1 4.3Å; I97-L119 HydrophobicContact CD1-CD2 4.12Å; I97-L119 HydrophobicContact CG2-CD1 3.6Å; A111-L119 HydrophobicContact CB-CB 4.17Å; A111-L119 HydrophobicContact CB-CD2 4.1Å; A111-L119 HydrophobicContact CB-CG 3.96Å; Y116-L119 PolarHBondContact O-N 3.12Å; A117-L119 PolarHBondContact O-N 3.19Å; L119-E121 VanDerWaalsContact C-N 3.32Å; L119-E121 PolarHBondContact O-N 2.94Å; L119-A122 PolarHBondContact O-N 3.02Å; L119-C123 PolarHBondContact O-N 3.34Å; L119-C123 PolarHBondContact O-SG 3.28Å; L119-C123 VanDerWaalsContact O-SG 3.37Å
120	F	95.4	Very high	94.8	Very high	31 Å²	31	50.5 Å²	50.5	14%	0.136	27%	0.268	C	S	.	.	H	α-helix	trans	-57.7	-44.4	174.3	-178.2	-89.6	0	0	0	112	L108 A111 Y116 A117 C123 S124 L146 C148	L108-F120 HydrophobicContact CD1-CD1 4.36Å; L108-F120 HydrophobicContact CD1-CD2 3.41Å; L108-F120 VanDerWaalsContact CD1-CD2 3.41Å; L108-F120 HydrophobicContact CD1-CE1 4.48Å; L108-F120 HydrophobicContact CD1-CE2 3.55Å; L108-F120 HydrophobicContact CD1-CG 3.86Å; L108-F120 HydrophobicContact CD1-CZ 4.11Å; L108-F120 VanDerWaalsContact CD1-O 3.28Å; L108-F120 WeakPolarHBondContact CD1-O 3.4Å; L108-F120 HydrophobicContact CG-CD2 3.94Å; L108-F120 HydrophobicContact CG-CE2 3.78Å; L108-F120 WeakPolarHBondContact O-CD2 3.42Å; A111-F120 HydrophobicContact CB-CB 4.14Å; Y116-F120 PolarHBondContact O-N 2.96Å; A117-F120 WeakPolarHBondContact O-CB 3.4Å; A117-F120 PolarHBondContact O-N 3.3Å; F120-C123 PolarHBondContact O-N 3.38Å; F120-S124 WeakPolarHBondContact O-CB 3.38Å; F120-S124 PolarHBondContact O-N 2.77Å; F120-L146 HydrophobicContact CE2-CB 4.29Å; F120-L146 HydrophobicContact CZ-CB 4.34Å; F120-C148 HydrophobicContact CE1-CB 4.11Å; F120-C148 HydrophobicContact CZ-CB 3.81Å
121	E	94.8	Very high	94.8	Very high	130 Å²	130	50.9 Å²	50.9	61%	0.607	27%	0.269	S	S	*	.	H	α-helix	trans	-63	-41.3	175.1	-75.3	175.2	-177.3	0	0	112.3	A117 K118 L119 S124 A125	A117-E121 WeakPolarHBondContact O-CG 3.07Å; A117-E121 PolarHBondContact O-N 3.31Å; K118-E121 PolarHBondContact O-N 3.32Å; L119-E121 VanDerWaalsContact C-N 3.32Å; L119-E121 PolarHBondContact O-N 2.94Å; E121-S124 PolarHBondContact O-N 3.35Å; E121-A125 WeakPolarHBondContact O-CB 3.47Å; E121-A125 PolarHBondContact O-N 3.12Å
122	A	95.7	Very high	94.7	Very high	45 Å²	45	53.6 Å²	53.6	37%	0.372	29%	0.286	S	S	.	.	H	α-helix	trans	-63.7	-45	176.4	0	0	0	0	0	112.2	I99 K118 L119 A125 Y126	I99-A122 HydrophobicContact CD1-CB 3.87Å; K118-A122 PolarHBondContact O-N 2.87Å; L119-A122 PolarHBondContact O-N 3.02Å; A122-A125 PolarHBondContact O-N 3.21Å; A122-Y126 PolarHBondContact O-N 3.34Å
123	C	95.9	Very high	94.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-41.7	174.4	-67.5	0	0	0	0	111.5	V104 L108 L119 F120 Y126 L127	V104-C123 HydrophobicContact CG2-CB 3.96Å; L108-C123 HydrophobicContact CB-CB 4Å; L108-C123 HydrophobicContact CD1-CB 3.53Å; L108-C123 HydrophobicContact CG-CB 4.34Å; L119-C123 PolarHBondContact O-N 3.34Å; L119-C123 PolarHBondContact O-SG 3.28Å; L119-C123 VanDerWaalsContact O-SG 3.37Å; F120-C123 PolarHBondContact O-N 3.38Å; C123-Y126 WeakPolarHBondContact O-CB 3.44Å; C123-Y126 PolarHBondContact O-N 2.99Å; C123-L127 WeakPolarHBondContact O-CG 3.44Å; C123-L127 PolarHBondContact O-N 3.43Å
124	S	95.4	Very high	94.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-43.2	175	179.8	0	0	0	0	112	F120 E121 Y126 L127 Q128 C148 S150	F120-S124 WeakPolarHBondContact O-CB 3.38Å; F120-S124 PolarHBondContact O-N 2.77Å; E121-S124 PolarHBondContact O-N 3.35Å; S124-Y126 VanDerWaalsContact C-N 3.33Å; S124-Y126 PolarHBondContact O-N 3.2Å; S124-L127 PolarHBondContact O-N 3.39Å; S124-Q128 WeakPolarHBondContact O-CB 3.47Å; S124-Q128 VanDerWaalsContact O-CG 3.23Å; S124-Q128 WeakPolarHBondContact O-CG 3.28Å; S124-Q128 PolarHBondContact O-N 2.95Å; S124-Q128 PolarHBondContact O-NE2 3.33Å; S124-Q128 PolarHBondContact OG-NE2 2.92Å; S124-Q128 VanDerWaalsContact OG-NE2 3.08Å; S124-C148 PolarHBondContact OG-SG 3.06Å; S124-S150 PolarHBondContact OG-OG 3.04Å
125	A	95.8	Very high	94.6	Very high	55 Å²	55	56 Å²	56	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-40.2	177	0	0	0	0	0	111.8	E121 A122 Q128 D129	E121-A125 WeakPolarHBondContact O-CB 3.47Å; E121-A125 PolarHBondContact O-N 3.12Å; A122-A125 PolarHBondContact O-N 3.21Å; A125-Q128 WeakPolarHBondContact O-CB 3.38Å; A125-Q128 PolarHBondContact O-N 3.08Å; A125-D129 PolarHBondContact O-N 3.39Å; A125-D129 VanDerWaalsContact O-N 3.09Å
126	Y	95.5	Very high	94.6	Very high	60 Å²	60	51 Å²	51	24%	0.235	27%	0.274	C	S	.	.	H	α-helix	trans	-60.4	-49.4	174.2	-177.2	-89	0	0	0	111.9	I99 P101 V104 A122 C123 S124 Q128 D129 K130	I99-Y126 HydrophobicContact CG2-CD1 3.99Å; I99-Y126 HydrophobicContact CG2-CD2 4.02Å; I99-Y126 HydrophobicContact CG2-CE1 4.48Å; I99-Y126 HydrophobicContact CG2-CE2 4.5Å; I99-Y126 HydrophobicContact CG2-CG 3.73Å; P101-Y126 VanDerWaalsContact CD-OH 3.25Å; P101-Y126 WeakPolarHBondContact CD-OH 3.44Å; P101-Y126 WeakPolarHBondContact CG-OH 3.27Å; V104-Y126 HydrophobicContact CB-CD1 4.29Å; V104-Y126 HydrophobicContact CG1-CD1 4.43Å; V104-Y126 HydrophobicContact CG1-CE1 4.45Å; V104-Y126 HydrophobicContact CG2-CD1 3.98Å; A122-Y126 PolarHBondContact O-N 3.34Å; C123-Y126 WeakPolarHBondContact O-CB 3.44Å; C123-Y126 PolarHBondContact O-N 2.99Å; S124-Y126 VanDerWaalsContact C-N 3.33Å; S124-Y126 PolarHBondContact O-N 3.2Å; Y126-Q128 VanDerWaalsContact C-N 3.28Å; Y126-Q128 PolarHBondContact O-N 2.94Å; Y126-D129 WeakPolarHBondContact O-CB 3.34Å; Y126-D129 PolarHBondContact O-N 3.06Å; Y126-D129 VanDerWaalsContact O-N 3.12Å; Y126-K130 HydrophobicContact CE1-CG 4.12Å; Y126-K130 PolarHBondContact O-N 3.09Å
127	L	94.9	Very high	94.5	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-39.1	176.7	-70.9	175.4	0	0	0	111.8	V104 L105 L108 C123 S124 D129 K130 L131 M139 L142 L151	V104-L127 HydrophobicContact CG1-CD2 3.74Å; V104-L127 HydrophobicContact CG1-CG 4.48Å; V104-L127 HydrophobicContact CG2-CD1 4.34Å; V104-L127 HydrophobicContact CG2-CD2 4.06Å; V104-L127 HydrophobicContact CG2-CG 3.87Å; L105-L127 HydrophobicContact CD2-CD1 4.44Å; L105-L127 HydrophobicContact CD2-CD2 4.5Å; L108-L127 HydrophobicContact CD2-CD1 3.77Å; C123-L127 WeakPolarHBondContact O-CG 3.44Å; C123-L127 PolarHBondContact O-N 3.43Å; S124-L127 PolarHBondContact O-N 3.39Å; L127-D129 VanDerWaalsContact C-N 3.26Å; L127-D129 PolarHBondContact O-N 3.4Å; L127-K130 CarbonylContact O-C 3.32Å; L127-K130 PolarHBondContact O-N 2.95Å; L127-K130 VanDerWaalsContact O-N 3.13Å; L127-L131 PolarHBondContact O-N 3.33Å; L127-L131 VanDerWaalsContact O-N 3.13Å; L127-M139 HydrophobicContact CD1-SD 4.34Å; L127-M139 HydrophobicContact CD2-CE 4.21Å; L127-M139 HydrophobicContact CD2-SD 4.15Å; L127-L142 HydrophobicContact CD1-CD2 4.02Å; L127-L151 HydrophobicContact CB-CD1 4.07Å; L127-L151 HydrophobicContact CB-CD2 4.4Å; L127-L151 HydrophobicContact CD1-CD2 3.99Å
128	Q	95.2	Very high	94.5	Very high	38 Å²	38	49.8 Å²	49.8	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-26.4	176.7	-78.2	179.6	64.8	0	0	113.9	S124 A125 Y126 L131 L151 K154	S124-Q128 WeakPolarHBondContact O-CB 3.47Å; S124-Q128 VanDerWaalsContact O-CG 3.23Å; S124-Q128 WeakPolarHBondContact O-CG 3.28Å; S124-Q128 PolarHBondContact O-N 2.95Å; S124-Q128 PolarHBondContact O-NE2 3.33Å; S124-Q128 PolarHBondContact OG-NE2 2.92Å; S124-Q128 VanDerWaalsContact OG-NE2 3.08Å; A125-Q128 WeakPolarHBondContact O-CB 3.38Å; A125-Q128 PolarHBondContact O-N 3.08Å; Y126-Q128 VanDerWaalsContact C-N 3.28Å; Y126-Q128 PolarHBondContact O-N 2.94Å; Q128-L131 HydrophobicContact CG-CD1 4.47Å; Q128-L151 HydrophobicContact CG-CB 4.43Å; Q128-L151 HydrophobicContact CG-CD1 3.65Å; Q128-K154 HydrophobicContact CB-CD 3.75Å; Q128-K154 HydrophobicContact CG-CB 4.42Å; Q128-K154 HydrophobicContact CG-CD 3.8Å; Q128-K154 PolarHBondContact O-NZ 3.1Å
129	D	94.8	Very high	94.4	Very high	112 Å²	112	43.3 Å²	43.3	60%	0.599	24%	0.236	S	C	*	.	H	α-helix	trans	-78.2	-29.3	173.4	-172.6	65.4	0	0	0	111.9	A125 Y126 L127	A125-D129 PolarHBondContact O-N 3.39Å; A125-D129 VanDerWaalsContact O-N 3.09Å; Y126-D129 WeakPolarHBondContact O-CB 3.34Å; Y126-D129 PolarHBondContact O-N 3.06Å; Y126-D129 VanDerWaalsContact O-N 3.12Å; L127-D129 VanDerWaalsContact C-N 3.26Å; L127-D129 PolarHBondContact O-N 3.4Å
130	K	93	Very high	94.3	Very high	103 Å²	103	44.2 Å²	44.2	45%	0.448	24%	0.241	S	C	.	.	S	Bend	trans	-97.6	15.1	179.7	-56	-53.3	178.3	-140	0	114.3	Y126 L127 T132 N135	Y126-K130 HydrophobicContact CE1-CG 4.12Å; Y126-K130 PolarHBondContact O-N 3.09Å; L127-K130 CarbonylContact O-C 3.32Å; L127-K130 PolarHBondContact O-N 2.95Å; L127-K130 VanDerWaalsContact O-N 3.13Å; K130-T132 PolarHBondContact O-N 3.39Å; K130-N135 PolarHBondContact O-ND2 3.48Å
131	L	94.2	Very high	94.2	Very high	15 Å²	15	45.7 Å²	45.7	8%	0.079	25%	0.246	C	C	.	.			trans	-66.4	128.4	174.5	-85.2	168.8	0	0	0	110.5	L127 Q128 M139 L151 K154 A155 M158	L127-L131 PolarHBondContact O-N 3.33Å; L127-L131 VanDerWaalsContact O-N 3.13Å; Q128-L131 HydrophobicContact CG-CD1 4.47Å; L131-M139 HydrophobicContact CD2-CB 3.72Å; L131-M139 HydrophobicContact CD2-CG 3.74Å; L131-L151 HydrophobicContact CD1-CD1 4.31Å; L131-K154 HydrophobicContact CD1-CB 4.07Å; L131-K154 HydrophobicContact CD1-CD 3.99Å; L131-K154 HydrophobicContact CD1-CG 3.85Å; L131-A155 HydrophobicContact CD1-CB 4.32Å; L131-A155 HydrophobicContact CD2-CB 3.81Å; L131-M158 HydrophobicContact CB-CE 3.86Å; L131-M158 HydrophobicContact CB-SD 3.8Å
132	T	93.5	Very high	94	Very high	56 Å²	56	40.6 Å²	40.6	34%	0.344	22%	0.222	S	C	.	.			trans	-128.9	159.7	174.5	64.7	0	0	0	0	109.8	K130 D134 N135 C136 M158	K130-T132 PolarHBondContact O-N 3.39Å; T132-D134 PolarHBondContact O-N 2.92Å; T132-N135 PolarHBondContact N-OD1 3.49Å; T132-N135 PolarHBondContact O-N 3.2Å; T132-N135 VanDerWaalsContact O-N 3.16Å; T132-N135 PolarHBondContact O-OD1 3.37Å; T132-N135 VanDerWaalsContact OG1-CG 3.26Å; T132-N135 PolarHBondContact OG1-N 2.98Å; T132-N135 PolarHBondContact OG1-ND2 3.14Å; T132-N135 PolarHBondContact OG1-OD1 3.31Å; T132-C136 WeakPolarHBondContact O-CB 3.41Å; T132-C136 PolarHBondContact O-N 3.34Å; T132-C136 VanDerWaalsContact O-N 3.09Å; T132-M158 VanDerWaalsContact C-SD 3.55Å
133	P	91.6	Very high	94	Very high	28 Å²	28	38.6 Å²	38.6	18%	0.182	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-33.9	172.8	-23.2	32.8	0	0	0	112.4	N135 C136 C162 E165 V166	P133-N135 PolarHBondContact O-N 2.98Å; P133-C136 PolarHBondContact O-SG 3.4Å; P133-C162 HydrophobicContact CB-CB 4.18Å; P133-C162 HydrophobicContact CG-CB 4.11Å; P133-E165 HydrophobicContact CB-CB 3.7Å; P133-E165 HydrophobicContact CG-CB 4.25Å; P133-E165 WeakPolarHBondContact CG-OE2 3.33Å; P133-V166 HydrophobicContact CB-CG2 4.3Å
134	D	92.3	Very high	93.8	Very high	106 Å²	106	44.3 Å²	44.3	57%	0.567	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-15	-178.7	-56.8	-52.8	0	0	0	114.8	T132 E171	T132-D134 PolarHBondContact O-N 2.92Å; D134-E171 WeakPolarHBondContact O-CG 3.44Å
135	N	92.8	Very high	93.5	Very high	36 Å²	36	50.8 Å²	50.8	19%	0.193	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-5	-179.8	75.5	13.8	0	0	0	114.3	K130 T132 P133 L137 S138 M139 E171	K130-N135 PolarHBondContact O-ND2 3.48Å; T132-N135 PolarHBondContact N-OD1 3.49Å; T132-N135 PolarHBondContact O-N 3.2Å; T132-N135 VanDerWaalsContact O-N 3.16Å; T132-N135 PolarHBondContact O-OD1 3.37Å; T132-N135 VanDerWaalsContact OG1-CG 3.26Å; T132-N135 PolarHBondContact OG1-N 2.98Å; T132-N135 PolarHBondContact OG1-ND2 3.14Å; T132-N135 PolarHBondContact OG1-OD1 3.31Å; P133-N135 PolarHBondContact O-N 2.98Å; N135-L137 VanDerWaalsContact C-N 3.32Å; N135-L137 PolarHBondContact O-N 3.33Å; N135-S138 PolarHBondContact O-N 3.02Å; N135-M139 VanDerWaalsContact O-CG 3.26Å; N135-M139 WeakPolarHBondContact O-CG 3.36Å; N135-M139 PolarHBondContact O-N 3.24Å; N135-E171 VanDerWaalsContact C-OE2 3.23Å; N135-E171 WeakPolarHBondContact CA-OE1 3.46Å; N135-E171 WeakPolarHBondContact CA-OE2 3.07Å
136	C	94.9	Very high	93.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-32.5	-168.1	66.4	0	0	0	0	112.8	T132 P133 M139 I140 M158 A159 E171	T132-C136 WeakPolarHBondContact O-CB 3.41Å; T132-C136 PolarHBondContact O-N 3.34Å; T132-C136 VanDerWaalsContact O-N 3.09Å; P133-C136 PolarHBondContact O-SG 3.4Å; C136-M139 PolarHBondContact O-N 3.4Å; C136-I140 VanDerWaalsContact O-CG1 3.25Å; C136-I140 WeakPolarHBondContact O-CG1 3.47Å; C136-I140 PolarHBondContact O-N 3.23Å; C136-M158 HydrophobicContact CB-CG 4.43Å; C136-A159 HydrophobicContact CB-CB 4.36Å; C136-A159 VanDerWaalsContact SG-CB 3.59Å; C136-E171 PolarHBondContact N-OE2 3.08Å
137	L	94.8	Very high	93	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-72	-42.9	-179.7	-61	175.4	0	0	0	110.4	N135 M139 I140 R141 A159 V166 E171 L172 L175 Y183	N135-L137 VanDerWaalsContact C-N 3.32Å; N135-L137 PolarHBondContact O-N 3.33Å; L137-M139 VanDerWaalsContact C-N 3.31Å; L137-M139 PolarHBondContact O-N 3.49Å; L137-I140 HydrophobicContact CD2-CD1 4.37Å; L137-I140 WeakPolarHBondContact O-CB 3.22Å; L137-I140 PolarHBondContact O-N 3.06Å; L137-R141 PolarHBondContact O-N 3.46Å; L137-R141 VanDerWaalsContact O-N 3.1Å; L137-A159 HydrophobicContact CD2-CB 4.23Å; L137-V166 HydrophobicContact CD1-CG1 3.62Å; L137-V166 HydrophobicContact CD2-CG1 4.13Å; L137-V166 HydrophobicContact CG-CG1 3.87Å; L137-E171 HydrophobicContact CB-CB 4.22Å; L137-E171 WeakPolarHBondContact CB-OE2 3.18Å; L137-E171 HydrophobicContact CD1-CB 3.92Å; L137-E171 PolarHBondContact N-OE2 3.48Å; L137-L172 HydrophobicContact CD1-CB 4.49Å; L137-L175 HydrophobicContact CB-CD2 4.45Å; L137-L175 HydrophobicContact CD1-CD1 3.91Å; L137-L175 HydrophobicContact CD1-CD2 4.28Å; L137-L175 HydrophobicContact CD1-CG 4.2Å; L137-Y183 HydrophobicContact CD2-CE1 4.43Å
138	S	92.4	Very high	92.9	Very high	45 Å²	45	52.1 Å²	52.1	32%	0.315	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-40.8	172.9	-65.3	0	0	0	0	111.8	N135 I140 R141 L142 E171	N135-S138 PolarHBondContact O-N 3.02Å; S138-I140 VanDerWaalsContact C-N 3.33Å; S138-I140 PolarHBondContact O-N 3.31Å; S138-R141 PolarHBondContact O-N 3.04Å; S138-L142 WeakPolarHBondContact O-CB 3.38Å; S138-L142 PolarHBondContact O-N 2.95Å; S138-E171 WeakPolarHBondContact CB-OE1 3.46Å; S138-E171 PolarHBondContact N-OE2 2.9Å; S138-E171 PolarHBondContact OG-OE1 2.88Å
139	M	93.9	Very high	92.8	Very high	27 Å²	27	56.3 Å²	56.3	13%	0.133	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-34	176.2	-67.3	-62.7	149	0	0	112.6	L127 L131 N135 C136 L137 L142 A143 A155	L127-M139 HydrophobicContact CD1-SD 4.34Å; L127-M139 HydrophobicContact CD2-CE 4.21Å; L127-M139 HydrophobicContact CD2-SD 4.15Å; L131-M139 HydrophobicContact CD2-CB 3.72Å; L131-M139 HydrophobicContact CD2-CG 3.74Å; N135-M139 VanDerWaalsContact O-CG 3.26Å; N135-M139 WeakPolarHBondContact O-CG 3.36Å; N135-M139 PolarHBondContact O-N 3.24Å; C136-M139 PolarHBondContact O-N 3.4Å; L137-M139 VanDerWaalsContact C-N 3.31Å; L137-M139 PolarHBondContact O-N 3.49Å; M139-L142 HydrophobicContact SD-CD2 4.06Å; M139-A143 WeakPolarHBondContact O-CB 3.47Å; M139-A143 PolarHBondContact O-N 3.26Å; M139-A155 HydrophobicContact CB-CB 4Å
140	I	94.4	Very high	92.7	Very high	23 Å²	23	54 Å²	54	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-45.8	171.6	-70.2	163.6	0	0	0	110.6	C136 L137 S138 A143 K144 N152 A155 K156 A159	C136-I140 VanDerWaalsContact O-CG1 3.25Å; C136-I140 WeakPolarHBondContact O-CG1 3.47Å; C136-I140 PolarHBondContact O-N 3.23Å; L137-I140 HydrophobicContact CD2-CD1 4.37Å; L137-I140 WeakPolarHBondContact O-CB 3.22Å; L137-I140 PolarHBondContact O-N 3.06Å; S138-I140 VanDerWaalsContact C-N 3.33Å; S138-I140 PolarHBondContact O-N 3.31Å; I140-A143 PolarHBondContact O-N 2.92Å; I140-K144 HydrophobicContact CG2-CD 4.48Å; I140-K144 WeakPolarHBondContact O-CG 3.2Å; I140-K144 PolarHBondContact O-N 2.84Å; I140-N152 PolarHBondContact O-ND2 3.36Å; I140-A155 HydrophobicContact CG1-CB 3.68Å; I140-K156 HydrophobicContact CD1-CB 4.21Å; I140-K156 HydrophobicContact CG1-CB 4.4Å; I140-A159 HydrophobicContact CD1-CB 3.88Å
141	R	92.2	Very high	92.8	Very high	63 Å²	63	49.1 Å²	49.1	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-50.3	178.1	-67	-173	-168.2	139.2	10.5	111.4	L137 S138 A143 K144 I145 D174 E179	L137-R141 PolarHBondContact O-N 3.46Å; L137-R141 VanDerWaalsContact O-N 3.1Å; S138-R141 PolarHBondContact O-N 3.04Å; R141-A143 VanDerWaalsContact C-N 3.3Å; R141-A143 PolarHBondContact O-N 2.86Å; R141-K144 WeakPolarHBondContact O-CB 3.28Å; R141-K144 PolarHBondContact O-N 2.88Å; R141-K144 VanDerWaalsContact O-N 3.08Å; R141-I145 WeakPolarHBondContact O-CG1 3.34Å; R141-I145 PolarHBondContact O-N 2.83Å; R141-D174 PolarHBondContact NH2-O 3.18Å; R141-D174 VanDerWaalsContact NH2-O 3.14Å; R141-E179 WeakPolarHBondContact CG-OE1 3.29Å; R141-E179 IonicContact CZ-OE2 2.67Å; R141-E179 IonicContact NE-OE1 2.68Å; R141-E179 PolarHBondContact NE-OE1 3.04Å; R141-E179 IonicContact NE-OE2 3.84Å; R141-E179 PolarHBondContact NE-OE2 2.93Å; R141-E179 IonicContact NH2-OE2 2.82Å; R141-E179 PolarHBondContact NH2-OE2 3.48Å
142	L	91.5	Very high	92.9	Very high	23 Å²	23	50.1 Å²	50.1	12%	0.12	26%	0.264	C	S	.	.	H	α-helix	trans	-55.6	-46.6	177	-178.3	70.9	0	0	0	111.2	L105 L108 L127 S138 M139 K144 I145 L146	L105-L142 HydrophobicContact CD2-CD1 4.41Å; L105-L142 HydrophobicContact CD2-CD2 3.4Å; L108-L142 HydrophobicContact CD2-CD2 4.4Å; L127-L142 HydrophobicContact CD1-CD2 4.02Å; S138-L142 WeakPolarHBondContact O-CB 3.38Å; S138-L142 PolarHBondContact O-N 2.95Å; M139-L142 HydrophobicContact SD-CD2 4.06Å; L142-K144 VanDerWaalsContact C-N 3.29Å; L142-K144 PolarHBondContact O-N 3.26Å; L142-I145 PolarHBondContact O-N 3.29Å; L142-L146 HydrophobicContact CD1-CD1 3.77Å; L142-L146 HydrophobicContact CD1-CG 4.36Å; L142-L146 HydrophobicContact CG-CD1 3.95Å; L142-L146 WeakPolarHBondContact O-CG 3.49Å; L142-L146 PolarHBondContact O-N 3.14Å
143	A	93.9	Very high	93	Very high	2 Å²	2	54.4 Å²	54.4	2%	0.017	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-33.3	179.2	0	0	0	0	0	112.9	M139 I140 R141 N147 C148 L151 N152	M139-A143 WeakPolarHBondContact O-CB 3.47Å; M139-A143 PolarHBondContact O-N 3.26Å; I140-A143 PolarHBondContact O-N 2.92Å; R141-A143 VanDerWaalsContact C-N 3.3Å; R141-A143 PolarHBondContact O-N 2.86Å; A143-N147 CarbonylContact O-C 3.53Å; A143-N147 WeakPolarHBondContact O-CA 3.49Å; A143-N147 PolarHBondContact O-N 3.42Å; A143-N147 VanDerWaalsContact O-N 3.07Å; A143-C148 HydrophobicContact CB-CB 4.27Å; A143-C148 PolarHBondContact O-N 3.18Å; A143-L151 HydrophobicContact CB-CB 4.03Å; A143-L151 HydrophobicContact CB-CD2 4.03Å; A143-L151 HydrophobicContact CB-CG 3.96Å; A143-N152 HydrophobicContact CB-CB 3.7Å
144	K	91.9	Very high	93.1	Very high	121 Å²	121	57.5 Å²	57.5	53%	0.526	29%	0.288	S	S	.	.	H	α-helix	trans	-68.8	-44.8	173.3	-73.1	176.9	-179.7	179.8	0	111.6	I140 R141 L142 L146 N147	I140-K144 HydrophobicContact CG2-CD 4.48Å; I140-K144 WeakPolarHBondContact O-CG 3.2Å; I140-K144 PolarHBondContact O-N 2.84Å; R141-K144 WeakPolarHBondContact O-CB 3.28Å; R141-K144 PolarHBondContact O-N 2.88Å; R141-K144 VanDerWaalsContact O-N 3.08Å; L142-K144 VanDerWaalsContact C-N 3.29Å; L142-K144 PolarHBondContact O-N 3.26Å; K144-L146 VanDerWaalsContact C-N 3.31Å; K144-L146 PolarHBondContact O-N 2.91Å; K144-N147 PolarHBondContact O-N 3.16Å
145	I	90.8	Very high	93.3	Very high	137 Å²	137	52.4 Å²	52.4	70%	0.703	26%	0.261	S	S	*	.	H	α-helix	trans	-59.6	-44	178.7	-67.4	167.2	0	0	0	110.7	R141 L142 N147	R141-I145 WeakPolarHBondContact O-CG1 3.34Å; R141-I145 PolarHBondContact O-N 2.83Å; L142-I145 PolarHBondContact O-N 3.29Å; I145-N147 VanDerWaalsContact C-N 3.34Å
146	L	89.1	Confident	93.4	Very high	23 Å²	23	54.9 Å²	54.9	12%	0.12	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	4.3	-177.2	-59.8	177	0	0	0	114	L108 E109 F120 L142 K144 C148	L108-L146 HydrophobicContact CB-CD1 4.46Å; L108-L146 HydrophobicContact CD2-CD1 3.36Å; L108-L146 HydrophobicContact CG-CD1 3.74Å; E109-L146 HydrophobicContact CG-CD1 4.36Å; E109-L146 HydrophobicContact CG-CD2 3.96Å; F120-L146 HydrophobicContact CE2-CB 4.29Å; F120-L146 HydrophobicContact CZ-CB 4.34Å; L142-L146 HydrophobicContact CD1-CD1 3.77Å; L142-L146 HydrophobicContact CD1-CG 4.36Å; L142-L146 HydrophobicContact CG-CD1 3.95Å; L142-L146 WeakPolarHBondContact O-CG 3.49Å; L142-L146 PolarHBondContact O-N 3.14Å; K144-L146 VanDerWaalsContact C-N 3.31Å; K144-L146 PolarHBondContact O-N 2.91Å; L146-C148 PolarHBondContact O-N 3.29Å
147	N	90.4	Very high	93.3	Very high	127 Å²	127	57.5 Å²	57.5	68%	0.679	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	33.6	-175	-163.2	27.1	0	0	0	113.7	A143 K144 I145 Q149	A143-N147 CarbonylContact O-C 3.53Å; A143-N147 WeakPolarHBondContact O-CA 3.49Å; A143-N147 PolarHBondContact O-N 3.42Å; A143-N147 VanDerWaalsContact O-N 3.07Å; K144-N147 PolarHBondContact O-N 3.16Å; I145-N147 VanDerWaalsContact C-N 3.34Å; N147-Q149 PolarHBondContact O-N 3.38Å
148	C	92.3	Very high	93.2	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.02	30%	0.302	C	S	.	.			trans	-86	88.5	-180	-165.3	0	0	0	0	111	F120 S124 A143 L146 S150 L151 N152	F120-C148 HydrophobicContact CE1-CB 4.11Å; F120-C148 HydrophobicContact CZ-CB 3.81Å; S124-C148 PolarHBondContact OG-SG 3.06Å; A143-C148 HydrophobicContact CB-CB 4.27Å; A143-C148 PolarHBondContact O-N 3.18Å; L146-C148 PolarHBondContact O-N 3.29Å; C148-S150 PolarHBondContact O-N 3.31Å; C148-L151 HydrophobicContact CB-CB 4.21Å; C148-N152 WeakPolarHBondContact O-CB 3.38Å; C148-N152 PolarHBondContact O-N 2.96Å
149	Q	93.4	Very high	93.2	Very high	126 Å²	126	57.6 Å²	57.6	59%	0.589	29%	0.288	S	S	*	.	H	α-helix	trans	-64.8	-34.1	-175	-64	-172.2	-3.8	0	0	114.2	N147 K153	N147-Q149 PolarHBondContact O-N 3.38Å; Q149-K153 WeakPolarHBondContact O-CB 3.17Å; Q149-K153 VanDerWaalsContact O-CG 3.29Å; Q149-K153 WeakPolarHBondContact O-CG 3.42Å; Q149-K153 PolarHBondContact O-N 2.62Å
150	S	93.9	Very high	93.2	Very high	63 Å²	63	56.5 Å²	56.5	44%	0.441	28%	0.282	S	S	.	.	H	α-helix	trans	-65.6	-50	179.8	51.2	0	0	0	0	111.7	S124 C148 K153 K154	S124-S150 PolarHBondContact OG-OG 3.04Å; C148-S150 PolarHBondContact O-N 3.31Å; S150-K153 PolarHBondContact O-N 3.29Å; S150-K154 PolarHBondContact O-N 3.48Å; S150-K154 VanDerWaalsContact O-N 3.14Å
151	L	95.2	Very high	92.9	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-43.9	175.5	-179.4	62.7	0	0	0	110.9	L127 Q128 L131 A143 C148 K153 K154 A155	L127-L151 HydrophobicContact CB-CD1 4.07Å; L127-L151 HydrophobicContact CB-CD2 4.4Å; L127-L151 HydrophobicContact CD1-CD2 3.99Å; Q128-L151 HydrophobicContact CG-CB 4.43Å; Q128-L151 HydrophobicContact CG-CD1 3.65Å; L131-L151 HydrophobicContact CD1-CD1 4.31Å; A143-L151 HydrophobicContact CB-CB 4.03Å; A143-L151 HydrophobicContact CB-CD2 4.03Å; A143-L151 HydrophobicContact CB-CG 3.96Å; C148-L151 HydrophobicContact CB-CB 4.21Å; L151-K153 PolarHBondContact O-N 2.87Å; L151-K154 PolarHBondContact O-N 3.28Å; L151-A155 WeakPolarHBondContact O-CB 3.06Å; L151-A155 PolarHBondContact O-N 2.96Å
152	N	95.2	Very high	92.8	Very high	37 Å²	37	61.2 Å²	61.2	20%	0.198	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-48.7	178.9	-175.2	-88.1	0	0	0	111.9	I140 A143 C148 K154 K156	I140-N152 PolarHBondContact O-ND2 3.36Å; A143-N152 HydrophobicContact CB-CB 3.7Å; C148-N152 WeakPolarHBondContact O-CB 3.38Å; C148-N152 PolarHBondContact O-N 2.96Å; N152-K154 PolarHBondContact O-N 2.55Å; N152-K156 WeakPolarHBondContact O-CB 3.27Å; N152-K156 PolarHBondContact O-N 3.08Å
153	K	95	Very high	92.8	Very high	145 Å²	145	60.1 Å²	60.1	63%	0.63	30%	0.301	S	S	*	.	H	α-helix	trans	-60.6	-45.9	179.1	-74.9	175.4	-176.4	179	0	111.7	Q149 S150 L151 A157	Q149-K153 WeakPolarHBondContact O-CB 3.17Å; Q149-K153 VanDerWaalsContact O-CG 3.29Å; Q149-K153 WeakPolarHBondContact O-CG 3.42Å; Q149-K153 PolarHBondContact O-N 2.62Å; S150-K153 PolarHBondContact O-N 3.29Å; L151-K153 PolarHBondContact O-N 2.87Å; K153-A157 VanDerWaalsContact O-CB 3.31Å; K153-A157 WeakPolarHBondContact O-CB 3.36Å; K153-A157 PolarHBondContact O-N 2.97Å
154	K	94.4	Very high	92.6	Very high	93 Å²	93	62.1 Å²	62.1	40%	0.404	31%	0.314	S	S	.	.	H	α-helix	trans	-69.2	-43	-178.4	-162.2	179	-176.4	-170.3	0	112.1	Q128 L131 S150 L151 N152 A157 M158	Q128-K154 HydrophobicContact CB-CD 3.75Å; Q128-K154 HydrophobicContact CG-CB 4.42Å; Q128-K154 HydrophobicContact CG-CD 3.8Å; Q128-K154 PolarHBondContact O-NZ 3.1Å; L131-K154 HydrophobicContact CD1-CB 4.07Å; L131-K154 HydrophobicContact CD1-CD 3.99Å; L131-K154 HydrophobicContact CD1-CG 3.85Å; S150-K154 PolarHBondContact O-N 3.48Å; S150-K154 VanDerWaalsContact O-N 3.14Å; L151-K154 PolarHBondContact O-N 3.28Å; N152-K154 PolarHBondContact O-N 2.55Å; K154-A157 PolarHBondContact O-N 3.44Å; K154-M158 PolarHBondContact O-N 3.3Å
155	A	96.1	Very high	92.6	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-42.8	176.9	0	0	0	0	0	111.4	L131 M139 I140 L151 M158 A159	L131-A155 HydrophobicContact CD1-CB 4.32Å; L131-A155 HydrophobicContact CD2-CB 3.81Å; M139-A155 HydrophobicContact CB-CB 4Å; I140-A155 HydrophobicContact CG1-CB 3.68Å; L151-A155 WeakPolarHBondContact O-CB 3.06Å; L151-A155 PolarHBondContact O-N 2.96Å; A155-M158 PolarHBondContact O-N 3.19Å; A155-A159 WeakPolarHBondContact O-CB 3.45Å; A155-A159 PolarHBondContact O-N 3.45Å
156	K	94.9	Very high	92.6	Very high	87 Å²	87	54 Å²	54	38%	0.378	28%	0.275	S	S	.	.	H	α-helix	trans	-61.8	-46.1	174.3	-170.9	-179.1	179.4	-167.8	0	111.8	I140 N152 M158 A159 L160 D186	I140-K156 HydrophobicContact CD1-CB 4.21Å; I140-K156 HydrophobicContact CG1-CB 4.4Å; N152-K156 WeakPolarHBondContact O-CB 3.27Å; N152-K156 PolarHBondContact O-N 3.08Å; K156-M158 VanDerWaalsContact C-N 3.29Å; K156-M158 PolarHBondContact O-N 3.21Å; K156-A159 PolarHBondContact O-N 2.99Å; K156-L160 HydrophobicContact CD-CD1 4.5Å; K156-L160 HydrophobicContact CG-CD1 4Å; K156-L160 HydrophobicContact CG-CG 4.36Å; K156-L160 VanDerWaalsContact O-CG 3.29Å; K156-L160 WeakPolarHBondContact O-CG 3.5Å; K156-L160 PolarHBondContact O-N 3.42Å; K156-D186 WeakPolarHBondContact CE-OD2 3.4Å; K156-D186 IonicContact NZ-OD2 3.56Å; K156-D186 PolarHBondContact NZ-OD2 3.03Å
157	A	93.2	Very high	92.8	Very high	56 Å²	56	53.6 Å²	53.6	46%	0.463	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-39.4	177.2	0	0	0	0	0	112.2	K153 K154 K161	K153-A157 VanDerWaalsContact O-CB 3.31Å; K153-A157 WeakPolarHBondContact O-CB 3.36Å; K153-A157 PolarHBondContact O-N 2.97Å; K154-A157 PolarHBondContact O-N 3.44Å; A157-K161 VanDerWaalsContact O-CB 3.23Å; A157-K161 WeakPolarHBondContact O-CB 3.28Å; A157-K161 PolarHBondContact O-N 3.36Å
158	M	93	Very high	92.7	Very high	52 Å²	52	52.3 Å²	52.3	26%	0.256	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-47.5	174	-178.1	170.8	-74.2	0	0	111.8	L131 T132 C136 K154 A155 K156 L160 K161 C162	L131-M158 HydrophobicContact CB-CE 3.86Å; L131-M158 HydrophobicContact CB-SD 3.8Å; T132-M158 VanDerWaalsContact C-SD 3.55Å; C136-M158 HydrophobicContact CB-CG 4.43Å; K154-M158 PolarHBondContact O-N 3.3Å; A155-M158 PolarHBondContact O-N 3.19Å; K156-M158 VanDerWaalsContact C-N 3.29Å; K156-M158 PolarHBondContact O-N 3.21Å; M158-L160 VanDerWaalsContact C-N 3.27Å; M158-L160 PolarHBondContact O-N 3.37Å; M158-K161 PolarHBondContact O-N 3.36Å; M158-C162 WeakPolarHBondContact O-CB 3.41Å; M158-C162 PolarHBondContact O-N 2.71Å
159	A	93.4	Very high	92.7	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-57.4	-41.6	178.6	0	0	0	0	0	111.8	C136 L137 I140 A155 K156 F163 Y183	C136-A159 HydrophobicContact CB-CB 4.36Å; C136-A159 VanDerWaalsContact SG-CB 3.59Å; L137-A159 HydrophobicContact CD2-CB 4.23Å; I140-A159 HydrophobicContact CD1-CB 3.88Å; A155-A159 WeakPolarHBondContact O-CB 3.45Å; A155-A159 PolarHBondContact O-N 3.45Å; K156-A159 PolarHBondContact O-N 2.99Å; A159-F163 PolarHBondContact O-N 3.48Å; A159-Y183 HydrophobicContact CB-CE2 3.85Å; A159-Y183 PolarHBondContact O-OH 2.72Å
160	L	92.1	Very high	92.6	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-70.2	-43.3	178.2	-67.1	170.1	0	0	0	112.2	K156 M158 Y183 D186 E188 L189 C190	K156-L160 HydrophobicContact CD-CD1 4.5Å; K156-L160 HydrophobicContact CG-CD1 4Å; K156-L160 HydrophobicContact CG-CG 4.36Å; K156-L160 VanDerWaalsContact O-CG 3.29Å; K156-L160 WeakPolarHBondContact O-CG 3.5Å; K156-L160 PolarHBondContact O-N 3.42Å; M158-L160 VanDerWaalsContact C-N 3.27Å; M158-L160 PolarHBondContact O-N 3.37Å; L160-Y183 HydrophobicContact CD2-CD2 4.24Å; L160-Y183 HydrophobicContact CD2-CE2 4.07Å; L160-D186 HydrophobicContact CD2-CB 3.69Å; L160-E188 HydrophobicContact CD1-CB 3.84Å; L160-L189 HydrophobicContact CD2-CB 4.17Å; L160-L189 HydrophobicContact CD2-CD1 3.74Å; L160-C190 WeakPolarHBondContact O-CB 3.2Å; L160-C190 PolarHBondContact O-N 3.32Å
161	K	89.8	Confident	92.4	Very high	158 Å²	158	50.7 Å²	50.7	69%	0.687	26%	0.262	S	S	*	.	H	α-helix	trans	-71.1	-39.8	-177.2	-172.7	-177.1	176.7	-171	0	112.8	A157 M158 F163 C190	A157-K161 VanDerWaalsContact O-CB 3.23Å; A157-K161 WeakPolarHBondContact O-CB 3.28Å; A157-K161 PolarHBondContact O-N 3.36Å; M158-K161 PolarHBondContact O-N 3.36Å; K161-F163 VanDerWaalsContact C-N 3.35Å; K161-C190 WeakPolarHBondContact O-CB 3.26Å
162	C	89.6	Confident	92.3	Very high	27 Å²	27	50.7 Å²	50.7	18%	0.182	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	30.7	-178.1	-69.7	0	0	0	0	112.1	P133 M158 P164 E165 V166	P133-C162 HydrophobicContact CB-CB 4.18Å; P133-C162 HydrophobicContact CG-CB 4.11Å; M158-C162 WeakPolarHBondContact O-CB 3.41Å; M158-C162 PolarHBondContact O-N 2.71Å; C162-P164 VanDerWaalsContact C-N 3.32Å; C162-E165 WeakPolarHBondContact CB-OE2 3.47Å; C162-E165 PolarHBondContact O-N 3.32Å; C162-E165 PolarHBondContact SG-OE2 2.85Å; C162-V166 WeakPolarHBondContact O-CG2 3.45Å; C162-V166 PolarHBondContact O-N 3.44Å; C162-V166 VanDerWaalsContact O-N 3.07Å
163	F	92	Very high	92.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-50.8	-41.4	-177.4	175.1	-106.2	0	0	0	114.5	A159 K161 E165 V166 A167 Y183 L184 L189 Q195 V196 A199	A159-F163 PolarHBondContact O-N 3.48Å; K161-F163 VanDerWaalsContact C-N 3.35Å; F163-E165 VanDerWaalsContact C-N 3.26Å; F163-E165 PolarHBondContact O-N 2.85Å; F163-V166 PolarHBondContact O-N 3.24Å; F163-A167 HydrophobicContact CD2-CB 4.47Å; F163-A167 HydrophobicContact CE1-CB 4.21Å; F163-A167 HydrophobicContact CE2-CB 4.08Å; F163-A167 HydrophobicContact CZ-CB 3.93Å; F163-A167 WeakPolarHBondContact O-CB 3.25Å; F163-A167 PolarHBondContact O-N 3.31Å; F163-Y183 AromaticContact CD2-CE1 3.87Å; F163-Y183 HydrophobicContact CD2-CE1 3.87Å; F163-Y183 AromaticContact CD2-CZ 3.85Å; F163-Y183 WeakPolarHBondContact CD2-OH 3.14Å; F163-Y183 AromaticContact CE2-CE1 3.98Å; F163-Y183 HydrophobicContact CE2-CE1 3.98Å; F163-L184 HydrophobicContact CE2-CD2 3.8Å; F163-L184 HydrophobicContact CZ-CD2 4.06Å; F163-L189 HydrophobicContact CB-CD1 3.91Å; F163-L189 HydrophobicContact CB-CG 3.95Å; F163-L189 HydrophobicContact CD1-CD2 4.01Å; F163-L189 HydrophobicContact CD1-CG 4.29Å; F163-L189 HydrophobicContact CD2-CD1 3.49Å; F163-L189 VanDerWaalsContact CD2-CD1 3.49Å; F163-L189 HydrophobicContact CD2-CD2 3.8Å; F163-L189 HydrophobicContact CD2-CG 3.88Å; F163-L189 HydrophobicContact CE1-CD2 4.09Å; F163-L189 HydrophobicContact CE2-CD1 4.18Å; F163-L189 HydrophobicContact CE2-CD2 3.89Å; F163-L189 HydrophobicContact CE2-CG 4.46Å; F163-L189 HydrophobicContact CG-CD1 3.79Å; F163-L189 HydrophobicContact CG-CD2 3.83Å; F163-L189 HydrophobicContact CG-CG 3.75Å; F163-L189 HydrophobicContact CZ-CD2 4.03Å; F163-Q195 HydrophobicContact CE1-CB 3.95Å; F163-V196 HydrophobicContact CE1-CG2 3.75Å; F163-V196 HydrophobicContact CZ-CB 4.44Å; F163-V196 HydrophobicContact CZ-CG2 3.97Å; F163-A199 HydrophobicContact CE2-CB 4.42Å; F163-A199 HydrophobicContact CZ-CB 3.89Å
164	P	88.9	Confident	92.1	Very high	44 Å²	44	48.9 Å²	48.9	29%	0.286	26%	0.257	S	S	.	.	H	α-helix	trans	-59.8	-35.7	179.7	-25.9	36.3	0	0	0	113.9	C162 S168	C162-P164 VanDerWaalsContact C-N 3.32Å; P164-S168 PolarHBondContact O-OG 2.82Å; P164-S168 VanDerWaalsContact O-OG 3.11Å
165	E	91.1	Very high	92	Very high	88 Å²	88	44.9 Å²	44.9	41%	0.411	24%	0.24	S	C	.	.	H	α-helix	trans	-74.2	-47.1	177.3	-67.5	147	-156.4	0	0	109.9	P133 C162 F163 A167 S168 S169	P133-E165 HydrophobicContact CB-CB 3.7Å; P133-E165 HydrophobicContact CG-CB 4.25Å; P133-E165 WeakPolarHBondContact CG-OE2 3.33Å; C162-E165 WeakPolarHBondContact CB-OE2 3.47Å; C162-E165 PolarHBondContact O-N 3.32Å; C162-E165 PolarHBondContact SG-OE2 2.85Å; F163-E165 VanDerWaalsContact C-N 3.26Å; F163-E165 PolarHBondContact O-N 2.85Å; E165-A167 VanDerWaalsContact C-N 3.32Å; E165-A167 PolarHBondContact O-N 2.78Å; E165-S168 PolarHBondContact O-N 3.02Å; E165-S168 VanDerWaalsContact O-N 3.08Å; E165-S169 PolarHBondContact O-N 3.44Å
166	V	92.7	Very high	91.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-37.2	177.9	-178.4	0	0	0	0	112.1	P133 L137 C162 F163 S168 S169 Y183	P133-V166 HydrophobicContact CB-CG2 4.3Å; L137-V166 HydrophobicContact CD1-CG1 3.62Å; L137-V166 HydrophobicContact CD2-CG1 4.13Å; L137-V166 HydrophobicContact CG-CG1 3.87Å; C162-V166 WeakPolarHBondContact O-CG2 3.45Å; C162-V166 PolarHBondContact O-N 3.44Å; C162-V166 VanDerWaalsContact O-N 3.07Å; F163-V166 PolarHBondContact O-N 3.24Å; V166-S168 PolarHBondContact O-N 2.87Å; V166-S169 PolarHBondContact O-N 3.02Å; V166-S169 VanDerWaalsContact O-N 3.09Å; V166-S169 PolarHBondContact O-OG 3.02Å; V166-Y183 HydrophobicContact CG1-CE1 4.1Å; V166-Y183 WeakPolarHBondContact CG1-OH 3.25Å
167	A	91.4	Very high	91.7	Very high	14 Å²	14	44.3 Å²	44.3	12%	0.116	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.1	177.1	0	0	0	0	0	112.7	F163 E165 A199	F163-A167 HydrophobicContact CD2-CB 4.47Å; F163-A167 HydrophobicContact CE1-CB 4.21Å; F163-A167 HydrophobicContact CE2-CB 4.08Å; F163-A167 HydrophobicContact CZ-CB 3.93Å; F163-A167 WeakPolarHBondContact O-CB 3.25Å; F163-A167 PolarHBondContact O-N 3.31Å; E165-A167 VanDerWaalsContact C-N 3.32Å; E165-A167 PolarHBondContact O-N 2.78Å; A167-A199 HydrophobicContact CB-CB 3.93Å
168	S	90.1	Very high	91.7	Very high	100 Å²	100	47.8 Å²	47.8	70%	0.699	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-7.6	178.6	-53	0	0	0	0	112.8	P164 E165 V166	P164-S168 PolarHBondContact O-OG 2.82Å; P164-S168 VanDerWaalsContact O-OG 3.11Å; E165-S168 PolarHBondContact O-N 3.02Å; E165-S168 VanDerWaalsContact O-N 3.08Å; V166-S168 PolarHBondContact O-N 2.87Å
169	S	92.1	Very high	91.7	Very high	10 Å²	10	47.7 Å²	47.7	7%	0.07	26%	0.256	C	S	.	.	S	Bend	trans	-80.7	157	-175.1	81.8	0	0	0	0	112.4	E165 V166 E171	E165-S169 PolarHBondContact O-N 3.44Å; V166-S169 PolarHBondContact O-N 3.02Å; V166-S169 VanDerWaalsContact O-N 3.09Å; V166-S169 PolarHBondContact O-OG 3.02Å; S169-E171 VanDerWaalsContact C-N 3.3Å
170	E	90.2	Very high	91.7	Very high	120 Å²	120	47.6 Å²	47.6	56%	0.561	26%	0.256	S	S	*	.	H	α-helix	trans	-67.6	-31.4	173.6	-65	-61.2	145	0	0	111.7	L172 K173	E170-L172 PolarHBondContact O-N 3.34Å; E170-L172 VanDerWaalsContact O-N 3.14Å; E170-K173 WeakPolarHBondContact O-CB 3.21Å; E170-K173 PolarHBondContact O-N 3.45Å; E170-K173 IonicContact OE1-NZ 2.71Å; E170-K173 PolarHBondContact OE1-NZ 3.37Å; E170-K173 WeakPolarHBondContact OE2-CD 3.14Å; E170-K173 WeakPolarHBondContact OE2-CE 3.41Å; E170-K173 IonicContact OE2-NZ 3.87Å; E170-K173 PolarHBondContact OE2-NZ 3.14Å
171	E	91	Very high	91.8	Very high	28 Å²	28	48.8 Å²	48.8	13%	0.131	26%	0.262	C	S	.	.	H	α-helix	trans	-58.7	-31.2	179.9	-67.1	-158.9	145.5	0	0	113.2	D134 N135 C136 L137 S138 S169 K173 D174	D134-E171 WeakPolarHBondContact O-CG 3.44Å; N135-E171 VanDerWaalsContact C-OE2 3.23Å; N135-E171 WeakPolarHBondContact CA-OE1 3.46Å; N135-E171 WeakPolarHBondContact CA-OE2 3.07Å; C136-E171 PolarHBondContact N-OE2 3.08Å; L137-E171 HydrophobicContact CB-CB 4.22Å; L137-E171 WeakPolarHBondContact CB-OE2 3.18Å; L137-E171 HydrophobicContact CD1-CB 3.92Å; L137-E171 PolarHBondContact N-OE2 3.48Å; S138-E171 WeakPolarHBondContact CB-OE1 3.46Å; S138-E171 PolarHBondContact N-OE2 2.9Å; S138-E171 PolarHBondContact OG-OE1 2.88Å; S169-E171 VanDerWaalsContact C-N 3.3Å; E171-K173 VanDerWaalsContact C-N 3.27Å; E171-K173 PolarHBondContact O-N 3.22Å; E171-D174 PolarHBondContact O-N 2.91Å
172	L	92.9	Very high	92	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-42.6	175.5	-172.1	88.4	0	0	0	110.5	L137 E170 D174 L175 L180 Y183 A199	L137-L172 HydrophobicContact CD1-CB 4.49Å; E170-L172 PolarHBondContact O-N 3.34Å; E170-L172 VanDerWaalsContact O-N 3.14Å; L172-D174 PolarHBondContact O-N 3.03Å; L172-L175 HydrophobicContact CD1-CD1 3.93Å; L172-L175 HydrophobicContact CG-CD1 4.4Å; L172-L175 WeakPolarHBondContact O-CB 3.25Å; L172-L175 WeakPolarHBondContact O-CG 3.4Å; L172-L175 PolarHBondContact O-N 3.35Å; L172-L175 VanDerWaalsContact O-N 3.16Å; L172-L180 HydrophobicContact CD1-CD1 3.99Å; L172-L180 HydrophobicContact CG-CD1 4.46Å; L172-Y183 HydrophobicContact CD1-CD1 4.33Å; L172-Y183 HydrophobicContact CD1-CE1 4.12Å; L172-A199 HydrophobicContact CD2-CB 3.97Å
173	K	92.5	Very high	92.1	Very high	42 Å²	42	46.1 Å²	46.1	18%	0.183	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-25.3	-176.4	-55.3	-178.9	-161.3	162.7	0	112.1	E170 E171 V202 R211	E170-K173 WeakPolarHBondContact O-CB 3.21Å; E170-K173 PolarHBondContact O-N 3.45Å; E170-K173 IonicContact OE1-NZ 2.71Å; E170-K173 PolarHBondContact OE1-NZ 3.37Å; E170-K173 WeakPolarHBondContact OE2-CD 3.14Å; E170-K173 WeakPolarHBondContact OE2-CE 3.41Å; E170-K173 IonicContact OE2-NZ 3.87Å; E170-K173 PolarHBondContact OE2-NZ 3.14Å; E171-K173 VanDerWaalsContact C-N 3.27Å; E171-K173 PolarHBondContact O-N 3.22Å; K173-V202 HydrophobicContact CG-CG1 4.36Å; K173-R211 VanDerWaalsContact O-CZ 3.31Å; K173-R211 PolarHBondContact O-NH1 2.88Å; K173-R211 PolarHBondContact O-NH2 3.09Å
174	D	91.9	Very high	92.2	Very high	103 Å²	103	46.1 Å²	46.1	55%	0.551	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-5.2	178.4	-65.9	-27.3	0	0	0	113.7	R141 E171 L172	R141-D174 PolarHBondContact NH2-O 3.18Å; R141-D174 VanDerWaalsContact NH2-O 3.14Å; E171-D174 PolarHBondContact O-N 2.91Å; L172-D174 PolarHBondContact O-N 3.03Å
175	L	92.8	Very high	92.2	Very high	9 Å²	9	45.2 Å²	45.2	5%	0.047	25%	0.25	C	S	.	.			trans	-63.3	139.9	175.4	-68	169.5	0	0	0	111.8	L137 L172 E179 L180 W203	L137-L175 HydrophobicContact CB-CD2 4.45Å; L137-L175 HydrophobicContact CD1-CD1 3.91Å; L137-L175 HydrophobicContact CD1-CD2 4.28Å; L137-L175 HydrophobicContact CD1-CG 4.2Å; L172-L175 HydrophobicContact CD1-CD1 3.93Å; L172-L175 HydrophobicContact CG-CD1 4.4Å; L172-L175 WeakPolarHBondContact O-CB 3.25Å; L172-L175 WeakPolarHBondContact O-CG 3.4Å; L172-L175 PolarHBondContact O-N 3.35Å; L172-L175 VanDerWaalsContact O-N 3.16Å; L175-E179 HydrophobicContact CB-CB 4.37Å; L175-E179 HydrophobicContact CD2-CB 3.84Å; L175-L180 HydrophobicContact CB-CB 4.35Å; L175-L180 HydrophobicContact CD1-CB 4.44Å; L175-L180 HydrophobicContact CD1-CD1 3.86Å; L175-W203 PolarHBondContact O-NE1 3.01Å
176	C	92.8	Very high	92.2	Very high	63 Å²	63	42.3 Å²	42.3	43%	0.426	24%	0.238	S	C	.	.			trans	-74.4	161	165	77.1	0	0	0	0	110.3	L178 E179 L180	C176-L178 VanDerWaalsContact C-N 3.28Å; C176-L178 PolarHBondContact O-N 2.98Å; C176-E179 PolarHBondContact N-OE2 3.42Å; C176-E179 PolarHBondContact O-N 3.48Å; C176-E179 VanDerWaalsContact O-N 3.16Å; C176-E179 WeakPolarHBondContact SG-CG 3.35Å; C176-L180 PolarHBondContact O-N 3.32Å; C176-L180 VanDerWaalsContact O-N 3.09Å
177	A	92.9	Very high	92	Very high	12 Å²	12	46.1 Å²	46.1	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-56.3	-40.8	-174.8	0	0	0	0	0	113	L180 I181 W203 Y214	A177-L180 PolarHBondContact O-N 3.13Å; A177-I181 WeakPolarHBondContact O-CB 3.43Å; A177-I181 WeakPolarHBondContact O-CD1 3.4Å; A177-I181 WeakPolarHBondContact O-CG1 3.37Å; A177-I181 PolarHBondContact O-N 2.88Å; A177-W203 HydrophobicContact CB-CH2 3.85Å; A177-W203 HydrophobicContact CB-CZ2 4.27Å; A177-Y214 HydrophobicContact CB-CD1 3.59Å; A177-Y214 HydrophobicContact CB-CD2 4.07Å; A177-Y214 HydrophobicContact CB-CE1 3.55Å; A177-Y214 HydrophobicContact CB-CE2 4.05Å; A177-Y214 HydrophobicContact CB-CG 3.85Å
178	L	92.3	Very high	91.8	Very high	129 Å²	129	51 Å²	51	68%	0.675	28%	0.279	S	S	*	.	H	α-helix	trans	-65.6	-43.8	179.6	-66.6	174.8	0	0	0	112	C176 L180 I181 D182	C176-L178 VanDerWaalsContact C-N 3.28Å; C176-L178 PolarHBondContact O-N 2.98Å; L178-L180 VanDerWaalsContact C-N 3.31Å; L178-L180 PolarHBondContact O-N 2.93Å; L178-I181 PolarHBondContact O-N 2.97Å; L178-D182 PolarHBondContact O-N 3.04Å
179	E	92.9	Very high	91.7	Very high	49 Å²	49	46.3 Å²	46.3	23%	0.229	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-41.1	177.3	-72.3	175.1	149.3	0	0	111.6	R141 L175 C176 Y183	R141-E179 WeakPolarHBondContact CG-OE1 3.29Å; R141-E179 IonicContact CZ-OE2 2.67Å; R141-E179 IonicContact NE-OE1 2.68Å; R141-E179 PolarHBondContact NE-OE1 3.04Å; R141-E179 IonicContact NE-OE2 3.84Å; R141-E179 PolarHBondContact NE-OE2 2.93Å; R141-E179 IonicContact NH2-OE2 2.82Å; R141-E179 PolarHBondContact NH2-OE2 3.48Å; L175-E179 HydrophobicContact CB-CB 4.37Å; L175-E179 HydrophobicContact CD2-CB 3.84Å; C176-E179 PolarHBondContact N-OE2 3.42Å; C176-E179 PolarHBondContact O-N 3.48Å; C176-E179 VanDerWaalsContact O-N 3.16Å; C176-E179 WeakPolarHBondContact SG-CG 3.35Å; E179-Y183 VanDerWaalsContact O-CB 3.28Å; E179-Y183 WeakPolarHBondContact O-CB 3.34Å; E179-Y183 PolarHBondContact O-N 3.44Å
180	L	94.8	Very high	91.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.9	-41.6	178.5	-173.3	68.3	0	0	0	112.3	L172 L175 C176 A177 L178 D182 Y183 L184 W203 L218	L172-L180 HydrophobicContact CD1-CD1 3.99Å; L172-L180 HydrophobicContact CG-CD1 4.46Å; L175-L180 HydrophobicContact CB-CB 4.35Å; L175-L180 HydrophobicContact CD1-CB 4.44Å; L175-L180 HydrophobicContact CD1-CD1 3.86Å; C176-L180 PolarHBondContact O-N 3.32Å; C176-L180 VanDerWaalsContact O-N 3.09Å; A177-L180 PolarHBondContact O-N 3.13Å; L178-L180 VanDerWaalsContact C-N 3.31Å; L178-L180 PolarHBondContact O-N 2.93Å; L180-D182 VanDerWaalsContact C-N 3.29Å; L180-D182 PolarHBondContact O-N 3.38Å; L180-Y183 PolarHBondContact O-N 2.93Å; L180-L184 HydrophobicContact CD1-CD1 3.92Å; L180-L184 HydrophobicContact CD1-CD2 4.24Å; L180-L184 HydrophobicContact CD1-CG 3.83Å; L180-L184 HydrophobicContact CD2-CD1 4.36Å; L180-L184 HydrophobicContact CG-CD1 3.89Å; L180-L184 HydrophobicContact CG-CG 4.08Å; L180-L184 WeakPolarHBondContact O-CB 3.47Å; L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.31Å; L180-W203 HydrophobicContact CD2-CB 3.76Å; L180-W203 HydrophobicContact CD2-CD2 3.35Å; L180-W203 HydrophobicContact CD2-CE3 3.67Å; L180-W203 HydrophobicContact CD2-CG 3.39Å; L180-W203 HydrophobicContact CD2-CZ3 4.42Å; L180-L218 HydrophobicContact CB-CD2 4.28Å; L180-L218 HydrophobicContact CD2-CD1 4.08Å; L180-L218 HydrophobicContact CD2-CD2 3.71Å; L180-L218 HydrophobicContact CG-CD2 3.83Å
181	I	94	Very high	91.2	Very high	29 Å²	29	41.9 Å²	41.9	15%	0.149	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-42.9	176.7	-73.2	168	0	0	0	110.7	A177 L178 G185 D217 L218 K221	A177-I181 WeakPolarHBondContact O-CB 3.43Å; A177-I181 WeakPolarHBondContact O-CD1 3.4Å; A177-I181 WeakPolarHBondContact O-CG1 3.37Å; A177-I181 PolarHBondContact O-N 2.88Å; L178-I181 PolarHBondContact O-N 2.97Å; I181-G185 WeakPolarHBondContact O-CA 3.49Å; I181-G185 PolarHBondContact O-N 2.92Å; I181-D217 HydrophobicContact CD1-CB 4.23Å; I181-L218 HydrophobicContact CG1-CD2 3.56Å; I181-L218 HydrophobicContact CG1-CG 4.09Å; I181-K221 VanDerWaalsContact CG2-CE 3.45Å
182	D	92.2	Very high	90.9	Very high	110 Å²	110	42.6 Å²	42.6	59%	0.588	23%	0.231	S	C	*	.	H	α-helix	trans	-67	-44	177	-75.4	-9.9	0	0	0	111.2	L178 L180 G185 D186	L178-D182 PolarHBondContact O-N 3.04Å; L180-D182 VanDerWaalsContact C-N 3.29Å; L180-D182 PolarHBondContact O-N 3.38Å; D182-G185 PolarHBondContact O-N 3.45Å; D182-D186 PolarHBondContact O-N 3.26Å
183	Y	93.6	Very high	90.7	Very high	19 Å²	19	43 Å²	43	8%	0.075	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-50.5	-178.5	-178.9	-128.5	0	0	0	112.9	L137 A159 L160 F163 V166 L172 E179 L180 G185 D186 L189	L137-Y183 HydrophobicContact CD2-CE1 4.43Å; A159-Y183 HydrophobicContact CB-CE2 3.85Å; A159-Y183 PolarHBondContact O-OH 2.72Å; L160-Y183 HydrophobicContact CD2-CD2 4.24Å; L160-Y183 HydrophobicContact CD2-CE2 4.07Å; F163-Y183 AromaticContact CD2-CE1 3.87Å; F163-Y183 HydrophobicContact CD2-CE1 3.87Å; F163-Y183 AromaticContact CD2-CZ 3.85Å; F163-Y183 WeakPolarHBondContact CD2-OH 3.14Å; F163-Y183 AromaticContact CE2-CE1 3.98Å; F163-Y183 HydrophobicContact CE2-CE1 3.98Å; V166-Y183 HydrophobicContact CG1-CE1 4.1Å; V166-Y183 WeakPolarHBondContact CG1-OH 3.25Å; L172-Y183 HydrophobicContact CD1-CD1 4.33Å; L172-Y183 HydrophobicContact CD1-CE1 4.12Å; E179-Y183 VanDerWaalsContact O-CB 3.28Å; E179-Y183 WeakPolarHBondContact O-CB 3.34Å; E179-Y183 PolarHBondContact O-N 3.44Å; L180-Y183 PolarHBondContact O-N 2.93Å; Y183-G185 PolarHBondContact O-N 3.14Å; Y183-D186 WeakPolarHBondContact O-CB 3.5Å; Y183-D186 PolarHBondContact O-N 3.41Å; Y183-L189 HydrophobicContact CD2-CD1 4.2Å; Y183-L189 HydrophobicContact CE1-CD1 4.43Å; Y183-L189 HydrophobicContact CE2-CD1 3.69Å
184	L	92.9	Very high	90.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70	-25.4	178.5	-60.6	-174.8	0	0	0	112.3	F163 L180 D186 V196 L200 L218 K221 R279	F163-L184 HydrophobicContact CE2-CD2 3.8Å; F163-L184 HydrophobicContact CZ-CD2 4.06Å; L180-L184 HydrophobicContact CD1-CD1 3.92Å; L180-L184 HydrophobicContact CD1-CD2 4.24Å; L180-L184 HydrophobicContact CD1-CG 3.83Å; L180-L184 HydrophobicContact CD2-CD1 4.36Å; L180-L184 HydrophobicContact CG-CD1 3.89Å; L180-L184 HydrophobicContact CG-CG 4.08Å; L180-L184 WeakPolarHBondContact O-CB 3.47Å; L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.31Å; L184-D186 VanDerWaalsContact C-N 3.3Å; L184-V196 HydrophobicContact CB-CG1 4.32Å; L184-V196 HydrophobicContact CD1-CG1 4.5Å; L184-V196 HydrophobicContact CD2-CG1 4.21Å; L184-L200 HydrophobicContact CD1-CB 4.03Å; L184-L218 HydrophobicContact CD1-CD2 4.33Å; L184-K221 HydrophobicContact CB-CB 4.26Å; L184-R279 PolarHBondContact O-NH1 2.71Å; L184-R279 PolarHBondContact O-NH2 3.01Å
185	G	90.2	Very high	90.5	Very high	24 Å²	24	39.1 Å²	39.1	25%	0.247	21%	0.213	C	C	.	.	H	α-helix	trans	-75.9	-12.6	176.6	0	0	0	0	0	114.9	I181 D182 Y183	I181-G185 WeakPolarHBondContact O-CA 3.49Å; I181-G185 PolarHBondContact O-N 2.92Å; D182-G185 PolarHBondContact O-N 3.45Å; Y183-G185 PolarHBondContact O-N 3.14Å
186	D	90	Very high	90.5	Very high	28 Å²	28	38.7 Å²	38.7	15%	0.15	21%	0.21	C	C	.	.			trans	-70.5	130.8	-175	-158.8	-53.2	0	0	0	112.3	K156 L160 D182 Y183 L184 E188 L189 R279	K156-D186 WeakPolarHBondContact CE-OD2 3.4Å; K156-D186 IonicContact NZ-OD2 3.56Å; K156-D186 PolarHBondContact NZ-OD2 3.03Å; L160-D186 HydrophobicContact CD2-CB 3.69Å; D182-D186 PolarHBondContact O-N 3.26Å; Y183-D186 WeakPolarHBondContact O-CB 3.5Å; Y183-D186 PolarHBondContact O-N 3.41Å; L184-D186 VanDerWaalsContact C-N 3.3Å; D186-E188 VanDerWaalsContact C-N 3.27Å; D186-E188 PolarHBondContact O-N 3.27Å; D186-E188 WeakPolarHBondContact OD1-CB 3.42Å; D186-E188 PolarHBondContact OD1-N 3.46Å; D186-L189 PolarHBondContact O-N 3.37Å; D186-R279 PolarHBondContact O-NH1 3.16Å
187	D	88.3	Confident	90.6	Very high	79 Å²	79	36.2 Å²	36.2	42%	0.422	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-23.1	-179.9	-79	-38.3	0	0	0	113.2	L189 R223 R279 Y280	D187-L189 VanDerWaalsContact C-N 3.33Å; D187-R223 IonicContact OD1-CZ 3.24Å; D187-R223 IonicContact OD1-NH1 3.83Å; D187-R223 PolarHBondContact OD1-NH1 3.45Å; D187-R223 IonicContact OD1-NH2 2.71Å; D187-R223 PolarHBondContact OD1-NH2 3.37Å; D187-R279 CarbonylContact O-C 3.57Å; D187-R279 VanDerWaalsContact O-CA 3.25Å; D187-R279 WeakPolarHBondContact O-CA 3.26Å; D187-R279 WeakPolarHBondContact O-CB 3.18Å; D187-Y280 PolarHBondContact O-N 2.82Å
188	E	87.4	Confident	90.6	Very high	118 Å²	118	40.2 Å²	40.2	55%	0.551	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-2.8	-178.2	-67.9	-174.4	170.3	0	0	113.4	L160 D186 C190	L160-E188 HydrophobicContact CD1-CB 3.84Å; D186-E188 VanDerWaalsContact C-N 3.27Å; D186-E188 PolarHBondContact O-N 3.27Å; D186-E188 WeakPolarHBondContact OD1-CB 3.42Å; D186-E188 PolarHBondContact OD1-N 3.46Å; E188-C190 PolarHBondContact O-N 3.17Å
189	L	89.1	Confident	90.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.			trans	-59.8	127	-179.8	-164.6	85.7	0	0	0	111.3	L160 F163 Y183 D186 D187 G191 V196 R279 S281	L160-L189 HydrophobicContact CD2-CB 4.17Å; L160-L189 HydrophobicContact CD2-CD1 3.74Å; F163-L189 HydrophobicContact CB-CD1 3.91Å; F163-L189 HydrophobicContact CB-CG 3.95Å; F163-L189 HydrophobicContact CD1-CD2 4.01Å; F163-L189 HydrophobicContact CD1-CG 4.29Å; F163-L189 HydrophobicContact CD2-CD1 3.49Å; F163-L189 VanDerWaalsContact CD2-CD1 3.49Å; F163-L189 HydrophobicContact CD2-CD2 3.8Å; F163-L189 HydrophobicContact CD2-CG 3.88Å; F163-L189 HydrophobicContact CE1-CD2 4.09Å; F163-L189 HydrophobicContact CE2-CD1 4.18Å; F163-L189 HydrophobicContact CE2-CD2 3.89Å; F163-L189 HydrophobicContact CE2-CG 4.46Å; F163-L189 HydrophobicContact CG-CD1 3.79Å; F163-L189 HydrophobicContact CG-CD2 3.83Å; F163-L189 HydrophobicContact CG-CG 3.75Å; F163-L189 HydrophobicContact CZ-CD2 4.03Å; Y183-L189 HydrophobicContact CD2-CD1 4.2Å; Y183-L189 HydrophobicContact CE1-CD1 4.43Å; Y183-L189 HydrophobicContact CE2-CD1 3.69Å; D186-L189 PolarHBondContact O-N 3.37Å; D187-L189 VanDerWaalsContact C-N 3.33Å; L189-G191 PolarHBondContact O-N 2.94Å; L189-V196 HydrophobicContact CD2-CG2 3.73Å; L189-R279 VanDerWaalsContact O-CD 3.29Å; L189-R279 WeakPolarHBondContact O-CD 3.45Å; L189-S281 PolarHBondContact O-OG 3.43Å
190	C	86.3	Confident	90.8	Very high	34 Å²	34	31.9 Å²	31.9	23%	0.23	17%	0.167	C	C	.	.			trans	-94.5	74.3	179.2	-68.3	0	0	0	0	111.1	L160 K161 E188 S281	L160-C190 WeakPolarHBondContact O-CB 3.2Å; L160-C190 PolarHBondContact O-N 3.32Å; K161-C190 WeakPolarHBondContact O-CB 3.26Å; E188-C190 PolarHBondContact O-N 3.17Å; C190-S281 WeakPolarHBondContact SG-CB 3.44Å
191	G	83.8	Confident	90.8	Very high	4 Å²	4	32.2 Å²	32.2	4%	0.041	17%	0.169	C	C	.	.	S	Bend	trans	-150.3	156.2	178.9	0	0	0	0	0	112.9	L189	L189-G191 PolarHBondContact O-N 2.94Å
192	E	85.5	Confident	90.8	Very high	42 Å²	42	34 Å²	34	20%	0.196	18%	0.181	C	C	.	.			trans	-71.4	146.6	167.1	-63.5	-175.6	131.7	0	0	109.8	E194 Q195 V196 K359 Y576	E192-E194 WeakPolarHBondContact CB-OE2 3.21Å; E192-E194 PolarHBondContact O-N 2.98Å; E192-Q195 HydrophobicContact CB-CG 4.37Å; E192-Q195 WeakPolarHBondContact O-CB 3.41Å; E192-Q195 PolarHBondContact O-N 2.85Å; E192-V196 WeakPolarHBondContact O-CG2 3.47Å; E192-V196 PolarHBondContact O-N 3.4Å; E192-V196 VanDerWaalsContact O-N 3.14Å; E192-K359 IonicContact OE2-NZ 3.55Å; E192-K359 PolarHBondContact OE2-NZ 2.85Å; E192-Y576 PolarHBondContact OE1-OH 3.29Å; E192-Y576 PolarHBondContact OE2-OH 3.5Å
193	E	89.3	Confident	91	Very high	9 Å²	9	29 Å²	29	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-66.3	-25	-178.7	-68	-64.8	152.1	0	0	112.4	Q195 V196 F197 R223 V227 R279	E193-Q195 VanDerWaalsContact C-N 3.34Å; E193-V196 PolarHBondContact O-N 3.08Å; E193-F197 PolarHBondContact O-N 3.03Å; E193-R223 HydrophobicContact CG-CB 4.04Å; E193-R223 WeakPolarHBondContact OE1-CD 3.33Å; E193-R223 IonicContact OE1-NE 3.11Å; E193-R223 PolarHBondContact OE2-N 3.13Å; E193-V227 HydrophobicContact CB-CG2 3.51Å; E193-R279 WeakPolarHBondContact OE1-CD 3.41Å; E193-R279 IonicContact OE1-CZ 3.07Å; E193-R279 IonicContact OE1-NE 3.32Å; E193-R279 PolarHBondContact OE1-NE 3.33Å; E193-R279 IonicContact OE1-NH2 3.37Å; E193-R279 IonicContact OE2-NH2 3.57Å
194	E	89.6	Confident	91.1	Very high	30 Å²	30	28 Å²	28	14%	0.14	15%	0.15	C	C	.	.	H	α-helix	trans	-58	-46.1	169.1	-66.2	82.1	175	0	0	111.2	E192 V196 F197 E198 V227 H228 F231	E192-E194 WeakPolarHBondContact CB-OE2 3.21Å; E192-E194 PolarHBondContact O-N 2.98Å; E194-V196 VanDerWaalsContact C-N 3.34Å; E194-V196 PolarHBondContact O-N 3.47Å; E194-F197 WeakPolarHBondContact O-CB 3.32Å; E194-F197 PolarHBondContact O-N 2.72Å; E194-E198 WeakPolarHBondContact O-CG 3.36Å; E194-E198 PolarHBondContact O-N 3Å; E194-V227 HydrophobicContact CG-CG1 4.18Å; E194-H228 WeakPolarHBondContact OE1-CB 3.25Å; E194-H228 PolarHBondContact OE1-N 2.97Å; E194-F231 HydrophobicContact CB-CD1 4.19Å; E194-F231 HydrophobicContact CB-CE1 4.06Å; E194-F231 HydrophobicContact CB-CE2 4.41Å; E194-F231 HydrophobicContact CB-CG 4.41Å; E194-F231 HydrophobicContact CB-CZ 4.17Å; E194-F231 HydrophobicContact CG-CB 4.04Å; E194-F231 HydrophobicContact CG-CD1 3.66Å; E194-F231 HydrophobicContact CG-CD2 4.09Å; E194-F231 HydrophobicContact CG-CE1 4.06Å; E194-F231 HydrophobicContact CG-CE2 4.45Å; E194-F231 HydrophobicContact CG-CG 3.66Å; E194-F231 HydrophobicContact CG-CZ 4.44Å
195	Q	90.1	Very high	91.1	Very high	33 Å²	33	34.7 Å²	34.7	15%	0.154	18%	0.175	C	C	.	.	H	α-helix	trans	-68.9	-34.8	178.9	-65.2	178.2	-42.8	0	0	111.5	F163 E192 E193 F197 E198 A199	F163-Q195 HydrophobicContact CE1-CB 3.95Å; E192-Q195 HydrophobicContact CB-CG 4.37Å; E192-Q195 WeakPolarHBondContact O-CB 3.41Å; E192-Q195 PolarHBondContact O-N 2.85Å; E193-Q195 VanDerWaalsContact C-N 3.34Å; Q195-F197 VanDerWaalsContact C-N 3.33Å; Q195-E198 PolarHBondContact O-N 3.08Å; Q195-A199 VanDerWaalsContact O-CB 3.28Å; Q195-A199 WeakPolarHBondContact O-CB 3.36Å; Q195-A199 PolarHBondContact O-N 3.14Å
196	V	93.3	Very high	91.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-43.8	173.7	178.6	0	0	0	0	110.5	F163 L184 L189 E192 E193 E194 L200 V222	F163-V196 HydrophobicContact CE1-CG2 3.75Å; F163-V196 HydrophobicContact CZ-CB 4.44Å; F163-V196 HydrophobicContact CZ-CG2 3.97Å; L184-V196 HydrophobicContact CB-CG1 4.32Å; L184-V196 HydrophobicContact CD1-CG1 4.5Å; L184-V196 HydrophobicContact CD2-CG1 4.21Å; L189-V196 HydrophobicContact CD2-CG2 3.73Å; E192-V196 WeakPolarHBondContact O-CG2 3.47Å; E192-V196 PolarHBondContact O-N 3.4Å; E192-V196 VanDerWaalsContact O-N 3.14Å; E193-V196 PolarHBondContact O-N 3.08Å; E194-V196 VanDerWaalsContact C-N 3.34Å; E194-V196 PolarHBondContact O-N 3.47Å; V196-L200 WeakPolarHBondContact O-CB 3.38Å; V196-L200 PolarHBondContact O-N 3.36Å; V196-L200 VanDerWaalsContact O-N 3.08Å; V196-V222 HydrophobicContact CG1-CG2 4.2Å
197	F	94.4	Very high	91.4	Very high	11 Å²	11	40.2 Å²	40.2	5%	0.048	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-45.4	174.6	177.2	-98.2	0	0	0	111.9	E193 E194 Q195 A199 L200 M201 F219 V222 F231 I236 V242	E193-F197 PolarHBondContact O-N 3.03Å; E194-F197 WeakPolarHBondContact O-CB 3.32Å; E194-F197 PolarHBondContact O-N 2.72Å; Q195-F197 VanDerWaalsContact C-N 3.33Å; F197-A199 PolarHBondContact O-N 2.79Å; F197-L200 WeakPolarHBondContact O-CB 3.41Å; F197-L200 PolarHBondContact O-N 3.19Å; F197-M201 HydrophobicContact CD1-CG 4.18Å; F197-M201 HydrophobicContact CD2-CG 4.42Å; F197-M201 HydrophobicContact CE1-CG 3.69Å; F197-M201 HydrophobicContact CE2-CG 3.94Å; F197-M201 HydrophobicContact CE2-SD 4.05Å; F197-M201 HydrophobicContact CZ-CG 3.56Å; F197-M201 HydrophobicContact CZ-SD 3.9Å; F197-M201 WeakPolarHBondContact O-CG 3.28Å; F197-M201 PolarHBondContact O-N 3.02Å; F197-F219 HydrophobicContact CD2-CD2 4.24Å; F197-F219 AromaticContact CD2-CE2 3.99Å; F197-F219 HydrophobicContact CD2-CE2 3.99Å; F197-F219 HydrophobicContact CE2-CD2 4.1Å; F197-F219 AromaticContact CE2-CE2 3.76Å; F197-F219 HydrophobicContact CE2-CE2 3.76Å; F197-V222 HydrophobicContact CB-CG1 4.1Å; F197-V222 HydrophobicContact CB-CG2 4.34Å; F197-V222 HydrophobicContact CD2-CG2 4.46Å; F197-F231 AromaticContact CD1-CE1 3.83Å; F197-F231 HydrophobicContact CD1-CE1 3.83Å; F197-F231 HydrophobicContact CD1-CZ 4.17Å; F197-F231 HydrophobicContact CG-CE1 4.49Å; F197-I236 HydrophobicContact CB-CD1 4.38Å; F197-I236 HydrophobicContact CD1-CD1 4.17Å; F197-I236 HydrophobicContact CD1-CG1 3.83Å; F197-I236 HydrophobicContact CD2-CD1 4.12Å; F197-I236 HydrophobicContact CD2-CG1 4.25Å; F197-I236 HydrophobicContact CD2-CG2 4.32Å; F197-I236 HydrophobicContact CE1-CB 4.43Å; F197-I236 HydrophobicContact CE1-CG1 3.77Å; F197-I236 HydrophobicContact CE2-CB 4.46Å; F197-I236 HydrophobicContact CE2-CG1 4.22Å; F197-I236 HydrophobicContact CE2-CG2 3.8Å; F197-I236 HydrophobicContact CG-CD1 3.94Å; F197-I236 HydrophobicContact CG-CG1 4.07Å; F197-I236 HydrophobicContact CZ-CB 4.2Å; F197-I236 HydrophobicContact CZ-CG1 3.97Å; F197-I236 HydrophobicContact CZ-CG2 3.95Å; F197-V242 HydrophobicContact CE2-CG2 4.04Å; F197-V242 HydrophobicContact CZ-CG2 4.09Å
198	E	93.8	Very high	91.6	Very high	97 Å²	97	40.2 Å²	40.2	45%	0.453	20%	0.195	S	C	.	.	H	α-helix	trans	-59.6	-47.2	177.3	-73.2	172.3	174.7	0	0	111.8	E194 Q195 L200 M201 V202 F231	E194-E198 WeakPolarHBondContact O-CG 3.36Å; E194-E198 PolarHBondContact O-N 3Å; Q195-E198 PolarHBondContact O-N 3.08Å; E198-L200 VanDerWaalsContact C-N 3.33Å; E198-L200 PolarHBondContact O-N 2.93Å; E198-M201 PolarHBondContact O-N 2.91Å; E198-M201 VanDerWaalsContact O-N 3.08Å; E198-V202 WeakPolarHBondContact O-CG2 3.34Å; E198-V202 PolarHBondContact O-N 3.05Å; E198-F231 HydrophobicContact CG-CZ 4.15Å
199	A	94.5	Very high	91.8	Very high	3 Å²	3	42.8 Å²	42.8	3%	0.025	21%	0.207	C	C	.	.	H	α-helix	trans	-58.5	-43.9	177.4	0	0	0	0	0	112.1	F163 A167 L172 Q195 F197 M201 V202 W203	F163-A199 HydrophobicContact CE2-CB 4.42Å; F163-A199 HydrophobicContact CZ-CB 3.89Å; A167-A199 HydrophobicContact CB-CB 3.93Å; L172-A199 HydrophobicContact CD2-CB 3.97Å; Q195-A199 VanDerWaalsContact O-CB 3.28Å; Q195-A199 WeakPolarHBondContact O-CB 3.36Å; Q195-A199 PolarHBondContact O-N 3.14Å; F197-A199 PolarHBondContact O-N 2.79Å; A199-M201 VanDerWaalsContact C-N 3.34Å; A199-M201 PolarHBondContact O-N 2.88Å; A199-V202 PolarHBondContact O-N 3.5Å; A199-W203 PolarHBondContact O-N 3.28Å
200	L	95.1	Very high	91.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-46.9	173.1	170.8	162.9	0	0	0	111.3	L184 V196 F197 E198 W203 I204 L218 V222	L184-L200 HydrophobicContact CD1-CB 4.03Å; V196-L200 WeakPolarHBondContact O-CB 3.38Å; V196-L200 PolarHBondContact O-N 3.36Å; V196-L200 VanDerWaalsContact O-N 3.08Å; F197-L200 WeakPolarHBondContact O-CB 3.41Å; F197-L200 PolarHBondContact O-N 3.19Å; E198-L200 VanDerWaalsContact C-N 3.33Å; E198-L200 PolarHBondContact O-N 2.93Å; L200-W203 PolarHBondContact O-N 2.83Å; L200-I204 HydrophobicContact CD2-CD1 3.65Å; L200-I204 HydrophobicContact CG-CD1 4.25Å; L200-I204 WeakPolarHBondContact O-CG1 3.34Å; L200-I204 PolarHBondContact O-N 2.87Å; L200-L218 HydrophobicContact CD1-CB 3.41Å; L200-L218 VanDerWaalsContact CD1-CB 3.41Å; L200-L218 WeakPolarHBondContact CD1-O 3.25Å; L200-L218 HydrophobicContact CG-CB 3.87Å; L200-L218 HydrophobicContact CG-CD1 4.47Å; L200-V222 HydrophobicContact CD1-CG2 3.88Å
201	M	94.1	Very high	92.3	Very high	7 Å²	7	45.7 Å²	45.7	3%	0.034	23%	0.226	C	C	.	.	H	α-helix	trans	-69.7	-36.7	-178.4	-67.1	-56.5	-64.8	0	0	112.2	F197 E198 A199 W203 I204 R205 D239 L241	F197-M201 HydrophobicContact CD1-CG 4.18Å; F197-M201 HydrophobicContact CD2-CG 4.42Å; F197-M201 HydrophobicContact CE1-CG 3.69Å; F197-M201 HydrophobicContact CE2-CG 3.94Å; F197-M201 HydrophobicContact CE2-SD 4.05Å; F197-M201 HydrophobicContact CZ-CG 3.56Å; F197-M201 HydrophobicContact CZ-SD 3.9Å; F197-M201 WeakPolarHBondContact O-CG 3.28Å; F197-M201 PolarHBondContact O-N 3.02Å; E198-M201 PolarHBondContact O-N 2.91Å; E198-M201 VanDerWaalsContact O-N 3.08Å; A199-M201 VanDerWaalsContact C-N 3.34Å; A199-M201 PolarHBondContact O-N 2.88Å; M201-W203 VanDerWaalsContact C-N 3.34Å; M201-I204 PolarHBondContact O-N 3.2Å; M201-R205 VanDerWaalsContact O-CB 3.26Å; M201-R205 WeakPolarHBondContact O-CB 3.43Å; M201-R205 WeakPolarHBondContact O-CG 3.32Å; M201-R205 PolarHBondContact O-N 2.79Å; M201-D239 WeakPolarHBondContact CE-OD1 3.46Å; M201-D239 WeakPolarHBondContact CE-OD2 3.4Å; M201-L241 HydrophobicContact CE-CB 4.32Å; M201-L241 HydrophobicContact CE-CD1 3.79Å
202	V	94.8	Very high	92.6	Very high	65 Å²	65	50.6 Å²	50.6	39%	0.394	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-45.9	173.2	168.8	0	0	0	0	110.4	K173 E198 A199 R205 H206	K173-V202 HydrophobicContact CG-CG1 4.36Å; E198-V202 WeakPolarHBondContact O-CG2 3.34Å; E198-V202 PolarHBondContact O-N 3.05Å; A199-V202 PolarHBondContact O-N 3.5Å; V202-R205 PolarHBondContact O-N 3.47Å; V202-H206 PolarHBondContact O-N 3.41Å; V202-H206 VanDerWaalsContact O-N 3.14Å
203	W	96.1	Very high	92.8	Very high	5 Å²	5	50.9 Å²	50.9	2%	0.019	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-42.4	178.8	-178	89.4	0	0	0	113.2	L175 A177 L180 A199 L200 M201 R211 Y214 L218	L175-W203 PolarHBondContact O-NE1 3.01Å; A177-W203 HydrophobicContact CB-CH2 3.85Å; A177-W203 HydrophobicContact CB-CZ2 4.27Å; L180-W203 HydrophobicContact CD2-CB 3.76Å; L180-W203 HydrophobicContact CD2-CD2 3.35Å; L180-W203 HydrophobicContact CD2-CE3 3.67Å; L180-W203 HydrophobicContact CD2-CG 3.39Å; L180-W203 HydrophobicContact CD2-CZ3 4.42Å; A199-W203 PolarHBondContact O-N 3.28Å; L200-W203 PolarHBondContact O-N 2.83Å; M201-W203 VanDerWaalsContact C-N 3.34Å; W203-R211 VanDerWaalsContact CD1-NH1 3.31Å; W203-R211 HydrophobicContact CE3-CB 4.25Å; W203-R211 HydrophobicContact CE3-CG 4.41Å; W203-R211 HydrophobicContact CH2-CB 3.98Å; W203-R211 HydrophobicContact CH2-CG 3.69Å; W203-R211 HydrophobicContact CZ2-CG 4.12Å; W203-R211 HydrophobicContact CZ3-CB 3.67Å; W203-R211 HydrophobicContact CZ3-CG 3.86Å; W203-R211 WeakPolarHBondContact O-CD 3.26Å; W203-R211 PolarHBondContact O-NH1 3.32Å; W203-Y214 HydrophobicContact CH2-CD2 4.2Å; W203-L218 HydrophobicContact CE3-CD1 3.75Å; W203-L218 HydrophobicContact CZ3-CD1 3.61Å
204	I	94	Very high	93	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-44.5	177.7	-67.1	175.7	0	0	0	110.5	L200 M201 H206 D207 L208 I215 L218 L241	L200-I204 HydrophobicContact CD2-CD1 3.65Å; L200-I204 HydrophobicContact CG-CD1 4.25Å; L200-I204 WeakPolarHBondContact O-CG1 3.34Å; L200-I204 PolarHBondContact O-N 2.87Å; M201-I204 PolarHBondContact O-N 3.2Å; I204-H206 PolarHBondContact O-N 2.71Å; I204-D207 CarbonylContact O-C 3.51Å; I204-D207 PolarHBondContact O-N 2.63Å; I204-L208 HydrophobicContact CG2-CD2 4.11Å; I204-L208 WeakPolarHBondContact O-CA 3.36Å; I204-L208 PolarHBondContact O-N 2.83Å; I204-I215 HydrophobicContact CD1-CB 3.86Å; I204-I215 HydrophobicContact CD1-CD1 4.26Å; I204-I215 HydrophobicContact CD1-CG1 3.8Å; I204-L218 HydrophobicContact CD1-CD1 4.22Å; I204-L218 HydrophobicContact CG1-CD1 4.21Å; I204-L241 HydrophobicContact CG2-CD1 4.26Å
205	R	94.1	Very high	93.1	Very high	140 Å²	140	54.6 Å²	54.6	53%	0.528	28%	0.276	S	S	.	.	H	α-helix	trans	-70	-19.2	-176.5	-71.2	173.8	-178.1	-179.5	2.9	113.7	M201 V202 D207 L208 D239 L241	M201-R205 VanDerWaalsContact O-CB 3.26Å; M201-R205 WeakPolarHBondContact O-CB 3.43Å; M201-R205 WeakPolarHBondContact O-CG 3.32Å; M201-R205 PolarHBondContact O-N 2.79Å; V202-R205 PolarHBondContact O-N 3.47Å; R205-D207 VanDerWaalsContact C-N 3.31Å; R205-D207 PolarHBondContact O-N 2.61Å; R205-L208 HydrophobicContact CG-CD2 4.23Å; R205-D239 IonicContact CZ-OD2 3.81Å; R205-D239 IonicContact NH2-OD2 3.71Å; R205-D239 PolarHBondContact NH2-OD2 3.33Å; R205-L241 HydrophobicContact CG-CD1 4.45Å
206	H	93.8	Very high	93.1	Very high	100 Å²	100	56.6 Å²	56.6	46%	0.463	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-34.6	174.7	-177.6	-103.7	0	0	0	113	V202 I204	V202-H206 PolarHBondContact O-N 3.41Å; V202-H206 VanDerWaalsContact O-N 3.14Å; I204-H206 PolarHBondContact O-N 2.71Å
207	D	93	Very high	93	Very high	67 Å²	67	59.5 Å²	59.5	36%	0.358	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.6	78.1	176.5	177.9	3.1	0	0	0	109.3	I204 R205 E209 A210 R211	I204-D207 CarbonylContact O-C 3.51Å; I204-D207 PolarHBondContact O-N 2.63Å; R205-D207 VanDerWaalsContact C-N 3.31Å; R205-D207 PolarHBondContact O-N 2.61Å; D207-E209 VanDerWaalsContact C-N 3.3Å; D207-E209 PolarHBondContact O-N 3.31Å; D207-A210 PolarHBondContact OD1-N 2.93Å; D207-A210 WeakPolarHBondContact OD2-CB 3.39Å; D207-R211 HydrophobicContact CB-CG 4.15Å; D207-R211 WeakPolarHBondContact O-CB 3.19Å; D207-R211 WeakPolarHBondContact O-CG 3.46Å; D207-R211 PolarHBondContact O-N 3.23Å
208	L	91.6	Very high	92.9	Very high	79 Å²	79	59 Å²	59	41%	0.414	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-39.5	-172.5	-78.1	164.4	0	0	0	112.7	I204 R205 Q212 L241	I204-L208 HydrophobicContact CG2-CD2 4.11Å; I204-L208 WeakPolarHBondContact O-CA 3.36Å; I204-L208 PolarHBondContact O-N 2.83Å; R205-L208 HydrophobicContact CG-CD2 4.23Å; L208-Q212 VanDerWaalsContact O-CB 3.24Å; L208-Q212 WeakPolarHBondContact O-CB 3.46Å; L208-Q212 VanDerWaalsContact O-CG 3.26Å; L208-Q212 WeakPolarHBondContact O-CG 3.44Å; L208-Q212 PolarHBondContact O-N 3.49Å; L208-Q212 VanDerWaalsContact O-N 3.11Å; L208-L241 HydrophobicContact CD2-CD1 3.77Å; L208-L241 HydrophobicContact CD2-CD2 4.29Å
209	E	91.2	Very high	92.8	Very high	173 Å²	173	54.4 Å²	54.4	81%	0.808	28%	0.278	S	S	*	.	H	α-helix	trans	-64.8	-47.9	-174	-66.7	-173.4	175.9	0	0	111.1	D207 Q212	D207-E209 VanDerWaalsContact C-N 3.3Å; D207-E209 PolarHBondContact O-N 3.31Å; E209-Q212 PolarHBondContact O-NE2 3.44Å
210	A	92.4	Very high	92.6	Very high	62 Å²	62	59.9 Å²	59.9	51%	0.512	30%	0.301	S	S	.	.	H	α-helix	trans	-80.9	-29	-179.7	0	0	0	0	0	113.3	D207	D207-A210 PolarHBondContact OD1-N 2.93Å; D207-A210 WeakPolarHBondContact OD2-CB 3.39Å
211	R	93.7	Very high	92.4	Very high	32 Å²	32	63.4 Å²	63.4	12%	0.121	32%	0.316	C	S	.	.	H	α-helix	trans	-100.8	-19.1	-166.5	-60	177.9	-177.6	-170.5	-2.9	115.4	K173 W203 D207 G213 Y214	K173-R211 VanDerWaalsContact O-CZ 3.31Å; K173-R211 PolarHBondContact O-NH1 2.88Å; K173-R211 PolarHBondContact O-NH2 3.09Å; W203-R211 VanDerWaalsContact CD1-NH1 3.31Å; W203-R211 HydrophobicContact CE3-CB 4.25Å; W203-R211 HydrophobicContact CE3-CG 4.41Å; W203-R211 HydrophobicContact CH2-CB 3.98Å; W203-R211 HydrophobicContact CH2-CG 3.69Å; W203-R211 HydrophobicContact CZ2-CG 4.12Å; W203-R211 HydrophobicContact CZ3-CB 3.67Å; W203-R211 HydrophobicContact CZ3-CG 3.86Å; W203-R211 WeakPolarHBondContact O-CD 3.26Å; W203-R211 PolarHBondContact O-NH1 3.32Å; D207-R211 HydrophobicContact CB-CG 4.15Å; D207-R211 WeakPolarHBondContact O-CB 3.19Å; D207-R211 WeakPolarHBondContact O-CG 3.46Å; D207-R211 PolarHBondContact O-N 3.23Å; R211-G213 PolarHBondContact O-N 2.96Å; R211-G213 VanDerWaalsContact O-N 3.08Å; R211-Y214 PolarHBondContact O-N 3.5Å
212	Q	90.7	Very high	92.2	Very high	107 Å²	107	63.4 Å²	63.4	50%	0.5	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-54.3	-32.5	-177.9	62	-175.5	-41.6	0	0	113.9	L208 E209 Y214 I215	L208-Q212 VanDerWaalsContact O-CB 3.24Å; L208-Q212 WeakPolarHBondContact O-CB 3.46Å; L208-Q212 VanDerWaalsContact O-CG 3.26Å; L208-Q212 WeakPolarHBondContact O-CG 3.44Å; L208-Q212 PolarHBondContact O-N 3.49Å; L208-Q212 VanDerWaalsContact O-N 3.11Å; E209-Q212 PolarHBondContact O-NE2 3.44Å; Q212-Y214 PolarHBondContact O-N 2.85Å; Q212-I215 WeakPolarHBondContact O-CB 3.29Å; Q212-I215 WeakPolarHBondContact O-CG2 3.47Å; Q212-I215 PolarHBondContact O-N 3.03Å
213	G	90.4	Very high	91.9	Very high	48 Å²	48	61.2 Å²	61.2	50%	0.495	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-63.2	-23.7	179.6	0	0	0	0	0	114.2	R211	R211-G213 PolarHBondContact O-N 2.96Å; R211-G213 VanDerWaalsContact O-N 3.08Å
214	Y	92.5	Very high	91.4	Very high	106 Å²	106	61.5 Å²	61.5	42%	0.416	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-85.4	-6.8	-179	-62	-77.7	0	0	0	113.7	A177 W203 R211 Q212 Q216 D217 L218	A177-Y214 HydrophobicContact CB-CD1 3.59Å; A177-Y214 HydrophobicContact CB-CD2 4.07Å; A177-Y214 HydrophobicContact CB-CE1 3.55Å; A177-Y214 HydrophobicContact CB-CE2 4.05Å; A177-Y214 HydrophobicContact CB-CG 3.85Å; W203-Y214 HydrophobicContact CH2-CD2 4.2Å; R211-Y214 PolarHBondContact O-N 3.5Å; Q212-Y214 PolarHBondContact O-N 2.85Å; Y214-Q216 PolarHBondContact O-N 3.43Å; Y214-Q216 VanDerWaalsContact O-N 3.15Å; Y214-D217 PolarHBondContact O-N 3.25Å; Y214-L218 PolarHBondContact O-N 2.92Å
215	I	92.1	Very high	90.7	Very high	12 Å²	12	65.4 Å²	65.4	6%	0.062	32%	0.321	C	S	.	.	H	α-helix	trans	-55	-39.3	-176.2	-166.2	166.6	0	0	0	112.2	I204 Q212 D217 F219 L241 V242	I204-I215 HydrophobicContact CD1-CB 3.86Å; I204-I215 HydrophobicContact CD1-CD1 4.26Å; I204-I215 HydrophobicContact CD1-CG1 3.8Å; Q212-I215 WeakPolarHBondContact O-CB 3.29Å; Q212-I215 WeakPolarHBondContact O-CG2 3.47Å; Q212-I215 PolarHBondContact O-N 3.03Å; I215-D217 VanDerWaalsContact C-N 3.31Å; I215-D217 PolarHBondContact O-N 2.86Å; I215-F219 WeakPolarHBondContact O-CB 3.23Å; I215-F219 PolarHBondContact O-N 2.94Å; I215-L241 HydrophobicContact CD1-CB 3.66Å; I215-V242 HydrophobicContact CD1-CG2 4.38Å
216	Q	90.4	Very high	90.1	Very high	74 Å²	74	62 Å²	62	35%	0.346	31%	0.309	S	S	.	.	H	α-helix	trans	-66.2	-30.8	-178.1	59.2	-178.1	-12.9	0	0	113.5	Y214 K220 T247	Y214-Q216 PolarHBondContact O-N 3.43Å; Y214-Q216 VanDerWaalsContact O-N 3.15Å; Q216-K220 WeakPolarHBondContact O-CD 3.36Å; Q216-K220 VanDerWaalsContact O-CE 3.27Å; Q216-K220 WeakPolarHBondContact O-CE 3.46Å; Q216-K220 WeakPolarHBondContact O-CG 3.49Å; Q216-T247 HydrophobicContact CB-CG2 4.37Å
217	D	90.6	Very high	89.7	Confident	62 Å²	62	57.4 Å²	57.4	33%	0.332	29%	0.288	S	S	.	.	H	α-helix	trans	-89.6	-37.3	-178.6	-67.5	-40	0	0	0	111.5	I181 Y214 I215 K220	I181-D217 HydrophobicContact CD1-CB 4.23Å; Y214-D217 PolarHBondContact O-N 3.25Å; I215-D217 VanDerWaalsContact C-N 3.31Å; I215-D217 PolarHBondContact O-N 2.86Å; D217-K220 IonicContact OD1-NZ 2.83Å; D217-K220 PolarHBondContact OD1-NZ 3.35Å
218	L	91.9	Very high	89.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-41.2	172.8	-71.6	168	0	0	0	111.5	L180 I181 L184 L200 W203 I204 Y214 K220 K221	L180-L218 HydrophobicContact CB-CD2 4.28Å; L180-L218 HydrophobicContact CD2-CD1 4.08Å; L180-L218 HydrophobicContact CD2-CD2 3.71Å; L180-L218 HydrophobicContact CG-CD2 3.83Å; I181-L218 HydrophobicContact CG1-CD2 3.56Å; I181-L218 HydrophobicContact CG1-CG 4.09Å; L184-L218 HydrophobicContact CD1-CD2 4.33Å; L200-L218 HydrophobicContact CD1-CB 3.41Å; L200-L218 VanDerWaalsContact CD1-CB 3.41Å; L200-L218 WeakPolarHBondContact CD1-O 3.25Å; L200-L218 HydrophobicContact CG-CB 3.87Å; L200-L218 HydrophobicContact CG-CD1 4.47Å; W203-L218 HydrophobicContact CE3-CD1 3.75Å; W203-L218 HydrophobicContact CZ3-CD1 3.61Å; I204-L218 HydrophobicContact CD1-CD1 4.22Å; I204-L218 HydrophobicContact CG1-CD1 4.21Å; Y214-L218 PolarHBondContact O-N 2.92Å; L218-K220 PolarHBondContact O-N 3.13Å; L218-K221 VanDerWaalsContact O-CB 3.27Å; L218-K221 WeakPolarHBondContact O-CB 3.31Å; L218-K221 PolarHBondContact O-N 3.37Å
219	F	91.7	Very high	88.9	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-29.3	-178.1	-167.5	-111.8	0	0	0	112.6	F197 I215 K221 V222 L224 I236 V242 C248 I251 L252	F197-F219 HydrophobicContact CD2-CD2 4.24Å; F197-F219 AromaticContact CD2-CE2 3.99Å; F197-F219 HydrophobicContact CD2-CE2 3.99Å; F197-F219 HydrophobicContact CE2-CD2 4.1Å; F197-F219 AromaticContact CE2-CE2 3.76Å; F197-F219 HydrophobicContact CE2-CE2 3.76Å; I215-F219 WeakPolarHBondContact O-CB 3.23Å; I215-F219 PolarHBondContact O-N 2.94Å; F219-K221 PolarHBondContact O-N 3.3Å; F219-V222 PolarHBondContact O-N 3.03Å; F219-L224 HydrophobicContact CE1-CD1 3.91Å; F219-L224 HydrophobicContact CE2-CD2 4.23Å; F219-L224 HydrophobicContact CZ-CD1 3.85Å; F219-L224 HydrophobicContact CZ-CD2 3.97Å; F219-L224 HydrophobicContact CZ-CG 4.43Å; F219-I236 HydrophobicContact CE2-CG2 3.74Å; F219-I236 HydrophobicContact CZ-CG2 3.85Å; F219-V242 HydrophobicContact CE1-CG1 4.45Å; F219-V242 HydrophobicContact CE2-CG1 4.17Å; F219-V242 HydrophobicContact CE2-CG2 4.46Å; F219-V242 HydrophobicContact CZ-CG1 3.97Å; F219-C248 HydrophobicContact CD1-CB 4.02Å; F219-C248 HydrophobicContact CE1-CB 4.22Å; F219-I251 HydrophobicContact CD1-CB 4.29Å; F219-I251 HydrophobicContact CD1-CD1 4.05Å; F219-I251 HydrophobicContact CD1-CG2 4.07Å; F219-I251 HydrophobicContact CE1-CB 4.05Å; F219-I251 HydrophobicContact CE1-CG2 3.74Å; F219-L252 HydrophobicContact CE1-CG 4.29Å; F219-L252 HydrophobicContact CZ-CD2 3.96Å; F219-L252 HydrophobicContact CZ-CG 4.12Å
220	K	90.1	Very high	88.6	Confident	118 Å²	118	45.5 Å²	45.5	51%	0.513	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.1	172.3	-67.6	165.5	-166.6	160.5	0	113	Q216 D217 L218 I251	Q216-K220 WeakPolarHBondContact O-CD 3.36Å; Q216-K220 VanDerWaalsContact O-CE 3.27Å; Q216-K220 WeakPolarHBondContact O-CE 3.46Å; Q216-K220 WeakPolarHBondContact O-CG 3.49Å; D217-K220 IonicContact OD1-NZ 2.83Å; D217-K220 PolarHBondContact OD1-NZ 3.35Å; L218-K220 PolarHBondContact O-N 3.13Å; K220-I251 HydrophobicContact CG-CD1 3.93Å
221	K	91	Very high	88.4	Confident	73 Å²	73	44 Å²	44	32%	0.317	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-16	177.6	-55	-54.9	-168.8	170.8	0	112.9	I181 L184 L218 F219	I181-K221 VanDerWaalsContact CG2-CE 3.45Å; L184-K221 HydrophobicContact CB-CB 4.26Å; L218-K221 VanDerWaalsContact O-CB 3.27Å; L218-K221 WeakPolarHBondContact O-CB 3.31Å; L218-K221 PolarHBondContact O-N 3.37Å; F219-K221 PolarHBondContact O-N 3.3Å
222	V	91.1	Very high	88.1	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.042	21%	0.207	C	C	.	.	S	Bend	trans	-81.9	119.6	173.7	-173.4	0	0	0	0	109.2	V196 F197 L200 F219 L224 V227	V196-V222 HydrophobicContact CG1-CG2 4.2Å; F197-V222 HydrophobicContact CB-CG1 4.1Å; F197-V222 HydrophobicContact CB-CG2 4.34Å; F197-V222 HydrophobicContact CD2-CG2 4.46Å; L200-V222 HydrophobicContact CD1-CG2 3.88Å; F219-V222 PolarHBondContact O-N 3.03Å; V222-L224 VanDerWaalsContact C-N 3.33Å; V222-L224 HydrophobicContact CB-CD2 4.41Å; V222-L224 HydrophobicContact CG1-CD2 3.88Å; V222-L224 PolarHBondContact O-N 3.32Å; V222-V227 HydrophobicContact CG1-CG2 4.32Å
223	R	88.1	Confident	87.8	Confident	20 Å²	20	38.2 Å²	38.2	8%	0.075	19%	0.186	C	C	.	.			trans	-84.6	76.7	-177.7	-54.4	174.7	-162.3	-157.6	-3	109.7	D187 E193 Q225 Y226 V276 P277	D187-R223 IonicContact OD1-CZ 3.24Å; D187-R223 IonicContact OD1-NH1 3.83Å; D187-R223 PolarHBondContact OD1-NH1 3.45Å; D187-R223 IonicContact OD1-NH2 2.71Å; D187-R223 PolarHBondContact OD1-NH2 3.37Å; E193-R223 HydrophobicContact CG-CB 4.04Å; E193-R223 WeakPolarHBondContact OE1-CD 3.33Å; E193-R223 IonicContact OE1-NE 3.11Å; E193-R223 PolarHBondContact OE2-N 3.13Å; R223-Q225 PolarHBondContact O-N 3.12Å; R223-Y226 HydrophobicContact CB-CD2 3.78Å; R223-Y226 HydrophobicContact CB-CE2 4.39Å; R223-Y226 PolarHBondContact O-N 3.48Å; R223-V276 HydrophobicContact CG-CG1 4.07Å; R223-P277 PolarHBondContact NH1-O 3.07Å
224	L	85.8	Confident	87.5	Confident	11 Å²	11	40 Å²	40	6%	0.058	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-51.5	-27.8	-174.8	-59.9	-178.4	0	0	0	114.7	F219 V222 Y226 V227 L232 I236 I251 L252 A255	F219-L224 HydrophobicContact CE1-CD1 3.91Å; F219-L224 HydrophobicContact CE2-CD2 4.23Å; F219-L224 HydrophobicContact CZ-CD1 3.85Å; F219-L224 HydrophobicContact CZ-CD2 3.97Å; F219-L224 HydrophobicContact CZ-CG 4.43Å; V222-L224 VanDerWaalsContact C-N 3.33Å; V222-L224 HydrophobicContact CB-CD2 4.41Å; V222-L224 HydrophobicContact CG1-CD2 3.88Å; V222-L224 PolarHBondContact O-N 3.32Å; L224-Y226 PolarHBondContact O-N 2.92Å; L224-Y226 VanDerWaalsContact O-N 3.16Å; L224-V227 HydrophobicContact CD2-CG2 4.43Å; L224-V227 PolarHBondContact O-N 3.35Å; L224-L232 HydrophobicContact CB-CD1 4.45Å; L224-L232 HydrophobicContact CD1-CD1 4.36Å; L224-L232 HydrophobicContact CD2-CD1 3.9Å; L224-L232 HydrophobicContact CG-CD1 4.47Å; L224-I236 HydrophobicContact CD2-CD1 4.09Å; L224-I251 HydrophobicContact CD1-CG2 3.58Å; L224-L252 HydrophobicContact CD1-CD2 4.15Å; L224-A255 HydrophobicContact CB-CB 4.12Å; L224-A255 HydrophobicContact CD1-CB 4.01Å
225	Q	79.1	Confident	87.3	Confident	82 Å²	82	41 Å²	41	38%	0.383	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-63.3	-14.9	176	68.7	-170.8	31.8	0	0	114.5	R223 V276	R223-Q225 PolarHBondContact O-N 3.12Å; Q225-V276 PolarHBondContact NE2-O 3.11Å
226	Y	81.1	Confident	87.3	Confident	67 Å²	67	40.5 Å²	40.5	26%	0.263	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-114.7	2	177.9	-53.9	-50.6	0	0	0	113.1	R223 L224 V276 R278	R223-Y226 HydrophobicContact CB-CD2 3.78Å; R223-Y226 HydrophobicContact CB-CE2 4.39Å; R223-Y226 PolarHBondContact O-N 3.48Å; L224-Y226 PolarHBondContact O-N 2.92Å; L224-Y226 VanDerWaalsContact O-N 3.16Å; Y226-V276 PolarHBondContact OH-O 3.24Å; Y226-R278 HydrophobicContact CD1-CG 3.94Å; Y226-R278 VanDerWaalsContact CD1-NE 3.32Å; Y226-R278 HydrophobicContact CD2-CG 3.87Å; Y226-R278 HydrophobicContact CE1-CG 3.46Å; Y226-R278 VanDerWaalsContact CE1-CG 3.46Å; Y226-R278 HydrophobicContact CE2-CB 4.15Å; Y226-R278 HydrophobicContact CE2-CG 3.35Å; Y226-R278 HydrophobicContact CG-CG 4.12Å; Y226-R278 WeakPolarHBondContact OH-CG 3.37Å
227	V	85.6	Confident	87.1	Confident	4 Å²	4	37 Å²	37	2%	0.024	17%	0.17	C	C	.	.	S	Bend	trans	-76.9	138	171.1	175.3	0	0	0	0	109	E193 E194 V222 L224 F231 L232 I236	E193-V227 HydrophobicContact CB-CG2 3.51Å; E194-V227 HydrophobicContact CG-CG1 4.18Å; V222-V227 HydrophobicContact CG1-CG2 4.32Å; L224-V227 HydrophobicContact CD2-CG2 4.43Å; L224-V227 PolarHBondContact O-N 3.35Å; V227-F231 HydrophobicContact CG1-CB 4.12Å; V227-F231 HydrophobicContact CG1-CD1 3.76Å; V227-F231 HydrophobicContact CG1-CG 4.4Å; V227-L232 HydrophobicContact CG1-CB 4.14Å; V227-I236 HydrophobicContact CG1-CD1 3.98Å; V227-I236 HydrophobicContact CG2-CD1 4.47Å
228	H	84.3	Confident	87	Confident	36 Å²	36	39.6 Å²	39.6	17%	0.167	18%	0.183	C	C	.	.			trans	-56.3	128.6	174.3	-169.3	-76.3	0	0	0	109.7	E194 T230 F231 L232 H331	E194-H228 WeakPolarHBondContact OE1-CB 3.25Å; E194-H228 PolarHBondContact OE1-N 2.97Å; H228-T230 VanDerWaalsContact C-N 3.31Å; H228-T230 PolarHBondContact CE1-OG1 3.32Å; H228-T230 WeakPolarHBondContact ND1-CB 3.36Å; H228-T230 PolarHBondContact ND1-N 3.35Å; H228-T230 PolarHBondContact ND1-OG1 3.27Å; H228-T230 PolarHBondContact O-N 2.83Å; H228-F231 HydrophobicContact CB-CB 4.41Å; H228-F231 WeakPolarHBondContact O-CA 3.36Å; H228-F231 WeakPolarHBondContact O-CB 2.93Å; H228-F231 PolarHBondContact O-N 3.22Å; H228-L232 PolarHBondContact O-N 3.37Å; H228-L232 VanDerWaalsContact O-N 3.07Å; H228-H331 VanDerWaalsContact CD2-CB 3.4Å; H228-H331 WeakPolarHBondContact CD2-CB 3.46Å
229	P	83.9	Confident	87	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-42.7	-172.6	-16.2	18.1	0	0	0	113.2	F231 L232 F233 M259 H331 N383 I407	P229-F231 PolarHBondContact O-N 3.09Å; P229-L232 WeakPolarHBondContact O-CB 3.09Å; P229-L232 PolarHBondContact O-N 3.32Å; P229-L232 VanDerWaalsContact O-N 3.11Å; P229-F233 HydrophobicContact CB-CD2 4.25Å; P229-F233 HydrophobicContact CB-CE2 4.28Å; P229-F233 WeakPolarHBondContact O-CD2 3.29Å; P229-F233 PolarHBondContact O-N 2.88Å; P229-M259 HydrophobicContact CB-CE 3.38Å; P229-M259 HydrophobicContact CG-CE 3.35Å; P229-H331 WeakPolarHBondContact CG-CE1 3.35Å; P229-H331 WeakPolarHBondContact CG-NE2 3.42Å; P229-N383 VanDerWaalsContact CG-OD1 3.26Å; P229-N383 WeakPolarHBondContact CG-OD1 3.39Å; P229-I407 HydrophobicContact CB-CD1 3.45Å; P229-I407 VanDerWaalsContact CB-CD1 3.45Å; P229-I407 HydrophobicContact CB-CG1 3.76Å; P229-I407 HydrophobicContact CG-CD1 4.35Å; P229-I407 HydrophobicContact CG-CG1 4.48Å
230	T	84.6	Confident	86.8	Confident	34 Å²	34	44.9 Å²	44.9	21%	0.209	22%	0.219	C	C	.	.	H	α-helix	trans	-55.4	-39.4	175.6	-46.7	0	0	0	0	112.4	H228 H234	H228-T230 VanDerWaalsContact C-N 3.31Å; H228-T230 PolarHBondContact CE1-OG1 3.32Å; H228-T230 WeakPolarHBondContact ND1-CB 3.36Å; H228-T230 PolarHBondContact ND1-N 3.35Å; H228-T230 PolarHBondContact ND1-OG1 3.27Å; H228-T230 PolarHBondContact O-N 2.83Å; T230-H234 WeakPolarHBondContact CG2-ND1 3.17Å; T230-H234 VanDerWaalsContact O-CB 3.32Å; T230-H234 WeakPolarHBondContact O-CB 3.5Å; T230-H234 PolarHBondContact O-N 2.65Å
231	F	87.9	Confident	86.8	Confident	30 Å²	30	40.7 Å²	40.7	13%	0.132	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-44.8	177.2	-170.5	-92.6	0	0	0	111.1	E194 F197 E198 V227 H228 P229 F233 F235 I236	E194-F231 HydrophobicContact CB-CD1 4.19Å; E194-F231 HydrophobicContact CB-CE1 4.06Å; E194-F231 HydrophobicContact CB-CE2 4.41Å; E194-F231 HydrophobicContact CB-CG 4.41Å; E194-F231 HydrophobicContact CB-CZ 4.17Å; E194-F231 HydrophobicContact CG-CB 4.04Å; E194-F231 HydrophobicContact CG-CD1 3.66Å; E194-F231 HydrophobicContact CG-CD2 4.09Å; E194-F231 HydrophobicContact CG-CE1 4.06Å; E194-F231 HydrophobicContact CG-CE2 4.45Å; E194-F231 HydrophobicContact CG-CG 3.66Å; E194-F231 HydrophobicContact CG-CZ 4.44Å; F197-F231 AromaticContact CD1-CE1 3.83Å; F197-F231 HydrophobicContact CD1-CE1 3.83Å; F197-F231 HydrophobicContact CD1-CZ 4.17Å; F197-F231 HydrophobicContact CG-CE1 4.49Å; E198-F231 HydrophobicContact CG-CZ 4.15Å; V227-F231 HydrophobicContact CG1-CB 4.12Å; V227-F231 HydrophobicContact CG1-CD1 3.76Å; V227-F231 HydrophobicContact CG1-CG 4.4Å; H228-F231 HydrophobicContact CB-CB 4.41Å; H228-F231 WeakPolarHBondContact O-CA 3.36Å; H228-F231 WeakPolarHBondContact O-CB 2.93Å; H228-F231 PolarHBondContact O-N 3.22Å; P229-F231 PolarHBondContact O-N 3.09Å; F231-F233 PolarHBondContact O-N 3.17Å; F231-F235 HydrophobicContact CD2-CB 4.28Å; F231-F235 AromaticContact CD2-CD2 3.84Å; F231-F235 HydrophobicContact CD2-CD2 3.84Å; F231-F235 HydrophobicContact CD2-CE2 4.39Å; F231-F235 HydrophobicContact CD2-CG 4.1Å; F231-F235 HydrophobicContact CE2-CB 4.21Å; F231-F235 HydrophobicContact CE2-CD2 4.34Å; F231-F235 HydrophobicContact CE2-CG 4.16Å; F231-F235 HydrophobicContact CG-CB 4.49Å; F231-F235 HydrophobicContact CG-CD2 4.34Å; F231-F235 HydrophobicContact CZ-CB 4.36Å; F231-F235 WeakPolarHBondContact O-CA 3.46Å; F231-F235 WeakPolarHBondContact O-CB 3.49Å; F231-F235 PolarHBondContact O-N 2.95Å; F231-I236 HydrophobicContact CD1-CD1 3.81Å; F231-I236 HydrophobicContact CD1-CG1 3.74Å; F231-I236 HydrophobicContact CE1-CD1 3.86Å; F231-I236 HydrophobicContact CE1-CG1 3.65Å; F231-I236 PolarHBondContact O-N 3.37Å
232	L	87.6	Confident	86.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.5	-47.2	176.3	-177.4	70	0	0	0	112.3	L224 V227 H228 P229 I236 A237 L252 A255 M259	L224-L232 HydrophobicContact CB-CD1 4.45Å; L224-L232 HydrophobicContact CD1-CD1 4.36Å; L224-L232 HydrophobicContact CD2-CD1 3.9Å; L224-L232 HydrophobicContact CG-CD1 4.47Å; V227-L232 HydrophobicContact CG1-CB 4.14Å; H228-L232 PolarHBondContact O-N 3.37Å; H228-L232 VanDerWaalsContact O-N 3.07Å; P229-L232 WeakPolarHBondContact O-CB 3.09Å; P229-L232 PolarHBondContact O-N 3.32Å; P229-L232 VanDerWaalsContact O-N 3.11Å; L232-I236 HydrophobicContact CD1-CB 4.18Å; L232-I236 HydrophobicContact CD1-CD1 3.99Å; L232-I236 HydrophobicContact CD1-CG2 4.28Å; L232-A237 VanDerWaalsContact O-CB 3.25Å; L232-A237 WeakPolarHBondContact O-CB 3.49Å; L232-A237 PolarHBondContact O-N 3.41Å; L232-L252 HydrophobicContact CD1-CD2 3.74Å; L232-A255 HydrophobicContact CD2-CB 4.43Å; L232-M259 HydrophobicContact CD2-CE 4.42Å; L232-M259 HydrophobicContact CD2-SD 3.35Å; L232-M259 WeakPolarHBondContact CD2-SD 3.33Å
233	F	84.2	Confident	86.6	Confident	17 Å²	17	40.1 Å²	40.1	8%	0.075	20%	0.2	C	C	.	.	H	α-helix	trans	-79.8	-39.7	-174	-74.6	-73.5	0	0	0	113.9	P229 F231 N238 R256 M259 F260 I407	P229-F233 HydrophobicContact CB-CD2 4.25Å; P229-F233 HydrophobicContact CB-CE2 4.28Å; P229-F233 WeakPolarHBondContact O-CD2 3.29Å; P229-F233 PolarHBondContact O-N 2.88Å; F231-F233 PolarHBondContact O-N 3.17Å; F233-N238 PolarHBondContact O-ND2 3.19Å; F233-R256 HydrophobicContact CE1-CB 4.4Å; F233-R256 HydrophobicContact CE1-CG 3.5Å; F233-R256 VanDerWaalsContact CE1-CG 3.5Å; F233-R256 HydrophobicContact CZ-CB 4.39Å; F233-R256 HydrophobicContact CZ-CG 3.77Å; F233-M259 HydrophobicContact CE2-SD 4.31Å; F233-F260 HydrophobicContact CD1-CE2 4.43Å; F233-F260 HydrophobicContact CD2-CE2 4.46Å; F233-F260 HydrophobicContact CD2-CZ 4.47Å; F233-F260 HydrophobicContact CE1-CD2 4.31Å; F233-F260 AromaticContact CE1-CE2 3.48Å; F233-F260 HydrophobicContact CE1-CE2 3.48Å; F233-F260 VanDerWaalsContact CE1-CE2 3.48Å; F233-F260 HydrophobicContact CE1-CZ 4.29Å; F233-F260 HydrophobicContact CE2-CD2 4.47Å; F233-F260 AromaticContact CE2-CE2 3.58Å; F233-F260 HydrophobicContact CE2-CE2 3.58Å; F233-F260 AromaticContact CE2-CZ 3.81Å; F233-F260 HydrophobicContact CE2-CZ 3.81Å; F233-F260 AromaticContact CZ-CD2 3.75Å; F233-F260 HydrophobicContact CZ-CD2 3.75Å; F233-F260 AromaticContact CZ-CE2 3.02Å; F233-F260 HydrophobicContact CZ-CE2 3.02Å; F233-F260 AromaticContact CZ-CZ 3.75Å; F233-F260 HydrophobicContact CZ-CZ 3.75Å; F233-I407 HydrophobicContact CD2-CD1 3.99Å; F233-I407 HydrophobicContact CD2-CG2 4.23Å; F233-I407 HydrophobicContact CE2-CD1 3.99Å
234	H	84.7	Confident	86.6	Confident	86 Å²	86	43.2 Å²	43.2	40%	0.398	23%	0.225	S	C	.	.	H	α-helix	trans	-88.9	-29.3	-175.7	-63.4	160.5	0	0	0	113.3	T230 N238	T230-H234 WeakPolarHBondContact CG2-ND1 3.17Å; T230-H234 VanDerWaalsContact O-CB 3.32Å; T230-H234 WeakPolarHBondContact O-CB 3.5Å; T230-H234 PolarHBondContact O-N 2.65Å; H234-N238 PolarHBondContact O-ND2 3.16Å
235	F	88.1	Confident	86.9	Confident	128 Å²	128	43.3 Å²	43.3	56%	0.561	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-65.4	-175.7	-60.9	-95.4	0	0	0	111.6	F231 A237 N238 D239	F231-F235 HydrophobicContact CD2-CB 4.28Å; F231-F235 AromaticContact CD2-CD2 3.84Å; F231-F235 HydrophobicContact CD2-CD2 3.84Å; F231-F235 HydrophobicContact CD2-CE2 4.39Å; F231-F235 HydrophobicContact CD2-CG 4.1Å; F231-F235 HydrophobicContact CE2-CB 4.21Å; F231-F235 HydrophobicContact CE2-CD2 4.34Å; F231-F235 HydrophobicContact CE2-CG 4.16Å; F231-F235 HydrophobicContact CG-CB 4.49Å; F231-F235 HydrophobicContact CG-CD2 4.34Å; F231-F235 HydrophobicContact CZ-CB 4.36Å; F231-F235 WeakPolarHBondContact O-CA 3.46Å; F231-F235 WeakPolarHBondContact O-CB 3.49Å; F231-F235 PolarHBondContact O-N 2.95Å; F235-A237 PolarHBondContact O-N 2.68Å; F235-N238 PolarHBondContact O-N 2.86Å; F235-D239 PolarHBondContact O-N 2.9Å
236	I	90.7	Very high	87.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-60.9	-47.1	-173.5	-56.4	-174.4	0	0	0	111	F197 F219 L224 V227 F231 L232 N238 D239 V242 L252	F197-I236 HydrophobicContact CB-CD1 4.38Å; F197-I236 HydrophobicContact CD1-CD1 4.17Å; F197-I236 HydrophobicContact CD1-CG1 3.83Å; F197-I236 HydrophobicContact CD2-CD1 4.12Å; F197-I236 HydrophobicContact CD2-CG1 4.25Å; F197-I236 HydrophobicContact CD2-CG2 4.32Å; F197-I236 HydrophobicContact CE1-CB 4.43Å; F197-I236 HydrophobicContact CE1-CG1 3.77Å; F197-I236 HydrophobicContact CE2-CB 4.46Å; F197-I236 HydrophobicContact CE2-CG1 4.22Å; F197-I236 HydrophobicContact CE2-CG2 3.8Å; F197-I236 HydrophobicContact CG-CD1 3.94Å; F197-I236 HydrophobicContact CG-CG1 4.07Å; F197-I236 HydrophobicContact CZ-CB 4.2Å; F197-I236 HydrophobicContact CZ-CG1 3.97Å; F197-I236 HydrophobicContact CZ-CG2 3.95Å; F219-I236 HydrophobicContact CE2-CG2 3.74Å; F219-I236 HydrophobicContact CZ-CG2 3.85Å; L224-I236 HydrophobicContact CD2-CD1 4.09Å; V227-I236 HydrophobicContact CG1-CD1 3.98Å; V227-I236 HydrophobicContact CG2-CD1 4.47Å; F231-I236 HydrophobicContact CD1-CD1 3.81Å; F231-I236 HydrophobicContact CD1-CG1 3.74Å; F231-I236 HydrophobicContact CE1-CD1 3.86Å; F231-I236 HydrophobicContact CE1-CG1 3.65Å; F231-I236 PolarHBondContact O-N 3.37Å; L232-I236 HydrophobicContact CD1-CB 4.18Å; L232-I236 HydrophobicContact CD1-CD1 3.99Å; L232-I236 HydrophobicContact CD1-CG2 4.28Å; I236-N238 VanDerWaalsContact C-N 3.25Å; I236-N238 PolarHBondContact O-N 2.95Å; I236-D239 PolarHBondContact O-N 3.35Å; I236-V242 HydrophobicContact CG2-CG1 4.48Å; I236-L252 HydrophobicContact CG2-CD2 3.95Å
237	A	87.4	Confident	87.7	Confident	2 Å²	2	42.6 Å²	42.6	2%	0.017	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-73.6	-15.3	-175.4	0	0	0	0	0	114.1	L232 F235 Q243 L252	L232-A237 VanDerWaalsContact O-CB 3.25Å; L232-A237 WeakPolarHBondContact O-CB 3.49Å; L232-A237 PolarHBondContact O-N 3.41Å; F235-A237 PolarHBondContact O-N 2.68Å; A237-Q243 PolarHBondContact O-NE2 3.2Å; A237-L252 HydrophobicContact CB-CD1 4.33Å
238	N	87.9	Confident	87.8	Confident	115 Å²	115	42.4 Å²	42.4	62%	0.615	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-98.7	-3.8	177.8	-67.6	-28.5	0	0	0	112.7	F233 H234 F235 I236	F233-N238 PolarHBondContact O-ND2 3.19Å; H234-N238 PolarHBondContact O-ND2 3.16Å; F235-N238 PolarHBondContact O-N 2.86Å; I236-N238 VanDerWaalsContact C-N 3.25Å; I236-N238 PolarHBondContact O-N 2.95Å
239	D	91.4	Very high	88	Confident	20 Å²	20	45.7 Å²	45.7	11%	0.107	25%	0.246	C	C	.	.			trans	-71.1	131.4	179.2	-173	-80.1	0	0	0	111.9	M201 R205 F235 I236 L241 V242 Q243	M201-D239 WeakPolarHBondContact CE-OD1 3.46Å; M201-D239 WeakPolarHBondContact CE-OD2 3.4Å; R205-D239 IonicContact CZ-OD2 3.81Å; R205-D239 IonicContact NH2-OD2 3.71Å; R205-D239 PolarHBondContact NH2-OD2 3.33Å; F235-D239 PolarHBondContact O-N 2.9Å; I236-D239 PolarHBondContact O-N 3.35Å; D239-L241 PolarHBondContact O-N 3.27Å; D239-L241 WeakPolarHBondContact OD1-CB 3.38Å; D239-L241 PolarHBondContact OD1-N 3.03Å; D239-V242 HydrophobicContact CB-CB 4.25Å; D239-V242 HydrophobicContact CB-CG2 3.94Å; D239-V242 PolarHBondContact O-N 2.97Å; D239-V242 PolarHBondContact OD1-N 3.26Å; D239-Q243 WeakPolarHBondContact O-CG 3.48Å; D239-Q243 PolarHBondContact O-N 3.5Å
240	S	88.9	Confident	88.1	Confident	92 Å²	92	49 Å²	49	64%	0.643	27%	0.269	S	S	*	.	H	α-helix	trans	-66.6	-34.2	-174.3	56.5	0	0	0	0	113.7	Q243 S244	S240-Q243 PolarHBondContact O-N 3.14Å; S240-S244 WeakPolarHBondContact O-CB 3.38Å; S240-S244 PolarHBondContact O-N 3.08Å
241	L	89.1	Confident	88.2	Confident	30 Å²	30	48.9 Å²	48.9	16%	0.157	27%	0.267	C	S	.	.	H	α-helix	trans	-73.2	-37.6	179	-65.1	169.2	0	0	0	110.9	M201 I204 R205 L208 I215 D239 Q243 S244	M201-L241 HydrophobicContact CE-CB 4.32Å; M201-L241 HydrophobicContact CE-CD1 3.79Å; I204-L241 HydrophobicContact CG2-CD1 4.26Å; R205-L241 HydrophobicContact CG-CD1 4.45Å; L208-L241 HydrophobicContact CD2-CD1 3.77Å; L208-L241 HydrophobicContact CD2-CD2 4.29Å; I215-L241 HydrophobicContact CD1-CB 3.66Å; D239-L241 PolarHBondContact O-N 3.27Å; D239-L241 WeakPolarHBondContact OD1-CB 3.38Å; D239-L241 PolarHBondContact OD1-N 3.03Å; L241-Q243 VanDerWaalsContact C-N 3.33Å; L241-S244 PolarHBondContact O-OG 3.29Å
242	V	89.9	Confident	88.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-38.6	175.2	-176.7	0	0	0	0	110.5	F197 I215 F219 I236 D239 C248 L252	F197-V242 HydrophobicContact CE2-CG2 4.04Å; F197-V242 HydrophobicContact CZ-CG2 4.09Å; I215-V242 HydrophobicContact CD1-CG2 4.38Å; F219-V242 HydrophobicContact CE1-CG1 4.45Å; F219-V242 HydrophobicContact CE2-CG1 4.17Å; F219-V242 HydrophobicContact CE2-CG2 4.46Å; F219-V242 HydrophobicContact CZ-CG1 3.97Å; I236-V242 HydrophobicContact CG2-CG1 4.48Å; D239-V242 HydrophobicContact CB-CB 4.25Å; D239-V242 HydrophobicContact CB-CG2 3.94Å; D239-V242 PolarHBondContact O-N 2.97Å; D239-V242 PolarHBondContact OD1-N 3.26Å; V242-C248 HydrophobicContact CG1-CB 3.9Å; V242-C248 VanDerWaalsContact O-CB 3.28Å; V242-C248 WeakPolarHBondContact O-CB 3.25Å; V242-L252 HydrophobicContact CG1-CD1 3.6Å; V242-L252 HydrophobicContact CG1-CG 4.32Å
243	Q	89.2	Confident	87.9	Confident	69 Å²	69	52.6 Å²	52.6	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-73.4	-31.2	178.6	-71	-59.5	-30.9	0	0	114	A237 D239 S240 L241 S245 R249	A237-Q243 PolarHBondContact O-NE2 3.2Å; D239-Q243 WeakPolarHBondContact O-CG 3.48Å; D239-Q243 PolarHBondContact O-N 3.5Å; S240-Q243 PolarHBondContact O-N 3.14Å; L241-Q243 VanDerWaalsContact C-N 3.33Å; Q243-S245 VanDerWaalsContact C-N 3.28Å; Q243-S245 PolarHBondContact O-N 2.85Å; Q243-R249 WeakPolarHBondContact O-CD 3.29Å; Q243-R249 PolarHBondContact O-NE 3.21Å
244	S	88.2	Confident	87.8	Confident	85 Å²	85	52.5 Å²	52.5	59%	0.594	29%	0.286	S	S	*	.	H	α-helix	trans	-66	-31.6	178.6	69.6	0	0	0	0	112.4	S240 L241	S240-S244 WeakPolarHBondContact O-CB 3.38Å; S240-S244 PolarHBondContact O-N 3.08Å; L241-S244 PolarHBondContact O-OG 3.29Å
245	S	90.4	Very high	87.7	Confident	12 Å²	12	48.9 Å²	48.9	8%	0.084	27%	0.271	C	S	.	.			trans	-83.4	121.6	179.4	175.9	0	0	0	0	112.7	Q243 T247 C248 R249	Q243-S245 VanDerWaalsContact C-N 3.28Å; Q243-S245 PolarHBondContact O-N 2.85Å; S245-T247 VanDerWaalsContact C-N 3.31Å; S245-T247 PolarHBondContact O-N 2.72Å; S245-C248 PolarHBondContact O-N 3.09Å; S245-R249 PolarHBondContact O-N 3.39Å; S245-R249 VanDerWaalsContact O-N 3.14Å
246	P	88.8	Confident	87.3	Confident	85 Å²	85	46.9 Å²	46.9	55%	0.552	26%	0.26	S	S	*	.	H	α-helix	trans	-64.6	-35	178.3	26.2	-33.2	0	0	0	112.6	R249 S250	P246-R249 PolarHBondContact O-N 2.88Å; P246-S250 PolarHBondContact O-N 2.93Å
247	T	88.1	Confident	86.6	Confident	49 Å²	49	52.9 Å²	52.9	30%	0.301	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-45.8	177.8	-52.7	0	0	0	0	111	Q216 S245 R249 S250 I251	Q216-T247 HydrophobicContact CB-CG2 4.37Å; S245-T247 VanDerWaalsContact C-N 3.31Å; S245-T247 PolarHBondContact O-N 2.72Å; T247-R249 PolarHBondContact O-N 2.96Å; T247-S250 PolarHBondContact O-N 3.21Å; T247-I251 HydrophobicContact CG2-CD1 4.19Å; T247-I251 WeakPolarHBondContact O-CG1 3.44Å; T247-I251 PolarHBondContact O-N 2.92Å
248	C	88.6	Confident	85.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-40.8	178	-66	0	0	0	0	111.7	F219 V242 S245 I251 L252	F219-C248 HydrophobicContact CD1-CB 4.02Å; F219-C248 HydrophobicContact CE1-CB 4.22Å; V242-C248 HydrophobicContact CG1-CB 3.9Å; V242-C248 VanDerWaalsContact O-CB 3.28Å; V242-C248 WeakPolarHBondContact O-CB 3.25Å; S245-C248 PolarHBondContact O-N 3.09Å; C248-I251 PolarHBondContact O-N 3.35Å; C248-L252 WeakPolarHBondContact O-CG 3.37Å; C248-L252 PolarHBondContact O-N 2.75Å
249	R	87.9	Confident	85.1	Confident	105 Å²	105	53.5 Å²	53.5	40%	0.396	28%	0.281	S	S	.	.	H	α-helix	trans	-59.6	-45.4	173.8	-74.7	-171	-76.8	130.3	-4.7	112.8	Q243 S245 P246 T247 I251 L252 E253	Q243-R249 WeakPolarHBondContact O-CD 3.29Å; Q243-R249 PolarHBondContact O-NE 3.21Å; S245-R249 PolarHBondContact O-N 3.39Å; S245-R249 VanDerWaalsContact O-N 3.14Å; P246-R249 PolarHBondContact O-N 2.88Å; T247-R249 PolarHBondContact O-N 2.96Å; R249-I251 VanDerWaalsContact C-N 3.3Å; R249-I251 PolarHBondContact O-N 3.26Å; R249-L252 PolarHBondContact O-N 3.07Å; R249-E253 WeakPolarHBondContact O-CG 3.44Å; R249-E253 PolarHBondContact O-N 3.27Å
250	S	87.3	Confident	83.9	Confident	70 Å²	70	55.2 Å²	55.2	49%	0.49	29%	0.288	S	S	.	.	H	α-helix	trans	-61.1	-39.5	176	-179.4	0	0	0	0	112.2	P246 T247 S254	P246-S250 PolarHBondContact O-N 2.93Å; T247-S250 PolarHBondContact O-N 3.21Å; S250-S254 WeakPolarHBondContact O-CB 3.34Å; S250-S254 PolarHBondContact O-N 3.47Å
251	I	85.9	Confident	82.5	Confident	32 Å²	32	52.6 Å²	52.6	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-44.9	176.6	-68	166.5	0	0	0	110.3	F219 K220 L224 T247 C248 R249 S254 A255	F219-I251 HydrophobicContact CD1-CB 4.29Å; F219-I251 HydrophobicContact CD1-CD1 4.05Å; F219-I251 HydrophobicContact CD1-CG2 4.07Å; F219-I251 HydrophobicContact CE1-CB 4.05Å; F219-I251 HydrophobicContact CE1-CG2 3.74Å; K220-I251 HydrophobicContact CG-CD1 3.93Å; L224-I251 HydrophobicContact CD1-CG2 3.58Å; T247-I251 HydrophobicContact CG2-CD1 4.19Å; T247-I251 WeakPolarHBondContact O-CG1 3.44Å; T247-I251 PolarHBondContact O-N 2.92Å; C248-I251 PolarHBondContact O-N 3.35Å; R249-I251 VanDerWaalsContact C-N 3.3Å; R249-I251 PolarHBondContact O-N 3.26Å; I251-S254 WeakPolarHBondContact O-CB 3.38Å; I251-S254 PolarHBondContact O-N 3.45Å; I251-A255 PolarHBondContact O-N 2.85Å
252	L	86.6	Confident	80.5	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-47	175.5	-76.5	177.2	0	0	0	112.1	F219 L224 L232 I236 A237 V242 C248 R249 S254 A255 R256	F219-L252 HydrophobicContact CE1-CG 4.29Å; F219-L252 HydrophobicContact CZ-CD2 3.96Å; F219-L252 HydrophobicContact CZ-CG 4.12Å; L224-L252 HydrophobicContact CD1-CD2 4.15Å; L232-L252 HydrophobicContact CD1-CD2 3.74Å; I236-L252 HydrophobicContact CG2-CD2 3.95Å; A237-L252 HydrophobicContact CB-CD1 4.33Å; V242-L252 HydrophobicContact CG1-CD1 3.6Å; V242-L252 HydrophobicContact CG1-CG 4.32Å; C248-L252 WeakPolarHBondContact O-CG 3.37Å; C248-L252 PolarHBondContact O-N 2.75Å; R249-L252 PolarHBondContact O-N 3.07Å; L252-S254 VanDerWaalsContact C-N 3.28Å; L252-S254 PolarHBondContact O-N 2.85Å; L252-A255 PolarHBondContact O-N 3.31Å; L252-R256 WeakPolarHBondContact O-CB 3.35Å; L252-R256 WeakPolarHBondContact O-CG 3.12Å; L252-R256 PolarHBondContact O-N 3.21Å
253	E	83.8	Confident	78.2	Confident	105 Å²	105	60.8 Å²	60.8	49%	0.491	30%	0.301	S	S	.	.	H	α-helix	trans	-61.6	-37	177.7	-77.4	179.1	-175.3	0	0	112.5	R249 R257	R249-E253 WeakPolarHBondContact O-CG 3.44Å; R249-E253 PolarHBondContact O-N 3.27Å; E253-R257 WeakPolarHBondContact O-CB 3.23Å; E253-R257 WeakPolarHBondContact O-CG 3.5Å; E253-R257 PolarHBondContact O-N 2.7Å; E253-R257 PolarHBondContact O-NE 3Å
254	S	81.6	Confident	75.8	Confident	16 Å²	16	61.5 Å²	61.5	11%	0.112	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-49	172.4	-175.1	0	0	0	0	111.1	S250 I251 L252 R256 R257 H258	S250-S254 WeakPolarHBondContact O-CB 3.34Å; S250-S254 PolarHBondContact O-N 3.47Å; I251-S254 WeakPolarHBondContact O-CB 3.38Å; I251-S254 PolarHBondContact O-N 3.45Å; L252-S254 VanDerWaalsContact C-N 3.28Å; L252-S254 PolarHBondContact O-N 2.85Å; S254-R256 PolarHBondContact O-N 3.16Å; S254-R257 PolarHBondContact O-N 2.67Å; S254-H258 PolarHBondContact O-N 3.48Å; S254-H258 PolarHBondContact O-ND1 3.02Å
255	A	81.3	Confident	73.3	Confident	9 Å²	9	63.1 Å²	63.1	7%	0.074	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-46	178.3	0	0	0	0	0	111.8	L224 L232 I251 L252 R257 H258 M259	L224-A255 HydrophobicContact CB-CB 4.12Å; L224-A255 HydrophobicContact CD1-CB 4.01Å; L232-A255 HydrophobicContact CD2-CB 4.43Å; I251-A255 PolarHBondContact O-N 2.85Å; L252-A255 PolarHBondContact O-N 3.31Å; A255-R257 PolarHBondContact O-N 3.07Å; A255-H258 PolarHBondContact O-N 3.37Å; A255-M259 VanDerWaalsContact O-CG 3.29Å; A255-M259 WeakPolarHBondContact O-CG 3.32Å; A255-M259 PolarHBondContact O-N 3.21Å
256	R	80.2	Confident	70.6	Confident	87 Å²	87	70.3 Å²	70.3	33%	0.328	36%	0.358	S	S	.	.	H	α-helix	trans	-57	-46.3	175.9	-71.9	-178	163.6	169.7	-10.6	112.1	F233 L252 S254 M259 F260	F233-R256 HydrophobicContact CE1-CB 4.4Å; F233-R256 HydrophobicContact CE1-CG 3.5Å; F233-R256 VanDerWaalsContact CE1-CG 3.5Å; F233-R256 HydrophobicContact CZ-CB 4.39Å; F233-R256 HydrophobicContact CZ-CG 3.77Å; L252-R256 WeakPolarHBondContact O-CB 3.35Å; L252-R256 WeakPolarHBondContact O-CG 3.12Å; L252-R256 PolarHBondContact O-N 3.21Å; S254-R256 PolarHBondContact O-N 3.16Å; R256-M259 PolarHBondContact O-N 3.38Å; R256-F260 WeakPolarHBondContact O-CB 3.47Å; R256-F260 PolarHBondContact O-N 3.43Å
257	R	76.4	Confident	68	Low	126 Å²	126	70.9 Å²	70.9	48%	0.475	36%	0.36	S	S	.	.	H	α-helix	trans	-62.1	-42.3	177.3	-79.6	-176.9	-76.7	166.6	-9.3	111.8	E253 S254 A255 S261	E253-R257 WeakPolarHBondContact O-CB 3.23Å; E253-R257 WeakPolarHBondContact O-CG 3.5Å; E253-R257 PolarHBondContact O-N 2.7Å; E253-R257 PolarHBondContact O-NE 3Å; S254-R257 PolarHBondContact O-N 2.67Å; A255-R257 PolarHBondContact O-N 3.07Å; R257-S261 WeakPolarHBondContact O-CA 3.32Å; R257-S261 WeakPolarHBondContact O-CB 3.09Å; R257-S261 PolarHBondContact O-N 2.88Å
258	H	72.9	Confident	65.5	Low	101 Å²	101	74.9 Å²	74.9	47%	0.468	39%	0.387	S	S	.	.	H	α-helix	trans	-65.4	-42.3	177.3	-74.5	79.4	0	0	0	112.1	S254 A255	S254-H258 PolarHBondContact O-N 3.48Å; S254-H258 PolarHBondContact O-ND1 3.02Å; A255-H258 PolarHBondContact O-N 3.37Å
259	M	70.4	Confident	63.1	Low	28 Å²	28	82.1 Å²	82.1	14%	0.138	43%	0.425	C	S	.	.	H	α-helix	trans	-70.2	-35.2	-179	-66.6	-179.9	87.9	0	0	113.3	P229 L232 F233 A255 R256 N383	P229-M259 HydrophobicContact CB-CE 3.38Å; P229-M259 HydrophobicContact CG-CE 3.35Å; L232-M259 HydrophobicContact CD2-CE 4.42Å; L232-M259 HydrophobicContact CD2-SD 3.35Å; L232-M259 WeakPolarHBondContact CD2-SD 3.33Å; F233-M259 HydrophobicContact CE2-SD 4.31Å; A255-M259 VanDerWaalsContact O-CG 3.29Å; A255-M259 WeakPolarHBondContact O-CG 3.32Å; A255-M259 PolarHBondContact O-N 3.21Å; R256-M259 PolarHBondContact O-N 3.38Å; M259-N383 PolarHBondContact O-ND2 2.83Å
260	F	66.4	Low	60.8	Low	57 Å²	57	81.6 Å²	81.6	25%	0.25	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	15.2	-179.7	-67.5	-61.4	0	0	0	114	F233 R256 L262 I407	F233-F260 HydrophobicContact CD1-CE2 4.43Å; F233-F260 HydrophobicContact CD2-CE2 4.46Å; F233-F260 HydrophobicContact CD2-CZ 4.47Å; F233-F260 HydrophobicContact CE1-CD2 4.31Å; F233-F260 AromaticContact CE1-CE2 3.48Å; F233-F260 HydrophobicContact CE1-CE2 3.48Å; F233-F260 VanDerWaalsContact CE1-CE2 3.48Å; F233-F260 HydrophobicContact CE1-CZ 4.29Å; F233-F260 HydrophobicContact CE2-CD2 4.47Å; F233-F260 AromaticContact CE2-CE2 3.58Å; F233-F260 HydrophobicContact CE2-CE2 3.58Å; F233-F260 AromaticContact CE2-CZ 3.81Å; F233-F260 HydrophobicContact CE2-CZ 3.81Å; F233-F260 AromaticContact CZ-CD2 3.75Å; F233-F260 HydrophobicContact CZ-CD2 3.75Å; F233-F260 AromaticContact CZ-CE2 3.02Å; F233-F260 HydrophobicContact CZ-CE2 3.02Å; F233-F260 AromaticContact CZ-CZ 3.75Å; F233-F260 HydrophobicContact CZ-CZ 3.75Å; R256-F260 WeakPolarHBondContact O-CB 3.47Å; R256-F260 PolarHBondContact O-N 3.43Å; F260-L262 PolarHBondContact O-N 3.46Å; F260-I407 HydrophobicContact CE1-CD1 3.85Å; F260-I407 HydrophobicContact CZ-CD1 3.64Å
261	S	59.6	Low	58.5	Low	37 Å²	37	87.3 Å²	87.3	26%	0.259	45%	0.445	S	S	.	.			trans	-68.2	71.7	175.8	171.5	0	0	0	0	110.5	R257 Y263	R257-S261 WeakPolarHBondContact O-CA 3.32Å; R257-S261 WeakPolarHBondContact O-CB 3.09Å; R257-S261 PolarHBondContact O-N 2.88Å; S261-Y263 VanDerWaalsContact C-N 3.29Å
262	L	46.3	Very low	56.5	Low	20 Å²	20	90.8 Å²	90.8	11%	0.105	47%	0.47	C	S	.	.	S	Bend	trans	-82.7	-15.7	153.1	-66.2	173.3	0	0	0	109.9	F260 Y381 Y384 V454 S455	F260-L262 PolarHBondContact O-N 3.46Å; L262-Y381 HydrophobicContact CD2-CE1 4.23Å; L262-Y384 HydrophobicContact CD1-CE2 3.89Å; L262-V454 HydrophobicContact CD2-CB 4.48Å; L262-V454 HydrophobicContact CD2-CG1 3.71Å; L262-S455 WeakPolarHBondContact O-CB 3.4Å
263	Y	43.2	Very low	54.6	Low	181 Å²	181	95.2 Å²	95.2	71%	0.71	49%	0.492	S	S	*	.			trans	-131	106.9	178.2	-57	-78.9	0	0	0	109.2	S261	S261-Y263 VanDerWaalsContact C-N 3.29Å
264	S	38.2	Very low	52.7	Low	84 Å²	84	97.5 Å²	97.5	59%	0.587	51%	0.507	S	S	*	.			trans	-124.6	95.9	156.2	-162.7	0	0	0	0	108.3
265	T	34.5	Very low	51.3	Low	119 Å²	119	104.5 Å²	104.5	73%	0.73	54%	0.537	S	S	*	.			trans	-58.3	125.5	149.4	43.2	0	0	0	0	107.7	T267	T265-T267 PolarHBondContact O-N 3Å
266	N	34.6	Very low	50.3	Low	164 Å²	164	106.8 Å²	106.8	88%	0.877	55%	0.55	S	S	*	*			trans	-38	105.9	169.5	-67.9	-22	0	0	0	111.3
267	T	33.6	Very low	49.5	Very low	97 Å²	97	105.9 Å²	105.9	60%	0.595	56%	0.556	S	S	*	*			trans	-118.5	124.5	159.9	45.2	0	0	0	0	107.1	T265 D269	T265-T267 PolarHBondContact O-N 3Å; T267-D269 VanDerWaalsContact C-N 3.3Å; T267-D269 PolarHBondContact O-N 2.98Å
268	P	37.1	Very low	49.1	Very low	133 Å²	133	104.7 Å²	104.7	86%	0.864	55%	0.551	S	S	*	*	S	Bend	trans	-78.6	2	-164.6	-16.8	33.4	0	0	0	116.5
269	D	36.5	Very low	49.4	Very low	151 Å²	151	100.2 Å²	100.2	81%	0.807	53%	0.53	S	S	*	.			trans	-127.9	26.2	-151.7	-117.5	-7.5	0	0	0	116.9	T267	T267-D269 VanDerWaalsContact C-N 3.3Å; T267-D269 PolarHBondContact O-N 2.98Å
270	I	39.8	Very low	49	Very low	95 Å²	95	108.3 Å²	108.3	49%	0.487	56%	0.561	S	S	.	*			trans	-126.1	111.6	173.9	-53.3	177.8	0	0	0	108.5	P272	I270-P272 VanDerWaalsContact O-N 3.11Å
271	K	38.8	Very low	49	Very low	189 Å²	189	105.9 Å²	105.9	82%	0.822	55%	0.551	S	S	*	*			trans	-48.5	121.8	166.2	-80	179.5	178.1	176.7	0	106.9	M273	K271-M273 PolarHBondContact O-N 2.89Å
272	P	45.1	Very low	49.6	Very low	105 Å²	105	106.5 Å²	106.5	68%	0.682	56%	0.555	S	S	*	*			trans	-50.5	138.5	171.6	21.6	-30.6	0	0	0	106.7	I270 L274	I270-P272 VanDerWaalsContact O-N 3.11Å; P272-L274 PolarHBondContact O-N 3.43Å
273	M	45.8	Very low	51.2	Low	95 Å²	95	108.3 Å²	108.3	47%	0.468	56%	0.563	S	S	.	*			trans	-44.2	123	175.5	-70.4	-128.7	74.7	0	0	106.8	K271 H275	K271-M273 PolarHBondContact O-N 2.89Å; M273-H275 PolarHBondContact O-N 3.19Å; M273-H275 VanDerWaalsContact O-N 3.08Å
274	L	45.3	Very low	53.3	Low	153 Å²	153	102.3 Å²	102.3	80%	0.801	54%	0.542	S	S	*	.			trans	-39.8	126	174.1	-94.6	133.3	0	0	0	105.9	P272 V276	P272-L274 PolarHBondContact O-N 3.43Å; L274-V276 WeakPolarHBondContact O-CG2 3.47Å; L274-V276 PolarHBondContact O-N 3.25Å
275	H	50.4	Low	55.7	Low	163 Å²	163	98.8 Å²	98.8	76%	0.755	52%	0.515	S	S	*	.			trans	-59.6	88.6	179.8	-177.9	41.7	0	0	0	107.5	M273 P277	M273-H275 PolarHBondContact O-N 3.19Å; M273-H275 VanDerWaalsContact O-N 3.08Å; H275-P277 VanDerWaalsContact O-CD 3.25Å; H275-P277 WeakPolarHBondContact O-CD 3.26Å
276	V	61.3	Low	58.5	Low	57 Å²	57	93.1 Å²	93.1	35%	0.345	48%	0.481	S	S	.	.			trans	-76	113.5	176.6	-175.1	0	0	0	0	103.5	R223 Q225 Y226 L274	R223-V276 HydrophobicContact CG-CG1 4.07Å; Q225-V276 PolarHBondContact NE2-O 3.11Å; Y226-V276 PolarHBondContact OH-O 3.24Å; L274-V276 WeakPolarHBondContact O-CG2 3.47Å; L274-V276 PolarHBondContact O-N 3.25Å
277	P	63.4	Low	61.4	Low	69 Å²	69	85.3 Å²	85.3	45%	0.448	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-59	159.9	179.3	25.1	-32.5	0	0	0	109.5	R223 H275	R223-P277 PolarHBondContact NH1-O 3.07Å; H275-P277 VanDerWaalsContact O-CD 3.25Å; H275-P277 WeakPolarHBondContact O-CD 3.26Å
278	R	68.7	Low	64.4	Low	101 Å²	101	80.8 Å²	80.8	38%	0.381	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-63.9	156.1	168.3	-72.8	-176.2	179.5	175.8	3	109.7	Y226 Y280	Y226-R278 HydrophobicContact CD1-CG 3.94Å; Y226-R278 VanDerWaalsContact CD1-NE 3.32Å; Y226-R278 HydrophobicContact CD2-CG 3.87Å; Y226-R278 HydrophobicContact CE1-CG 3.46Å; Y226-R278 VanDerWaalsContact CE1-CG 3.46Å; Y226-R278 HydrophobicContact CE2-CB 4.15Å; Y226-R278 HydrophobicContact CE2-CG 3.35Å; Y226-R278 HydrophobicContact CG-CG 4.12Å; Y226-R278 WeakPolarHBondContact OH-CG 3.37Å; R278-Y280 PolarHBondContact O-N 2.89Å
279	R	77.7	Confident	67.2	Low	7 Å²	7	74.7 Å²	74.7	3%	0.026	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-57.8	139.6	167.3	-60.7	-167.7	-173.5	-106.3	4	109	L184 D186 D187 L189 E193 S281 S282	L184-R279 PolarHBondContact O-NH1 2.71Å; L184-R279 PolarHBondContact O-NH2 3.01Å; D186-R279 PolarHBondContact O-NH1 3.16Å; D187-R279 CarbonylContact O-C 3.57Å; D187-R279 VanDerWaalsContact O-CA 3.25Å; D187-R279 WeakPolarHBondContact O-CA 3.26Å; D187-R279 WeakPolarHBondContact O-CB 3.18Å; L189-R279 VanDerWaalsContact O-CD 3.29Å; L189-R279 WeakPolarHBondContact O-CD 3.45Å; E193-R279 WeakPolarHBondContact OE1-CD 3.41Å; E193-R279 IonicContact OE1-CZ 3.07Å; E193-R279 IonicContact OE1-NE 3.32Å; E193-R279 PolarHBondContact OE1-NE 3.33Å; E193-R279 IonicContact OE1-NH2 3.37Å; E193-R279 IonicContact OE2-NH2 3.57Å; R279-S281 PolarHBondContact O-N 3.07Å; R279-S282 PolarHBondContact O-N 3.42Å
280	Y	62.6	Low	70	Confident	197 Å²	197	67.8 Å²	67.8	77%	0.773	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.6	-174.7	-175.7	-102.2	0	0	0	112.8	D187 R278 S282	D187-Y280 PolarHBondContact O-N 2.82Å; R278-Y280 PolarHBondContact O-N 2.89Å; Y280-S282 VanDerWaalsContact C-N 3.29Å; Y280-S282 PolarHBondContact O-N 3.3Å
281	S	66.1	Low	72.5	Confident	7 Å²	7	63.6 Å²	63.6	5%	0.049	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21	178.3	58.2	0	0	0	0	114.6	L189 C190 R279 Q283 P575	L189-S281 PolarHBondContact O-OG 3.43Å; C190-S281 WeakPolarHBondContact SG-CB 3.44Å; R279-S281 PolarHBondContact O-N 3.07Å; S281-Q283 PolarHBondContact O-N 3.09Å; S281-P575 WeakPolarHBondContact O-CD 3.14Å
282	S	72.1	Confident	75.1	Confident	49 Å²	49	56.1 Å²	56.1	34%	0.343	28%	0.283	S	S	.	.			trans	-70.1	124.1	-180	-67.3	0	0	0	0	112.4	R279 Y280	R279-S282 PolarHBondContact O-N 3.42Å; Y280-S282 VanDerWaalsContact C-N 3.29Å; Y280-S282 PolarHBondContact O-N 3.3Å
283	Q	80.3	Confident	77.2	Confident	59 Å²	59	53.6 Å²	53.6	28%	0.276	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	153.6	178.5	-68	178.9	28.8	0	0	111.7	S281 F285 Q572 C573	S281-Q283 PolarHBondContact O-N 3.09Å; Q283-F285 HydrophobicContact CB-CE2 3.64Å; Q283-F285 HydrophobicContact CB-CZ 3.69Å; Q283-Q572 CarbonylContact O-C 3.51Å; Q283-Q572 WeakPolarHBondContact O-CA 2.93Å; Q283-C573 PolarHBondContact N-O 3.29Å; Q283-C573 PolarHBondContact O-N 3.34Å
284	E	86.8	Confident	78.8	Confident	55 Å²	55	53.1 Å²	53.1	26%	0.257	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	130.5	175	-47.8	-166.6	138.7	0	0	109.8	I519 K520 T570 L571 Q572	E284-I519 HydrophobicContact CB-CG2 4.05Å; E284-I519 WeakPolarHBondContact OE2-CA 3.14Å; E284-K520 PolarHBondContact OE2-N 3.45Å; E284-T570 HydrophobicContact CB-CG2 3.94Å; E284-L571 CarbonylContact C-O 3.58Å; E284-L571 WeakPolarHBondContact CA-O 3.41Å; E284-Q572 HydrophobicContact CG-CG 4.01Å; E284-Q572 PolarHBondContact OE1-NE2 2.77Å
285	F	89.4	Confident	80.3	Confident	9 Å²	9	50.9 Å²	50.9	4%	0.039	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	140.7	-178.2	-61.1	-83.5	0	0	0	110.6	Q283 L304 T570 L571 C573 P575 L580	Q283-F285 HydrophobicContact CB-CE2 3.64Å; Q283-F285 HydrophobicContact CB-CZ 3.69Å; F285-L304 HydrophobicContact CB-CD1 4.14Å; F285-L304 HydrophobicContact CB-CG 4.22Å; F285-L304 HydrophobicContact CD1-CD1 4.3Å; F285-L304 HydrophobicContact CD1-CD2 3.96Å; F285-L304 HydrophobicContact CD1-CG 4.36Å; F285-L304 HydrophobicContact CG-CD1 4.2Å; F285-T570 WeakPolarHBondContact O-CA 3.37Å; F285-L571 PolarHBondContact N-O 3.1Å; F285-L571 PolarHBondContact O-N 3.1Å; F285-C573 VanDerWaalsContact CD2-SG 3.54Å; F285-C573 WeakPolarHBondContact CE2-SG 3.03Å; F285-P575 HydrophobicContact CZ-CB 4.45Å; F285-L580 HydrophobicContact CE1-CD1 3.81Å; F285-L580 HydrophobicContact CE1-CD2 4.29Å; F285-L580 HydrophobicContact CZ-CD1 3.71Å
286	L	94.2	Very high	81.6	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124	169.1	169.4	65.7	0	0	0	108.7	Y305 W312 T517 I519 T526 L543 C568	L286-Y305 HydrophobicContact CB-CD1 4.33Å; L286-Y305 HydrophobicContact CD2-CD1 4.24Å; L286-Y305 HydrophobicContact CD2-CG 4.24Å; L286-Y305 PolarHBondContact O-N 2.72Å; L286-W312 HydrophobicContact CD2-CH2 3.75Å; L286-W312 HydrophobicContact CD2-CZ2 4.43Å; L286-W312 HydrophobicContact CG-CH2 4.15Å; L286-W312 HydrophobicContact CG-CZ3 4.49Å; L286-T517 HydrophobicContact CD1-CG2 3.45Å; L286-T517 VanDerWaalsContact CD1-CG2 3.45Å; L286-I519 HydrophobicContact CB-CD1 3.49Å; L286-I519 VanDerWaalsContact CB-CD1 3.49Å; L286-T526 HydrophobicContact CD1-CG2 4.47Å; L286-T526 HydrophobicContact CD2-CG2 4.02Å; L286-L543 HydrophobicContact CD2-CD1 3.6Å; L286-C568 VanDerWaalsContact CD1-SG 3.6Å
287	I	95.2	Very high	82.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	135	176.7	-57.6	-177.5	0	0	0	110.7	V289 V302 L303 L304 I334 C568 L569 L571	I287-V289 HydrophobicContact CG2-CG2 4.03Å; I287-V302 HydrophobicContact CG2-CG1 4.02Å; I287-L303 CarbonylContact C-O 3.34Å; I287-L303 VanDerWaalsContact CA-O 3.3Å; I287-L303 WeakPolarHBondContact CA-O 3.36Å; I287-L304 HydrophobicContact CD1-CD1 4.3Å; I287-L304 HydrophobicContact CG1-CB 4.41Å; I287-L304 HydrophobicContact CG1-CD1 4.44Å; I287-L304 HydrophobicContact CG1-CG 4.37Å; I287-I334 HydrophobicContact CB-CD1 4.33Å; I287-I334 HydrophobicContact CD1-CD1 3.79Å; I287-I334 HydrophobicContact CG2-CD1 3.68Å; I287-C568 WeakPolarHBondContact O-CA 3.48Å; I287-L569 PolarHBondContact N-O 3.26Å; I287-L569 PolarHBondContact O-N 3.37Å; I287-L571 HydrophobicContact CD1-CB 3.5Å; I287-L571 HydrophobicContact CD1-CD2 3.39Å; I287-L571 HydrophobicContact CD1-CG 4.06Å; I287-L571 HydrophobicContact CG1-CB 4.21Å
288	I	95.8	Very high	84.2	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.8	172.9	-67.7	-175.9	0	0	0	109.3	V302 L303 W312 T526 L559 L563 H566 G567	I288-V302 CarbonylContact O-C 3.54Å; I288-V302 VanDerWaalsContact O-CA 3.3Å; I288-V302 WeakPolarHBondContact O-CA 3.41Å; I288-L303 HydrophobicContact CB-CB 4.38Å; I288-L303 PolarHBondContact N-O 3.11Å; I288-L303 PolarHBondContact O-N 3.2Å; I288-W312 HydrophobicContact CB-CZ3 4.26Å; I288-W312 HydrophobicContact CD1-CH2 3.25Å; I288-W312 HydrophobicContact CD1-CZ2 4.07Å; I288-W312 HydrophobicContact CD1-CZ3 3.59Å; I288-W312 HydrophobicContact CG1-CH2 3.79Å; I288-W312 HydrophobicContact CG1-CZ3 3.75Å; I288-T526 HydrophobicContact CD1-CG2 3.99Å; I288-L559 HydrophobicContact CD1-CD2 3.39Å; I288-L559 HydrophobicContact CD1-CG 3.97Å; I288-L563 HydrophobicContact CG2-CD2 3.36Å; I288-H566 HydrophobicContact CG2-CB 4.08Å; I288-G567 CarbonylContact C-O 3.59Å; I288-G567 VanDerWaalsContact CA-O 3.28Å; I288-G567 WeakPolarHBondContact CA-O 3.5Å
289	V	96.6	Very high	85.4	Confident	6 Å²	6	42.9 Å²	42.9	4%	0.036	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.2	-177.3	-173.5	0	0	0	0	110.3	I287 V302 A327 I334 V336 W363 G567 L569	I287-V289 HydrophobicContact CG2-CG2 4.03Å; V289-V302 HydrophobicContact CG1-CG2 4.44Å; V289-V302 HydrophobicContact CG2-CG1 4.37Å; V289-A327 HydrophobicContact CB-CB 4.36Å; V289-I334 HydrophobicContact CG2-CD1 4.37Å; V289-I334 HydrophobicContact CG2-CG2 4.04Å; V289-V336 HydrophobicContact CG1-CG2 3.73Å; V289-W363 HydrophobicContact CG1-CH2 4.35Å; V289-G567 PolarHBondContact N-O 3.01Å; V289-G567 PolarHBondContact O-N 2.94Å; V289-L569 HydrophobicContact CG2-CD1 4.27Å
290	G	94.5	Very high	86.2	Confident	6 Å²	6	46.5 Å²	46.5	6%	0.062	22%	0.222	C	C	.	.			trans	62.6	-143.9	171.8	0	0	0	0	0	113.4	T299 D301 H566	G290-T299 VanDerWaalsContact C-CG2 3.44Å; G290-T299 WeakPolarHBondContact O-CG2 3.21Å; G290-D301 PolarHBondContact N-O 2.97Å; G290-H566 WeakPolarHBondContact O-CB 3.37Å
291	G	93.1	Very high	87.7	Confident	7 Å²	7	38.5 Å²	38.5	7%	0.072	19%	0.192	C	C	.	.			trans	93.3	-163.1	-175.4	0	0	0	0	0	113.4	T298 T299 F564	G291-T298 CarbonylContact O-C 3.58Å; G291-T298 WeakPolarHBondContact O-CA 3.33Å; G291-T299 PolarHBondContact O-N 2.89Å; G291-F564 CarbonylContact C-O 3.59Å; G291-F564 WeakPolarHBondContact CA-O 3.45Å
292	R	92.6	Very high	89.2	Confident	31 Å²	31	38.2 Å²	38.2	12%	0.117	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-129.1	135.3	-174.9	-64.6	177.6	74.1	-168.3	8.3	111.2	Q296 Q297 L563 F564	R292-Q296 PolarHBondContact NE-O 3.07Å; R292-Q296 VanDerWaalsContact NH2-CG 3.35Å; R292-Q296 PolarHBondContact NH2-O 2.95Å; R292-Q296 VanDerWaalsContact NH2-O 3.1Å; R292-Q297 WeakPolarHBondContact CA-O 3Å; R292-L563 WeakPolarHBondContact O-CA 3.4Å; R292-F564 HydrophobicContact CB-CD1 4.27Å; R292-F564 HydrophobicContact CB-CD2 4.23Å; R292-F564 HydrophobicContact CB-CE1 3.72Å; R292-F564 HydrophobicContact CB-CE2 3.69Å; R292-F564 HydrophobicContact CB-CG 4.49Å; R292-F564 HydrophobicContact CB-CZ 3.37Å; R292-F564 HydrophobicContact CG-CE2 4.23Å; R292-F564 HydrophobicContact CG-CZ 4.24Å; R292-F564 PolarHBondContact N-O 3.09Å; R292-F564 WeakPolarHBondContact O-CD1 3.34Å; R292-F564 WeakPolarHBondContact O-CE1 3.38Å; R292-F564 PolarHBondContact O-N 3.38Å
293	K	89.9	Confident	90.3	Very high	52 Å²	52	36.2 Å²	36.2	23%	0.226	18%	0.175	C	C	.	.			trans	-86.7	175.2	176.6	-52.5	-166.2	-175.6	-163.1	0	111.1	N295 Q296 Q297 T299 D301 H561 L563	K293-N295 VanDerWaalsContact C-N 3.25Å; K293-N295 PolarHBondContact O-N 3.26Å; K293-N295 VanDerWaalsContact O-N 3.14Å; K293-Q296 VanDerWaalsContact O-CA 3.29Å; K293-Q296 WeakPolarHBondContact O-CA 2.93Å; K293-Q296 PolarHBondContact O-N 2.75Å; K293-Q297 PolarHBondContact N-O 3.41Å; K293-T299 VanDerWaalsContact CE-CB 3.46Å; K293-T299 VanDerWaalsContact CE-OG1 3.27Å; K293-T299 WeakPolarHBondContact CE-OG1 3.25Å; K293-D301 WeakPolarHBondContact CE-OD2 3.49Å; K293-D301 IonicContact NZ-OD2 3.97Å; K293-D301 PolarHBondContact NZ-OD2 3.31Å; K293-H561 WeakPolarHBondContact CE-NE2 3.01Å; K293-H561 PolarHBondContact NZ-CE1 3.44Å; K293-L563 HydrophobicContact CG-CD1 4.44Å
294	D	78.9	Confident	90.9	Very high	85 Å²	85	33.9 Å²	33.9	46%	0.455	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-40.2	-178.4	-72.2	-41.4	0	0	0	115.1	Q296 D539 K562	D294-Q296 PolarHBondContact O-N 2.78Å; D294-Q296 VanDerWaalsContact O-N 3.1Å; D294-D539 WeakPolarHBondContact OD1-CB 3.49Å; D294-K562 WeakPolarHBondContact OD1-CB 3.39Å; D294-K562 WeakPolarHBondContact OD1-CD 3.46Å; D294-K562 WeakPolarHBondContact OD2-CD 2.91Å
295	N	77.4	Confident	91.1	Very high	106 Å²	106	32 Å²	32	57%	0.567	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	17.8	176.7	61.9	-8.6	0	0	0	112.8	K293 Q297	K293-N295 VanDerWaalsContact C-N 3.25Å; K293-N295 PolarHBondContact O-N 3.26Å; K293-N295 VanDerWaalsContact O-N 3.14Å; N295-Q297 PolarHBondContact ND2-OE1 2.92Å; N295-Q297 PolarHBondContact O-N 2.69Å; N295-Q297 WeakPolarHBondContact OD1-CB 3.43Å; N295-Q297 PolarHBondContact OD1-N 2.89Å
296	Q	78.1	Confident	91	Very high	111 Å²	111	32.6 Å²	32.6	52%	0.519	16%	0.159	S	C	.	.	S	Bend	trans	61.4	9.6	-179.3	-83.6	-168.6	63.5	0	0	114.7	R292 K293 D294 F564	R292-Q296 PolarHBondContact NE-O 3.07Å; R292-Q296 VanDerWaalsContact NH2-CG 3.35Å; R292-Q296 PolarHBondContact NH2-O 2.95Å; R292-Q296 VanDerWaalsContact NH2-O 3.1Å; K293-Q296 VanDerWaalsContact O-CA 3.29Å; K293-Q296 WeakPolarHBondContact O-CA 2.93Å; K293-Q296 PolarHBondContact O-N 2.75Å; D294-Q296 PolarHBondContact O-N 2.78Å; D294-Q296 VanDerWaalsContact O-N 3.1Å; Q296-F564 HydrophobicContact CG-CZ 4.37Å
297	Q	86.9	Confident	90.3	Very high	99 Å²	99	36.5 Å²	36.5	46%	0.463	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-77.9	129.4	-178.8	-168.5	179.2	21.5	0	0	110.4	R292 K293 N295 T299	R292-Q297 WeakPolarHBondContact CA-O 3Å; K293-Q297 PolarHBondContact N-O 3.41Å; N295-Q297 PolarHBondContact ND2-OE1 2.92Å; N295-Q297 PolarHBondContact O-N 2.69Å; N295-Q297 WeakPolarHBondContact OD1-CB 3.43Å; N295-Q297 PolarHBondContact OD1-N 2.89Å; Q297-T299 PolarHBondContact O-N 3.01Å
298	T	91.1	Very high	89.7	Confident	7 Å²	7	44.3 Å²	44.3	4%	0.043	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-69.3	128.9	175.8	-54.7	0	0	0	0	110.3	G291 R321 L322	G291-T298 CarbonylContact O-C 3.58Å; G291-T298 WeakPolarHBondContact O-CA 3.33Å; T298-R321 HydrophobicContact CG2-CB 4.07Å; T298-R321 PolarHBondContact O-NH1 3.43Å; T298-L322 WeakPolarHBondContact CG2-O 3.44Å
299	T	93.6	Very high	89.2	Confident	5 Å²	5	48 Å²	48	3%	0.031	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-97.5	156.4	178	-165.7	0	0	0	0	112.4	G290 G291 K293 Q297 D301 L563	G290-T299 VanDerWaalsContact C-CG2 3.44Å; G290-T299 WeakPolarHBondContact O-CG2 3.21Å; G291-T299 PolarHBondContact O-N 2.89Å; K293-T299 VanDerWaalsContact CE-CB 3.46Å; K293-T299 VanDerWaalsContact CE-OG1 3.27Å; K293-T299 WeakPolarHBondContact CE-OG1 3.25Å; Q297-T299 PolarHBondContact O-N 3.01Å; T299-D301 HydrophobicContact CG2-CB 4.38Å; T299-D301 PolarHBondContact OG1-N 3.34Å; T299-D301 PolarHBondContact OG1-OD2 3.07Å; T299-L563 HydrophobicContact CG2-CD1 3.92Å
300	R	95.1	Very high	88.6	Confident	84 Å²	84	51.8 Å²	51.8	32%	0.317	26%	0.263	S	S	.	.			trans	-106.5	2.1	172	-61.6	169.2	54.9	-172.2	-3.5	111.5	K317 L318 P319 R321	R300-K317 HydrophobicContact CB-CB 4.05Å; R300-K317 CarbonylContact O-C 3.55Å; R300-K317 VanDerWaalsContact O-CA 3.29Å; R300-K317 WeakPolarHBondContact O-CA 3.4Å; R300-L318 HydrophobicContact CB-CB 4.21Å; R300-L318 PolarHBondContact NE-O 2.96Å; R300-L318 PolarHBondContact NH2-O 3.01Å; R300-L318 PolarHBondContact O-N 3.4Å; R300-P319 PolarHBondContact NH2-O 3.24Å; R300-R321 HydrophobicContact CG-CB 4.42Å; R300-R321 HydrophobicContact CG-CG 3.51Å
301	D	95.3	Very high	88.4	Confident	29 Å²	29	57.5 Å²	57.5	16%	0.155	29%	0.288	C	S	.	.			trans	-67.9	143.1	-171.8	-60	-27.3	0	0	0	110.2	G290 K293 T299 L303 K317 H561	G290-D301 PolarHBondContact N-O 2.97Å; K293-D301 WeakPolarHBondContact CE-OD2 3.49Å; K293-D301 IonicContact NZ-OD2 3.97Å; K293-D301 PolarHBondContact NZ-OD2 3.31Å; T299-D301 HydrophobicContact CG2-CB 4.38Å; T299-D301 PolarHBondContact OG1-N 3.34Å; T299-D301 PolarHBondContact OG1-OD2 3.07Å; D301-L303 HydrophobicContact CB-CG 4.49Å; D301-K317 WeakPolarHBondContact OD1-CE 3.28Å; D301-H561 IonicContact OD2-CE1 3.09Å
302	V	95.9	Very high	88.4	Confident	1 Å²	1	59 Å²	59	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	117.4	175.3	-176.5	0	0	0	0	105.3	I287 I288 V289 L315 A316 W363	I287-V302 HydrophobicContact CG2-CG1 4.02Å; I288-V302 CarbonylContact O-C 3.54Å; I288-V302 VanDerWaalsContact O-CA 3.3Å; I288-V302 WeakPolarHBondContact O-CA 3.41Å; V289-V302 HydrophobicContact CG1-CG2 4.44Å; V289-V302 HydrophobicContact CG2-CG1 4.37Å; V302-L315 HydrophobicContact CB-CB 4.05Å; V302-L315 HydrophobicContact CG1-CB 3.96Å; V302-L315 HydrophobicContact CG1-CD1 4.04Å; V302-L315 PolarHBondContact O-N 2.83Å; V302-A316 WeakPolarHBondContact CG2-O 3.45Å; V302-W363 HydrophobicContact CG2-CZ2 3.68Å
303	L	94.9	Very high	88.4	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.8	-170.3	-56.6	174.9	0	0	0	109.8	I287 I288 D301 W312 L313 P560	I287-L303 CarbonylContact C-O 3.34Å; I287-L303 VanDerWaalsContact CA-O 3.3Å; I287-L303 WeakPolarHBondContact CA-O 3.36Å; I288-L303 HydrophobicContact CB-CB 4.38Å; I288-L303 PolarHBondContact N-O 3.11Å; I288-L303 PolarHBondContact O-N 3.2Å; D301-L303 HydrophobicContact CB-CG 4.49Å; L303-W312 HydrophobicContact CB-CD2 4.5Å; L303-W312 HydrophobicContact CB-CE3 3.61Å; L303-W312 HydrophobicContact CB-CZ3 4.14Å; L303-L313 CarbonylContact C-O 3.4Å; L303-L313 WeakPolarHBondContact CA-O 3.44Å; L303-P560 HydrophobicContact CD1-CG 3.97Å
304	L	93.5	Very high	88.5	Confident	10 Å²	10	62.9 Å²	62.9	5%	0.052	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	130	172.8	-178.2	151	0	0	0	108.9	F285 I287 W312 L313 L315 L358 L580	F285-L304 HydrophobicContact CB-CD1 4.14Å; F285-L304 HydrophobicContact CB-CG 4.22Å; F285-L304 HydrophobicContact CD1-CD1 4.3Å; F285-L304 HydrophobicContact CD1-CD2 3.96Å; F285-L304 HydrophobicContact CD1-CG 4.36Å; F285-L304 HydrophobicContact CG-CD1 4.2Å; I287-L304 HydrophobicContact CD1-CD1 4.3Å; I287-L304 HydrophobicContact CG1-CB 4.41Å; I287-L304 HydrophobicContact CG1-CD1 4.44Å; I287-L304 HydrophobicContact CG1-CG 4.37Å; L304-W312 CarbonylContact O-C 3.57Å; L304-W312 WeakPolarHBondContact O-CA 3.44Å; L304-L313 HydrophobicContact CD2-CD1 4.18Å; L304-L313 PolarHBondContact N-O 3.2Å; L304-L313 PolarHBondContact O-N 3.32Å; L304-L315 HydrophobicContact CB-CD1 3.95Å; L304-L315 HydrophobicContact CB-CG 4.28Å; L304-L315 HydrophobicContact CD1-CD1 4.38Å; L304-L358 HydrophobicContact CD1-CD1 4.44Å; L304-L580 HydrophobicContact CD2-CD2 4.21Å
305	Y	91.7	Very high	89.3	Confident	17 Å²	17	59.8 Å²	59.8	7%	0.067	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	120.3	176.8	175.1	-105.5	0	0	0	110.5	L286 N310 W312 L543	L286-Y305 HydrophobicContact CB-CD1 4.33Å; L286-Y305 HydrophobicContact CD2-CD1 4.24Å; L286-Y305 HydrophobicContact CD2-CG 4.24Å; L286-Y305 PolarHBondContact O-N 2.72Å; Y305-N310 VanDerWaalsContact CE2-OD1 3.24Å; Y305-N310 WeakPolarHBondContact CE2-OD1 3.46Å; Y305-N310 PolarHBondContact OH-OD1 3.28Å; Y305-W312 HydrophobicContact CD2-CD2 4.15Å; Y305-W312 AromaticContact CD2-CE2 3.79Å; Y305-W312 HydrophobicContact CD2-CH2 4.46Å; Y305-W312 AromaticContact CD2-CZ2 3.97Å; Y305-W312 HydrophobicContact CD2-CZ2 3.97Å; Y305-W312 HydrophobicContact CG-CH2 4.42Å; Y305-W312 HydrophobicContact CG-CZ2 4.37Å; Y305-L543 HydrophobicContact CD2-CD2 4.07Å; Y305-L543 HydrophobicContact CE1-CD2 4.23Å; Y305-L543 HydrophobicContact CE2-CD2 3.61Å
306	D	86.3	Confident	90.1	Very high	21 Å²	21	56 Å²	56	11%	0.112	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	112.2	171.5	176.2	17.3	0	0	0	110.3	K308 T309 N310 Q311 L313	D306-K308 PolarHBondContact O-N 3.37Å; D306-K308 WeakPolarHBondContact OD1-CB 3.41Å; D306-K308 PolarHBondContact OD1-N 3.43Å; D306-T309 WeakPolarHBondContact CB-OG1 3.39Å; D306-T309 VanDerWaalsContact CG-OG1 3.29Å; D306-T309 WeakPolarHBondContact OD2-CB 3.22Å; D306-T309 VanDerWaalsContact OD2-CG2 3.23Å; D306-T309 WeakPolarHBondContact OD2-CG2 3.27Å; D306-T309 PolarHBondContact OD2-N 2.97Å; D306-T309 PolarHBondContact OD2-OG1 3.36Å; D306-N310 VanDerWaalsContact O-CA 3.28Å; D306-N310 WeakPolarHBondContact O-CA 3.16Å; D306-N310 PolarHBondContact O-N 2.81Å; D306-Q311 PolarHBondContact N-O 3.22Å; D306-Q311 PolarHBondContact O-N 3.21Å; D306-L313 HydrophobicContact CB-CD1 4.46Å
307	S	81	Confident	90.9	Very high	82 Å²	82	56.7 Å²	56.7	57%	0.573	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.5	178.2	65.7	0	0	0	0	114.6
308	K	82.1	Confident	91.3	Very high	164 Å²	164	52.1 Å²	52.1	71%	0.713	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-45.5	-179.4	-65.5	177.9	-178.6	174.2	0	111.6	D306	D306-K308 PolarHBondContact O-N 3.37Å; D306-K308 WeakPolarHBondContact OD1-CB 3.41Å; D306-K308 PolarHBondContact OD1-N 3.43Å
309	T	84.4	Confident	91.4	Very high	80 Å²	80	54.6 Å²	54.6	49%	0.491	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-13	179.8	58.3	0	0	0	0	113.4	D306 Q311	D306-T309 WeakPolarHBondContact CB-OG1 3.39Å; D306-T309 VanDerWaalsContact CG-OG1 3.29Å; D306-T309 WeakPolarHBondContact OD2-CB 3.22Å; D306-T309 VanDerWaalsContact OD2-CG2 3.23Å; D306-T309 WeakPolarHBondContact OD2-CG2 3.27Å; D306-T309 PolarHBondContact OD2-N 2.97Å; D306-T309 PolarHBondContact OD2-OG1 3.36Å; T309-Q311 PolarHBondContact O-N 3.15Å
310	N	85.2	Confident	91.3	Very high	85 Å²	85	55.3 Å²	55.3	46%	0.455	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	38	-171.8	-163.7	11.6	0	0	0	112.1	Y305 D306 K556	Y305-N310 VanDerWaalsContact CE2-OD1 3.24Å; Y305-N310 WeakPolarHBondContact CE2-OD1 3.46Å; Y305-N310 PolarHBondContact OH-OD1 3.28Å; D306-N310 VanDerWaalsContact O-CA 3.28Å; D306-N310 WeakPolarHBondContact O-CA 3.16Å; D306-N310 PolarHBondContact O-N 2.81Å; N310-K556 PolarHBondContact ND2-O 3.47Å; N310-K556 PolarHBondContact OD1-O 3.27Å
311	Q	89.4	Confident	91.2	Very high	126 Å²	126	56.1 Å²	56.1	59%	0.589	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	159.9	-179.1	-65.3	-169.6	-3.9	0	0	111.9	D306 T309	D306-Q311 PolarHBondContact N-O 3.22Å; D306-Q311 PolarHBondContact O-N 3.21Å; T309-Q311 PolarHBondContact O-N 3.15Å
312	W	92.6	Very high	91.1	Very high	38 Å²	38	55.1 Å²	55.1	14%	0.144	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.8	177	-67.3	90.4	0	0	0	110.5	L286 I288 L303 L304 Y305 L543 K558 L559 P560	L286-W312 HydrophobicContact CD2-CH2 3.75Å; L286-W312 HydrophobicContact CD2-CZ2 4.43Å; L286-W312 HydrophobicContact CG-CH2 4.15Å; L286-W312 HydrophobicContact CG-CZ3 4.49Å; I288-W312 HydrophobicContact CB-CZ3 4.26Å; I288-W312 HydrophobicContact CD1-CH2 3.25Å; I288-W312 HydrophobicContact CD1-CZ2 4.07Å; I288-W312 HydrophobicContact CD1-CZ3 3.59Å; I288-W312 HydrophobicContact CG1-CH2 3.79Å; I288-W312 HydrophobicContact CG1-CZ3 3.75Å; L303-W312 HydrophobicContact CB-CD2 4.5Å; L303-W312 HydrophobicContact CB-CE3 3.61Å; L303-W312 HydrophobicContact CB-CZ3 4.14Å; L304-W312 CarbonylContact O-C 3.57Å; L304-W312 WeakPolarHBondContact O-CA 3.44Å; Y305-W312 HydrophobicContact CD2-CD2 4.15Å; Y305-W312 AromaticContact CD2-CE2 3.79Å; Y305-W312 HydrophobicContact CD2-CH2 4.46Å; Y305-W312 AromaticContact CD2-CZ2 3.97Å; Y305-W312 HydrophobicContact CD2-CZ2 3.97Å; Y305-W312 HydrophobicContact CG-CH2 4.42Å; Y305-W312 HydrophobicContact CG-CZ2 4.37Å; W312-L543 HydrophobicContact CZ2-CD2 4.3Å; W312-K558 PolarHBondContact NE1-O 2.75Å; W312-L559 HydrophobicContact CZ2-CG 4.08Å; W312-P560 HydrophobicContact CB-CG 3.68Å; W312-P560 HydrophobicContact CG-CG 3.73Å
313	L	92.4	Very high	90.9	Very high	65 Å²	65	57.7 Å²	57.7	34%	0.34	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	133	175.4	-68.4	165.1	0	0	0	109.6	L303 L304 D306 L580	L303-L313 CarbonylContact C-O 3.4Å; L303-L313 WeakPolarHBondContact CA-O 3.44Å; L304-L313 HydrophobicContact CD2-CD1 4.18Å; L304-L313 PolarHBondContact N-O 3.2Å; L304-L313 PolarHBondContact O-N 3.32Å; D306-L313 HydrophobicContact CB-CD1 4.46Å; L313-L580 HydrophobicContact CD1-CD2 3.9Å
314	S	93.6	Very high	90.8	Very high	99 Å²	99	59 Å²	59	69%	0.692	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.1	176.8	-66.5	0	0	0	0	110.8
315	L	94.1	Very high	90.8	Very high	20 Å²	20	59.7 Å²	59.7	11%	0.105	32%	0.315	C	S	.	.			trans	-97.8	178.2	175.1	-61	178.7	0	0	0	110.9	V302 L304 K317 Y356 L358	V302-L315 HydrophobicContact CB-CB 4.05Å; V302-L315 HydrophobicContact CG1-CB 3.96Å; V302-L315 HydrophobicContact CG1-CD1 4.04Å; V302-L315 PolarHBondContact O-N 2.83Å; L304-L315 HydrophobicContact CB-CD1 3.95Å; L304-L315 HydrophobicContact CB-CG 4.28Å; L304-L315 HydrophobicContact CD1-CD1 4.38Å; L315-K317 PolarHBondContact O-N 3.48Å; L315-Y356 HydrophobicContact CD1-CE1 4.07Å; L315-L358 HydrophobicContact CD1-CD1 3.94Å; L315-L358 HydrophobicContact CD2-CD1 4.44Å
316	A	94.3	Very high	91	Very high	28 Å²	28	59.1 Å²	59.1	23%	0.231	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-58.3	131.1	178.4	0	0	0	0	0	111.2	V302 Y356 N361 W363	V302-A316 WeakPolarHBondContact CG2-O 3.45Å; A316-Y356 HydrophobicContact CB-CE2 4.11Å; A316-N361 WeakPolarHBondContact CB-O 3.24Å; A316-N361 VanDerWaalsContact CB-OD1 3.23Å; A316-N361 WeakPolarHBondContact CB-OD1 3.33Å; A316-N361 PolarHBondContact N-OD1 2.78Å; A316-W363 PolarHBondContact O-NE1 2.92Å
317	K	96.3	Very high	91.5	Very high	124 Å²	124	58.8 Å²	58.8	54%	0.539	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-67.7	141	-175.9	-67.8	179.2	177.5	174.2	0	110.9	R300 D301 L315 W363	R300-K317 HydrophobicContact CB-CB 4.05Å; R300-K317 CarbonylContact O-C 3.55Å; R300-K317 VanDerWaalsContact O-CA 3.29Å; R300-K317 WeakPolarHBondContact O-CA 3.4Å; D301-K317 WeakPolarHBondContact OD1-CE 3.28Å; L315-K317 PolarHBondContact O-N 3.48Å; K317-W363 VanDerWaalsContact O-CD1 3.32Å; K317-W363 PolarHBondContact O-NE1 2.89Å
318	L	94.7	Very high	92.2	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-50	141.3	173.2	-170.6	66.8	0	0	0	110.5	R300 A320 L322 V336 Y354 W363	R300-L318 HydrophobicContact CB-CB 4.21Å; R300-L318 PolarHBondContact NE-O 2.96Å; R300-L318 PolarHBondContact NH2-O 3.01Å; R300-L318 PolarHBondContact O-N 3.4Å; L318-A320 VanDerWaalsContact C-N 3.31Å; L318-A320 WeakPolarHBondContact CD2-O 3.13Å; L318-A320 PolarHBondContact O-N 2.69Å; L318-L322 HydrophobicContact CD2-CD1 4.15Å; L318-L322 HydrophobicContact CD2-CG 4.45Å; L318-V336 HydrophobicContact CD1-CB 4.12Å; L318-V336 HydrophobicContact CD1-CG1 4.29Å; L318-V336 HydrophobicContact CD1-CG2 3.91Å; L318-V336 HydrophobicContact CD2-CG1 4.35Å; L318-Y354 HydrophobicContact CD1-CD2 4.48Å; L318-W363 HydrophobicContact CD1-CD2 4.11Å; L318-W363 HydrophobicContact CD1-CE3 3.91Å; L318-W363 HydrophobicContact CD1-CH2 3.51Å; L318-W363 HydrophobicContact CD1-CZ2 3.73Å; L318-W363 HydrophobicContact CD1-CZ3 3.6Å
319	P	93.6	Very high	92.8	Very high	58 Å²	58	49.1 Å²	49.1	38%	0.377	27%	0.266	S	S	.	.	S	Bend	trans	-61.8	-35.7	-175.6	-28.1	37.9	0	0	0	114	R300 Y354 W363	R300-P319 PolarHBondContact NH2-O 3.24Å; P319-Y354 HydrophobicContact CB-CD1 4.3Å; P319-Y354 HydrophobicContact CB-CE1 3.95Å; P319-Y354 HydrophobicContact CG-CD1 3.82Å; P319-Y354 HydrophobicContact CG-CE1 3.99Å; P319-Y354 HydrophobicContact CG-CG 4.41Å; P319-W363 HydrophobicContact CG-CB 3.56Å; P319-W363 HydrophobicContact CG-CG 3.96Å
320	A	91.3	Very high	93.1	Very high	21 Å²	21	45.9 Å²	45.9	17%	0.174	25%	0.246	C	C	.	.	S	Bend	trans	-122.8	155.1	-178	0	0	0	0	0	112.4	L318 L322 Y354	L318-A320 VanDerWaalsContact C-N 3.31Å; L318-A320 WeakPolarHBondContact CD2-O 3.13Å; L318-A320 PolarHBondContact O-N 2.69Å; A320-L322 HydrophobicContact CB-CD2 4.21Å; A320-L322 HydrophobicContact CB-CG 4.22Å; A320-L322 PolarHBondContact O-N 2.82Å; A320-Y354 HydrophobicContact CB-CE2 4.45Å
321	R	92.4	Very high	93	Very high	100 Å²	100	44.2 Å²	44.2	38%	0.377	24%	0.235	S	C	.	.			trans	-82.6	103.9	168.2	-75.7	-178.2	-164.8	-78.7	-0.2	108.7	T298 R300 P341 V342	T298-R321 HydrophobicContact CG2-CB 4.07Å; T298-R321 PolarHBondContact O-NH1 3.43Å; R300-R321 HydrophobicContact CG-CB 4.42Å; R300-R321 HydrophobicContact CG-CG 3.51Å; R321-P341 CarbonylContact O-C 3.58Å; R321-P341 VanDerWaalsContact O-CA 3.3Å; R321-P341 WeakPolarHBondContact O-CA 3.19Å; R321-V342 PolarHBondContact O-N 2.75Å
322	L	93.3	Very high	92.7	Very high	9 Å²	9	40.8 Å²	40.8	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.2	-176.3	-63.6	173.8	0	0	0	112.1	T298 L318 A320 A325 V336 G338 P341 Y354	T298-L322 WeakPolarHBondContact CG2-O 3.44Å; L318-L322 HydrophobicContact CD2-CD1 4.15Å; L318-L322 HydrophobicContact CD2-CG 4.45Å; A320-L322 HydrophobicContact CB-CD2 4.21Å; A320-L322 HydrophobicContact CB-CG 4.22Å; A320-L322 PolarHBondContact O-N 2.82Å; L322-A325 HydrophobicContact CB-CB 3.83Å; L322-A325 HydrophobicContact CD1-CB 4.06Å; L322-V336 HydrophobicContact CD1-CG1 3.86Å; L322-G338 WeakPolarHBondContact CD1-O 3.34Å; L322-P341 HydrophobicContact CD2-CB 4.32Å; L322-P341 HydrophobicContact CD2-CG 4.03Å; L322-Y354 HydrophobicContact CD1-CD2 4.12Å; L322-Y354 HydrophobicContact CD1-CE2 4Å
323	Y	92.2	Very high	92.6	Very high	54 Å²	54	40 Å²	40	21%	0.212	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	125.6	171.2	176.6	-116.7	0	0	0	110.3	A325 G339 M340 Y374	Y323-A325 VanDerWaalsContact C-N 3.27Å; Y323-A325 PolarHBondContact O-N 2.9Å; Y323-G339 CarbonylContact O-C 3.5Å; Y323-G339 WeakPolarHBondContact O-CA 3.4Å; Y323-M340 WeakPolarHBondContact CB-O 3.4Å; Y323-M340 HydrophobicContact CD1-CB 4.28Å; Y323-M340 HydrophobicContact CD1-CE 4.29Å; Y323-M340 PolarHBondContact N-O 2.91Å; Y323-M340 PolarHBondContact O-N 3.32Å; Y323-Y374 HydrophobicContact CD1-CD2 4.3Å; Y323-Y374 HydrophobicContact CE1-CD2 4.34Å; Y323-Y374 HydrophobicContact CE1-CE2 4.27Å
324	K	92.3	Very high	92.7	Very high	33 Å²	33	36.9 Å²	36.9	14%	0.143	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	42.9	176.6	-64.7	-172.9	169.9	-166.3	0	114.4	Y374 S375 H423	K324-Y374 HydrophobicContact CB-CD2 4.36Å; K324-S375 WeakPolarHBondContact CD-OG 3.04Å; K324-S375 PolarHBondContact O-N 3.5Å; K324-H423 PolarHBondContact NZ-CE1 2.8Å; K324-H423 PolarHBondContact NZ-NE2 3.31Å
325	A	94.7	Very high	92.9	Very high	26 Å²	26	32.3 Å²	32.3	22%	0.215	18%	0.175	C	C	.	.			trans	-72.9	158.3	165	0	0	0	0	0	110.6	L322 Y323 V336	L322-A325 HydrophobicContact CB-CB 3.83Å; L322-A325 HydrophobicContact CD1-CB 4.06Å; Y323-A325 VanDerWaalsContact C-N 3.27Å; Y323-A325 PolarHBondContact O-N 2.9Å; A325-V336 HydrophobicContact CB-CG1 3.83Å
326	S	95.8	Very high	93	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.028	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	132	171.7	-170.7	0	0	0	0	110.1	V336 L337 H376 S378	S326-V336 WeakPolarHBondContact O-CA 3.44Å; S326-L337 PolarHBondContact N-O 3.03Å; S326-L337 VanDerWaalsContact N-O 3.08Å; S326-L337 PolarHBondContact O-N 2.94Å; S326-H376 WeakPolarHBondContact CB-NE2 3.39Å; S326-S378 WeakPolarHBondContact OG-CB 3.42Å; S326-S378 PolarHBondContact OG-N 2.88Å
327	A	96.1	Very high	93.1	Very high	14 Å²	14	30.2 Å²	30.2	12%	0.116	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	145.2	173.2	0	0	0	0	0	110.5	V289 Y335 V336 L569	V289-A327 HydrophobicContact CB-CB 4.36Å; A327-Y335 CarbonylContact C-O 3.58Å; A327-Y335 VanDerWaalsContact CA-O 3.25Å; A327-Y335 WeakPolarHBondContact CA-O 3.35Å; A327-V336 HydrophobicContact CB-CG2 4.27Å; A327-L569 HydrophobicContact CB-CD1 3.98Å; A327-L569 HydrophobicContact CB-CG 4.49Å
328	V	95.8	Very high	93.1	Very high	10 Å²	10	24.3 Å²	24.3	6%	0.061	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.9	178.5	66.4	0	0	0	0	110.5	Y335 L337 A380 I385	V328-Y335 PolarHBondContact N-O 2.77Å; V328-Y335 PolarHBondContact O-N 2.97Å; V328-L337 HydrophobicContact CG1-CD1 3.81Å; V328-A380 HydrophobicContact CG2-CB 3.53Å; V328-A380 VanDerWaalsContact CG2-N 3.32Å; V328-I385 HydrophobicContact CG1-CD1 3.71Å; V328-I385 HydrophobicContact CG1-CG1 4.06Å; V328-I385 HydrophobicContact CG1-CG2 3.84Å
329	S	93.9	Very high	93.1	Very high	34 Å²	34	24.1 Å²	24.1	24%	0.238	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.2	171.8	52	0	0	0	0	110.9	N333 A380 T570	S329-N333 WeakPolarHBondContact CA-O 3.48Å; S329-A380 WeakPolarHBondContact O-CB 3.45Å; S329-T570 WeakPolarHBondContact CB-O 3.48Å; S329-T570 PolarHBondContact OG-O 2.84Å
330	L	90.6	Very high	93	Very high	12 Å²	12	23.3 Å²	23.3	6%	0.063	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	129.9	177.7	177.1	64.7	0	0	0	109.7	S332 N333 Y335 A380 N382 I385	L330-S332 PolarHBondContact O-N 3.17Å; L330-N333 PolarHBondContact N-O 2.84Å; L330-N333 PolarHBondContact O-N 2.78Å; L330-Y335 HydrophobicContact CB-CD2 4.09Å; L330-Y335 HydrophobicContact CB-CE2 3.82Å; L330-Y335 HydrophobicContact CD2-CE2 4.47Å; L330-Y335 HydrophobicContact CG-CE2 4.46Å; L330-A380 HydrophobicContact CB-CB 4.21Å; L330-A380 HydrophobicContact CD1-CB 4.16Å; L330-N382 WeakPolarHBondContact CD1-O 3.29Å; L330-I385 HydrophobicContact CD2-CD1 4.06Å; L330-I385 HydrophobicContact CD2-CG1 3.76Å
331	H	83.8	Confident	93	Very high	49 Å²	49	24.1 Å²	24.1	23%	0.227	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	53.2	-179.5	-49	128.1	0	0	0	114.2	H228 P229 N333 N383	H228-H331 VanDerWaalsContact CD2-CB 3.4Å; H228-H331 WeakPolarHBondContact CD2-CB 3.46Å; P229-H331 WeakPolarHBondContact CG-CE1 3.35Å; P229-H331 WeakPolarHBondContact CG-NE2 3.42Å; H331-N333 PolarHBondContact O-N 2.95Å; H331-N333 PolarHBondContact O-ND2 2.91Å; H331-N383 PolarHBondContact CE1-OD1 3.01Å; H331-N383 VanDerWaalsContact CE1-OD1 3.29Å; H331-N383 PolarHBondContact NE2-OD1 2.82Å; H331-N383 VanDerWaalsContact NE2-OD1 3.09Å
332	S	83.6	Confident	92.7	Very high	54 Å²	54	22.8 Å²	22.8	38%	0.378	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	11.5	179.5	-44.2	0	0	0	0	115.3	L330 Q572	L330-S332 PolarHBondContact O-N 3.17Å; S332-Q572 WeakPolarHBondContact CB-O 3.35Å; S332-Q572 PolarHBondContact OG-O 2.62Å
333	N	90.1	Very high	92	Very high	22 Å²	22	26 Å²	26	12%	0.118	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	158.3	173	-65.2	-58.3	0	0	0	110.8	S329 L330 H331 Y335 I355 Y356	S329-N333 WeakPolarHBondContact CA-O 3.48Å; L330-N333 PolarHBondContact N-O 2.84Å; L330-N333 PolarHBondContact O-N 2.78Å; H331-N333 PolarHBondContact O-N 2.95Å; H331-N333 PolarHBondContact O-ND2 2.91Å; N333-Y335 HydrophobicContact CB-CE2 3.85Å; N333-I355 HydrophobicContact CB-CG2 3.97Å; N333-Y356 PolarHBondContact OD1-O 2.9Å
334	I	95.1	Very high	90.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.9	173.8	-57.7	170.1	0	0	0	108.7	I287 V289 V336 I355 Y356 W363 L569 L571	I287-I334 HydrophobicContact CB-CD1 4.33Å; I287-I334 HydrophobicContact CD1-CD1 3.79Å; I287-I334 HydrophobicContact CG2-CD1 3.68Å; V289-I334 HydrophobicContact CG2-CD1 4.37Å; V289-I334 HydrophobicContact CG2-CG2 4.04Å; I334-V336 HydrophobicContact CG2-CG2 4.48Å; I334-I355 CarbonylContact O-C 3.58Å; I334-I355 WeakPolarHBondContact O-CA 3.33Å; I334-Y356 HydrophobicContact CB-CD1 4.42Å; I334-Y356 HydrophobicContact CD1-CD1 3.84Å; I334-Y356 HydrophobicContact CD1-CE1 4.41Å; I334-Y356 HydrophobicContact CG1-CD1 4.3Å; I334-Y356 PolarHBondContact N-O 3.02Å; I334-Y356 VanDerWaalsContact N-O 3.17Å; I334-Y356 PolarHBondContact O-N 2.71Å; I334-W363 HydrophobicContact CG2-CH2 4.28Å; I334-L569 HydrophobicContact CG1-CD1 4.37Å; I334-L569 HydrophobicContact CG2-CD1 3.63Å; I334-L571 HydrophobicContact CG1-CD1 4.1Å; I334-L571 HydrophobicContact CG1-CD2 4.43Å
335	Y	96.4	Very high	89.3	Confident	3 Å²	3	38.9 Å²	38.9	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.4	176.2	-66.2	-108.9	0	0	0	109.1	A327 V328 L330 N333 I353 Y354 I355 I385 Y404	A327-Y335 CarbonylContact C-O 3.58Å; A327-Y335 VanDerWaalsContact CA-O 3.25Å; A327-Y335 WeakPolarHBondContact CA-O 3.35Å; V328-Y335 PolarHBondContact N-O 2.77Å; V328-Y335 PolarHBondContact O-N 2.97Å; L330-Y335 HydrophobicContact CB-CD2 4.09Å; L330-Y335 HydrophobicContact CB-CE2 3.82Å; L330-Y335 HydrophobicContact CD2-CE2 4.47Å; L330-Y335 HydrophobicContact CG-CE2 4.46Å; N333-Y335 HydrophobicContact CB-CE2 3.85Å; Y335-I353 HydrophobicContact CD1-CG2 4.16Å; Y335-Y354 CarbonylContact C-O 3.6Å; Y335-Y354 VanDerWaalsContact CA-O 3.28Å; Y335-Y354 WeakPolarHBondContact CA-O 3.47Å; Y335-I355 HydrophobicContact CD1-CD1 3.98Å; Y335-I355 HydrophobicContact CD1-CG1 3.62Å; Y335-I355 HydrophobicContact CE1-CB 4.42Å; Y335-I355 HydrophobicContact CE1-CD1 3.25Å; Y335-I355 HydrophobicContact CE1-CG1 3.44Å; Y335-I355 VanDerWaalsContact CE1-CG1 3.44Å; Y335-I355 HydrophobicContact CE1-CG2 4.23Å; Y335-I355 HydrophobicContact CE2-CG2 4.33Å; Y335-I355 HydrophobicContact CG-CG1 4.44Å; Y335-I385 HydrophobicContact CD1-CD1 3.42Å; Y335-I385 VanDerWaalsContact CD1-CD1 3.42Å; Y335-I385 HydrophobicContact CD2-CD1 3.75Å; Y335-I385 HydrophobicContact CE1-CD1 3.93Å; Y335-I385 HydrophobicContact CE2-CD1 4.24Å; Y335-I385 HydrophobicContact CG-CD1 3.34Å; Y335-Y404 HydrophobicContact CD1-CE1 4.23Å; Y335-Y404 HydrophobicContact CE1-CD1 4.46Å; Y335-Y404 AromaticContact CE1-CE1 3.67Å; Y335-Y404 HydrophobicContact CE1-CE1 3.67Å
336	V	97.3	Very high	88.1	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.2	171.7	179.9	0	0	0	0	108.2	V289 L318 L322 A325 S326 A327 I334 I353 Y354 W363	V289-V336 HydrophobicContact CG1-CG2 3.73Å; L318-V336 HydrophobicContact CD1-CB 4.12Å; L318-V336 HydrophobicContact CD1-CG1 4.29Å; L318-V336 HydrophobicContact CD1-CG2 3.91Å; L318-V336 HydrophobicContact CD2-CG1 4.35Å; L322-V336 HydrophobicContact CD1-CG1 3.86Å; A325-V336 HydrophobicContact CB-CG1 3.83Å; S326-V336 WeakPolarHBondContact O-CA 3.44Å; A327-V336 HydrophobicContact CB-CG2 4.27Å; I334-V336 HydrophobicContact CG2-CG2 4.48Å; V336-I353 WeakPolarHBondContact O-CA 3.34Å; V336-Y354 PolarHBondContact N-O 2.76Å; V336-Y354 PolarHBondContact O-N 3.01Å; V336-W363 HydrophobicContact CB-CZ3 4.41Å; V336-W363 HydrophobicContact CG2-CH2 3.69Å; V336-W363 HydrophobicContact CG2-CZ3 3.86Å
337	L	96.8	Very high	87.4	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.2	-172.1	-61	93.9	0	0	0	110.5	S326 V328 I353 M369 H376 I385	S326-L337 PolarHBondContact N-O 3.03Å; S326-L337 VanDerWaalsContact N-O 3.08Å; S326-L337 PolarHBondContact O-N 2.94Å; V328-L337 HydrophobicContact CG1-CD1 3.81Å; L337-I353 HydrophobicContact CD2-CD1 3.82Å; L337-I353 HydrophobicContact CD2-CG1 4.07Å; L337-I353 HydrophobicContact CG-CD1 4.4Å; L337-I353 HydrophobicContact CG-CG1 4.13Å; L337-I353 HydrophobicContact CG-CG2 4.17Å; L337-M369 HydrophobicContact CB-SD 3.87Å; L337-H376 PolarHBondContact O-CE1 2.86Å; L337-H376 PolarHBondContact O-NE2 2.82Å; L337-I385 HydrophobicContact CD1-CG2 4.07Å; L337-I385 HydrophobicContact CD2-CG2 3.87Å
338	G	95.4	Very high	87	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.284	C	S	.	.			trans	58	-138.5	172.2	0	0	0	0	0	114.4	L322 S350 N352	L322-G338 WeakPolarHBondContact CD1-O 3.34Å; G338-S350 VanDerWaalsContact CA-O 3.22Å; G338-S350 WeakPolarHBondContact CA-O 3.48Å; G338-N352 PolarHBondContact N-O 2.96Å
339	G	94.4	Very high	86.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.284	C	S	.	.			trans	90.4	-179.2	-174.4	0	0	0	0	0	112.9	Y323 S350 R373	Y323-G339 CarbonylContact O-C 3.5Å; Y323-G339 WeakPolarHBondContact O-CA 3.4Å; G339-S350 WeakPolarHBondContact O-CA 3.28Å; G339-S350 WeakPolarHBondContact O-CB 3.19Å; G339-S350 PolarHBondContact O-N 2.88Å; G339-R373 PolarHBondContact N-O 2.96Å
340	M	92.8	Very high	86.9	Confident	41 Å²	41	51.2 Å²	51.2	20%	0.202	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	114.3	-179.6	-132.3	173.8	65.4	0	0	109.5	Y323 V342 V349 Y374	Y323-M340 WeakPolarHBondContact CB-O 3.4Å; Y323-M340 HydrophobicContact CD1-CB 4.28Å; Y323-M340 HydrophobicContact CD1-CE 4.29Å; Y323-M340 PolarHBondContact N-O 2.91Å; Y323-M340 PolarHBondContact O-N 3.32Å; M340-V342 PolarHBondContact O-N 2.85Å; M340-V349 HydrophobicContact CG-CG2 4.35Å; M340-Y374 HydrophobicContact CB-CG 4.48Å; M340-Y374 HydrophobicContact SD-CD1 4.33Å; M340-Y374 HydrophobicContact SD-CE1 4.08Å; M340-Y374 HydrophobicContact SD-CE2 4.37Å
341	P	90.8	Very high	87.1	Confident	37 Å²	37	53.2 Å²	53.2	24%	0.24	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	121.5	178.6	-15.3	31.3	0	0	0	109.9	R321 L322 S343 S347 P348	R321-P341 CarbonylContact O-C 3.58Å; R321-P341 VanDerWaalsContact O-CA 3.3Å; R321-P341 WeakPolarHBondContact O-CA 3.19Å; L322-P341 HydrophobicContact CD2-CB 4.32Å; L322-P341 HydrophobicContact CD2-CG 4.03Å; P341-S343 PolarHBondContact O-N 2.74Å; P341-S347 WeakPolarHBondContact O-CB 3.49Å; P341-S347 PolarHBondContact O-OG 2.83Å; P341-S347 VanDerWaalsContact O-OG 3.12Å; P341-P348 WeakPolarHBondContact CD-O 3.43Å
342	V	86.8	Confident	87.7	Confident	72 Å²	72	53.5 Å²	53.5	44%	0.436	29%	0.29	S	S	.	.			trans	-87.9	109.3	179.2	-175.2	0	0	0	0	109	R321 M340	R321-V342 PolarHBondContact O-N 2.75Å; M340-V342 PolarHBondContact O-N 2.85Å
343	S	78.6	Confident	88.3	Confident	77 Å²	77	51 Å²	51	54%	0.538	27%	0.272	S	S	.	.			trans	-135.9	164.4	177.2	-176.6	0	0	0	0	110.6	P341 K345	P341-S343 PolarHBondContact O-N 2.74Å; S343-K345 PolarHBondContact O-N 2.95Å; S343-K345 VanDerWaalsContact O-O 3.06Å
344	N	63.5	Low	88.6	Confident	177 Å²	177	51.2 Å²	51.2	95%	0.947	27%	0.272	S	S	*	.	S	Bend	trans	-68.1	-13.1	176.5	-70.8	-3	0	0	0	113.1
345	K	64.1	Low	88.6	Confident	180 Å²	180	51.3 Å²	51.3	78%	0.783	27%	0.272	S	S	*	.	S	Bend	trans	-102.9	172.3	172.2	-66.1	-176.1	-179.8	-180	0	110	S343 S347	S343-K345 PolarHBondContact O-N 2.95Å; S343-K345 VanDerWaalsContact O-O 3.06Å; K345-S347 PolarHBondContact O-N 2.88Å
346	K	69.2	Low	88.5	Confident	209 Å²	209	51.2 Å²	51.2	91%	0.909	27%	0.272	S	S	*	.			trans	-36.9	129.3	175.9	-74.5	-176.4	177.1	-178.2	0	110.4	P348	K346-P348 VanDerWaalsContact C-CD 3.47Å; K346-P348 WeakPolarHBondContact O-CD 3.41Å
347	S	80.1	Confident	88.1	Confident	42 Å²	42	52.4 Å²	52.4	29%	0.294	28%	0.28	S	S	.	.			trans	-102.1	81.7	-177.5	-62.4	0	0	0	0	108.6	P341 K345	P341-S347 WeakPolarHBondContact O-CB 3.49Å; P341-S347 PolarHBondContact O-OG 2.83Å; P341-S347 VanDerWaalsContact O-OG 3.12Å; K345-S347 PolarHBondContact O-N 2.88Å
348	P	89.1	Confident	87.5	Confident	75 Å²	75	52.9 Å²	52.9	49%	0.487	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-65.6	156.9	179.9	30.4	-36.7	0	0	0	110.5	P341 K346	P341-P348 WeakPolarHBondContact CD-O 3.43Å; K346-P348 VanDerWaalsContact C-CD 3.47Å; K346-P348 WeakPolarHBondContact O-CD 3.41Å
349	V	93.1	Very high	86.8	Confident	12 Å²	12	57.7 Å²	57.7	7%	0.073	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-70.6	134.3	172.2	-173.6	0	0	0	0	108.7	M340 P372 R373 Y374	M340-V349 HydrophobicContact CG-CG2 4.35Å; V349-P372 HydrophobicContact CB-CB 4.22Å; V349-P372 HydrophobicContact CG1-CB 4.03Å; V349-P372 WeakPolarHBondContact O-CB 3.27Å; V349-R373 VanDerWaalsContact CG1-C 3.47Å; V349-R373 VanDerWaalsContact CG1-CA 3.42Å; V349-R373 VanDerWaalsContact CG1-N 3.28Å; V349-Y374 HydrophobicContact CB-CD1 4.4Å; V349-Y374 HydrophobicContact CG1-CD1 3.8Å; V349-Y374 HydrophobicContact CG2-CD1 3.69Å; V349-Y374 HydrophobicContact CG2-CE1 3.78Å
350	S	93.7	Very high	86.3	Confident	9 Å²	9	62.9 Å²	62.9	6%	0.063	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-93.4	146.3	-177.8	-170.7	0	0	0	0	111.5	G338 G339 N352 P372 R373	G338-S350 VanDerWaalsContact CA-O 3.22Å; G338-S350 WeakPolarHBondContact CA-O 3.48Å; G339-S350 WeakPolarHBondContact O-CA 3.28Å; G339-S350 WeakPolarHBondContact O-CB 3.19Å; G339-S350 PolarHBondContact O-N 2.88Å; S350-N352 WeakPolarHBondContact OG-CB 3.34Å; S350-N352 PolarHBondContact OG-N 2.68Å; S350-P372 WeakPolarHBondContact O-CA 3.33Å; S350-R373 PolarHBondContact O-N 2.9Å
351	D	95	Very high	86.2	Confident	55 Å²	55	63.6 Å²	63.6	29%	0.294	34%	0.335	S	S	.	.			trans	-107.9	-9.5	167.6	54.7	-2.1	0	0	0	112.4	I353 P368 M369 P372	D351-I353 PolarHBondContact O-N 3.33Å; D351-P368 HydrophobicContact CB-CB 4.2Å; D351-M369 HydrophobicContact CB-CB 3.95Å; D351-M369 VanDerWaalsContact O-CB 3.32Å; D351-M369 WeakPolarHBondContact O-CB 3.48Å; D351-M369 VanDerWaalsContact O-CG 3.22Å; D351-M369 WeakPolarHBondContact O-CG 3.32Å; D351-M369 PolarHBondContact O-N 3.45Å; D351-P372 HydrophobicContact CB-CB 3.96Å
352	N	95.3	Very high	86.3	Confident	55 Å²	55	67.7 Å²	67.7	29%	0.294	35%	0.351	S	S	.	.			trans	-51.9	140.1	178.4	-67.5	-18.6	0	0	0	114.1	G338 S350 Y354	G338-N352 PolarHBondContact N-O 2.96Å; S350-N352 WeakPolarHBondContact OG-CB 3.34Å; S350-N352 PolarHBondContact OG-N 2.68Å; N352-Y354 HydrophobicContact CB-CE2 3.96Å; N352-Y354 PolarHBondContact ND2-OH 3.41Å
353	I	96.3	Very high	86.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.8	169.3	-57.1	-178.6	0	0	0	108.5	Y335 V336 L337 D351 V366 E367 M369 Y404	Y335-I353 HydrophobicContact CD1-CG2 4.16Å; V336-I353 WeakPolarHBondContact O-CA 3.34Å; L337-I353 HydrophobicContact CD2-CD1 3.82Å; L337-I353 HydrophobicContact CD2-CG1 4.07Å; L337-I353 HydrophobicContact CG-CD1 4.4Å; L337-I353 HydrophobicContact CG-CG1 4.13Å; L337-I353 HydrophobicContact CG-CG2 4.17Å; D351-I353 PolarHBondContact O-N 3.33Å; I353-V366 HydrophobicContact CB-CG2 3.7Å; I353-V366 HydrophobicContact CG2-CG2 3.53Å; I353-V366 PolarHBondContact O-N 3.28Å; I353-V366 VanDerWaalsContact O-N 3.07Å; I353-E367 WeakPolarHBondContact CD1-O 3.29Å; I353-M369 HydrophobicContact CD1-CG 3.82Å; I353-M369 HydrophobicContact CG1-CG 3.74Å; I353-Y404 HydrophobicContact CD1-CD2 3.89Å; I353-Y404 HydrophobicContact CD1-CE2 4.35Å; I353-Y404 HydrophobicContact CD1-CG 4.21Å
354	Y	96.6	Very high	87.5	Confident	28 Å²	28	69.6 Å²	69.6	11%	0.11	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.4	175	-62.8	-70.3	0	0	0	110.5	L318 P319 A320 L322 Y335 V336 N352 R364	L318-Y354 HydrophobicContact CD1-CD2 4.48Å; P319-Y354 HydrophobicContact CB-CD1 4.3Å; P319-Y354 HydrophobicContact CB-CE1 3.95Å; P319-Y354 HydrophobicContact CG-CD1 3.82Å; P319-Y354 HydrophobicContact CG-CE1 3.99Å; P319-Y354 HydrophobicContact CG-CG 4.41Å; A320-Y354 HydrophobicContact CB-CE2 4.45Å; L322-Y354 HydrophobicContact CD1-CD2 4.12Å; L322-Y354 HydrophobicContact CD1-CE2 4Å; Y335-Y354 CarbonylContact C-O 3.6Å; Y335-Y354 VanDerWaalsContact CA-O 3.28Å; Y335-Y354 WeakPolarHBondContact CA-O 3.47Å; V336-Y354 PolarHBondContact N-O 2.76Å; V336-Y354 PolarHBondContact O-N 3.01Å; N352-Y354 HydrophobicContact CB-CE2 3.96Å; N352-Y354 PolarHBondContact ND2-OH 3.41Å; Y354-R364 CarbonylContact C-O 3.6Å; Y354-R364 WeakPolarHBondContact CA-O 3.46Å
355	I	95.5	Very high	88.9	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.1	173.1	-49.4	-175.7	0	0	0	109.1	N333 I334 Y335 W363 R364 V366	N333-I355 HydrophobicContact CB-CG2 3.97Å; I334-I355 CarbonylContact O-C 3.58Å; I334-I355 WeakPolarHBondContact O-CA 3.33Å; Y335-I355 HydrophobicContact CD1-CD1 3.98Å; Y335-I355 HydrophobicContact CD1-CG1 3.62Å; Y335-I355 HydrophobicContact CE1-CB 4.42Å; Y335-I355 HydrophobicContact CE1-CD1 3.25Å; Y335-I355 HydrophobicContact CE1-CG1 3.44Å; Y335-I355 VanDerWaalsContact CE1-CG1 3.44Å; Y335-I355 HydrophobicContact CE1-CG2 4.23Å; Y335-I355 HydrophobicContact CE2-CG2 4.33Å; Y335-I355 HydrophobicContact CG-CG1 4.44Å; I355-W363 CarbonylContact O-C 3.55Å; I355-W363 WeakPolarHBondContact O-CA 3.35Å; I355-R364 HydrophobicContact CB-CG 3.96Å; I355-R364 PolarHBondContact N-O 2.64Å; I355-R364 PolarHBondContact O-N 2.86Å; I355-V366 HydrophobicContact CD1-CB 4.13Å; I355-V366 HydrophobicContact CD1-CG1 3.29Å; I355-V366 HydrophobicContact CD1-CG2 3.84Å; I355-V366 HydrophobicContact CG1-CB 4.44Å; I355-V366 HydrophobicContact CG1-CG1 3.75Å; I355-V366 HydrophobicContact CG1-CG2 3.86Å
356	Y	94.5	Very high	90.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.4	170.9	175	-102.4	0	0	0	110.8	L315 A316 N333 I334 L358 N361 Q362 W363	L315-Y356 HydrophobicContact CD1-CE1 4.07Å; A316-Y356 HydrophobicContact CB-CE2 4.11Å; N333-Y356 PolarHBondContact OD1-O 2.9Å; I334-Y356 HydrophobicContact CB-CD1 4.42Å; I334-Y356 HydrophobicContact CD1-CD1 3.84Å; I334-Y356 HydrophobicContact CD1-CE1 4.41Å; I334-Y356 HydrophobicContact CG1-CD1 4.3Å; I334-Y356 PolarHBondContact N-O 3.02Å; I334-Y356 VanDerWaalsContact N-O 3.17Å; I334-Y356 PolarHBondContact O-N 2.71Å; Y356-L358 HydrophobicContact CE1-CB 4.17Å; Y356-L358 HydrophobicContact CE1-CD1 3.86Å; Y356-N361 PolarHBondContact OH-OD1 3.23Å; Y356-Q362 WeakPolarHBondContact CA-O 3.28Å; Y356-W363 AromaticContact CD2-CD1 3.81Å; Y356-W363 AromaticContact CD2-CD2 3.95Å; Y356-W363 HydrophobicContact CD2-CD2 3.95Å; Y356-W363 AromaticContact CD2-CE2 3.58Å; Y356-W363 HydrophobicContact CD2-CG 4.09Å; Y356-W363 HydrophobicContact CD2-CZ2 4.04Å; Y356-W363 AromaticContact CD2-NE1 3.47Å; Y356-W363 HydrophobicContact CG-CD2 4.26Å; Y356-W363 AromaticContact CG-CE2 3.92Å; Y356-W363 HydrophobicContact CG-CH2 4.33Å; Y356-W363 AromaticContact CG-CZ2 3.96Å; Y356-W363 HydrophobicContact CG-CZ2 3.96Å
357	S	89.1	Confident	91.4	Very high	28 Å²	28	52 Å²	52	20%	0.196	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	117.7	170.1	176.4	0	0	0	0	108.9	K359 L360 N361 Q362	S357-K359 VanDerWaalsContact C-N 3.31Å; S357-K359 PolarHBondContact O-N 2.88Å; S357-L360 PolarHBondContact OG-N 2.85Å; S357-N361 WeakPolarHBondContact O-CA 3.45Å; S357-N361 PolarHBondContact O-N 2.84Å; S357-Q362 PolarHBondContact N-O 2.8Å; S357-Q362 PolarHBondContact O-N 2.98Å
358	L	84.2	Confident	92.1	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.063	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-39.3	176	-173.3	71.7	0	0	0	111.3	L304 L315 Y356 L360 N361 L571 C573 L579	L304-L358 HydrophobicContact CD1-CD1 4.44Å; L315-L358 HydrophobicContact CD1-CD1 3.94Å; L315-L358 HydrophobicContact CD2-CD1 4.44Å; Y356-L358 HydrophobicContact CE1-CB 4.17Å; Y356-L358 HydrophobicContact CE1-CD1 3.86Å; L358-L360 VanDerWaalsContact C-N 3.33Å; L358-L360 PolarHBondContact O-N 2.83Å; L358-N361 PolarHBondContact O-N 2.6Å; L358-L571 HydrophobicContact CB-CD2 4.18Å; L358-L571 HydrophobicContact CD1-CD2 4.47Å; L358-L571 HydrophobicContact CD2-CD2 3.89Å; L358-L571 HydrophobicContact CG-CD2 4.41Å; L358-C573 HydrophobicContact CD2-CB 4.04Å; L358-C573 WeakPolarHBondContact CD2-SG 3Å; L358-L579 HydrophobicContact CG-CD1 4.43Å; L358-L579 WeakPolarHBondContact O-CD1 3.48Å
359	K	79.5	Confident	92.4	Very high	100 Å²	100	48.9 Å²	48.9	44%	0.435	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-43.9	179.6	-175.3	175.9	-167	161.5	0	112.6	E192 S357 Y576	E192-K359 IonicContact OE2-NZ 3.55Å; E192-K359 PolarHBondContact OE2-NZ 2.85Å; S357-K359 VanDerWaalsContact C-N 3.31Å; S357-K359 PolarHBondContact O-N 2.88Å; K359-Y576 HydrophobicContact CB-CE2 4.11Å; K359-Y576 WeakPolarHBondContact CD-OH 3.18Å; K359-Y576 HydrophobicContact CG-CE1 4.43Å; K359-Y576 HydrophobicContact CG-CE2 4.27Å; K359-Y576 WeakPolarHBondContact CG-OH 3.29Å
360	L	84.6	Confident	92.5	Very high	109 Å²	109	52.8 Å²	52.8	57%	0.571	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-9.8	-179.6	-60.9	177.6	0	0	0	113	S357 L358 Q362	S357-L360 PolarHBondContact OG-N 2.85Å; L358-L360 VanDerWaalsContact C-N 3.33Å; L358-L360 PolarHBondContact O-N 2.83Å; L360-Q362 HydrophobicContact CB-CB 4.11Å; L360-Q362 HydrophobicContact CB-CG 4.45Å; L360-Q362 WeakPolarHBondContact O-CG 3.39Å; L360-Q362 PolarHBondContact O-N 3.4Å
361	N	89.8	Confident	92.6	Very high	56 Å²	56	54.6 Å²	54.6	30%	0.299	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	46.1	-168.8	-170.7	19.9	0	0	0	111.8	A316 Y356 S357 L358	A316-N361 WeakPolarHBondContact CB-O 3.24Å; A316-N361 VanDerWaalsContact CB-OD1 3.23Å; A316-N361 WeakPolarHBondContact CB-OD1 3.33Å; A316-N361 PolarHBondContact N-OD1 2.78Å; Y356-N361 PolarHBondContact OH-OD1 3.23Å; S357-N361 WeakPolarHBondContact O-CA 3.45Å; S357-N361 PolarHBondContact O-N 2.84Å; L358-N361 PolarHBondContact O-N 2.6Å
362	Q	93.3	Very high	92.6	Very high	123 Å²	123	53.2 Å²	53.2	58%	0.575	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	148.7	-172.3	-79.4	175.2	17.3	0	0	112.1	Y356 S357 L360	Y356-Q362 WeakPolarHBondContact CA-O 3.28Å; S357-Q362 PolarHBondContact N-O 2.8Å; S357-Q362 PolarHBondContact O-N 2.98Å; L360-Q362 HydrophobicContact CB-CB 4.11Å; L360-Q362 HydrophobicContact CB-CG 4.45Å; L360-Q362 WeakPolarHBondContact O-CG 3.39Å; L360-Q362 PolarHBondContact O-N 3.4Å
363	W	96.3	Very high	92.6	Very high	39 Å²	39	50.6 Å²	50.6	15%	0.148	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.8	175	-70.3	92.7	0	0	0	110.7	V289 V302 A316 K317 L318 P319 I334 V336 I355 Y356	V289-W363 HydrophobicContact CG1-CH2 4.35Å; V302-W363 HydrophobicContact CG2-CZ2 3.68Å; A316-W363 PolarHBondContact O-NE1 2.92Å; K317-W363 VanDerWaalsContact O-CD1 3.32Å; K317-W363 PolarHBondContact O-NE1 2.89Å; L318-W363 HydrophobicContact CD1-CD2 4.11Å; L318-W363 HydrophobicContact CD1-CE3 3.91Å; L318-W363 HydrophobicContact CD1-CH2 3.51Å; L318-W363 HydrophobicContact CD1-CZ2 3.73Å; L318-W363 HydrophobicContact CD1-CZ3 3.6Å; P319-W363 HydrophobicContact CG-CB 3.56Å; P319-W363 HydrophobicContact CG-CG 3.96Å; I334-W363 HydrophobicContact CG2-CH2 4.28Å; V336-W363 HydrophobicContact CB-CZ3 4.41Å; V336-W363 HydrophobicContact CG2-CH2 3.69Å; V336-W363 HydrophobicContact CG2-CZ3 3.86Å; I355-W363 CarbonylContact O-C 3.55Å; I355-W363 WeakPolarHBondContact O-CA 3.35Å; Y356-W363 AromaticContact CD2-CD1 3.81Å; Y356-W363 AromaticContact CD2-CD2 3.95Å; Y356-W363 HydrophobicContact CD2-CD2 3.95Å; Y356-W363 AromaticContact CD2-CE2 3.58Å; Y356-W363 HydrophobicContact CD2-CG 4.09Å; Y356-W363 HydrophobicContact CD2-CZ2 4.04Å; Y356-W363 AromaticContact CD2-NE1 3.47Å; Y356-W363 HydrophobicContact CG-CD2 4.26Å; Y356-W363 AromaticContact CG-CE2 3.92Å; Y356-W363 HydrophobicContact CG-CH2 4.33Å; Y356-W363 AromaticContact CG-CZ2 3.96Å; Y356-W363 HydrophobicContact CG-CZ2 3.96Å
364	R	95	Very high	92.6	Very high	151 Å²	151	51.7 Å²	51.7	57%	0.57	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	148.9	169.3	64.1	179.4	-177.2	176.8	1.9	110.5	Y354 I355 V366	Y354-R364 CarbonylContact C-O 3.6Å; Y354-R364 WeakPolarHBondContact CA-O 3.46Å; I355-R364 HydrophobicContact CB-CG 3.96Å; I355-R364 PolarHBondContact N-O 2.64Å; I355-R364 PolarHBondContact O-N 2.86Å; R364-V366 HydrophobicContact CG-CG1 4.46Å
365	S	93.8	Very high	92.4	Very high	75 Å²	75	50.5 Å²	50.5	52%	0.524	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	145.4	168.4	-161.2	0	0	0	0	109.3
366	V	93.5	Very high	92.4	Very high	25 Å²	25	50.8 Å²	50.8	15%	0.152	26%	0.257	C	S	.	.			trans	-126.5	-168.4	173.8	-64.3	0	0	0	0	111	I353 I355 R364 Y404 N409	I353-V366 HydrophobicContact CB-CG2 3.7Å; I353-V366 HydrophobicContact CG2-CG2 3.53Å; I353-V366 PolarHBondContact O-N 3.28Å; I353-V366 VanDerWaalsContact O-N 3.07Å; I355-V366 HydrophobicContact CD1-CB 4.13Å; I355-V366 HydrophobicContact CD1-CG1 3.29Å; I355-V366 HydrophobicContact CD1-CG2 3.84Å; I355-V366 HydrophobicContact CG1-CB 4.44Å; I355-V366 HydrophobicContact CG1-CG1 3.75Å; I355-V366 HydrophobicContact CG1-CG2 3.86Å; R364-V366 HydrophobicContact CG-CG1 4.46Å; V366-Y404 HydrophobicContact CG2-CE2 4.25Å; V366-N409 WeakPolarHBondContact CB-OD1 3.49Å
367	E	92.3	Very high	92.4	Very high	96 Å²	96	54.6 Å²	54.6	45%	0.449	27%	0.272	S	S	.	.	S	Bend	trans	-54.6	129.3	179.9	-165.4	62.7	-157	0	0	109.8	I353 N409	I353-E367 WeakPolarHBondContact CD1-O 3.29Å; E367-N409 WeakPolarHBondContact CB-O 3.05Å; E367-N409 WeakPolarHBondContact CB-OD1 3.49Å; E367-N409 PolarHBondContact N-OD1 3.37Å
368	P	94.8	Very high	92.7	Very high	46 Å²	46	53.5 Å²	53.5	30%	0.299	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-69.1	162.4	-179.3	28.6	-34.5	0	0	0	111.9	D351 C411	D351-P368 HydrophobicContact CB-CB 4.2Å; P368-C411 PolarHBondContact O-SG 2.94Å
369	M	95.3	Very high	93.3	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.025	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-59.1	152.7	169.6	-65.7	177.2	79.2	0	0	110.9	L337 D351 I353 V371 R373 E402	L337-M369 HydrophobicContact CB-SD 3.87Å; D351-M369 HydrophobicContact CB-CB 3.95Å; D351-M369 VanDerWaalsContact O-CB 3.32Å; D351-M369 WeakPolarHBondContact O-CB 3.48Å; D351-M369 VanDerWaalsContact O-CG 3.22Å; D351-M369 WeakPolarHBondContact O-CG 3.32Å; D351-M369 PolarHBondContact O-N 3.45Å; I353-M369 HydrophobicContact CD1-CG 3.82Å; I353-M369 HydrophobicContact CG1-CG 3.74Å; M369-V371 VanDerWaalsContact C-N 3.29Å; M369-V371 PolarHBondContact O-N 2.83Å; M369-R373 HydrophobicContact CE-CG 3.45Å; M369-R373 VanDerWaalsContact CE-CG 3.45Å; M369-R373 HydrophobicContact SD-CG 4.22Å; M369-E402 WeakPolarHBondContact CA-OE1 3.04Å; M369-E402 WeakPolarHBondContact CB-OE1 3.48Å; M369-E402 HydrophobicContact CE-CG 4.45Å; M369-E402 WeakPolarHBondContact CE-OE1 3.24Å; M369-E402 WeakPolarHBondContact CG-OE1 3.41Å
370	L	95.2	Very high	94	Very high	94 Å²	94	51 Å²	51	49%	0.492	26%	0.26	S	S	.	.	S	Bend	trans	-69.2	-32.6	175.7	-66.4	175.8	0	0	0	111.9	E402 C411	L370-E402 PolarHBondContact N-OE2 3.31Å; L370-C411 HydrophobicContact CD1-CB 4.37Å; L370-C411 HydrophobicContact CD2-CB 4.11Å; L370-C411 HydrophobicContact CG-CB 3.75Å
371	V	94.3	Very high	94.3	Very high	48 Å²	48	47.2 Å²	47.2	29%	0.291	24%	0.238	S	C	.	.	S	Bend	trans	-130.3	121.9	-179.5	-176.2	0	0	0	0	109.7	M369 R373 L398 E402	M369-V371 VanDerWaalsContact C-N 3.29Å; M369-V371 PolarHBondContact O-N 2.83Å; V371-R373 PolarHBondContact O-N 2.81Å; V371-R373 PolarHBondContact O-NE 2.79Å; V371-L398 HydrophobicContact CG1-CD1 3.7Å; V371-L398 HydrophobicContact CG1-CD2 4.35Å; V371-E402 PolarHBondContact N-OE2 3.47Å
372	P	95.6	Very high	94.1	Very high	25 Å²	25	47.6 Å²	47.6	16%	0.162	24%	0.24	C	C	.	.			trans	-62.8	131.7	175.3	25.9	-33.9	0	0	0	110.1	V349 S350 D351 E393	V349-P372 HydrophobicContact CB-CB 4.22Å; V349-P372 HydrophobicContact CG1-CB 4.03Å; V349-P372 WeakPolarHBondContact O-CB 3.27Å; S350-P372 WeakPolarHBondContact O-CA 3.33Å; D351-P372 HydrophobicContact CB-CB 3.96Å; P372-E393 HydrophobicContact CG-CB 4.18Å
373	R	95.8	Very high	93.8	Very high	1 Å²	1	42 Å²	42	0%	0.004	21%	0.214	C	C	.	.			trans	-151.9	147.6	-175.8	58.3	179	88.1	-154.6	8.8	114.1	G339 V349 S350 M369 V371 H376 G389 I391 L398 S400 E402	G339-R373 PolarHBondContact N-O 2.96Å; V349-R373 VanDerWaalsContact CG1-C 3.47Å; V349-R373 VanDerWaalsContact CG1-CA 3.42Å; V349-R373 VanDerWaalsContact CG1-N 3.28Å; S350-R373 PolarHBondContact O-N 2.9Å; M369-R373 HydrophobicContact CE-CG 3.45Å; M369-R373 VanDerWaalsContact CE-CG 3.45Å; M369-R373 HydrophobicContact SD-CG 4.22Å; V371-R373 PolarHBondContact O-N 2.81Å; V371-R373 PolarHBondContact O-NE 2.79Å; R373-H376 HydrophobicContact CG-CB 4.21Å; R373-H376 WeakPolarHBondContact CG-ND1 3.5Å; R373-H376 PolarHBondContact O-CE1 2.99Å; R373-H376 PolarHBondContact O-ND1 3.17Å; R373-G389 PolarHBondContact NH1-O 3.41Å; R373-G389 VanDerWaalsContact NH1-O 3.15Å; R373-I391 VanDerWaalsContact CA-O 3.29Å; R373-I391 WeakPolarHBondContact CA-O 3.36Å; R373-L398 HydrophobicContact CB-CD1 3.84Å; R373-S400 PolarHBondContact NH1-O 3.12Å; R373-S400 PolarHBondContact NH2-OG 2.78Å; R373-E402 IonicContact CZ-OE2 4Å; R373-E402 IonicContact NE-OE2 2.67Å; R373-E402 IonicContact NH2-OE2 3.62Å; R373-E402 PolarHBondContact NH2-OE2 3.25Å
374	Y	94.9	Very high	93.6	Very high	22 Å²	22	40.9 Å²	40.9	9%	0.086	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-132.9	164.8	169.5	74.5	-75	0	0	0	110.9	Y323 K324 M340 V349 H376 G390 I391 Q395	Y323-Y374 HydrophobicContact CD1-CD2 4.3Å; Y323-Y374 HydrophobicContact CE1-CD2 4.34Å; Y323-Y374 HydrophobicContact CE1-CE2 4.27Å; K324-Y374 HydrophobicContact CB-CD2 4.36Å; M340-Y374 HydrophobicContact CB-CG 4.48Å; M340-Y374 HydrophobicContact SD-CD1 4.33Å; M340-Y374 HydrophobicContact SD-CE1 4.08Å; M340-Y374 HydrophobicContact SD-CE2 4.37Å; V349-Y374 HydrophobicContact CB-CD1 4.4Å; V349-Y374 HydrophobicContact CG1-CD1 3.8Å; V349-Y374 HydrophobicContact CG2-CD1 3.69Å; V349-Y374 HydrophobicContact CG2-CE1 3.78Å; Y374-H376 PolarHBondContact O-N 3.19Å; Y374-H376 VanDerWaalsContact O-N 3.09Å; Y374-G390 CarbonylContact O-C 3.53Å; Y374-G390 VanDerWaalsContact O-CA 3.26Å; Y374-G390 WeakPolarHBondContact O-CA 3.23Å; Y374-I391 HydrophobicContact CD1-CB 3.92Å; Y374-I391 HydrophobicContact CD1-CG2 4.37Å; Y374-I391 WeakPolarHBondContact CD1-O 3.44Å; Y374-I391 HydrophobicContact CE1-CB 3.42Å; Y374-I391 VanDerWaalsContact CE1-CB 3.42Å; Y374-I391 HydrophobicContact CE1-CD1 4.29Å; Y374-I391 HydrophobicContact CE1-CG1 4.38Å; Y374-I391 HydrophobicContact CE1-CG2 3.49Å; Y374-I391 VanDerWaalsContact CE1-CG2 3.49Å; Y374-I391 HydrophobicContact CE2-CB 4.47Å; Y374-I391 HydrophobicContact CE2-CD1 3.99Å; Y374-I391 PolarHBondContact N-O 2.86Å; Y374-I391 VanDerWaalsContact N-O 3.13Å; Y374-I391 PolarHBondContact O-N 3.19Å; Y374-I391 WeakPolarHBondContact OH-CD1 3.47Å; Y374-Q395 PolarHBondContact OH-OE1 3.39Å
375	S	93.7	Very high	93.6	Very high	4 Å²	4	33.7 Å²	33.7	3%	0.028	18%	0.183	C	C	.	.	S	Bend	trans	60.4	15.3	-173.4	-46.4	0	0	0	0	114.3	K324 H423	K324-S375 WeakPolarHBondContact CD-OG 3.04Å; K324-S375 PolarHBondContact O-N 3.5Å; S375-H423 WeakPolarHBondContact CB-NE2 3.28Å; S375-H423 PolarHBondContact O-N 2.86Å; S375-H423 VanDerWaalsContact O-N 3.1Å
376	H	94.9	Very high	93.8	Very high	8 Å²	8	30.2 Å²	30.2	4%	0.037	16%	0.158	C	C	.	.			trans	-83.9	170.4	173.9	69.4	-84.1	0	0	0	110.1	S326 L337 R373 Y374 S378 F388 G389	S326-H376 WeakPolarHBondContact CB-NE2 3.39Å; L337-H376 PolarHBondContact O-CE1 2.86Å; L337-H376 PolarHBondContact O-NE2 2.82Å; R373-H376 HydrophobicContact CG-CB 4.21Å; R373-H376 WeakPolarHBondContact CG-ND1 3.5Å; R373-H376 PolarHBondContact O-CE1 2.99Å; R373-H376 PolarHBondContact O-ND1 3.17Å; Y374-H376 PolarHBondContact O-N 3.19Å; Y374-H376 VanDerWaalsContact O-N 3.09Å; H376-S378 PolarHBondContact CD2-OG 3.04Å; H376-S378 PolarHBondContact NE2-OG 2.83Å; H376-F388 WeakPolarHBondContact CB-O 3.48Å; H376-G389 VanDerWaalsContact CB-O 3.29Å; H376-G389 WeakPolarHBondContact CB-O 3.34Å
377	R	94.6	Very high	93.9	Very high	79 Å²	79	29.1 Å²	29.1	30%	0.298	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.2	170	-160.8	71.8	179.9	-171.1	0.1	110.1	F388 P424 V426	R377-F388 PolarHBondContact N-O 2.86Å; R377-F388 VanDerWaalsContact N-O 3.09Å; R377-F388 WeakPolarHBondContact O-CD2 3.41Å; R377-F388 PolarHBondContact O-N 2.9Å; R377-P424 HydrophobicContact CB-CG 4.01Å; R377-V426 HydrophobicContact CB-CG2 3.82Å; R377-V426 HydrophobicContact CG-CB 4.13Å; R377-V426 HydrophobicContact CG-CG2 3.77Å
378	S	96.1	Very high	94.1	Very high	6 Å²	6	24.5 Å²	24.5	4%	0.042	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	147.4	174.1	-56.6	0	0	0	0	110.9	S326 H376 L386 S387	S326-S378 WeakPolarHBondContact OG-CB 3.42Å; S326-S378 PolarHBondContact OG-N 2.88Å; H376-S378 PolarHBondContact CD2-OG 3.04Å; H376-S378 PolarHBondContact NE2-OG 2.83Å; S378-L386 CarbonylContact C-O 3.6Å; S378-L386 WeakPolarHBondContact CA-O 3.33Å; S378-S387 PolarHBondContact OG-OG 3.06Å
379	L	95.6	Very high	94	Very high	31 Å²	31	22.3 Å²	22.3	16%	0.162	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137	-179.8	-176.5	79.2	0	0	0	110.3	I385 L386 F388 V426 A428 I433	L379-I385 WeakPolarHBondContact O-CA 3.37Å; L379-L386 PolarHBondContact N-O 2.75Å; L379-L386 PolarHBondContact O-N 2.64Å; L379-F388 HydrophobicContact CB-CE2 4.22Å; L379-V426 HydrophobicContact CB-CG1 4.17Å; L379-V426 HydrophobicContact CD2-CG1 4.08Å; L379-A428 HydrophobicContact CD2-CB 3.5Å; L379-A428 VanDerWaalsContact CD2-CB 3.5Å; L379-I433 HydrophobicContact CD2-CD1 4.26Å; L379-I433 HydrophobicContact CD2-CG1 4.2Å; L379-I433 HydrophobicContact CD2-CG2 3.8Å
380	A	94	Very high	93.9	Very high	29 Å²	29	22.1 Å²	22.1	24%	0.24	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	131.6	170.5	0	0	0	0	0	110	V328 S329 L330 Y384	V328-A380 HydrophobicContact CG2-CB 3.53Å; V328-A380 VanDerWaalsContact CG2-N 3.32Å; S329-A380 WeakPolarHBondContact O-CB 3.45Å; L330-A380 HydrophobicContact CB-CB 4.21Å; L330-A380 HydrophobicContact CD1-CB 4.16Å; A380-Y384 CarbonylContact C-O 3.59Å; A380-Y384 WeakPolarHBondContact CA-O 3.45Å
381	Y	91.1	Very high	93.9	Very high	29 Å²	29	18.7 Å²	18.7	11%	0.114	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	118.1	173.9	-177.8	-103.6	0	0	0	109.8	L262 N383 Y384 A428 Q431 V454	L262-Y381 HydrophobicContact CD2-CE1 4.23Å; Y381-N383 PolarHBondContact O-N 3.11Å; Y381-Y384 PolarHBondContact N-O 2.93Å; Y381-Y384 PolarHBondContact O-N 2.93Å; Y381-A428 HydrophobicContact CD2-CB 3.53Å; Y381-A428 HydrophobicContact CE2-CB 4.21Å; Y381-A428 HydrophobicContact CG-CB 4.35Å; Y381-Q431 WeakPolarHBondContact OH-CA 3.34Å; Y381-V454 HydrophobicContact CD1-CB 4.45Å; Y381-V454 HydrophobicContact CD1-CG1 4.03Å; Y381-V454 HydrophobicContact CD1-CG2 4.02Å; Y381-V454 HydrophobicContact CE1-CB 4.15Å; Y381-V454 HydrophobicContact CE1-CG1 4Å; Y381-V454 HydrophobicContact CE1-CG2 3.95Å
382	N	86.1	Confident	93.9	Very high	63 Å²	63	16.4 Å²	16.4	34%	0.337	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	-120.1	-167.8	-60.8	-14	0	0	0	110.4	L330	L330-N382 WeakPolarHBondContact CD1-O 3.29Å
383	N	87.2	Confident	93.6	Very high	6 Å²	6	21.5 Å²	21.5	3%	0.032	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	6.1	-179.8	-54.9	-40.5	0	0	0	113.8	P229 M259 H331 Y381 S406 I407	P229-N383 VanDerWaalsContact CG-OD1 3.26Å; P229-N383 WeakPolarHBondContact CG-OD1 3.39Å; M259-N383 PolarHBondContact O-ND2 2.83Å; H331-N383 PolarHBondContact CE1-OD1 3.01Å; H331-N383 VanDerWaalsContact CE1-OD1 3.29Å; H331-N383 PolarHBondContact NE2-OD1 2.82Å; H331-N383 VanDerWaalsContact NE2-OD1 3.09Å; Y381-N383 PolarHBondContact O-N 3.11Å; N383-S406 WeakPolarHBondContact O-CB 3.44Å; N383-S406 PolarHBondContact O-N 2.79Å; N383-S406 PolarHBondContact O-OG 3.29Å; N383-I407 HydrophobicContact CB-CD1 3.97Å; N383-I407 HydrophobicContact CB-CG1 4.18Å
384	Y	91.4	Very high	93.3	Very high	16 Å²	16	30.3 Å²	30.3	6%	0.063	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	148.9	-171.6	-57.7	-72.7	0	0	0	111.7	L262 A380 Y381 R403 Y404 D405	L262-Y384 HydrophobicContact CD1-CE2 3.89Å; A380-Y384 CarbonylContact C-O 3.59Å; A380-Y384 WeakPolarHBondContact CA-O 3.45Å; Y381-Y384 PolarHBondContact N-O 2.93Å; Y381-Y384 PolarHBondContact O-N 2.93Å; Y384-R403 HydrophobicContact CD1-CG 3.65Å; Y384-R403 HydrophobicContact CG-CG 3.9Å; Y384-Y404 WeakPolarHBondContact CA-O 3.43Å; Y384-D405 HydrophobicContact CD1-CB 4.04Å; Y384-D405 HydrophobicContact CE1-CB 3.9Å; Y384-D405 WeakPolarHBondContact CE1-OD2 3.47Å
385	I	96.1	Very high	92.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.1	165.1	-60.5	171.2	0	0	0	107.1	V328 L330 Y335 L337 L379 R403 Y404	V328-I385 HydrophobicContact CG1-CD1 3.71Å; V328-I385 HydrophobicContact CG1-CG1 4.06Å; V328-I385 HydrophobicContact CG1-CG2 3.84Å; L330-I385 HydrophobicContact CD2-CD1 4.06Å; L330-I385 HydrophobicContact CD2-CG1 3.76Å; Y335-I385 HydrophobicContact CD1-CD1 3.42Å; Y335-I385 VanDerWaalsContact CD1-CD1 3.42Å; Y335-I385 HydrophobicContact CD2-CD1 3.75Å; Y335-I385 HydrophobicContact CE1-CD1 3.93Å; Y335-I385 HydrophobicContact CE2-CD1 4.24Å; Y335-I385 HydrophobicContact CG-CD1 3.34Å; L337-I385 HydrophobicContact CD1-CG2 4.07Å; L337-I385 HydrophobicContact CD2-CG2 3.87Å; L379-I385 WeakPolarHBondContact O-CA 3.37Å; I385-R403 CarbonylContact O-C 3.59Å; I385-R403 WeakPolarHBondContact O-CA 3.28Å; I385-Y404 HydrophobicContact CB-CD1 4.42Å; I385-Y404 HydrophobicContact CD1-CD1 4.09Å; I385-Y404 HydrophobicContact CG1-CD1 4.45Å; I385-Y404 PolarHBondContact N-O 3.23Å; I385-Y404 PolarHBondContact O-N 3.42Å
386	L	96.4	Very high	92.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.4	175.4	-66.6	93	0	0	0	110	S378 L379 F388 E402 R403 I433 Y452	S378-L386 CarbonylContact C-O 3.6Å; S378-L386 WeakPolarHBondContact CA-O 3.33Å; L379-L386 PolarHBondContact N-O 2.75Å; L379-L386 PolarHBondContact O-N 2.64Å; L386-F388 HydrophobicContact CB-CE1 4.22Å; L386-F388 HydrophobicContact CB-CE2 3.57Å; L386-F388 HydrophobicContact CB-CZ 3.37Å; L386-F388 HydrophobicContact CD2-CE1 4.45Å; L386-F388 HydrophobicContact CD2-CZ 4.01Å; L386-F388 HydrophobicContact CG-CZ 4.28Å; L386-F388 WeakPolarHBondContact O-CE2 3.35Å; L386-E402 CarbonylContact C-O 3.52Å; L386-E402 VanDerWaalsContact CA-O 3.29Å; L386-E402 WeakPolarHBondContact CA-O 3.38Å; L386-R403 HydrophobicContact CG-CB 4.3Å; L386-R403 HydrophobicContact CG-CG 4.23Å; L386-I433 HydrophobicContact CD1-CD1 3.9Å; L386-I433 HydrophobicContact CD2-CD1 4Å; L386-I433 HydrophobicContact CG-CD1 4.38Å; L386-Y452 HydrophobicContact CD2-CD1 4.3Å; L386-Y452 HydrophobicContact CD2-CE1 3.75Å
387	S	96.7	Very high	92.8	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.2	178.3	-65.9	0	0	0	0	111	S378 V401 E402	S378-S387 PolarHBondContact OG-OG 3.06Å; S387-V401 WeakPolarHBondContact O-CA 3.46Å; S387-E402 PolarHBondContact N-O 2.88Å; S387-E402 PolarHBondContact O-N 2.8Å
388	F	95.6	Very high	92.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125	-171.8	-54.7	-82.1	0	0	0	111.3	H376 R377 L379 L386 V401 M417 V426 I433 L435 W459	H376-F388 WeakPolarHBondContact CB-O 3.48Å; R377-F388 PolarHBondContact N-O 2.86Å; R377-F388 VanDerWaalsContact N-O 3.09Å; R377-F388 WeakPolarHBondContact O-CD2 3.41Å; R377-F388 PolarHBondContact O-N 2.9Å; L379-F388 HydrophobicContact CB-CE2 4.22Å; L386-F388 HydrophobicContact CB-CE1 4.22Å; L386-F388 HydrophobicContact CB-CE2 3.57Å; L386-F388 HydrophobicContact CB-CZ 3.37Å; L386-F388 HydrophobicContact CD2-CE1 4.45Å; L386-F388 HydrophobicContact CD2-CZ 4.01Å; L386-F388 HydrophobicContact CG-CZ 4.28Å; L386-F388 WeakPolarHBondContact O-CE2 3.35Å; F388-V401 HydrophobicContact CD1-CB 4.5Å; F388-V401 HydrophobicContact CD1-CG1 3.74Å; F388-V401 HydrophobicContact CD1-CG2 3.95Å; F388-V401 HydrophobicContact CE1-CG1 3.6Å; F388-V401 HydrophobicContact CE1-CG2 4.43Å; F388-V401 HydrophobicContact CZ-CG1 4.49Å; F388-M417 HydrophobicContact CB-SD 4Å; F388-M417 HydrophobicContact CD1-SD 4.3Å; F388-V426 HydrophobicContact CD2-CG1 4.08Å; F388-V426 HydrophobicContact CE2-CG1 4.03Å; F388-I433 HydrophobicContact CE2-CG2 4.11Å; F388-I433 HydrophobicContact CZ-CB 4.49Å; F388-I433 HydrophobicContact CZ-CD1 3.85Å; F388-I433 HydrophobicContact CZ-CG2 3.81Å; F388-L435 HydrophobicContact CB-CD2 4.08Å; F388-L435 HydrophobicContact CD1-CD1 4.31Å; F388-L435 HydrophobicContact CD1-CD2 4.15Å; F388-L435 HydrophobicContact CE1-CD1 4.4Å; F388-L435 HydrophobicContact CG-CD2 4.2Å; F388-W459 AromaticContact CD1-CH2 3.92Å; F388-W459 HydrophobicContact CD1-CH2 3.92Å; F388-W459 HydrophobicContact CD1-CZ2 4.11Å; F388-W459 AromaticContact CE1-CH2 3.9Å; F388-W459 HydrophobicContact CE1-CH2 3.9Å; F388-W459 AromaticContact CE1-CZ2 3.97Å; F388-W459 HydrophobicContact CE1-CZ2 3.97Å
389	G	93.4	Very high	92.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.			trans	67.8	-144.6	168.8	0	0	0	0	0	114.5	R373 H376 L398 M417	R373-G389 PolarHBondContact NH1-O 3.41Å; R373-G389 VanDerWaalsContact NH1-O 3.15Å; H376-G389 VanDerWaalsContact CB-O 3.29Å; H376-G389 WeakPolarHBondContact CB-O 3.34Å; G389-L398 VanDerWaalsContact CA-O 3.28Å; G389-L398 WeakPolarHBondContact CA-O 3.38Å; G389-M417 VanDerWaalsContact N-CE 3.33Å
390	G	94.3	Very high	92.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.			trans	89.7	-171.2	-176.4	0	0	0	0	0	113.7	Y374 I397 L398 V421 L422	Y374-G390 CarbonylContact O-C 3.53Å; Y374-G390 VanDerWaalsContact O-CA 3.26Å; Y374-G390 WeakPolarHBondContact O-CA 3.23Å; G390-I397 WeakPolarHBondContact O-CA 3.23Å; G390-L398 PolarHBondContact O-N 2.91Å; G390-V421 PolarHBondContact N-O 3.34Å; G390-L422 VanDerWaalsContact C-CD2 3.49Å
391	I	94.4	Very high	92.8	Very high	23 Å²	23	37 Å²	37	12%	0.118	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-108.6	128.8	-179.8	-57	174.6	0	0	0	108.7	R373 Y374 D396 L422	R373-I391 VanDerWaalsContact CA-O 3.29Å; R373-I391 WeakPolarHBondContact CA-O 3.36Å; Y374-I391 HydrophobicContact CD1-CB 3.92Å; Y374-I391 HydrophobicContact CD1-CG2 4.37Å; Y374-I391 WeakPolarHBondContact CD1-O 3.44Å; Y374-I391 HydrophobicContact CE1-CB 3.42Å; Y374-I391 VanDerWaalsContact CE1-CB 3.42Å; Y374-I391 HydrophobicContact CE1-CD1 4.29Å; Y374-I391 HydrophobicContact CE1-CG1 4.38Å; Y374-I391 HydrophobicContact CE1-CG2 3.49Å; Y374-I391 VanDerWaalsContact CE1-CG2 3.49Å; Y374-I391 HydrophobicContact CE2-CB 4.47Å; Y374-I391 HydrophobicContact CE2-CD1 3.99Å; Y374-I391 PolarHBondContact N-O 2.86Å; Y374-I391 VanDerWaalsContact N-O 3.13Å; Y374-I391 PolarHBondContact O-N 3.19Å; Y374-I391 WeakPolarHBondContact OH-CD1 3.47Å; I391-D396 WeakPolarHBondContact CA-O 3.41Å; I391-L422 HydrophobicContact CD1-CD1 3.96Å; I391-L422 HydrophobicContact CD1-CD2 4.2Å; I391-L422 HydrophobicContact CG1-CD1 4.11Å; I391-L422 HydrophobicContact CG1-CD2 3.46Å; I391-L422 VanDerWaalsContact CG1-CD2 3.46Å; I391-L422 HydrophobicContact CG1-CG 4.44Å
392	G	93.2	Very high	93	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.			trans	-81.9	179.8	176.9	0	0	0	0	0	113.7	K394 Q395 D396	G392-K394 PolarHBondContact O-N 2.83Å; G392-Q395 PolarHBondContact O-N 2.96Å; G392-Q395 VanDerWaalsContact O-N 3.09Å; G392-D396 PolarHBondContact N-O 2.88Å
393	E	89.8	Confident	93.5	Very high	132 Å²	132	34.5 Å²	34.5	62%	0.617	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.9	177.9	-172.2	178.3	-147.8	0	0	112.6	P372 Q395	P372-E393 HydrophobicContact CG-CB 4.18Å; E393-Q395 PolarHBondContact O-N 2.64Å
394	K	88.9	Confident	93.9	Very high	185 Å²	185	34.5 Å²	34.5	80%	0.804	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	10.1	179.6	-62	178.9	-177.8	174.1	0	113.5	G392 D396	G392-K394 PolarHBondContact O-N 2.83Å; K394-D396 PolarHBondContact O-N 3.3Å
395	Q	88.4	Confident	93.9	Very high	112 Å²	112	34.1 Å²	34.1	52%	0.523	16%	0.164	S	C	.	.	S	Bend	trans	62.4	20.2	-175.8	-57.1	-65.4	-62.1	0	0	113.9	Y374 G392 E393	Y374-Q395 PolarHBondContact OH-OE1 3.39Å; G392-Q395 PolarHBondContact O-N 2.96Å; G392-Q395 VanDerWaalsContact O-N 3.09Å; E393-Q395 PolarHBondContact O-N 2.64Å
396	D	91.7	Very high	93.6	Very high	70 Å²	70	34.5 Å²	34.5	37%	0.374	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-85.2	144.7	172.8	57.8	-39.1	0	0	0	111	I391 G392 K394 L398	I391-D396 WeakPolarHBondContact CA-O 3.41Å; G392-D396 PolarHBondContact N-O 2.88Å; K394-D396 PolarHBondContact O-N 3.3Å; D396-L398 PolarHBondContact O-N 3.17Å; D396-L398 WeakPolarHBondContact OD2-CD2 3.44Å
397	I	93.2	Very high	93.1	Very high	30 Å²	30	34.8 Å²	34.8	15%	0.154	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-78.8	121.8	169.3	-57	-168.8	0	0	0	108.5	G390 A420 L422 I441	G390-I397 WeakPolarHBondContact O-CA 3.23Å; I397-A420 HydrophobicContact CB-CB 4.14Å; I397-A420 HydrophobicContact CG2-CB 3.53Å; I397-L422 HydrophobicContact CD1-CD1 3.94Å; I397-L422 HydrophobicContact CD1-CD2 4.1Å; I397-L422 HydrophobicContact CD1-CG 3.82Å; I397-L422 HydrophobicContact CG1-CD2 4.15Å; I397-L422 HydrophobicContact CG1-CG 4.41Å; I397-L422 HydrophobicContact CG2-CD2 3.94Å; I397-L422 HydrophobicContact CG2-CG 4.44Å; I397-I441 HydrophobicContact CD1-CB 3.58Å; I397-I441 HydrophobicContact CD1-CG1 4.09Å; I397-I441 HydrophobicContact CG1-CB 4.16Å; I397-I441 HydrophobicContact CG1-CG1 4.23Å
398	L	94.9	Very high	92.6	Very high	14 Å²	14	40.8 Å²	40.8	7%	0.073	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-80.1	136.4	-178.6	-58	175.9	0	0	0	110.1	V371 R373 G389 G390 D396	V371-L398 HydrophobicContact CG1-CD1 3.7Å; V371-L398 HydrophobicContact CG1-CD2 4.35Å; R373-L398 HydrophobicContact CB-CD1 3.84Å; G389-L398 VanDerWaalsContact CA-O 3.28Å; G389-L398 WeakPolarHBondContact CA-O 3.38Å; G390-L398 PolarHBondContact O-N 2.91Å; D396-L398 PolarHBondContact O-N 3.17Å; D396-L398 WeakPolarHBondContact OD2-CD2 3.44Å
399	N	94.9	Very high	92.3	Very high	71 Å²	71	43.7 Å²	43.7	38%	0.38	21%	0.207	S	C	.	.			trans	-101.1	-2.1	159.2	69.7	-16.7	0	0	0	112	S416 M417 A420	N399-S416 CarbonylContact O-C 3.49Å; N399-S416 WeakPolarHBondContact O-CA 3.43Å; N399-M417 HydrophobicContact CB-CB 4.27Å; N399-M417 WeakPolarHBondContact CB-O 3.4Å; N399-M417 PolarHBondContact ND2-O 2.99Å; N399-M417 PolarHBondContact O-N 2.84Å; N399-A420 HydrophobicContact CB-CB 3.91Å
400	S	95.3	Very high	92.3	Very high	22 Å²	22	46.4 Å²	46.4	15%	0.154	22%	0.223	C	C	.	.			trans	-65.3	140.7	-179.4	64.3	0	0	0	0	110.7	R373	R373-S400 PolarHBondContact NH1-O 3.12Å; R373-S400 PolarHBondContact NH2-OG 2.78Å
401	V	96.4	Very high	92.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.8	176.7	-176.7	0	0	0	0	107.1	S387 F388 M414 M417 W459	S387-V401 WeakPolarHBondContact O-CA 3.46Å; F388-V401 HydrophobicContact CD1-CB 4.5Å; F388-V401 HydrophobicContact CD1-CG1 3.74Å; F388-V401 HydrophobicContact CD1-CG2 3.95Å; F388-V401 HydrophobicContact CE1-CG1 3.6Å; F388-V401 HydrophobicContact CE1-CG2 4.43Å; F388-V401 HydrophobicContact CZ-CG1 4.49Å; V401-M414 HydrophobicContact CB-CB 4.12Å; V401-M414 HydrophobicContact CG1-CB 3.98Å; V401-M414 HydrophobicContact CG1-CG 4.4Å; V401-M414 PolarHBondContact O-N 2.83Å; V401-M417 HydrophobicContact CG2-CG 3.49Å; V401-M417 VanDerWaalsContact CG2-CG 3.49Å; V401-M417 HydrophobicContact CG2-SD 4.37Å; V401-W459 HydrophobicContact CG2-CZ2 3.86Å
402	E	95.8	Very high	92.3	Very high	5 Å²	5	50.3 Å²	50.3	2%	0.023	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	154.4	176.2	60.1	-177.8	-126	0	0	110	M369 L370 V371 R373 L386 S387 E412	M369-E402 WeakPolarHBondContact CA-OE1 3.04Å; M369-E402 WeakPolarHBondContact CB-OE1 3.48Å; M369-E402 HydrophobicContact CE-CG 4.45Å; M369-E402 WeakPolarHBondContact CE-OE1 3.24Å; M369-E402 WeakPolarHBondContact CG-OE1 3.41Å; L370-E402 PolarHBondContact N-OE2 3.31Å; V371-E402 PolarHBondContact N-OE2 3.47Å; R373-E402 IonicContact CZ-OE2 4Å; R373-E402 IonicContact NE-OE2 2.67Å; R373-E402 IonicContact NH2-OE2 3.62Å; R373-E402 PolarHBondContact NH2-OE2 3.25Å; L386-E402 CarbonylContact C-O 3.52Å; L386-E402 VanDerWaalsContact CA-O 3.29Å; L386-E402 WeakPolarHBondContact CA-O 3.38Å; S387-E402 PolarHBondContact N-O 2.88Å; S387-E402 PolarHBondContact O-N 2.8Å; E402-E412 CarbonylContact C-O 3.55Å; E402-E412 VanDerWaalsContact CA-O 3.26Å; E402-E412 WeakPolarHBondContact CA-O 3.4Å
403	R	95.1	Very high	92.4	Very high	35 Å²	35	54.5 Å²	54.5	13%	0.132	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.4	-178.2	-179.7	-179.8	73.2	160.1	-0.5	108.6	Y384 I385 L386 C411 E412 M414	Y384-R403 HydrophobicContact CD1-CG 3.65Å; Y384-R403 HydrophobicContact CG-CG 3.9Å; I385-R403 CarbonylContact O-C 3.59Å; I385-R403 WeakPolarHBondContact O-CA 3.28Å; L386-R403 HydrophobicContact CG-CB 4.3Å; L386-R403 HydrophobicContact CG-CG 4.23Å; R403-C411 WeakPolarHBondContact O-CA 3.33Å; R403-E412 IonicContact CZ-OE2 2.76Å; R403-E412 PolarHBondContact N-O 3.35Å; R403-E412 IonicContact NE-OE2 3.74Å; R403-E412 IonicContact NH2-OE2 3.7Å; R403-E412 PolarHBondContact NH2-OE2 2.78Å; R403-E412 PolarHBondContact O-N 3.37Å; R403-M414 HydrophobicContact CB-CG 3.61Å; R403-M414 HydrophobicContact CB-SD 3.63Å; R403-M414 HydrophobicContact CG-SD 4.43Å
404	Y	95.4	Very high	92.7	Very high	6 Å²	6	49.1 Å²	49.1	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	123.6	170.1	173	-97.9	0	0	0	109.8	Y335 I353 V366 Y384 I385 N409 T410	Y335-Y404 HydrophobicContact CD1-CE1 4.23Å; Y335-Y404 HydrophobicContact CE1-CD1 4.46Å; Y335-Y404 AromaticContact CE1-CE1 3.67Å; Y335-Y404 HydrophobicContact CE1-CE1 3.67Å; I353-Y404 HydrophobicContact CD1-CD2 3.89Å; I353-Y404 HydrophobicContact CD1-CE2 4.35Å; I353-Y404 HydrophobicContact CD1-CG 4.21Å; V366-Y404 HydrophobicContact CG2-CE2 4.25Å; Y384-Y404 WeakPolarHBondContact CA-O 3.43Å; I385-Y404 HydrophobicContact CB-CD1 4.42Å; I385-Y404 HydrophobicContact CD1-CD1 4.09Å; I385-Y404 HydrophobicContact CG1-CD1 4.45Å; I385-Y404 PolarHBondContact N-O 3.23Å; I385-Y404 PolarHBondContact O-N 3.42Å; Y404-N409 WeakPolarHBondContact CE2-OD1 2.96Å; Y404-N409 PolarHBondContact OH-OD1 2.82Å; Y404-T410 CarbonylContact C-O 3.57Å; Y404-T410 WeakPolarHBondContact CA-O 3.15Å
405	D	91.6	Very high	93	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.043	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.1	172.4	-169.2	-37.2	0	0	0	110	Y384 I407 Y408 N409 T410	Y384-D405 HydrophobicContact CD1-CB 4.04Å; Y384-D405 HydrophobicContact CE1-CB 3.9Å; Y384-D405 WeakPolarHBondContact CE1-OD2 3.47Å; D405-I407 PolarHBondContact O-N 3.23Å; D405-I407 WeakPolarHBondContact OD1-CA 3.48Å; D405-I407 VanDerWaalsContact OD1-CB 3.27Å; D405-I407 WeakPolarHBondContact OD1-CB 3.5Å; D405-I407 PolarHBondContact OD1-N 3.19Å; D405-Y408 PolarHBondContact OD1-N 3.07Å; D405-Y408 WeakPolarHBondContact OD2-CD2 3.36Å; D405-N409 WeakPolarHBondContact O-CA 3.26Å; D405-N409 PolarHBondContact O-N 3.3Å; D405-T410 PolarHBondContact N-O 2.8Å
406	S	89.3	Confident	93.4	Very high	8 Å²	8	39.2 Å²	39.2	6%	0.056	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.1	-178.8	64.3	0	0	0	0	114.7	N383	N383-S406 WeakPolarHBondContact O-CB 3.44Å; N383-S406 PolarHBondContact O-N 2.79Å; N383-S406 PolarHBondContact O-OG 3.29Å
407	I	86.4	Confident	93.6	Very high	7 Å²	7	36 Å²	36	4%	0.036	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-50.8	-178.9	-54	-173.8	0	0	0	110	P229 F233 F260 N383 D405	P229-I407 HydrophobicContact CB-CD1 3.45Å; P229-I407 VanDerWaalsContact CB-CD1 3.45Å; P229-I407 HydrophobicContact CB-CG1 3.76Å; P229-I407 HydrophobicContact CG-CD1 4.35Å; P229-I407 HydrophobicContact CG-CG1 4.48Å; F233-I407 HydrophobicContact CD2-CD1 3.99Å; F233-I407 HydrophobicContact CD2-CG2 4.23Å; F233-I407 HydrophobicContact CE2-CD1 3.99Å; F260-I407 HydrophobicContact CE1-CD1 3.85Å; F260-I407 HydrophobicContact CZ-CD1 3.64Å; N383-I407 HydrophobicContact CB-CD1 3.97Å; N383-I407 HydrophobicContact CB-CG1 4.18Å; D405-I407 PolarHBondContact O-N 3.23Å; D405-I407 WeakPolarHBondContact OD1-CA 3.48Å; D405-I407 VanDerWaalsContact OD1-CB 3.27Å; D405-I407 WeakPolarHBondContact OD1-CB 3.5Å; D405-I407 PolarHBondContact OD1-N 3.19Å
408	Y	86.3	Confident	93.6	Very high	128 Å²	128	37.6 Å²	37.6	50%	0.502	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-5.8	-175.5	-61.1	-68	0	0	0	113.7	D405	D405-Y408 PolarHBondContact OD1-N 3.07Å; D405-Y408 WeakPolarHBondContact OD2-CD2 3.36Å
409	N	89.4	Confident	93.6	Very high	60 Å²	60	39.1 Å²	39.1	32%	0.321	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	51.8	-177.6	-177.4	47.4	0	0	0	111.8	V366 E367 Y404 D405	V366-N409 WeakPolarHBondContact CB-OD1 3.49Å; E367-N409 WeakPolarHBondContact CB-O 3.05Å; E367-N409 WeakPolarHBondContact CB-OD1 3.49Å; E367-N409 PolarHBondContact N-OD1 3.37Å; Y404-N409 WeakPolarHBondContact CE2-OD1 2.96Å; Y404-N409 PolarHBondContact OH-OD1 2.82Å; D405-N409 WeakPolarHBondContact O-CA 3.26Å; D405-N409 PolarHBondContact O-N 3.3Å
410	T	92.9	Very high	93.5	Very high	57 Å²	57	37.2 Å²	37.2	35%	0.35	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.3	-179	50.3	0	0	0	0	110.7	Y404 D405	Y404-T410 CarbonylContact C-O 3.57Å; Y404-T410 WeakPolarHBondContact CA-O 3.15Å; D405-T410 PolarHBondContact N-O 2.8Å
411	C	94.4	Very high	93.4	Very high	20 Å²	20	36.1 Å²	36.1	14%	0.135	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.8	173.7	-67.8	0	0	0	0	110	P368 L370 R403	P368-C411 PolarHBondContact O-SG 2.94Å; L370-C411 HydrophobicContact CD1-CB 4.37Å; L370-C411 HydrophobicContact CD2-CB 4.11Å; L370-C411 HydrophobicContact CG-CB 3.75Å; R403-C411 WeakPolarHBondContact O-CA 3.33Å
412	E	94.4	Very high	93.2	Very high	86 Å²	86	36.7 Å²	36.7	40%	0.402	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.1	178.2	-65.9	-179.8	176.9	0	0	111.1	E402 R403	E402-E412 CarbonylContact C-O 3.55Å; E402-E412 VanDerWaalsContact CA-O 3.26Å; E402-E412 WeakPolarHBondContact CA-O 3.4Å; R403-E412 IonicContact CZ-OE2 2.76Å; R403-E412 PolarHBondContact N-O 3.35Å; R403-E412 IonicContact NE-OE2 3.74Å; R403-E412 IonicContact NH2-OE2 3.7Å; R403-E412 PolarHBondContact NH2-OE2 2.78Å; R403-E412 PolarHBondContact O-N 3.37Å
413	S	95.8	Very high	92.9	Very high	88 Å²	88	37.7 Å²	37.7	62%	0.615	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	133.5	174.2	-173.3	0	0	0	0	110.6
414	M	96.1	Very high	92.8	Very high	18 Å²	18	36 Å²	36	9%	0.089	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	174.4	176.9	-52.9	-55.6	-69.4	0	0	110.3	V401 R403 S416 Y452	V401-M414 HydrophobicContact CB-CB 4.12Å; V401-M414 HydrophobicContact CG1-CB 3.98Å; V401-M414 HydrophobicContact CG1-CG 4.4Å; V401-M414 PolarHBondContact O-N 2.83Å; R403-M414 HydrophobicContact CB-CG 3.61Å; R403-M414 HydrophobicContact CB-SD 3.63Å; R403-M414 HydrophobicContact CG-SD 4.43Å; M414-S416 PolarHBondContact O-N 2.84Å; M414-Y452 WeakPolarHBondContact CE-OH 3.42Å
415	A	96	Very high	92.7	Very high	30 Å²	30	35.8 Å²	35.8	25%	0.248	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-58.4	129.7	174.4	0	0	0	0	0	110.8	Y452 N457 W459	A415-Y452 HydrophobicContact CB-CE2 4.44Å; A415-N457 WeakPolarHBondContact CB-O 3.35Å; A415-N457 VanDerWaalsContact CB-OD1 3.27Å; A415-N457 WeakPolarHBondContact CB-OD1 3.41Å; A415-N457 PolarHBondContact N-OD1 3.41Å; A415-W459 PolarHBondContact O-NE1 3.24Å
416	S	96.3	Very high	92.8	Very high	60 Å²	60	35.7 Å²	35.7	42%	0.42	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-66.1	148	-179.6	-56.9	0	0	0	0	112.2	N399 M414 W459	N399-S416 CarbonylContact O-C 3.49Å; N399-S416 WeakPolarHBondContact O-CA 3.43Å; M414-S416 PolarHBondContact O-N 2.84Å; S416-W459 PolarHBondContact O-NE1 2.91Å
417	M	95.3	Very high	93.1	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-63.5	143.6	175.6	-58.9	-175	-63.3	0	0	110.9	F388 G389 N399 V401 V419 V421 L435 W459	F388-M417 HydrophobicContact CB-SD 4Å; F388-M417 HydrophobicContact CD1-SD 4.3Å; G389-M417 VanDerWaalsContact N-CE 3.33Å; N399-M417 HydrophobicContact CB-CB 4.27Å; N399-M417 WeakPolarHBondContact CB-O 3.4Å; N399-M417 PolarHBondContact ND2-O 2.99Å; N399-M417 PolarHBondContact O-N 2.84Å; V401-M417 HydrophobicContact CG2-CG 3.49Å; V401-M417 VanDerWaalsContact CG2-CG 3.49Å; V401-M417 HydrophobicContact CG2-SD 4.37Å; M417-V419 VanDerWaalsContact C-N 3.27Å; M417-V419 PolarHBondContact O-N 3.35Å; M417-V421 HydrophobicContact CE-CG2 4.28Å; M417-L435 HydrophobicContact CG-CD2 4.48Å; M417-L435 HydrophobicContact SD-CD2 3.34Å; M417-L435 WeakPolarHBondContact SD-CD2 3.25Å; M417-W459 HydrophobicContact CG-CH2 3.74Å; M417-W459 HydrophobicContact CG-CZ2 3.62Å; M417-W459 HydrophobicContact CG-CZ3 4.35Å; M417-W459 HydrophobicContact SD-CH2 4.27Å
418	P	94.3	Very high	93.5	Very high	64 Å²	64	36.1 Å²	36.1	42%	0.416	21%	0.212	S	C	.	.	S	Bend	trans	-58.6	-37.5	172.5	-26.5	33.5	0	0	0	113.6	Q450 W459	P418-Q450 VanDerWaalsContact CD-OE1 3.29Å; P418-W459 HydrophobicContact CG-CB 3.66Å; P418-W459 HydrophobicContact CG-CG 4.22Å
419	V	93.1	Very high	93.7	Very high	46 Å²	46	30.7 Å²	30.7	28%	0.279	19%	0.191	S	C	.	.	S	Bend	trans	-130.5	125.1	180	-178.3	0	0	0	0	109.7	M417 V421 V446 L448 Q450	M417-V419 VanDerWaalsContact C-N 3.27Å; M417-V419 PolarHBondContact O-N 3.35Å; V419-V421 HydrophobicContact CG1-CG1 4.24Å; V419-V446 HydrophobicContact CG1-CG1 4.44Å; V419-L448 HydrophobicContact CB-CD1 4.26Å; V419-L448 HydrophobicContact CG1-CD1 4.42Å; V419-L448 HydrophobicContact CG2-CD1 3.71Å; V419-Q450 PolarHBondContact O-NE2 2.84Å; V419-Q450 PolarHBondContact O-OE1 3.44Å
420	A	94	Very high	93.5	Very high	30 Å²	30	31.8 Å²	31.8	25%	0.248	20%	0.197	C	C	.	.			trans	-70.2	132.4	176	0	0	0	0	0	110.2	I397 N399	I397-A420 HydrophobicContact CB-CB 4.14Å; I397-A420 HydrophobicContact CG2-CB 3.53Å; N399-A420 HydrophobicContact CB-CB 3.91Å
421	V	92.9	Very high	93.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.199	C	C	.	.			trans	-144.8	152.5	-173.7	-64.6	0	0	0	0	112.7	G390 M417 V419 P424 E439 V446	G390-V421 PolarHBondContact N-O 3.34Å; M417-V421 HydrophobicContact CE-CG2 4.28Å; V419-V421 HydrophobicContact CG1-CG1 4.24Å; V421-P424 HydrophobicContact CG2-CB 3.85Å; V421-P424 HydrophobicContact CG2-CG 3.91Å; V421-E439 CarbonylContact C-O 3.59Å; V421-E439 WeakPolarHBondContact CA-O 3.47Å; V421-V446 HydrophobicContact CG1-CB 4.24Å; V421-V446 HydrophobicContact CG1-CG1 4.14Å; V421-V446 HydrophobicContact CG1-CG2 4Å
422	L	92.1	Very high	93.1	Very high	13 Å²	13	37.3 Å²	37.3	7%	0.068	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-106.1	147.2	170.3	-49.3	178.3	0	0	0	110.9	G390 I391 I397 P424 G438 E439	G390-L422 VanDerWaalsContact C-CD2 3.49Å; I391-L422 HydrophobicContact CD1-CD1 3.96Å; I391-L422 HydrophobicContact CD1-CD2 4.2Å; I391-L422 HydrophobicContact CG1-CD1 4.11Å; I391-L422 HydrophobicContact CG1-CD2 3.46Å; I391-L422 VanDerWaalsContact CG1-CD2 3.46Å; I391-L422 HydrophobicContact CG1-CG 4.44Å; I397-L422 HydrophobicContact CD1-CD1 3.94Å; I397-L422 HydrophobicContact CD1-CD2 4.1Å; I397-L422 HydrophobicContact CD1-CG 3.82Å; I397-L422 HydrophobicContact CG1-CD2 4.15Å; I397-L422 HydrophobicContact CG1-CG 4.41Å; I397-L422 HydrophobicContact CG2-CD2 3.94Å; I397-L422 HydrophobicContact CG2-CG 4.44Å; L422-P424 VanDerWaalsContact C-N 3.3Å; L422-P424 VanDerWaalsContact O-N 3.16Å; L422-G438 CarbonylContact O-C 3.47Å; L422-G438 WeakPolarHBondContact O-CA 3.33Å; L422-E439 HydrophobicContact CB-CB 4.24Å; L422-E439 PolarHBondContact N-O 2.84Å; L422-E439 PolarHBondContact O-N 3.32Å
423	H	89.6	Confident	93.1	Very high	25 Å²	25	33.2 Å²	33.2	12%	0.116	19%	0.193	C	C	.	.	S	Bend	trans	45.9	42.8	177.6	-41.7	100.7	0	0	0	115.3	K324 S375 E439 C471	K324-H423 PolarHBondContact NZ-CE1 2.8Å; K324-H423 PolarHBondContact NZ-NE2 3.31Å; S375-H423 WeakPolarHBondContact CB-NE2 3.28Å; S375-H423 PolarHBondContact O-N 2.86Å; S375-H423 VanDerWaalsContact O-N 3.1Å; H423-E439 IonicContact CE1-OE2 2.63Å; H423-E439 PolarHBondContact CE1-OE2 2.79Å; H423-E439 IonicContact CG-OE2 2.68Å; H423-E439 IonicContact ND1-OE2 2.83Å; H423-E439 PolarHBondContact ND1-OE2 2.87Å; H423-C471 HydrophobicContact CB-CB 4.49Å
424	P	92.4	Very high	93.1	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.006	17%	0.166	C	C	.	.			trans	-64.5	147.8	178	29.5	-35.1	0	0	0	110.5	R377 V421 L422 V426	R377-P424 HydrophobicContact CB-CG 4.01Å; V421-P424 HydrophobicContact CG2-CB 3.85Å; V421-P424 HydrophobicContact CG2-CG 3.91Å; L422-P424 VanDerWaalsContact C-N 3.3Å; L422-P424 VanDerWaalsContact O-N 3.16Å; P424-V426 HydrophobicContact CB-CG2 4.01Å; P424-V426 HydrophobicContact CG-CG2 3.82Å
425	A	93.3	Very high	93	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	119.5	167.6	0	0	0	0	0	108.3	L435 F436 N469 A472 A474 I483	A425-L435 CarbonylContact O-C 3.55Å; A425-L435 WeakPolarHBondContact O-CA 3.17Å; A425-F436 HydrophobicContact CB-CB 4.25Å; A425-F436 PolarHBondContact N-O 3.45Å; A425-F436 VanDerWaalsContact N-O 3.12Å; A425-F436 PolarHBondContact O-N 3.12Å; A425-N469 WeakPolarHBondContact CB-ND2 3.4Å; A425-A472 WeakPolarHBondContact CA-O 3.49Å; A425-A472 WeakPolarHBondContact CB-O 3.24Å; A425-A474 HydrophobicContact CB-CB 3.75Å; A425-I483 HydrophobicContact CB-CG2 4.48Å
426	V	94.8	Very high	92.8	Very high	6 Å²	6	27.2 Å²	27.2	4%	0.036	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.2	-170.2	-169.7	0	0	0	0	111	R377 L379 F388 P424 I433 Y434 L435	R377-V426 HydrophobicContact CB-CG2 3.82Å; R377-V426 HydrophobicContact CG-CB 4.13Å; R377-V426 HydrophobicContact CG-CG2 3.77Å; L379-V426 HydrophobicContact CB-CG1 4.17Å; L379-V426 HydrophobicContact CD2-CG1 4.08Å; F388-V426 HydrophobicContact CD2-CG1 4.08Å; F388-V426 HydrophobicContact CE2-CG1 4.03Å; P424-V426 HydrophobicContact CB-CG2 4.01Å; P424-V426 HydrophobicContact CG-CG2 3.82Å; V426-I433 HydrophobicContact CG1-CG2 3.63Å; V426-Y434 WeakPolarHBondContact CA-O 3.44Å; V426-L435 HydrophobicContact CG1-CD1 3.97Å; V426-L435 HydrophobicContact CG1-CG 4.3Å; V426-L435 HydrophobicContact CG2-CD1 4.5Å; V426-L435 HydrophobicContact CG2-CG 3.94Å
427	A	95.4	Very high	92.6	Very high	2 Å²	2	24.5 Å²	24.5	2%	0.017	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	146.8	175	0	0	0	0	0	111.7	Y434 A474 V476 I481	A427-Y434 PolarHBondContact N-O 2.96Å; A427-Y434 PolarHBondContact O-N 3.01Å; A427-A474 HydrophobicContact CB-CB 4.16Å; A427-V476 HydrophobicContact CB-CG2 3.97Å; A427-I481 HydrophobicContact CB-CD1 4.22Å; A427-I481 HydrophobicContact CB-CG1 4.24Å; A427-I481 HydrophobicContact CB-CG2 3.57Å
428	A	93.6	Very high	92.3	Very high	22 Å²	22	24.4 Å²	24.4	18%	0.182	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.9	175.2	0	0	0	0	0	111	L379 Y381 R432 I433 V476	L379-A428 HydrophobicContact CD2-CB 3.5Å; L379-A428 VanDerWaalsContact CD2-CB 3.5Å; Y381-A428 HydrophobicContact CD2-CB 3.53Å; Y381-A428 HydrophobicContact CE2-CB 4.21Å; Y381-A428 HydrophobicContact CG-CB 4.35Å; A428-R432 CarbonylContact C-O 3.46Å; A428-R432 WeakPolarHBondContact CA-O 3.34Å; A428-I433 HydrophobicContact CB-CG1 4.16Å; A428-V476 WeakPolarHBondContact O-CG2 3.45Å
429	K	91.1	Very high	92.1	Very high	14 Å²	14	22 Å²	22	6%	0.061	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	144.5	176.1	-170.9	168.7	-175.8	-85.7	0	111.1	Q431 R432 Y434 V476 D479 I481 T496	K429-Q431 VanDerWaalsContact C-N 3.32Å; K429-Q431 PolarHBondContact O-N 2.94Å; K429-R432 PolarHBondContact N-O 3.27Å; K429-R432 PolarHBondContact O-N 2.77Å; K429-Y434 HydrophobicContact CB-CE2 4.32Å; K429-V476 HydrophobicContact CD-CG1 4.43Å; K429-D479 WeakPolarHBondContact CE-O 3.35Å; K429-D479 WeakPolarHBondContact CE-OD1 3.32Å; K429-D479 PolarHBondContact NZ-O 3.29Å; K429-D479 IonicContact NZ-OD1 2.86Å; K429-D479 PolarHBondContact NZ-OD1 2.85Å; K429-I481 HydrophobicContact CB-CD1 4.11Å; K429-I481 HydrophobicContact CB-CG1 4.29Å; K429-I481 HydrophobicContact CD-CG1 4.1Å; K429-T496 HydrophobicContact CB-CG2 4.49Å; K429-T496 HydrophobicContact CD-CG2 3.91Å; K429-T496 HydrophobicContact CG-CG2 4.4Å; K429-T496 PolarHBondContact NZ-OG1 3.05Å
430	D	84.9	Confident	91.8	Very high	83 Å²	83	22.2 Å²	22.2	44%	0.444	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	45	174.2	-53.1	-34.5	0	0	0	113.6	R432 T496	D430-R432 PolarHBondContact O-N 2.82Å; D430-T496 PolarHBondContact OD2-OG1 3.03Å
431	Q	86.5	Confident	91.3	Very high	85 Å²	85	26.5 Å²	26.5	40%	0.397	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	19.3	-175.9	-52.6	-179.5	30.4	0	0	115.9	Y381 K429	Y381-Q431 WeakPolarHBondContact OH-CA 3.34Å; K429-Q431 VanDerWaalsContact C-N 3.32Å; K429-Q431 PolarHBondContact O-N 2.94Å
432	R	92.3	Very high	90.9	Very high	108 Å²	108	33.2 Å²	33.2	41%	0.408	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.6	179.7	-64.2	173.7	-177	-175.2	1.7	110.2	A428 K429 D430 Y434 V451 Y452	A428-R432 CarbonylContact C-O 3.46Å; A428-R432 WeakPolarHBondContact CA-O 3.34Å; K429-R432 PolarHBondContact N-O 3.27Å; K429-R432 PolarHBondContact O-N 2.77Å; D430-R432 PolarHBondContact O-N 2.82Å; R432-Y434 HydrophobicContact CB-CD2 4.34Å; R432-Y434 HydrophobicContact CB-CE2 3.65Å; R432-V451 HydrophobicContact CB-CG1 3.98Å; R432-V451 HydrophobicContact CG-CG1 4.33Å; R432-Y452 CarbonylContact C-O 3.51Å; R432-Y452 VanDerWaalsContact CA-O 3.28Å; R432-Y452 WeakPolarHBondContact CA-O 3.5Å
433	I	95.6	Very high	90.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.4	172.7	-58	177	0	0	0	107.5	L379 L386 F388 V426 A428 L435 V451 Y452 V454	L379-I433 HydrophobicContact CD2-CD1 4.26Å; L379-I433 HydrophobicContact CD2-CG1 4.2Å; L379-I433 HydrophobicContact CD2-CG2 3.8Å; L386-I433 HydrophobicContact CD1-CD1 3.9Å; L386-I433 HydrophobicContact CD2-CD1 4Å; L386-I433 HydrophobicContact CG-CD1 4.38Å; F388-I433 HydrophobicContact CE2-CG2 4.11Å; F388-I433 HydrophobicContact CZ-CB 4.49Å; F388-I433 HydrophobicContact CZ-CD1 3.85Å; F388-I433 HydrophobicContact CZ-CG2 3.81Å; V426-I433 HydrophobicContact CG1-CG2 3.63Å; A428-I433 HydrophobicContact CB-CG1 4.16Å; I433-L435 HydrophobicContact CG2-CD1 3.82Å; I433-V451 CarbonylContact O-C 3.57Å; I433-V451 WeakPolarHBondContact O-CA 3.5Å; I433-Y452 HydrophobicContact CB-CD1 4.5Å; I433-Y452 HydrophobicContact CD1-CD1 4.2Å; I433-Y452 PolarHBondContact N-O 3.44Å; I433-Y452 PolarHBondContact O-N 2.8Å; I433-V454 HydrophobicContact CD1-CG2 3.87Å; I433-V454 HydrophobicContact CG1-CG2 3.84Å
434	Y	95.1	Very high	90.3	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.035	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127	-177.8	-62.5	-101.4	0	0	0	109.2	V426 A427 K429 R432 F436 I449 V451 I481 Y494 T496	V426-Y434 WeakPolarHBondContact CA-O 3.44Å; A427-Y434 PolarHBondContact N-O 2.96Å; A427-Y434 PolarHBondContact O-N 3.01Å; K429-Y434 HydrophobicContact CB-CE2 4.32Å; R432-Y434 HydrophobicContact CB-CD2 4.34Å; R432-Y434 HydrophobicContact CB-CE2 3.65Å; Y434-F436 HydrophobicContact CD1-CZ 4.24Å; Y434-F436 HydrophobicContact CG-CE2 4.36Å; Y434-F436 HydrophobicContact CG-CZ 4.17Å; Y434-I449 HydrophobicContact CD1-CG2 4.4Å; Y434-V451 HydrophobicContact CD1-CB 4.4Å; Y434-V451 HydrophobicContact CD1-CG1 4.02Å; Y434-V451 HydrophobicContact CD1-CG2 3.6Å; Y434-V451 HydrophobicContact CE1-CB 4.47Å; Y434-V451 HydrophobicContact CE1-CG1 3.79Å; Y434-V451 HydrophobicContact CE1-CG2 3.8Å; Y434-I481 HydrophobicContact CD2-CD1 3.5Å; Y434-I481 VanDerWaalsContact CD2-CD1 3.5Å; Y434-I481 HydrophobicContact CE2-CD1 4.06Å; Y434-I481 HydrophobicContact CG-CD1 3.78Å; Y434-Y494 HydrophobicContact CD1-CE1 4.07Å; Y434-Y494 AromaticContact CE1-CE1 3.99Å; Y434-Y494 HydrophobicContact CE1-CE1 3.99Å; Y434-T496 HydrophobicContact CE1-CG2 4.27Å; Y434-T496 HydrophobicContact CE2-CG2 3.93Å
435	L	94.6	Very high	90	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.3	173.8	-76.1	64.6	0	0	0	107.9	F388 M417 A425 V426 I433 I449 Q450 W459	F388-L435 HydrophobicContact CB-CD2 4.08Å; F388-L435 HydrophobicContact CD1-CD1 4.31Å; F388-L435 HydrophobicContact CD1-CD2 4.15Å; F388-L435 HydrophobicContact CE1-CD1 4.4Å; F388-L435 HydrophobicContact CG-CD2 4.2Å; M417-L435 HydrophobicContact CG-CD2 4.48Å; M417-L435 HydrophobicContact SD-CD2 3.34Å; M417-L435 WeakPolarHBondContact SD-CD2 3.25Å; A425-L435 CarbonylContact O-C 3.55Å; A425-L435 WeakPolarHBondContact O-CA 3.17Å; V426-L435 HydrophobicContact CG1-CD1 3.97Å; V426-L435 HydrophobicContact CG1-CG 4.3Å; V426-L435 HydrophobicContact CG2-CD1 4.5Å; V426-L435 HydrophobicContact CG2-CG 3.94Å; I433-L435 HydrophobicContact CG2-CD1 3.82Å; L435-I449 CarbonylContact O-C 3.59Å; L435-I449 VanDerWaalsContact O-CA 3.32Å; L435-I449 WeakPolarHBondContact O-CA 3.33Å; L435-Q450 HydrophobicContact CB-CB 4.16Å; L435-Q450 PolarHBondContact N-O 3.17Å; L435-Q450 PolarHBondContact O-N 2.97Å; L435-W459 HydrophobicContact CD1-CH2 3.72Å; L435-W459 HydrophobicContact CD1-CZ3 3.87Å; L435-W459 HydrophobicContact CD2-CH2 3.83Å; L435-W459 HydrophobicContact CD2-CZ3 4.07Å; L435-W459 HydrophobicContact CG-CH2 4.41Å; L435-W459 HydrophobicContact CG-CZ3 4.47Å
436	F	92.6	Very high	89.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	118.3	179.8	-55.9	-91.7	0	0	0	110.1	A425 Y434 I449 V467 N469 I481 I483 Y494	A425-F436 HydrophobicContact CB-CB 4.25Å; A425-F436 PolarHBondContact N-O 3.45Å; A425-F436 VanDerWaalsContact N-O 3.12Å; A425-F436 PolarHBondContact O-N 3.12Å; Y434-F436 HydrophobicContact CD1-CZ 4.24Å; Y434-F436 HydrophobicContact CG-CE2 4.36Å; Y434-F436 HydrophobicContact CG-CZ 4.17Å; F436-I449 HydrophobicContact CD1-CB 4.41Å; F436-I449 HydrophobicContact CD1-CD1 4.19Å; F436-I449 HydrophobicContact CD1-CG1 3.92Å; F436-I449 HydrophobicContact CD1-CG2 3.84Å; F436-I449 HydrophobicContact CE1-CD1 4.06Å; F436-I449 HydrophobicContact CE1-CG1 4.21Å; F436-I449 HydrophobicContact CE1-CG2 3.7Å; F436-I449 HydrophobicContact CZ-CG2 4.35Å; F436-V467 HydrophobicContact CB-CG1 3.91Å; F436-V467 HydrophobicContact CD1-CG2 4.28Å; F436-N469 PolarHBondContact O-ND2 3.47Å; F436-N469 PolarHBondContact O-OD1 2.81Å; F436-I481 HydrophobicContact CE2-CD1 4.22Å; F436-I481 HydrophobicContact CE2-CG2 3.76Å; F436-I481 HydrophobicContact CZ-CD1 4.18Å; F436-I481 HydrophobicContact CZ-CG2 4.22Å; F436-I483 HydrophobicContact CB-CD1 3.83Å; F436-I483 HydrophobicContact CB-CG1 4.49Å; F436-I483 HydrophobicContact CD1-CD1 3.66Å; F436-I483 HydrophobicContact CD2-CD1 4.09Å; F436-I483 HydrophobicContact CD2-CG1 4.3Å; F436-I483 HydrophobicContact CE1-CD1 4.19Å; F436-I483 HydrophobicContact CG-CD1 3.59Å; F436-I483 HydrophobicContact CG-CG1 4.26Å; F436-Y494 AromaticContact CE1-CD1 3.89Å; F436-Y494 HydrophobicContact CE1-CD1 3.89Å; F436-Y494 HydrophobicContact CE1-CD2 4.48Å; F436-Y494 HydrophobicContact CE1-CE1 4.23Å; F436-Y494 HydrophobicContact CE1-CG 4.01Å; F436-Y494 AromaticContact CZ-CD1 3.64Å; F436-Y494 HydrophobicContact CZ-CD1 3.64Å; F436-Y494 HydrophobicContact CZ-CE1 4.12Å; F436-Y494 HydrophobicContact CZ-CG 4.1Å
437	G	90.3	Very high	89.5	Confident	3 Å²	3	51 Å²	51	3%	0.031	25%	0.25	C	C	.	.			trans	59.4	-132.6	174.2	0	0	0	0	0	114	V446 L448	G437-V446 WeakPolarHBondContact CA-O 3.13Å; G437-L448 PolarHBondContact N-O 2.83Å
438	G	89.6	Confident	89.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.257	C	S	.	.			trans	104.2	-169.9	-167.5	0	0	0	0	0	111.7	L422 V446 N469	L422-G438 CarbonylContact O-C 3.47Å; L422-G438 WeakPolarHBondContact O-CA 3.33Å; G438-V446 PolarHBondContact O-N 2.8Å; G438-N469 PolarHBondContact N-O 2.89Å
439	E	90.1	Very high	89.2	Confident	15 Å²	15	51.6 Å²	51.6	7%	0.07	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-115.9	146.5	-179.7	-57.9	167.3	137	0	0	111.1	V421 L422 H423 N444 V470	V421-E439 CarbonylContact C-O 3.59Å; V421-E439 WeakPolarHBondContact CA-O 3.47Å; L422-E439 HydrophobicContact CB-CB 4.24Å; L422-E439 PolarHBondContact N-O 2.84Å; L422-E439 PolarHBondContact O-N 3.32Å; H423-E439 IonicContact CE1-OE2 2.63Å; H423-E439 PolarHBondContact CE1-OE2 2.79Å; H423-E439 IonicContact CG-OE2 2.68Å; H423-E439 IonicContact ND1-OE2 2.83Å; H423-E439 PolarHBondContact ND1-OE2 2.87Å; E439-N444 WeakPolarHBondContact CA-O 3.24Å; E439-V470 VanDerWaalsContact CD-CG1 3.47Å; E439-V470 HydrophobicContact CG-CB 4.35Å; E439-V470 HydrophobicContact CG-CG1 3.5Å; E439-V470 HydrophobicContact CG-CG2 4.15Å; E439-V470 WeakPolarHBondContact OE1-CG1 3.37Å
440	D	87.9	Confident	89.4	Confident	49 Å²	49	51.1 Å²	51.1	26%	0.262	25%	0.247	S	C	.	.			trans	-86.5	-174.7	167.4	72.7	11.3	0	0	0	111.8	M442 Q443 N444 V446	D440-M442 PolarHBondContact O-N 2.88Å; D440-M442 VanDerWaalsContact OD1-C 3.27Å; D440-M442 VanDerWaalsContact OD1-CA 3.31Å; D440-M442 WeakPolarHBondContact OD1-CA 3.32Å; D440-M442 WeakPolarHBondContact OD1-CB 3.43Å; D440-M442 PolarHBondContact OD1-N 3.1Å; D440-Q443 PolarHBondContact O-N 3.14Å; D440-Q443 PolarHBondContact OD1-N 3.04Å; D440-N444 PolarHBondContact N-O 2.88Å; D440-N444 PolarHBondContact OD1-N 3.24Å; D440-V446 HydrophobicContact CB-CG2 4.03Å
441	I	83.2	Confident	89.9	Confident	121 Å²	121	47.5 Å²	47.5	62%	0.621	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.5	-179.5	-162.2	165.8	0	0	0	113.6	I397 Q443	I397-I441 HydrophobicContact CD1-CB 3.58Å; I397-I441 HydrophobicContact CD1-CG1 4.09Å; I397-I441 HydrophobicContact CG1-CB 4.16Å; I397-I441 HydrophobicContact CG1-CG1 4.23Å; I441-Q443 VanDerWaalsContact C-N 3.29Å
442	M	84.7	Confident	90.3	Very high	141 Å²	141	43.5 Å²	43.5	70%	0.695	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	9.7	176.9	-58.9	-60.3	-69.8	0	0	111.6	D440 N444	D440-M442 PolarHBondContact O-N 2.88Å; D440-M442 VanDerWaalsContact OD1-C 3.27Å; D440-M442 VanDerWaalsContact OD1-CA 3.31Å; D440-M442 WeakPolarHBondContact OD1-CA 3.32Å; D440-M442 WeakPolarHBondContact OD1-CB 3.43Å; D440-M442 PolarHBondContact OD1-N 3.1Å; M442-N444 VanDerWaalsContact CB-ND2 3.34Å; M442-N444 WeakPolarHBondContact CB-ND2 3.14Å; M442-N444 PolarHBondContact O-N 2.92Å
443	Q	81.8	Confident	90.4	Very high	144 Å²	144	39.4 Å²	39.4	67%	0.673	20%	0.195	S	C	*	.			trans	61.3	21.7	-176	-56.2	176.7	-3.3	0	0	113.7	D440 I441	D440-Q443 PolarHBondContact O-N 3.14Å; D440-Q443 PolarHBondContact OD1-N 3.04Å; I441-Q443 VanDerWaalsContact C-N 3.29Å
444	N	86.5	Confident	90	Very high	85 Å²	85	39.8 Å²	39.8	46%	0.455	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-82.5	145.7	174.4	-64.5	-58.1	0	0	0	110.7	E439 D440 M442 V446	E439-N444 WeakPolarHBondContact CA-O 3.24Å; D440-N444 PolarHBondContact N-O 2.88Å; D440-N444 PolarHBondContact OD1-N 3.24Å; M442-N444 VanDerWaalsContact CB-ND2 3.34Å; M442-N444 WeakPolarHBondContact CB-ND2 3.14Å; M442-N444 PolarHBondContact O-N 2.92Å; N444-V446 PolarHBondContact O-N 3.12Å
445	P	86.2	Confident	89.5	Confident	49 Å²	49	40.5 Å²	40.5	32%	0.318	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-66.2	122.9	176.8	26.3	-33.8	0	0	0	111.1	V470	P445-V470 HydrophobicContact CB-CG2 3.73Å
446	V	88.8	Confident	89.3	Confident	16 Å²	16	48.3 Å²	48.3	10%	0.097	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-78	130.2	172.7	179.7	0	0	0	0	109.2	V419 V421 G437 G438 D440 N444 L448	V419-V446 HydrophobicContact CG1-CG1 4.44Å; V421-V446 HydrophobicContact CG1-CB 4.24Å; V421-V446 HydrophobicContact CG1-CG1 4.14Å; V421-V446 HydrophobicContact CG1-CG2 4Å; G437-V446 WeakPolarHBondContact CA-O 3.13Å; G438-V446 PolarHBondContact O-N 2.8Å; D440-V446 HydrophobicContact CB-CG2 4.03Å; N444-V446 PolarHBondContact O-N 3.12Å; V446-L448 HydrophobicContact CG1-CB 4.03Å; V446-L448 HydrophobicContact CG1-CD1 3.9Å; V446-L448 HydrophobicContact CG1-CG 4.12Å
447	R	87.8	Confident	89.3	Confident	125 Å²	125	51.3 Å²	51.3	47%	0.472	25%	0.249	S	C	.	.			trans	-107.8	51.2	-174.2	-67.8	-170.7	-175.2	166.3	5.9	112.4	T464	R447-T464 WeakPolarHBondContact CB-O 3.18Å; R447-T464 PolarHBondContact O-N 3.2Å
448	L	90.7	Very high	89.5	Confident	33 Å²	33	56 Å²	56	17%	0.173	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	149.5	-174.7	-67	167	0	0	0	110.8	V419 G437 V446 E463	V419-L448 HydrophobicContact CB-CD1 4.26Å; V419-L448 HydrophobicContact CG1-CD1 4.42Å; V419-L448 HydrophobicContact CG2-CD1 3.71Å; G437-L448 PolarHBondContact N-O 2.83Å; V446-L448 HydrophobicContact CG1-CB 4.03Å; V446-L448 HydrophobicContact CG1-CD1 3.9Å; V446-L448 HydrophobicContact CG1-CG 4.12Å; L448-E463 HydrophobicContact CD2-CG 3.82Å
449	I	93	Very high	89.9	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.015	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.4	161.8	-45.4	175.6	0	0	0	106.2	Y434 L435 F436 V451 R461 M462 T464 Y494 F501	Y434-I449 HydrophobicContact CD1-CG2 4.4Å; L435-I449 CarbonylContact O-C 3.59Å; L435-I449 VanDerWaalsContact O-CA 3.32Å; L435-I449 WeakPolarHBondContact O-CA 3.33Å; F436-I449 HydrophobicContact CD1-CB 4.41Å; F436-I449 HydrophobicContact CD1-CD1 4.19Å; F436-I449 HydrophobicContact CD1-CG1 3.92Å; F436-I449 HydrophobicContact CD1-CG2 3.84Å; F436-I449 HydrophobicContact CE1-CD1 4.06Å; F436-I449 HydrophobicContact CE1-CG1 4.21Å; F436-I449 HydrophobicContact CE1-CG2 3.7Å; F436-I449 HydrophobicContact CZ-CG2 4.35Å; I449-V451 HydrophobicContact CG2-CG2 4Å; I449-R461 WeakPolarHBondContact O-CA 3.3Å; I449-M462 HydrophobicContact CB-CB 4.23Å; I449-M462 PolarHBondContact N-O 2.97Å; I449-M462 PolarHBondContact O-N 2.86Å; I449-T464 HydrophobicContact CD1-CG2 4.12Å; I449-T464 HydrophobicContact CG1-CG2 3.61Å; I449-Y494 HydrophobicContact CD1-CE2 4.37Å; I449-F501 HydrophobicContact CD1-CE2 4.22Å; I449-F501 HydrophobicContact CD1-CZ 3.77Å
450	Q	94.6	Very high	90	Very high	3 Å²	3	61.8 Å²	61.8	1%	0.014	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.7	174.4	-51.2	-174.3	79.6	0	0	107.9	P418 V419 L435 W459	P418-Q450 VanDerWaalsContact CD-OE1 3.29Å; V419-Q450 PolarHBondContact O-NE2 2.84Å; V419-Q450 PolarHBondContact O-OE1 3.44Å; L435-Q450 HydrophobicContact CB-CB 4.16Å; L435-Q450 PolarHBondContact N-O 3.17Å; L435-Q450 PolarHBondContact O-N 2.97Å; Q450-W459 HydrophobicContact CB-CE3 3.89Å; Q450-W459 HydrophobicContact CB-CZ3 3.73Å
451	V	95.6	Very high	90.2	Very high	8 Å²	8	68.4 Å²	68.4	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	117.7	-175.1	-172.2	0	0	0	0	109	R432 I433 Y434 I449 W459 F460 M462	R432-V451 HydrophobicContact CB-CG1 3.98Å; R432-V451 HydrophobicContact CG-CG1 4.33Å; I433-V451 CarbonylContact O-C 3.57Å; I433-V451 WeakPolarHBondContact O-CA 3.5Å; Y434-V451 HydrophobicContact CD1-CB 4.4Å; Y434-V451 HydrophobicContact CD1-CG1 4.02Å; Y434-V451 HydrophobicContact CD1-CG2 3.6Å; Y434-V451 HydrophobicContact CE1-CB 4.47Å; Y434-V451 HydrophobicContact CE1-CG1 3.79Å; Y434-V451 HydrophobicContact CE1-CG2 3.8Å; I449-V451 HydrophobicContact CG2-CG2 4Å; V451-W459 CarbonylContact O-C 3.59Å; V451-W459 WeakPolarHBondContact O-CA 3.25Å; V451-F460 HydrophobicContact CB-CB 4.49Å; V451-F460 PolarHBondContact N-O 3.01Å; V451-F460 PolarHBondContact O-N 3.15Å; V451-M462 HydrophobicContact CG2-SD 4.29Å
452	Y	96.1	Very high	90.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	124.9	177.1	-177.7	-119.9	0	0	0	110.9	L386 M414 A415 R432 I433 V454 N457 M458 W459	L386-Y452 HydrophobicContact CD2-CD1 4.3Å; L386-Y452 HydrophobicContact CD2-CE1 3.75Å; M414-Y452 WeakPolarHBondContact CE-OH 3.42Å; A415-Y452 HydrophobicContact CB-CE2 4.44Å; R432-Y452 CarbonylContact C-O 3.51Å; R432-Y452 VanDerWaalsContact CA-O 3.28Å; R432-Y452 WeakPolarHBondContact CA-O 3.5Å; I433-Y452 HydrophobicContact CB-CD1 4.5Å; I433-Y452 HydrophobicContact CD1-CD1 4.2Å; I433-Y452 PolarHBondContact N-O 3.44Å; I433-Y452 PolarHBondContact O-N 2.8Å; Y452-V454 HydrophobicContact CD1-CG2 4.05Å; Y452-V454 HydrophobicContact CE1-CB 4.39Å; Y452-V454 HydrophobicContact CE1-CG2 4.21Å; Y452-N457 WeakPolarHBondContact CE2-OD1 2.82Å; Y452-N457 PolarHBondContact OH-OD1 3.48Å; Y452-M458 WeakPolarHBondContact CD2-O 3.34Å; Y452-W459 AromaticContact CD2-CD1 3.78Å; Y452-W459 AromaticContact CD2-CD2 3.79Å; Y452-W459 HydrophobicContact CD2-CD2 3.79Å; Y452-W459 AromaticContact CD2-CE2 3.31Å; Y452-W459 HydrophobicContact CD2-CG 4.04Å; Y452-W459 HydrophobicContact CD2-CH2 4.47Å; Y452-W459 AromaticContact CD2-CZ2 3.67Å; Y452-W459 HydrophobicContact CD2-CZ2 3.67Å; Y452-W459 AromaticContact CD2-NE1 3.32Å; Y452-W459 VanDerWaalsContact CD2-NE1 3.32Å; Y452-W459 HydrophobicContact CE2-CZ2 4.46Å; Y452-W459 AromaticContact CE2-NE1 3.68Å; Y452-W459 HydrophobicContact CG-CD2 4.29Å; Y452-W459 AromaticContact CG-CE2 3.83Å; Y452-W459 HydrophobicContact CG-CH2 4.18Å; Y452-W459 AromaticContact CG-CZ2 3.73Å; Y452-W459 HydrophobicContact CG-CZ2 3.73Å
453	H	92.8	Very high	90.5	Very high	22 Å²	22	67.1 Å²	67.1	10%	0.102	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	101.9	174.4	-161.3	-52.6	0	0	0	109.2	S455 R456 N457 M458	H453-S455 PolarHBondContact CE1-OG 3.11Å; H453-S455 PolarHBondContact ND1-OG 2.85Å; H453-S455 VanDerWaalsContact ND1-OG 3.07Å; H453-S455 PolarHBondContact O-N 3.07Å; H453-R456 HydrophobicContact CB-CB 4.25Å; H453-R456 PolarHBondContact O-N 2.86Å; H453-R456 VanDerWaalsContact O-N 3.16Å; H453-N457 PolarHBondContact O-N 3.47Å; H453-M458 PolarHBondContact N-O 3.49Å; H453-M458 PolarHBondContact O-N 2.81Å
454	V	88.3	Confident	90.5	Very high	8 Å²	8	61 Å²	61	5%	0.048	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58.4	-46	-168.7	-173.6	0	0	0	0	111.8	L262 Y381 I433 Y452 R456 N457	L262-V454 HydrophobicContact CD2-CB 4.48Å; L262-V454 HydrophobicContact CD2-CG1 3.71Å; Y381-V454 HydrophobicContact CD1-CB 4.45Å; Y381-V454 HydrophobicContact CD1-CG1 4.03Å; Y381-V454 HydrophobicContact CD1-CG2 4.02Å; Y381-V454 HydrophobicContact CE1-CB 4.15Å; Y381-V454 HydrophobicContact CE1-CG1 4Å; Y381-V454 HydrophobicContact CE1-CG2 3.95Å; I433-V454 HydrophobicContact CD1-CG2 3.87Å; I433-V454 HydrophobicContact CG1-CG2 3.84Å; Y452-V454 HydrophobicContact CD1-CG2 4.05Å; Y452-V454 HydrophobicContact CE1-CB 4.39Å; Y452-V454 HydrophobicContact CE1-CG2 4.21Å; V454-R456 VanDerWaalsContact C-N 3.35Å; V454-R456 PolarHBondContact O-N 3.3Å; V454-N457 PolarHBondContact O-N 3.37Å
455	S	85.5	Confident	90.1	Very high	25 Å²	25	67.8 Å²	67.8	18%	0.175	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-72.4	-23.3	-177.7	60.3	0	0	0	0	115.3	L262 H453	L262-S455 WeakPolarHBondContact O-CB 3.4Å; H453-S455 PolarHBondContact CE1-OG 3.11Å; H453-S455 PolarHBondContact ND1-OG 2.85Å; H453-S455 VanDerWaalsContact ND1-OG 3.07Å; H453-S455 PolarHBondContact O-N 3.07Å
456	R	89.2	Confident	89.7	Confident	164 Å²	164	69.2 Å²	69.2	62%	0.619	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-96.7	-10.4	178.7	-65.5	-177.8	-177.4	-173.3	0.9	112.2	H453 V454 M458	H453-R456 HydrophobicContact CB-CB 4.25Å; H453-R456 PolarHBondContact O-N 2.86Å; H453-R456 VanDerWaalsContact O-N 3.16Å; V454-R456 VanDerWaalsContact C-N 3.35Å; V454-R456 PolarHBondContact O-N 3.3Å; R456-M458 VanDerWaalsContact C-N 3.26Å; R456-M458 HydrophobicContact CB-CB 4.25Å; R456-M458 HydrophobicContact CB-CG 4.25Å; R456-M458 HydrophobicContact CB-SD 4.38Å; R456-M458 WeakPolarHBondContact O-CG 3.3Å; R456-M458 PolarHBondContact O-N 2.76Å
457	N	92.8	Very high	88.9	Confident	64 Å²	64	68.5 Å²	68.5	34%	0.342	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	47.3	-170.5	-167.8	24.1	0	0	0	112.1	A415 Y452 H453 V454	A415-N457 WeakPolarHBondContact CB-O 3.35Å; A415-N457 VanDerWaalsContact CB-OD1 3.27Å; A415-N457 WeakPolarHBondContact CB-OD1 3.41Å; A415-N457 PolarHBondContact N-OD1 3.41Å; Y452-N457 WeakPolarHBondContact CE2-OD1 2.82Å; Y452-N457 PolarHBondContact OH-OD1 3.48Å; H453-N457 PolarHBondContact O-N 3.47Å; V454-N457 PolarHBondContact O-N 3.37Å
458	M	94.9	Very high	88	Confident	100 Å²	100	67.7 Å²	67.7	49%	0.493	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.4	-174.9	-74.4	-177.7	78.3	0	0	112.1	Y452 H453 R456	Y452-M458 WeakPolarHBondContact CD2-O 3.34Å; H453-M458 PolarHBondContact N-O 3.49Å; H453-M458 PolarHBondContact O-N 2.81Å; R456-M458 VanDerWaalsContact C-N 3.26Å; R456-M458 HydrophobicContact CB-CB 4.25Å; R456-M458 HydrophobicContact CB-CG 4.25Å; R456-M458 HydrophobicContact CB-SD 4.38Å; R456-M458 WeakPolarHBondContact O-CG 3.3Å; R456-M458 PolarHBondContact O-N 2.76Å
459	W	96.6	Very high	87.1	Confident	32 Å²	32	66.4 Å²	66.4	12%	0.121	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	144.9	180	-72.1	92	0	0	0	112.6	F388 V401 A415 S416 M417 P418 L435 Q450 V451 Y452	F388-W459 AromaticContact CD1-CH2 3.92Å; F388-W459 HydrophobicContact CD1-CH2 3.92Å; F388-W459 HydrophobicContact CD1-CZ2 4.11Å; F388-W459 AromaticContact CE1-CH2 3.9Å; F388-W459 HydrophobicContact CE1-CH2 3.9Å; F388-W459 AromaticContact CE1-CZ2 3.97Å; F388-W459 HydrophobicContact CE1-CZ2 3.97Å; V401-W459 HydrophobicContact CG2-CZ2 3.86Å; A415-W459 PolarHBondContact O-NE1 3.24Å; S416-W459 PolarHBondContact O-NE1 2.91Å; M417-W459 HydrophobicContact CG-CH2 3.74Å; M417-W459 HydrophobicContact CG-CZ2 3.62Å; M417-W459 HydrophobicContact CG-CZ3 4.35Å; M417-W459 HydrophobicContact SD-CH2 4.27Å; P418-W459 HydrophobicContact CG-CB 3.66Å; P418-W459 HydrophobicContact CG-CG 4.22Å; L435-W459 HydrophobicContact CD1-CH2 3.72Å; L435-W459 HydrophobicContact CD1-CZ3 3.87Å; L435-W459 HydrophobicContact CD2-CH2 3.83Å; L435-W459 HydrophobicContact CD2-CZ3 4.07Å; L435-W459 HydrophobicContact CG-CH2 4.41Å; L435-W459 HydrophobicContact CG-CZ3 4.47Å; Q450-W459 HydrophobicContact CB-CE3 3.89Å; Q450-W459 HydrophobicContact CB-CZ3 3.73Å; V451-W459 CarbonylContact O-C 3.59Å; V451-W459 WeakPolarHBondContact O-CA 3.25Å; Y452-W459 AromaticContact CD2-CD1 3.78Å; Y452-W459 AromaticContact CD2-CD2 3.79Å; Y452-W459 HydrophobicContact CD2-CD2 3.79Å; Y452-W459 AromaticContact CD2-CE2 3.31Å; Y452-W459 HydrophobicContact CD2-CG 4.04Å; Y452-W459 HydrophobicContact CD2-CH2 4.47Å; Y452-W459 AromaticContact CD2-CZ2 3.67Å; Y452-W459 HydrophobicContact CD2-CZ2 3.67Å; Y452-W459 AromaticContact CD2-NE1 3.32Å; Y452-W459 VanDerWaalsContact CD2-NE1 3.32Å; Y452-W459 HydrophobicContact CE2-CZ2 4.46Å; Y452-W459 AromaticContact CE2-NE1 3.68Å; Y452-W459 HydrophobicContact CG-CD2 4.29Å; Y452-W459 AromaticContact CG-CE2 3.83Å; Y452-W459 HydrophobicContact CG-CH2 4.18Å; Y452-W459 AromaticContact CG-CZ2 3.73Å; Y452-W459 HydrophobicContact CG-CZ2 3.73Å
460	F	93.7	Very high	86.2	Confident	105 Å²	105	66.3 Å²	66.3	46%	0.461	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	148	168	-62.8	-86.9	0	0	0	109.3	V451	V451-F460 HydrophobicContact CB-CB 4.49Å; V451-F460 PolarHBondContact N-O 3.01Å; V451-F460 PolarHBondContact O-N 3.15Å
461	R	91.8	Very high	85.5	Confident	188 Å²	188	66.6 Å²	66.6	71%	0.709	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.7	178.3	67.7	-179.7	-177.9	-177.6	0.7	110.8	I449	I449-R461 WeakPolarHBondContact O-CA 3.3Å
462	M	89.9	Confident	85	Confident	58 Å²	58	66.4 Å²	66.4	29%	0.286	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	128.1	175.8	-54.7	169.7	62.9	0	0	108.8	I449 V451 N499	I449-M462 HydrophobicContact CB-CB 4.23Å; I449-M462 PolarHBondContact N-O 2.97Å; I449-M462 PolarHBondContact O-N 2.86Å; V451-M462 HydrophobicContact CG2-SD 4.29Å; M462-N499 VanDerWaalsContact CE-CG 3.49Å; M462-N499 WeakPolarHBondContact CE-ND2 3.46Å; M462-N499 WeakPolarHBondContact CE-OD1 3.38Å
463	E	84.6	Confident	84.9	Confident	177 Å²	177	66.5 Å²	66.5	83%	0.827	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	146.4	174.5	-67.3	-175.5	-178.8	0	0	110.8	L448	L448-E463 HydrophobicContact CD2-CG 3.82Å
464	T	82	Confident	84.9	Confident	16 Å²	16	66 Å²	66	10%	0.098	30%	0.296	C	S	.	.			trans	-148.7	139.3	178.3	175.3	0	0	0	0	111.2	R447 I449 V466 V467	R447-T464 WeakPolarHBondContact CB-O 3.18Å; R447-T464 PolarHBondContact O-N 3.2Å; I449-T464 HydrophobicContact CD1-CG2 4.12Å; I449-T464 HydrophobicContact CG1-CG2 3.61Å; T464-V466 PolarHBondContact OG1-N 3.09Å; T464-V467 HydrophobicContact CG2-CB 3.59Å; T464-V467 HydrophobicContact CG2-CG2 3.75Å
465	R	78.3	Confident	85.2	Confident	227 Å²	227	66.3 Å²	66.3	86%	0.857	30%	0.299	S	S	*	.	S	Bend	trans	-94.8	-11.3	172.9	-62.7	-176.1	-178.6	-176.9	-0.6	112.9
466	V	76.8	Confident	85.6	Confident	79 Å²	79	67.6 Å²	67.6	48%	0.479	31%	0.305	S	S	.	.	S	Bend	trans	-82.2	-40.1	-173.9	-175.3	0	0	0	0	110.7	T464 K468 I492 F501	T464-V466 PolarHBondContact OG1-N 3.09Å; V466-K468 PolarHBondContact O-N 3.09Å; V466-I492 HydrophobicContact CG1-CD1 4.03Å; V466-F501 HydrophobicContact CB-CD2 3.95Å; V466-F501 HydrophobicContact CB-CE2 4.19Å; V466-F501 HydrophobicContact CB-CG 4.24Å; V466-F501 HydrophobicContact CG1-CB 4.08Å; V466-F501 HydrophobicContact CG1-CD1 4.23Å; V466-F501 HydrophobicContact CG1-CD2 4.09Å; V466-F501 HydrophobicContact CG1-CG 3.86Å; V466-F501 HydrophobicContact CG2-CD2 3.94Å; V466-F501 HydrophobicContact CG2-CE2 4.42Å; V466-F501 HydrophobicContact CG2-CG 4.48Å
467	V	71.9	Confident	85.8	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.006	28%	0.279	C	S	.	.			trans	-83	108.2	-177	179.5	0	0	0	0	108.6	F436 T464 N469 I483 I492 F501	F436-V467 HydrophobicContact CB-CG1 3.91Å; F436-V467 HydrophobicContact CD1-CG2 4.28Å; T464-V467 HydrophobicContact CG2-CB 3.59Å; T464-V467 HydrophobicContact CG2-CG2 3.75Å; V467-N469 WeakPolarHBondContact CG1-OD1 3.39Å; V467-I483 HydrophobicContact CG2-CD1 4.29Å; V467-I492 HydrophobicContact CG2-CD1 4.41Å; V467-F501 HydrophobicContact CG2-CE1 3.66Å; V467-F501 HydrophobicContact CG2-CE2 4.35Å; V467-F501 HydrophobicContact CG2-CZ 3.44Å; V467-F501 VanDerWaalsContact CG2-CZ 3.44Å
468	K	69.9	Low	85.5	Confident	108 Å²	108	59.9 Å²	59.9	47%	0.47	29%	0.289	S	S	.	.			trans	-125.6	22.9	173.7	-60.7	-177.2	-179	-179.7	0	110.8	V466	V466-K468 PolarHBondContact O-N 3.09Å
469	N	70.9	Confident	85.1	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.037	28%	0.283	C	S	.	.			trans	-73.3	136.7	-172.3	66.5	-51.9	0	0	0	110	A425 F436 G438 V467 A472 I483	A425-N469 WeakPolarHBondContact CB-ND2 3.4Å; F436-N469 PolarHBondContact O-ND2 3.47Å; F436-N469 PolarHBondContact O-OD1 2.81Å; G438-N469 PolarHBondContact N-O 2.89Å; V467-N469 WeakPolarHBondContact CG1-OD1 3.39Å; N469-A472 HydrophobicContact CB-CB 3.71Å; N469-I483 HydrophobicContact CB-CG2 4.08Å
470	V	73.1	Confident	84.9	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	29%	0.293	C	S	.	.	S	Bend	trans	-132.2	128.6	173.7	168.6	0	0	0	0	106	E439 P445 A472 G486 Y487	E439-V470 VanDerWaalsContact CD-CG1 3.47Å; E439-V470 HydrophobicContact CG-CB 4.35Å; E439-V470 HydrophobicContact CG-CG1 3.5Å; E439-V470 HydrophobicContact CG-CG2 4.15Å; E439-V470 WeakPolarHBondContact OE1-CG1 3.37Å; P445-V470 HydrophobicContact CB-CG2 3.73Å; V470-A472 PolarHBondContact O-N 3.08Å; V470-G486 WeakPolarHBondContact O-CA 3.44Å; V470-Y487 HydrophobicContact CB-CD2 3.4Å; V470-Y487 HydrophobicContact CB-CE2 3.3Å; V470-Y487 HydrophobicContact CB-CG 4.47Å; V470-Y487 HydrophobicContact CG1-CD2 4Å; V470-Y487 HydrophobicContact CG1-CE2 3.37Å; V470-Y487 HydrophobicContact CG2-CD2 3.6Å; V470-Y487 HydrophobicContact CG2-CE2 3.51Å
471	C	80.2	Confident	84.9	Confident	8 Å²	8	55.2 Å²	55.2	5%	0.054	27%	0.271	C	S	.	.	S	Bend	trans	53.8	37.9	-179.3	-55.1	0	0	0	0	113.1	H423 M512 H513	H423-C471 HydrophobicContact CB-CB 4.49Å; C471-M512 HydrophobicContact CB-CB 4.36Å; C471-H513 PolarHBondContact O-N 3.14Å; C471-H513 PolarHBondContact SG-CE1 3.44Å; C471-H513 PolarHBondContact SG-NE2 2.86Å
472	A	86.4	Confident	85	Confident	5 Å²	5	46.4 Å²	46.4	4%	0.041	24%	0.238	C	C	.	.			trans	-106.5	137	177.7	0	0	0	0	0	109.9	A425 N469 V470 I483 V484	A425-A472 WeakPolarHBondContact CA-O 3.49Å; A425-A472 WeakPolarHBondContact CB-O 3.24Å; N469-A472 HydrophobicContact CB-CB 3.71Å; V470-A472 PolarHBondContact O-N 3.08Å; A472-I483 HydrophobicContact CB-CG2 4.47Å; A472-V484 WeakPolarHBondContact CB-O 3.43Å
473	P	92.3	Very high	85.2	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.013	23%	0.226	C	C	.	.			trans	-77.3	154.7	169.2	30.9	-32.5	0	0	0	111.8	V484 H514 A516	P473-V484 HydrophobicContact CG-CB 4.29Å; P473-V484 PolarHBondContact O-N 3.31Å; P473-H514 VanDerWaalsContact CD-NE2 3.3Å; P473-H514 WeakPolarHBondContact CD-NE2 3.48Å; P473-A516 HydrophobicContact CB-CB 3.86Å; P473-A516 HydrophobicContact CG-CB 3.34Å
474	A	94.1	Very high	85.6	Confident	10 Å²	10	35.4 Å²	35.4	8%	0.083	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	145.5	162.7	0	0	0	0	0	109.4	A425 A427 I481 I482 I483	A425-A474 HydrophobicContact CB-CB 3.75Å; A427-A474 HydrophobicContact CB-CB 4.16Å; A474-I481 HydrophobicContact CB-CG2 4.17Å; A474-I482 CarbonylContact C-O 3.57Å; A474-I482 VanDerWaalsContact CA-O 3.23Å; A474-I482 WeakPolarHBondContact CA-O 3.43Å; A474-I483 HydrophobicContact CB-CG1 4.38Å
475	V	94.5	Very high	85.8	Confident	16 Å²	16	34.9 Å²	34.9	10%	0.097	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	162.6	177.3	-61.7	0	0	0	0	110.3	I477 I481 I482 A516 V518 L523	V475-I477 HydrophobicContact CG2-CD1 4.39Å; V475-I477 HydrophobicContact CG2-CG1 4.22Å; V475-I481 CarbonylContact O-C 3.58Å; V475-I481 WeakPolarHBondContact O-CA 3.22Å; V475-I482 HydrophobicContact CG2-CB 4.14Å; V475-I482 PolarHBondContact N-O 2.84Å; V475-I482 PolarHBondContact O-N 2.93Å; V475-A516 HydrophobicContact CG1-CB 4.21Å; V475-V518 HydrophobicContact CB-CG2 3.67Å; V475-V518 HydrophobicContact CG1-CG2 4.26Å; V475-V518 HydrophobicContact CG2-CG2 3.68Å; V475-L523 HydrophobicContact CG2-CD1 3.8Å
476	V	94.3	Very high	86.1	Confident	52 Å²	52	24.1 Å²	24.1	32%	0.315	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.1	175.9	-176.5	0	0	0	0	109.2	A427 A428 K429 I481	A427-V476 HydrophobicContact CB-CG2 3.97Å; A428-V476 WeakPolarHBondContact O-CG2 3.45Å; K429-V476 HydrophobicContact CD-CG1 4.43Å; V476-I481 HydrophobicContact CG2-CG1 4.38Å
477	I	91.9	Very high	86.2	Confident	11 Å²	11	25.7 Å²	25.7	6%	0.056	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	122.1	175.2	-58.1	-162.9	0	0	0	108	V475 D479 Q480 I482 V518 N521 L523 P548	V475-I477 HydrophobicContact CG2-CD1 4.39Å; V475-I477 HydrophobicContact CG2-CG1 4.22Å; I477-D479 PolarHBondContact O-N 3.47Å; I477-Q480 PolarHBondContact N-O 3.1Å; I477-Q480 PolarHBondContact O-N 2.89Å; I477-I482 HydrophobicContact CB-CD1 3.78Å; I477-I482 HydrophobicContact CB-CG1 4.36Å; I477-I482 HydrophobicContact CD1-CD1 3.69Å; I477-I482 HydrophobicContact CG1-CD1 3.81Å; I477-I482 HydrophobicContact CG1-CG1 4.4Å; I477-I482 HydrophobicContact CG2-CD1 4.47Å; I477-V518 HydrophobicContact CD1-CG1 4.19Å; I477-V518 HydrophobicContact CD1-CG2 3.73Å; I477-V518 HydrophobicContact CG1-CB 4.43Å; I477-V518 HydrophobicContact CG1-CG1 3.98Å; I477-V518 HydrophobicContact CG1-CG2 3.53Å; I477-N521 VanDerWaalsContact CG2-OD1 3.25Å; I477-N521 WeakPolarHBondContact CG2-OD1 3.42Å; I477-L523 HydrophobicContact CD1-CB 3.66Å; I477-P548 HydrophobicContact CG2-CB 4.35Å; I477-P548 HydrophobicContact CG2-CG 3.91Å
478	G	86.9	Confident	86.7	Confident	55 Å²	55	27.8 Å²	27.8	57%	0.567	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	-121.8	-170.9	0	0	0	0	0	112	N521	G478-N521 PolarHBondContact N-OD1 2.9Å
479	D	86.3	Confident	87.5	Confident	69 Å²	69	28.8 Å²	28.8	37%	0.369	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	16.7	-178.6	-157.3	28.6	0	0	0	113.4	K429 I477 K497	K429-D479 WeakPolarHBondContact CE-O 3.35Å; K429-D479 WeakPolarHBondContact CE-OD1 3.32Å; K429-D479 PolarHBondContact NZ-O 3.29Å; K429-D479 IonicContact NZ-OD1 2.86Å; K429-D479 PolarHBondContact NZ-OD1 2.85Å; I477-D479 PolarHBondContact O-N 3.47Å; D479-K497 IonicContact OD1-NZ 2.72Å; D479-K497 WeakPolarHBondContact OD2-CE 3.4Å; D479-K497 IonicContact OD2-NZ 3.91Å; D479-K497 PolarHBondContact OD2-NZ 3.28Å
480	Q	92.1	Very high	88.3	Confident	69 Å²	69	36 Å²	36	32%	0.322	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149.6	-175.9	-64.9	-178.6	-22.4	0	0	112.8	I477 A493	I477-Q480 PolarHBondContact N-O 3.1Å; I477-Q480 PolarHBondContact O-N 2.89Å; Q480-A493 HydrophobicContact CB-CB 4.27Å
481	I	95	Very high	89.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120.1	170.9	-59.4	172.8	0	0	0	108.5	A427 K429 Y434 F436 A474 V475 V476 A493 Y494 T496	A427-I481 HydrophobicContact CB-CD1 4.22Å; A427-I481 HydrophobicContact CB-CG1 4.24Å; A427-I481 HydrophobicContact CB-CG2 3.57Å; K429-I481 HydrophobicContact CB-CD1 4.11Å; K429-I481 HydrophobicContact CB-CG1 4.29Å; K429-I481 HydrophobicContact CD-CG1 4.1Å; Y434-I481 HydrophobicContact CD2-CD1 3.5Å; Y434-I481 VanDerWaalsContact CD2-CD1 3.5Å; Y434-I481 HydrophobicContact CE2-CD1 4.06Å; Y434-I481 HydrophobicContact CG-CD1 3.78Å; F436-I481 HydrophobicContact CE2-CD1 4.22Å; F436-I481 HydrophobicContact CE2-CG2 3.76Å; F436-I481 HydrophobicContact CZ-CD1 4.18Å; F436-I481 HydrophobicContact CZ-CG2 4.22Å; A474-I481 HydrophobicContact CB-CG2 4.17Å; V475-I481 CarbonylContact O-C 3.58Å; V475-I481 WeakPolarHBondContact O-CA 3.22Å; V476-I481 HydrophobicContact CG2-CG1 4.38Å; I481-A493 CarbonylContact O-C 3.51Å; I481-A493 WeakPolarHBondContact O-CA 3.49Å; I481-Y494 HydrophobicContact CD1-CD1 4.4Å; I481-Y494 PolarHBondContact N-O 3.03Å; I481-Y494 PolarHBondContact O-N 3.18Å; I481-T496 HydrophobicContact CD1-CG2 3.85Å; I481-T496 HydrophobicContact CG1-CG2 4.34Å
482	I	94.1	Very high	89.7	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.9	-179.4	-55.8	-171	0	0	0	109.7	A474 V475 I477 V484 I491 A493 L523	A474-I482 CarbonylContact C-O 3.57Å; A474-I482 VanDerWaalsContact CA-O 3.23Å; A474-I482 WeakPolarHBondContact CA-O 3.43Å; V475-I482 HydrophobicContact CG2-CB 4.14Å; V475-I482 PolarHBondContact N-O 2.84Å; V475-I482 PolarHBondContact O-N 2.93Å; I477-I482 HydrophobicContact CB-CD1 3.78Å; I477-I482 HydrophobicContact CB-CG1 4.36Å; I477-I482 HydrophobicContact CD1-CD1 3.69Å; I477-I482 HydrophobicContact CG1-CD1 3.81Å; I477-I482 HydrophobicContact CG1-CG1 4.4Å; I477-I482 HydrophobicContact CG2-CD1 4.47Å; I482-V484 HydrophobicContact CG2-CG2 4Å; I482-I491 HydrophobicContact CG2-CG2 3.25Å; I482-A493 HydrophobicContact CG1-CB 4.3Å; I482-L523 HydrophobicContact CG2-CD2 4.39Å
483	I	93.4	Very high	90	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.7	173.2	-55.2	163.6	0	0	0	107.8	A425 F436 V467 N469 A472 A474 I491 I492 F501	A425-I483 HydrophobicContact CB-CG2 4.48Å; F436-I483 HydrophobicContact CB-CD1 3.83Å; F436-I483 HydrophobicContact CB-CG1 4.49Å; F436-I483 HydrophobicContact CD1-CD1 3.66Å; F436-I483 HydrophobicContact CD2-CD1 4.09Å; F436-I483 HydrophobicContact CD2-CG1 4.3Å; F436-I483 HydrophobicContact CE1-CD1 4.19Å; F436-I483 HydrophobicContact CG-CD1 3.59Å; F436-I483 HydrophobicContact CG-CG1 4.26Å; V467-I483 HydrophobicContact CG2-CD1 4.29Å; N469-I483 HydrophobicContact CB-CG2 4.08Å; A472-I483 HydrophobicContact CB-CG2 4.47Å; A474-I483 HydrophobicContact CB-CG1 4.38Å; I483-I491 WeakPolarHBondContact O-CA 3.36Å; I483-I492 HydrophobicContact CB-CD1 4.41Å; I483-I492 HydrophobicContact CB-CG1 3.82Å; I483-I492 HydrophobicContact CD1-CD1 3.98Å; I483-I492 HydrophobicContact CD1-CG1 4.06Å; I483-I492 HydrophobicContact CG1-CG1 4.39Å; I483-I492 PolarHBondContact N-O 2.86Å; I483-I492 PolarHBondContact O-N 3.35Å; I483-F501 HydrophobicContact CD1-CE1 4.22Å
484	V	92.1	Very high	90.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	105.2	-168.3	-169.9	0	0	0	0	110	A472 P473 I482 M507 H514 A516 L523 V525	A472-V484 WeakPolarHBondContact CB-O 3.43Å; P473-V484 HydrophobicContact CG-CB 4.29Å; P473-V484 PolarHBondContact O-N 3.31Å; I482-V484 HydrophobicContact CG2-CG2 4Å; V484-M507 HydrophobicContact CG1-SD 4.06Å; V484-H514 PolarHBondContact O-CE1 2.86Å; V484-H514 PolarHBondContact O-NE2 2.87Å; V484-H514 VanDerWaalsContact O-NE2 3.14Å; V484-A516 HydrophobicContact CG2-CB 4.4Å; V484-L523 HydrophobicContact CG1-CD2 4.31Å; V484-L523 HydrophobicContact CG2-CD1 4.21Å; V484-L523 HydrophobicContact CG2-CD2 3.66Å; V484-V525 HydrophobicContact CG1-CG2 3.73Å
485	G	87.4	Confident	90	Very high	4 Å²	4	38 Å²	38	4%	0.041	19%	0.189	C	C	.	.			trans	72.2	-135	167.3	0	0	0	0	0	116.7	T488 R490	G485-T488 WeakPolarHBondContact CA-O 3.29Å; G485-R490 PolarHBondContact N-O 2.93Å; G485-R490 VanDerWaalsContact N-O 3.12Å
486	G	84.4	Confident	89.7	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.01	19%	0.191	C	C	.	.	S	Bend	trans	100	-136.1	-166.4	0	0	0	0	0	111.4	V470 T488 R511	V470-G486 WeakPolarHBondContact O-CA 3.44Å; G486-T488 PolarHBondContact O-N 3.28Å; G486-R511 WeakPolarHBondContact CA-O 3.28Å; G486-R511 PolarHBondContact N-O 2.88Å; G486-R511 CarbonylContact O-C 3.55Å; G486-R511 VanDerWaalsContact O-O 3.04Å
487	Y	78.8	Confident	89.4	Confident	113 Å²	113	43 Å²	43	44%	0.443	21%	0.207	S	C	.	.	S	Bend	trans	-66.8	6	172	-74.3	-59.1	0	0	0	114.8	V470 M512	V470-Y487 HydrophobicContact CB-CD2 3.4Å; V470-Y487 HydrophobicContact CB-CE2 3.3Å; V470-Y487 HydrophobicContact CB-CG 4.47Å; V470-Y487 HydrophobicContact CG1-CD2 4Å; V470-Y487 HydrophobicContact CG1-CE2 3.37Å; V470-Y487 HydrophobicContact CG2-CD2 3.6Å; V470-Y487 HydrophobicContact CG2-CE2 3.51Å; Y487-M512 HydrophobicContact CD1-SD 4.48Å; Y487-M512 HydrophobicContact CE1-SD 4.03Å
488	T	83.3	Confident	89.2	Confident	44 Å²	44	44 Å²	44	27%	0.27	22%	0.221	S	C	.	.	S	Bend	trans	-132.1	162.4	-178.7	83	0	0	0	0	110.4	G485 G486 R490	G485-T488 WeakPolarHBondContact CA-O 3.29Å; G486-T488 PolarHBondContact O-N 3.28Å; T488-R490 VanDerWaalsContact C-N 3.26Å; T488-R490 WeakPolarHBondContact OG1-CB 3.42Å; T488-R490 PolarHBondContact OG1-N 3.46Å; T488-R490 VanDerWaalsContact OG1-N 3.12Å
489	R	86.8	Confident	89.2	Confident	130 Å²	130	45.3 Å²	45.3	49%	0.491	22%	0.215	S	C	.	.	S	Bend	trans	-84.1	-1.4	168.6	67.9	171.4	-165.9	-177.2	1.4	113.1	D506 M507 R510	R489-D506 HydrophobicContact CG-CB 3.93Å; R489-D506 IonicContact CZ-OD2 3.43Å; R489-D506 VanDerWaalsContact CZ-OD2 3.32Å; R489-D506 IonicContact NE-OD2 2.82Å; R489-D506 PolarHBondContact NE-OD2 2.78Å; R489-D506 IonicContact NH2-OD2 2.88Å; R489-D506 PolarHBondContact NH2-OD2 3.08Å; R489-D506 VanDerWaalsContact NH2-OD2 3.11Å; R489-D506 CarbonylContact O-C 3.56Å; R489-D506 WeakPolarHBondContact O-CA 3.5Å; R489-M507 HydrophobicContact CB-CB 4.44Å; R489-M507 WeakPolarHBondContact CB-O 3.42Å; R489-M507 PolarHBondContact O-N 3.29Å; R489-R510 HydrophobicContact CB-CG 4.44Å
490	R	87.8	Confident	89.5	Confident	157 Å²	157	48.9 Å²	48.9	59%	0.592	23%	0.227	S	C	*	.			trans	-78.2	143.4	-169.1	-64.1	-178.1	-179.3	-178.5	-0.6	110.3	G485 T488	G485-R490 PolarHBondContact N-O 2.93Å; G485-R490 VanDerWaalsContact N-O 3.12Å; T488-R490 VanDerWaalsContact C-N 3.26Å; T488-R490 WeakPolarHBondContact OG1-CB 3.42Å; T488-R490 PolarHBondContact OG1-N 3.46Å; T488-R490 VanDerWaalsContact OG1-N 3.12Å
491	I	90.6	Very high	89.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.9	163.3	-53.7	168.5	0	0	0	107	I482 I483 C504 A505 M507 Y546 W553	I482-I491 HydrophobicContact CG2-CG2 3.25Å; I483-I491 WeakPolarHBondContact O-CA 3.36Å; I491-C504 HydrophobicContact CB-CB 3.91Å; I491-C504 HydrophobicContact CG2-CB 3.88Å; I491-C504 PolarHBondContact O-N 2.87Å; I491-C504 VanDerWaalsContact O-N 3.12Å; I491-A505 WeakPolarHBondContact CD1-O 3.44Å; I491-M507 HydrophobicContact CD1-CG 4.41Å; I491-M507 HydrophobicContact CG1-CG 4.29Å; I491-Y546 HydrophobicContact CD1-CD2 4.39Å; I491-Y546 HydrophobicContact CD1-CG 4.48Å; I491-W553 HydrophobicContact CD1-CH2 4.24Å; I491-W553 HydrophobicContact CD1-CZ2 3.14Å; I491-W553 HydrophobicContact CG1-CZ2 4.13Å
492	I	91.7	Very high	89.3	Confident	25 Å²	25	51.4 Å²	51.4	13%	0.128	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.8	177.1	56.8	-178.5	0	0	0	108.9	V466 V467 I483 F501 V502	V466-I492 HydrophobicContact CG1-CD1 4.03Å; V467-I492 HydrophobicContact CG2-CD1 4.41Å; I483-I492 HydrophobicContact CB-CD1 4.41Å; I483-I492 HydrophobicContact CB-CG1 3.82Å; I483-I492 HydrophobicContact CD1-CD1 3.98Å; I483-I492 HydrophobicContact CD1-CG1 4.06Å; I483-I492 HydrophobicContact CG1-CG1 4.39Å; I483-I492 PolarHBondContact N-O 2.86Å; I483-I492 PolarHBondContact O-N 3.35Å; I492-F501 HydrophobicContact CB-CD1 4.38Å; I492-F501 HydrophobicContact CD1-CD1 3.92Å; I492-F501 HydrophobicContact CD1-CE1 4.12Å; I492-F501 HydrophobicContact CG1-CD1 4.32Å; I492-V502 WeakPolarHBondContact CA-O 3.41Å
493	A	92.8	Very high	89.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.2	169.1	0	0	0	0	0	108.9	Q480 I481 I482 F501 V502	Q480-A493 HydrophobicContact CB-CB 4.27Å; I481-A493 CarbonylContact O-C 3.51Å; I481-A493 WeakPolarHBondContact O-CA 3.49Å; I482-A493 HydrophobicContact CG1-CB 4.3Å; A493-F501 CarbonylContact O-C 3.56Å; A493-F501 WeakPolarHBondContact O-CA 3.13Å; A493-V502 HydrophobicContact CB-CB 4.36Å; A493-V502 PolarHBondContact N-O 2.78Å; A493-V502 PolarHBondContact O-N 2.76Å
494	Y	93.4	Very high	89	Confident	5 Å²	5	58.3 Å²	58.3	2%	0.02	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	116.7	176.9	178.3	-108.1	0	0	0	108.8	Y434 F436 I449 I481 T496 N499 F501	Y434-Y494 HydrophobicContact CD1-CE1 4.07Å; Y434-Y494 AromaticContact CE1-CE1 3.99Å; Y434-Y494 HydrophobicContact CE1-CE1 3.99Å; F436-Y494 AromaticContact CE1-CD1 3.89Å; F436-Y494 HydrophobicContact CE1-CD1 3.89Å; F436-Y494 HydrophobicContact CE1-CD2 4.48Å; F436-Y494 HydrophobicContact CE1-CE1 4.23Å; F436-Y494 HydrophobicContact CE1-CG 4.01Å; F436-Y494 AromaticContact CZ-CD1 3.64Å; F436-Y494 HydrophobicContact CZ-CD1 3.64Å; F436-Y494 HydrophobicContact CZ-CE1 4.12Å; F436-Y494 HydrophobicContact CZ-CG 4.1Å; I449-Y494 HydrophobicContact CD1-CE2 4.37Å; I481-Y494 HydrophobicContact CD1-CD1 4.4Å; I481-Y494 PolarHBondContact N-O 3.03Å; I481-Y494 PolarHBondContact O-N 3.18Å; Y494-T496 HydrophobicContact CD1-CG2 4.07Å; Y494-T496 HydrophobicContact CE1-CG2 4Å; Y494-N499 WeakPolarHBondContact CE2-OD1 3.28Å; Y494-N499 PolarHBondContact OH-OD1 2.88Å; Y494-F501 AromaticContact CD2-CD1 3.9Å; Y494-F501 HydrophobicContact CD2-CD1 3.9Å; Y494-F501 HydrophobicContact CD2-CD2 4.28Å; Y494-F501 AromaticContact CD2-CE1 3.56Å; Y494-F501 HydrophobicContact CD2-CE1 3.56Å; Y494-F501 AromaticContact CD2-CE2 3.97Å; Y494-F501 HydrophobicContact CD2-CE2 3.97Å; Y494-F501 HydrophobicContact CD2-CG 4.25Å; Y494-F501 AromaticContact CD2-CZ 3.59Å; Y494-F501 HydrophobicContact CD2-CZ 3.59Å; Y494-F501 HydrophobicContact CE2-CE1 4.44Å; Y494-F501 HydrophobicContact CE2-CE2 4.17Å; Y494-F501 HydrophobicContact CE2-CZ 4.03Å; Y494-F501 HydrophobicContact CG-CD1 4.46Å; Y494-F501 HydrophobicContact CG-CE1 4.07Å; Y494-F501 HydrophobicContact CG-CZ 4.42Å
495	D	91.6	Very high	89	Confident	40 Å²	40	59.5 Å²	59.5	21%	0.214	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	114.1	172.3	172.8	16.9	0	0	0	109.1	K497 G498 N499 K500	D495-K497 VanDerWaalsContact C-N 3.32Å; D495-K497 WeakPolarHBondContact OD1-CB 3.14Å; D495-K497 PolarHBondContact OD1-N 2.88Å; D495-G498 VanDerWaalsContact CG-N 3.33Å; D495-G498 PolarHBondContact OD1-N 3.11Å; D495-G498 WeakPolarHBondContact OD2-CA 3.33Å; D495-G498 PolarHBondContact OD2-N 2.99Å; D495-N499 WeakPolarHBondContact O-CA 3.23Å; D495-N499 PolarHBondContact O-N 2.95Å; D495-K500 PolarHBondContact N-O 3.46Å; D495-K500 PolarHBondContact O-N 3.15Å
496	T	89.6	Confident	89.2	Confident	20 Å²	20	60.9 Å²	60.9	12%	0.123	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-25	-179.6	56.6	0	0	0	0	112.9	K429 D430 Y434 I481 Y494	K429-T496 HydrophobicContact CB-CG2 4.49Å; K429-T496 HydrophobicContact CD-CG2 3.91Å; K429-T496 HydrophobicContact CG-CG2 4.4Å; K429-T496 PolarHBondContact NZ-OG1 3.05Å; D430-T496 PolarHBondContact OD2-OG1 3.03Å; Y434-T496 HydrophobicContact CE1-CG2 4.27Å; Y434-T496 HydrophobicContact CE2-CG2 3.93Å; I481-T496 HydrophobicContact CD1-CG2 3.85Å; I481-T496 HydrophobicContact CG1-CG2 4.34Å; Y494-T496 HydrophobicContact CD1-CG2 4.07Å; Y494-T496 HydrophobicContact CE1-CG2 4Å
497	K	88.3	Confident	89.4	Confident	151 Å²	151	61.3 Å²	61.3	66%	0.657	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-48	179.6	-68.4	173.4	178.4	161.4	0	110.8	D479 D495	D479-K497 IonicContact OD1-NZ 2.72Å; D479-K497 WeakPolarHBondContact OD2-CE 3.4Å; D479-K497 IonicContact OD2-NZ 3.91Å; D479-K497 PolarHBondContact OD2-NZ 3.28Å; D495-K497 VanDerWaalsContact C-N 3.32Å; D495-K497 WeakPolarHBondContact OD1-CB 3.14Å; D495-K497 PolarHBondContact OD1-N 2.88Å
498	G	86.8	Confident	89.7	Confident	34 Å²	34	64.9 Å²	64.9	35%	0.351	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.8	178.3	0	0	0	0	0	114.7	D495 K500	D495-G498 VanDerWaalsContact CG-N 3.33Å; D495-G498 PolarHBondContact OD1-N 3.11Å; D495-G498 WeakPolarHBondContact OD2-CA 3.33Å; D495-G498 PolarHBondContact OD2-N 2.99Å; G498-K500 VanDerWaalsContact C-N 3.3Å; G498-K500 WeakPolarHBondContact O-CG 3.3Å; G498-K500 PolarHBondContact O-N 3.12Å
499	N	87.8	Confident	89.7	Confident	81 Å²	81	65.6 Å²	65.6	43%	0.433	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	49.6	-170.8	-177.5	33.1	0	0	0	112	M462 Y494 D495	M462-N499 VanDerWaalsContact CE-CG 3.49Å; M462-N499 WeakPolarHBondContact CE-ND2 3.46Å; M462-N499 WeakPolarHBondContact CE-OD1 3.38Å; Y494-N499 WeakPolarHBondContact CE2-OD1 3.28Å; Y494-N499 PolarHBondContact OH-OD1 2.88Å; D495-N499 WeakPolarHBondContact O-CA 3.23Å; D495-N499 PolarHBondContact O-N 2.95Å
500	K	90.9	Very high	89.7	Confident	144 Å²	144	65.6 Å²	65.6	63%	0.626	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.9	148.2	-174.3	-76.7	171.8	-173.2	179.5	0	111.2	D495 G498	D495-K500 PolarHBondContact N-O 3.46Å; D495-K500 PolarHBondContact O-N 3.15Å; G498-K500 VanDerWaalsContact C-N 3.3Å; G498-K500 WeakPolarHBondContact O-CG 3.3Å; G498-K500 PolarHBondContact O-N 3.12Å
501	F	91.2	Very high	89.8	Confident	55 Å²	55	58.6 Å²	58.6	24%	0.241	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.1	171.6	-66.8	-83.4	0	0	0	110	I449 V466 V467 I483 I492 A493 Y494	I449-F501 HydrophobicContact CD1-CE2 4.22Å; I449-F501 HydrophobicContact CD1-CZ 3.77Å; V466-F501 HydrophobicContact CB-CD2 3.95Å; V466-F501 HydrophobicContact CB-CE2 4.19Å; V466-F501 HydrophobicContact CB-CG 4.24Å; V466-F501 HydrophobicContact CG1-CB 4.08Å; V466-F501 HydrophobicContact CG1-CD1 4.23Å; V466-F501 HydrophobicContact CG1-CD2 4.09Å; V466-F501 HydrophobicContact CG1-CG 3.86Å; V466-F501 HydrophobicContact CG2-CD2 3.94Å; V466-F501 HydrophobicContact CG2-CE2 4.42Å; V466-F501 HydrophobicContact CG2-CG 4.48Å; V467-F501 HydrophobicContact CG2-CE1 3.66Å; V467-F501 HydrophobicContact CG2-CE2 4.35Å; V467-F501 HydrophobicContact CG2-CZ 3.44Å; V467-F501 VanDerWaalsContact CG2-CZ 3.44Å; I483-F501 HydrophobicContact CD1-CE1 4.22Å; I492-F501 HydrophobicContact CB-CD1 4.38Å; I492-F501 HydrophobicContact CD1-CD1 3.92Å; I492-F501 HydrophobicContact CD1-CE1 4.12Å; I492-F501 HydrophobicContact CG1-CD1 4.32Å; A493-F501 CarbonylContact O-C 3.56Å; A493-F501 WeakPolarHBondContact O-CA 3.13Å; Y494-F501 AromaticContact CD2-CD1 3.9Å; Y494-F501 HydrophobicContact CD2-CD1 3.9Å; Y494-F501 HydrophobicContact CD2-CD2 4.28Å; Y494-F501 AromaticContact CD2-CE1 3.56Å; Y494-F501 HydrophobicContact CD2-CE1 3.56Å; Y494-F501 AromaticContact CD2-CE2 3.97Å; Y494-F501 HydrophobicContact CD2-CE2 3.97Å; Y494-F501 HydrophobicContact CD2-CG 4.25Å; Y494-F501 AromaticContact CD2-CZ 3.59Å; Y494-F501 HydrophobicContact CD2-CZ 3.59Å; Y494-F501 HydrophobicContact CE2-CE1 4.44Å; Y494-F501 HydrophobicContact CE2-CE2 4.17Å; Y494-F501 HydrophobicContact CE2-CZ 4.03Å; Y494-F501 HydrophobicContact CG-CD1 4.46Å; Y494-F501 HydrophobicContact CG-CE1 4.07Å; Y494-F501 HydrophobicContact CG-CZ 4.42Å
502	V	91.4	Very high	89.7	Confident	68 Å²	68	59.5 Å²	59.5	41%	0.412	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.7	174.5	-176.6	0	0	0	0	108	I492 A493	I492-V502 WeakPolarHBondContact CA-O 3.41Å; A493-V502 HydrophobicContact CB-CB 4.36Å; A493-V502 PolarHBondContact N-O 2.78Å; A493-V502 PolarHBondContact O-N 2.76Å
503	K	91.1	Very high	89.7	Confident	140 Å²	140	59.7 Å²	59.7	61%	0.609	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.5	178.7	-175.1	179.5	177.7	-169.4	0	110	D506	K503-D506 WeakPolarHBondContact CE-OD1 3.48Å; K503-D506 IonicContact NZ-OD1 3.91Å; K503-D506 IonicContact NZ-OD2 3.55Å
504	C	91.9	Very high	89.8	Confident	13 Å²	13	60.1 Å²	60.1	9%	0.088	29%	0.292	C	S	.	.			trans	-104.8	174.6	170.8	-58.4	0	0	0	0	110.7	I491 D506 Y546	I491-C504 HydrophobicContact CB-CB 3.91Å; I491-C504 HydrophobicContact CG2-CB 3.88Å; I491-C504 PolarHBondContact O-N 2.87Å; I491-C504 VanDerWaalsContact O-N 3.12Å; C504-D506 PolarHBondContact O-N 2.78Å; C504-Y546 WeakPolarHBondContact CB-OH 3.31Å
505	A	91.6	Very high	89.8	Confident	24 Å²	24	60 Å²	60	20%	0.198	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-58.2	129.8	174.3	0	0	0	0	0	111.1	I491 Y546 N551 W553	I491-A505 WeakPolarHBondContact CD1-O 3.44Å; A505-Y546 HydrophobicContact CB-CE2 4.06Å; A505-N551 VanDerWaalsContact CB-O 3.29Å; A505-N551 WeakPolarHBondContact CB-O 2.95Å; A505-N551 WeakPolarHBondContact CB-OD1 3.34Å; A505-N551 PolarHBondContact N-OD1 2.82Å; A505-W553 PolarHBondContact O-NE1 2.94Å
506	D	91.2	Very high	89.9	Confident	34 Å²	34	58.3 Å²	58.3	18%	0.182	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-66	147	179.8	-69.6	-15.7	0	0	0	110.3	R489 K503 C504 W553	R489-D506 HydrophobicContact CG-CB 3.93Å; R489-D506 IonicContact CZ-OD2 3.43Å; R489-D506 VanDerWaalsContact CZ-OD2 3.32Å; R489-D506 IonicContact NE-OD2 2.82Å; R489-D506 PolarHBondContact NE-OD2 2.78Å; R489-D506 IonicContact NH2-OD2 2.88Å; R489-D506 PolarHBondContact NH2-OD2 3.08Å; R489-D506 VanDerWaalsContact NH2-OD2 3.11Å; R489-D506 CarbonylContact O-C 3.56Å; R489-D506 WeakPolarHBondContact O-CA 3.5Å; K503-D506 WeakPolarHBondContact CE-OD1 3.48Å; K503-D506 IonicContact NZ-OD1 3.91Å; K503-D506 IonicContact NZ-OD2 3.55Å; C504-D506 PolarHBondContact O-N 2.78Å; D506-W553 PolarHBondContact O-NE1 3.09Å
507	M	89.1	Confident	90.2	Very high	10 Å²	10	58.1 Å²	58.1	5%	0.049	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-62.3	160.2	164.6	-69	-174.7	-60.2	0	0	110.6	V484 R489 I491 R511 W553	V484-M507 HydrophobicContact CG1-SD 4.06Å; R489-M507 HydrophobicContact CB-CB 4.44Å; R489-M507 WeakPolarHBondContact CB-O 3.42Å; R489-M507 PolarHBondContact O-N 3.29Å; I491-M507 HydrophobicContact CD1-CG 4.41Å; I491-M507 HydrophobicContact CG1-CG 4.29Å; M507-R511 HydrophobicContact CE-CB 4.07Å; M507-W553 HydrophobicContact CB-CZ2 4.5Å; M507-W553 HydrophobicContact CG-CH2 4.01Å; M507-W553 HydrophobicContact CG-CZ2 3.36Å; M507-W553 HydrophobicContact SD-CH2 4.44Å; M507-W553 HydrophobicContact SD-CZ2 4.29Å
508	K	84.8	Confident	90.5	Very high	187 Å²	187	52.4 Å²	52.4	81%	0.813	26%	0.26	S	S	*	.	S	Bend	trans	-61.1	-52.6	174.2	-173.1	-178.4	175.9	-174.7	0	111.6
509	D	83.4	Confident	90.7	Very high	60 Å²	60	51.5 Å²	51.5	32%	0.321	25%	0.247	S	C	.	.	S	Bend	trans	-116.4	157	-174.4	-56.4	-60	0	0	0	111.5	R511 C530	D509-R511 PolarHBondContact O-N 2.92Å; D509-C530 HydrophobicContact CB-CB 4.39Å
510	R	87	Confident	90.7	Very high	129 Å²	129	55.2 Å²	55.2	49%	0.487	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	124.8	170.4	-61.9	-179.2	-173.3	-176.3	7.6	108	R489 C530 L531	R489-R510 HydrophobicContact CB-CG 4.44Å; R510-C530 CarbonylContact O-C 3.6Å; R510-C530 VanDerWaalsContact O-CA 3.25Å; R510-C530 WeakPolarHBondContact O-CA 3.22Å; R510-L531 HydrophobicContact CB-CB 4.23Å; R510-L531 PolarHBondContact O-N 2.72Å
511	R	88.6	Confident	90.7	Very high	11 Å²	11	51.8 Å²	51.8	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	125.5	-169.6	-168.3	-174.2	-73.5	-147.2	17.5	111.7	G486 M507 D509 H514 G527 R529 S542 D544	G486-R511 WeakPolarHBondContact CA-O 3.28Å; G486-R511 PolarHBondContact N-O 2.88Å; G486-R511 CarbonylContact O-C 3.55Å; G486-R511 VanDerWaalsContact O-O 3.04Å; M507-R511 HydrophobicContact CE-CB 4.07Å; D509-R511 PolarHBondContact O-N 2.92Å; R511-H514 HydrophobicContact CG-CB 3.81Å; R511-H514 PolarHBondContact O-CE1 2.85Å; R511-H514 PolarHBondContact O-ND1 3.13Å; R511-G527 VanDerWaalsContact CD-O 3.22Å; R511-G527 WeakPolarHBondContact CD-O 3.21Å; R511-G527 PolarHBondContact NH1-O 2.67Å; R511-R529 WeakPolarHBondContact CA-O 3.37Å; R511-S542 PolarHBondContact NH1-OG 2.67Å; R511-S542 PolarHBondContact NH2-OG 3.11Å; R511-D544 IonicContact CZ-OD2 3.53Å; R511-D544 IonicContact NH1-OD2 3.16Å; R511-D544 IonicContact NH2-OD2 3.42Å; R511-D544 PolarHBondContact NH2-OD2 2.81Å
512	M	89.9	Confident	90.8	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.089	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	162.3	177.8	58.4	-178.1	175.9	0	0	110.8	C471 Y487 H514 R529 I537	C471-M512 HydrophobicContact CB-CB 4.36Å; Y487-M512 HydrophobicContact CD1-SD 4.48Å; Y487-M512 HydrophobicContact CE1-SD 4.03Å; M512-H514 PolarHBondContact O-N 2.92Å; M512-R529 HydrophobicContact CE-CB 3.92Å; M512-R529 HydrophobicContact CG-CB 3.85Å; M512-R529 PolarHBondContact N-O 3.23Å; M512-R529 PolarHBondContact O-N 3.23Å; M512-I537 HydrophobicContact CE-CD1 3.86Å; M512-I537 HydrophobicContact CE-CG1 4.11Å; M512-I537 HydrophobicContact CE-CG2 4.04Å
513	H	91.4	Very high	91	Very high	30 Å²	30	49.6 Å²	49.6	14%	0.139	23%	0.233	C	C	.	.	S	Bend	trans	55.5	24.5	179.5	-61.2	-79.8	0	0	0	114.2	C471 F564 D565	C471-H513 PolarHBondContact O-N 3.14Å; C471-H513 PolarHBondContact SG-CE1 3.44Å; C471-H513 PolarHBondContact SG-NE2 2.86Å; H513-F564 HydrophobicContact CB-CB 4.2Å; H513-F564 HydrophobicContact CB-CD2 4.46Å; H513-D565 IonicContact CE1-OD1 3.83Å; H513-D565 IonicContact CG-OD1 3.85Å; H513-D565 IonicContact ND1-OD1 2.77Å; H513-D565 PolarHBondContact ND1-OD1 2.88Å; H513-D565 PolarHBondContact O-N 3.14Å
514	H	93.8	Very high	91.2	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.037	21%	0.21	C	C	.	.			trans	-91.2	159.7	177.5	61.3	-85.6	0	0	0	110.9	P473 V484 R511 M512 V525 G527	P473-H514 VanDerWaalsContact CD-NE2 3.3Å; P473-H514 WeakPolarHBondContact CD-NE2 3.48Å; V484-H514 PolarHBondContact O-CE1 2.86Å; V484-H514 PolarHBondContact O-NE2 2.87Å; V484-H514 VanDerWaalsContact O-NE2 3.14Å; R511-H514 HydrophobicContact CG-CB 3.81Å; R511-H514 PolarHBondContact O-CE1 2.85Å; R511-H514 PolarHBondContact O-ND1 3.13Å; M512-H514 PolarHBondContact O-N 2.92Å; H514-V525 HydrophobicContact CB-CG1 4.43Å; H514-G527 WeakPolarHBondContact CB-O 3.24Å
515	G	94.1	Very high	91.3	Very high	2 Å²	2	43.8 Å²	43.8	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	145.3	170.3	0	0	0	0	0	111.2	V525 T526	G515-V525 WeakPolarHBondContact O-CA 3.13Å; G515-T526 PolarHBondContact N-O 2.87Å; G515-T526 PolarHBondContact O-N 3.3Å
516	A	95	Very high	91.5	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.041	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	141.2	168	0	0	0	0	0	110.8	P473 V475 V484 L523 Y524 V525	P473-A516 HydrophobicContact CB-CB 3.86Å; P473-A516 HydrophobicContact CG-CB 3.34Å; V475-A516 HydrophobicContact CG1-CB 4.21Å; V484-A516 HydrophobicContact CG2-CB 4.4Å; A516-L523 HydrophobicContact CB-CD1 4.06Å; A516-Y524 CarbonylContact C-O 3.57Å; A516-Y524 VanDerWaalsContact CA-O 3.25Å; A516-Y524 WeakPolarHBondContact CA-O 3.45Å; A516-V525 HydrophobicContact CB-CG2 4.26Å
517	T	95.3	Very high	91.6	Very high	16 Å²	16	41 Å²	41	10%	0.098	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	174	175.9	-152.6	0	0	0	0	111.2	L286 I519 Y524 T570	L286-T517 HydrophobicContact CD1-CG2 3.45Å; L286-T517 VanDerWaalsContact CD1-CG2 3.45Å; T517-I519 HydrophobicContact CG2-CD1 4.44Å; T517-I519 HydrophobicContact CG2-CG1 4.46Å; T517-Y524 PolarHBondContact N-O 3.42Å; T517-Y524 PolarHBondContact O-N 3.23Å; T517-T570 WeakPolarHBondContact CG2-OG1 3.13Å; T517-T570 PolarHBondContact OG1-N 3.19Å; T517-T570 PolarHBondContact OG1-OG1 3.12Å
518	V	94.4	Very high	91.8	Very high	31 Å²	31	40.6 Å²	40.6	19%	0.188	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.6	-172.9	-179.5	0	0	0	0	109.9	V475 I477 K522 T570	V475-V518 HydrophobicContact CB-CG2 3.67Å; V475-V518 HydrophobicContact CG1-CG2 4.26Å; V475-V518 HydrophobicContact CG2-CG2 3.68Å; I477-V518 HydrophobicContact CD1-CG1 4.19Å; I477-V518 HydrophobicContact CD1-CG2 3.73Å; I477-V518 HydrophobicContact CG1-CB 4.43Å; I477-V518 HydrophobicContact CG1-CG1 3.98Å; I477-V518 HydrophobicContact CG1-CG2 3.53Å; V518-K522 WeakPolarHBondContact CA-O 3.45Å; V518-T570 WeakPolarHBondContact O-CB 3.32Å; V518-T570 WeakPolarHBondContact O-CG2 3.14Å; V518-T570 PolarHBondContact O-OG1 3.44Å
519	I	91.4	Very high	92.1	Very high	16 Å²	16	33.9 Å²	33.9	8%	0.082	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.3	179	-63.6	171.9	0	0	0	107.9	E284 L286 T517 N521 K522 Y524 T570	E284-I519 HydrophobicContact CB-CG2 4.05Å; E284-I519 WeakPolarHBondContact OE2-CA 3.14Å; L286-I519 HydrophobicContact CB-CD1 3.49Å; L286-I519 VanDerWaalsContact CB-CD1 3.49Å; T517-I519 HydrophobicContact CG2-CD1 4.44Å; T517-I519 HydrophobicContact CG2-CG1 4.46Å; I519-N521 PolarHBondContact O-N 2.96Å; I519-K522 PolarHBondContact N-O 3.21Å; I519-K522 PolarHBondContact O-N 2.82Å; I519-Y524 HydrophobicContact CB-CD2 3.95Å; I519-Y524 HydrophobicContact CB-CE2 3.77Å; I519-Y524 HydrophobicContact CD1-CD2 4.3Å; I519-Y524 HydrophobicContact CG1-CD2 4.33Å; I519-Y524 HydrophobicContact CG2-CE2 4.44Å; I519-T570 HydrophobicContact CG1-CG2 3.97Å; I519-T570 WeakPolarHBondContact CG1-OG1 3.34Å
520	K	87.4	Confident	92.3	Very high	159 Å²	159	31.5 Å²	31.5	69%	0.691	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.2	47.9	-178.9	-60.5	-178.9	179.6	-178.3	0	112.2	E284 K522	E284-K520 PolarHBondContact OE2-N 3.45Å; K520-K522 PolarHBondContact O-N 2.86Å
521	N	89.9	Confident	92.1	Very high	71 Å²	71	27.3 Å²	27.3	38%	0.38	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	14.9	-178.6	-156.6	47.9	0	0	0	115.7	I477 G478 I519 P548	I477-N521 VanDerWaalsContact CG2-OD1 3.25Å; I477-N521 WeakPolarHBondContact CG2-OD1 3.42Å; G478-N521 PolarHBondContact N-OD1 2.9Å; I519-N521 PolarHBondContact O-N 2.96Å; N521-P548 WeakPolarHBondContact O-CD 3.29Å; N521-P548 WeakPolarHBondContact O-CG 3.21Å
522	K	93.5	Very high	91.4	Very high	77 Å²	77	28.4 Å²	28.4	34%	0.335	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	143.8	174.3	-56.8	-168.2	-173.5	-156	0	110.8	V518 I519 K520 Y524 D547	V518-K522 WeakPolarHBondContact CA-O 3.45Å; I519-K522 PolarHBondContact N-O 3.21Å; I519-K522 PolarHBondContact O-N 2.82Å; K520-K522 PolarHBondContact O-N 2.86Å; K522-Y524 HydrophobicContact CB-CE2 4.08Å; K522-D547 HydrophobicContact CD-CB 4.49Å; K522-D547 VanDerWaalsContact CE-OD2 3.28Å; K522-D547 WeakPolarHBondContact CE-OD2 3.18Å; K522-D547 IonicContact NZ-OD2 3.6Å; K522-D547 PolarHBondContact NZ-OD2 3.12Å
523	L	95.3	Very high	90.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	126.2	179.7	172.8	56.3	0	0	0	109.8	V475 I477 I482 V484 A516 V525 C545 Y546 W553	V475-L523 HydrophobicContact CG2-CD1 3.8Å; I477-L523 HydrophobicContact CD1-CB 3.66Å; I482-L523 HydrophobicContact CG2-CD2 4.39Å; V484-L523 HydrophobicContact CG1-CD2 4.31Å; V484-L523 HydrophobicContact CG2-CD1 4.21Å; V484-L523 HydrophobicContact CG2-CD2 3.66Å; A516-L523 HydrophobicContact CB-CD1 4.06Å; L523-V525 HydrophobicContact CD1-CG2 4.36Å; L523-V525 HydrophobicContact CD2-CG2 4.42Å; L523-V525 HydrophobicContact CG-CG2 4.17Å; L523-C545 CarbonylContact O-C 3.57Å; L523-C545 VanDerWaalsContact O-CA 3.24Å; L523-C545 WeakPolarHBondContact O-CA 3.49Å; L523-Y546 HydrophobicContact CB-CD1 4.01Å; L523-Y546 HydrophobicContact CD2-CD1 4.12Å; L523-Y546 HydrophobicContact CD2-CG 4.49Å; L523-Y546 PolarHBondContact N-O 3.05Å; L523-Y546 PolarHBondContact O-N 3.42Å; L523-W553 HydrophobicContact CD2-CH2 4.33Å
524	Y	95.3	Very high	89.9	Confident	32 Å²	32	37.2 Å²	37.2	13%	0.125	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.1	171.5	-74.3	-103	0	0	0	109.9	A516 T517 I519 K522 L543 D544 C545 K556	A516-Y524 CarbonylContact C-O 3.57Å; A516-Y524 VanDerWaalsContact CA-O 3.25Å; A516-Y524 WeakPolarHBondContact CA-O 3.45Å; T517-Y524 PolarHBondContact N-O 3.42Å; T517-Y524 PolarHBondContact O-N 3.23Å; I519-Y524 HydrophobicContact CB-CD2 3.95Å; I519-Y524 HydrophobicContact CB-CE2 3.77Å; I519-Y524 HydrophobicContact CD1-CD2 4.3Å; I519-Y524 HydrophobicContact CG1-CD2 4.33Å; I519-Y524 HydrophobicContact CG2-CE2 4.44Å; K522-Y524 HydrophobicContact CB-CE2 4.08Å; Y524-L543 HydrophobicContact CD1-CD1 4.18Å; Y524-D544 CarbonylContact C-O 3.57Å; Y524-D544 WeakPolarHBondContact CA-O 3.33Å; Y524-C545 HydrophobicContact CD1-CB 4.27Å; Y524-C545 HydrophobicContact CE1-CB 4.08Å; Y524-K556 HydrophobicContact CE1-CG 4.12Å
525	V	95.2	Very high	89	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.4	176.8	172.6	0	0	0	0	109.7	V484 H514 G515 A516 L523 L543 D544 W553	V484-V525 HydrophobicContact CG1-CG2 3.73Å; H514-V525 HydrophobicContact CB-CG1 4.43Å; G515-V525 WeakPolarHBondContact O-CA 3.13Å; A516-V525 HydrophobicContact CB-CG2 4.26Å; L523-V525 HydrophobicContact CD1-CG2 4.36Å; L523-V525 HydrophobicContact CD2-CG2 4.42Å; L523-V525 HydrophobicContact CG-CG2 4.17Å; V525-L543 WeakPolarHBondContact O-CA 3.29Å; V525-D544 PolarHBondContact N-O 2.77Å; V525-D544 PolarHBondContact O-N 2.82Å; V525-W553 HydrophobicContact CB-CH2 4.25Å; V525-W553 HydrophobicContact CB-CZ3 4.31Å; V525-W553 HydrophobicContact CG2-CH2 3.67Å; V525-W553 HydrophobicContact CG2-CZ3 4.14Å
526	T	95.2	Very high	88.3	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.8	-173.9	51	0	0	0	0	111.9	L286 I288 G515 L543 H566 C568	L286-T526 HydrophobicContact CD1-CG2 4.47Å; L286-T526 HydrophobicContact CD2-CG2 4.02Å; I288-T526 HydrophobicContact CD1-CG2 3.99Å; G515-T526 PolarHBondContact N-O 2.87Å; G515-T526 PolarHBondContact O-N 3.3Å; T526-L543 HydrophobicContact CG2-CD1 3.4Å; T526-L543 VanDerWaalsContact CG2-CD1 3.4Å; T526-H566 PolarHBondContact O-CE1 3Å; T526-H566 PolarHBondContact O-NE2 3.35Å; T526-H566 PolarHBondContact OG1-NE2 3.17Å; T526-C568 PolarHBondContact OG1-SG 3.29Å
527	G	94.1	Very high	87.8	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.			trans	54.6	-140.5	169.9	0	0	0	0	0	114.1	R511 H514 S540 S542 L563	R511-G527 VanDerWaalsContact CD-O 3.22Å; R511-G527 WeakPolarHBondContact CD-O 3.21Å; R511-G527 PolarHBondContact NH1-O 2.67Å; H514-G527 WeakPolarHBondContact CB-O 3.24Å; G527-S540 VanDerWaalsContact CA-O 3.24Å; G527-S540 WeakPolarHBondContact CA-O 3.41Å; G527-S542 PolarHBondContact N-O 3.18Å; G527-L563 CarbonylContact C-O 3.51Å; G527-L563 WeakPolarHBondContact CA-O 3.3Å
528	G	92.8	Very high	87.5	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.289	C	S	.	.			trans	93.4	-171.9	-179.2	0	0	0	0	0	114	S540 L563	G528-S540 WeakPolarHBondContact O-CB 3.26Å; G528-S540 PolarHBondContact O-N 2.82Å; G528-L563 PolarHBondContact N-O 3.04Å
529	R	90.4	Very high	87.4	Confident	46 Å²	46	54.5 Å²	54.5	17%	0.174	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	114.9	178.6	-71.9	-173.4	162.5	-178.1	-6.7	110.1	R511 M512 I537 E538 D539 F564	R511-R529 WeakPolarHBondContact CA-O 3.37Å; M512-R529 HydrophobicContact CE-CB 3.92Å; M512-R529 HydrophobicContact CG-CB 3.85Å; M512-R529 PolarHBondContact N-O 3.23Å; M512-R529 PolarHBondContact O-N 3.23Å; R529-I537 HydrophobicContact CB-CG2 4.01Å; R529-I537 HydrophobicContact CG-CG2 4.22Å; R529-E538 CarbonylContact C-O 3.6Å; R529-D539 VanDerWaalsContact CG-OD1 3.27Å; R529-D539 WeakPolarHBondContact CG-OD1 3.22Å; R529-D539 IonicContact CZ-OD1 2.72Å; R529-D539 IonicContact NE-OD1 2.7Å; R529-D539 PolarHBondContact NE-OD1 2.87Å; R529-D539 VanDerWaalsContact NE-OD1 3.09Å; R529-F564 HydrophobicContact CG-CB 4.06Å; R529-F564 HydrophobicContact CG-CD1 4.33Å; R529-F564 HydrophobicContact CG-CD2 4.3Å; R529-F564 HydrophobicContact CG-CG 3.97Å; R529-F564 VanDerWaalsContact CZ-CE2 3.41Å; R529-F564 VanDerWaalsContact NH2-CE2 3.34Å
530	C	88.1	Confident	87.3	Confident	11 Å²	11	54.5 Å²	54.5	7%	0.074	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	133.1	175.6	-68.9	0	0	0	0	109.7	D509 R510 I537 E538	D509-C530 HydrophobicContact CB-CB 4.39Å; R510-C530 CarbonylContact O-C 3.6Å; R510-C530 VanDerWaalsContact O-CA 3.25Å; R510-C530 WeakPolarHBondContact O-CA 3.22Å; C530-I537 WeakPolarHBondContact O-CA 3.19Å; C530-E538 PolarHBondContact N-O 2.86Å; C530-E538 PolarHBondContact O-N 3.22Å
531	L	82.9	Confident	87.6	Confident	40 Å²	40	48.8 Å²	48.8	21%	0.209	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	110.9	168	-170.7	73.2	0	0	0	107.8	R510 I537	R510-L531 HydrophobicContact CB-CB 4.23Å; R510-L531 PolarHBondContact O-N 2.72Å; L531-I537 HydrophobicContact CD1-CG1 3.72Å
532	T	74.8	Confident	87.8	Confident	35 Å²	35	46.4 Å²	46.4	22%	0.215	25%	0.252	C	S	.	.			trans	-72.1	169.7	180	65.3	0	0	0	0	111.2	D534 N535 I536 E538	T532-D534 PolarHBondContact O-N 3.07Å; T532-N535 PolarHBondContact O-N 2.99Å; T532-I536 PolarHBondContact N-O 2.83Å; T532-I536 PolarHBondContact OG1-N 3.25Å; T532-I536 PolarHBondContact OG1-O 3.01Å; T532-E538 HydrophobicContact CG2-CG 4.2Å
533	A	73.8	Confident	87.8	Confident	101 Å²	101	42.7 Å²	42.7	84%	0.835	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.5	178.1	0	0	0	0	0	112.7	N535	A533-N535 PolarHBondContact O-N 3.02Å
534	D	75.9	Confident	87.8	Confident	132 Å²	132	44.4 Å²	44.4	71%	0.706	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	9.7	178.5	-55.1	-44.5	0	0	0	113.3	T532 I536	T532-D534 PolarHBondContact O-N 3.07Å; D534-I536 HydrophobicContact CB-CD1 4.26Å; D534-I536 HydrophobicContact CB-CG1 4.28Å; D534-I536 PolarHBondContact O-N 2.88Å
535	N	73.6	Confident	87.8	Confident	118 Å²	118	43 Å²	43	63%	0.631	24%	0.24	S	C	*	.	S	Bend	trans	60	24.8	-175.4	-58.7	-54.5	0	0	0	114.6	T532 A533	T532-N535 PolarHBondContact O-N 2.99Å; A533-N535 PolarHBondContact O-N 3.02Å
536	I	80.8	Confident	87.8	Confident	93 Å²	93	43.2 Å²	43.2	48%	0.477	24%	0.241	S	C	.	.			trans	-87.2	133.1	172.7	-57.8	173.2	0	0	0	108.3	T532 D534 E538	T532-I536 PolarHBondContact N-O 2.83Å; T532-I536 PolarHBondContact OG1-N 3.25Å; T532-I536 PolarHBondContact OG1-O 3.01Å; D534-I536 HydrophobicContact CB-CD1 4.26Å; D534-I536 HydrophobicContact CB-CG1 4.28Å; D534-I536 PolarHBondContact O-N 2.88Å; I536-E538 HydrophobicContact CG2-CG 4.18Å
537	I	84.5	Confident	87.7	Confident	94 Å²	94	44.1 Å²	44.1	48%	0.482	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116.3	174.6	-61.6	172.5	0	0	0	108	M512 R529 C530 L531	M512-I537 HydrophobicContact CE-CD1 3.86Å; M512-I537 HydrophobicContact CE-CG1 4.11Å; M512-I537 HydrophobicContact CE-CG2 4.04Å; R529-I537 HydrophobicContact CB-CG2 4.01Å; R529-I537 HydrophobicContact CG-CG2 4.22Å; C530-I537 WeakPolarHBondContact O-CA 3.19Å; L531-I537 HydrophobicContact CD1-CG1 3.72Å
538	E	88.2	Confident	87.6	Confident	98 Å²	98	46 Å²	46	46%	0.458	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	134	175.1	-65.3	-172.1	176.2	0	0	110.8	R529 C530 T532 I536	R529-E538 CarbonylContact C-O 3.6Å; C530-E538 PolarHBondContact N-O 2.86Å; C530-E538 PolarHBondContact O-N 3.22Å; T532-E538 HydrophobicContact CG2-CG 4.2Å; I536-E538 HydrophobicContact CG2-CG 4.18Å
539	D	91.3	Very high	87.6	Confident	22 Å²	22	53.8 Å²	53.8	12%	0.118	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	142	171.4	-63.6	-26.7	0	0	0	109.4	D294 R529 K562 F564	D294-D539 WeakPolarHBondContact OD1-CB 3.49Å; R529-D539 VanDerWaalsContact CG-OD1 3.27Å; R529-D539 WeakPolarHBondContact CG-OD1 3.22Å; R529-D539 IonicContact CZ-OD1 2.72Å; R529-D539 IonicContact NE-OD1 2.7Å; R529-D539 PolarHBondContact NE-OD1 2.87Å; R529-D539 VanDerWaalsContact NE-OD1 3.09Å; D539-K562 HydrophobicContact CB-CB 4.05Å; D539-K562 HydrophobicContact CB-CD 4.32Å; D539-K562 WeakPolarHBondContact O-CD 3.46Å; D539-K562 WeakPolarHBondContact O-CE 3.43Å; D539-K562 PolarHBondContact O-NZ 3.43Å; D539-F564 HydrophobicContact CB-CD1 4.37Å; D539-F564 WeakPolarHBondContact OD1-CD1 3.36Å; D539-F564 WeakPolarHBondContact OD1-CE1 3.2Å; D539-F564 WeakPolarHBondContact OD2-CE1 3.27Å
540	S	91.3	Very high	87.7	Confident	16 Å²	16	55.5 Å²	55.5	11%	0.112	31%	0.31	C	S	.	.			trans	-116.7	146	-174.4	-167.4	0	0	0	0	112.1	G527 G528 S542 K562 L563	G527-S540 VanDerWaalsContact CA-O 3.24Å; G527-S540 WeakPolarHBondContact CA-O 3.41Å; G528-S540 WeakPolarHBondContact O-CB 3.26Å; G528-S540 PolarHBondContact O-N 2.82Å; S540-S542 PolarHBondContact OG-N 3.45Å; S540-S542 PolarHBondContact OG-OG 2.95Å; S540-K562 WeakPolarHBondContact O-CA 3.36Å; S540-L563 PolarHBondContact O-N 2.97Å; S540-L563 VanDerWaalsContact O-N 3.12Å
541	D	93.3	Very high	87.9	Confident	39 Å²	39	58.5 Å²	58.5	21%	0.209	33%	0.326	C	S	.	.			trans	-112.6	13.5	172.3	63.2	-10.7	0	0	0	111.5	K558 L559 K562	D541-K558 CarbonylContact O-C 3.57Å; D541-K558 WeakPolarHBondContact O-CA 3.45Å; D541-K558 WeakPolarHBondContact O-CB 3.34Å; D541-L559 VanDerWaalsContact C-CD1 3.47Å; D541-L559 HydrophobicContact CB-CB 4.34Å; D541-L559 WeakPolarHBondContact O-CD1 3.32Å; D541-L559 PolarHBondContact O-N 3.2Å; D541-K562 HydrophobicContact CB-CB 4.37Å; D541-K562 HydrophobicContact CB-CG 3.78Å
542	S	93.3	Very high	88.5	Confident	20 Å²	20	59.8 Å²	59.8	14%	0.14	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	143.2	-174.8	52.2	0	0	0	0	112.9	R511 G527 S540 L559	R511-S542 PolarHBondContact NH1-OG 2.67Å; R511-S542 PolarHBondContact NH2-OG 3.11Å; G527-S542 PolarHBondContact N-O 3.18Å; S540-S542 PolarHBondContact OG-N 3.45Å; S540-S542 PolarHBondContact OG-OG 2.95Å; S542-L559 WeakPolarHBondContact O-CD1 3.42Å
543	L	94.6	Very high	89.4	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	108.6	168.8	174.3	70.5	0	0	0	108.7	L286 Y305 W312 Y524 V525 T526 K556 G557 L559	L286-L543 HydrophobicContact CD2-CD1 3.6Å; Y305-L543 HydrophobicContact CD2-CD2 4.07Å; Y305-L543 HydrophobicContact CE1-CD2 4.23Å; Y305-L543 HydrophobicContact CE2-CD2 3.61Å; W312-L543 HydrophobicContact CZ2-CD2 4.3Å; Y524-L543 HydrophobicContact CD1-CD1 4.18Å; V525-L543 WeakPolarHBondContact O-CA 3.29Å; T526-L543 HydrophobicContact CG2-CD1 3.4Å; T526-L543 VanDerWaalsContact CG2-CD1 3.4Å; L543-K556 HydrophobicContact CD2-CB 3.84Å; L543-K556 HydrophobicContact CG-CB 3.97Å; L543-K556 PolarHBondContact O-N 2.81Å; L543-G557 PolarHBondContact N-O 2.8Å; L543-G557 VanDerWaalsContact N-O 3.08Å; L543-G557 PolarHBondContact O-N 2.86Å; L543-L559 HydrophobicContact CB-CD1 4.44Å
544	D	94.3	Very high	90.4	Very high	36 Å²	36	58.7 Å²	58.7	19%	0.193	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.1	-176.3	-61.8	-53.4	0	0	0	110.6	R511 Y524 V525 W553	R511-D544 IonicContact CZ-OD2 3.53Å; R511-D544 IonicContact NH1-OD2 3.16Å; R511-D544 IonicContact NH2-OD2 3.42Å; R511-D544 PolarHBondContact NH2-OD2 2.81Å; Y524-D544 CarbonylContact C-O 3.57Å; Y524-D544 WeakPolarHBondContact CA-O 3.33Å; V525-D544 PolarHBondContact N-O 2.77Å; V525-D544 PolarHBondContact O-N 2.82Å; D544-W553 HydrophobicContact CB-CE3 3.8Å; D544-W553 HydrophobicContact CB-CZ3 3.7Å
545	C	94.9	Very high	91.2	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.007	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122.3	178.3	176	0	0	0	0	110.2	L523 Y524 W553 T554 K556	L523-C545 CarbonylContact O-C 3.57Å; L523-C545 VanDerWaalsContact O-CA 3.24Å; L523-C545 WeakPolarHBondContact O-CA 3.49Å; Y524-C545 HydrophobicContact CD1-CB 4.27Å; Y524-C545 HydrophobicContact CE1-CB 4.08Å; C545-W553 CarbonylContact O-C 3.49Å; C545-W553 WeakPolarHBondContact O-CA 3.38Å; C545-T554 PolarHBondContact N-O 3.27Å; C545-T554 PolarHBondContact O-N 3.3Å; C545-T554 PolarHBondContact O-OG1 2.9Å; C545-K556 HydrophobicContact CB-CD 4.16Å; C545-K556 HydrophobicContact CB-CG 3.5Å
546	Y	95.2	Very high	92.1	Very high	6 Å²	6	55.8 Å²	55.8	2%	0.024	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.8	171.7	168	-98.2	0	0	0	110.4	I491 C504 A505 L523 P548 N551 T552 W553	I491-Y546 HydrophobicContact CD1-CD2 4.39Å; I491-Y546 HydrophobicContact CD1-CG 4.48Å; C504-Y546 WeakPolarHBondContact CB-OH 3.31Å; A505-Y546 HydrophobicContact CB-CE2 4.06Å; L523-Y546 HydrophobicContact CB-CD1 4.01Å; L523-Y546 HydrophobicContact CD2-CD1 4.12Å; L523-Y546 HydrophobicContact CD2-CG 4.49Å; L523-Y546 PolarHBondContact N-O 3.05Å; L523-Y546 PolarHBondContact O-N 3.42Å; Y546-P548 HydrophobicContact CE1-CB 4Å; Y546-N551 WeakPolarHBondContact CE2-OD1 3.2Å; Y546-N551 PolarHBondContact OH-OD1 3.28Å; Y546-T552 WeakPolarHBondContact CA-O 3.39Å; Y546-W553 HydrophobicContact CD2-CD2 4.22Å; Y546-W553 AromaticContact CD2-CE2 3.93Å; Y546-W553 HydrophobicContact CD2-CG 4.33Å; Y546-W553 AromaticContact CD2-NE1 3.76Å; Y546-W553 HydrophobicContact CG-CD2 4.43Å; Y546-W553 HydrophobicContact CG-CZ2 4.36Å
547	D	94.4	Very high	92.5	Very high	18 Å²	18	52.7 Å²	52.7	10%	0.096	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	114.2	175.7	-168.8	-30.3	0	0	0	109.3	K522 E549 T550 N551 T552	K522-D547 HydrophobicContact CD-CB 4.49Å; K522-D547 VanDerWaalsContact CE-OD2 3.28Å; K522-D547 WeakPolarHBondContact CE-OD2 3.18Å; K522-D547 IonicContact NZ-OD2 3.6Å; K522-D547 PolarHBondContact NZ-OD2 3.12Å; D547-E549 VanDerWaalsContact C-N 3.28Å; D547-E549 PolarHBondContact O-N 2.95Å; D547-E549 WeakPolarHBondContact OD1-CB 3.44Å; D547-E549 PolarHBondContact OD1-N 2.9Å; D547-T550 WeakPolarHBondContact CB-OG1 3.44Å; D547-N551 VanDerWaalsContact O-CA 3.24Å; D547-N551 WeakPolarHBondContact O-CA 3.36Å; D547-N551 PolarHBondContact O-N 2.79Å; D547-T552 PolarHBondContact N-O 2.72Å; D547-T552 PolarHBondContact O-N 3.12Å
548	P	91.4	Very high	92.9	Very high	40 Å²	40	54.9 Å²	54.9	26%	0.26	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.7	-179	30.9	-37.8	0	0	0	113.5	I477 N521 Y546	I477-P548 HydrophobicContact CG2-CB 4.35Å; I477-P548 HydrophobicContact CG2-CG 3.91Å; N521-P548 WeakPolarHBondContact O-CD 3.29Å; N521-P548 WeakPolarHBondContact O-CG 3.21Å; Y546-P548 HydrophobicContact CE1-CB 4Å
549	E	91.8	Very high	93.2	Very high	163 Å²	163	50.6 Å²	50.6	76%	0.762	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-43.5	-177.9	-64.4	-176.8	173	0	0	111.1	D547	D547-E549 VanDerWaalsContact C-N 3.28Å; D547-E549 PolarHBondContact O-N 2.95Å; D547-E549 WeakPolarHBondContact OD1-CB 3.44Å; D547-E549 PolarHBondContact OD1-N 2.9Å
550	T	93.2	Very high	93.2	Very high	83 Å²	83	53.1 Å²	53.1	51%	0.509	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-12.1	176.8	59	0	0	0	0	112.7	D547 T552	D547-T550 WeakPolarHBondContact CB-OG1 3.44Å; T550-T552 VanDerWaalsContact C-N 3.28Å; T550-T552 WeakPolarHBondContact O-CG2 3.27Å; T550-T552 PolarHBondContact O-N 3.28Å; T550-T552 PolarHBondContact OG1-OG1 3.22Å
551	N	93.1	Very high	93.2	Very high	74 Å²	74	54.3 Å²	54.3	40%	0.396	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	43.8	-174	-171.4	34.5	0	0	0	112	A505 Y546 D547	A505-N551 VanDerWaalsContact CB-O 3.29Å; A505-N551 WeakPolarHBondContact CB-O 2.95Å; A505-N551 WeakPolarHBondContact CB-OD1 3.34Å; A505-N551 PolarHBondContact N-OD1 2.82Å; Y546-N551 WeakPolarHBondContact CE2-OD1 3.2Å; Y546-N551 PolarHBondContact OH-OD1 3.28Å; D547-N551 VanDerWaalsContact O-CA 3.24Å; D547-N551 WeakPolarHBondContact O-CA 3.36Å; D547-N551 PolarHBondContact O-N 2.79Å
552	T	94.4	Very high	93.2	Very high	67 Å²	67	55.6 Å²	55.6	41%	0.411	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	155	-177.6	56.3	0	0	0	0	112.8	Y546 D547 T550	Y546-T552 WeakPolarHBondContact CA-O 3.39Å; D547-T552 PolarHBondContact N-O 2.72Å; D547-T552 PolarHBondContact O-N 3.12Å; T550-T552 VanDerWaalsContact C-N 3.28Å; T550-T552 WeakPolarHBondContact O-CG2 3.27Å; T550-T552 PolarHBondContact O-N 3.28Å; T550-T552 PolarHBondContact OG1-OG1 3.22Å
553	W	94.3	Very high	93.3	Very high	61 Å²	61	54.7 Å²	54.7	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.5	176.3	-78.2	99.1	0	0	0	111	I491 A505 D506 M507 L523 V525 D544 C545 Y546	I491-W553 HydrophobicContact CD1-CH2 4.24Å; I491-W553 HydrophobicContact CD1-CZ2 3.14Å; I491-W553 HydrophobicContact CG1-CZ2 4.13Å; A505-W553 PolarHBondContact O-NE1 2.94Å; D506-W553 PolarHBondContact O-NE1 3.09Å; M507-W553 HydrophobicContact CB-CZ2 4.5Å; M507-W553 HydrophobicContact CG-CH2 4.01Å; M507-W553 HydrophobicContact CG-CZ2 3.36Å; M507-W553 HydrophobicContact SD-CH2 4.44Å; M507-W553 HydrophobicContact SD-CZ2 4.29Å; L523-W553 HydrophobicContact CD2-CH2 4.33Å; V525-W553 HydrophobicContact CB-CH2 4.25Å; V525-W553 HydrophobicContact CB-CZ3 4.31Å; V525-W553 HydrophobicContact CG2-CH2 3.67Å; V525-W553 HydrophobicContact CG2-CZ3 4.14Å; D544-W553 HydrophobicContact CB-CE3 3.8Å; D544-W553 HydrophobicContact CB-CZ3 3.7Å; C545-W553 CarbonylContact O-C 3.49Å; C545-W553 WeakPolarHBondContact O-CA 3.38Å; Y546-W553 HydrophobicContact CD2-CD2 4.22Å; Y546-W553 AromaticContact CD2-CE2 3.93Å; Y546-W553 HydrophobicContact CD2-CG 4.33Å; Y546-W553 AromaticContact CD2-NE1 3.76Å; Y546-W553 HydrophobicContact CG-CD2 4.43Å; Y546-W553 HydrophobicContact CG-CZ2 4.36Å
554	T	94.3	Very high	93.2	Very high	52 Å²	52	54.7 Å²	54.7	32%	0.319	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	128	176	56.9	0	0	0	0	110.5	C545 K556	C545-T554 PolarHBondContact N-O 3.27Å; C545-T554 PolarHBondContact O-N 3.3Å; C545-T554 PolarHBondContact O-OG1 2.9Å; T554-K556 WeakPolarHBondContact OG1-CE 3.37Å
555	P	93.3	Very high	93.2	Very high	108 Å²	108	54.3 Å²	54.3	70%	0.701	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.1	172.1	29.7	-32.9	0	0	0	109
556	K	91.9	Very high	93.2	Very high	80 Å²	80	54.7 Å²	54.7	35%	0.348	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-21.1	178.5	-65.3	-62.6	-175.6	-176.4	0	113.2	N310 Y524 L543 C545 T554	N310-K556 PolarHBondContact ND2-O 3.47Å; N310-K556 PolarHBondContact OD1-O 3.27Å; Y524-K556 HydrophobicContact CE1-CG 4.12Å; L543-K556 HydrophobicContact CD2-CB 3.84Å; L543-K556 HydrophobicContact CG-CB 3.97Å; L543-K556 PolarHBondContact O-N 2.81Å; C545-K556 HydrophobicContact CB-CD 4.16Å; C545-K556 HydrophobicContact CB-CG 3.5Å; T554-K556 WeakPolarHBondContact OG1-CE 3.37Å
557	G	89.8	Confident	93.1	Very high	28 Å²	28	55 Å²	55	29%	0.289	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	158.2	-152.8	177.1	0	0	0	0	0	111.1	L543	L543-G557 PolarHBondContact N-O 2.8Å; L543-G557 VanDerWaalsContact N-O 3.08Å; L543-G557 PolarHBondContact O-N 2.86Å
558	K	93.3	Very high	93.2	Very high	141 Å²	141	54.5 Å²	54.5	61%	0.613	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	152.5	176.7	-64.8	-178.2	172	-162.9	0	110.8	W312 D541	W312-K558 PolarHBondContact NE1-O 2.75Å; D541-K558 CarbonylContact O-C 3.57Å; D541-K558 WeakPolarHBondContact O-CA 3.45Å; D541-K558 WeakPolarHBondContact O-CB 3.34Å
559	L	93.4	Very high	93.4	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.037	29%	0.287	C	S	.	.			trans	-68.8	156.9	166.2	-70.7	83.1	0	0	0	109.1	I288 W312 D541 S542 L543 H561 L563	I288-L559 HydrophobicContact CD1-CD2 3.39Å; I288-L559 HydrophobicContact CD1-CG 3.97Å; W312-L559 HydrophobicContact CZ2-CG 4.08Å; D541-L559 VanDerWaalsContact C-CD1 3.47Å; D541-L559 HydrophobicContact CB-CB 4.34Å; D541-L559 WeakPolarHBondContact O-CD1 3.32Å; D541-L559 PolarHBondContact O-N 3.2Å; S542-L559 WeakPolarHBondContact O-CD1 3.42Å; L543-L559 HydrophobicContact CB-CD1 4.44Å; L559-H561 VanDerWaalsContact CB-O 3.32Å; L559-H561 WeakPolarHBondContact CB-O 3.25Å; L559-H561 PolarHBondContact O-N 3.26Å; L559-H561 VanDerWaalsContact O-N 3.12Å; L559-L563 HydrophobicContact CD2-CB 3.97Å; L559-L563 HydrophobicContact CD2-CD2 4.09Å
560	P	91.8	Very high	93.4	Very high	76 Å²	76	46.4 Å²	46.4	49%	0.494	26%	0.256	S	S	.	.	S	Bend	trans	-63	-19.8	178.4	-24.2	36.5	0	0	0	114.1	L303 W312	L303-P560 HydrophobicContact CD1-CG 3.97Å; W312-P560 HydrophobicContact CB-CG 3.68Å; W312-P560 HydrophobicContact CG-CG 3.73Å
561	H	91.1	Very high	93.2	Very high	40 Å²	40	42.5 Å²	42.5	19%	0.185	23%	0.232	C	C	.	.	S	Bend	trans	-155.8	159.2	174	48.1	-87.2	0	0	0	108.6	K293 D301 L559	K293-H561 WeakPolarHBondContact CE-NE2 3.01Å; K293-H561 PolarHBondContact NZ-CE1 3.44Å; D301-H561 IonicContact OD2-CE1 3.09Å; L559-H561 VanDerWaalsContact CB-O 3.32Å; L559-H561 WeakPolarHBondContact CB-O 3.25Å; L559-H561 PolarHBondContact O-N 3.26Å; L559-H561 VanDerWaalsContact O-N 3.12Å
562	K	93.9	Very high	92.8	Very high	66 Å²	66	42.2 Å²	42.2	29%	0.287	23%	0.229	S	C	.	.			trans	-63	136	172.1	-65.8	172.1	164.4	-151.7	0	109.8	D294 D539 S540 D541	D294-K562 WeakPolarHBondContact OD1-CB 3.39Å; D294-K562 WeakPolarHBondContact OD1-CD 3.46Å; D294-K562 WeakPolarHBondContact OD2-CD 2.91Å; D539-K562 HydrophobicContact CB-CB 4.05Å; D539-K562 HydrophobicContact CB-CD 4.32Å; D539-K562 WeakPolarHBondContact O-CD 3.46Å; D539-K562 WeakPolarHBondContact O-CE 3.43Å; D539-K562 PolarHBondContact O-NZ 3.43Å; S540-K562 WeakPolarHBondContact O-CA 3.36Å; D541-K562 HydrophobicContact CB-CB 4.37Å; D541-K562 HydrophobicContact CB-CG 3.78Å
563	L	94.3	Very high	92	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.213	C	C	.	.			trans	-150.6	135.4	-168	-169.8	73.7	0	0	0	111	I288 R292 K293 T299 G527 G528 S540 L559 H566	I288-L563 HydrophobicContact CG2-CD2 3.36Å; R292-L563 WeakPolarHBondContact O-CA 3.4Å; K293-L563 HydrophobicContact CG-CD1 4.44Å; T299-L563 HydrophobicContact CG2-CD1 3.92Å; G527-L563 CarbonylContact C-O 3.51Å; G527-L563 WeakPolarHBondContact CA-O 3.3Å; G528-L563 PolarHBondContact N-O 3.04Å; S540-L563 PolarHBondContact O-N 2.97Å; S540-L563 VanDerWaalsContact O-N 3.12Å; L559-L563 HydrophobicContact CD2-CB 3.97Å; L559-L563 HydrophobicContact CD2-CD2 4.09Å; L563-H566 HydrophobicContact CD2-CB 3.55Å; L563-H566 HydrophobicContact CG-CB 3.9Å
564	F	93.7	Very high	91	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-140.9	168.1	173.8	64.5	-84.6	0	0	0	111	G291 R292 Q296 H513 R529 D539 H566	G291-F564 CarbonylContact C-O 3.59Å; G291-F564 WeakPolarHBondContact CA-O 3.45Å; R292-F564 HydrophobicContact CB-CD1 4.27Å; R292-F564 HydrophobicContact CB-CD2 4.23Å; R292-F564 HydrophobicContact CB-CE1 3.72Å; R292-F564 HydrophobicContact CB-CE2 3.69Å; R292-F564 HydrophobicContact CB-CG 4.49Å; R292-F564 HydrophobicContact CB-CZ 3.37Å; R292-F564 HydrophobicContact CG-CE2 4.23Å; R292-F564 HydrophobicContact CG-CZ 4.24Å; R292-F564 PolarHBondContact N-O 3.09Å; R292-F564 WeakPolarHBondContact O-CD1 3.34Å; R292-F564 WeakPolarHBondContact O-CE1 3.38Å; R292-F564 PolarHBondContact O-N 3.38Å; Q296-F564 HydrophobicContact CG-CZ 4.37Å; H513-F564 HydrophobicContact CB-CB 4.2Å; H513-F564 HydrophobicContact CB-CD2 4.46Å; R529-F564 HydrophobicContact CG-CB 4.06Å; R529-F564 HydrophobicContact CG-CD1 4.33Å; R529-F564 HydrophobicContact CG-CD2 4.3Å; R529-F564 HydrophobicContact CG-CG 3.97Å; R529-F564 VanDerWaalsContact CZ-CE2 3.41Å; R529-F564 VanDerWaalsContact NH2-CE2 3.34Å; D539-F564 HydrophobicContact CB-CD1 4.37Å; D539-F564 WeakPolarHBondContact OD1-CD1 3.36Å; D539-F564 WeakPolarHBondContact OD1-CE1 3.2Å; D539-F564 WeakPolarHBondContact OD2-CE1 3.27Å; F564-H566 PolarHBondContact O-N 2.95Å; F564-H566 VanDerWaalsContact O-N 3.11Å
565	D	93	Very high	89.5	Confident	27 Å²	27	37 Å²	37	14%	0.144	21%	0.205	C	C	.	.	S	Bend	trans	57.5	18.5	-174.1	-73.5	-36.9	0	0	0	114	H513	H513-D565 IonicContact CE1-OD1 3.83Å; H513-D565 IonicContact CG-OD1 3.85Å; H513-D565 IonicContact ND1-OD1 2.77Å; H513-D565 PolarHBondContact ND1-OD1 2.88Å; H513-D565 PolarHBondContact O-N 3.14Å
566	H	94.9	Very high	87.9	Confident	10 Å²	10	34.2 Å²	34.2	5%	0.046	18%	0.18	C	C	.	.			trans	-84.1	153.9	178.5	59.3	-76.6	0	0	0	112.4	I288 G290 T526 L563 F564	I288-H566 HydrophobicContact CG2-CB 4.08Å; G290-H566 WeakPolarHBondContact O-CB 3.37Å; T526-H566 PolarHBondContact O-CE1 3Å; T526-H566 PolarHBondContact O-NE2 3.35Å; T526-H566 PolarHBondContact OG1-NE2 3.17Å; L563-H566 HydrophobicContact CD2-CB 3.55Å; L563-H566 HydrophobicContact CG-CB 3.9Å; F564-H566 PolarHBondContact O-N 2.95Å; F564-H566 VanDerWaalsContact O-N 3.11Å
567	G	94.8	Very high	86	Confident	12 Å²	12	34.8 Å²	34.8	12%	0.124	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.5	162.7	0	0	0	0	0	110.1	I288 V289	I288-G567 CarbonylContact C-O 3.59Å; I288-G567 VanDerWaalsContact CA-O 3.28Å; I288-G567 WeakPolarHBondContact CA-O 3.5Å; V289-G567 PolarHBondContact N-O 3.01Å; V289-G567 PolarHBondContact O-N 2.94Å
568	C	95.6	Very high	84	Confident	7 Å²	7	40.7 Å²	40.7	5%	0.047	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	114.7	174.3	179.7	0	0	0	0	107.9	L286 I287 T526	L286-C568 VanDerWaalsContact CD1-SG 3.6Å; I287-C568 WeakPolarHBondContact O-CA 3.48Å; T526-C568 PolarHBondContact OG1-SG 3.29Å
569	L	95.5	Very high	81.9	Confident	15 Å²	15	36.7 Å²	36.7	8%	0.079	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.5	-165.1	-56.6	176.4	0	0	0	110.5	I287 V289 A327 I334	I287-L569 PolarHBondContact N-O 3.26Å; I287-L569 PolarHBondContact O-N 3.37Å; V289-L569 HydrophobicContact CG2-CD1 4.27Å; A327-L569 HydrophobicContact CB-CD1 3.98Å; A327-L569 HydrophobicContact CB-CG 4.49Å; I334-L569 HydrophobicContact CG1-CD1 4.37Å; I334-L569 HydrophobicContact CG2-CD1 3.63Å
570	T	93	Very high	79.4	Confident	18 Å²	18	41.5 Å²	41.5	11%	0.11	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.7	162.2	-61.6	0	0	0	0	108	E284 F285 S329 T517 V518 I519 Q572	E284-T570 HydrophobicContact CB-CG2 3.94Å; F285-T570 WeakPolarHBondContact O-CA 3.37Å; S329-T570 WeakPolarHBondContact CB-O 3.48Å; S329-T570 PolarHBondContact OG-O 2.84Å; T517-T570 WeakPolarHBondContact CG2-OG1 3.13Å; T517-T570 PolarHBondContact OG1-N 3.19Å; T517-T570 PolarHBondContact OG1-OG1 3.12Å; V518-T570 WeakPolarHBondContact O-CB 3.32Å; V518-T570 WeakPolarHBondContact O-CG2 3.14Å; V518-T570 PolarHBondContact O-OG1 3.44Å; I519-T570 HydrophobicContact CG1-CG2 3.97Å; I519-T570 WeakPolarHBondContact CG1-OG1 3.34Å; T570-Q572 HydrophobicContact CG2-CG 4.43Å
571	L	89.1	Confident	78.8	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.7	171.9	-164.5	70.9	0	0	0	109.1	E284 F285 I287 I334 L358	E284-L571 CarbonylContact C-O 3.58Å; E284-L571 WeakPolarHBondContact CA-O 3.41Å; F285-L571 PolarHBondContact N-O 3.1Å; F285-L571 PolarHBondContact O-N 3.1Å; I287-L571 HydrophobicContact CD1-CB 3.5Å; I287-L571 HydrophobicContact CD1-CD2 3.39Å; I287-L571 HydrophobicContact CD1-CG 4.06Å; I287-L571 HydrophobicContact CG1-CB 4.21Å; I334-L571 HydrophobicContact CG1-CD1 4.1Å; I334-L571 HydrophobicContact CG1-CD2 4.43Å; L358-L571 HydrophobicContact CB-CD2 4.18Å; L358-L571 HydrophobicContact CD1-CD2 4.47Å; L358-L571 HydrophobicContact CD2-CD2 3.89Å; L358-L571 HydrophobicContact CG-CD2 4.41Å
572	Q	84.3	Confident	78.2	Confident	68 Å²	68	39.7 Å²	39.7	32%	0.318	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.9	178	-57.7	178.6	-36.4	0	0	107.9	Q283 E284 S332 T570	Q283-Q572 CarbonylContact O-C 3.51Å; Q283-Q572 WeakPolarHBondContact O-CA 2.93Å; E284-Q572 HydrophobicContact CG-CG 4.01Å; E284-Q572 PolarHBondContact OE1-NE2 2.77Å; S332-Q572 WeakPolarHBondContact CB-O 3.35Å; S332-Q572 PolarHBondContact OG-O 2.62Å; T570-Q572 HydrophobicContact CG2-CG 4.43Å
573	C	76.5	Confident	77.3	Confident	12 Å²	12	38.3 Å²	38.3	8%	0.081	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	161.8	177.2	65.6	0	0	0	0	111.6	Q283 F285 L358	Q283-C573 PolarHBondContact N-O 3.29Å; Q283-C573 PolarHBondContact O-N 3.34Å; F285-C573 VanDerWaalsContact CD2-SG 3.54Å; F285-C573 WeakPolarHBondContact CE2-SG 3.03Å; L358-C573 HydrophobicContact CD2-CB 4.04Å; L358-C573 WeakPolarHBondContact CD2-SG 3Å
574	V	73.6	Confident	76.3	Confident	18 Å²	18	40.4 Å²	40.4	11%	0.109	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-75.1	128.3	166.8	-178.6	0	0	0	0	107.2	Y576	V574-Y576 PolarHBondContact O-N 2.98Å; V574-Y576 VanDerWaalsContact O-N 3.17Å
575	P	63.5	Low	75.2	Confident	41 Å²	41	42.9 Å²	42.9	27%	0.266	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-63.5	118	179.5	26.1	-32.8	0	0	0	109.5	S281 F285 L580	S281-P575 WeakPolarHBondContact O-CD 3.14Å; F285-P575 HydrophobicContact CZ-CB 4.45Å; P575-L580 HydrophobicContact CB-CD1 3.57Å
576	Y	60.2	Low	74	Confident	49 Å²	49	44 Å²	44	19%	0.192	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-78.9	130.5	169.6	-66.6	-78.1	0	0	0	109.1	E192 K359 V574 N578 L579	E192-Y576 PolarHBondContact OE1-OH 3.29Å; E192-Y576 PolarHBondContact OE2-OH 3.5Å; K359-Y576 HydrophobicContact CB-CE2 4.11Å; K359-Y576 WeakPolarHBondContact CD-OH 3.18Å; K359-Y576 HydrophobicContact CG-CE1 4.43Å; K359-Y576 HydrophobicContact CG-CE2 4.27Å; K359-Y576 WeakPolarHBondContact CG-OH 3.29Å; V574-Y576 PolarHBondContact O-N 2.98Å; V574-Y576 VanDerWaalsContact O-N 3.17Å; Y576-N578 PolarHBondContact O-N 3.3Å; Y576-L579 HydrophobicContact CD2-CD1 4.25Å; Y576-L579 PolarHBondContact O-N 3.23Å; Y576-L579 VanDerWaalsContact O-N 3.11Å
577	S	51.6	Low	72.5	Confident	91 Å²	91	46.4 Å²	46.4	64%	0.636	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.7	176.9	42.4	0	0	0	0	114.6
578	N	46.9	Very low	70.8	Confident	152 Å²	152	49.1 Å²	49.1	81%	0.813	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-5.2	-178.9	-70.3	-12.9	0	0	0	114.4	Y576	Y576-N578 PolarHBondContact O-N 3.3Å
579	L	48.5	Very low	68.8	Low	57 Å²	57	52.6 Å²	52.6	30%	0.298	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-13.4	-175.6	-74.7	166.3	0	0	0	114	L358 Y576	L358-L579 HydrophobicContact CG-CD1 4.43Å; L358-L579 WeakPolarHBondContact O-CD1 3.48Å; Y576-L579 HydrophobicContact CD2-CD1 4.25Å; Y576-L579 PolarHBondContact O-N 3.23Å; Y576-L579 VanDerWaalsContact O-N 3.11Å
580	L	42.6	Very low	66.3	Low	108 Å²	108	56 Å²	56	57%	0.565	31%	0.309	S	S	*	.			trans	-127.9	0	175.3	-67.8	166.9	0	0	0	108.1	F285 L304 L313 P575	F285-L580 HydrophobicContact CE1-CD1 3.81Å; F285-L580 HydrophobicContact CE1-CD2 4.29Å; F285-L580 HydrophobicContact CZ-CD1 3.71Å; L304-L580 HydrophobicContact CD2-CD2 4.21Å; L313-L580 HydrophobicContact CD1-CD2 3.9Å; P575-L580 HydrophobicContact CB-CD1 3.57Å

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