A0A087XEA5_POEFO Loading...

N-acylethanolamine-hydrolyzing acid amidase

AlphaFold DB , UniProt , Accession A0A087XEA5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 356 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	43.7	Very low	237 Å²	237	126.2 Å²	126.2	100%	1.167	63%	0.631	S	S	*	*				0	31.9	0	-130.4	170.6	-165.6	0	0	112.6
2	F	35	Very low	44	Very low	179 Å²	179	116.7 Å²	116.7	79%	0.785	58%	0.584	S	S	*	*			trans	-116.2	3.5	-174.9	-89.4	-86.2	0	0	0	114.7
3	R	49.8	Very low	44	Very low	223 Å²	223	111.9 Å²	111.9	84%	0.842	58%	0.583	S	S	*	*	H	α-helix	trans	-83.8	-12.1	-167.8	-83.9	-177.1	173.5	179.9	-2.7	116.5
4	T	48.5	Very low	44.2	Very low	117 Å²	117	112.1 Å²	112.1	72%	0.718	58%	0.584	S	S	*	*	H	α-helix	trans	-90	-32.9	-173	47.1	0	0	0	0	113.9	L8	T4-L8 PolarHBondContact O-N 3.24Å
5	A	39.2	Very low	44.4	Very low	63 Å²	63	105.6 Å²	105.6	52%	0.521	55%	0.551	S	S	.	*	H	α-helix	trans	-73.3	-39.4	178.6	0	0	0	0	0	112	L8 L9	A5-L8 PolarHBondContact O-N 3.14Å; A5-L9 WeakPolarHBondContact O-CG 3.22Å; A5-L9 PolarHBondContact O-N 2.71Å
6	E	41.2	Very low	44.3	Very low	120 Å²	120	102 Å²	102	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-65.7	-37.3	176	-69.9	177.1	164	0	0	112.1	L9 L10	E6-L9 PolarHBondContact O-N 3.24Å; E6-L10 WeakPolarHBondContact O-CB 3.45Å; E6-L10 PolarHBondContact O-N 3.27Å
7	L	45.6	Very low	44.3	Very low	114 Å²	114	100.7 Å²	100.7	60%	0.597	55%	0.549	S	S	*	.	H	α-helix	trans	-65.4	-39.8	175.4	-144.9	84.5	0	0	0	111.6	L10 L11	L7-L10 PolarHBondContact O-N 2.7Å; L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CD1 3.11Å; L7-L11 VanDerWaalsContact O-CG 3.3Å; L7-L11 WeakPolarHBondContact O-CG 3.42Å; L7-L11 PolarHBondContact O-N 2.88Å
8	L	44.7	Very low	44.6	Very low	57 Å²	57	97.6 Å²	97.6	30%	0.298	53%	0.531	S	S	.	.	H	α-helix	trans	-65	-42.7	175.5	-144.5	84.5	0	0	0	111	T4 A5 L11 L12 A304	T4-L8 PolarHBondContact O-N 3.24Å; A5-L8 PolarHBondContact O-N 3.14Å; L8-L11 PolarHBondContact O-N 2.76Å; L8-L12 WeakPolarHBondContact O-CB 3.26Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 3.38Å; L8-A304 HydrophobicContact CD2-CB 3.74Å
9	L	46.4	Very low	44.9	Very low	107 Å²	107	95.8 Å²	95.8	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-66.5	-36.3	177.3	-73.6	161.6	0	0	0	112.8	A5 E6 L12 G13	A5-L9 WeakPolarHBondContact O-CG 3.22Å; A5-L9 PolarHBondContact O-N 2.71Å; E6-L9 PolarHBondContact O-N 3.24Å; L9-L12 HydrophobicContact CD2-CD1 4.42Å; L9-L12 PolarHBondContact O-N 3.11Å; L9-G13 PolarHBondContact O-N 3.06Å; L9-G13 VanDerWaalsContact O-N 3.07Å
10	L	42.5	Very low	45.2	Very low	118 Å²	118	95.8 Å²	95.8	62%	0.618	53%	0.529	S	S	*	.	H	α-helix	trans	-66.3	-41.7	172.8	-90.6	152.3	0	0	0	112.3	E6 L7 L12 G13 L14	E6-L10 WeakPolarHBondContact O-CB 3.45Å; E6-L10 PolarHBondContact O-N 3.27Å; L7-L10 PolarHBondContact O-N 2.7Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 2.9Å; L10-G13 PolarHBondContact O-N 2.91Å; L10-L14 PolarHBondContact O-N 3.46Å
11	L	47.1	Very low	45.8	Very low	53 Å²	53	98.1 Å²	98.1	28%	0.277	54%	0.536	S	S	.	.	H	α-helix	trans	-64	-36	173.6	-73.7	162.2	0	0	0	111.9	L7 L8 G13 L14 C15	L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CD1 3.11Å; L7-L11 VanDerWaalsContact O-CG 3.3Å; L7-L11 WeakPolarHBondContact O-CG 3.42Å; L7-L11 PolarHBondContact O-N 2.88Å; L8-L11 PolarHBondContact O-N 2.76Å; L11-G13 VanDerWaalsContact C-N 3.33Å; L11-G13 PolarHBondContact O-N 3.35Å; L11-L14 PolarHBondContact O-N 2.98Å; L11-C15 PolarHBondContact O-N 3.01Å
12	L	47.8	Very low	47.3	Very low	12 Å²	12	87.6 Å²	87.6	6%	0.063	48%	0.484	C	S	.	.	H	α-helix	trans	-68.2	-29.4	174	-69.5	170.2	0	0	0	112.5	L8 L9 L10 Q317	L8-L12 WeakPolarHBondContact O-CB 3.26Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 3.38Å; L9-L12 HydrophobicContact CD2-CD1 4.42Å; L9-L12 PolarHBondContact O-N 3.11Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 2.9Å; L12-Q317 HydrophobicContact CD2-CB 3.56Å; L12-Q317 HydrophobicContact CD2-CG 4.27Å; L12-Q317 VanDerWaalsContact CD2-OE1 3.27Å; L12-Q317 PolarHBondContact O-NE2 3.45Å; L12-Q317 PolarHBondContact O-OE1 3.27Å
13	G	44.3	Very low	49.5	Very low	55 Å²	55	82.8 Å²	82.8	57%	0.567	47%	0.471	S	S	*	.	H	α-helix	trans	-69.6	-39.1	175	0	0	0	0	0	113.7	L9 L10 L11 C15 G16	L9-G13 PolarHBondContact O-N 3.06Å; L9-G13 VanDerWaalsContact O-N 3.07Å; L10-G13 PolarHBondContact O-N 2.91Å; L11-G13 VanDerWaalsContact C-N 3.33Å; L11-G13 PolarHBondContact O-N 3.35Å; G13-C15 VanDerWaalsContact C-N 3.35Å; G13-C15 PolarHBondContact O-N 3.18Å; G13-G16 PolarHBondContact O-N 3.31Å
14	L	45.8	Very low	51.3	Low	115 Å²	115	75.7 Å²	75.7	60%	0.602	46%	0.456	S	S	*	.	H	α-helix	trans	-72	-23.4	178.9	-78.7	155.3	0	0	0	113.6	L10 L11 G16 S17	L10-L14 PolarHBondContact O-N 3.46Å; L11-L14 PolarHBondContact O-N 2.98Å; L14-G16 VanDerWaalsContact C-N 3.31Å; L14-G16 PolarHBondContact O-N 2.74Å; L14-S17 PolarHBondContact O-OG 2.84Å; L14-S17 VanDerWaalsContact O-OG 3.09Å
15	C	48	Very low	53.6	Low	14 Å²	14	70.3 Å²	70.3	10%	0.095	42%	0.423	C	S	.	.	H	α-helix	trans	-69.5	-23.5	176	-102	0	0	0	0	114.1	L11 G13 L18 Q317	L11-C15 PolarHBondContact O-N 3.01Å; G13-C15 VanDerWaalsContact C-N 3.35Å; G13-C15 PolarHBondContact O-N 3.18Å; C15-L18 PolarHBondContact O-N 3.47Å; C15-Q317 HydrophobicContact CB-CG 3.77Å
16	G	43.3	Very low	56.2	Low	48 Å²	48	69.9 Å²	69.9	50%	0.495	42%	0.415	S	S	.	.	H	α-helix	trans	-66.2	-37.9	-178.4	0	0	0	0	0	113.4	G13 L14	G13-G16 PolarHBondContact O-N 3.31Å; L14-G16 VanDerWaalsContact C-N 3.31Å; L14-G16 PolarHBondContact O-N 2.74Å
17	S	44	Very low	58.8	Low	80 Å²	80	68 Å²	68	56%	0.559	41%	0.412	S	S	*	.	H	α-helix	trans	-77	-22.6	177.7	50.5	0	0	0	0	113.6	L14	L14-S17 PolarHBondContact O-OG 2.84Å; L14-S17 VanDerWaalsContact O-OG 3.09Å
18	L	49.6	Very low	61.3	Low	45 Å²	45	62.7 Å²	62.7	24%	0.236	38%	0.384	C	S	.	.	H	α-helix	trans	-75.6	-20.9	176.8	-81.6	153.3	0	0	0	113.5	C15 A20 Q21 F353	C15-L18 PolarHBondContact O-N 3.47Å; L18-A20 PolarHBondContact O-N 3.21Å; L18-Q21 PolarHBondContact O-N 2.86Å; L18-F353 HydrophobicContact CD2-CD1 4.46Å; L18-F353 HydrophobicContact CD2-CD2 3.99Å; L18-F353 HydrophobicContact CD2-CE1 4.47Å; L18-F353 HydrophobicContact CD2-CE2 3.98Å; L18-F353 HydrophobicContact CD2-CG 4.23Å; L18-F353 HydrophobicContact CD2-CZ 4.24Å
19	R	50.8	Low	63.8	Low	64 Å²	64	63 Å²	63	24%	0.242	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-63.2	-29.9	179.8	-159.8	176.4	-171.3	-150.7	-10.6	112.6	Q21 D313 Y316 F346	R19-Q21 VanDerWaalsContact C-N 3.28Å; R19-Q21 PolarHBondContact O-N 3.42Å; R19-D313 IonicContact CZ-OD1 3.33Å; R19-D313 IonicContact NE-OD1 2.69Å; R19-D313 IonicContact NH1-OD1 3.92Å; R19-D313 PolarHBondContact NH1-OD1 3.25Å; R19-Y316 HydrophobicContact CG-CE1 4.43Å; R19-F346 HydrophobicContact CG-CE1 3.75Å; R19-F346 HydrophobicContact CG-CZ 3.74Å
20	A	50.5	Low	66.2	Low	94 Å²	94	58 Å²	58	78%	0.777	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-76.3	-8.9	-179	0	0	0	0	0	114.5	L18	L18-A20 PolarHBondContact O-N 3.21Å
21	Q	57.3	Low	68.8	Low	146 Å²	146	54.5 Å²	54.5	68%	0.682	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-109.6	-8.9	-174.4	-66.7	-177.8	-8.9	0	0	114.1	L18 R19	L18-Q21 PolarHBondContact O-N 2.86Å; R19-Q21 VanDerWaalsContact C-N 3.28Å; R19-Q21 PolarHBondContact O-N 3.42Å
22	L	72.2	Confident	71.2	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.079	33%	0.333	C	S	.	.	S	Bend	trans	-85.3	133.7	179.6	-74.1	178.4	0	0	0	111.5	S24 Y316 F346 P349 F353	L22-S24 PolarHBondContact O-N 3.06Å; L22-Y316 WeakPolarHBondContact CD1-OH 3.49Å; L22-F346 HydrophobicContact CB-CB 4.43Å; L22-F346 HydrophobicContact CB-CD1 4.18Å; L22-F346 HydrophobicContact CD1-CB 4.27Å; L22-P349 HydrophobicContact CD2-CG 4.27Å; L22-F353 HydrophobicContact CD1-CE2 4.42Å; L22-F353 HydrophobicContact CD2-CD2 4.47Å; L22-F353 HydrophobicContact CD2-CE2 3.5Å; L22-F353 VanDerWaalsContact CD2-CE2 3.5Å; L22-F353 HydrophobicContact CD2-CZ 4.08Å; L22-F353 HydrophobicContact CG-CE2 4.02Å
23	P	80.9	Confident	73.6	Confident	79 Å²	79	55.6 Å²	55.6	51%	0.513	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-65.3	125.4	177.8	24.6	-29.1	0	0	0	109.9	I347	P23-I347 HydrophobicContact CG-CB 4.31Å; P23-I347 PolarHBondContact O-N 2.98Å; P23-I347 VanDerWaalsContact O-N 3.08Å
24	S	88.4	Confident	76.1	Confident	74 Å²	74	56.8 Å²	56.8	52%	0.517	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-72.9	137.8	162	-65.5	0	0	0	0	108.3	L22	L22-S24 PolarHBondContact O-N 3.06Å
25	P	95.1	Very high	78.6	Confident	4 Å²	4	57.5 Å²	57.5	3%	0.026	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-64.4	151.8	176.4	29.2	-33.6	0	0	0	110.2	T147 T345 I347	P25-T147 HydrophobicContact CB-CG2 3.95Å; P25-T147 VanDerWaalsContact CB-O 3.26Å; P25-T147 WeakPolarHBondContact CB-O 3.41Å; P25-T147 HydrophobicContact CG-CG2 4.25Å; P25-T345 WeakPolarHBondContact CD-O 3.47Å; P25-T345 HydrophobicContact CG-CG2 3.86Å; P25-I347 HydrophobicContact CB-CD1 3.89Å; P25-I347 HydrophobicContact CB-CG1 4.1Å
26	P	95.6	Very high	80.9	Confident	53 Å²	53	57.9 Å²	57.9	34%	0.344	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-60.5	152.7	174.6	28.6	-36.3	0	0	0	110.8	V46 F47 M148 N149	P26-V46 HydrophobicContact CB-CG1 3.48Å; P26-V46 VanDerWaalsContact CB-CG1 3.48Å; P26-V46 HydrophobicContact CG-CG1 3.69Å; P26-F47 HydrophobicContact CG-CE1 4.11Å; P26-F47 HydrophobicContact CG-CE2 4.29Å; P26-F47 HydrophobicContact CG-CZ 3.6Å; P26-M148 WeakPolarHBondContact O-CA 3.2Å; P26-N149 PolarHBondContact O-N 3.49Å
27	T	95.8	Very high	83.5	Confident	81 Å²	81	58.9 Å²	58.9	50%	0.497	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.6	177.4	-60.3	0	0	0	0	110.2	N149 V151	T27-N149 CarbonylContact C-O 3.47Å; T27-N149 WeakPolarHBondContact CA-O 3.29Å; T27-V151 HydrophobicContact CG2-CG2 3.66Å
28	V	96.8	Very high	86	Confident	3 Å²	3	59 Å²	59	2%	0.018	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.1	176.3	-176.8	0	0	0	0	108.6	I30 A42 L43 V46 F47 M148 N149 L150 V151	V28-I30 HydrophobicContact CG1-CD1 4Å; V28-A42 HydrophobicContact CG1-CB 3.78Å; V28-L43 HydrophobicContact CG1-CD2 4.24Å; V28-L43 HydrophobicContact CG2-CD2 4.14Å; V28-V46 HydrophobicContact CG2-CB 4.38Å; V28-V46 HydrophobicContact CG2-CG1 4.28Å; V28-V46 HydrophobicContact CG2-CG2 4.13Å; V28-F47 HydrophobicContact CG2-CE2 4.42Å; V28-M148 HydrophobicContact CB-SD 4.42Å; V28-M148 HydrophobicContact CG2-CB 4.29Å; V28-M148 HydrophobicContact CG2-SD 3.91Å; V28-N149 PolarHBondContact N-O 3.16Å; V28-L150 HydrophobicContact CB-CD2 3.94Å; V28-L150 HydrophobicContact CG1-CD2 4.47Å; V28-L150 WeakPolarHBondContact O-CA 3.45Å; V28-V151 PolarHBondContact O-N 3.42Å
29	V	97	Very high	88.3	Confident	64 Å²	64	58.3 Å²	58.3	39%	0.388	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128	174	177.5	0	0	0	0	108.9	V151 Q153	V29-V151 WeakPolarHBondContact CA-O 3.22Å; V29-V151 HydrophobicContact CG2-CB 4.43Å; V29-Q153 HydrophobicContact CG1-CB 4.36Å; V29-Q153 VanDerWaalsContact CG1-CD 3.41Å; V29-Q153 HydrophobicContact CG1-CG 3.8Å
30	I	97.6	Very high	90.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	111.8	175	-56.7	-59.4	0	0	0	108	V28 L32 R39 W40 L150 V151 F152 Q153	V28-I30 HydrophobicContact CG1-CD1 4Å; I30-L32 PolarHBondContact O-N 3.06Å; I30-R39 HydrophobicContact CG2-CB 4.05Å; I30-W40 HydrophobicContact CD1-CD2 4.04Å; I30-W40 HydrophobicContact CD1-CE3 3.57Å; I30-W40 HydrophobicContact CD1-CH2 4.2Å; I30-W40 HydrophobicContact CD1-CZ3 3.65Å; I30-W40 HydrophobicContact CG1-CH2 4.38Å; I30-W40 HydrophobicContact CG1-CZ3 4.24Å; I30-L150 HydrophobicContact CD1-CD2 4.31Å; I30-L150 HydrophobicContact CG1-CD2 3.97Å; I30-V151 PolarHBondContact N-O 3.04Å; I30-F152 HydrophobicContact CB-CD1 3.65Å; I30-F152 HydrophobicContact CB-CE1 3.87Å; I30-F152 HydrophobicContact CB-CG 4.29Å; I30-F152 HydrophobicContact CG1-CD1 4.28Å; I30-F152 HydrophobicContact CG1-CE1 4.06Å; I30-F152 HydrophobicContact CG1-CZ 4.43Å; I30-F152 HydrophobicContact CG2-CD1 3.64Å; I30-F152 HydrophobicContact CG2-CE1 3.7Å; I30-F152 WeakPolarHBondContact O-CA 3.42Å; I30-Q153 PolarHBondContact O-N 3.39Å
31	N	97.4	Very high	92.5	Very high	45 Å²	45	54.2 Å²	54.2	24%	0.241	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108	-180	-174.5	6	0	0	0	110.5	D33 E34 R39	N31-D33 PolarHBondContact O-N 3.18Å; N31-D33 WeakPolarHBondContact OD1-CB 3.43Å; N31-D33 PolarHBondContact OD1-N 3.06Å; N31-D33 VanDerWaalsContact OD1-N 3.11Å; N31-D33 PolarHBondContact OD1-OD2 3.22Å; N31-E34 HydrophobicContact CB-CG 4.06Å; N31-E34 WeakPolarHBondContact O-CB 3.3Å; N31-E34 PolarHBondContact O-N 2.87Å; N31-R39 WeakPolarHBondContact O-CG 3.24Å
32	L	97.4	Very high	94.1	Very high	11 Å²	11	48.5 Å²	48.5	6%	0.058	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-15.1	-179.7	-62.8	176.1	0	0	0	113.2	I30 E34 R39 F152 Q153 K154 V159 Y160	I30-L32 PolarHBondContact O-N 3.06Å; L32-E34 VanDerWaalsContact C-N 3.26Å; L32-R39 PolarHBondContact O-NH2 3.39Å; L32-F152 HydrophobicContact CD1-CB 4.25Å; L32-F152 HydrophobicContact CD2-CD1 3.92Å; L32-F152 HydrophobicContact CG-CB 4.46Å; L32-F152 HydrophobicContact CG-CD1 4.45Å; L32-Q153 VanDerWaalsContact CB-O 3.26Å; L32-Q153 WeakPolarHBondContact CB-O 3.45Å; L32-Q153 WeakPolarHBondContact CG-O 3.43Å; L32-Q153 PolarHBondContact N-O 2.99Å; L32-K154 HydrophobicContact CB-CB 4.4Å; L32-K154 HydrophobicContact CB-CG 4.49Å; L32-K154 HydrophobicContact CD1-CB 4.47Å; L32-V159 HydrophobicContact CD1-CG2 3.72Å; L32-Y160 HydrophobicContact CD1-CE1 3.99Å
33	D	97.4	Very high	95.1	Very high	77 Å²	77	47.8 Å²	47.8	41%	0.412	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-15	173.9	-53.1	-38.4	0	0	0	112.2	N31 K154 N155	N31-D33 PolarHBondContact O-N 3.18Å; N31-D33 WeakPolarHBondContact OD1-CB 3.43Å; N31-D33 PolarHBondContact OD1-N 3.06Å; N31-D33 VanDerWaalsContact OD1-N 3.11Å; N31-D33 PolarHBondContact OD1-OD2 3.22Å; D33-K154 WeakPolarHBondContact OD1-CG 3.32Å; D33-N155 PolarHBondContact OD1-N 3.47Å; D33-N155 VanDerWaalsContact OD2-CA 3.22Å; D33-N155 WeakPolarHBondContact OD2-CA 3.39Å; D33-N155 PolarHBondContact OD2-N 3.12Å
34	E	97.4	Very high	95.6	Very high	80 Å²	80	49 Å²	49	37%	0.374	26%	0.264	S	S	.	.	S	Bend	trans	-80.5	153.2	173.1	-70	176	-171.9	0	0	111.6	N31 L32 R39	N31-E34 HydrophobicContact CB-CG 4.06Å; N31-E34 WeakPolarHBondContact O-CB 3.3Å; N31-E34 PolarHBondContact O-N 2.87Å; L32-E34 VanDerWaalsContact C-N 3.26Å; E34-R39 HydrophobicContact CB-CG 4.2Å; E34-R39 PolarHBondContact O-NE 3.27Å; E34-R39 PolarHBondContact O-NH2 3.21Å
35	E	97.8	Very high	95.8	Very high	131 Å²	131	54.6 Å²	54.6	61%	0.612	28%	0.279	S	S	*	.			trans	-54.5	137.2	169.8	-68.2	-59.4	152.9	0	0	110.5	E37 L38 R39	E35-E37 PolarHBondContact O-N 3.41Å; E35-L38 HydrophobicContact CB-CD1 4.3Å; E35-L38 HydrophobicContact CB-CG 4.38Å; E35-L38 PolarHBondContact O-N 3.1Å; E35-R39 PolarHBondContact O-N 2.96Å
36	P	97.4	Very high	95.6	Very high	22 Å²	22	57.2 Å²	57.2	14%	0.143	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46	-41.4	-177.3	-33.1	38.6	0	0	0	114.8	L38 R39 P86 E90	P36-L38 PolarHBondContact O-N 2.65Å; P36-R39 PolarHBondContact O-N 3.07Å; P36-P86 HydrophobicContact CB-CB 4.15Å; P36-P86 WeakPolarHBondContact CB-O 3.48Å; P36-P86 HydrophobicContact CG-CB 3.85Å; P36-E90 HydrophobicContact CB-CG 3.93Å; P36-E90 WeakPolarHBondContact O-CA 3.13Å; P36-E90 WeakPolarHBondContact O-CG 3.33Å
37	E	96.5	Very high	95.6	Very high	69 Å²	69	56 Å²	56	32%	0.322	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.5	179	-73.2	76.6	-176.8	0	0	114.2	E35 G89 R92 G93	E35-E37 PolarHBondContact O-N 3.41Å; E37-G89 WeakPolarHBondContact CA-O 3.35Å; E37-G89 WeakPolarHBondContact OE1-CA 3.49Å; E37-R92 HydrophobicContact CG-CB 4.34Å; E37-R92 IonicContact OE1-NH1 3.4Å; E37-R92 PolarHBondContact OE1-NH1 3.24Å; E37-R92 VanDerWaalsContact OE1-NH1 3.14Å; E37-G93 WeakPolarHBondContact O-CA 3.42Å
38	L	96.9	Very high	95.5	Very high	83 Å²	83	57.2 Å²	57.2	44%	0.435	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-22.7	-174.4	-57.1	179.7	0	0	0	113.2	E35 P36 W40 L41	E35-L38 HydrophobicContact CB-CD1 4.3Å; E35-L38 HydrophobicContact CB-CG 4.38Å; E35-L38 PolarHBondContact O-N 3.1Å; P36-L38 PolarHBondContact O-N 2.65Å; L38-W40 PolarHBondContact O-N 3.27Å; L38-L41 HydrophobicContact CB-CD1 4.14Å; L38-L41 HydrophobicContact CD2-CD1 3.84Å; L38-L41 VanDerWaalsContact O-CB 3.29Å; L38-L41 WeakPolarHBondContact O-CB 3.44Å; L38-L41 VanDerWaalsContact O-CG 3.24Å; L38-L41 WeakPolarHBondContact O-CG 3.45Å; L38-L41 PolarHBondContact O-N 3.24Å
39	R	97.2	Very high	95.2	Very high	29 Å²	29	58.9 Å²	58.9	11%	0.109	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-32.5	-172.4	-70.7	-178.2	-176.2	170	-5.5	114.9	I30 N31 L32 E34 E35 P36 P86 E90	I30-R39 HydrophobicContact CG2-CB 4.05Å; N31-R39 WeakPolarHBondContact O-CG 3.24Å; L32-R39 PolarHBondContact O-NH2 3.39Å; E34-R39 HydrophobicContact CB-CG 4.2Å; E34-R39 PolarHBondContact O-NE 3.27Å; E34-R39 PolarHBondContact O-NH2 3.21Å; E35-R39 PolarHBondContact O-N 2.96Å; P36-R39 PolarHBondContact O-N 3.07Å; R39-P86 VanDerWaalsContact NH1-CB 3.33Å; R39-E90 VanDerWaalsContact CD-OE1 3.3Å; R39-E90 WeakPolarHBondContact CD-OE1 3.46Å; R39-E90 IonicContact CZ-OE1 2.84Å; R39-E90 IonicContact NE-OE1 3.81Å; R39-E90 IonicContact NH1-OE1 2.74Å; R39-E90 PolarHBondContact NH1-OE1 2.89Å
40	W	95.8	Very high	95	Very high	1 Å²	1	60.8 Å²	60.8	0%	0.004	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	3.1	-175.5	-63	98.9	0	0	0	114.1	I30 L38 A42 L43 E90 L94 M148 L150 V169	I30-W40 HydrophobicContact CD1-CD2 4.04Å; I30-W40 HydrophobicContact CD1-CE3 3.57Å; I30-W40 HydrophobicContact CD1-CH2 4.2Å; I30-W40 HydrophobicContact CD1-CZ3 3.65Å; I30-W40 HydrophobicContact CG1-CH2 4.38Å; I30-W40 HydrophobicContact CG1-CZ3 4.24Å; L38-W40 PolarHBondContact O-N 3.27Å; W40-A42 PolarHBondContact O-N 3.3Å; W40-A42 VanDerWaalsContact O-N 3.16Å; W40-L43 HydrophobicContact CB-CD1 4.37Å; W40-L43 HydrophobicContact CE3-CD1 4.05Å; W40-L43 HydrophobicContact CE3-CD2 4.44Å; W40-L43 HydrophobicContact CE3-CG 4.26Å; W40-L43 WeakPolarHBondContact O-CB 3.48Å; W40-L43 WeakPolarHBondContact O-CG 3.38Å; W40-L43 PolarHBondContact O-N 2.81Å; W40-L43 VanDerWaalsContact O-N 3.11Å; W40-E90 PolarHBondContact NE1-OE2 2.81Å; W40-L94 HydrophobicContact CB-CD2 3.52Å; W40-L94 HydrophobicContact CB-CG 3.93Å; W40-L94 HydrophobicContact CD2-CD1 4.42Å; W40-L94 HydrophobicContact CD2-CD2 3.91Å; W40-L94 HydrophobicContact CD2-CG 4.22Å; W40-L94 HydrophobicContact CE3-CD2 4.19Å; W40-L94 HydrophobicContact CG-CD1 4.37Å; W40-L94 HydrophobicContact CG-CD2 3.64Å; W40-L94 HydrophobicContact CG-CG 3.75Å; W40-M148 HydrophobicContact CE3-CE 4.4Å; W40-M148 HydrophobicContact CH2-CE 4.32Å; W40-M148 HydrophobicContact CZ3-CE 3.56Å; W40-L150 HydrophobicContact CH2-CD1 3.76Å; W40-L150 HydrophobicContact CH2-CD2 4.42Å; W40-L150 HydrophobicContact CZ3-CD1 4.14Å; W40-L150 HydrophobicContact CZ3-CD2 4.02Å; W40-V169 HydrophobicContact CZ2-CB 4.4Å; W40-V169 HydrophobicContact CZ2-CG1 4.39Å
41	L	94.3	Very high	94.8	Very high	72 Å²	72	64.1 Å²	64.1	38%	0.377	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-59.6	-26.3	175.4	-72.5	175.6	0	0	0	112.8	L38 L43 K44 V97	L38-L41 HydrophobicContact CB-CD1 4.14Å; L38-L41 HydrophobicContact CD2-CD1 3.84Å; L38-L41 VanDerWaalsContact O-CB 3.29Å; L38-L41 WeakPolarHBondContact O-CB 3.44Å; L38-L41 VanDerWaalsContact O-CG 3.24Å; L38-L41 WeakPolarHBondContact O-CG 3.45Å; L38-L41 PolarHBondContact O-N 3.24Å; L41-L43 PolarHBondContact O-N 3.18Å; L41-L43 VanDerWaalsContact O-N 3.14Å; L41-K44 PolarHBondContact O-N 3Å; L41-K44 VanDerWaalsContact O-N 3.15Å; L41-V97 HydrophobicContact CD2-CG2 4.04Å
42	A	90.9	Very high	94.5	Very high	26 Å²	26	62 Å²	62	22%	0.215	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-57.1	-25.8	176.1	0	0	0	0	0	113.3	V28 W40 K44 K45	V28-A42 HydrophobicContact CG1-CB 3.78Å; W40-A42 PolarHBondContact O-N 3.3Å; W40-A42 VanDerWaalsContact O-N 3.16Å; A42-K44 PolarHBondContact O-N 3.32Å; A42-K45 WeakPolarHBondContact O-CB 3.31Å; A42-K45 PolarHBondContact O-N 3.13Å
43	L	93.2	Very high	94.2	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-58.5	-35.3	177.2	-65.3	-178.8	0	0	0	112.6	V28 W40 L41 K45 V46 F47 L94 V97 M148 A166	V28-L43 HydrophobicContact CG1-CD2 4.24Å; V28-L43 HydrophobicContact CG2-CD2 4.14Å; W40-L43 HydrophobicContact CB-CD1 4.37Å; W40-L43 HydrophobicContact CE3-CD1 4.05Å; W40-L43 HydrophobicContact CE3-CD2 4.44Å; W40-L43 HydrophobicContact CE3-CG 4.26Å; W40-L43 WeakPolarHBondContact O-CB 3.48Å; W40-L43 WeakPolarHBondContact O-CG 3.38Å; W40-L43 PolarHBondContact O-N 2.81Å; W40-L43 VanDerWaalsContact O-N 3.11Å; L41-L43 PolarHBondContact O-N 3.18Å; L41-L43 VanDerWaalsContact O-N 3.14Å; L43-K45 PolarHBondContact O-N 3.04Å; L43-K45 VanDerWaalsContact O-N 3.11Å; L43-V46 PolarHBondContact O-N 2.9Å; L43-F47 HydrophobicContact CD2-CD2 4.15Å; L43-F47 HydrophobicContact CD2-CE2 4.2Å; L43-F47 PolarHBondContact O-N 3.09Å; L43-L94 HydrophobicContact CD1-CD2 3.48Å; L43-L94 VanDerWaalsContact CD1-CD2 3.48Å; L43-V97 HydrophobicContact CB-CG1 4.2Å; L43-M148 HydrophobicContact CD2-CE 4.08Å; L43-M148 HydrophobicContact CD2-SD 3.45Å; L43-M148 WeakPolarHBondContact CD2-SD 3.33Å; L43-A166 HydrophobicContact CD1-CB 4.42Å; L43-A166 HydrophobicContact CD2-CB 4.28Å
44	K	92.4	Very high	94	Very high	104 Å²	104	67.1 Å²	67.1	45%	0.452	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-62.3	-19.6	178.9	-64.2	-173.7	174.9	178.7	0	113.4	L41 A42 V49 V97	L41-K44 PolarHBondContact O-N 3Å; L41-K44 VanDerWaalsContact O-N 3.15Å; A42-K44 PolarHBondContact O-N 3.32Å; K44-V49 HydrophobicContact CG-CG2 4.03Å; K44-V97 HydrophobicContact CG-CG1 3.91Å
45	K	91	Very high	93.8	Very high	192 Å²	192	63.3 Å²	63.3	84%	0.835	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-87.5	-16.9	178.4	-59.3	179.9	-178.8	174.7	0	112.6	A42 L43	A42-K45 WeakPolarHBondContact O-CB 3.31Å; A42-K45 PolarHBondContact O-N 3.13Å; L43-K45 PolarHBondContact O-N 3.04Å; L43-K45 VanDerWaalsContact O-N 3.11Å
46	V	92.7	Very high	93.4	Very high	59 Å²	59	57.6 Å²	57.6	36%	0.358	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-33.3	-169.4	179.2	0	0	0	0	111.7	P26 V28 L43	P26-V46 HydrophobicContact CB-CG1 3.48Å; P26-V46 VanDerWaalsContact CB-CG1 3.48Å; P26-V46 HydrophobicContact CG-CG1 3.69Å; V28-V46 HydrophobicContact CG2-CB 4.38Å; V28-V46 HydrophobicContact CG2-CG1 4.28Å; V28-V46 HydrophobicContact CG2-CG2 4.13Å; L43-V46 PolarHBondContact O-N 2.9Å
47	F	93.9	Very high	93.1	Very high	28 Å²	28	59.2 Å²	59.2	12%	0.123	30%	0.303	C	S	.	.	S	Bend	trans	-120.9	148.2	-175.6	-66.5	-79.1	0	0	0	111.9	P26 V28 L43 V49 L52 N145 M148 A166	P26-F47 HydrophobicContact CG-CE1 4.11Å; P26-F47 HydrophobicContact CG-CE2 4.29Å; P26-F47 HydrophobicContact CG-CZ 3.6Å; V28-F47 HydrophobicContact CG2-CE2 4.42Å; L43-F47 HydrophobicContact CD2-CD2 4.15Å; L43-F47 HydrophobicContact CD2-CE2 4.2Å; L43-F47 PolarHBondContact O-N 3.09Å; F47-V49 PolarHBondContact O-N 2.8Å; F47-L52 HydrophobicContact CB-CD1 3.64Å; F47-L52 HydrophobicContact CB-CD2 4.13Å; F47-L52 HydrophobicContact CB-CG 3.88Å; F47-L52 HydrophobicContact CD1-CD2 4.23Å; F47-L52 HydrophobicContact CG-CD1 4.19Å; F47-L52 HydrophobicContact CG-CD2 4.18Å; F47-L52 HydrophobicContact CG-CG 4.44Å; F47-N145 VanDerWaalsContact CE1-O 3.23Å; F47-N145 WeakPolarHBondContact CE1-O 3.36Å; F47-M148 HydrophobicContact CE2-CB 4.24Å; F47-M148 HydrophobicContact CE2-SD 4.15Å; F47-M148 HydrophobicContact CZ-CB 4.1Å; F47-A166 HydrophobicContact CD2-CB 4.07Å; F47-A166 HydrophobicContact CE2-CB 3.98Å; F47-A166 HydrophobicContact CG-CB 4.49Å; F47-A166 HydrophobicContact CZ-CB 4.34Å
48	D	93.5	Very high	92.8	Very high	105 Å²	105	60.5 Å²	60.5	56%	0.561	31%	0.309	S	S	*	.			trans	-67.3	115.8	162.7	-179.9	-7.3	0	0	0	109	D50 Y51 L52	D48-D50 VanDerWaalsContact C-N 3.31Å; D48-D50 PolarHBondContact O-N 3.31Å; D48-D50 WeakPolarHBondContact OD1-CB 3.42Å; D48-D50 PolarHBondContact OD1-N 2.92Å; D48-Y51 WeakPolarHBondContact O-CB 3.36Å; D48-Y51 PolarHBondContact O-N 2.83Å; D48-L52 PolarHBondContact O-N 2.83Å; D48-L52 VanDerWaalsContact O-N 3.08Å
49	V	91.2	Very high	92.4	Very high	39 Å²	39	56.5 Å²	56.5	24%	0.236	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-38.8	-178.5	176.1	0	0	0	0	111	K44 F47 Y51 L52 T53 V97	K44-V49 HydrophobicContact CG-CG2 4.03Å; F47-V49 PolarHBondContact O-N 2.8Å; V49-Y51 PolarHBondContact O-N 3.11Å; V49-L52 PolarHBondContact O-N 3.19Å; V49-L52 VanDerWaalsContact O-N 3.1Å; V49-T53 PolarHBondContact O-N 3.14Å; V49-T53 PolarHBondContact O-OG1 3.32Å; V49-V97 WeakPolarHBondContact CG1-O 3.46Å
50	D	92.5	Very high	91.9	Very high	104 Å²	104	55.5 Å²	55.5	56%	0.556	28%	0.284	S	S	*	.	H	α-helix	trans	-63.6	-35.9	179.5	-75.4	-9.7	0	0	0	111	D48 K54	D48-D50 VanDerWaalsContact C-N 3.31Å; D48-D50 PolarHBondContact O-N 3.31Å; D48-D50 WeakPolarHBondContact OD1-CB 3.42Å; D48-D50 PolarHBondContact OD1-N 2.92Å; D50-K54 WeakPolarHBondContact O-CD 3.5Å; D50-K54 VanDerWaalsContact O-CG 3.28Å; D50-K54 WeakPolarHBondContact O-CG 3.4Å; D50-K54 PolarHBondContact O-N 2.95Å; D50-K54 VanDerWaalsContact O-N 3.13Å
51	Y	93.1	Very high	91.5	Very high	70 Å²	70	61 Å²	61	28%	0.275	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-49.2	172.5	-179.9	-98	0	0	0	111.4	D48 V49 T53 K54 A55 V142 N145 M146	D48-Y51 WeakPolarHBondContact O-CB 3.36Å; D48-Y51 PolarHBondContact O-N 2.83Å; V49-Y51 PolarHBondContact O-N 3.11Å; Y51-T53 VanDerWaalsContact C-N 3.31Å; Y51-T53 PolarHBondContact O-N 3Å; Y51-K54 PolarHBondContact O-N 3.49Å; Y51-A55 HydrophobicContact CE1-CB 4.44Å; Y51-A55 VanDerWaalsContact O-CB 3.28Å; Y51-A55 WeakPolarHBondContact O-CB 3.46Å; Y51-A55 PolarHBondContact O-N 2.88Å; Y51-V142 HydrophobicContact CE1-CG2 4.36Å; Y51-V142 HydrophobicContact CE2-CG2 4.45Å; Y51-V142 WeakPolarHBondContact OH-CG2 3.32Å; Y51-N145 HydrophobicContact CE1-CB 3.68Å; Y51-N145 VanDerWaalsContact OH-CB 3.25Å; Y51-N145 WeakPolarHBondContact OH-CB 3.21Å; Y51-N145 PolarHBondContact OH-ND2 2.99Å; Y51-M146 HydrophobicContact CE1-CG 4.28Å
52	L	91.9	Very high	91.1	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-40.9	179.3	-65.1	-175.7	0	0	0	112.2	F47 D48 V49 A55 A56 L98 M146 A166	F47-L52 HydrophobicContact CB-CD1 3.64Å; F47-L52 HydrophobicContact CB-CD2 4.13Å; F47-L52 HydrophobicContact CB-CG 3.88Å; F47-L52 HydrophobicContact CD1-CD2 4.23Å; F47-L52 HydrophobicContact CG-CD1 4.19Å; F47-L52 HydrophobicContact CG-CD2 4.18Å; F47-L52 HydrophobicContact CG-CG 4.44Å; D48-L52 PolarHBondContact O-N 2.83Å; D48-L52 VanDerWaalsContact O-N 3.08Å; V49-L52 PolarHBondContact O-N 3.19Å; V49-L52 VanDerWaalsContact O-N 3.1Å; L52-A55 PolarHBondContact O-N 3.16Å; L52-A56 WeakPolarHBondContact O-CB 3.33Å; L52-A56 PolarHBondContact O-N 3.15Å; L52-L98 HydrophobicContact CB-CD2 3.42Å; L52-L98 VanDerWaalsContact CB-CD2 3.42Å; L52-L98 HydrophobicContact CD1-CD2 3.92Å; L52-L98 HydrophobicContact CG-CD2 4.33Å; L52-M146 HydrophobicContact CD2-CE 4.29Å; L52-M146 HydrophobicContact CD2-CG 4.04Å; L52-A166 HydrophobicContact CD1-CB 3.92Å; L52-A166 HydrophobicContact CD2-CB 3.59Å; L52-A166 HydrophobicContact CG-CB 4.43Å
53	T	91.8	Very high	90.5	Very high	51 Å²	51	60.4 Å²	60.4	31%	0.313	31%	0.314	S	S	.	.	H	α-helix	trans	-63.6	-45.8	177.9	-52.3	0	0	0	0	111.4	V49 Y51 A56 A57 L98	V49-T53 PolarHBondContact O-N 3.14Å; V49-T53 PolarHBondContact O-OG1 3.32Å; Y51-T53 VanDerWaalsContact C-N 3.31Å; Y51-T53 PolarHBondContact O-N 3Å; T53-A56 PolarHBondContact O-N 3.47Å; T53-A57 PolarHBondContact O-N 2.93Å; T53-A57 VanDerWaalsContact O-N 3.09Å; T53-L98 WeakPolarHBondContact CG2-O 3.47Å; T53-L98 PolarHBondContact OG1-O 2.97Å
54	K	93.1	Very high	89.8	Confident	144 Å²	144	61.1 Å²	61.1	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-64.3	-42.2	176.6	-71.9	168.8	-173	166.6	0	111.7	D50 Y51 A57 E58	D50-K54 WeakPolarHBondContact O-CD 3.5Å; D50-K54 VanDerWaalsContact O-CG 3.28Å; D50-K54 WeakPolarHBondContact O-CG 3.4Å; D50-K54 PolarHBondContact O-N 2.95Å; D50-K54 VanDerWaalsContact O-N 3.13Å; Y51-K54 PolarHBondContact O-N 3.49Å; K54-A57 PolarHBondContact O-N 2.84Å; K54-E58 PolarHBondContact O-N 2.86Å
55	A	92.4	Very high	89.3	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-43.5	178.3	0	0	0	0	0	112.4	Y51 L52 A57 E58 I59 V142 M146	Y51-A55 HydrophobicContact CE1-CB 4.44Å; Y51-A55 VanDerWaalsContact O-CB 3.28Å; Y51-A55 WeakPolarHBondContact O-CB 3.46Å; Y51-A55 PolarHBondContact O-N 2.88Å; L52-A55 PolarHBondContact O-N 3.16Å; A55-A57 PolarHBondContact O-N 3.36Å; A55-E58 PolarHBondContact O-N 3.33Å; A55-I59 WeakPolarHBondContact O-CD1 3.11Å; A55-I59 VanDerWaalsContact O-CG1 3.28Å; A55-I59 WeakPolarHBondContact O-CG1 3.38Å; A55-I59 PolarHBondContact O-N 3.4Å; A55-V142 HydrophobicContact CB-CB 4.42Å; A55-V142 HydrophobicContact CB-CG1 4.27Å; A55-V142 HydrophobicContact CB-CG2 3.31Å; A55-M146 HydrophobicContact CB-CE 4.25Å; A55-M146 HydrophobicContact CB-CG 4.34Å; A55-M146 HydrophobicContact CB-SD 3.44Å; A55-M146 WeakPolarHBondContact CB-SD 3.19Å
56	A	90.6	Very high	89	Confident	11 Å²	11	55.1 Å²	55.1	9%	0.091	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-45.1	174.8	0	0	0	0	0	111.6	L52 T53 I59 I60 L108	L52-A56 WeakPolarHBondContact O-CB 3.33Å; L52-A56 PolarHBondContact O-N 3.15Å; T53-A56 PolarHBondContact O-N 3.47Å; A56-I59 PolarHBondContact O-N 2.9Å; A56-I60 VanDerWaalsContact O-CG1 3.31Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.22Å; A56-L108 HydrophobicContact CB-CD2 3.89Å
57	A	89.6	Confident	88.3	Confident	56 Å²	56	61.2 Å²	61.2	46%	0.463	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-43.3	176.5	0	0	0	0	0	112.3	T53 K54 A55 I59 I60 E61	T53-A57 PolarHBondContact O-N 2.93Å; T53-A57 VanDerWaalsContact O-N 3.09Å; K54-A57 PolarHBondContact O-N 2.84Å; A55-A57 PolarHBondContact O-N 3.36Å; A57-I59 PolarHBondContact O-N 3.28Å; A57-I60 PolarHBondContact O-N 3.05Å; A57-E61 WeakPolarHBondContact O-CB 3.25Å; A57-E61 PolarHBondContact O-N 3.24Å
58	E	91.3	Very high	87.5	Confident	95 Å²	95	61 Å²	61	44%	0.444	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-45.9	175.9	-176	-171.1	140.7	0	0	111.6	K54 A55 E61 A62	K54-E58 PolarHBondContact O-N 2.86Å; A55-E58 PolarHBondContact O-N 3.33Å; E58-E61 PolarHBondContact O-N 3.14Å; E58-A62 VanDerWaalsContact O-CB 3.31Å; E58-A62 WeakPolarHBondContact O-CB 3.48Å; E58-A62 PolarHBondContact O-N 2.81Å
59	I	88.8	Confident	87.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-45.3	179	-66.1	159.2	0	0	0	110.6	A55 A56 A57 A62 T63 L108 H140 V142 L143 M146	A55-I59 WeakPolarHBondContact O-CD1 3.11Å; A55-I59 VanDerWaalsContact O-CG1 3.28Å; A55-I59 WeakPolarHBondContact O-CG1 3.38Å; A55-I59 PolarHBondContact O-N 3.4Å; A56-I59 PolarHBondContact O-N 2.9Å; A57-I59 PolarHBondContact O-N 3.28Å; I59-A62 PolarHBondContact O-N 2.66Å; I59-T63 VanDerWaalsContact O-CB 3.24Å; I59-T63 WeakPolarHBondContact O-CB 3.49Å; I59-T63 PolarHBondContact O-N 2.87Å; I59-T63 PolarHBondContact O-OG1 3.02Å; I59-L108 HydrophobicContact CB-CD1 4.01Å; I59-L108 HydrophobicContact CD1-CD1 4.32Å; I59-L108 HydrophobicContact CG2-CD1 3.62Å; I59-H140 HydrophobicContact CG1-CB 4.4Å; I59-V142 HydrophobicContact CD1-CG1 3.85Å; I59-V142 HydrophobicContact CG1-CG1 3.81Å; I59-L143 HydrophobicContact CD1-CD2 3.55Å; I59-L143 HydrophobicContact CD1-CG 4.32Å; I59-M146 HydrophobicContact CD1-CE 4.43Å; I59-M146 HydrophobicContact CD1-SD 4.01Å
60	I	86.1	Confident	86.7	Confident	7 Å²	7	62 Å²	62	4%	0.036	31%	0.313	C	S	.	.	H	α-helix	trans	-62.2	-48.6	178.9	-68.6	168.4	0	0	0	110.2	A56 A57 A62 T63 V64 D104 I107 L108	A56-I60 VanDerWaalsContact O-CG1 3.31Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.22Å; A57-I60 PolarHBondContact O-N 3.05Å; I60-A62 VanDerWaalsContact C-N 3.31Å; I60-A62 PolarHBondContact O-N 3.25Å; I60-T63 PolarHBondContact O-N 3.25Å; I60-V64 WeakPolarHBondContact O-CB 3.24Å; I60-V64 PolarHBondContact O-N 3.21Å; I60-D104 HydrophobicContact CD1-CB 3.7Å; I60-I107 HydrophobicContact CG1-CG2 4.46Å; I60-I107 HydrophobicContact CG2-CG2 4.49Å; I60-L108 HydrophobicContact CD1-CB 4.41Å; I60-L108 HydrophobicContact CG1-CB 4.46Å; I60-L108 HydrophobicContact CG1-CD1 4.41Å
61	E	87.3	Confident	86.1	Confident	116 Å²	116	59.4 Å²	59.4	54%	0.542	31%	0.306	S	S	.	.	H	α-helix	trans	-62.3	-37.7	-179	-176.7	170.9	-162.6	0	0	112.3	A57 E58 K66	A57-E61 WeakPolarHBondContact O-CB 3.25Å; A57-E61 PolarHBondContact O-N 3.24Å; E58-E61 PolarHBondContact O-N 3.14Å; E61-K66 WeakPolarHBondContact OE1-CE 3.41Å; E61-K66 IonicContact OE1-NZ 3.9Å; E61-K66 PolarHBondContact OE1-NZ 2.72Å
62	A	84.9	Confident	85.4	Confident	72 Å²	72	56.4 Å²	56.4	60%	0.595	30%	0.296	S	S	*	.	H	α-helix	trans	-78.2	-25.6	178.9	0	0	0	0	0	113.6	E58 I59 I60	E58-A62 VanDerWaalsContact O-CB 3.31Å; E58-A62 WeakPolarHBondContact O-CB 3.48Å; E58-A62 PolarHBondContact O-N 2.81Å; I59-A62 PolarHBondContact O-N 2.66Å; I60-A62 VanDerWaalsContact C-N 3.31Å; I60-A62 PolarHBondContact O-N 3.25Å
63	T	79.9	Confident	85.1	Confident	14 Å²	14	59 Å²	59	9%	0.086	31%	0.309	C	S	.	.	H	α-helix	trans	-96.6	-34.9	-176.8	-48.5	0	0	0	0	112.8	I59 I60 A111 T115	I59-T63 VanDerWaalsContact O-CB 3.24Å; I59-T63 WeakPolarHBondContact O-CB 3.49Å; I59-T63 PolarHBondContact O-N 2.87Å; I59-T63 PolarHBondContact O-OG1 3.02Å; I60-T63 PolarHBondContact O-N 3.25Å; T63-A111 HydrophobicContact CG2-CB 4.14Å; T63-T115 HydrophobicContact CG2-CG2 4.37Å
64	V	78.2	Confident	84.6	Confident	16 Å²	16	60.2 Å²	60.2	10%	0.097	32%	0.318	C	S	.	.	S	Bend	trans	-119.7	118.1	-171.4	-173.4	0	0	0	0	109.4	I60 K66 V68 H69 I107	I60-V64 WeakPolarHBondContact O-CB 3.24Å; I60-V64 PolarHBondContact O-N 3.21Å; V64-K66 PolarHBondContact O-N 3.28Å; V64-V68 HydrophobicContact CG1-CB 3.93Å; V64-V68 HydrophobicContact CG1-CG1 3.87Å; V64-H69 HydrophobicContact CG1-CB 3.99Å; V64-I107 HydrophobicContact CG2-CG2 3.92Å
65	P	81.6	Confident	83.9	Confident	41 Å²	41	58 Å²	58	27%	0.266	31%	0.312	S	S	.	.			trans	-57.7	141	175.7	-25.8	35.4	0	0	0	111.8	W67 V68 H69 W192	P65-W67 PolarHBondContact O-N 3.11Å; P65-W67 VanDerWaalsContact O-N 3.08Å; P65-V68 HydrophobicContact CB-CG2 4.35Å; P65-V68 WeakPolarHBondContact O-CA 3.16Å; P65-V68 WeakPolarHBondContact O-CB 3.25Å; P65-V68 PolarHBondContact O-N 3.06Å; P65-H69 PolarHBondContact O-N 2.86Å; P65-W192 HydrophobicContact CB-CH2 4.44Å; P65-W192 HydrophobicContact CG-CH2 3.38Å; P65-W192 HydrophobicContact CG-CZ2 3.15Å; P65-W192 HydrophobicContact CG-CZ3 4.24Å
66	K	84.6	Confident	83.3	Confident	128 Å²	128	58.1 Å²	58.1	56%	0.557	31%	0.312	S	S	*	.	H	α-helix	trans	-50.6	-40.5	-174.5	-67.1	-175.3	176.8	-178.8	0	114.2	E61 V64 V68 H69 H70	E61-K66 WeakPolarHBondContact OE1-CE 3.41Å; E61-K66 IonicContact OE1-NZ 3.9Å; E61-K66 PolarHBondContact OE1-NZ 2.72Å; V64-K66 PolarHBondContact O-N 3.28Å; K66-V68 VanDerWaalsContact C-N 3.35Å; K66-H69 PolarHBondContact O-N 3.22Å; K66-H70 PolarHBondContact O-N 2.88Å; K66-H70 PolarHBondContact O-ND1 3.46Å
67	W	79	Confident	82.8	Confident	187 Å²	187	64.6 Å²	64.6	71%	0.708	34%	0.338	S	S	*	.	H	α-helix	trans	-67.4	-35.6	178.7	72.3	-94.5	0	0	0	112.4	P65 A71	P65-W67 PolarHBondContact O-N 3.11Å; P65-W67 VanDerWaalsContact O-N 3.08Å; W67-A71 WeakPolarHBondContact O-CB 3.24Å; W67-A71 PolarHBondContact O-N 2.88Å; W67-A71 VanDerWaalsContact O-N 3.08Å
68	V	77.1	Confident	82.4	Confident	23 Å²	23	65.7 Å²	65.7	14%	0.139	34%	0.343	C	S	.	.	H	α-helix	trans	-70.7	-44.4	174.9	178.7	0	0	0	0	110.2	V64 P65 K66 H70 A71 A72 W192	V64-V68 HydrophobicContact CG1-CB 3.93Å; V64-V68 HydrophobicContact CG1-CG1 3.87Å; P65-V68 HydrophobicContact CB-CG2 4.35Å; P65-V68 WeakPolarHBondContact O-CA 3.16Å; P65-V68 WeakPolarHBondContact O-CB 3.25Å; P65-V68 PolarHBondContact O-N 3.06Å; K66-V68 VanDerWaalsContact C-N 3.35Å; V68-H70 VanDerWaalsContact C-N 3.33Å; V68-H70 PolarHBondContact O-N 3.43Å; V68-A71 PolarHBondContact O-N 3.43Å; V68-A71 VanDerWaalsContact O-N 3.16Å; V68-A72 WeakPolarHBondContact O-CB 3.43Å; V68-A72 PolarHBondContact O-N 2.91Å; V68-W192 HydrophobicContact CB-CH2 4.43Å; V68-W192 HydrophobicContact CB-CZ3 4.1Å; V68-W192 HydrophobicContact CG1-CZ3 3.9Å; V68-W192 HydrophobicContact CG2-CH2 3.62Å; V68-W192 HydrophobicContact CG2-CZ3 3.67Å
69	H	83.4	Confident	81.6	Confident	36 Å²	36	62.1 Å²	62.1	17%	0.167	33%	0.327	C	S	.	.	H	α-helix	trans	-54.3	-51.4	177.4	178.8	-146.4	0	0	0	110.7	V64 P65 K66 A71 A72 I73 D104	V64-H69 HydrophobicContact CG1-CB 3.99Å; P65-H69 PolarHBondContact O-N 2.86Å; K66-H69 PolarHBondContact O-N 3.22Å; H69-A71 PolarHBondContact O-N 2.96Å; H69-A72 PolarHBondContact O-N 3.26Å; H69-I73 WeakPolarHBondContact O-CG1 3.01Å; H69-I73 PolarHBondContact O-N 3Å; H69-D104 IonicContact CD2-OD1 2.71Å; H69-D104 IonicContact CE1-OD1 3.25Å; H69-D104 IonicContact NE2-OD1 3.79Å; H69-D104 PolarHBondContact NE2-OD1 3.32Å
70	H	84.4	Confident	81.4	Confident	130 Å²	130	63.6 Å²	63.6	60%	0.602	33%	0.333	S	S	*	.	H	α-helix	trans	-60.6	-42.3	175.6	-68.3	145.7	0	0	0	113.5	K66 V68 A72	K66-H70 PolarHBondContact O-N 2.88Å; K66-H70 PolarHBondContact O-ND1 3.46Å; V68-H70 VanDerWaalsContact C-N 3.33Å; V68-H70 PolarHBondContact O-N 3.43Å; H70-A72 VanDerWaalsContact C-N 3.34Å; H70-A72 PolarHBondContact O-N 3.1Å
71	A	79.9	Confident	81.2	Confident	50 Å²	50	70.1 Å²	70.1	41%	0.413	36%	0.361	S	S	.	.	H	α-helix	trans	-69.4	-30	179.3	0	0	0	0	0	113.1	W67 V68 H69 P74	W67-A71 WeakPolarHBondContact O-CB 3.24Å; W67-A71 PolarHBondContact O-N 2.88Å; W67-A71 VanDerWaalsContact O-N 3.08Å; V68-A71 PolarHBondContact O-N 3.43Å; V68-A71 VanDerWaalsContact O-N 3.16Å; H69-A71 PolarHBondContact O-N 2.96Å; A71-P74 WeakPolarHBondContact O-CD 3.25Å
72	A	78.3	Confident	80.9	Confident	7 Å²	7	69.7 Å²	69.7	6%	0.058	36%	0.356	C	S	.	.	H	α-helix	trans	-77.3	-30.4	-176.9	0	0	0	0	0	112.7	V68 H69 H70 I75 V76 I107 W195	V68-A72 WeakPolarHBondContact O-CB 3.43Å; V68-A72 PolarHBondContact O-N 2.91Å; H69-A72 PolarHBondContact O-N 3.26Å; H70-A72 VanDerWaalsContact C-N 3.34Å; H70-A72 PolarHBondContact O-N 3.1Å; A72-I75 PolarHBondContact O-N 3.24Å; A72-I75 VanDerWaalsContact O-N 3.07Å; A72-V76 HydrophobicContact CB-CG2 4.25Å; A72-V76 WeakPolarHBondContact O-CB 3.35Å; A72-V76 VanDerWaalsContact O-CG2 3.26Å; A72-V76 WeakPolarHBondContact O-CG2 3.48Å; A72-V76 PolarHBondContact O-N 3.17Å; A72-I107 HydrophobicContact CB-CD1 4.15Å; A72-W195 HydrophobicContact CB-CZ3 4.3Å
73	I	84.4	Confident	81	Confident	54 Å²	54	66.7 Å²	66.7	28%	0.277	33%	0.329	S	S	.	.	H	α-helix	trans	-46.4	-55.3	-177.5	-71.9	166.2	0	0	0	113.9	H69 I75 K77 S103	H69-I73 WeakPolarHBondContact O-CG1 3.01Å; H69-I73 PolarHBondContact O-N 3Å; I73-I75 VanDerWaalsContact C-N 3.34Å; I73-I75 PolarHBondContact O-N 3.35Å; I73-K77 WeakPolarHBondContact O-CB 3.13Å; I73-K77 PolarHBondContact O-N 3.15Å; I73-S103 PolarHBondContact O-OG 3.01Å; I73-S103 VanDerWaalsContact O-OG 3.07Å
74	P	82.3	Confident	81.4	Confident	76 Å²	76	68.8 Å²	68.8	49%	0.494	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-33	-178.2	26	-34.9	0	0	0	112.9	A71 S78	A71-P74 WeakPolarHBondContact O-CD 3.25Å; P74-S78 WeakPolarHBondContact O-CB 3.32Å; P74-S78 PolarHBondContact O-N 3.27Å; P74-S78 VanDerWaalsContact O-N 3.13Å; P74-S78 PolarHBondContact O-OG 2.98Å
75	I	76.7	Confident	82	Confident	98 Å²	98	73.4 Å²	73.4	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-67.9	-51.7	179.4	-59.4	172.8	0	0	0	109.2	A72 I73 K77 S78 L79	A72-I75 PolarHBondContact O-N 3.24Å; A72-I75 VanDerWaalsContact O-N 3.07Å; I73-I75 VanDerWaalsContact C-N 3.34Å; I73-I75 PolarHBondContact O-N 3.35Å; I75-K77 VanDerWaalsContact C-N 3.33Å; I75-K77 PolarHBondContact O-N 3.46Å; I75-S78 CarbonylContact O-C 3.52Å; I75-S78 WeakPolarHBondContact O-CA 3.33Å; I75-S78 WeakPolarHBondContact O-CB 3.35Å; I75-S78 PolarHBondContact O-N 2.91Å; I75-L79 HydrophobicContact CG2-CD1 3.76Å; I75-L79 HydrophobicContact CG2-CG 4.31Å; I75-L79 WeakPolarHBondContact O-CG 3.4Å; I75-L79 PolarHBondContact O-N 2.78Å
76	V	79.9	Confident	82.6	Confident	3 Å²	3	73 Å²	73	2%	0.018	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-44.5	-179.7	171.4	0	0	0	0	111.1	A72 S78 L79 E80 I106 I107 W195	A72-V76 HydrophobicContact CB-CG2 4.25Å; A72-V76 WeakPolarHBondContact O-CB 3.35Å; A72-V76 VanDerWaalsContact O-CG2 3.26Å; A72-V76 WeakPolarHBondContact O-CG2 3.48Å; A72-V76 PolarHBondContact O-N 3.17Å; V76-S78 PolarHBondContact O-N 3.47Å; V76-L79 PolarHBondContact O-N 2.92Å; V76-L79 VanDerWaalsContact O-N 3.09Å; V76-E80 PolarHBondContact O-N 3.49Å; V76-I106 HydrophobicContact CG1-CB 3.47Å; V76-I106 VanDerWaalsContact CG1-CB 3.47Å; V76-I106 HydrophobicContact CG1-CD1 3.55Å; V76-I106 HydrophobicContact CG1-CG1 4.09Å; V76-I106 HydrophobicContact CG1-CG2 3.5Å; V76-I107 HydrophobicContact CG2-CD1 4.45Å; V76-I107 HydrophobicContact CG2-CG1 4.08Å; V76-W195 HydrophobicContact CG2-CH2 3.63Å; V76-W195 HydrophobicContact CG2-CZ3 4.43Å
77	K	81.3	Confident	83.1	Confident	147 Å²	147	67 Å²	67	64%	0.639	35%	0.345	S	S	*	.	H	α-helix	trans	-59.5	-37.6	175.2	-170.7	177.9	-178.4	179.2	0	112.1	I73 I75	I73-K77 WeakPolarHBondContact O-CB 3.13Å; I73-K77 PolarHBondContact O-N 3.15Å; I75-K77 VanDerWaalsContact C-N 3.33Å; I75-K77 PolarHBondContact O-N 3.46Å
78	S	80.8	Confident	83.7	Confident	79 Å²	79	58.6 Å²	58.6	55%	0.552	32%	0.315	S	S	*	.	H	α-helix	trans	-74.7	-26.8	177.5	-57.2	0	0	0	0	113.1	P74 I75 V76	P74-S78 WeakPolarHBondContact O-CB 3.32Å; P74-S78 PolarHBondContact O-N 3.27Å; P74-S78 VanDerWaalsContact O-N 3.13Å; P74-S78 PolarHBondContact O-OG 2.98Å; I75-S78 CarbonylContact O-C 3.52Å; I75-S78 WeakPolarHBondContact O-CA 3.33Å; I75-S78 WeakPolarHBondContact O-CB 3.35Å; I75-S78 PolarHBondContact O-N 2.91Å; V76-S78 PolarHBondContact O-N 3.47Å
79	L	75.5	Confident	84.6	Confident	21 Å²	21	57.7 Å²	57.7	11%	0.11	31%	0.31	C	S	.	.	H	α-helix	trans	-86.2	-16	-179.6	-70.2	177	0	0	0	113.6	I75 V76 K81 Y82 V199 F203	I75-L79 HydrophobicContact CG2-CD1 3.76Å; I75-L79 HydrophobicContact CG2-CG 4.31Å; I75-L79 WeakPolarHBondContact O-CG 3.4Å; I75-L79 PolarHBondContact O-N 2.78Å; V76-L79 PolarHBondContact O-N 2.92Å; V76-L79 VanDerWaalsContact O-N 3.09Å; L79-K81 PolarHBondContact O-N 3.16Å; L79-Y82 HydrophobicContact CD2-CD2 3.89Å; L79-Y82 HydrophobicContact CD2-CE2 4.19Å; L79-Y82 WeakPolarHBondContact O-CB 3.38Å; L79-Y82 PolarHBondContact O-N 3.08Å; L79-V199 HydrophobicContact CD1-CG1 3.44Å; L79-V199 VanDerWaalsContact CD1-CG1 3.44Å; L79-F203 HydrophobicContact CB-CD2 3.94Å; L79-F203 HydrophobicContact CB-CE2 4.33Å; L79-F203 HydrophobicContact CD1-CD2 4.13Å; L79-F203 HydrophobicContact CD2-CB 4.43Å; L79-F203 HydrophobicContact CG-CD2 4.45Å
80	E	83	Confident	85.3	Confident	30 Å²	30	56 Å²	56	14%	0.14	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-53.5	-38.3	-179.3	176.2	-104	-161.5	0	0	113.4	V76 Y82 I83 R92 L102 I106	V76-E80 PolarHBondContact O-N 3.49Å; E80-Y82 PolarHBondContact O-N 3.31Å; E80-I83 HydrophobicContact CB-CD1 4.43Å; E80-I83 HydrophobicContact CG-CD1 4.33Å; E80-I83 WeakPolarHBondContact O-CB 3.48Å; E80-I83 PolarHBondContact O-N 3.04Å; E80-R92 IonicContact OE1-CZ 3.14Å; E80-R92 IonicContact OE1-NE 3.96Å; E80-R92 PolarHBondContact OE1-NE 3.41Å; E80-R92 IonicContact OE1-NH2 3.1Å; E80-R92 PolarHBondContact OE1-NH2 3.07Å; E80-R92 IonicContact OE2-NH2 2.71Å; E80-L102 HydrophobicContact CG-CD2 3.85Å; E80-L102 HydrophobicContact CG-CG 4.47Å; E80-I106 HydrophobicContact CB-CD1 3.84Å; E80-I106 HydrophobicContact CG-CD1 4.04Å
81	K	82.6	Confident	85.8	Confident	144 Å²	144	49.8 Å²	49.8	63%	0.626	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-61.7	-15.6	175.7	68.8	-179.7	-179.9	172.1	0	115	L79	L79-K81 PolarHBondContact O-N 3.16Å
82	Y	81.5	Confident	86.5	Confident	107 Å²	107	51.8 Å²	51.8	42%	0.42	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-98.9	-4.2	176.8	-58.2	-70	0	0	0	112.5	L79 E80 P84 F203	L79-Y82 HydrophobicContact CD2-CD2 3.89Å; L79-Y82 HydrophobicContact CD2-CE2 4.19Å; L79-Y82 WeakPolarHBondContact O-CB 3.38Å; L79-Y82 PolarHBondContact O-N 3.08Å; E80-Y82 PolarHBondContact O-N 3.31Å; Y82-P84 WeakPolarHBondContact O-CD 3.44Å; Y82-F203 HydrophobicContact CG-CB 4.42Å; Y82-F203 WeakPolarHBondContact O-CD1 3.25Å
83	I	86.5	Confident	87.3	Confident	9 Å²	9	51.7 Å²	51.7	5%	0.046	27%	0.27	C	S	.	.	S	Bend	trans	-66.4	123.7	169.4	-62.8	168.5	0	0	0	107.7	E80 A88 I91 I106 F203 W212	E80-I83 HydrophobicContact CB-CD1 4.43Å; E80-I83 HydrophobicContact CG-CD1 4.33Å; E80-I83 WeakPolarHBondContact O-CB 3.48Å; E80-I83 PolarHBondContact O-N 3.04Å; I83-A88 HydrophobicContact CB-CB 3.87Å; I83-A88 HydrophobicContact CG2-CB 3.82Å; I83-A88 VanDerWaalsContact CG2-N 3.32Å; I83-A88 WeakPolarHBondContact O-CB 3.42Å; I83-I91 HydrophobicContact CD1-CD1 4.23Å; I83-I91 HydrophobicContact CG2-CD1 4.41Å; I83-I106 HydrophobicContact CD1-CD1 3.78Å; I83-I106 HydrophobicContact CD1-CG1 3.85Å; I83-I106 HydrophobicContact CD1-CG2 4.34Å; I83-F203 HydrophobicContact CB-CE1 3.98Å; I83-F203 HydrophobicContact CB-CZ 4.48Å; I83-F203 HydrophobicContact CD1-CE1 4.48Å; I83-F203 HydrophobicContact CD1-CZ 4.13Å; I83-F203 HydrophobicContact CG1-CD1 4.22Å; I83-F203 HydrophobicContact CG1-CE1 3.26Å; I83-F203 HydrophobicContact CG1-CE2 4.36Å; I83-F203 HydrophobicContact CG1-CZ 3.32Å; I83-W212 HydrophobicContact CG2-CH2 3.77Å; I83-W212 HydrophobicContact CG2-CZ3 3.99Å
84	P	88.8	Confident	87.7	Confident	58 Å²	58	49.1 Å²	49.1	38%	0.377	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-66.3	148.2	179.4	25.7	-33.3	0	0	0	111.4	Y82 Y87 A88 W212	Y82-P84 WeakPolarHBondContact O-CD 3.44Å; P84-Y87 HydrophobicContact CG-CD2 4.27Å; P84-Y87 WeakPolarHBondContact O-CB 3.49Å; P84-Y87 PolarHBondContact O-N 2.96Å; P84-A88 PolarHBondContact O-N 3.47Å; P84-W212 HydrophobicContact CG-CZ3 4.3Å
85	P	90.6	Very high	88.2	Confident	113 Å²	113	45.9 Å²	45.9	73%	0.734	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	149.2	163.8	29.5	-33.6	0	0	0	110
86	P	94.8	Very high	88.9	Confident	33 Å²	33	45.3 Å²	45.3	21%	0.214	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	cis	-82.8	-7.2	0.5	33.9	-35.4	0	0	0	113.9	P36 R39 A88 G89 E90	P36-P86 HydrophobicContact CB-CB 4.15Å; P36-P86 WeakPolarHBondContact CB-O 3.48Å; P36-P86 HydrophobicContact CG-CB 3.85Å; R39-P86 VanDerWaalsContact NH1-CB 3.33Å; P86-A88 VanDerWaalsContact C-N 3.31Å; P86-A88 PolarHBondContact O-N 3.26Å; P86-G89 PolarHBondContact O-N 3.43Å; P86-E90 PolarHBondContact O-N 3.21Å
87	Y	94.4	Very high	89.4	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.012	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-36.5	-169.1	-57.9	-71.4	0	0	0	114.2	P84 G89 E90 I91 V169 W212 E216	P84-Y87 HydrophobicContact CG-CD2 4.27Å; P84-Y87 WeakPolarHBondContact O-CB 3.49Å; P84-Y87 PolarHBondContact O-N 2.96Å; Y87-G89 PolarHBondContact O-N 3.11Å; Y87-E90 PolarHBondContact O-N 3.18Å; Y87-I91 WeakPolarHBondContact O-CB 3.43Å; Y87-I91 WeakPolarHBondContact O-CD1 3.18Å; Y87-I91 WeakPolarHBondContact O-CG1 3.46Å; Y87-I91 PolarHBondContact O-N 3.38Å; Y87-V169 HydrophobicContact CD1-CB 4.22Å; Y87-V169 HydrophobicContact CD1-CG2 3.6Å; Y87-V169 HydrophobicContact CE1-CG2 4.3Å; Y87-W212 AromaticContact CD1-CD2 3.89Å; Y87-W212 HydrophobicContact CD1-CD2 3.89Å; Y87-W212 HydrophobicContact CD1-CE3 4.17Å; Y87-W212 HydrophobicContact CD1-CG 4.2Å; Y87-W212 HydrophobicContact CD2-CD2 4.05Å; Y87-W212 AromaticContact CD2-CE3 3.52Å; Y87-W212 HydrophobicContact CD2-CE3 3.52Å; Y87-W212 AromaticContact CD2-CZ3 3.94Å; Y87-W212 HydrophobicContact CD2-CZ3 3.94Å; Y87-W212 HydrophobicContact CE1-CB 4.18Å; Y87-W212 HydrophobicContact CE1-CD2 4.05Å; Y87-W212 HydrophobicContact CE1-CE3 4.49Å; Y87-W212 AromaticContact CE1-CG 3.89Å; Y87-W212 HydrophobicContact CE1-CG 3.89Å; Y87-W212 HydrophobicContact CE2-CB 4.2Å; Y87-W212 HydrophobicContact CE2-CD2 4.22Å; Y87-W212 AromaticContact CE2-CE3 3.91Å; Y87-W212 HydrophobicContact CE2-CE3 3.91Å; Y87-W212 HydrophobicContact CE2-CG 4.36Å; Y87-W212 AromaticContact CG-CD2 3.87Å; Y87-W212 HydrophobicContact CG-CD2 3.87Å; Y87-W212 AromaticContact CG-CE3 3.65Å; Y87-W212 HydrophobicContact CG-CE3 3.65Å; Y87-W212 HydrophobicContact CG-CH2 4.28Å; Y87-W212 HydrophobicContact CG-CZ2 4.44Å; Y87-W212 AromaticContact CG-CZ3 3.87Å; Y87-W212 HydrophobicContact CG-CZ3 3.87Å; Y87-W212 AromaticContact CZ-CG 3.97Å; Y87-W212 PolarHBondContact OH-O 3.27Å; Y87-E216 HydrophobicContact CE2-CG 4.38Å; Y87-E216 WeakPolarHBondContact CE2-OE1 3.46Å; Y87-E216 VanDerWaalsContact OH-CG 3.27Å; Y87-E216 WeakPolarHBondContact OH-CG 3.36Å
88	A	92.6	Very high	89.6	Confident	9 Å²	9	39 Å²	39	7%	0.074	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-49.9	177.7	0	0	0	0	0	111.7	I83 P84 P86 I91 R92	I83-A88 HydrophobicContact CB-CB 3.87Å; I83-A88 HydrophobicContact CG2-CB 3.82Å; I83-A88 VanDerWaalsContact CG2-N 3.32Å; I83-A88 WeakPolarHBondContact O-CB 3.42Å; P84-A88 PolarHBondContact O-N 3.47Å; P86-A88 VanDerWaalsContact C-N 3.31Å; P86-A88 PolarHBondContact O-N 3.26Å; A88-I91 PolarHBondContact O-N 2.86Å; A88-R92 WeakPolarHBondContact O-CG 3.27Å; A88-R92 PolarHBondContact O-N 3.4Å; A88-R92 VanDerWaalsContact O-N 3.1Å
89	G	95.6	Very high	89.6	Confident	4 Å²	4	38.5 Å²	38.5	4%	0.041	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-40.2	179.5	0	0	0	0	0	112.1	E37 P86 Y87 I91 R92 G93	E37-G89 WeakPolarHBondContact CA-O 3.35Å; E37-G89 WeakPolarHBondContact OE1-CA 3.49Å; P86-G89 PolarHBondContact O-N 3.43Å; Y87-G89 PolarHBondContact O-N 3.11Å; G89-I91 PolarHBondContact O-N 3.44Å; G89-R92 WeakPolarHBondContact O-CB 3.39Å; G89-R92 PolarHBondContact O-N 2.72Å; G89-G93 PolarHBondContact O-N 3.06Å
90	E	96.9	Very high	89.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-40.3	175.8	-74.6	-171	-163.8	0	0	113.2	P36 R39 W40 P86 Y87 G93 L94 V169 R215	P36-E90 HydrophobicContact CB-CG 3.93Å; P36-E90 WeakPolarHBondContact O-CA 3.13Å; P36-E90 WeakPolarHBondContact O-CG 3.33Å; R39-E90 VanDerWaalsContact CD-OE1 3.3Å; R39-E90 WeakPolarHBondContact CD-OE1 3.46Å; R39-E90 IonicContact CZ-OE1 2.84Å; R39-E90 IonicContact NE-OE1 3.81Å; R39-E90 IonicContact NH1-OE1 2.74Å; R39-E90 PolarHBondContact NH1-OE1 2.89Å; W40-E90 PolarHBondContact NE1-OE2 2.81Å; P86-E90 PolarHBondContact O-N 3.21Å; Y87-E90 PolarHBondContact O-N 3.18Å; E90-G93 PolarHBondContact O-N 2.83Å; E90-L94 WeakPolarHBondContact O-CG 3.46Å; E90-L94 PolarHBondContact O-N 3.47Å; E90-V169 HydrophobicContact CB-CG1 3.87Å; E90-R215 VanDerWaalsContact CD-NH2 3.31Å; E90-R215 IonicContact OE1-CZ 3.34Å; E90-R215 IonicContact OE1-NH1 2.66Å; E90-R215 IonicContact OE1-NH2 3.14Å; E90-R215 PolarHBondContact OE1-NH2 2.76Å; E90-R215 IonicContact OE2-CZ 3.32Å; E90-R215 IonicContact OE2-NH1 2.72Å; E90-R215 PolarHBondContact OE2-NH1 2.94Å; E90-R215 IonicContact OE2-NH2 3.65Å; E90-R215 PolarHBondContact OE2-NH2 2.89Å; E90-R215 VanDerWaalsContact OE2-NH2 3.14Å
91	I	95.1	Very high	89.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-37.7	176.3	-67.8	166.2	0	0	0	110.9	I83 Y87 A88 G89 L94 A95 L102 A105 I106 V169 W212	I83-I91 HydrophobicContact CD1-CD1 4.23Å; I83-I91 HydrophobicContact CG2-CD1 4.41Å; Y87-I91 WeakPolarHBondContact O-CB 3.43Å; Y87-I91 WeakPolarHBondContact O-CD1 3.18Å; Y87-I91 WeakPolarHBondContact O-CG1 3.46Å; Y87-I91 PolarHBondContact O-N 3.38Å; A88-I91 PolarHBondContact O-N 2.86Å; G89-I91 PolarHBondContact O-N 3.44Å; I91-L94 PolarHBondContact O-N 3.07Å; I91-A95 WeakPolarHBondContact O-CB 3.43Å; I91-A95 PolarHBondContact O-N 2.67Å; I91-L102 HydrophobicContact CG2-CD1 3.93Å; I91-A105 HydrophobicContact CG2-CB 3.86Å; I91-I106 HydrophobicContact CG2-CG1 3.66Å; I91-V169 HydrophobicContact CD1-CG2 4.37Å; I91-V169 HydrophobicContact CG1-CG1 3.89Å; I91-V169 HydrophobicContact CG1-CG2 4.18Å; I91-W212 HydrophobicContact CD1-CH2 4.16Å; I91-W212 HydrophobicContact CD1-CZ2 3.96Å
92	R	94.6	Very high	90.1	Very high	93 Å²	93	36.7 Å²	36.7	35%	0.351	23%	0.229	S	C	.	.	H	α-helix	trans	-61.5	-44.7	170.7	-68.8	175.5	-164.7	125.6	6.1	111.9	E37 E80 A88 G89 A95 S96 L102	E37-R92 HydrophobicContact CG-CB 4.34Å; E37-R92 IonicContact OE1-NH1 3.4Å; E37-R92 PolarHBondContact OE1-NH1 3.24Å; E37-R92 VanDerWaalsContact OE1-NH1 3.14Å; E80-R92 IonicContact OE1-CZ 3.14Å; E80-R92 IonicContact OE1-NE 3.96Å; E80-R92 PolarHBondContact OE1-NE 3.41Å; E80-R92 IonicContact OE1-NH2 3.1Å; E80-R92 PolarHBondContact OE1-NH2 3.07Å; E80-R92 IonicContact OE2-NH2 2.71Å; A88-R92 WeakPolarHBondContact O-CG 3.27Å; A88-R92 PolarHBondContact O-N 3.4Å; A88-R92 VanDerWaalsContact O-N 3.1Å; G89-R92 WeakPolarHBondContact O-CB 3.39Å; G89-R92 PolarHBondContact O-N 2.72Å; R92-A95 PolarHBondContact O-N 2.84Å; R92-S96 PolarHBondContact O-N 2.86Å; R92-L102 HydrophobicContact CG-CD1 3.95Å; R92-L102 HydrophobicContact CG-CD2 4.27Å
93	G	94.8	Very high	90.4	Very high	5 Å²	5	31.9 Å²	31.9	5%	0.052	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-47.6	176.2	0	0	0	0	0	111.9	E37 G89 E90 S96 V97	E37-G93 WeakPolarHBondContact O-CA 3.42Å; G89-G93 PolarHBondContact O-N 3.06Å; E90-G93 PolarHBondContact O-N 2.83Å; G93-S96 WeakPolarHBondContact O-CB 3.37Å; G93-S96 PolarHBondContact O-N 3.15Å; G93-V97 WeakPolarHBondContact O-CG2 3.43Å; G93-V97 PolarHBondContact O-N 3.45Å
94	L	94	Very high	90.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.6	-43.8	175.1	-76.3	173.2	0	0	0	112.7	W40 L43 E90 I91 S96 V97 L98 V169	W40-L94 HydrophobicContact CB-CD2 3.52Å; W40-L94 HydrophobicContact CB-CG 3.93Å; W40-L94 HydrophobicContact CD2-CD1 4.42Å; W40-L94 HydrophobicContact CD2-CD2 3.91Å; W40-L94 HydrophobicContact CD2-CG 4.22Å; W40-L94 HydrophobicContact CE3-CD2 4.19Å; W40-L94 HydrophobicContact CG-CD1 4.37Å; W40-L94 HydrophobicContact CG-CD2 3.64Å; W40-L94 HydrophobicContact CG-CG 3.75Å; L43-L94 HydrophobicContact CD1-CD2 3.48Å; L43-L94 VanDerWaalsContact CD1-CD2 3.48Å; E90-L94 WeakPolarHBondContact O-CG 3.46Å; E90-L94 PolarHBondContact O-N 3.47Å; I91-L94 PolarHBondContact O-N 3.07Å; L94-S96 VanDerWaalsContact C-N 3.26Å; L94-S96 PolarHBondContact O-N 2.9Å; L94-V97 PolarHBondContact O-N 2.81Å; L94-V97 VanDerWaalsContact O-N 3.1Å; L94-L98 WeakPolarHBondContact O-CB 3.26Å; L94-L98 VanDerWaalsContact O-CG 3.31Å; L94-L98 WeakPolarHBondContact O-CG 3.37Å; L94-L98 PolarHBondContact O-N 2.98Å; L94-V169 HydrophobicContact CD1-CG1 3.39Å
95	A	92.7	Very high	90.5	Very high	8 Å²	8	30.8 Å²	30.8	7%	0.066	20%	0.203	C	C	.	.	H	α-helix	trans	-57.7	-42	175.9	0	0	0	0	0	111.4	I91 R92 L98 G99 G100 L102 A105	I91-A95 WeakPolarHBondContact O-CB 3.43Å; I91-A95 PolarHBondContact O-N 2.67Å; R92-A95 PolarHBondContact O-N 2.84Å; A95-L98 PolarHBondContact O-N 3.19Å; A95-G99 PolarHBondContact O-N 3.11Å; A95-G100 PolarHBondContact O-N 3.43Å; A95-G100 VanDerWaalsContact O-N 3.15Å; A95-L102 HydrophobicContact CB-CD1 4.33Å; A95-A105 HydrophobicContact CB-CB 3.87Å
96	S	91.7	Very high	90.4	Very high	85 Å²	85	25.6 Å²	25.6	59%	0.594	17%	0.169	S	C	*	.	H	α-helix	trans	-65.5	-38.4	174.6	-176.8	0	0	0	0	112.9	R92 G93 L94 G99	R92-S96 PolarHBondContact O-N 2.86Å; G93-S96 WeakPolarHBondContact O-CB 3.37Å; G93-S96 PolarHBondContact O-N 3.15Å; L94-S96 VanDerWaalsContact C-N 3.26Å; L94-S96 PolarHBondContact O-N 2.9Å; S96-G99 PolarHBondContact O-N 2.99Å
97	V	89.7	Confident	90	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.024	16%	0.159	C	C	.	.	H	α-helix	trans	-63.8	-45.1	176.4	167.2	0	0	0	0	111.4	L41 L43 K44 V49 G93 L94 G99	L41-V97 HydrophobicContact CD2-CG2 4.04Å; L43-V97 HydrophobicContact CB-CG1 4.2Å; K44-V97 HydrophobicContact CG-CG1 3.91Å; V49-V97 WeakPolarHBondContact CG1-O 3.46Å; G93-V97 WeakPolarHBondContact O-CG2 3.43Å; G93-V97 PolarHBondContact O-N 3.45Å; L94-V97 PolarHBondContact O-N 2.81Å; L94-V97 VanDerWaalsContact O-N 3.1Å; V97-G99 VanDerWaalsContact C-N 3.26Å; V97-G99 PolarHBondContact O-N 2.85Å
98	L	86.1	Confident	89.7	Confident	13 Å²	13	24 Å²	24	7%	0.068	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-4.7	-176.4	-62.4	174.6	0	0	0	113.4	L52 T53 L94 A95 G100	L52-L98 HydrophobicContact CB-CD2 3.42Å; L52-L98 VanDerWaalsContact CB-CD2 3.42Å; L52-L98 HydrophobicContact CD1-CD2 3.92Å; L52-L98 HydrophobicContact CG-CD2 4.33Å; T53-L98 WeakPolarHBondContact CG2-O 3.47Å; T53-L98 PolarHBondContact OG1-O 2.97Å; L94-L98 WeakPolarHBondContact O-CB 3.26Å; L94-L98 VanDerWaalsContact O-CG 3.31Å; L94-L98 WeakPolarHBondContact O-CG 3.37Å; L94-L98 PolarHBondContact O-N 2.98Å; A95-L98 PolarHBondContact O-N 3.19Å; L98-G100 PolarHBondContact O-N 2.97Å; L98-G100 VanDerWaalsContact O-N 3.09Å
99	G	80.6	Confident	89.4	Confident	70 Å²	70	23.6 Å²	23.6	72%	0.722	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	17.6	-173.4	0	0	0	0	0	113.6	A95 S96 V97	A95-G99 PolarHBondContact O-N 3.11Å; S96-G99 PolarHBondContact O-N 2.99Å; V97-G99 VanDerWaalsContact C-N 3.26Å; V97-G99 PolarHBondContact O-N 2.85Å
100	G	77	Confident	88.8	Confident	37 Å²	37	23.5 Å²	23.5	38%	0.381	15%	0.154	S	C	.	.			trans	-98.2	172.9	-175	0	0	0	0	0	112.6	A95 L98	A95-G100 PolarHBondContact O-N 3.43Å; A95-G100 VanDerWaalsContact O-N 3.15Å; L98-G100 PolarHBondContact O-N 2.97Å; L98-G100 VanDerWaalsContact O-N 3.09Å
101	N	85.6	Confident	87.9	Confident	71 Å²	71	23.7 Å²	23.7	38%	0.38	16%	0.156	S	C	.	.			trans	-79.4	150.1	173.4	76.5	59.2	0	0	0	110.8	S103 D104 A105	N101-S103 VanDerWaalsContact C-N 3.26Å; N101-S103 PolarHBondContact O-N 3.26Å; N101-S103 WeakPolarHBondContact OD1-CA 3.37Å; N101-S103 WeakPolarHBondContact OD1-CB 3.39Å; N101-S103 PolarHBondContact OD1-N 2.92Å; N101-S103 VanDerWaalsContact OD1-N 3.08Å; N101-D104 VanDerWaalsContact CG-CG 3.49Å; N101-D104 PolarHBondContact ND2-OD1 3.48Å; N101-D104 PolarHBondContact ND2-OD2 3.41Å; N101-D104 PolarHBondContact O-N 3.11Å; N101-D104 WeakPolarHBondContact OD1-CB 3.19Å; N101-D104 VanDerWaalsContact OD1-CG 3.22Å; N101-D104 PolarHBondContact OD1-N 2.94Å; N101-D104 PolarHBondContact OD1-OD1 2.95Å; N101-A105 PolarHBondContact O-N 2.91Å
102	L	88.5	Confident	87.1	Confident	48 Å²	48	23.8 Å²	23.8	25%	0.251	16%	0.156	S	C	.	.	H	α-helix	trans	-60.5	-34.5	-178.8	178.9	57.7	0	0	0	112.9	E80 I91 R92 A95 D104 A105 I106	E80-L102 HydrophobicContact CG-CD2 3.85Å; E80-L102 HydrophobicContact CG-CG 4.47Å; I91-L102 HydrophobicContact CG2-CD1 3.93Å; R92-L102 HydrophobicContact CG-CD1 3.95Å; R92-L102 HydrophobicContact CG-CD2 4.27Å; A95-L102 HydrophobicContact CB-CD1 4.33Å; L102-D104 VanDerWaalsContact C-N 3.34Å; L102-D104 PolarHBondContact O-N 3.11Å; L102-A105 PolarHBondContact O-N 2.68Å; L102-I106 HydrophobicContact CD1-CD1 4.25Å; L102-I106 HydrophobicContact CD1-CG1 4.4Å; L102-I106 HydrophobicContact CG-CD1 4.04Å; L102-I106 WeakPolarHBondContact O-CG1 3.12Å; L102-I106 PolarHBondContact O-N 3.07Å
103	S	87.6	Confident	86.4	Confident	6 Å²	6	19.4 Å²	19.4	4%	0.042	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-40.3	179.6	-61.9	0	0	0	0	111.7	I73 N101 I106 I107	I73-S103 PolarHBondContact O-OG 3.01Å; I73-S103 VanDerWaalsContact O-OG 3.07Å; N101-S103 VanDerWaalsContact C-N 3.26Å; N101-S103 PolarHBondContact O-N 3.26Å; N101-S103 WeakPolarHBondContact OD1-CA 3.37Å; N101-S103 WeakPolarHBondContact OD1-CB 3.39Å; N101-S103 PolarHBondContact OD1-N 2.92Å; N101-S103 VanDerWaalsContact OD1-N 3.08Å; S103-I106 PolarHBondContact O-N 3.39Å; S103-I107 WeakPolarHBondContact O-CB 3.26Å; S103-I107 WeakPolarHBondContact O-CG1 3.46Å; S103-I107 PolarHBondContact O-N 2.67Å
104	D	88.5	Confident	85.1	Confident	38 Å²	38	20 Å²	20	20%	0.203	14%	0.141	C	C	.	.	H	α-helix	trans	-66.7	-40.8	177.3	-70	-6.5	0	0	0	111.1	I60 H69 N101 L102 I106 I107 L108	I60-D104 HydrophobicContact CD1-CB 3.7Å; H69-D104 IonicContact CD2-OD1 2.71Å; H69-D104 IonicContact CE1-OD1 3.25Å; H69-D104 IonicContact NE2-OD1 3.79Å; H69-D104 PolarHBondContact NE2-OD1 3.32Å; N101-D104 VanDerWaalsContact CG-CG 3.49Å; N101-D104 PolarHBondContact ND2-OD1 3.48Å; N101-D104 PolarHBondContact ND2-OD2 3.41Å; N101-D104 PolarHBondContact O-N 3.11Å; N101-D104 WeakPolarHBondContact OD1-CB 3.19Å; N101-D104 VanDerWaalsContact OD1-CG 3.22Å; N101-D104 PolarHBondContact OD1-N 2.94Å; N101-D104 PolarHBondContact OD1-OD1 2.95Å; L102-D104 VanDerWaalsContact C-N 3.34Å; L102-D104 PolarHBondContact O-N 3.11Å; D104-I106 VanDerWaalsContact C-N 3.33Å; D104-I106 PolarHBondContact O-N 2.91Å; D104-I107 PolarHBondContact O-N 3.27Å; D104-L108 VanDerWaalsContact O-CB 3.22Å; D104-L108 WeakPolarHBondContact O-CB 3.03Å; D104-L108 PolarHBondContact O-N 3.44Å
105	A	90.1	Very high	83.5	Confident	7 Å²	7	21.6 Å²	21.6	6%	0.058	15%	0.151	C	C	.	.	H	α-helix	trans	-61.2	-42.3	174.9	0	0	0	0	0	111.7	I91 A95 N101 L102 N109	I91-A105 HydrophobicContact CG2-CB 3.86Å; A95-A105 HydrophobicContact CB-CB 3.87Å; N101-A105 PolarHBondContact O-N 2.91Å; L102-A105 PolarHBondContact O-N 2.68Å; A105-N109 PolarHBondContact O-N 3.35Å; A105-N109 VanDerWaalsContact O-N 3.08Å; A105-N109 PolarHBondContact O-ND2 2.96Å
106	I	88.6	Confident	82.3	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.015	15%	0.149	C	C	.	.	H	α-helix	trans	-66.7	-47.4	175.2	-64	163.7	0	0	0	110.7	V76 E80 I83 I91 L102 S103 D104 L108 N109 F110	V76-I106 HydrophobicContact CG1-CB 3.47Å; V76-I106 VanDerWaalsContact CG1-CB 3.47Å; V76-I106 HydrophobicContact CG1-CD1 3.55Å; V76-I106 HydrophobicContact CG1-CG1 4.09Å; V76-I106 HydrophobicContact CG1-CG2 3.5Å; E80-I106 HydrophobicContact CB-CD1 3.84Å; E80-I106 HydrophobicContact CG-CD1 4.04Å; I83-I106 HydrophobicContact CD1-CD1 3.78Å; I83-I106 HydrophobicContact CD1-CG1 3.85Å; I83-I106 HydrophobicContact CD1-CG2 4.34Å; I91-I106 HydrophobicContact CG2-CG1 3.66Å; L102-I106 HydrophobicContact CD1-CD1 4.25Å; L102-I106 HydrophobicContact CD1-CG1 4.4Å; L102-I106 HydrophobicContact CG-CD1 4.04Å; L102-I106 WeakPolarHBondContact O-CG1 3.12Å; L102-I106 PolarHBondContact O-N 3.07Å; S103-I106 PolarHBondContact O-N 3.39Å; D104-I106 VanDerWaalsContact C-N 3.33Å; D104-I106 PolarHBondContact O-N 2.91Å; I106-L108 VanDerWaalsContact C-N 3.3Å; I106-L108 PolarHBondContact O-N 2.93Å; I106-N109 PolarHBondContact O-N 3.09Å; I106-F110 HydrophobicContact CG2-CD2 3.96Å; I106-F110 HydrophobicContact CG2-CE2 4.06Å; I106-F110 WeakPolarHBondContact O-CD2 3.3Å; I106-F110 PolarHBondContact O-N 3.01Å
107	I	86.1	Confident	81.7	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-57.1	-46.6	179.2	-72.5	166.9	0	0	0	110.5	I60 V64 A72 V76 S103 D104 N109 F110 A111 W195	I60-I107 HydrophobicContact CG1-CG2 4.46Å; I60-I107 HydrophobicContact CG2-CG2 4.49Å; V64-I107 HydrophobicContact CG2-CG2 3.92Å; A72-I107 HydrophobicContact CB-CD1 4.15Å; V76-I107 HydrophobicContact CG2-CD1 4.45Å; V76-I107 HydrophobicContact CG2-CG1 4.08Å; S103-I107 WeakPolarHBondContact O-CB 3.26Å; S103-I107 WeakPolarHBondContact O-CG1 3.46Å; S103-I107 PolarHBondContact O-N 2.67Å; D104-I107 PolarHBondContact O-N 3.27Å; I107-N109 PolarHBondContact O-N 2.89Å; I107-F110 PolarHBondContact O-N 2.93Å; I107-A111 WeakPolarHBondContact O-CB 3.27Å; I107-A111 PolarHBondContact O-N 3.4Å; I107-W195 HydrophobicContact CG1-CH2 4.02Å; I107-W195 HydrophobicContact CG1-CZ2 4.11Å
108	L	86.7	Confident	81.8	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-59.4	-46	177.7	-176.3	65.1	0	0	0	111.3	A56 I59 I60 D104 I106 F110 A111 Y112	A56-L108 HydrophobicContact CB-CD2 3.89Å; I59-L108 HydrophobicContact CB-CD1 4.01Å; I59-L108 HydrophobicContact CD1-CD1 4.32Å; I59-L108 HydrophobicContact CG2-CD1 3.62Å; I60-L108 HydrophobicContact CD1-CB 4.41Å; I60-L108 HydrophobicContact CG1-CB 4.46Å; I60-L108 HydrophobicContact CG1-CD1 4.41Å; D104-L108 VanDerWaalsContact O-CB 3.22Å; D104-L108 WeakPolarHBondContact O-CB 3.03Å; D104-L108 PolarHBondContact O-N 3.44Å; I106-L108 VanDerWaalsContact C-N 3.3Å; I106-L108 PolarHBondContact O-N 2.93Å; L108-F110 VanDerWaalsContact C-N 3.3Å; L108-F110 PolarHBondContact O-N 3.19Å; L108-A111 WeakPolarHBondContact O-CB 3.26Å; L108-A111 PolarHBondContact O-N 3.41Å; L108-A111 VanDerWaalsContact O-N 3.14Å; L108-Y112 HydrophobicContact CD1-CE2 3.77Å; L108-Y112 HydrophobicContact CD2-CE2 4.26Å; L108-Y112 HydrophobicContact CG-CD2 4.34Å; L108-Y112 HydrophobicContact CG-CE2 3.61Å; L108-Y112 WeakPolarHBondContact O-CD2 3.19Å; L108-Y112 PolarHBondContact O-N 3.09Å
109	N	87.3	Confident	82.4	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-35.2	179.1	-85.7	-93.5	0	0	0	112.7	A105 I106 I107 G167 Y168 V169	A105-N109 PolarHBondContact O-N 3.35Å; A105-N109 VanDerWaalsContact O-N 3.08Å; A105-N109 PolarHBondContact O-ND2 2.96Å; I106-N109 PolarHBondContact O-N 3.09Å; I107-N109 PolarHBondContact O-N 2.89Å; N109-G167 PolarHBondContact ND2-O 2.73Å; N109-Y168 HydrophobicContact CB-CD2 4.22Å; N109-Y168 HydrophobicContact CB-CE2 4.43Å; N109-Y168 WeakPolarHBondContact O-CE2 3.39Å; N109-Y168 WeakPolarHBondContact OD1-CA 3.47Å; N109-Y168 WeakPolarHBondContact OD1-CD2 3.42Å; N109-V169 WeakPolarHBondContact OD1-CG2 3.44Å; N109-V169 PolarHBondContact OD1-N 2.92Å
110	F	82.5	Confident	83.3	Confident	1 Å²	1	18.3 Å²	18.3	0%	0.004	10%	0.104	C	C	.	.	H	α-helix	trans	-84.2	-22.5	174.3	-77.9	-98.3	0	0	0	113.6	I106 I107 L108 Y112 E113 F114 W195 V199 A202 F203 P209 W212 I237	I106-F110 HydrophobicContact CG2-CD2 3.96Å; I106-F110 HydrophobicContact CG2-CE2 4.06Å; I106-F110 WeakPolarHBondContact O-CD2 3.3Å; I106-F110 PolarHBondContact O-N 3.01Å; I107-F110 PolarHBondContact O-N 2.93Å; L108-F110 VanDerWaalsContact C-N 3.3Å; L108-F110 PolarHBondContact O-N 3.19Å; F110-Y112 VanDerWaalsContact C-N 3.26Å; F110-Y112 PolarHBondContact O-N 3.29Å; F110-E113 WeakPolarHBondContact O-CB 3.41Å; F110-E113 PolarHBondContact O-N 3.31Å; F110-E113 VanDerWaalsContact O-N 3.11Å; F110-F114 WeakPolarHBondContact O-CD2 3.5Å; F110-F114 VanDerWaalsContact O-CE2 3.25Å; F110-F114 WeakPolarHBondContact O-CE2 3.36Å; F110-W195 HydrophobicContact CB-CZ2 4.06Å; F110-W195 AromaticContact CG-NE1 3.98Å; F110-V199 HydrophobicContact CD1-CG2 3.81Å; F110-V199 HydrophobicContact CE1-CG2 4.11Å; F110-V199 HydrophobicContact CG-CG2 4.05Å; F110-A202 HydrophobicContact CE1-CB 4.09Å; F110-A202 HydrophobicContact CZ-CB 4.3Å; F110-F203 HydrophobicContact CE1-CZ 4.42Å; F110-F203 HydrophobicContact CE2-CE2 4.03Å; F110-F203 AromaticContact CE2-CZ 3.57Å; F110-F203 HydrophobicContact CE2-CZ 3.57Å; F110-F203 HydrophobicContact CZ-CE1 4.13Å; F110-F203 AromaticContact CZ-CE2 3.74Å; F110-F203 HydrophobicContact CZ-CE2 3.74Å; F110-F203 AromaticContact CZ-CZ 3.3Å; F110-F203 HydrophobicContact CZ-CZ 3.3Å; F110-P209 HydrophobicContact CE1-CG 4.04Å; F110-P209 HydrophobicContact CZ-CG 4.17Å; F110-W212 HydrophobicContact CE2-CH2 4.28Å; F110-W212 HydrophobicContact CE2-CZ2 4.38Å; F110-W212 HydrophobicContact CZ-CH2 4.34Å; F110-I237 HydrophobicContact CD1-CD1 4.19Å; F110-I237 HydrophobicContact CE1-CD1 4.13Å
111	A	78.9	Confident	84.3	Confident	5 Å²	5	16.5 Å²	16.5	4%	0.041	9%	0.086	C	C	.	.	H	α-helix	trans	-62.2	-36.9	176.3	0	0	0	0	0	111.8	T63 I107 L108 E113 F114 T115 Y138	T63-A111 HydrophobicContact CG2-CB 4.14Å; I107-A111 WeakPolarHBondContact O-CB 3.27Å; I107-A111 PolarHBondContact O-N 3.4Å; L108-A111 WeakPolarHBondContact O-CB 3.26Å; L108-A111 PolarHBondContact O-N 3.41Å; L108-A111 VanDerWaalsContact O-N 3.14Å; A111-E113 PolarHBondContact O-N 3.11Å; A111-F114 PolarHBondContact O-N 2.82Å; A111-T115 PolarHBondContact O-OG1 2.66Å; A111-Y138 PolarHBondContact O-OH 3.42Å
112	Y	77.6	Confident	85	Confident	2 Å²	2	13.1 Å²	13.1	1%	0.008	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.8	174.5	-69	-59	0	0	0	114.3	L108 F110 F114 Y138 L143 F165 Y168 W172	L108-Y112 HydrophobicContact CD1-CE2 3.77Å; L108-Y112 HydrophobicContact CD2-CE2 4.26Å; L108-Y112 HydrophobicContact CG-CD2 4.34Å; L108-Y112 HydrophobicContact CG-CE2 3.61Å; L108-Y112 WeakPolarHBondContact O-CD2 3.19Å; L108-Y112 PolarHBondContact O-N 3.09Å; F110-Y112 VanDerWaalsContact C-N 3.26Å; F110-Y112 PolarHBondContact O-N 3.29Å; Y112-F114 VanDerWaalsContact C-N 3.29Å; Y112-F114 PolarHBondContact O-N 2.67Å; Y112-Y138 HydrophobicContact CD1-CE2 4.04Å; Y112-Y138 AromaticContact CD1-CZ 3.73Å; Y112-Y138 VanDerWaalsContact CD1-OH 3.28Å; Y112-Y138 WeakPolarHBondContact CD1-OH 3.44Å; Y112-L143 HydrophobicContact CE1-CD1 4.1Å; Y112-L143 HydrophobicContact CE1-CD2 3.67Å; Y112-L143 VanDerWaalsContact OH-CD2 3.31Å; Y112-L143 WeakPolarHBondContact OH-CD2 3.27Å; Y112-F165 HydrophobicContact CD1-CD2 4.05Å; Y112-F165 HydrophobicContact CD1-CE2 4.33Å; Y112-F165 AromaticContact CE1-CD2 3.68Å; Y112-F165 HydrophobicContact CE1-CD2 3.68Å; Y112-F165 HydrophobicContact CE1-CE2 4.18Å; Y112-F165 HydrophobicContact CE1-CG 4.5Å; Y112-Y168 HydrophobicContact CD2-CD1 4.28Å; Y112-Y168 AromaticContact CD2-CD2 3.33Å; Y112-Y168 HydrophobicContact CD2-CD2 3.33Å; Y112-Y168 AromaticContact CD2-CE2 3.79Å; Y112-Y168 HydrophobicContact CD2-CE2 3.79Å; Y112-Y168 AromaticContact CD2-CG 3.61Å; Y112-Y168 HydrophobicContact CD2-CG 3.61Å; Y112-Y168 HydrophobicContact CE2-CD2 4.07Å; Y112-Y168 HydrophobicContact CE2-CG 4.04Å; Y112-Y168 HydrophobicContact CG-CD2 4.06Å; Y112-Y168 HydrophobicContact CG-CE2 4.11Å; Y112-Y168 HydrophobicContact CG-CG 4.25Å; Y112-W172 PolarHBondContact O-NE1 2.83Å
113	E	80.5	Confident	85.5	Confident	1 Å²	1	10.9 Å²	10.9	1%	0.005	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.8	-179.5	-57.8	-67.6	126.8	0	0	113.8	F110 A111 Y168 Q186 P209 V210 S211 I237	F110-E113 WeakPolarHBondContact O-CB 3.41Å; F110-E113 PolarHBondContact O-N 3.31Å; F110-E113 VanDerWaalsContact O-N 3.11Å; A111-E113 PolarHBondContact O-N 3.11Å; E113-Y168 PolarHBondContact OE1-OH 3.3Å; E113-Q186 PolarHBondContact O-OE1 2.69Å; E113-P209 HydrophobicContact CG-CB 4.41Å; E113-V210 WeakPolarHBondContact OE2-CG2 3.45Å; E113-V210 PolarHBondContact OE2-N 3.15Å; E113-S211 VanDerWaalsContact OE1-CB 3.3Å; E113-S211 WeakPolarHBondContact OE1-CB 3.4Å; E113-S211 PolarHBondContact OE1-OG 3.41Å; E113-S211 PolarHBondContact OE2-N 3.37Å; E113-I237 HydrophobicContact CB-CD1 4.5Å; E113-I237 HydrophobicContact CG-CD1 4.35Å
114	F	66.5	Low	86	Confident	17 Å²	17	11.2 Å²	11.2	8%	0.075	6%	0.057	C	C	.	.	S	Bend	trans	-131.5	-5.6	-165.9	-60.3	-71	0	0	0	116.2	F110 A111 Y112 W195 N198 I237 T238	F110-F114 WeakPolarHBondContact O-CD2 3.5Å; F110-F114 VanDerWaalsContact O-CE2 3.25Å; F110-F114 WeakPolarHBondContact O-CE2 3.36Å; A111-F114 PolarHBondContact O-N 2.82Å; Y112-F114 VanDerWaalsContact C-N 3.29Å; Y112-F114 PolarHBondContact O-N 2.67Å; F114-W195 AromaticContact CD2-CD1 3.84Å; F114-W195 AromaticContact CE2-CD1 3.5Å; F114-W195 HydrophobicContact CE2-CG 4.35Å; F114-N198 HydrophobicContact CE1-CB 4.39Å; F114-N198 WeakPolarHBondContact CE1-ND2 3.35Å; F114-N198 HydrophobicContact CZ-CB 3.76Å; F114-N198 VanDerWaalsContact CZ-ND2 3.27Å; F114-N198 WeakPolarHBondContact CZ-ND2 3.33Å; F114-I237 HydrophobicContact CZ-CD1 4.17Å; F114-T238 HydrophobicContact CE1-CG2 4.09Å
115	T	60	Low	86.5	Confident	34 Å²	34	10.1 Å²	10.1	21%	0.209	5%	0.051	C	C	.	.			trans	-131	17.6	-165.8	48.9	0	0	0	0	114.4	T63 A111 Y138	T63-T115 HydrophobicContact CG2-CG2 4.37Å; A111-T115 PolarHBondContact O-OG1 2.66Å; T115-Y138 WeakPolarHBondContact O-CD2 3.5Å; T115-Y138 WeakPolarHBondContact OG1-CE2 3.49Å; T115-Y138 PolarHBondContact OG1-OH 2.7Å
116	A	68	Low	86.8	Confident	4 Å²	4	15.9 Å²	15.9	3%	0.033	8%	0.075	C	C	.	.			trans	-93.9	118.7	176.3	0	0	0	0	0	112.1	Y138 Q186	A116-Y138 HydrophobicContact CB-CD2 4.01Å; A116-Y138 HydrophobicContact CB-CE2 4.33Å; A116-Q186 WeakPolarHBondContact O-CB 3.49Å
117	F	79.9	Confident	87.3	Confident	105 Å²	105	22.3 Å²	22.3	46%	0.461	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	145.3	161.6	-63.9	-88.8	0	0	0	107.8	D137 I328	F117-D137 HydrophobicContact CB-CB 3.83Å; F117-D137 PolarHBondContact N-O 2.54Å; F117-D137 CarbonylContact O-C 3.5Å; F117-D137 VanDerWaalsContact O-CA 3.26Å; F117-D137 WeakPolarHBondContact O-CA 3.49Å; F117-D137 WeakPolarHBondContact O-CB 3.31Å; F117-D137 PolarHBondContact O-N 2.77Å; F117-I328 HydrophobicContact CB-CD1 4.35Å; F117-I328 HydrophobicContact CD2-CD1 3.96Å; F117-I328 HydrophobicContact CG-CD1 4.42Å
118	C	92.4	Very high	87.8	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.007	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	149	-165.8	-66.4	0	0	0	0	111.3	R134 D185 T280 N281 R294	C118-R134 PolarHBondContact SG-NH2 3.32Å; C118-D185 HydrophobicContact CB-CB 3.63Å; C118-D185 VanDerWaalsContact CB-OD1 3.24Å; C118-D185 WeakPolarHBondContact CB-OD1 3.33Å; C118-D185 WeakPolarHBondContact CB-OD2 3.49Å; C118-T280 CarbonylContact O-C 3.57Å; C118-T280 VanDerWaalsContact O-CA 3.23Å; C118-T280 WeakPolarHBondContact O-CA 3.31Å; C118-N281 PolarHBondContact N-OD1 3.18Å; C118-N281 PolarHBondContact O-OD1 2.81Å; C118-R294 VanDerWaalsContact C-NH1 3.28Å; C118-R294 PolarHBondContact O-NH1 2.54Å
119	T	98.1	Very high	88.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	123.7	164.5	-50.8	0	0	0	0	107.7	I121 R134 N135 V278 T280 R294 L319 I324	T119-I121 HydrophobicContact CG2-CG1 4.45Å; T119-R134 CarbonylContact O-C 3.57Å; T119-R134 WeakPolarHBondContact O-CA 3.21Å; T119-N135 PolarHBondContact N-O 3.45Å; T119-N135 PolarHBondContact O-N 2.85Å; T119-V278 HydrophobicContact CG2-CG1 4.49Å; T119-T280 HydrophobicContact CG2-CG2 3.89Å; T119-R294 PolarHBondContact OG1-NH1 2.81Å; T119-L319 HydrophobicContact CG2-CD2 4.44Å; T119-I324 HydrophobicContact CG2-CG2 3.78Å
120	S	98.8	Very high	88.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.6	-178.9	-66.2	0	0	0	0	110.4	R134 S183 D185 I243 E279	S120-R134 WeakPolarHBondContact OG-CB 3.27Å; S120-S183 VanDerWaalsContact CB-OG 3.3Å; S120-S183 WeakPolarHBondContact CB-OG 3.4Å; S120-S183 PolarHBondContact OG-OG 3.08Å; S120-D185 WeakPolarHBondContact CB-OD2 3.28Å; S120-D185 PolarHBondContact N-OD2 2.89Å; S120-D185 VanDerWaalsContact OG-CG 3.32Å; S120-D185 PolarHBondContact OG-OD1 3.16Å; S120-D185 PolarHBondContact OG-OD2 3.41Å; S120-I243 VanDerWaalsContact CB-CD1 3.46Å; S120-E279 PolarHBondContact N-O 3.12Å; S120-E279 PolarHBondContact O-N 3.09Å
121	I	98.9	Very high	89.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	126.1	-173.3	-52	176.1	0	0	0	108.6	T119 T123 H132 G133 R277 V278 A298 L302 L315 V318 L319	T119-I121 HydrophobicContact CG2-CG1 4.45Å; I121-T123 HydrophobicContact CG2-CG2 3.58Å; I121-H132 WeakPolarHBondContact O-CA 3.19Å; I121-H132 PolarHBondContact O-CD2 3.26Å; I121-G133 PolarHBondContact N-O 2.83Å; I121-G133 PolarHBondContact O-N 3.38Å; I121-R277 WeakPolarHBondContact CA-O 3.32Å; I121-V278 HydrophobicContact CG1-CG1 4.4Å; I121-V278 HydrophobicContact CG1-CG2 4.21Å; I121-V278 HydrophobicContact CG2-CG2 4.28Å; I121-A298 HydrophobicContact CD1-CB 4.29Å; I121-L302 HydrophobicContact CD1-CD1 4.4Å; I121-L302 HydrophobicContact CG2-CD1 3.79Å; I121-L302 HydrophobicContact CG2-CD2 4.37Å; I121-L315 HydrophobicContact CB-CD1 3.87Å; I121-L315 HydrophobicContact CD1-CD1 4.14Å; I121-L315 HydrophobicContact CG2-CD1 3.7Å; I121-V318 HydrophobicContact CD1-CG1 3.78Å; I121-L319 HydrophobicContact CD1-CD2 3.9Å; I121-L319 HydrophobicContact CD1-CG 4.23Å; I121-L319 HydrophobicContact CG1-CD2 4.34Å
122	V	98.9	Very high	90.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.4	167.3	62.4	0	0	0	0	108.8	V130 I243 L268 Y276 R277	V122-V130 HydrophobicContact CG2-CG1 3.92Å; V122-I243 HydrophobicContact CB-CG2 3.91Å; V122-I243 HydrophobicContact CG1-CG2 3.85Å; V122-L268 HydrophobicContact CG2-CD1 4.39Å; V122-Y276 CarbonylContact O-C 3.54Å; V122-Y276 WeakPolarHBondContact O-CA 3.39Å; V122-R277 HydrophobicContact CG1-CB 3.89Å; V122-R277 HydrophobicContact CG1-CG 4.36Å; V122-R277 PolarHBondContact N-O 3.13Å; V122-R277 VanDerWaalsContact N-O 3.07Å; V122-R277 PolarHBondContact O-N 3.19Å
123	T	98.8	Very high	91.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	158.9	-174.8	69.7	0	0	0	0	110.9	I121 V130 F131 W275 L302 I310 L315	I121-T123 HydrophobicContact CG2-CG2 3.58Å; T123-V130 WeakPolarHBondContact O-CA 3.44Å; T123-F131 PolarHBondContact N-O 3.07Å; T123-F131 PolarHBondContact O-N 2.9Å; T123-F131 PolarHBondContact OG1-O 3.06Å; T123-W275 CarbonylContact C-O 3.58Å; T123-W275 WeakPolarHBondContact CA-O 3.25Å; T123-L302 HydrophobicContact CG2-CD2 4.06Å; T123-I310 HydrophobicContact CG2-CD1 4.42Å; T123-I310 HydrophobicContact CG2-CG1 4.13Å; T123-L315 HydrophobicContact CG2-CD1 4.17Å
124	Q	98.7	Very high	92.5	Very high	14 Å²	14	27 Å²	27	7%	0.065	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.1	168.7	-170.8	-165.5	-66.9	0	0	111.1	N129 L268 P270 W275 Q307	Q124-N129 VanDerWaalsContact CA-O 3.25Å; Q124-N129 WeakPolarHBondContact CA-O 3.42Å; Q124-L268 HydrophobicContact CB-CD1 4.09Å; Q124-P270 VanDerWaalsContact OE1-CG 3.3Å; Q124-W275 PolarHBondContact N-O 2.8Å; Q124-Q307 VanDerWaalsContact O-CG 3.3Å; Q124-Q307 WeakPolarHBondContact O-CG 3.42Å; Q124-Q307 PolarHBondContact O-NE2 2.84Å
125	D	98.4	Very high	94	Very high	14 Å²	14	26.2 Å²	26.2	8%	0.075	13%	0.132	C	C	.	.			trans	-77.3	-178.3	171.9	73.9	10.3	0	0	0	113.1	N127 G128 N129 F131 Q307 I310	D125-N127 VanDerWaalsContact C-N 3.26Å; D125-N127 PolarHBondContact O-N 3.17Å; D125-N127 WeakPolarHBondContact OD1-CA 3.27Å; D125-N127 WeakPolarHBondContact OD1-CB 3.22Å; D125-N127 PolarHBondContact OD1-N 3.08Å; D125-G128 PolarHBondContact O-N 3.33Å; D125-G128 PolarHBondContact OD1-N 3.3Å; D125-N129 PolarHBondContact N-O 2.89Å; D125-N129 PolarHBondContact OD1-N 3.47Å; D125-N129 PolarHBondContact OD1-ND2 3.33Å; D125-N129 WeakPolarHBondContact OD2-CB 3.26Å; D125-N129 PolarHBondContact OD2-ND2 3.09Å; D125-F131 HydrophobicContact CB-CE2 4.06Å; D125-Q307 PolarHBondContact O-NE2 2.97Å; D125-I310 HydrophobicContact CB-CG2 3.81Å
126	K	97.6	Very high	95.8	Very high	129 Å²	129	24.7 Å²	24.7	56%	0.561	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-22.4	176.4	-72.3	-61.2	-172.1	-168.5	0	114.6	G128 Q307 D308	K126-G128 VanDerWaalsContact C-N 3.28Å; K126-Q307 HydrophobicContact CD-CG 4.18Å; K126-Q307 VanDerWaalsContact CE-OE1 3.24Å; K126-Q307 HydrophobicContact CG-CG 4.31Å; K126-D308 WeakPolarHBondContact CE-OD1 3.43Å; K126-D308 WeakPolarHBondContact CG-OD1 3.25Å
127	N	97.7	Very high	97	Very high	138 Å²	138	24.5 Å²	24.5	74%	0.738	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4.8	179.2	-60	-43.2	0	0	0	112	D125	D125-N127 VanDerWaalsContact C-N 3.26Å; D125-N127 PolarHBondContact O-N 3.17Å; D125-N127 WeakPolarHBondContact OD1-CA 3.27Å; D125-N127 WeakPolarHBondContact OD1-CB 3.22Å; D125-N127 PolarHBondContact OD1-N 3.08Å
128	G	98	Very high	97.5	Very high	11 Å²	11	19.7 Å²	19.7	11%	0.113	10%	0.1	C	C	.	.			trans	88.9	8.3	-178.7	0	0	0	0	0	114.1	D125 K126 A249	D125-G128 PolarHBondContact O-N 3.33Å; D125-G128 PolarHBondContact OD1-N 3.3Å; K126-G128 VanDerWaalsContact C-N 3.28Å; G128-A249 PolarHBondContact O-N 3.25Å
129	N	98.4	Very high	97.3	Very high	73 Å²	73	22.8 Å²	22.8	39%	0.39	12%	0.12	S	C	.	.			trans	-73.8	132.7	176.7	-57.5	-55.2	0	0	0	110.1	Q124 D125 F131	Q124-N129 VanDerWaalsContact CA-O 3.25Å; Q124-N129 WeakPolarHBondContact CA-O 3.42Å; D125-N129 PolarHBondContact N-O 2.89Å; D125-N129 PolarHBondContact OD1-N 3.47Å; D125-N129 PolarHBondContact OD1-ND2 3.33Å; D125-N129 WeakPolarHBondContact OD2-CB 3.26Å; D125-N129 PolarHBondContact OD2-ND2 3.09Å; N129-F131 HydrophobicContact CB-CE1 4.24Å; N129-F131 HydrophobicContact CB-CE2 4.16Å; N129-F131 HydrophobicContact CB-CZ 3.72Å
130	V	98.8	Very high	96.9	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.018	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.1	177.8	178.6	0	0	0	0	110.3	V122 T123 R248 S336	V122-V130 HydrophobicContact CG2-CG1 3.92Å; T123-V130 WeakPolarHBondContact O-CA 3.44Å; V130-R248 WeakPolarHBondContact CG2-O 3.42Å; V130-S336 WeakPolarHBondContact O-CB 3.33Å; V130-S336 PolarHBondContact O-OG 2.99Å
131	F	98.8	Very high	96.6	Very high	23 Å²	23	26.6 Å²	26.6	10%	0.101	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.7	173.5	-47.1	-69.8	0	0	0	110.3	T123 D125 N129 I310 N311 M312 L315	T123-F131 PolarHBondContact N-O 3.07Å; T123-F131 PolarHBondContact O-N 2.9Å; T123-F131 PolarHBondContact OG1-O 3.06Å; D125-F131 HydrophobicContact CB-CE2 4.06Å; N129-F131 HydrophobicContact CB-CE1 4.24Å; N129-F131 HydrophobicContact CB-CE2 4.16Å; N129-F131 HydrophobicContact CB-CZ 3.72Å; F131-I310 WeakPolarHBondContact CE2-O 3.45Å; F131-N311 HydrophobicContact CZ-CB 4.44Å; F131-M312 HydrophobicContact CB-SD 4.18Å; F131-M312 HydrophobicContact CD1-CG 3.66Å; F131-M312 HydrophobicContact CD1-SD 3.87Å; F131-M312 HydrophobicContact CE1-CG 4.13Å; F131-M312 HydrophobicContact CG-CG 4.45Å; F131-M312 HydrophobicContact CG-SD 4.43Å; F131-L315 HydrophobicContact CB-CD2 3.89Å
132	H	98.9	Very high	96.3	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	128.4	-178.1	-171.1	171.3	0	0	0	109.1	I121 T181 S183 I243 V334 M335	I121-H132 WeakPolarHBondContact O-CA 3.19Å; I121-H132 PolarHBondContact O-CD2 3.26Å; H132-T181 WeakPolarHBondContact CB-OG1 3.14Å; H132-T181 WeakPolarHBondContact ND1-CB 3.47Å; H132-T181 PolarHBondContact ND1-OG1 2.86Å; H132-S183 PolarHBondContact CE1-N 3.45Å; H132-S183 PolarHBondContact NE2-OG 2.77Å; H132-I243 PolarHBondContact CE1-O 3.45Å; H132-V334 CarbonylContact O-C 3.49Å; H132-M335 HydrophobicContact CB-CE 4.43Å; H132-M335 HydrophobicContact CB-CG 4.14Å; H132-M335 PolarHBondContact N-O 3.4Å; H132-M335 WeakPolarHBondContact O-CG 3.25Å; H132-M335 PolarHBondContact O-N 2.96Å
133	G	98.8	Very high	96.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153	179.8	0	0	0	0	0	111.6	I121 L319 T333	I121-G133 PolarHBondContact N-O 2.83Å; I121-G133 PolarHBondContact O-N 3.38Å; G133-L319 VanDerWaalsContact C-CD1 3.48Å; G133-T333 CarbonylContact C-O 3.55Å; G133-T333 WeakPolarHBondContact CA-O 3.47Å
134	R	98.6	Very high	95.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	152	-176.2	80.2	95.2	52.6	-177.1	-1.8	114.5	C118 T119 S120 T173 G184 D185 L319 T332 T333	C118-R134 PolarHBondContact SG-NH2 3.32Å; T119-R134 CarbonylContact O-C 3.57Å; T119-R134 WeakPolarHBondContact O-CA 3.21Å; S120-R134 WeakPolarHBondContact OG-CB 3.27Å; R134-T173 WeakPolarHBondContact CD-OG1 3.27Å; R134-T173 HydrophobicContact CG-CG2 4.05Å; R134-G184 PolarHBondContact NH2-O 2.94Å; R134-D185 IonicContact CZ-OD1 2.9Å; R134-D185 IonicContact NH2-OD1 3.86Å; R134-D185 PolarHBondContact NH2-OD1 3.38Å; R134-L319 VanDerWaalsContact N-CD1 3.34Å; R134-T332 CarbonylContact O-C 3.58Å; R134-T332 VanDerWaalsContact O-CA 3.26Å; R134-T332 WeakPolarHBondContact O-CA 3.21Å; R134-T333 PolarHBondContact N-O 3.42Å; R134-T333 PolarHBondContact O-N 3.47Å
135	N	98.3	Very high	95.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.8	165.3	-80.6	-2.7	0	0	0	110.2	T119 L319 I324 T329 Y331 T332	T119-N135 PolarHBondContact N-O 3.45Å; T119-N135 PolarHBondContact O-N 2.85Å; N135-L319 PolarHBondContact ND2-O 3.31Å; N135-I324 PolarHBondContact ND2-O 3.33Å; N135-T329 HydrophobicContact CB-CG2 4.02Å; N135-Y331 WeakPolarHBondContact CA-O 3.34Å; N135-T332 WeakPolarHBondContact OD1-CB 3.38Å; N135-T332 WeakPolarHBondContact OD1-CG2 3.29Å; N135-T332 PolarHBondContact OD1-OG1 2.76Å
136	L	96.8	Very high	95.6	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.4	165	-160.2	146.2	0	0	0	110.5	Y138 F165 W172 I330 Y331	L136-Y138 HydrophobicContact CD2-CD2 4.35Å; L136-F165 HydrophobicContact CD1-CZ 4.37Å; L136-F165 HydrophobicContact CD2-CE2 4.34Å; L136-F165 HydrophobicContact CD2-CZ 3.84Å; L136-W172 HydrophobicContact CD1-CB 4.27Å; L136-I330 HydrophobicContact CD2-CB 4.43Å; L136-I330 HydrophobicContact CD2-CG1 4.37Å; L136-I330 PolarHBondContact O-N 3.06Å; L136-Y331 HydrophobicContact CB-CD1 3.95Å; L136-Y331 HydrophobicContact CB-CD2 4.15Å; L136-Y331 HydrophobicContact CB-CE1 3.59Å; L136-Y331 HydrophobicContact CB-CE2 3.78Å; L136-Y331 HydrophobicContact CB-CG 4.22Å; L136-Y331 VanDerWaalsContact CB-CZ 3.49Å; L136-Y331 HydrophobicContact CD1-CE1 3.63Å; L136-Y331 WeakPolarHBondContact CD1-OH 3.45Å; L136-Y331 HydrophobicContact CD2-CE1 4.37Å; L136-Y331 HydrophobicContact CG-CE1 4.03Å; L136-Y331 PolarHBondContact N-O 3.32Å
137	D	93.9	Very high	95.6	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.2	177	-57.4	-20.1	0	0	0	109.9	F117 R294 N326 I328 T329	F117-D137 HydrophobicContact CB-CB 3.83Å; F117-D137 PolarHBondContact N-O 2.54Å; F117-D137 CarbonylContact O-C 3.5Å; F117-D137 VanDerWaalsContact O-CA 3.26Å; F117-D137 WeakPolarHBondContact O-CA 3.49Å; F117-D137 WeakPolarHBondContact O-CB 3.31Å; F117-D137 PolarHBondContact O-N 2.77Å; D137-R294 IonicContact OD2-NH1 3.18Å; D137-N326 PolarHBondContact OD2-ND2 3.34Å; D137-I328 CarbonylContact C-O 3.58Å; D137-I328 VanDerWaalsContact CA-O 3.32Å; D137-I328 WeakPolarHBondContact CA-O 3.45Å; D137-I328 HydrophobicContact CB-CD1 3.89Å; D137-I328 HydrophobicContact CB-CG1 3.89Å; D137-T329 WeakPolarHBondContact OD1-CA 3.5Å; D137-T329 WeakPolarHBondContact OD1-CB 3.42Å; D137-T329 WeakPolarHBondContact OD1-CG2 3.35Å; D137-T329 PolarHBondContact OD1-OG1 2.01Å
138	Y	90.1	Very high	95.5	Very high	3 Å²	3	18.9 Å²	18.9	1%	0.012	11%	0.108	C	C	.	.			trans	-149.7	132.7	-178.6	-149.8	-86.8	0	0	0	109.9	A111 Y112 T115 A116 L136 H140 L143 I328	A111-Y138 PolarHBondContact O-OH 3.42Å; Y112-Y138 HydrophobicContact CD1-CE2 4.04Å; Y112-Y138 AromaticContact CD1-CZ 3.73Å; Y112-Y138 VanDerWaalsContact CD1-OH 3.28Å; Y112-Y138 WeakPolarHBondContact CD1-OH 3.44Å; T115-Y138 WeakPolarHBondContact O-CD2 3.5Å; T115-Y138 WeakPolarHBondContact OG1-CE2 3.49Å; T115-Y138 PolarHBondContact OG1-OH 2.7Å; A116-Y138 HydrophobicContact CB-CD2 4.01Å; A116-Y138 HydrophobicContact CB-CE2 4.33Å; L136-Y138 HydrophobicContact CD2-CD2 4.35Å; Y138-H140 HydrophobicContact CD1-CB 3.89Å; Y138-H140 AromaticContact CD1-CD2 3.3Å; Y138-H140 WeakPolarHBondContact CD1-CD2 3.34Å; Y138-H140 AromaticContact CD1-CG 3.91Å; Y138-H140 HydrophobicContact CE1-CB 4.24Å; Y138-H140 AromaticContact CE1-CD2 3.18Å; Y138-H140 WeakPolarHBondContact CE1-CD2 3.15Å; Y138-H140 AromaticContact CE1-CG 3.89Å; Y138-H140 AromaticContact CE1-NE2 3.89Å; Y138-H140 PolarHBondContact O-N 2.99Å; Y138-L143 HydrophobicContact CD1-CD1 3.15Å; Y138-L143 HydrophobicContact CD1-CG 4.47Å; Y138-L143 HydrophobicContact CD2-CD1 4.3Å; Y138-L143 HydrophobicContact CE1-CD1 3.61Å; Y138-L143 HydrophobicContact CG-CD1 3.53Å; Y138-I328 PolarHBondContact N-O 2.96Å
139	P	87.9	Confident	95.5	Very high	66 Å²	66	19.3 Å²	19.3	43%	0.429	11%	0.108	S	C	.	.	S	Bend	trans	-77.4	30.2	-173.1	32.5	-36.2	0	0	0	114.2	I328	P139-I328 HydrophobicContact CB-CG2 4.21Å
140	H	90	Very high	95.5	Very high	16 Å²	16	16 Å²	16	7%	0.074	9%	0.09	C	C	.	.			trans	-127.8	97.1	179.4	-65.2	-100.9	0	0	0	109.9	I59 Y138 V142 L143	I59-H140 HydrophobicContact CG1-CB 4.4Å; Y138-H140 HydrophobicContact CD1-CB 3.89Å; Y138-H140 AromaticContact CD1-CD2 3.3Å; Y138-H140 WeakPolarHBondContact CD1-CD2 3.34Å; Y138-H140 AromaticContact CD1-CG 3.91Å; Y138-H140 HydrophobicContact CE1-CB 4.24Å; Y138-H140 AromaticContact CE1-CD2 3.18Å; Y138-H140 WeakPolarHBondContact CE1-CD2 3.15Å; Y138-H140 AromaticContact CE1-CG 3.89Å; Y138-H140 AromaticContact CE1-NE2 3.89Å; Y138-H140 PolarHBondContact O-N 2.99Å; H140-V142 HydrophobicContact CB-CG1 4.41Å; H140-V142 PolarHBondContact O-N 2.81Å; H140-V142 VanDerWaalsContact O-N 3.12Å; H140-L143 HydrophobicContact CB-CD1 4.02Å; H140-L143 HydrophobicContact CB-CG 4.04Å; H140-L143 WeakPolarHBondContact O-CB 3.45Å; H140-L143 PolarHBondContact O-N 3.26Å; H140-L143 VanDerWaalsContact O-N 3.09Å
141	P	91.7	Very high	95.5	Very high	65 Å²	65	17 Å²	17	42%	0.422	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.5	-175.1	-27	35.5	0	0	0	114.7	L143 R144	P141-L143 PolarHBondContact O-N 3.24Å; P141-L143 VanDerWaalsContact O-N 3.14Å; P141-R144 WeakPolarHBondContact O-CB 3.17Å; P141-R144 PolarHBondContact O-N 2.74Å; P141-R144 VanDerWaalsContact O-N 3.13Å
142	V	93.1	Very high	95.5	Very high	12 Å²	12	15.9 Å²	15.9	7%	0.073	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-28	177.8	78.4	0	0	0	0	112.9	Y51 A55 I59 H140 R144 N145 M146	Y51-V142 HydrophobicContact CE1-CG2 4.36Å; Y51-V142 HydrophobicContact CE2-CG2 4.45Å; Y51-V142 WeakPolarHBondContact OH-CG2 3.32Å; A55-V142 HydrophobicContact CB-CB 4.42Å; A55-V142 HydrophobicContact CB-CG1 4.27Å; A55-V142 HydrophobicContact CB-CG2 3.31Å; I59-V142 HydrophobicContact CD1-CG1 3.85Å; I59-V142 HydrophobicContact CG1-CG1 3.81Å; H140-V142 HydrophobicContact CB-CG1 4.41Å; H140-V142 PolarHBondContact O-N 2.81Å; H140-V142 VanDerWaalsContact O-N 3.12Å; V142-R144 PolarHBondContact O-N 3.32Å; V142-N145 PolarHBondContact O-N 3.4Å; V142-N145 VanDerWaalsContact O-N 3.16Å; V142-M146 HydrophobicContact CG1-SD 4.3Å; V142-M146 PolarHBondContact O-N 2.83Å
143	L	94.3	Very high	95.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.2	-22.9	179.5	-66.8	178.8	0	0	0	114	I59 Y112 Y138 H140 P141 N145 M146 T147 F165 I330	I59-L143 HydrophobicContact CD1-CD2 3.55Å; I59-L143 HydrophobicContact CD1-CG 4.32Å; Y112-L143 HydrophobicContact CE1-CD1 4.1Å; Y112-L143 HydrophobicContact CE1-CD2 3.67Å; Y112-L143 VanDerWaalsContact OH-CD2 3.31Å; Y112-L143 WeakPolarHBondContact OH-CD2 3.27Å; Y138-L143 HydrophobicContact CD1-CD1 3.15Å; Y138-L143 HydrophobicContact CD1-CG 4.47Å; Y138-L143 HydrophobicContact CD2-CD1 4.3Å; Y138-L143 HydrophobicContact CE1-CD1 3.61Å; Y138-L143 HydrophobicContact CG-CD1 3.53Å; H140-L143 HydrophobicContact CB-CD1 4.02Å; H140-L143 HydrophobicContact CB-CG 4.04Å; H140-L143 WeakPolarHBondContact O-CB 3.45Å; H140-L143 PolarHBondContact O-N 3.26Å; H140-L143 VanDerWaalsContact O-N 3.09Å; P141-L143 PolarHBondContact O-N 3.24Å; P141-L143 VanDerWaalsContact O-N 3.14Å; L143-N145 VanDerWaalsContact C-N 3.29Å; L143-N145 PolarHBondContact O-N 3.19Å; L143-M146 HydrophobicContact CD2-SD 4.07Å; L143-M146 CarbonylContact O-C 3.47Å; L143-M146 PolarHBondContact O-N 3.34Å; L143-M146 VanDerWaalsContact O-N 3.15Å; L143-T147 PolarHBondContact O-N 3.27Å; L143-T147 PolarHBondContact O-OG1 3.03Å; L143-F165 HydrophobicContact CB-CD1 4.09Å; L143-F165 HydrophobicContact CB-CE1 3.8Å; L143-F165 HydrophobicContact CB-CZ 4.12Å; L143-F165 HydrophobicContact CD1-CD2 4.46Å; L143-F165 HydrophobicContact CD1-CE1 4.47Å; L143-F165 HydrophobicContact CD1-CE2 3.99Å; L143-F165 HydrophobicContact CD1-CZ 4Å; L143-F165 HydrophobicContact CD2-CB 4.37Å; L143-F165 HydrophobicContact CD2-CD1 4.13Å; L143-F165 HydrophobicContact CD2-CD2 4.07Å; L143-F165 HydrophobicContact CD2-CE1 4.47Å; L143-F165 HydrophobicContact CD2-CE2 4.39Å; L143-F165 HydrophobicContact CD2-CG 3.93Å; L143-F165 HydrophobicContact CG-CE1 4.48Å; L143-F165 HydrophobicContact CG-CZ 4.48Å; L143-I330 HydrophobicContact CB-CD1 4.17Å; L143-I330 HydrophobicContact CB-CG1 4.33Å; L143-I330 HydrophobicContact CB-CG2 4.09Å
144	R	94.8	Very high	95.4	Very high	19 Å²	19	23 Å²	23	7%	0.072	12%	0.123	C	C	.	.	H	α-helix	trans	-58.5	-44.4	174.4	-70.5	-179	178.4	87	3.6	111.2	P141 V142 M146 T147 R327 T329 I330 I347 R348	P141-R144 WeakPolarHBondContact O-CB 3.17Å; P141-R144 PolarHBondContact O-N 2.74Å; P141-R144 VanDerWaalsContact O-N 3.13Å; V142-R144 PolarHBondContact O-N 3.32Å; R144-M146 VanDerWaalsContact C-N 3.28Å; R144-M146 PolarHBondContact O-N 3.31Å; R144-T147 WeakPolarHBondContact O-CB 3.36Å; R144-T147 PolarHBondContact O-N 3.42Å; R144-T147 PolarHBondContact O-OG1 3.5Å; R144-R327 PolarHBondContact NH2-O 2.94Å; R144-T329 PolarHBondContact NE-O 2.84Å; R144-T329 PolarHBondContact NH2-O 2.87Å; R144-I330 HydrophobicContact CG-CD1 3.96Å; R144-I330 HydrophobicContact CG-CG2 3.96Å; R144-I347 HydrophobicContact CB-CG2 3.75Å; R144-I347 HydrophobicContact CG-CG2 4.04Å; R144-I347 WeakPolarHBondContact O-CD1 3.41Å; R144-R348 WeakPolarHBondContact CD-O 3.4Å; R144-R348 PolarHBondContact NE-O 2.97Å
145	N	95.1	Very high	95.3	Very high	101 Å²	101	29.1 Å²	29.1	54%	0.54	16%	0.155	S	C	.	.	H	α-helix	trans	-81.2	-9.9	-180	-66.2	-12.1	0	0	0	113	F47 Y51 V142 L143	F47-N145 VanDerWaalsContact CE1-O 3.23Å; F47-N145 WeakPolarHBondContact CE1-O 3.36Å; Y51-N145 HydrophobicContact CE1-CB 3.68Å; Y51-N145 VanDerWaalsContact OH-CB 3.25Å; Y51-N145 WeakPolarHBondContact OH-CB 3.21Å; Y51-N145 PolarHBondContact OH-ND2 2.99Å; V142-N145 PolarHBondContact O-N 3.4Å; V142-N145 VanDerWaalsContact O-N 3.16Å; L143-N145 VanDerWaalsContact C-N 3.29Å; L143-N145 PolarHBondContact O-N 3.19Å
146	M	95.6	Very high	95.1	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-97.9	-7.2	173.3	-59.1	173.4	70.4	0	0	112.1	Y51 L52 A55 I59 V142 L143 R144 M148 F165 A166	Y51-M146 HydrophobicContact CE1-CG 4.28Å; L52-M146 HydrophobicContact CD2-CE 4.29Å; L52-M146 HydrophobicContact CD2-CG 4.04Å; A55-M146 HydrophobicContact CB-CE 4.25Å; A55-M146 HydrophobicContact CB-CG 4.34Å; A55-M146 HydrophobicContact CB-SD 3.44Å; A55-M146 WeakPolarHBondContact CB-SD 3.19Å; I59-M146 HydrophobicContact CD1-CE 4.43Å; I59-M146 HydrophobicContact CD1-SD 4.01Å; V142-M146 HydrophobicContact CG1-SD 4.3Å; V142-M146 PolarHBondContact O-N 2.83Å; L143-M146 HydrophobicContact CD2-SD 4.07Å; L143-M146 CarbonylContact O-C 3.47Å; L143-M146 PolarHBondContact O-N 3.34Å; L143-M146 VanDerWaalsContact O-N 3.15Å; R144-M146 VanDerWaalsContact C-N 3.28Å; R144-M146 PolarHBondContact O-N 3.31Å; M146-M148 PolarHBondContact O-N 3.22Å; M146-F165 HydrophobicContact CB-CB 4.41Å; M146-F165 CarbonylContact O-C 3.53Å; M146-F165 VanDerWaalsContact O-CA 3.3Å; M146-F165 WeakPolarHBondContact O-CA 3.49Å; M146-A166 HydrophobicContact CB-CB 4.48Å; M146-A166 WeakPolarHBondContact CE-O 3.12Å; M146-A166 PolarHBondContact O-N 2.85Å
147	T	97.3	Very high	95.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	131.6	-178.1	-59.3	0	0	0	0	109.8	P25 L143 R144 T163 S164 F165 I330 Y331 I347	P25-T147 HydrophobicContact CB-CG2 3.95Å; P25-T147 VanDerWaalsContact CB-O 3.26Å; P25-T147 WeakPolarHBondContact CB-O 3.41Å; P25-T147 HydrophobicContact CG-CG2 4.25Å; L143-T147 PolarHBondContact O-N 3.27Å; L143-T147 PolarHBondContact O-OG1 3.03Å; R144-T147 WeakPolarHBondContact O-CB 3.36Å; R144-T147 PolarHBondContact O-N 3.42Å; R144-T147 PolarHBondContact O-OG1 3.5Å; T147-T163 HydrophobicContact CG2-CG2 3.93Å; T147-S164 WeakPolarHBondContact CA-O 3.42Å; T147-F165 WeakPolarHBondContact OG1-CE1 3.41Å; T147-I330 WeakPolarHBondContact OG1-CG2 3.43Å; T147-Y331 HydrophobicContact CG2-CD1 3.77Å; T147-Y331 HydrophobicContact CG2-CE1 4.48Å; T147-Y331 HydrophobicContact CG2-CG 4.22Å; T147-I347 HydrophobicContact CG2-CG1 4.26Å
148	M	97.4	Very high	95.2	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.1	178.5	59.8	-174.2	175.4	0	0	111.1	P26 V28 W40 L43 F47 M146 L150 T163 S164 F165 A166	P26-M148 WeakPolarHBondContact O-CA 3.2Å; V28-M148 HydrophobicContact CB-SD 4.42Å; V28-M148 HydrophobicContact CG2-CB 4.29Å; V28-M148 HydrophobicContact CG2-SD 3.91Å; W40-M148 HydrophobicContact CE3-CE 4.4Å; W40-M148 HydrophobicContact CH2-CE 4.32Å; W40-M148 HydrophobicContact CZ3-CE 3.56Å; L43-M148 HydrophobicContact CD2-CE 4.08Å; L43-M148 HydrophobicContact CD2-SD 3.45Å; L43-M148 WeakPolarHBondContact CD2-SD 3.33Å; F47-M148 HydrophobicContact CE2-CB 4.24Å; F47-M148 HydrophobicContact CE2-SD 4.15Å; F47-M148 HydrophobicContact CZ-CB 4.1Å; M146-M148 PolarHBondContact O-N 3.22Å; M148-L150 HydrophobicContact CE-CD1 4.25Å; M148-L150 HydrophobicContact CE-CD2 3.84Å; M148-L150 HydrophobicContact CE-CG 4.35Å; M148-L150 HydrophobicContact CG-CD2 4.05Å; M148-L150 HydrophobicContact CG-CG 4.35Å; M148-L150 HydrophobicContact SD-CD2 3.84Å; M148-T163 WeakPolarHBondContact O-CA 3.48Å; M148-S164 PolarHBondContact N-O 2.73Å; M148-S164 PolarHBondContact O-N 2.79Å; M148-F165 VanDerWaalsContact CE-C 3.45Å; M148-F165 VanDerWaalsContact CE-O 3.29Å; M148-F165 WeakPolarHBondContact CE-O 3.41Å; M148-A166 HydrophobicContact CE-CB 4.47Å; M148-A166 HydrophobicContact SD-CB 4.28Å
149	N	98.1	Very high	95.5	Very high	20 Å²	20	43.1 Å²	43.1	11%	0.107	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140.3	161.9	-73.2	-25.6	0	0	0	109.2	P26 T27 V28 G162 T163 T345	P26-N149 PolarHBondContact O-N 3.49Å; T27-N149 CarbonylContact C-O 3.47Å; T27-N149 WeakPolarHBondContact CA-O 3.29Å; V28-N149 PolarHBondContact N-O 3.16Å; N149-G162 CarbonylContact C-O 3.5Å; N149-G162 WeakPolarHBondContact CA-O 3.48Å; N149-T163 PolarHBondContact OD1-OG1 2.88Å; N149-T345 WeakPolarHBondContact OD1-CB 3.16Å; N149-T345 PolarHBondContact OD1-OG1 3.07Å
150	L	98.3	Very high	96	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.5	179.8	-65.5	-179.9	0	0	0	109.8	V28 I30 W40 M148 F152 Y161 G162 L171	V28-L150 HydrophobicContact CB-CD2 3.94Å; V28-L150 HydrophobicContact CG1-CD2 4.47Å; V28-L150 WeakPolarHBondContact O-CA 3.45Å; I30-L150 HydrophobicContact CD1-CD2 4.31Å; I30-L150 HydrophobicContact CG1-CD2 3.97Å; W40-L150 HydrophobicContact CH2-CD1 3.76Å; W40-L150 HydrophobicContact CH2-CD2 4.42Å; W40-L150 HydrophobicContact CZ3-CD1 4.14Å; W40-L150 HydrophobicContact CZ3-CD2 4.02Å; M148-L150 HydrophobicContact CE-CD1 4.25Å; M148-L150 HydrophobicContact CE-CD2 3.84Å; M148-L150 HydrophobicContact CE-CG 4.35Å; M148-L150 HydrophobicContact CG-CD2 4.05Å; M148-L150 HydrophobicContact CG-CG 4.35Å; M148-L150 HydrophobicContact SD-CD2 3.84Å; L150-F152 HydrophobicContact CB-CD2 4.09Å; L150-F152 HydrophobicContact CB-CE2 3.58Å; L150-F152 HydrophobicContact CB-CZ 4.29Å; L150-F152 HydrophobicContact CD1-CE2 3.8Å; L150-F152 HydrophobicContact CD1-CZ 3.78Å; L150-F152 HydrophobicContact CG-CE2 4.32Å; L150-Y161 VanDerWaalsContact O-CA 3.31Å; L150-Y161 WeakPolarHBondContact O-CA 3.43Å; L150-G162 PolarHBondContact N-O 2.78Å; L150-G162 PolarHBondContact O-N 3.08Å; L150-L171 HydrophobicContact CD1-CD2 4.06Å
151	V	98.1	Very high	96.4	Very high	24 Å²	24	41.9 Å²	41.9	15%	0.145	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	105.8	167.7	-176.7	0	0	0	0	107	T27 V28 V29 I30 Q153 A158 Y161	T27-V151 HydrophobicContact CG2-CG2 3.66Å; V28-V151 PolarHBondContact O-N 3.42Å; V29-V151 WeakPolarHBondContact CA-O 3.22Å; V29-V151 HydrophobicContact CG2-CB 4.43Å; I30-V151 PolarHBondContact N-O 3.04Å; V151-Q153 HydrophobicContact CG1-CG 4.04Å; V151-A158 HydrophobicContact CG1-CB 3.66Å; V151-Y161 HydrophobicContact CB-CD1 4.49Å; V151-Y161 HydrophobicContact CG1-CD1 4.33Å; V151-Y161 HydrophobicContact CG1-CE1 4Å; V151-Y161 HydrophobicContact CG2-CD1 3.97Å; V151-Y161 HydrophobicContact CG2-CE1 4.07Å
152	F	98.4	Very high	96.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	125.1	174.5	-68.2	-94.2	0	0	0	108.6	I30 L32 L150 A158 V159 Y160 L171	I30-F152 HydrophobicContact CB-CD1 3.65Å; I30-F152 HydrophobicContact CB-CE1 3.87Å; I30-F152 HydrophobicContact CB-CG 4.29Å; I30-F152 HydrophobicContact CG1-CD1 4.28Å; I30-F152 HydrophobicContact CG1-CE1 4.06Å; I30-F152 HydrophobicContact CG1-CZ 4.43Å; I30-F152 HydrophobicContact CG2-CD1 3.64Å; I30-F152 HydrophobicContact CG2-CE1 3.7Å; I30-F152 WeakPolarHBondContact O-CA 3.42Å; L32-F152 HydrophobicContact CD1-CB 4.25Å; L32-F152 HydrophobicContact CD2-CD1 3.92Å; L32-F152 HydrophobicContact CG-CB 4.46Å; L32-F152 HydrophobicContact CG-CD1 4.45Å; L150-F152 HydrophobicContact CB-CD2 4.09Å; L150-F152 HydrophobicContact CB-CE2 3.58Å; L150-F152 HydrophobicContact CB-CZ 4.29Å; L150-F152 HydrophobicContact CD1-CE2 3.8Å; L150-F152 HydrophobicContact CD1-CZ 3.78Å; L150-F152 HydrophobicContact CG-CE2 4.32Å; F152-A158 CarbonylContact O-C 3.55Å; F152-A158 WeakPolarHBondContact O-CA 3.49Å; F152-V159 HydrophobicContact CB-CG2 4.18Å; F152-V159 VanDerWaalsContact O-CG2 3.25Å; F152-V159 WeakPolarHBondContact O-CG2 3.41Å; F152-V159 PolarHBondContact O-N 2.89Å; F152-Y160 HydrophobicContact CB-CD1 3.92Å; F152-Y160 HydrophobicContact CB-CD2 4.09Å; F152-Y160 HydrophobicContact CB-CE1 3.56Å; F152-Y160 HydrophobicContact CB-CE2 3.77Å; F152-Y160 HydrophobicContact CB-CG 4.15Å; F152-Y160 VanDerWaalsContact CB-CZ 3.46Å; F152-Y160 HydrophobicContact CD1-CE1 4.37Å; F152-Y160 AromaticContact CD1-CE2 3.94Å; F152-Y160 HydrophobicContact CD1-CE2 3.94Å; F152-Y160 AromaticContact CD1-CZ 3.56Å; F152-Y160 WeakPolarHBondContact CD1-OH 3.48Å; F152-Y160 AromaticContact CD2-CD2 3.54Å; F152-Y160 HydrophobicContact CD2-CD2 3.54Å; F152-Y160 HydrophobicContact CD2-CE1 4.43Å; F152-Y160 AromaticContact CD2-CE2 3.04Å; F152-Y160 HydrophobicContact CD2-CE2 3.04Å; F152-Y160 HydrophobicContact CD2-CG 4.4Å; F152-Y160 AromaticContact CD2-CZ 3.55Å; F152-Y160 HydrophobicContact CE1-CE2 4.25Å; F152-Y160 VanDerWaalsContact CE1-OH 3.32Å; F152-Y160 WeakPolarHBondContact CE1-OH 3.18Å; F152-Y160 HydrophobicContact CE2-CD2 4.18Å; F152-Y160 AromaticContact CE2-CE2 3.45Å; F152-Y160 HydrophobicContact CE2-CE2 3.45Å; F152-Y160 VanDerWaalsContact CE2-CE2 3.45Å; F152-Y160 HydrophobicContact CG-CD1 4.5Å; F152-Y160 AromaticContact CG-CD2 3.98Å; F152-Y160 HydrophobicContact CG-CD2 3.98Å; F152-Y160 AromaticContact CG-CE1 3.89Å; F152-Y160 HydrophobicContact CG-CE1 3.89Å; F152-Y160 AromaticContact CG-CE2 3.3Å; F152-Y160 HydrophobicContact CG-CE2 3.3Å; F152-Y160 AromaticContact CG-CZ 3.22Å; F152-Y160 VanDerWaalsContact CG-OH 3.24Å; F152-Y160 WeakPolarHBondContact CG-OH 3.34Å; F152-Y160 HydrophobicContact CZ-CE2 4.02Å; F152-Y160 PolarHBondContact N-O 2.87Å; F152-L171 HydrophobicContact CE2-CD1 3.9Å; F152-L171 HydrophobicContact CE2-CD2 4.44Å; F152-L171 HydrophobicContact CZ-CD1 4.41Å
153	Q	97.9	Very high	97	Very high	52 Å²	52	38.3 Å²	38.3	24%	0.243	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.6	-177.7	-67.1	-172.3	6.6	0	0	111.3	V29 I30 L32 V151 K157	V29-Q153 HydrophobicContact CG1-CB 4.36Å; V29-Q153 VanDerWaalsContact CG1-CD 3.41Å; V29-Q153 HydrophobicContact CG1-CG 3.8Å; I30-Q153 PolarHBondContact O-N 3.39Å; L32-Q153 VanDerWaalsContact CB-O 3.26Å; L32-Q153 WeakPolarHBondContact CB-O 3.45Å; L32-Q153 WeakPolarHBondContact CG-O 3.43Å; L32-Q153 PolarHBondContact N-O 2.99Å; V151-Q153 HydrophobicContact CG1-CG 4.04Å; Q153-K157 CarbonylContact C-O 3.58Å; Q153-K157 WeakPolarHBondContact CA-O 3.29Å
154	K	97.2	Very high	97.1	Very high	99 Å²	99	38.4 Å²	38.4	43%	0.43	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	132.2	171.5	-164.5	173.8	-173.4	165.7	0	108.5	L32 D33 G156 K157 V159	L32-K154 HydrophobicContact CB-CB 4.4Å; L32-K154 HydrophobicContact CB-CG 4.49Å; L32-K154 HydrophobicContact CD1-CB 4.47Å; D33-K154 WeakPolarHBondContact OD1-CG 3.32Å; K154-G156 PolarHBondContact O-N 3.32Å; K154-K157 PolarHBondContact N-O 3.04Å; K154-K157 PolarHBondContact O-N 3.06Å; K154-V159 HydrophobicContact CB-CG1 3.78Å; K154-V159 HydrophobicContact CB-CG2 4.33Å
155	N	97	Very high	97.1	Very high	128 Å²	128	37.8 Å²	37.8	68%	0.684	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	42.1	-170.6	-58.8	-61.2	0	0	0	112.7	D33 K157	D33-N155 PolarHBondContact OD1-N 3.47Å; D33-N155 VanDerWaalsContact OD2-CA 3.22Å; D33-N155 WeakPolarHBondContact OD2-CA 3.39Å; D33-N155 PolarHBondContact OD2-N 3.12Å; N155-K157 PolarHBondContact O-N 3.42Å
156	G	94.8	Very high	97.1	Very high	59 Å²	59	33 Å²	33	61%	0.608	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	10.2	-179.1	0	0	0	0	0	115.9	K154	K154-G156 PolarHBondContact O-N 3.32Å
157	K	95.6	Very high	96.9	Very high	156 Å²	156	33 Å²	33	68%	0.678	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115	137.7	178.3	-63.6	-177.2	-177.8	179	0	110.8	Q153 K154 N155 V159	Q153-K157 CarbonylContact C-O 3.58Å; Q153-K157 WeakPolarHBondContact CA-O 3.29Å; K154-K157 PolarHBondContact N-O 3.04Å; K154-K157 PolarHBondContact O-N 3.06Å; N155-K157 PolarHBondContact O-N 3.42Å; K157-V159 PolarHBondContact O-N 3.28Å
158	A	95.6	Very high	96.8	Very high	37 Å²	37	33 Å²	33	31%	0.306	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	123.3	171.6	0	0	0	0	0	110.1	V151 F152 Y161	V151-A158 HydrophobicContact CG1-CB 3.66Å; F152-A158 CarbonylContact O-C 3.55Å; F152-A158 WeakPolarHBondContact O-CA 3.49Å; A158-Y161 HydrophobicContact CB-CE1 4.25Å
159	V	97.5	Very high	96.7	Very high	48 Å²	48	33.1 Å²	33.1	29%	0.291	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-33.7	-179.4	-72.2	0	0	0	0	112.4	L32 F152 K154 K157 P177	L32-V159 HydrophobicContact CD1-CG2 3.72Å; F152-V159 HydrophobicContact CB-CG2 4.18Å; F152-V159 VanDerWaalsContact O-CG2 3.25Å; F152-V159 WeakPolarHBondContact O-CG2 3.41Å; F152-V159 PolarHBondContact O-N 2.89Å; K154-V159 HydrophobicContact CB-CG1 3.78Å; K154-V159 HydrophobicContact CB-CG2 4.33Å; K157-V159 PolarHBondContact O-N 3.28Å; V159-P177 VanDerWaalsContact O-CD 3.24Å; V159-P177 WeakPolarHBondContact O-CD 3.38Å
160	Y	98.6	Very high	96.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	165.9	170.9	63.5	-86.4	0	0	0	110.9	L32 F152 L171 M175 R215 L218 E219	L32-Y160 HydrophobicContact CD1-CE1 3.99Å; F152-Y160 HydrophobicContact CB-CD1 3.92Å; F152-Y160 HydrophobicContact CB-CD2 4.09Å; F152-Y160 HydrophobicContact CB-CE1 3.56Å; F152-Y160 HydrophobicContact CB-CE2 3.77Å; F152-Y160 HydrophobicContact CB-CG 4.15Å; F152-Y160 VanDerWaalsContact CB-CZ 3.46Å; F152-Y160 HydrophobicContact CD1-CE1 4.37Å; F152-Y160 AromaticContact CD1-CE2 3.94Å; F152-Y160 HydrophobicContact CD1-CE2 3.94Å; F152-Y160 AromaticContact CD1-CZ 3.56Å; F152-Y160 WeakPolarHBondContact CD1-OH 3.48Å; F152-Y160 AromaticContact CD2-CD2 3.54Å; F152-Y160 HydrophobicContact CD2-CD2 3.54Å; F152-Y160 HydrophobicContact CD2-CE1 4.43Å; F152-Y160 AromaticContact CD2-CE2 3.04Å; F152-Y160 HydrophobicContact CD2-CE2 3.04Å; F152-Y160 HydrophobicContact CD2-CG 4.4Å; F152-Y160 AromaticContact CD2-CZ 3.55Å; F152-Y160 HydrophobicContact CE1-CE2 4.25Å; F152-Y160 VanDerWaalsContact CE1-OH 3.32Å; F152-Y160 WeakPolarHBondContact CE1-OH 3.18Å; F152-Y160 HydrophobicContact CE2-CD2 4.18Å; F152-Y160 AromaticContact CE2-CE2 3.45Å; F152-Y160 HydrophobicContact CE2-CE2 3.45Å; F152-Y160 VanDerWaalsContact CE2-CE2 3.45Å; F152-Y160 HydrophobicContact CG-CD1 4.5Å; F152-Y160 AromaticContact CG-CD2 3.98Å; F152-Y160 HydrophobicContact CG-CD2 3.98Å; F152-Y160 AromaticContact CG-CE1 3.89Å; F152-Y160 HydrophobicContact CG-CE1 3.89Å; F152-Y160 AromaticContact CG-CE2 3.3Å; F152-Y160 HydrophobicContact CG-CE2 3.3Å; F152-Y160 AromaticContact CG-CZ 3.22Å; F152-Y160 VanDerWaalsContact CG-OH 3.24Å; F152-Y160 WeakPolarHBondContact CG-OH 3.34Å; F152-Y160 HydrophobicContact CZ-CE2 4.02Å; F152-Y160 PolarHBondContact N-O 2.87Å; Y160-L171 HydrophobicContact CD2-CD1 4.23Å; Y160-L171 HydrophobicContact CE2-CD1 3.85Å; Y160-M175 WeakPolarHBondContact CA-O 3.45Å; Y160-R215 HydrophobicContact CE2-CG 4.21Å; Y160-R215 PolarHBondContact OH-NE 3.39Å; Y160-L218 HydrophobicContact CD2-CB 3.76Å; Y160-L218 HydrophobicContact CD2-CD1 4.34Å; Y160-L218 HydrophobicContact CE2-CB 4.33Å; Y160-L218 HydrophobicContact CG-CB 3.96Å; Y160-E219 HydrophobicContact CD1-CB 4.09Å; Y160-E219 HydrophobicContact CD1-CG 4.48Å; Y160-E219 HydrophobicContact CE1-CB 3.58Å; Y160-E219 HydrophobicContact CE1-CG 3.85Å
161	Y	98.4	Very high	96.5	Very high	57 Å²	57	32 Å²	32	22%	0.224	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	153.7	-176.3	-54.5	-89.6	0	0	0	110.4	L150 V151 A158 G174 M175 P177	L150-Y161 VanDerWaalsContact O-CA 3.31Å; L150-Y161 WeakPolarHBondContact O-CA 3.43Å; V151-Y161 HydrophobicContact CB-CD1 4.49Å; V151-Y161 HydrophobicContact CG1-CD1 4.33Å; V151-Y161 HydrophobicContact CG1-CE1 4Å; V151-Y161 HydrophobicContact CG2-CD1 3.97Å; V151-Y161 HydrophobicContact CG2-CE1 4.07Å; A158-Y161 HydrophobicContact CB-CE1 4.25Å; Y161-G174 CarbonylContact O-C 3.51Å; Y161-G174 WeakPolarHBondContact O-CA 3.36Å; Y161-M175 HydrophobicContact CD2-CE 3.56Å; Y161-M175 HydrophobicContact CE2-CE 4.02Å; Y161-M175 HydrophobicContact CG-CE 4.26Å; Y161-M175 PolarHBondContact N-O 2.98Å; Y161-M175 PolarHBondContact O-N 2.89Å; Y161-P177 HydrophobicContact CE2-CB 4.07Å; Y161-P177 HydrophobicContact CE2-CG 4.04Å
162	G	98.3	Very high	96.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	165.6	174.5	0	0	0	0	0	113.1	N149 L150 T173	N149-G162 CarbonylContact C-O 3.5Å; N149-G162 WeakPolarHBondContact CA-O 3.48Å; L150-G162 PolarHBondContact N-O 2.78Å; L150-G162 PolarHBondContact O-N 3.08Å; G162-T173 VanDerWaalsContact CA-O 3.3Å; G162-T173 WeakPolarHBondContact CA-O 3.45Å
163	T	98.4	Very high	96.5	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.6	165.5	-55.4	0	0	0	0	107.6	T147 M148 N149 T173 Y331 Y343 T345	T147-T163 HydrophobicContact CG2-CG2 3.93Å; M148-T163 WeakPolarHBondContact O-CA 3.48Å; N149-T163 PolarHBondContact OD1-OG1 2.88Å; T163-T173 PolarHBondContact N-O 2.99Å; T163-Y331 HydrophobicContact CG2-CD1 4.13Å; T163-Y331 HydrophobicContact CG2-CD2 4.11Å; T163-Y331 HydrophobicContact CG2-CE1 3.88Å; T163-Y331 HydrophobicContact CG2-CE2 3.88Å; T163-Y331 HydrophobicContact CG2-CG 4.25Å; T163-Y343 PolarHBondContact N-OH 3.46Å; T163-Y343 VanDerWaalsContact N-OH 3.07Å; T163-Y343 WeakPolarHBondContact OG1-CE1 3.34Å; T163-Y343 PolarHBondContact OG1-OH 3.09Å; T163-T345 HydrophobicContact CG2-CG2 3.73Å; T163-T345 PolarHBondContact OG1-OG1 3.45Å
164	S	96.5	Very high	96.5	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.021	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	-173.3	-176.2	-158.6	0	0	0	0	111.7	T147 M148 Y168 G170	T147-S164 WeakPolarHBondContact CA-O 3.42Å; M148-S164 PolarHBondContact N-O 2.73Å; M148-S164 PolarHBondContact O-N 2.79Å; S164-Y168 WeakPolarHBondContact OG-CD1 3.5Å; S164-G170 PolarHBondContact OG-O 2.85Å
165	F	96	Very high	96.6	Very high	5 Å²	5	24 Å²	24	2%	0.022	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.4	175.3	-55.6	-56.8	0	0	0	110.9	Y112 L136 L143 M146 T147 M148 G167 Y168 I330 Y331	Y112-F165 HydrophobicContact CD1-CD2 4.05Å; Y112-F165 HydrophobicContact CD1-CE2 4.33Å; Y112-F165 AromaticContact CE1-CD2 3.68Å; Y112-F165 HydrophobicContact CE1-CD2 3.68Å; Y112-F165 HydrophobicContact CE1-CE2 4.18Å; Y112-F165 HydrophobicContact CE1-CG 4.5Å; L136-F165 HydrophobicContact CD1-CZ 4.37Å; L136-F165 HydrophobicContact CD2-CE2 4.34Å; L136-F165 HydrophobicContact CD2-CZ 3.84Å; L143-F165 HydrophobicContact CB-CD1 4.09Å; L143-F165 HydrophobicContact CB-CE1 3.8Å; L143-F165 HydrophobicContact CB-CZ 4.12Å; L143-F165 HydrophobicContact CD1-CD2 4.46Å; L143-F165 HydrophobicContact CD1-CE1 4.47Å; L143-F165 HydrophobicContact CD1-CE2 3.99Å; L143-F165 HydrophobicContact CD1-CZ 4Å; L143-F165 HydrophobicContact CD2-CB 4.37Å; L143-F165 HydrophobicContact CD2-CD1 4.13Å; L143-F165 HydrophobicContact CD2-CD2 4.07Å; L143-F165 HydrophobicContact CD2-CE1 4.47Å; L143-F165 HydrophobicContact CD2-CE2 4.39Å; L143-F165 HydrophobicContact CD2-CG 3.93Å; L143-F165 HydrophobicContact CG-CE1 4.48Å; L143-F165 HydrophobicContact CG-CZ 4.48Å; M146-F165 HydrophobicContact CB-CB 4.41Å; M146-F165 CarbonylContact O-C 3.53Å; M146-F165 VanDerWaalsContact O-CA 3.3Å; M146-F165 WeakPolarHBondContact O-CA 3.49Å; T147-F165 WeakPolarHBondContact OG1-CE1 3.41Å; M148-F165 VanDerWaalsContact CE-C 3.45Å; M148-F165 VanDerWaalsContact CE-O 3.29Å; M148-F165 WeakPolarHBondContact CE-O 3.41Å; F165-G167 PolarHBondContact O-N 3.41Å; F165-G167 VanDerWaalsContact O-N 3.16Å; F165-Y168 WeakPolarHBondContact O-CB 3.3Å; F165-Y168 PolarHBondContact O-N 3.07Å; F165-I330 HydrophobicContact CE1-CG2 3.87Å; F165-I330 HydrophobicContact CZ-CG2 4.27Å; F165-Y331 HydrophobicContact CE1-CD1 4.21Å; F165-Y331 HydrophobicContact CE1-CE1 4.09Å; F165-Y331 HydrophobicContact CZ-CD1 4.4Å; F165-Y331 AromaticContact CZ-CE1 3.99Å; F165-Y331 HydrophobicContact CZ-CE1 3.99Å
166	A	94.4	Very high	96.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	119.8	173	0	0	0	0	0	110	L43 F47 L52 M146 M148	L43-A166 HydrophobicContact CD1-CB 4.42Å; L43-A166 HydrophobicContact CD2-CB 4.28Å; F47-A166 HydrophobicContact CD2-CB 4.07Å; F47-A166 HydrophobicContact CE2-CB 3.98Å; F47-A166 HydrophobicContact CG-CB 4.49Å; F47-A166 HydrophobicContact CZ-CB 4.34Å; L52-A166 HydrophobicContact CD1-CB 3.92Å; L52-A166 HydrophobicContact CD2-CB 3.59Å; L52-A166 HydrophobicContact CG-CB 4.43Å; M146-A166 HydrophobicContact CB-CB 4.48Å; M146-A166 WeakPolarHBondContact CE-O 3.12Å; M146-A166 PolarHBondContact O-N 2.85Å; M148-A166 HydrophobicContact CE-CB 4.47Å; M148-A166 HydrophobicContact SD-CB 4.28Å
167	G	90.9	Very high	96.8	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.01	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.4	-1.7	-171.5	0	0	0	0	0	115	N109 F165	N109-G167 PolarHBondContact ND2-O 2.73Å; F165-G167 PolarHBondContact O-N 3.41Å; F165-G167 VanDerWaalsContact O-N 3.16Å
168	Y	94.6	Very high	97	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.008	8%	0.081	C	C	.	.			trans	-121	129.2	-179.7	-172.4	-133.2	0	0	0	112.6	N109 Y112 E113 S164 F165 W172 S211	N109-Y168 HydrophobicContact CB-CD2 4.22Å; N109-Y168 HydrophobicContact CB-CE2 4.43Å; N109-Y168 WeakPolarHBondContact O-CE2 3.39Å; N109-Y168 WeakPolarHBondContact OD1-CA 3.47Å; N109-Y168 WeakPolarHBondContact OD1-CD2 3.42Å; Y112-Y168 HydrophobicContact CD2-CD1 4.28Å; Y112-Y168 AromaticContact CD2-CD2 3.33Å; Y112-Y168 HydrophobicContact CD2-CD2 3.33Å; Y112-Y168 AromaticContact CD2-CE2 3.79Å; Y112-Y168 HydrophobicContact CD2-CE2 3.79Å; Y112-Y168 AromaticContact CD2-CG 3.61Å; Y112-Y168 HydrophobicContact CD2-CG 3.61Å; Y112-Y168 HydrophobicContact CE2-CD2 4.07Å; Y112-Y168 HydrophobicContact CE2-CG 4.04Å; Y112-Y168 HydrophobicContact CG-CD2 4.06Å; Y112-Y168 HydrophobicContact CG-CE2 4.11Å; Y112-Y168 HydrophobicContact CG-CG 4.25Å; E113-Y168 PolarHBondContact OE1-OH 3.3Å; S164-Y168 WeakPolarHBondContact OG-CD1 3.5Å; F165-Y168 WeakPolarHBondContact O-CB 3.3Å; F165-Y168 PolarHBondContact O-N 3.07Å; Y168-W172 AromaticContact CE1-CD1 3.72Å; Y168-W172 AromaticContact CE1-NE1 3.97Å; Y168-W172 AromaticContact CZ-NE1 3.94Å; Y168-W172 PolarHBondContact OH-NE1 2.9Å; Y168-S211 WeakPolarHBondContact OH-CB 3.43Å; Y168-S211 PolarHBondContact OH-OG 2.85Å
169	V	95.9	Very high	97.1	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.081	C	C	.	.			trans	-90.4	-16.4	-178.1	-55	0	0	0	0	113.6	W40 Y87 E90 I91 L94 N109 W212 R215	W40-V169 HydrophobicContact CZ2-CB 4.4Å; W40-V169 HydrophobicContact CZ2-CG1 4.39Å; Y87-V169 HydrophobicContact CD1-CB 4.22Å; Y87-V169 HydrophobicContact CD1-CG2 3.6Å; Y87-V169 HydrophobicContact CE1-CG2 4.3Å; E90-V169 HydrophobicContact CB-CG1 3.87Å; I91-V169 HydrophobicContact CD1-CG2 4.37Å; I91-V169 HydrophobicContact CG1-CG1 3.89Å; I91-V169 HydrophobicContact CG1-CG2 4.18Å; L94-V169 HydrophobicContact CD1-CG1 3.39Å; N109-V169 WeakPolarHBondContact OD1-CG2 3.44Å; N109-V169 PolarHBondContact OD1-N 2.92Å; V169-W212 HydrophobicContact CG2-CZ2 4.14Å; V169-R215 WeakPolarHBondContact O-CD 3.38Å; V169-R215 PolarHBondContact O-NH1 2.77Å
170	G	95.3	Very high	97.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.068	C	C	.	.			trans	-80.3	168	-179.9	0	0	0	0	0	113.4	S164 S211	S164-G170 PolarHBondContact OG-O 2.85Å; G170-S211 WeakPolarHBondContact CA-OG 3.44Å
171	L	97.3	Very high	97.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.068	C	C	.	.			trans	-126.8	125	170.8	-71.1	-179.8	0	0	0	110.7	L150 F152 Y160 S211 V214 R215 L218	L150-L171 HydrophobicContact CD1-CD2 4.06Å; F152-L171 HydrophobicContact CE2-CD1 3.9Å; F152-L171 HydrophobicContact CE2-CD2 4.44Å; F152-L171 HydrophobicContact CZ-CD1 4.41Å; Y160-L171 HydrophobicContact CD2-CD1 4.23Å; Y160-L171 HydrophobicContact CE2-CD1 3.85Å; L171-S211 PolarHBondContact N-O 2.94Å; L171-S211 VanDerWaalsContact N-O 3.09Å; L171-S211 WeakPolarHBondContact O-CA 3.45Å; L171-S211 VanDerWaalsContact O-O 3.07Å; L171-V214 HydrophobicContact CB-CG1 4.16Å; L171-V214 WeakPolarHBondContact O-CB 3.44Å; L171-V214 WeakPolarHBondContact O-CG1 3.4Å; L171-R215 HydrophobicContact CB-CB 4.23Å; L171-R215 HydrophobicContact CD1-CB 4.16Å; L171-R215 HydrophobicContact CD1-CG 4.16Å; L171-R215 HydrophobicContact CG-CB 4.19Å; L171-R215 HydrophobicContact CG-CG 4.45Å; L171-L218 HydrophobicContact CB-CD1 4.46Å; L171-L218 HydrophobicContact CD1-CD1 3.59Å
172	W	97.3	Very high	97.2	Very high	7 Å²	7	11.1 Å²	11.1	3%	0.027	6%	0.057	C	C	.	.	S	Bend	trans	-96.6	-16.5	167.3	-77	104.7	0	0	0	112.8	Y112 L136 Y168 S183 G184 V210 V240	Y112-W172 PolarHBondContact O-NE1 2.83Å; L136-W172 HydrophobicContact CD1-CB 4.27Å; Y168-W172 AromaticContact CE1-CD1 3.72Å; Y168-W172 AromaticContact CE1-NE1 3.97Å; Y168-W172 AromaticContact CZ-NE1 3.94Å; Y168-W172 PolarHBondContact OH-NE1 2.9Å; W172-S183 CarbonylContact O-C 3.49Å; W172-S183 VanDerWaalsContact O-CA 3.24Å; W172-S183 WeakPolarHBondContact O-CA 3.14Å; W172-G184 PolarHBondContact O-N 2.76Å; W172-V210 HydrophobicContact CH2-CB 4.46Å; W172-V210 HydrophobicContact CH2-CG2 3.19Å; W172-V210 HydrophobicContact CZ2-CG2 3.57Å; W172-V210 HydrophobicContact CZ3-CG2 3.85Å; W172-V240 HydrophobicContact CH2-CG2 4.27Å; W172-V240 HydrophobicContact CZ3-CG2 3.75Å
173	T	98.6	Very high	97.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	130	-178.4	-51.8	0	0	0	0	108.5	R134 G162 T163 I182 Y331 T333 M335	R134-T173 WeakPolarHBondContact CD-OG1 3.27Å; R134-T173 HydrophobicContact CG-CG2 4.05Å; G162-T173 VanDerWaalsContact CA-O 3.3Å; G162-T173 WeakPolarHBondContact CA-O 3.45Å; T163-T173 PolarHBondContact N-O 2.99Å; T173-I182 WeakPolarHBondContact CA-O 3.3Å; T173-Y331 PolarHBondContact OG1-OH 3.31Å; T173-T333 HydrophobicContact CG2-CG2 3.83Å; T173-M335 HydrophobicContact CG2-CE 4.02Å; T173-M335 HydrophobicContact CG2-SD 4.36Å
174	G	98.5	Very high	97.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	175.7	174.9	0	0	0	0	0	114.6	Y161 T181 I182	Y161-G174 CarbonylContact O-C 3.51Å; Y161-G174 WeakPolarHBondContact O-CA 3.36Å; G174-T181 WeakPolarHBondContact O-CA 3.47Å; G174-I182 PolarHBondContact N-O 3.25Å; G174-I182 PolarHBondContact O-N 3.02Å
175	M	98.7	Very high	97.1	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	132.1	-176.3	178.6	-176	71.4	0	0	111	Y160 Y161 F180 T181 M335 A337 P340 Y343	Y160-M175 WeakPolarHBondContact CA-O 3.45Å; Y161-M175 HydrophobicContact CD2-CE 3.56Å; Y161-M175 HydrophobicContact CE2-CE 4.02Å; Y161-M175 HydrophobicContact CG-CE 4.26Å; Y161-M175 PolarHBondContact N-O 2.98Å; Y161-M175 PolarHBondContact O-N 2.89Å; M175-F180 WeakPolarHBondContact CA-O 3.46Å; M175-T181 HydrophobicContact CB-CG2 3.98Å; M175-T181 HydrophobicContact CG-CG2 3.65Å; M175-T181 HydrophobicContact SD-CG2 4.1Å; M175-M335 HydrophobicContact CB-SD 4.35Å; M175-M335 HydrophobicContact SD-CB 4.39Å; M175-A337 HydrophobicContact CG-CB 4.34Å; M175-P340 HydrophobicContact CE-CB 3.75Å; M175-P340 WeakPolarHBondContact CE-O 3.08Å; M175-Y343 HydrophobicContact CB-CD2 3.65Å; M175-Y343 HydrophobicContact CB-CE2 3.87Å; M175-Y343 HydrophobicContact CE-CD2 3.92Å; M175-Y343 HydrophobicContact CE-CG 4.23Å; M175-Y343 HydrophobicContact SD-CD2 4.15Å
176	S	98.7	Very high	96.9	Very high	3 Å²	3	11.3 Å²	11.3	2%	0.021	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	115.6	166.4	-161.6	0	0	0	0	108.1	N178 K179 F180 L218	S176-N178 PolarHBondContact O-N 2.94Å; S176-K179 PolarHBondContact O-N 3.03Å; S176-K179 VanDerWaalsContact O-N 3.11Å; S176-K179 WeakPolarHBondContact OG-CD 3.34Å; S176-F180 PolarHBondContact N-O 3.19Å; S176-F180 PolarHBondContact O-N 3.46Å; S176-F180 VanDerWaalsContact O-N 3.15Å; S176-F180 VanDerWaalsContact O-O 3.12Å; S176-L218 PolarHBondContact OG-O 3.33Å
177	P	98.3	Very high	96.8	Very high	28 Å²	28	12.9 Å²	12.9	18%	0.182	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	133.2	-168.8	24.3	-33.1	0	0	0	111.8	V159 Y161 K179 P340	V159-P177 VanDerWaalsContact O-CD 3.24Å; V159-P177 WeakPolarHBondContact O-CD 3.38Å; Y161-P177 HydrophobicContact CE2-CB 4.07Å; Y161-P177 HydrophobicContact CE2-CG 4.04Å; P177-K179 PolarHBondContact O-N 2.9Å; P177-P340 HydrophobicContact CB-CB 3.73Å; P177-P340 HydrophobicContact CB-CG 3.58Å
178	N	98.4	Very high	96.1	Very high	109 Å²	109	15.4 Å²	15.4	58%	0.583	9%	0.09	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	16.4	-178.3	-46.5	-59.4	0	0	0	114.4	S176 V247 A337	S176-N178 PolarHBondContact O-N 2.94Å; N178-V247 VanDerWaalsContact C-CG1 3.43Å; N178-A337 WeakPolarHBondContact CA-O 3.3Å; N178-A337 PolarHBondContact N-O 3Å
179	K	98.7	Very high	94.5	Very high	71 Å²	71	21.1 Å²	21.1	31%	0.309	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-71.9	178.1	-63.7	179.5	172	-172.7	0	111.7	S176 P177 A221 E222 V247	S176-K179 PolarHBondContact O-N 3.03Å; S176-K179 VanDerWaalsContact O-N 3.11Å; S176-K179 WeakPolarHBondContact OG-CD 3.34Å; P177-K179 PolarHBondContact O-N 2.9Å; K179-A221 PolarHBondContact NZ-O 2.74Å; K179-E222 VanDerWaalsContact CD-O 3.25Å; K179-E222 WeakPolarHBondContact CD-O 3.46Å; K179-E222 WeakPolarHBondContact CE-O 3.29Å; K179-V247 WeakPolarHBondContact O-CG1 3.3Å
180	F	98.9	Very high	92.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	167.3	-175.4	55.5	-93.7	0	0	0	112.8	M175 S176 I182 T217 L218 A221 D223 F224 A227 V244 G245	M175-F180 WeakPolarHBondContact CA-O 3.46Å; S176-F180 PolarHBondContact N-O 3.19Å; S176-F180 PolarHBondContact O-N 3.46Å; S176-F180 VanDerWaalsContact O-N 3.15Å; S176-F180 VanDerWaalsContact O-O 3.12Å; F180-I182 HydrophobicContact CD2-CD1 3.76Å; F180-I182 HydrophobicContact CD2-CG1 3.83Å; F180-I182 HydrophobicContact CE2-CD1 3.52Å; F180-I182 HydrophobicContact CE2-CG1 4.12Å; F180-T217 HydrophobicContact CE2-CG2 4.19Å; F180-T217 HydrophobicContact CZ-CG2 4.27Å; F180-T217 WeakPolarHBondContact CZ-O 3.4Å; F180-L218 HydrophobicContact CD2-CD2 4.35Å; F180-L218 HydrophobicContact CE2-CD2 3.81Å; F180-L218 HydrophobicContact CE2-CG 4.43Å; F180-A221 HydrophobicContact CE1-CB 3.78Å; F180-A221 HydrophobicContact CZ-CB 3.72Å; F180-D223 VanDerWaalsContact CD1-C 3.49Å; F180-D223 WeakPolarHBondContact CD1-O 3.42Å; F180-D223 WeakPolarHBondContact CE1-O 3.3Å; F180-F224 HydrophobicContact CB-CB 4.44Å; F180-F224 HydrophobicContact CB-CD2 4.41Å; F180-A227 HydrophobicContact CD1-CB 3.8Å; F180-A227 HydrophobicContact CD2-CB 3.95Å; F180-A227 HydrophobicContact CE1-CB 3.78Å; F180-A227 HydrophobicContact CE2-CB 3.9Å; F180-A227 HydrophobicContact CG-CB 3.92Å; F180-A227 HydrophobicContact CZ-CB 3.86Å; F180-V244 HydrophobicContact CB-CG1 4.24Å; F180-G245 CarbonylContact C-O 3.59Å; F180-G245 WeakPolarHBondContact CA-O 3.18Å
181	T	98.9	Very high	90.8	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.2	176.2	49.7	0	0	0	0	108.6	H132 G174 M175 V244 G245 M335 A337	H132-T181 WeakPolarHBondContact CB-OG1 3.14Å; H132-T181 WeakPolarHBondContact ND1-CB 3.47Å; H132-T181 PolarHBondContact ND1-OG1 2.86Å; G174-T181 WeakPolarHBondContact O-CA 3.47Å; M175-T181 HydrophobicContact CB-CG2 3.98Å; M175-T181 HydrophobicContact CG-CG2 3.65Å; M175-T181 HydrophobicContact SD-CG2 4.1Å; T181-V244 VanDerWaalsContact O-CA 3.27Å; T181-V244 WeakPolarHBondContact O-CA 3.25Å; T181-V244 WeakPolarHBondContact O-CG1 3.3Å; T181-G245 PolarHBondContact N-O 2.85Å; T181-G245 PolarHBondContact O-N 3.41Å; T181-G245 WeakPolarHBondContact OG1-CA 3.43Å; T181-G245 PolarHBondContact OG1-N 2.93Å; T181-G245 PolarHBondContact OG1-O 2.78Å; T181-M335 HydrophobicContact CG2-CB 3.93Å; T181-M335 HydrophobicContact CG2-CE 4.5Å; T181-M335 HydrophobicContact CG2-CG 3.62Å; T181-M335 HydrophobicContact CG2-SD 3.75Å; T181-A337 HydrophobicContact CG2-CB 4.05Å
182	I	98.9	Very high	88.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136	178.4	-58.4	164.3	0	0	0	109.8	T173 G174 F180 V214 T217 L218 L231 I243 V244	T173-I182 WeakPolarHBondContact CA-O 3.3Å; G174-I182 PolarHBondContact N-O 3.25Å; G174-I182 PolarHBondContact O-N 3.02Å; F180-I182 HydrophobicContact CD2-CD1 3.76Å; F180-I182 HydrophobicContact CD2-CG1 3.83Å; F180-I182 HydrophobicContact CE2-CD1 3.52Å; F180-I182 HydrophobicContact CE2-CG1 4.12Å; I182-V214 HydrophobicContact CB-CG1 4.07Å; I182-V214 HydrophobicContact CD1-CG1 4.42Å; I182-V214 HydrophobicContact CG2-CB 4.43Å; I182-V214 HydrophobicContact CG2-CG1 3.76Å; I182-V214 HydrophobicContact CG2-CG2 3.92Å; I182-T217 HydrophobicContact CD1-CG2 3.78Å; I182-L218 HydrophobicContact CD1-CD2 4.15Å; I182-L218 HydrophobicContact CD1-CG 4.12Å; I182-L231 HydrophobicContact CD1-CD1 3.82Å; I182-L231 HydrophobicContact CG1-CD1 4.14Å; I182-L231 HydrophobicContact CG2-CD1 4.33Å; I182-I243 WeakPolarHBondContact CA-O 3.44Å; I182-V244 HydrophobicContact CG1-CG1 4.24Å; I182-V244 HydrophobicContact CG1-CG2 4.39Å
183	S	98.8	Very high	87	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.1	158.5	63.3	0	0	0	0	110.3	S120 H132 W172 I243	S120-S183 VanDerWaalsContact CB-OG 3.3Å; S120-S183 WeakPolarHBondContact CB-OG 3.4Å; S120-S183 PolarHBondContact OG-OG 3.08Å; H132-S183 PolarHBondContact CE1-N 3.45Å; H132-S183 PolarHBondContact NE2-OG 2.77Å; W172-S183 CarbonylContact O-C 3.49Å; W172-S183 VanDerWaalsContact O-CA 3.24Å; W172-S183 WeakPolarHBondContact O-CA 3.14Å; S183-I243 PolarHBondContact N-O 2.81Å; S183-I243 PolarHBondContact O-N 2.93Å
184	G	97.3	Very high	85.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.2	177.9	0	0	0	0	0	111.9	R134 W172 Y241	R134-G184 PolarHBondContact NH2-O 2.94Å; W172-G184 PolarHBondContact O-N 2.76Å; G184-Y241 CarbonylContact C-O 3.19Å; G184-Y241 WeakPolarHBondContact CA-O 3.47Å
185	D	95.7	Very high	83.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.2	179.2	-65.5	13.9	0	0	0	109.8	C118 S120 R134 R187 V240 Y241 I243 T280	C118-D185 HydrophobicContact CB-CB 3.63Å; C118-D185 VanDerWaalsContact CB-OD1 3.24Å; C118-D185 WeakPolarHBondContact CB-OD1 3.33Å; C118-D185 WeakPolarHBondContact CB-OD2 3.49Å; S120-D185 WeakPolarHBondContact CB-OD2 3.28Å; S120-D185 PolarHBondContact N-OD2 2.89Å; S120-D185 VanDerWaalsContact OG-CG 3.32Å; S120-D185 PolarHBondContact OG-OD1 3.16Å; S120-D185 PolarHBondContact OG-OD2 3.41Å; R134-D185 IonicContact CZ-OD1 2.9Å; R134-D185 IonicContact NH2-OD1 3.86Å; R134-D185 PolarHBondContact NH2-OD1 3.38Å; D185-R187 PolarHBondContact O-N 2.9Å; D185-V240 CarbonylContact O-C 3.47Å; D185-V240 VanDerWaalsContact O-CG2 3.3Å; D185-V240 WeakPolarHBondContact O-CG2 3.23Å; D185-Y241 HydrophobicContact CB-CD2 4.1Å; D185-Y241 PolarHBondContact N-O 3.34Å; D185-Y241 WeakPolarHBondContact O-CD2 3.38Å; D185-Y241 PolarHBondContact O-N 3Å; D185-I243 HydrophobicContact CB-CD1 4.32Å; D185-T280 WeakPolarHBondContact CB-O 2.96Å
186	Q	91.1	Very high	82	Confident	14 Å²	14	47.9 Å²	47.9	7%	0.065	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	135.2	-177	-176.1	56.1	38.3	0	0	111.6	E113 A116 G239 Y241 N281	E113-Q186 PolarHBondContact O-OE1 2.69Å; A116-Q186 WeakPolarHBondContact O-CB 3.49Å; Q186-G239 PolarHBondContact NE2-O 3.44Å; Q186-G239 VanDerWaalsContact NE2-O 3.12Å; Q186-Y241 WeakPolarHBondContact O-CE2 3.43Å; Q186-N281 PolarHBondContact N-ND2 2.89Å; Q186-N281 PolarHBondContact O-ND2 3.39Å
187	R	91.3	Very high	80.4	Confident	32 Å²	32	52.6 Å²	52.6	12%	0.121	26%	0.256	C	S	.	.			trans	-114.1	140	172.3	-180	166.5	-173.6	-93.7	-4.4	111.7	D185 G239 Y241 R257 D258 D283	D185-R187 PolarHBondContact O-N 2.9Å; R187-G239 PolarHBondContact N-O 3.37Å; R187-Y241 HydrophobicContact CB-CD2 3.85Å; R187-Y241 HydrophobicContact CB-CE1 4.32Å; R187-Y241 HydrophobicContact CB-CE2 3.4Å; R187-Y241 VanDerWaalsContact CB-CE2 3.4Å; R187-Y241 HydrophobicContact CB-CG 4.46Å; R187-Y241 HydrophobicContact CG-CE1 4.05Å; R187-Y241 HydrophobicContact CG-CE2 3.81Å; R187-Y241 VanDerWaalsContact CG-CZ 3.5Å; R187-Y241 WeakPolarHBondContact CG-OH 3.28Å; R187-R257 PolarHBondContact NH1-O 3.38Å; R187-D258 IonicContact CZ-OD1 3.93Å; R187-D258 IonicContact NH1-OD1 2.94Å; R187-D258 PolarHBondContact NH1-OD1 3.1Å; R187-D258 IonicContact NH1-OD2 2.71Å; R187-D283 IonicContact CZ-OD1 2.79Å; R187-D283 IonicContact CZ-OD2 3.38Å; R187-D283 IonicContact NE-OD1 3.48Å; R187-D283 PolarHBondContact NE-OD1 2.86Å; R187-D283 IonicContact NE-OD2 3.88Å; R187-D283 IonicContact NH2-OD1 2.6Å; R187-D283 PolarHBondContact NH2-OD1 3.25Å; R187-D283 IonicContact NH2-OD2 3.26Å; R187-D283 PolarHBondContact NH2-OD2 2.93Å
188	G	76.1	Confident	78.8	Confident	55 Å²	55	51.2 Å²	51.2	57%	0.567	25%	0.248	S	C	*	.	S	Bend	trans	85.6	172.8	175.8	0	0	0	0	0	114.2
189	T	61.6	Low	77.2	Confident	122 Å²	122	46.2 Å²	46.2	75%	0.748	22%	0.221	S	C	*	.			trans	-99	25.8	-177.9	55.2	0	0	0	0	112.1	H191	T189-H191 PolarHBondContact O-CD2 3.32Å; T189-H191 PolarHBondContact O-N 2.93Å
190	E	57.4	Low	75.6	Confident	45 Å²	45	44.8 Å²	44.8	21%	0.21	22%	0.218	C	C	.	.			trans	-62.5	99	-178.2	-72	-160.7	-169.9	0	0	110.3	N198 T238 R259	E190-N198 PolarHBondContact OE2-ND2 3.34Å; E190-T238 VanDerWaalsContact CD-OG1 3.29Å; E190-T238 PolarHBondContact OE2-OG1 3.24Å; E190-R259 IonicContact OE1-CZ 2.84Å; E190-R259 IonicContact OE1-NE 3.72Å; E190-R259 PolarHBondContact OE1-NE 3.41Å; E190-R259 IonicContact OE1-NH2 3.8Å; E190-R259 PolarHBondContact OE1-NH2 3.13Å; E190-R259 IonicContact OE2-CZ 3.59Å; E190-R259 IonicContact OE2-NH2 2.7Å; E190-R259 PolarHBondContact OE2-NH2 3.37Å
191	H	56.9	Low	74	Confident	96 Å²	96	45 Å²	45	44%	0.444	22%	0.219	S	C	.	.			trans	-74.7	156.2	176.4	-62.9	-73.7	0	0	0	111.4	T189 W193 N194	T189-H191 PolarHBondContact O-CD2 3.32Å; T189-H191 PolarHBondContact O-N 2.93Å; H191-W193 HydrophobicContact CB-CD2 3.71Å; H191-W193 HydrophobicContact CB-CG 4.01Å; H191-W193 HydrophobicContact CB-CH2 4.22Å; H191-W193 HydrophobicContact CB-CZ2 3.4Å; H191-W193 AromaticContact CD2-CE2 3.76Å; H191-W193 AromaticContact CD2-CZ2 3.58Å; H191-W193 AromaticContact CD2-NE1 3.52Å; H191-W193 AromaticContact CG-CE2 3.44Å; H191-W193 VanDerWaalsContact CG-CE2 3.44Å; H191-W193 AromaticContact CG-CZ2 3.24Å; H191-W193 AromaticContact CG-NE1 3.52Å; H191-W193 AromaticContact ND1-CZ2 3.55Å; H191-W193 PolarHBondContact O-N 3.45Å; H191-N194 PolarHBondContact O-N 2.81Å
192	W	57.8	Low	72.5	Confident	66 Å²	66	45.3 Å²	45.3	25%	0.25	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-54.1	-25.2	-178.9	77.4	-96.9	0	0	0	113.6	P65 V68 N194 W195	P65-W192 HydrophobicContact CB-CH2 4.44Å; P65-W192 HydrophobicContact CG-CH2 3.38Å; P65-W192 HydrophobicContact CG-CZ2 3.15Å; P65-W192 HydrophobicContact CG-CZ3 4.24Å; V68-W192 HydrophobicContact CB-CH2 4.43Å; V68-W192 HydrophobicContact CB-CZ3 4.1Å; V68-W192 HydrophobicContact CG1-CZ3 3.9Å; V68-W192 HydrophobicContact CG2-CH2 3.62Å; V68-W192 HydrophobicContact CG2-CZ3 3.67Å; W192-N194 PolarHBondContact O-N 3.38Å; W192-N194 VanDerWaalsContact O-N 3.15Å; W192-W195 WeakPolarHBondContact O-CB 3.35Å; W192-W195 PolarHBondContact O-N 3.01Å
193	W	57.4	Low	71	Confident	136 Å²	136	45.6 Å²	45.6	52%	0.515	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-63.9	-17.5	175.7	32.3	83.7	0	0	0	114.2	H191 W196	H191-W193 HydrophobicContact CB-CD2 3.71Å; H191-W193 HydrophobicContact CB-CG 4.01Å; H191-W193 HydrophobicContact CB-CH2 4.22Å; H191-W193 HydrophobicContact CB-CZ2 3.4Å; H191-W193 AromaticContact CD2-CE2 3.76Å; H191-W193 AromaticContact CD2-CZ2 3.58Å; H191-W193 AromaticContact CD2-NE1 3.52Å; H191-W193 AromaticContact CG-CE2 3.44Å; H191-W193 VanDerWaalsContact CG-CE2 3.44Å; H191-W193 AromaticContact CG-CZ2 3.24Å; H191-W193 AromaticContact CG-NE1 3.52Å; H191-W193 AromaticContact ND1-CZ2 3.55Å; H191-W193 PolarHBondContact O-N 3.45Å; W193-W196 VanDerWaalsContact O-CD1 3.28Å; W193-W196 PolarHBondContact O-NE1 3.11Å
194	N	63.7	Low	69.5	Low	48 Å²	48	50.1 Å²	50.1	26%	0.257	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-91.8	-0.7	170.9	-72.4	-44.7	0	0	0	113.6	H191 W192 W196 K197 N198	H191-N194 PolarHBondContact O-N 2.81Å; W192-N194 PolarHBondContact O-N 3.38Å; W192-N194 VanDerWaalsContact O-N 3.15Å; N194-W196 VanDerWaalsContact C-N 3.26Å; N194-W196 PolarHBondContact O-N 3.19Å; N194-K197 WeakPolarHBondContact O-CB 3.35Å; N194-K197 PolarHBondContact O-N 3.42Å; N194-K197 PolarHBondContact OD1-NZ 2.77Å; N194-N198 PolarHBondContact O-N 3.34Å
195	W	64.9	Low	68.1	Low	31 Å²	31	56.5 Å²	56.5	12%	0.117	28%	0.275	C	S	.	.	H	α-helix	trans	-52.1	-42.1	179.5	174.2	93.8	0	0	0	112.7	A72 V76 I107 F110 F114 W192 K197 N198 V199	A72-W195 HydrophobicContact CB-CZ3 4.3Å; V76-W195 HydrophobicContact CG2-CH2 3.63Å; V76-W195 HydrophobicContact CG2-CZ3 4.43Å; I107-W195 HydrophobicContact CG1-CH2 4.02Å; I107-W195 HydrophobicContact CG1-CZ2 4.11Å; F110-W195 HydrophobicContact CB-CZ2 4.06Å; F110-W195 AromaticContact CG-NE1 3.98Å; F114-W195 AromaticContact CD2-CD1 3.84Å; F114-W195 AromaticContact CE2-CD1 3.5Å; F114-W195 HydrophobicContact CE2-CG 4.35Å; W192-W195 WeakPolarHBondContact O-CB 3.35Å; W192-W195 PolarHBondContact O-N 3.01Å; W195-K197 VanDerWaalsContact C-N 3.31Å; W195-K197 PolarHBondContact O-N 3.39Å; W195-N198 CarbonylContact O-C 3.51Å; W195-N198 WeakPolarHBondContact O-CA 3.43Å; W195-N198 WeakPolarHBondContact O-CB 3.3Å; W195-N198 PolarHBondContact O-N 3.42Å; W195-V199 HydrophobicContact CD2-CG2 3.72Å; W195-V199 VanDerWaalsContact CE2-CG2 3.43Å; W195-V199 HydrophobicContact CE3-CG2 4.03Å; W195-V199 HydrophobicContact CG-CG2 4.38Å; W195-V199 HydrophobicContact CH2-CG2 3.79Å; W195-V199 HydrophobicContact CZ2-CG2 3.47Å; W195-V199 VanDerWaalsContact CZ2-CG2 3.47Å; W195-V199 HydrophobicContact CZ3-CG2 4.07Å; W195-V199 PolarHBondContact O-N 3.49Å
196	W	60.9	Low	67	Low	148 Å²	148	64.4 Å²	64.4	56%	0.561	31%	0.312	S	S	*	.	H	α-helix	trans	-64.3	-34.7	-179.4	73.8	-94.2	0	0	0	112.4	W193 N194 N198 V200	W193-W196 VanDerWaalsContact O-CD1 3.28Å; W193-W196 PolarHBondContact O-NE1 3.11Å; N194-W196 VanDerWaalsContact C-N 3.26Å; N194-W196 PolarHBondContact O-N 3.19Å; W196-N198 PolarHBondContact O-N 3.14Å; W196-V200 HydrophobicContact CE3-CG2 4.17Å; W196-V200 VanDerWaalsContact O-CB 3.27Å; W196-V200 WeakPolarHBondContact O-CB 3.06Å; W196-V200 VanDerWaalsContact O-CG2 3.3Å; W196-V200 WeakPolarHBondContact O-CG2 3.47Å; W196-V200 PolarHBondContact O-N 3.34Å
197	K	65.6	Low	66.7	Low	101 Å²	101	66.8 Å²	66.8	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-65.9	-31.4	174.6	-65.7	179.1	-179.1	163.8	0	110.8	N194 W195 S201	N194-K197 WeakPolarHBondContact O-CB 3.35Å; N194-K197 PolarHBondContact O-N 3.42Å; N194-K197 PolarHBondContact OD1-NZ 2.77Å; W195-K197 VanDerWaalsContact C-N 3.31Å; W195-K197 PolarHBondContact O-N 3.39Å; K197-S201 WeakPolarHBondContact O-CB 3.22Å; K197-S201 PolarHBondContact O-N 3.36Å
198	N	64.1	Low	66.4	Low	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-81.1	-39.5	-179.1	-65	-15.5	0	0	0	111.6	F114 E190 N194 W195 W196 S201 A202 I237 R259	F114-N198 HydrophobicContact CE1-CB 4.39Å; F114-N198 WeakPolarHBondContact CE1-ND2 3.35Å; F114-N198 HydrophobicContact CZ-CB 3.76Å; F114-N198 VanDerWaalsContact CZ-ND2 3.27Å; F114-N198 WeakPolarHBondContact CZ-ND2 3.33Å; E190-N198 PolarHBondContact OE2-ND2 3.34Å; N194-N198 PolarHBondContact O-N 3.34Å; W195-N198 CarbonylContact O-C 3.51Å; W195-N198 WeakPolarHBondContact O-CA 3.43Å; W195-N198 WeakPolarHBondContact O-CB 3.3Å; W195-N198 PolarHBondContact O-N 3.42Å; W196-N198 PolarHBondContact O-N 3.14Å; N198-S201 CarbonylContact O-C 3.58Å; N198-S201 PolarHBondContact O-N 3.01Å; N198-A202 WeakPolarHBondContact O-CB 3.31Å; N198-A202 PolarHBondContact O-N 3.33Å; N198-I237 HydrophobicContact CB-CB 4.2Å; N198-I237 HydrophobicContact CB-CD1 4.46Å; N198-I237 PolarHBondContact OD1-O 2.94Å; N198-R259 PolarHBondContact OD1-NH1 3.08Å; N198-R259 PolarHBondContact OD1-NH2 3.09Å
199	V	64.8	Low	67.2	Low	4 Å²	4	63.4 Å²	63.4	2%	0.024	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-50	167.9	162.1	0	0	0	0	110.7	L79 F110 W195 S201 A202 F203	L79-V199 HydrophobicContact CD1-CG1 3.44Å; L79-V199 VanDerWaalsContact CD1-CG1 3.44Å; F110-V199 HydrophobicContact CD1-CG2 3.81Å; F110-V199 HydrophobicContact CE1-CG2 4.11Å; F110-V199 HydrophobicContact CG-CG2 4.05Å; W195-V199 HydrophobicContact CD2-CG2 3.72Å; W195-V199 VanDerWaalsContact CE2-CG2 3.43Å; W195-V199 HydrophobicContact CE3-CG2 4.03Å; W195-V199 HydrophobicContact CG-CG2 4.38Å; W195-V199 HydrophobicContact CH2-CG2 3.79Å; W195-V199 HydrophobicContact CZ2-CG2 3.47Å; W195-V199 VanDerWaalsContact CZ2-CG2 3.47Å; W195-V199 HydrophobicContact CZ3-CG2 4.07Å; W195-V199 PolarHBondContact O-N 3.49Å; V199-S201 VanDerWaalsContact C-N 3.28Å; V199-S201 PolarHBondContact O-N 3.48Å; V199-A202 PolarHBondContact O-N 3.25Å; V199-F203 HydrophobicContact CG1-CD2 3.82Å; V199-F203 HydrophobicContact CG1-CE2 3.81Å; V199-F203 WeakPolarHBondContact O-CD2 3.07Å; V199-F203 PolarHBondContact O-N 3Å; V199-F203 VanDerWaalsContact O-N 3.11Å
200	V	66.1	Low	68.6	Low	41 Å²	41	57.6 Å²	57.6	25%	0.248	26%	0.257	C	S	.	.	H	α-helix	trans	-57.4	-44.7	171.9	158.3	0	0	0	0	110.4	W196 A202 F203 L204	W196-V200 HydrophobicContact CE3-CG2 4.17Å; W196-V200 VanDerWaalsContact O-CB 3.27Å; W196-V200 WeakPolarHBondContact O-CB 3.06Å; W196-V200 VanDerWaalsContact O-CG2 3.3Å; W196-V200 WeakPolarHBondContact O-CG2 3.47Å; W196-V200 PolarHBondContact O-N 3.34Å; V200-A202 VanDerWaalsContact C-N 3.33Å; V200-A202 PolarHBondContact O-N 3.46Å; V200-F203 PolarHBondContact O-N 3.37Å; V200-L204 HydrophobicContact CG1-CD1 3.91Å; V200-L204 WeakPolarHBondContact O-CA 3.27Å; V200-L204 VanDerWaalsContact O-CB 3.26Å; V200-L204 WeakPolarHBondContact O-CB 3.28Å; V200-L204 PolarHBondContact O-N 3.24Å
201	S	65.6	Low	70.4	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-68.1	-31.3	179.6	-175.8	0	0	0	0	114	K197 N198 V199 F205 R207	K197-S201 WeakPolarHBondContact O-CB 3.22Å; K197-S201 PolarHBondContact O-N 3.36Å; N198-S201 CarbonylContact O-C 3.58Å; N198-S201 PolarHBondContact O-N 3.01Å; V199-S201 VanDerWaalsContact C-N 3.28Å; V199-S201 PolarHBondContact O-N 3.48Å; S201-F205 WeakPolarHBondContact O-CB 3.25Å; S201-F205 PolarHBondContact O-N 2.83Å; S201-R207 PolarHBondContact O-N 2.71Å; S201-R207 WeakPolarHBondContact OG-CD 2.91Å; S201-R207 PolarHBondContact OG-NE 2.78Å; S201-R207 PolarHBondContact OG-NH1 2.9Å
202	A	65.9	Low	72.3	Confident	8 Å²	8	51 Å²	51	7%	0.066	23%	0.226	C	C	.	.	H	α-helix	trans	-65.8	-49.3	177.4	0	0	0	0	0	109.4	F110 N198 V199 V200 H206 R207 I237	F110-A202 HydrophobicContact CE1-CB 4.09Å; F110-A202 HydrophobicContact CZ-CB 4.3Å; N198-A202 WeakPolarHBondContact O-CB 3.31Å; N198-A202 PolarHBondContact O-N 3.33Å; V199-A202 PolarHBondContact O-N 3.25Å; V200-A202 VanDerWaalsContact C-N 3.33Å; V200-A202 PolarHBondContact O-N 3.46Å; A202-H206 VanDerWaalsContact O-CA 3.31Å; A202-H206 WeakPolarHBondContact O-CA 3.11Å; A202-H206 PolarHBondContact O-N 3.12Å; A202-R207 VanDerWaalsContact CA-O 3.26Å; A202-R207 WeakPolarHBondContact CA-O 3.35Å; A202-R207 PolarHBondContact O-N 3.24Å; A202-I237 HydrophobicContact CB-CG2 3.61Å
203	F	68.4	Low	74.1	Confident	7 Å²	7	48 Å²	48	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-90	-33.6	-168	-62.3	-45.2	0	0	0	114.3	L79 Y82 I83 F110 V199 V200	L79-F203 HydrophobicContact CB-CD2 3.94Å; L79-F203 HydrophobicContact CB-CE2 4.33Å; L79-F203 HydrophobicContact CD1-CD2 4.13Å; L79-F203 HydrophobicContact CD2-CB 4.43Å; L79-F203 HydrophobicContact CG-CD2 4.45Å; Y82-F203 HydrophobicContact CG-CB 4.42Å; Y82-F203 WeakPolarHBondContact O-CD1 3.25Å; I83-F203 HydrophobicContact CB-CE1 3.98Å; I83-F203 HydrophobicContact CB-CZ 4.48Å; I83-F203 HydrophobicContact CD1-CE1 4.48Å; I83-F203 HydrophobicContact CD1-CZ 4.13Å; I83-F203 HydrophobicContact CG1-CD1 4.22Å; I83-F203 HydrophobicContact CG1-CE1 3.26Å; I83-F203 HydrophobicContact CG1-CE2 4.36Å; I83-F203 HydrophobicContact CG1-CZ 3.32Å; F110-F203 HydrophobicContact CE1-CZ 4.42Å; F110-F203 HydrophobicContact CE2-CE2 4.03Å; F110-F203 AromaticContact CE2-CZ 3.57Å; F110-F203 HydrophobicContact CE2-CZ 3.57Å; F110-F203 HydrophobicContact CZ-CE1 4.13Å; F110-F203 AromaticContact CZ-CE2 3.74Å; F110-F203 HydrophobicContact CZ-CE2 3.74Å; F110-F203 AromaticContact CZ-CZ 3.3Å; F110-F203 HydrophobicContact CZ-CZ 3.3Å; V199-F203 HydrophobicContact CG1-CD2 3.82Å; V199-F203 HydrophobicContact CG1-CE2 3.81Å; V199-F203 WeakPolarHBondContact O-CD2 3.07Å; V199-F203 PolarHBondContact O-N 3Å; V199-F203 VanDerWaalsContact O-N 3.11Å; V200-F203 PolarHBondContact O-N 3.37Å
204	L	67	Low	76.1	Confident	95 Å²	95	41.6 Å²	41.6	50%	0.497	19%	0.191	S	C	.	.	H	α-helix	trans	-94.5	-22.1	179.4	-66.7	176.2	0	0	0	113.6	V200	V200-L204 HydrophobicContact CG1-CD1 3.91Å; V200-L204 WeakPolarHBondContact O-CA 3.27Å; V200-L204 VanDerWaalsContact O-CB 3.26Å; V200-L204 WeakPolarHBondContact O-CB 3.28Å; V200-L204 PolarHBondContact O-N 3.24Å
205	F	67.9	Low	77.7	Confident	133 Å²	133	39.3 Å²	39.3	58%	0.583	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117	14.4	178.8	-57.3	-60.1	0	0	0	113.5	S201 R207	S201-F205 WeakPolarHBondContact O-CB 3.25Å; S201-F205 PolarHBondContact O-N 2.83Å; F205-R207 HydrophobicContact CB-CG 4.21Å; F205-R207 PolarHBondContact O-N 2.94Å; F205-R207 VanDerWaalsContact O-N 3.16Å
206	H	73.3	Confident	79.3	Confident	167 Å²	167	40.4 Å²	40.4	77%	0.773	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.8	42	177.6	-57.8	-71.1	0	0	0	113.3	A202	A202-H206 VanDerWaalsContact O-CA 3.31Å; A202-H206 WeakPolarHBondContact O-CA 3.11Å; A202-H206 PolarHBondContact O-N 3.12Å
207	R	83.4	Confident	81.1	Confident	63 Å²	63	33.4 Å²	33.4	24%	0.238	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-94	139.1	176.4	-58	-162.2	-168.6	149.2	-6.7	110	S201 A202 F205 P235 L236 I237	S201-R207 PolarHBondContact O-N 2.71Å; S201-R207 WeakPolarHBondContact OG-CD 2.91Å; S201-R207 PolarHBondContact OG-NE 2.78Å; S201-R207 PolarHBondContact OG-NH1 2.9Å; A202-R207 VanDerWaalsContact CA-O 3.26Å; A202-R207 WeakPolarHBondContact CA-O 3.35Å; A202-R207 PolarHBondContact O-N 3.24Å; F205-R207 HydrophobicContact CB-CG 4.21Å; F205-R207 PolarHBondContact O-N 2.94Å; F205-R207 VanDerWaalsContact O-N 3.16Å; R207-P235 HydrophobicContact CG-CB 4.09Å; R207-L236 WeakPolarHBondContact CD-O 3.18Å; R207-I237 HydrophobicContact CB-CG2 3.89Å; R207-I237 WeakPolarHBondContact O-CG2 3.37Å
208	S	86.3	Confident	82.7	Confident	13 Å²	13	28.7 Å²	28.7	9%	0.091	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-79.1	137.6	-178.5	-173	0	0	0	0	111.6	L213 P235 L236 I237	S208-L213 PolarHBondContact OG-N 2.76Å; S208-P235 PolarHBondContact N-O 2.63Å; S208-L236 WeakPolarHBondContact O-CA 3.16Å; S208-I237 PolarHBondContact O-N 2.69Å
209	P	91.4	Very high	84.3	Confident	4 Å²	4	31.9 Å²	31.9	3%	0.026	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-52.1	145.9	153.3	-24.2	37	0	0	0	110.4	F110 E113 W212 L213 I237	F110-P209 HydrophobicContact CE1-CG 4.04Å; F110-P209 HydrophobicContact CZ-CG 4.17Å; E113-P209 HydrophobicContact CG-CB 4.41Å; P209-W212 HydrophobicContact CB-CB 4.08Å; P209-W212 HydrophobicContact CB-CD2 3.86Å; P209-W212 HydrophobicContact CB-CE3 4.34Å; P209-W212 HydrophobicContact CB-CG 3.74Å; P209-W212 HydrophobicContact CG-CB 4.46Å; P209-W212 HydrophobicContact CG-CD2 3.56Å; P209-W212 HydrophobicContact CG-CE3 3.57Å; P209-W212 HydrophobicContact CG-CG 3.99Å; P209-W212 HydrophobicContact CG-CH2 4.29Å; P209-W212 HydrophobicContact CG-CZ2 4.3Å; P209-W212 HydrophobicContact CG-CZ3 3.94Å; P209-W212 PolarHBondContact O-N 3.08Å; P209-L213 PolarHBondContact O-N 2.97Å; P209-I237 HydrophobicContact CB-CD1 4.07Å; P209-I237 HydrophobicContact CG-CD1 4.28Å
210	V	92.6	Very high	85.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-73.1	-34.7	-169.2	-61.1	0	0	0	0	111.2	E113 W172 V214 L236 T238 V240 Y242	E113-V210 WeakPolarHBondContact OE2-CG2 3.45Å; E113-V210 PolarHBondContact OE2-N 3.15Å; W172-V210 HydrophobicContact CH2-CB 4.46Å; W172-V210 HydrophobicContact CH2-CG2 3.19Å; W172-V210 HydrophobicContact CZ2-CG2 3.57Å; W172-V210 HydrophobicContact CZ3-CG2 3.85Å; V210-V214 WeakPolarHBondContact O-CG2 3.42Å; V210-V214 PolarHBondContact O-N 2.9Å; V210-L236 HydrophobicContact CG1-CB 4.21Å; V210-L236 HydrophobicContact CG1-CD1 4.05Å; V210-L236 HydrophobicContact CG1-CD2 4.02Å; V210-L236 HydrophobicContact CG1-CG 4.3Å; V210-T238 HydrophobicContact CG1-CG2 3.69Å; V210-T238 HydrophobicContact CG2-CG2 4.35Å; V210-V240 HydrophobicContact CB-CB 4.17Å; V210-V240 HydrophobicContact CB-CG1 4.17Å; V210-V240 HydrophobicContact CB-CG2 4.25Å; V210-V240 HydrophobicContact CG1-CB 4.02Å; V210-V240 HydrophobicContact CG1-CG1 3.94Å; V210-V240 HydrophobicContact CG2-CB 4.48Å; V210-V240 HydrophobicContact CG2-CG2 4.32Å; V210-Y242 VanDerWaalsContact CA-OH 3.27Å; V210-Y242 WeakPolarHBondContact CA-OH 2.92Å; V210-Y242 WeakPolarHBondContact CB-OH 3.34Å; V210-Y242 PolarHBondContact O-OH 2.97Å
211	S	94.9	Very high	87.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-75.5	-25.4	175.8	73.6	0	0	0	0	113.5	E113 Y168 G170 L171 R215	E113-S211 VanDerWaalsContact OE1-CB 3.3Å; E113-S211 WeakPolarHBondContact OE1-CB 3.4Å; E113-S211 PolarHBondContact OE1-OG 3.41Å; E113-S211 PolarHBondContact OE2-N 3.37Å; Y168-S211 WeakPolarHBondContact OH-CB 3.43Å; Y168-S211 PolarHBondContact OH-OG 2.85Å; G170-S211 WeakPolarHBondContact CA-OG 3.44Å; L171-S211 PolarHBondContact N-O 2.94Å; L171-S211 VanDerWaalsContact N-O 3.09Å; L171-S211 WeakPolarHBondContact O-CA 3.45Å; L171-S211 VanDerWaalsContact O-O 3.07Å; S211-R215 PolarHBondContact O-N 3.16Å
212	W	95.6	Very high	89	Confident	3 Å²	3	41.9 Å²	41.9	1%	0.011	20%	0.196	C	C	.	.	H	α-helix	trans	-73.9	-43.4	178.2	-67.2	11.8	0	0	0	109.6	I83 P84 Y87 I91 F110 V169 P209 V214 R215 E216	I83-W212 HydrophobicContact CG2-CH2 3.77Å; I83-W212 HydrophobicContact CG2-CZ3 3.99Å; P84-W212 HydrophobicContact CG-CZ3 4.3Å; Y87-W212 AromaticContact CD1-CD2 3.89Å; Y87-W212 HydrophobicContact CD1-CD2 3.89Å; Y87-W212 HydrophobicContact CD1-CE3 4.17Å; Y87-W212 HydrophobicContact CD1-CG 4.2Å; Y87-W212 HydrophobicContact CD2-CD2 4.05Å; Y87-W212 AromaticContact CD2-CE3 3.52Å; Y87-W212 HydrophobicContact CD2-CE3 3.52Å; Y87-W212 AromaticContact CD2-CZ3 3.94Å; Y87-W212 HydrophobicContact CD2-CZ3 3.94Å; Y87-W212 HydrophobicContact CE1-CB 4.18Å; Y87-W212 HydrophobicContact CE1-CD2 4.05Å; Y87-W212 HydrophobicContact CE1-CE3 4.49Å; Y87-W212 AromaticContact CE1-CG 3.89Å; Y87-W212 HydrophobicContact CE1-CG 3.89Å; Y87-W212 HydrophobicContact CE2-CB 4.2Å; Y87-W212 HydrophobicContact CE2-CD2 4.22Å; Y87-W212 AromaticContact CE2-CE3 3.91Å; Y87-W212 HydrophobicContact CE2-CE3 3.91Å; Y87-W212 HydrophobicContact CE2-CG 4.36Å; Y87-W212 AromaticContact CG-CD2 3.87Å; Y87-W212 HydrophobicContact CG-CD2 3.87Å; Y87-W212 AromaticContact CG-CE3 3.65Å; Y87-W212 HydrophobicContact CG-CE3 3.65Å; Y87-W212 HydrophobicContact CG-CH2 4.28Å; Y87-W212 HydrophobicContact CG-CZ2 4.44Å; Y87-W212 AromaticContact CG-CZ3 3.87Å; Y87-W212 HydrophobicContact CG-CZ3 3.87Å; Y87-W212 AromaticContact CZ-CG 3.97Å; Y87-W212 PolarHBondContact OH-O 3.27Å; I91-W212 HydrophobicContact CD1-CH2 4.16Å; I91-W212 HydrophobicContact CD1-CZ2 3.96Å; F110-W212 HydrophobicContact CE2-CH2 4.28Å; F110-W212 HydrophobicContact CE2-CZ2 4.38Å; F110-W212 HydrophobicContact CZ-CH2 4.34Å; V169-W212 HydrophobicContact CG2-CZ2 4.14Å; P209-W212 HydrophobicContact CB-CB 4.08Å; P209-W212 HydrophobicContact CB-CD2 3.86Å; P209-W212 HydrophobicContact CB-CE3 4.34Å; P209-W212 HydrophobicContact CB-CG 3.74Å; P209-W212 HydrophobicContact CG-CB 4.46Å; P209-W212 HydrophobicContact CG-CD2 3.56Å; P209-W212 HydrophobicContact CG-CE3 3.57Å; P209-W212 HydrophobicContact CG-CG 3.99Å; P209-W212 HydrophobicContact CG-CH2 4.29Å; P209-W212 HydrophobicContact CG-CZ2 4.3Å; P209-W212 HydrophobicContact CG-CZ3 3.94Å; P209-W212 PolarHBondContact O-N 3.08Å; W212-V214 PolarHBondContact O-N 2.89Å; W212-R215 CarbonylContact O-C 3.59Å; W212-R215 WeakPolarHBondContact O-CA 3.35Å; W212-R215 WeakPolarHBondContact O-CB 3.26Å; W212-R215 PolarHBondContact O-N 3.45Å; W212-E216 WeakPolarHBondContact O-CG 3.42Å; W212-E216 PolarHBondContact O-N 3.23Å
213	L	97.1	Very high	90.5	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-58.2	-37.4	174.4	-178.4	60.5	0	0	0	112	S208 P209 R215 T217 L231 T234 L236 Y242	S208-L213 PolarHBondContact OG-N 2.76Å; P209-L213 PolarHBondContact O-N 2.97Å; L213-R215 VanDerWaalsContact C-N 3.34Å; L213-T217 VanDerWaalsContact O-CB 3.22Å; L213-T217 WeakPolarHBondContact O-CB 3.26Å; L213-T217 PolarHBondContact O-N 2.75Å; L213-T217 PolarHBondContact O-OG1 2.78Å; L213-L231 HydrophobicContact CD2-CD2 4.18Å; L213-L231 HydrophobicContact CG-CD2 4.05Å; L213-T234 HydrophobicContact CD1-CG2 3.79Å; L213-T234 HydrophobicContact CD2-CG2 4.12Å; L213-L236 HydrophobicContact CB-CD2 4.32Å; L213-L236 HydrophobicContact CD2-CD2 3.64Å; L213-Y242 HydrophobicContact CD2-CE2 4.2Å
214	V	98.3	Very high	92	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-46.3	173.7	171	0	0	0	0	110.5	L171 I182 V210 W212 T217 L218 L231 Y242	L171-V214 HydrophobicContact CB-CG1 4.16Å; L171-V214 WeakPolarHBondContact O-CB 3.44Å; L171-V214 WeakPolarHBondContact O-CG1 3.4Å; I182-V214 HydrophobicContact CB-CG1 4.07Å; I182-V214 HydrophobicContact CD1-CG1 4.42Å; I182-V214 HydrophobicContact CG2-CB 4.43Å; I182-V214 HydrophobicContact CG2-CG1 3.76Å; I182-V214 HydrophobicContact CG2-CG2 3.92Å; V210-V214 WeakPolarHBondContact O-CG2 3.42Å; V210-V214 PolarHBondContact O-N 2.9Å; W212-V214 PolarHBondContact O-N 2.89Å; V214-T217 PolarHBondContact O-N 2.71Å; V214-L218 HydrophobicContact CG1-CD1 3.88Å; V214-L218 HydrophobicContact CG1-CG 4.45Å; V214-L218 VanDerWaalsContact O-CG 3.26Å; V214-L218 WeakPolarHBondContact O-CG 3.13Å; V214-L218 PolarHBondContact O-N 3.02Å; V214-L231 HydrophobicContact CG2-CD2 4.39Å; V214-Y242 HydrophobicContact CG2-CD1 3.86Å; V214-Y242 HydrophobicContact CG2-CE1 3.35Å
215	R	97.9	Very high	93.5	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-47.3	178.4	-179.9	174.3	167.2	-169.9	-5.2	112.3	E90 Y160 V169 L171 S211 W212 L213 T217 L218 E219	E90-R215 VanDerWaalsContact CD-NH2 3.31Å; E90-R215 IonicContact OE1-CZ 3.34Å; E90-R215 IonicContact OE1-NH1 2.66Å; E90-R215 IonicContact OE1-NH2 3.14Å; E90-R215 PolarHBondContact OE1-NH2 2.76Å; E90-R215 IonicContact OE2-CZ 3.32Å; E90-R215 IonicContact OE2-NH1 2.72Å; E90-R215 PolarHBondContact OE2-NH1 2.94Å; E90-R215 IonicContact OE2-NH2 3.65Å; E90-R215 PolarHBondContact OE2-NH2 2.89Å; E90-R215 VanDerWaalsContact OE2-NH2 3.14Å; Y160-R215 HydrophobicContact CE2-CG 4.21Å; Y160-R215 PolarHBondContact OH-NE 3.39Å; V169-R215 WeakPolarHBondContact O-CD 3.38Å; V169-R215 PolarHBondContact O-NH1 2.77Å; L171-R215 HydrophobicContact CB-CB 4.23Å; L171-R215 HydrophobicContact CD1-CB 4.16Å; L171-R215 HydrophobicContact CD1-CG 4.16Å; L171-R215 HydrophobicContact CG-CB 4.19Å; L171-R215 HydrophobicContact CG-CG 4.45Å; S211-R215 PolarHBondContact O-N 3.16Å; W212-R215 CarbonylContact O-C 3.59Å; W212-R215 WeakPolarHBondContact O-CA 3.35Å; W212-R215 WeakPolarHBondContact O-CB 3.26Å; W212-R215 PolarHBondContact O-N 3.45Å; L213-R215 VanDerWaalsContact C-N 3.34Å; R215-T217 VanDerWaalsContact C-N 3.26Å; R215-T217 PolarHBondContact O-N 2.79Å; R215-L218 PolarHBondContact O-N 2.95Å; R215-E219 PolarHBondContact O-N 2.9Å
216	E	97.9	Very high	95	Very high	54 Å²	54	41 Å²	41	25%	0.252	20%	0.196	S	C	.	.	H	α-helix	trans	-58.3	-42.3	175	-66	173.3	179.6	0	0	110.7	Y87 W212 E219 E220	Y87-E216 HydrophobicContact CE2-CG 4.38Å; Y87-E216 WeakPolarHBondContact CE2-OE1 3.46Å; Y87-E216 VanDerWaalsContact OH-CG 3.27Å; Y87-E216 WeakPolarHBondContact OH-CG 3.36Å; W212-E216 WeakPolarHBondContact O-CG 3.42Å; W212-E216 PolarHBondContact O-N 3.23Å; E216-E219 PolarHBondContact O-N 3.24Å; E216-E220 WeakPolarHBondContact O-CB 3.33Å; E216-E220 WeakPolarHBondContact O-CG 3.45Å; E216-E220 PolarHBondContact O-N 3.49Å
217	T	98.8	Very high	96.2	Very high	1 Å²	1	33 Å²	33	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-63.6	-44.9	178	-58.2	0	0	0	0	111.2	F180 I182 L213 V214 R215 E219 A221 A227 L231	F180-T217 HydrophobicContact CE2-CG2 4.19Å; F180-T217 HydrophobicContact CZ-CG2 4.27Å; F180-T217 WeakPolarHBondContact CZ-O 3.4Å; I182-T217 HydrophobicContact CD1-CG2 3.78Å; L213-T217 VanDerWaalsContact O-CB 3.22Å; L213-T217 WeakPolarHBondContact O-CB 3.26Å; L213-T217 PolarHBondContact O-N 2.75Å; L213-T217 PolarHBondContact O-OG1 2.78Å; V214-T217 PolarHBondContact O-N 2.71Å; R215-T217 VanDerWaalsContact C-N 3.26Å; R215-T217 PolarHBondContact O-N 2.79Å; T217-E219 VanDerWaalsContact C-N 3.26Å; T217-E219 PolarHBondContact O-N 2.89Å; T217-A221 HydrophobicContact CG2-CB 3.87Å; T217-A221 WeakPolarHBondContact O-CB 3.26Å; T217-A221 PolarHBondContact O-N 3.46Å; T217-A227 HydrophobicContact CG2-CB 3.57Å; T217-L231 HydrophobicContact CG2-CD1 4.23Å; T217-L231 HydrophobicContact CG2-CG 4.08Å
218	L	98.8	Very high	96.9	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-60.7	-35.8	177.1	-73	164.2	0	0	0	112.8	Y160 L171 S176 F180 I182 V214 R215	Y160-L218 HydrophobicContact CD2-CB 3.76Å; Y160-L218 HydrophobicContact CD2-CD1 4.34Å; Y160-L218 HydrophobicContact CE2-CB 4.33Å; Y160-L218 HydrophobicContact CG-CB 3.96Å; L171-L218 HydrophobicContact CB-CD1 4.46Å; L171-L218 HydrophobicContact CD1-CD1 3.59Å; S176-L218 PolarHBondContact OG-O 3.33Å; F180-L218 HydrophobicContact CD2-CD2 4.35Å; F180-L218 HydrophobicContact CE2-CD2 3.81Å; F180-L218 HydrophobicContact CE2-CG 4.43Å; I182-L218 HydrophobicContact CD1-CD2 4.15Å; I182-L218 HydrophobicContact CD1-CG 4.12Å; V214-L218 HydrophobicContact CG1-CD1 3.88Å; V214-L218 HydrophobicContact CG1-CG 4.45Å; V214-L218 VanDerWaalsContact O-CG 3.26Å; V214-L218 WeakPolarHBondContact O-CG 3.13Å; V214-L218 PolarHBondContact O-N 3.02Å; R215-L218 PolarHBondContact O-N 2.95Å
219	E	97.9	Very high	97.5	Very high	68 Å²	68	34.4 Å²	34.4	32%	0.318	17%	0.169	S	C	.	.	H	α-helix	trans	-77.2	-45.3	179.8	-174.3	168.2	175.5	0	0	112.5	Y160 R215 E216 T217	Y160-E219 HydrophobicContact CD1-CB 4.09Å; Y160-E219 HydrophobicContact CD1-CG 4.48Å; Y160-E219 HydrophobicContact CE1-CB 3.58Å; Y160-E219 HydrophobicContact CE1-CG 3.85Å; R215-E219 PolarHBondContact O-N 2.9Å; E216-E219 PolarHBondContact O-N 3.24Å; T217-E219 VanDerWaalsContact C-N 3.26Å; T217-E219 PolarHBondContact O-N 2.89Å
220	E	97.9	Very high	97.8	Very high	106 Å²	106	37.6 Å²	37.6	50%	0.495	18%	0.181	S	C	.	.	H	α-helix	trans	-103.4	-27.8	-165.7	-62.1	-175.9	177.3	0	0	114.8	E216 E222 R230	E216-E220 WeakPolarHBondContact O-CB 3.33Å; E216-E220 WeakPolarHBondContact O-CG 3.45Å; E216-E220 PolarHBondContact O-N 3.49Å; E220-E222 PolarHBondContact O-N 2.96Å; E220-R230 IonicContact OE2-CZ 3.78Å; E220-R230 IonicContact OE2-NH1 3.83Å; E220-R230 PolarHBondContact OE2-NH1 2.94Å; E220-R230 IonicContact OE2-NH2 3.69Å
221	A	98.6	Very high	98.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.			trans	-70.2	138	-171.1	0	0	0	0	0	111.8	K179 F180 T217 D226 A227	K179-A221 PolarHBondContact NZ-O 2.74Å; F180-A221 HydrophobicContact CE1-CB 3.78Å; F180-A221 HydrophobicContact CZ-CB 3.72Å; T217-A221 HydrophobicContact CG2-CB 3.87Å; T217-A221 WeakPolarHBondContact O-CB 3.26Å; T217-A221 PolarHBondContact O-N 3.46Å; A221-D226 VanDerWaalsContact CA-OD2 3.25Å; A221-D226 WeakPolarHBondContact CA-OD2 3.23Å; A221-D226 HydrophobicContact CB-CB 4.39Å; A221-A227 HydrophobicContact CB-CB 3.98Å
222	E	98.4	Very high	98.3	Very high	152 Å²	152	37.8 Å²	37.8	71%	0.71	18%	0.182	S	C	*	.			trans	-73.6	-40.9	-175	-65.7	-173.5	178.4	0	0	111.8	K179 E220 D226	K179-E222 VanDerWaalsContact CD-O 3.25Å; K179-E222 WeakPolarHBondContact CD-O 3.46Å; K179-E222 WeakPolarHBondContact CE-O 3.29Å; E220-E222 PolarHBondContact O-N 2.96Å; E222-D226 PolarHBondContact N-OD2 3.39Å; E222-D226 VanDerWaalsContact N-OD2 3.11Å
223	D	98.8	Very high	98.3	Very high	57 Å²	57	44.3 Å²	44.3	31%	0.305	21%	0.21	S	C	.	.	S	Bend	trans	-155.1	-172.5	-178.1	68.3	22.5	0	0	0	112.6	F180 L225 D226 A227	F180-D223 VanDerWaalsContact CD1-C 3.49Å; F180-D223 WeakPolarHBondContact CD1-O 3.42Å; F180-D223 WeakPolarHBondContact CE1-O 3.3Å; D223-L225 PolarHBondContact O-N 3.15Å; D223-L225 PolarHBondContact OD1-N 3.43Å; D223-D226 PolarHBondContact OD1-N 3.41Å; D223-A227 WeakPolarHBondContact O-CB 3.24Å; D223-A227 PolarHBondContact O-N 3.47Å
224	F	98.9	Very high	98.2	Very high	15 Å²	15	46.2 Å²	46.2	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-57.1	-43	178.9	172.4	-98.3	0	0	0	113.2	F180 A227 V228 V244 G246 E251 V253	F180-F224 HydrophobicContact CB-CB 4.44Å; F180-F224 HydrophobicContact CB-CD2 4.41Å; F224-A227 PolarHBondContact O-N 2.95Å; F224-V228 HydrophobicContact CD1-CG2 4.42Å; F224-V228 HydrophobicContact CD2-CG2 4.4Å; F224-V228 HydrophobicContact CE1-CG2 4.04Å; F224-V228 HydrophobicContact CE2-CG2 4.03Å; F224-V228 HydrophobicContact CZ-CG2 3.83Å; F224-V228 VanDerWaalsContact O-CG2 3.27Å; F224-V228 WeakPolarHBondContact O-CG2 3.41Å; F224-V228 PolarHBondContact O-N 2.8Å; F224-V244 HydrophobicContact CD2-CG1 3.72Å; F224-V244 HydrophobicContact CE2-CB 3.99Å; F224-V244 HydrophobicContact CE2-CG1 3.69Å; F224-G246 VanDerWaalsContact CD2-N 3.34Å; F224-E251 HydrophobicContact CD1-CB 3.78Å; F224-E251 HydrophobicContact CD1-CG 3.74Å; F224-E251 HydrophobicContact CD2-CB 4.03Å; F224-E251 HydrophobicContact CE1-CB 3.86Å; F224-E251 HydrophobicContact CE1-CG 4.07Å; F224-E251 HydrophobicContact CE2-CB 4.09Å; F224-E251 HydrophobicContact CG-CB 3.87Å; F224-E251 HydrophobicContact CG-CG 4.12Å; F224-E251 HydrophobicContact CZ-CB 4.01Å; F224-V253 HydrophobicContact CE2-CG1 4.17Å; F224-V253 HydrophobicContact CZ-CB 4.34Å; F224-V253 HydrophobicContact CZ-CG1 3.79Å
225	L	98.8	Very high	98	Very high	106 Å²	106	49.1 Å²	49.1	56%	0.555	24%	0.241	S	C	*	.	H	α-helix	trans	-72.8	-41.1	-176.2	-70.5	177	0	0	0	111.2	D223 A227 V228 M229	D223-L225 PolarHBondContact O-N 3.15Å; D223-L225 PolarHBondContact OD1-N 3.43Å; L225-A227 VanDerWaalsContact C-N 3.31Å; L225-A227 PolarHBondContact O-N 2.87Å; L225-V228 PolarHBondContact O-N 2.88Å; L225-M229 WeakPolarHBondContact O-CB 3.14Å; L225-M229 VanDerWaalsContact O-CG 3.25Å; L225-M229 WeakPolarHBondContact O-CG 3.48Å; L225-M229 PolarHBondContact O-N 2.61Å
226	D	98.8	Very high	97.6	Very high	46 Å²	46	49.1 Å²	49.1	25%	0.246	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-42.1	173.2	-174.3	33.5	0	0	0	111	A221 E222 D223 V228 M229 R230	A221-D226 VanDerWaalsContact CA-OD2 3.25Å; A221-D226 WeakPolarHBondContact CA-OD2 3.23Å; A221-D226 HydrophobicContact CB-CB 4.39Å; E222-D226 PolarHBondContact N-OD2 3.39Å; E222-D226 VanDerWaalsContact N-OD2 3.11Å; D223-D226 PolarHBondContact OD1-N 3.41Å; D226-V228 PolarHBondContact O-N 2.74Å; D226-M229 PolarHBondContact O-N 2.85Å; D226-R230 WeakPolarHBondContact O-CB 3.42Å; D226-R230 WeakPolarHBondContact O-CG 3.48Å; D226-R230 PolarHBondContact O-N 2.99Å; D226-R230 IonicContact OD1-NE 3Å; D226-R230 PolarHBondContact OD1-NE 2.99Å; D226-R230 IonicContact OD2-CZ 3.65Å; D226-R230 IonicContact OD2-NE 2.65Å; D226-R230 PolarHBondContact OD2-NE 3.32Å; D226-R230 IonicContact OD2-NH2 3.72Å
227	A	98.9	Very high	97.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-47.7	175	0	0	0	0	0	112.3	F180 T217 A221 D223 F224 L225 M229 R230 L231	F180-A227 HydrophobicContact CD1-CB 3.8Å; F180-A227 HydrophobicContact CD2-CB 3.95Å; F180-A227 HydrophobicContact CE1-CB 3.78Å; F180-A227 HydrophobicContact CE2-CB 3.9Å; F180-A227 HydrophobicContact CG-CB 3.92Å; F180-A227 HydrophobicContact CZ-CB 3.86Å; T217-A227 HydrophobicContact CG2-CB 3.57Å; A221-A227 HydrophobicContact CB-CB 3.98Å; D223-A227 WeakPolarHBondContact O-CB 3.24Å; D223-A227 PolarHBondContact O-N 3.47Å; F224-A227 PolarHBondContact O-N 2.95Å; L225-A227 VanDerWaalsContact C-N 3.31Å; L225-A227 PolarHBondContact O-N 2.87Å; A227-M229 VanDerWaalsContact C-N 3.29Å; A227-M229 PolarHBondContact O-N 3.28Å; A227-R230 PolarHBondContact O-N 3.43Å; A227-L231 VanDerWaalsContact O-CB 3.27Å; A227-L231 WeakPolarHBondContact O-CB 3.4Å; A227-L231 WeakPolarHBondContact O-CD1 3.39Å; A227-L231 WeakPolarHBondContact O-CG 3.28Å; A227-L231 PolarHBondContact O-N 3.25Å
228	V	98.8	Very high	96.5	Very high	16 Å²	16	46.5 Å²	46.5	10%	0.097	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-40.2	176.7	169.8	0	0	0	0	111.3	F224 L225 D226 S232 V244 V253 I255	F224-V228 HydrophobicContact CD1-CG2 4.42Å; F224-V228 HydrophobicContact CD2-CG2 4.4Å; F224-V228 HydrophobicContact CE1-CG2 4.04Å; F224-V228 HydrophobicContact CE2-CG2 4.03Å; F224-V228 HydrophobicContact CZ-CG2 3.83Å; F224-V228 VanDerWaalsContact O-CG2 3.27Å; F224-V228 WeakPolarHBondContact O-CG2 3.41Å; F224-V228 PolarHBondContact O-N 2.8Å; L225-V228 PolarHBondContact O-N 2.88Å; D226-V228 PolarHBondContact O-N 2.74Å; V228-S232 WeakPolarHBondContact O-CB 3.18Å; V228-S232 PolarHBondContact O-N 2.87Å; V228-S232 PolarHBondContact O-OG 2.71Å; V228-V244 HydrophobicContact CG2-CB 4.33Å; V228-V244 HydrophobicContact CG2-CG1 4.34Å; V228-V244 HydrophobicContact CG2-CG2 4.45Å; V228-V253 HydrophobicContact CG1-CG1 4.44Å; V228-V253 HydrophobicContact CG2-CG1 3.52Å; V228-I255 HydrophobicContact CB-CD1 4.35Å; V228-I255 HydrophobicContact CG1-CD1 3.98Å; V228-I255 HydrophobicContact CG2-CD1 4.4Å
229	M	98.5	Very high	96.1	Very high	89 Å²	89	46.7 Å²	46.7	44%	0.438	23%	0.232	S	C	.	.	H	α-helix	trans	-67.6	-46.6	179.8	-74.9	-67	-71.1	0	0	112.5	L225 D226 A227 S232 K233	L225-M229 WeakPolarHBondContact O-CB 3.14Å; L225-M229 VanDerWaalsContact O-CG 3.25Å; L225-M229 WeakPolarHBondContact O-CG 3.48Å; L225-M229 PolarHBondContact O-N 2.61Å; D226-M229 PolarHBondContact O-N 2.85Å; A227-M229 VanDerWaalsContact C-N 3.29Å; A227-M229 PolarHBondContact O-N 3.28Å; M229-S232 PolarHBondContact O-N 2.7Å; M229-K233 HydrophobicContact CE-CD 3.95Å; M229-K233 WeakPolarHBondContact O-CB 3.33Å; M229-K233 WeakPolarHBondContact O-CG 3.24Å; M229-K233 PolarHBondContact O-N 2.8Å
230	R	98.3	Very high	96	Very high	72 Å²	72	43.5 Å²	43.5	27%	0.272	22%	0.216	S	C	.	.	H	α-helix	trans	-58.4	-51.9	174.2	-72.6	168	175.2	-103	7.2	110.8	E220 D226 A227 S232 K233 T234	E220-R230 IonicContact OE2-CZ 3.78Å; E220-R230 IonicContact OE2-NH1 3.83Å; E220-R230 PolarHBondContact OE2-NH1 2.94Å; E220-R230 IonicContact OE2-NH2 3.69Å; D226-R230 WeakPolarHBondContact O-CB 3.42Å; D226-R230 WeakPolarHBondContact O-CG 3.48Å; D226-R230 PolarHBondContact O-N 2.99Å; D226-R230 IonicContact OD1-NE 3Å; D226-R230 PolarHBondContact OD1-NE 2.99Å; D226-R230 IonicContact OD2-CZ 3.65Å; D226-R230 IonicContact OD2-NE 2.65Å; D226-R230 PolarHBondContact OD2-NE 3.32Å; D226-R230 IonicContact OD2-NH2 3.72Å; A227-R230 PolarHBondContact O-N 3.43Å; R230-S232 PolarHBondContact O-N 3.43Å; R230-K233 PolarHBondContact O-N 2.69Å; R230-T234 WeakPolarHBondContact O-CB 3.31Å; R230-T234 PolarHBondContact O-N 3.5Å; R230-T234 PolarHBondContact O-OG1 3.48Å; R230-T234 VanDerWaalsContact O-OG1 3.11Å
231	L	98.5	Very high	96	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-20	179.1	-69	168.8	0	0	0	113.6	I182 L213 V214 T217 A227 Y242 V244 I255 R257	I182-L231 HydrophobicContact CD1-CD1 3.82Å; I182-L231 HydrophobicContact CG1-CD1 4.14Å; I182-L231 HydrophobicContact CG2-CD1 4.33Å; L213-L231 HydrophobicContact CD2-CD2 4.18Å; L213-L231 HydrophobicContact CG-CD2 4.05Å; V214-L231 HydrophobicContact CG2-CD2 4.39Å; T217-L231 HydrophobicContact CG2-CD1 4.23Å; T217-L231 HydrophobicContact CG2-CG 4.08Å; A227-L231 VanDerWaalsContact O-CB 3.27Å; A227-L231 WeakPolarHBondContact O-CB 3.4Å; A227-L231 WeakPolarHBondContact O-CD1 3.39Å; A227-L231 WeakPolarHBondContact O-CG 3.28Å; A227-L231 PolarHBondContact O-N 3.25Å; L231-Y242 HydrophobicContact CB-CD2 3.8Å; L231-Y242 HydrophobicContact CB-CE2 4.27Å; L231-Y242 HydrophobicContact CB-CG 4.35Å; L231-Y242 HydrophobicContact CD1-CG 4.44Å; L231-Y242 HydrophobicContact CD2-CD1 4.11Å; L231-Y242 HydrophobicContact CD2-CD2 3.74Å; L231-Y242 HydrophobicContact CD2-CE1 4.1Å; L231-Y242 HydrophobicContact CD2-CE2 3.69Å; L231-Y242 HydrophobicContact CD2-CG 3.92Å; L231-Y242 HydrophobicContact CG-CD2 4.26Å; L231-Y242 HydrophobicContact CG-CG 4.48Å; L231-V244 HydrophobicContact CD1-CG2 3.58Å; L231-I255 HydrophobicContact CB-CD1 3.86Å; L231-R257 WeakPolarHBondContact O-CD 3.44Å; L231-R257 PolarHBondContact O-NH1 2.81Å
232	S	98	Very high	96	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-86.2	-36.8	175.9	-64.9	0	0	0	0	112.9	V228 M229 R230 R257 P262	V228-S232 WeakPolarHBondContact O-CB 3.18Å; V228-S232 PolarHBondContact O-N 2.87Å; V228-S232 PolarHBondContact O-OG 2.71Å; M229-S232 PolarHBondContact O-N 2.7Å; R230-S232 PolarHBondContact O-N 3.43Å; S232-R257 VanDerWaalsContact O-CZ 3.24Å; S232-R257 PolarHBondContact O-NE 2.91Å; S232-R257 PolarHBondContact O-NH1 2.89Å; S232-P262 WeakPolarHBondContact O-CD 3.39Å
233	K	96.7	Very high	96.1	Very high	139 Å²	139	31.4 Å²	31.4	60%	0.604	16%	0.16	S	C	*	.	H	α-helix	trans	-104.8	-26.2	-165.2	-67.4	-174.2	174	-173.2	0	114.8	M229 R230 P235	M229-K233 HydrophobicContact CE-CD 3.95Å; M229-K233 WeakPolarHBondContact O-CB 3.33Å; M229-K233 WeakPolarHBondContact O-CG 3.24Å; M229-K233 PolarHBondContact O-N 2.8Å; R230-K233 PolarHBondContact O-N 2.69Å; K233-P235 WeakPolarHBondContact O-CD 3.4Å
234	T	95.6	Very high	96.1	Very high	44 Å²	44	28.7 Å²	28.7	27%	0.27	15%	0.145	S	C	.	.	S	Bend	trans	-66.8	127.5	-177.6	-59.6	0	0	0	0	110.6	L213 R230 R257	L213-T234 HydrophobicContact CD1-CG2 3.79Å; L213-T234 HydrophobicContact CD2-CG2 4.12Å; R230-T234 WeakPolarHBondContact O-CB 3.31Å; R230-T234 PolarHBondContact O-N 3.5Å; R230-T234 PolarHBondContact O-OG1 3.48Å; R230-T234 VanDerWaalsContact O-OG1 3.11Å; T234-R257 PolarHBondContact O-NH1 3.11Å; T234-R257 PolarHBondContact O-NH2 2.9Å
235	P	92.6	Very high	96.1	Very high	61 Å²	61	28 Å²	28	40%	0.396	14%	0.142	S	C	.	.			trans	-60.4	137.3	177.6	-25.8	35.7	0	0	0	112.9	R207 S208 K233 R259	R207-P235 HydrophobicContact CG-CB 4.09Å; S208-P235 PolarHBondContact N-O 2.63Å; K233-P235 WeakPolarHBondContact O-CD 3.4Å; P235-R259 WeakPolarHBondContact CA-O 3.14Å
236	L	90.8	Very high	96.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-117.8	155.3	-174.1	-65	173.9	0	0	0	112.6	R207 S208 V210 L213 T238 V240 Y242 R257 R259	R207-L236 WeakPolarHBondContact CD-O 3.18Å; S208-L236 WeakPolarHBondContact O-CA 3.16Å; V210-L236 HydrophobicContact CG1-CB 4.21Å; V210-L236 HydrophobicContact CG1-CD1 4.05Å; V210-L236 HydrophobicContact CG1-CD2 4.02Å; V210-L236 HydrophobicContact CG1-CG 4.3Å; L213-L236 HydrophobicContact CB-CD2 4.32Å; L213-L236 HydrophobicContact CD2-CD2 3.64Å; L236-T238 WeakPolarHBondContact CB-O 3.38Å; L236-V240 HydrophobicContact CD1-CG1 3.62Å; L236-Y242 HydrophobicContact CD1-CE2 4.01Å; L236-R257 HydrophobicContact CD1-CB 3.96Å; L236-R257 HydrophobicContact CD1-CG 4.18Å; L236-R259 PolarHBondContact N-O 2.88Å; L236-R259 WeakPolarHBondContact O-CB 3.42Å
237	I	86.3	Confident	96.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-74.7	-27.3	175.5	66.9	174	0	0	0	112.6	F110 E113 F114 N198 A202 R207 S208 P209 R259	F110-I237 HydrophobicContact CD1-CD1 4.19Å; F110-I237 HydrophobicContact CE1-CD1 4.13Å; E113-I237 HydrophobicContact CB-CD1 4.5Å; E113-I237 HydrophobicContact CG-CD1 4.35Å; F114-I237 HydrophobicContact CZ-CD1 4.17Å; N198-I237 HydrophobicContact CB-CB 4.2Å; N198-I237 HydrophobicContact CB-CD1 4.46Å; N198-I237 PolarHBondContact OD1-O 2.94Å; A202-I237 HydrophobicContact CB-CG2 3.61Å; R207-I237 HydrophobicContact CB-CG2 3.89Å; R207-I237 WeakPolarHBondContact O-CG2 3.37Å; S208-I237 PolarHBondContact O-N 2.69Å; P209-I237 HydrophobicContact CB-CD1 4.07Å; P209-I237 HydrophobicContact CG-CD1 4.28Å; I237-R259 PolarHBondContact O-NE 2.81Å; I237-R259 PolarHBondContact O-NH1 2.86Å
238	T	87.3	Confident	96	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-146.9	170.4	-177.5	-170.6	0	0	0	0	110.8	F114 E190 V210 L236	F114-T238 HydrophobicContact CE1-CG2 4.09Å; E190-T238 VanDerWaalsContact CD-OG1 3.29Å; E190-T238 PolarHBondContact OE2-OG1 3.24Å; V210-T238 HydrophobicContact CG1-CG2 3.69Å; V210-T238 HydrophobicContact CG2-CG2 4.35Å; L236-T238 WeakPolarHBondContact CB-O 3.38Å
239	G	90.8	Very high	96	Very high	6 Å²	6	31.3 Å²	31.3	6%	0.062	16%	0.161	C	C	.	.			trans	-74.8	149.5	171.4	0	0	0	0	0	111.9	Q186 R187 R257	Q186-G239 PolarHBondContact NE2-O 3.44Å; Q186-G239 VanDerWaalsContact NE2-O 3.12Å; R187-G239 PolarHBondContact N-O 3.37Å; G239-R257 VanDerWaalsContact CA-O 3.25Å; G239-R257 WeakPolarHBondContact CA-O 3.44Å
240	V	95.3	Very high	96	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	160.5	178.5	64.5	0	0	0	0	109.9	W172 D185 V210 L236 Y242 R257	W172-V240 HydrophobicContact CH2-CG2 4.27Å; W172-V240 HydrophobicContact CZ3-CG2 3.75Å; D185-V240 CarbonylContact O-C 3.47Å; D185-V240 VanDerWaalsContact O-CG2 3.3Å; D185-V240 WeakPolarHBondContact O-CG2 3.23Å; V210-V240 HydrophobicContact CB-CB 4.17Å; V210-V240 HydrophobicContact CB-CG1 4.17Å; V210-V240 HydrophobicContact CB-CG2 4.25Å; V210-V240 HydrophobicContact CG1-CB 4.02Å; V210-V240 HydrophobicContact CG1-CG1 3.94Å; V210-V240 HydrophobicContact CG2-CB 4.48Å; V210-V240 HydrophobicContact CG2-CG2 4.32Å; L236-V240 HydrophobicContact CD1-CG1 3.62Å; V240-Y242 HydrophobicContact CG1-CD1 4.32Å; V240-Y242 HydrophobicContact CG1-CD2 3.93Å; V240-Y242 HydrophobicContact CG1-CE1 3.9Å; V240-Y242 HydrophobicContact CG1-CE2 3.49Å; V240-Y242 VanDerWaalsContact CG1-CE2 3.49Å; V240-Y242 HydrophobicContact CG1-CG 4.34Å; V240-Y242 VanDerWaalsContact CG1-CZ 3.49Å; V240-Y242 HydrophobicContact CG2-CD1 4.16Å; V240-Y242 HydrophobicContact CG2-CE1 3.91Å; V240-R257 HydrophobicContact CG1-CB 3.79Å; V240-R257 HydrophobicContact CG1-CG 4.22Å; V240-R257 PolarHBondContact N-O 2.84Å; V240-R257 WeakPolarHBondContact O-CA 3.28Å; V240-R257 VanDerWaalsContact O-CB 3.28Å; V240-R257 WeakPolarHBondContact O-CB 3.36Å; V240-R257 PolarHBondContact O-N 2.98Å
241	Y	98.1	Very high	96	Very high	4 Å²	4	26 Å²	26	2%	0.016	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.8	160.2	-46.3	-88.4	0	0	0	108.4	G184 D185 Q186 R187 I255 T256 E279 N281 F282 D283	G184-Y241 CarbonylContact C-O 3.19Å; G184-Y241 WeakPolarHBondContact CA-O 3.47Å; D185-Y241 HydrophobicContact CB-CD2 4.1Å; D185-Y241 PolarHBondContact N-O 3.34Å; D185-Y241 WeakPolarHBondContact O-CD2 3.38Å; D185-Y241 PolarHBondContact O-N 3Å; Q186-Y241 WeakPolarHBondContact O-CE2 3.43Å; R187-Y241 HydrophobicContact CB-CD2 3.85Å; R187-Y241 HydrophobicContact CB-CE1 4.32Å; R187-Y241 HydrophobicContact CB-CE2 3.4Å; R187-Y241 VanDerWaalsContact CB-CE2 3.4Å; R187-Y241 HydrophobicContact CB-CG 4.46Å; R187-Y241 HydrophobicContact CG-CE1 4.05Å; R187-Y241 HydrophobicContact CG-CE2 3.81Å; R187-Y241 VanDerWaalsContact CG-CZ 3.5Å; R187-Y241 WeakPolarHBondContact CG-OH 3.28Å; Y241-I255 WeakPolarHBondContact CA-O 3.39Å; Y241-T256 HydrophobicContact CD1-CG2 3.81Å; Y241-T256 HydrophobicContact CE1-CG2 3.6Å; Y241-E279 HydrophobicContact CD1-CG 3.96Å; Y241-E279 HydrophobicContact CD2-CG 4.03Å; Y241-E279 HydrophobicContact CG-CG 3.59Å; Y241-N281 VanDerWaalsContact CE2-C 3.5Å; Y241-N281 PolarHBondContact OH-O 3.45Å; Y241-F282 WeakPolarHBondContact OH-CA 3.17Å; Y241-F282 PolarHBondContact OH-N 2.91Å; Y241-D283 WeakPolarHBondContact CE1-OD1 3.24Å; Y241-D283 PolarHBondContact OH-N 2.96Å; Y241-D283 PolarHBondContact OH-OD1 3.03Å; Y241-D283 VanDerWaalsContact OH-OD1 3.11Å
242	Y	98.8	Very high	96	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	122.2	170.2	-66	-55.4	0	0	0	109.8	V210 L213 V214 L231 L236 V240 V254 I255 R257	V210-Y242 VanDerWaalsContact CA-OH 3.27Å; V210-Y242 WeakPolarHBondContact CA-OH 2.92Å; V210-Y242 WeakPolarHBondContact CB-OH 3.34Å; V210-Y242 PolarHBondContact O-OH 2.97Å; L213-Y242 HydrophobicContact CD2-CE2 4.2Å; V214-Y242 HydrophobicContact CG2-CD1 3.86Å; V214-Y242 HydrophobicContact CG2-CE1 3.35Å; L231-Y242 HydrophobicContact CB-CD2 3.8Å; L231-Y242 HydrophobicContact CB-CE2 4.27Å; L231-Y242 HydrophobicContact CB-CG 4.35Å; L231-Y242 HydrophobicContact CD1-CG 4.44Å; L231-Y242 HydrophobicContact CD2-CD1 4.11Å; L231-Y242 HydrophobicContact CD2-CD2 3.74Å; L231-Y242 HydrophobicContact CD2-CE1 4.1Å; L231-Y242 HydrophobicContact CD2-CE2 3.69Å; L231-Y242 HydrophobicContact CD2-CG 3.92Å; L231-Y242 HydrophobicContact CG-CD2 4.26Å; L231-Y242 HydrophobicContact CG-CG 4.48Å; L236-Y242 HydrophobicContact CD1-CE2 4.01Å; V240-Y242 HydrophobicContact CG1-CD1 4.32Å; V240-Y242 HydrophobicContact CG1-CD2 3.93Å; V240-Y242 HydrophobicContact CG1-CE1 3.9Å; V240-Y242 HydrophobicContact CG1-CE2 3.49Å; V240-Y242 VanDerWaalsContact CG1-CE2 3.49Å; V240-Y242 HydrophobicContact CG1-CG 4.34Å; V240-Y242 VanDerWaalsContact CG1-CZ 3.49Å; V240-Y242 HydrophobicContact CG2-CD1 4.16Å; V240-Y242 HydrophobicContact CG2-CE1 3.91Å; Y242-V254 CarbonylContact O-C 3.59Å; Y242-V254 WeakPolarHBondContact O-CA 3.31Å; Y242-I255 PolarHBondContact N-O 2.8Å; Y242-I255 PolarHBondContact O-N 3.13Å; Y242-R257 HydrophobicContact CD2-CG 3.94Å; Y242-R257 HydrophobicContact CE2-CG 4.17Å
243	I	98.9	Very high	96.1	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.8	173.5	-54.9	79.7	0	0	0	106.1	S120 V122 H132 I182 S183 D185 V253 V254 E279	S120-I243 VanDerWaalsContact CB-CD1 3.46Å; V122-I243 HydrophobicContact CB-CG2 3.91Å; V122-I243 HydrophobicContact CG1-CG2 3.85Å; H132-I243 PolarHBondContact CE1-O 3.45Å; I182-I243 WeakPolarHBondContact CA-O 3.44Å; S183-I243 PolarHBondContact N-O 2.81Å; S183-I243 PolarHBondContact O-N 2.93Å; D185-I243 HydrophobicContact CB-CD1 4.32Å; I243-V253 WeakPolarHBondContact CA-O 3.41Å; I243-V254 HydrophobicContact CG1-CG1 4.45Å; I243-V254 HydrophobicContact CG1-CG2 4.13Å; I243-V254 HydrophobicContact CG2-CG2 4.46Å; I243-E279 HydrophobicContact CD1-CB 4.05Å; I243-E279 HydrophobicContact CD1-CG 4.22Å; I243-E279 HydrophobicContact CG1-CB 3.96Å
244	V	98.9	Very high	96.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	134.3	-176.8	-166.8	0	0	0	0	108.9	F180 T181 I182 F224 V228 L231 G252 V253 I255	F180-V244 HydrophobicContact CB-CG1 4.24Å; T181-V244 VanDerWaalsContact O-CA 3.27Å; T181-V244 WeakPolarHBondContact O-CA 3.25Å; T181-V244 WeakPolarHBondContact O-CG1 3.3Å; I182-V244 HydrophobicContact CG1-CG1 4.24Å; I182-V244 HydrophobicContact CG1-CG2 4.39Å; F224-V244 HydrophobicContact CD2-CG1 3.72Å; F224-V244 HydrophobicContact CE2-CB 3.99Å; F224-V244 HydrophobicContact CE2-CG1 3.69Å; V228-V244 HydrophobicContact CG2-CB 4.33Å; V228-V244 HydrophobicContact CG2-CG1 4.34Å; V228-V244 HydrophobicContact CG2-CG2 4.45Å; L231-V244 HydrophobicContact CD1-CG2 3.58Å; V244-G252 CarbonylContact O-C 3.49Å; V244-G252 VanDerWaalsContact O-CA 3.26Å; V244-G252 WeakPolarHBondContact O-CA 3.27Å; V244-V253 HydrophobicContact CB-CG1 3.92Å; V244-V253 HydrophobicContact CG2-CG1 4.32Å; V244-V253 PolarHBondContact N-O 2.72Å; V244-V253 PolarHBondContact O-N 2.94Å; V244-I255 HydrophobicContact CG2-CD1 4.17Å
245	G	98.9	Very high	96.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.7	172	0	0	0	0	0	110.8	F180 T181 E251	F180-G245 CarbonylContact C-O 3.59Å; F180-G245 WeakPolarHBondContact CA-O 3.18Å; T181-G245 PolarHBondContact N-O 2.85Å; T181-G245 PolarHBondContact O-N 3.41Å; T181-G245 WeakPolarHBondContact OG1-CA 3.43Å; T181-G245 PolarHBondContact OG1-N 2.93Å; T181-G245 PolarHBondContact OG1-O 2.78Å; G245-E251 CarbonylContact C-O 3.54Å; G245-E251 WeakPolarHBondContact CA-O 3.41Å
246	G	98.8	Very high	96.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.086	C	C	.	.			trans	-89.6	-151.2	179.9	0	0	0	0	0	113.4	F224 E251	F224-G246 VanDerWaalsContact CD2-N 3.34Å; G246-E251 PolarHBondContact N-O 3.48Å
247	V	98.6	Very high	96.9	Very high	43 Å²	43	14.4 Å²	14.4	26%	0.261	9%	0.086	S	C	.	.	S	Bend	trans	-114.4	-13.7	-178.8	-59.9	0	0	0	0	113.6	N178 K179 E251 A337 A338	N178-V247 VanDerWaalsContact C-CG1 3.43Å; K179-V247 WeakPolarHBondContact O-CG1 3.3Å; V247-E251 PolarHBondContact N-OE2 2.91Å; V247-A337 HydrophobicContact CG1-CB 3.64Å; V247-A338 HydrophobicContact CB-CB 4.15Å; V247-A338 HydrophobicContact CG1-CB 4.28Å
248	R	98.4	Very high	97.1	Very high	132 Å²	132	18 Å²	18	50%	0.498	11%	0.105	S	C	.	.	S	Bend	trans	-108.2	158.6	-179.4	-62.2	175.4	-75.3	-113.6	3.3	111.9	V130 G250 E251	V130-R248 WeakPolarHBondContact CG2-O 3.42Å; R248-G250 PolarHBondContact O-N 2.84Å; R248-E251 HydrophobicContact CB-CG 4.02Å; R248-E251 IonicContact CZ-OE1 3.76Å; R248-E251 PolarHBondContact N-OE2 3.31Å; R248-E251 IonicContact NE-OE1 3.73Å; R248-E251 PolarHBondContact NE-OE1 3.22Å; R248-E251 IonicContact NE-OE2 2.67Å; R248-E251 IonicContact NH2-OE1 3.12Å; R248-E251 PolarHBondContact NH2-OE1 3.06Å; R248-E251 VanDerWaalsContact O-CB 3.29Å; R248-E251 WeakPolarHBondContact O-CB 3.21Å; R248-E251 PolarHBondContact O-N 3.35Å
249	A	98.3	Very high	97.1	Very high	64 Å²	64	20.9 Å²	20.9	53%	0.529	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	135.6	169.5	0	0	0	0	0	110.9	G128 E251	G128-A249 PolarHBondContact O-N 3.25Å; A249-E251 VanDerWaalsContact C-N 3.29Å
250	G	98.2	Very high	96.9	Very high	33 Å²	33	29.2 Å²	29.2	34%	0.34	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	-15.1	-176.2	0	0	0	0	0	113.8	R248 G252	R248-G250 PolarHBondContact O-N 2.84Å; G250-G252 VanDerWaalsContact C-N 3.31Å; G250-G252 PolarHBondContact O-N 3.44Å
251	E	98.8	Very high	96.7	Very high	15 Å²	15	29.8 Å²	29.8	7%	0.07	16%	0.157	C	C	.	.			trans	-82.9	75	-177.3	-61.6	-172.8	152.6	0	0	111.7	F224 G245 G246 V247 R248 A249	F224-E251 HydrophobicContact CD1-CB 3.78Å; F224-E251 HydrophobicContact CD1-CG 3.74Å; F224-E251 HydrophobicContact CD2-CB 4.03Å; F224-E251 HydrophobicContact CE1-CB 3.86Å; F224-E251 HydrophobicContact CE1-CG 4.07Å; F224-E251 HydrophobicContact CE2-CB 4.09Å; F224-E251 HydrophobicContact CG-CB 3.87Å; F224-E251 HydrophobicContact CG-CG 4.12Å; F224-E251 HydrophobicContact CZ-CB 4.01Å; G245-E251 CarbonylContact C-O 3.54Å; G245-E251 WeakPolarHBondContact CA-O 3.41Å; G246-E251 PolarHBondContact N-O 3.48Å; V247-E251 PolarHBondContact N-OE2 2.91Å; R248-E251 HydrophobicContact CB-CG 4.02Å; R248-E251 IonicContact CZ-OE1 3.76Å; R248-E251 PolarHBondContact N-OE2 3.31Å; R248-E251 IonicContact NE-OE1 3.73Å; R248-E251 PolarHBondContact NE-OE1 3.22Å; R248-E251 IonicContact NE-OE2 2.67Å; R248-E251 IonicContact NH2-OE1 3.12Å; R248-E251 PolarHBondContact NH2-OE1 3.06Å; R248-E251 VanDerWaalsContact O-CB 3.29Å; R248-E251 WeakPolarHBondContact O-CB 3.21Å; R248-E251 PolarHBondContact O-N 3.35Å; A249-E251 VanDerWaalsContact C-N 3.29Å
252	G	98.9	Very high	96.7	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	-149.2	140.6	166.1	0	0	0	0	0	109.8	V244 G250 P267 L268	V244-G252 CarbonylContact O-C 3.49Å; V244-G252 VanDerWaalsContact O-CA 3.26Å; V244-G252 WeakPolarHBondContact O-CA 3.27Å; G250-G252 VanDerWaalsContact C-N 3.31Å; G250-G252 PolarHBondContact O-N 3.44Å; G252-P267 CarbonylContact O-C 3.59Å; G252-P267 WeakPolarHBondContact O-CA 3.26Å; G252-L268 PolarHBondContact O-N 3.05Å
253	V	98.9	Very high	96.6	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.03	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	147.2	-176.9	64.3	0	0	0	0	111.7	F224 V228 I243 V244 I255 I265 W266 P267	F224-V253 HydrophobicContact CE2-CG1 4.17Å; F224-V253 HydrophobicContact CZ-CB 4.34Å; F224-V253 HydrophobicContact CZ-CG1 3.79Å; V228-V253 HydrophobicContact CG1-CG1 4.44Å; V228-V253 HydrophobicContact CG2-CG1 3.52Å; I243-V253 WeakPolarHBondContact CA-O 3.41Å; V244-V253 HydrophobicContact CB-CG1 3.92Å; V244-V253 HydrophobicContact CG2-CG1 4.32Å; V244-V253 PolarHBondContact N-O 2.72Å; V244-V253 PolarHBondContact O-N 2.94Å; V253-I255 HydrophobicContact CG1-CD1 4.49Å; V253-I255 HydrophobicContact CG1-CG1 4.19Å; V253-I255 HydrophobicContact CG2-CG1 4.21Å; V253-I265 HydrophobicContact CG2-CG2 3.47Å; V253-I265 VanDerWaalsContact CG2-CG2 3.47Å; V253-W266 WeakPolarHBondContact CA-O 3.34Å; V253-P267 HydrophobicContact CG2-CB 4.42Å
254	V	98.9	Very high	96.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.6	163	-178.5	0	0	0	0	108.1	Y242 I243 W266 R277 E279	Y242-V254 CarbonylContact O-C 3.59Å; Y242-V254 WeakPolarHBondContact O-CA 3.31Å; I243-V254 HydrophobicContact CG1-CG1 4.45Å; I243-V254 HydrophobicContact CG1-CG2 4.13Å; I243-V254 HydrophobicContact CG2-CG2 4.46Å; V254-W266 HydrophobicContact CB-CB 4.32Å; V254-W266 HydrophobicContact CB-CE3 4.17Å; V254-W266 HydrophobicContact CG2-CE3 4.14Å; V254-W266 PolarHBondContact N-O 2.95Å; V254-W266 PolarHBondContact O-N 2.82Å; V254-R277 HydrophobicContact CG2-CB 3.6Å; V254-R277 HydrophobicContact CG2-CG 4.27Å; V254-E279 HydrophobicContact CG1-CB 3.9Å; V254-E279 HydrophobicContact CG1-CG 3.84Å; V254-E279 HydrophobicContact CG2-CB 4.19Å
255	I	98.8	Very high	96.6	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	108.5	178.3	-50.5	168.2	0	0	0	107.3	V228 L231 Y241 Y242 V244 V253 R257 P262 I265	V228-I255 HydrophobicContact CB-CD1 4.35Å; V228-I255 HydrophobicContact CG1-CD1 3.98Å; V228-I255 HydrophobicContact CG2-CD1 4.4Å; L231-I255 HydrophobicContact CB-CD1 3.86Å; Y241-I255 WeakPolarHBondContact CA-O 3.39Å; Y242-I255 PolarHBondContact N-O 2.8Å; Y242-I255 PolarHBondContact O-N 3.13Å; V244-I255 HydrophobicContact CG2-CD1 4.17Å; V253-I255 HydrophobicContact CG1-CD1 4.49Å; V253-I255 HydrophobicContact CG1-CG1 4.19Å; V253-I255 HydrophobicContact CG2-CG1 4.21Å; I255-R257 HydrophobicContact CG2-CG 3.9Å; I255-R257 PolarHBondContact O-N 2.8Å; I255-P262 HydrophobicContact CG2-CB 4.26Å; I255-I265 HydrophobicContact CG2-CG1 4.42Å
256	T	98.5	Very high	96.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	112.8	175.4	-58.1	0	0	0	0	109.1	Y241 P262 A263 D264 D283 W285	Y241-T256 HydrophobicContact CD1-CG2 3.81Å; Y241-T256 HydrophobicContact CE1-CG2 3.6Å; T256-P262 CarbonylContact O-C 3.57Å; T256-P262 WeakPolarHBondContact O-CA 3.2Å; T256-A263 HydrophobicContact CG2-CB 4.15Å; T256-A263 PolarHBondContact O-N 3.11Å; T256-D264 PolarHBondContact N-O 3.07Å; T256-D264 PolarHBondContact O-N 3.37Å; T256-D283 WeakPolarHBondContact CG2-OD1 3.4Å; T256-W285 HydrophobicContact CG2-CH2 3.69Å; T256-W285 HydrophobicContact CG2-CZ3 4.08Å
257	R	95.9	Very high	96.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.5	-172.8	-73.3	-64.1	-49.8	-86.7	-5.2	113.5	R187 L231 S232 T234 L236 G239 V240 Y242 I255 G261	R187-R257 PolarHBondContact NH1-O 3.38Å; L231-R257 WeakPolarHBondContact O-CD 3.44Å; L231-R257 PolarHBondContact O-NH1 2.81Å; S232-R257 VanDerWaalsContact O-CZ 3.24Å; S232-R257 PolarHBondContact O-NE 2.91Å; S232-R257 PolarHBondContact O-NH1 2.89Å; T234-R257 PolarHBondContact O-NH1 3.11Å; T234-R257 PolarHBondContact O-NH2 2.9Å; L236-R257 HydrophobicContact CD1-CB 3.96Å; L236-R257 HydrophobicContact CD1-CG 4.18Å; G239-R257 VanDerWaalsContact CA-O 3.25Å; G239-R257 WeakPolarHBondContact CA-O 3.44Å; V240-R257 HydrophobicContact CG1-CB 3.79Å; V240-R257 HydrophobicContact CG1-CG 4.22Å; V240-R257 PolarHBondContact N-O 2.84Å; V240-R257 WeakPolarHBondContact O-CA 3.28Å; V240-R257 VanDerWaalsContact O-CB 3.28Å; V240-R257 WeakPolarHBondContact O-CB 3.36Å; V240-R257 PolarHBondContact O-N 2.98Å; Y242-R257 HydrophobicContact CD2-CG 3.94Å; Y242-R257 HydrophobicContact CE2-CG 4.17Å; I255-R257 HydrophobicContact CG2-CG 3.9Å; I255-R257 PolarHBondContact O-N 2.8Å; R257-G261 VanDerWaalsContact NE-C 3.29Å; R257-G261 PolarHBondContact NE-O 2.88Å; R257-G261 VanDerWaalsContact NE-O 3.11Å
258	D	91.1	Very high	96.6	Very high	75 Å²	75	45 Å²	45	40%	0.401	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	171.3	154	-75.5	-47.1	0	0	0	110.5	R187 K260 G261	R187-D258 IonicContact CZ-OD1 3.93Å; R187-D258 IonicContact NH1-OD1 2.94Å; R187-D258 PolarHBondContact NH1-OD1 3.1Å; R187-D258 IonicContact NH1-OD2 2.71Å; D258-K260 PolarHBondContact O-N 2.9Å; D258-K260 VanDerWaalsContact O-N 3.09Å; D258-G261 PolarHBondContact N-O 2.84Å; D258-G261 PolarHBondContact O-N 3.41Å; D258-G261 VanDerWaalsContact O-O 3.13Å
259	R	88.3	Confident	96.5	Very high	62 Å²	62	42.8 Å²	42.8	23%	0.234	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.8	176.9	-63.8	-178.6	-174.6	-135.6	4.9	113.7	E190 N198 P235 L236 I237	E190-R259 IonicContact OE1-CZ 2.84Å; E190-R259 IonicContact OE1-NE 3.72Å; E190-R259 PolarHBondContact OE1-NE 3.41Å; E190-R259 IonicContact OE1-NH2 3.8Å; E190-R259 PolarHBondContact OE1-NH2 3.13Å; E190-R259 IonicContact OE2-CZ 3.59Å; E190-R259 IonicContact OE2-NH2 2.7Å; E190-R259 PolarHBondContact OE2-NH2 3.37Å; N198-R259 PolarHBondContact OD1-NH1 3.08Å; N198-R259 PolarHBondContact OD1-NH2 3.09Å; P235-R259 WeakPolarHBondContact CA-O 3.14Å; L236-R259 PolarHBondContact N-O 2.88Å; L236-R259 WeakPolarHBondContact O-CB 3.42Å; I237-R259 PolarHBondContact O-NE 2.81Å; I237-R259 PolarHBondContact O-NH1 2.86Å
260	K	85.9	Confident	96.2	Very high	180 Å²	180	41.1 Å²	41.1	78%	0.783	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-17.4	-174	-67.8	-175.1	178.8	-179.4	0	114.7	D258	D258-K260 PolarHBondContact O-N 2.9Å; D258-K260 VanDerWaalsContact O-N 3.09Å
261	G	91.6	Very high	95.9	Very high	13 Å²	13	47.8 Å²	47.8	13%	0.134	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	-172.3	-173.2	0	0	0	0	0	112.4	R257 D258	R257-G261 VanDerWaalsContact NE-C 3.29Å; R257-G261 PolarHBondContact NE-O 2.88Å; R257-G261 VanDerWaalsContact NE-O 3.11Å; D258-G261 PolarHBondContact N-O 2.84Å; D258-G261 PolarHBondContact O-N 3.41Å; D258-G261 VanDerWaalsContact O-O 3.13Å
262	P	96.6	Very high	95.7	Very high	58 Å²	58	53.4 Å²	53.4	38%	0.377	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	130	178.8	32.7	-29.3	0	0	0	110.2	S232 I255 T256 I265	S232-P262 WeakPolarHBondContact O-CD 3.39Å; I255-P262 HydrophobicContact CG2-CB 4.26Å; T256-P262 CarbonylContact O-C 3.57Å; T256-P262 WeakPolarHBondContact O-CA 3.2Å; P262-I265 HydrophobicContact CB-CD1 4.33Å; P262-I265 HydrophobicContact CB-CG1 4.02Å; P262-I265 HydrophobicContact CG-CD1 4.25Å; P262-I265 HydrophobicContact CG-CG1 4.47Å
263	A	97.4	Very high	95.4	Very high	48 Å²	48	55.8 Å²	55.8	40%	0.397	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-32.2	164.8	0	0	0	0	0	110.7	T256 W285	T256-A263 HydrophobicContact CG2-CB 4.15Å; T256-A263 PolarHBondContact O-N 3.11Å; A263-W285 HydrophobicContact CB-CH2 4.17Å
264	D	98.5	Very high	95.3	Very high	54 Å²	54	56.1 Å²	56.1	29%	0.289	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	156	175.3	-172.4	67	0	0	0	111.7	T256 H284 W285	T256-D264 PolarHBondContact N-O 3.07Å; T256-D264 PolarHBondContact O-N 3.37Å; D264-H284 IonicContact OD2-CD2 2.72Å; D264-H284 IonicContact OD2-CE1 3.82Å; D264-H284 IonicContact OD2-NE2 2.63Å; D264-H284 PolarHBondContact OD2-NE2 2.83Å; D264-W285 HydrophobicContact CB-CE3 4.28Å; D264-W285 HydrophobicContact CB-CH2 3.99Å; D264-W285 HydrophobicContact CB-CZ3 3.44Å; D264-W285 VanDerWaalsContact CB-CZ3 3.44Å
265	I	98.6	Very high	95.3	Very high	78 Å²	78	57.1 Å²	57.1	40%	0.4	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	112.3	171.7	-61.3	172.1	0	0	0	107.3	V253 I255 P262 P267	V253-I265 HydrophobicContact CG2-CG2 3.47Å; V253-I265 VanDerWaalsContact CG2-CG2 3.47Å; I255-I265 HydrophobicContact CG2-CG1 4.42Å; P262-I265 HydrophobicContact CB-CD1 4.33Å; P262-I265 HydrophobicContact CB-CG1 4.02Å; P262-I265 HydrophobicContact CG-CD1 4.25Å; P262-I265 HydrophobicContact CG-CG1 4.47Å; I265-P267 WeakPolarHBondContact O-CD 3.42Å
266	W	98.8	Very high	95.3	Very high	58 Å²	58	58.6 Å²	58.6	22%	0.22	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	86.3	-171.8	-170.6	34.1	0	0	0	111.3	V253 V254 R277 H284	V253-W266 WeakPolarHBondContact CA-O 3.34Å; V254-W266 HydrophobicContact CB-CB 4.32Å; V254-W266 HydrophobicContact CB-CE3 4.17Å; V254-W266 HydrophobicContact CG2-CE3 4.14Å; V254-W266 PolarHBondContact N-O 2.95Å; V254-W266 PolarHBondContact O-N 2.82Å; W266-R277 VanDerWaalsContact CD2-CD 3.46Å; W266-R277 HydrophobicContact CD2-CG 4.31Å; W266-R277 HydrophobicContact CE3-CB 4.27Å; W266-R277 HydrophobicContact CE3-CG 4.3Å; W266-R277 VanDerWaalsContact CZ2-CD 3.44Å; W266-R277 HydrophobicContact CZ3-CB 4.16Å; W266-H284 AromaticContact CD2-CD2 3.96Å; W266-H284 AromaticContact CD2-CG 3.97Å; W266-H284 HydrophobicContact CE3-CB 3.9Å; W266-H284 AromaticContact CE3-CD2 3.76Å; W266-H284 AromaticContact CE3-CG 3.73Å; W266-H284 AromaticContact CG-NE2 3.82Å; W266-H284 HydrophobicContact CH2-CB 4.24Å; W266-H284 HydrophobicContact CZ3-CB 3.74Å
267	P	98.8	Very high	95.3	Very high	59 Å²	59	59.5 Å²	59.5	38%	0.383	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	163	-176.8	32.8	-37.2	0	0	0	111.6	G252 V253 I265 R277	G252-P267 CarbonylContact O-C 3.59Å; G252-P267 WeakPolarHBondContact O-CA 3.26Å; V253-P267 HydrophobicContact CG2-CB 4.42Å; I265-P267 WeakPolarHBondContact O-CD 3.42Å; P267-R277 PolarHBondContact O-NE 2.87Å; P267-R277 PolarHBondContact O-NH2 3.16Å
268	L	98.7	Very high	95.4	Very high	10 Å²	10	59.5 Å²	59.5	5%	0.052	32%	0.324	C	S	.	.			trans	-61	143.8	162.6	-70.9	176.3	0	0	0	110	V122 Q124 G252 P270 Y276 R277	V122-L268 HydrophobicContact CG2-CD1 4.39Å; Q124-L268 HydrophobicContact CB-CD1 4.09Å; G252-L268 PolarHBondContact O-N 3.05Å; L268-P270 HydrophobicContact CB-CG 4.37Å; L268-Y276 VanDerWaalsContact CD2-CA 3.48Å; L268-R277 HydrophobicContact CD2-CG 3.98Å
269	E	97.2	Very high	95.8	Very high	86 Å²	86	56 Å²	56	40%	0.402	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-132.6	66	175.5	-64.4	174.8	94.4	0	0	109.9	L271 N272 G273 G274 R277	E269-L271 PolarHBondContact O-N 3.26Å; E269-L271 VanDerWaalsContact O-N 3.11Å; E269-N272 HydrophobicContact CB-CB 4.27Å; E269-N272 CarbonylContact O-C 3.53Å; E269-N272 PolarHBondContact O-N 3.35Å; E269-G273 PolarHBondContact O-N 2.79Å; E269-G274 CarbonylContact C-O 3.57Å; E269-G274 PolarHBondContact N-O 3.23Å; E269-G274 WeakPolarHBondContact O-CA 3.17Å; E269-G274 PolarHBondContact O-N 2.93Å; E269-R277 IonicContact OE2-NH2 2.74Å; E269-R277 PolarHBondContact OE2-NH2 3.14Å
270	P	92.9	Very high	96.2	Very high	30 Å²	30	53 Å²	53	20%	0.195	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-59.6	-30.7	-169.7	-21.6	32.5	0	0	0	113.4	Q124 L268 N272 G273	Q124-P270 VanDerWaalsContact OE1-CG 3.3Å; L268-P270 HydrophobicContact CB-CG 4.37Å; P270-N272 VanDerWaalsContact C-N 3.28Å; P270-N272 PolarHBondContact O-N 2.68Å; P270-G273 PolarHBondContact O-N 2.9Å
271	L	91.4	Very high	96.6	Very high	173 Å²	173	45.7 Å²	45.7	91%	0.906	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-68.9	-25.3	177.8	-60.3	-179.5	0	0	0	113.2	E269	E269-L271 PolarHBondContact O-N 3.26Å; E269-L271 VanDerWaalsContact O-N 3.11Å
272	N	93.9	Very high	96.8	Very high	132 Å²	132	46.1 Å²	46.1	71%	0.706	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-104.2	18.3	179.7	-61.7	-27.9	0	0	0	111.8	E269 P270 G274	E269-N272 HydrophobicContact CB-CB 4.27Å; E269-N272 CarbonylContact O-C 3.53Å; E269-N272 PolarHBondContact O-N 3.35Å; P270-N272 VanDerWaalsContact C-N 3.28Å; P270-N272 PolarHBondContact O-N 2.68Å; N272-G274 VanDerWaalsContact C-N 3.25Å; N272-G274 PolarHBondContact O-N 3.17Å
273	G	92.8	Very high	96.8	Very high	51 Å²	51	44.2 Å²	44.2	53%	0.526	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-2	-177.3	0	0	0	0	0	114.9	E269 P270 W275	E269-G273 PolarHBondContact O-N 2.79Å; P270-G273 PolarHBondContact O-N 2.9Å; G273-W275 PolarHBondContact O-N 3.18Å
274	G	97	Very high	96.8	Very high	11 Å²	11	44 Å²	44	11%	0.113	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-79.4	52.3	175.5	0	0	0	0	0	113.2	E269 N272 Y276	E269-G274 CarbonylContact C-O 3.57Å; E269-G274 PolarHBondContact N-O 3.23Å; E269-G274 WeakPolarHBondContact O-CA 3.17Å; E269-G274 PolarHBondContact O-N 2.93Å; N272-G274 VanDerWaalsContact C-N 3.25Å; N272-G274 PolarHBondContact O-N 3.17Å; G274-Y276 PolarHBondContact O-N 2.76Å
275	W	98.5	Very high	96.7	Very high	21 Å²	21	47.2 Å²	47.2	8%	0.08	25%	0.247	C	C	.	.			trans	-78.9	-2.3	-176.1	63.8	-91.4	0	0	0	114.3	T123 Q124 G273 L302 Q307 I310	T123-W275 CarbonylContact C-O 3.58Å; T123-W275 WeakPolarHBondContact CA-O 3.25Å; Q124-W275 PolarHBondContact N-O 2.8Å; G273-W275 PolarHBondContact O-N 3.18Å; W275-L302 HydrophobicContact CH2-CB 4.15Å; W275-L302 HydrophobicContact CH2-CD2 4.42Å; W275-L302 WeakPolarHBondContact CH2-O 3.47Å; W275-L302 WeakPolarHBondContact CZ2-O 3.49Å; W275-Q307 VanDerWaalsContact CB-CD 3.49Å; W275-Q307 HydrophobicContact CB-CG 3.91Å; W275-Q307 VanDerWaalsContact CB-NE2 3.33Å; W275-Q307 HydrophobicContact CD2-CB 3.69Å; W275-Q307 HydrophobicContact CD2-CG 3.72Å; W275-Q307 HydrophobicContact CE3-CB 4.14Å; W275-Q307 HydrophobicContact CE3-CG 3.98Å; W275-Q307 HydrophobicContact CG-CB 3.9Å; W275-Q307 HydrophobicContact CG-CG 3.69Å; W275-Q307 HydrophobicContact CZ2-CB 4.36Å; W275-I310 HydrophobicContact CE3-CG2 4.26Å; W275-I310 HydrophobicContact CH2-CB 4.49Å; W275-I310 HydrophobicContact CZ3-CB 3.89Å; W275-I310 HydrophobicContact CZ3-CG1 4.04Å; W275-I310 HydrophobicContact CZ3-CG2 3.89Å
276	Y	98.8	Very high	96.5	Very high	31 Å²	31	47.5 Å²	47.5	12%	0.122	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	159	169.2	66	-99.5	0	0	0	111.6	V122 L268 G274 V278 N299 L302 N303	V122-Y276 CarbonylContact O-C 3.54Å; V122-Y276 WeakPolarHBondContact O-CA 3.39Å; L268-Y276 VanDerWaalsContact CD2-CA 3.48Å; G274-Y276 PolarHBondContact O-N 2.76Å; Y276-V278 HydrophobicContact CD2-CG2 3.91Å; Y276-V278 HydrophobicContact CE2-CG2 4.1Å; Y276-N299 VanDerWaalsContact CE2-OD1 3.29Å; Y276-N299 WeakPolarHBondContact CE2-OD1 3.23Å; Y276-L302 HydrophobicContact CD1-CB 4Å; Y276-L302 HydrophobicContact CD1-CD1 4.29Å; Y276-L302 HydrophobicContact CD2-CD1 3.58Å; Y276-L302 HydrophobicContact CE1-CB 3.85Å; Y276-L302 HydrophobicContact CE2-CB 4.44Å; Y276-L302 HydrophobicContact CE2-CD1 3.93Å; Y276-L302 HydrophobicContact CG-CB 4.36Å; Y276-L302 HydrophobicContact CG-CD1 3.79Å; Y276-N303 PolarHBondContact OH-ND2 3.26Å; Y276-N303 PolarHBondContact OH-OD1 3.23Å; Y276-N303 VanDerWaalsContact OH-OD1 3.09Å
277	R	98.8	Very high	96.1	Very high	19 Å²	19	49.9 Å²	49.9	7%	0.072	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.2	163.2	-56.6	-59.3	178.6	-152.6	9	109.6	I121 V122 V254 W266 P267 L268 E269	I121-R277 WeakPolarHBondContact CA-O 3.32Å; V122-R277 HydrophobicContact CG1-CB 3.89Å; V122-R277 HydrophobicContact CG1-CG 4.36Å; V122-R277 PolarHBondContact N-O 3.13Å; V122-R277 VanDerWaalsContact N-O 3.07Å; V122-R277 PolarHBondContact O-N 3.19Å; V254-R277 HydrophobicContact CG2-CB 3.6Å; V254-R277 HydrophobicContact CG2-CG 4.27Å; W266-R277 VanDerWaalsContact CD2-CD 3.46Å; W266-R277 HydrophobicContact CD2-CG 4.31Å; W266-R277 HydrophobicContact CE3-CB 4.27Å; W266-R277 HydrophobicContact CE3-CG 4.3Å; W266-R277 VanDerWaalsContact CZ2-CD 3.44Å; W266-R277 HydrophobicContact CZ3-CB 4.16Å; P267-R277 PolarHBondContact O-NE 2.87Å; P267-R277 PolarHBondContact O-NH2 3.16Å; L268-R277 HydrophobicContact CD2-CG 3.98Å; E269-R277 IonicContact OE2-NH2 2.74Å; E269-R277 PolarHBondContact OE2-NH2 3.14Å
278	V	98.8	Very high	95.7	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.4	173.8	178.9	0	0	0	0	107.2	T119 I121 Y276 R295 A298 N299 L302	T119-V278 HydrophobicContact CG2-CG1 4.49Å; I121-V278 HydrophobicContact CG1-CG1 4.4Å; I121-V278 HydrophobicContact CG1-CG2 4.21Å; I121-V278 HydrophobicContact CG2-CG2 4.28Å; Y276-V278 HydrophobicContact CD2-CG2 3.91Å; Y276-V278 HydrophobicContact CE2-CG2 4.1Å; V278-R295 HydrophobicContact CB-CG 4.43Å; V278-R295 HydrophobicContact CG1-CG 4.02Å; V278-A298 HydrophobicContact CG1-CB 3.73Å; V278-A298 HydrophobicContact CG2-CB 4.09Å; V278-N299 VanDerWaalsContact CG2-OD1 3.3Å; V278-N299 WeakPolarHBondContact CG2-OD1 3.26Å; V278-L302 HydrophobicContact CG2-CD1 3.4Å
279	E	98.6	Very high	95.3	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.2	170.8	-173.7	49.6	-108.2	0	0	109.3	S120 Y241 I243 V254	S120-E279 PolarHBondContact N-O 3.12Å; S120-E279 PolarHBondContact O-N 3.09Å; Y241-E279 HydrophobicContact CD1-CG 3.96Å; Y241-E279 HydrophobicContact CD2-CG 4.03Å; Y241-E279 HydrophobicContact CG-CG 3.59Å; I243-E279 HydrophobicContact CD1-CB 4.05Å; I243-E279 HydrophobicContact CD1-CG 4.22Å; I243-E279 HydrophobicContact CG1-CB 3.96Å; V254-E279 HydrophobicContact CG1-CB 3.9Å; V254-E279 HydrophobicContact CG1-CG 3.84Å; V254-E279 HydrophobicContact CG2-CB 4.19Å
280	T	96.8	Very high	94.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.304	C	S	.	.			trans	-125.9	-99.8	173.9	52	0	0	0	0	109.1	C118 T119 D185 F282 R294 R295	C118-T280 CarbonylContact O-C 3.57Å; C118-T280 VanDerWaalsContact O-CA 3.23Å; C118-T280 WeakPolarHBondContact O-CA 3.31Å; T119-T280 HydrophobicContact CG2-CG2 3.89Å; D185-T280 WeakPolarHBondContact CB-O 2.96Å; T280-F282 WeakPolarHBondContact OG1-CD1 3.17Å; T280-F282 WeakPolarHBondContact OG1-CE1 3.3Å; T280-F282 WeakPolarHBondContact OG1-CZ 3.09Å; T280-R294 HydrophobicContact CG2-CB 3.91Å; T280-R295 HydrophobicContact CG2-CB 4.1Å
281	N	95	Very high	94.8	Very high	26 Å²	26	56.4 Å²	56.4	14%	0.139	33%	0.333	C	S	.	.	S	Bend	trans	-138.9	19	-178.1	-63.1	108.6	0	0	0	112.5	C118 Q186 Y241 R294	C118-N281 PolarHBondContact N-OD1 3.18Å; C118-N281 PolarHBondContact O-OD1 2.81Å; Q186-N281 PolarHBondContact N-ND2 2.89Å; Q186-N281 PolarHBondContact O-ND2 3.39Å; Y241-N281 VanDerWaalsContact CE2-C 3.5Å; Y241-N281 PolarHBondContact OH-O 3.45Å; N281-R294 PolarHBondContact OD1-NH1 2.94Å; N281-R294 PolarHBondContact OD1-NH2 2.85Å
282	F	94.7	Very high	94.8	Very high	22 Å²	22	49.5 Å²	49.5	10%	0.096	30%	0.297	C	S	.	.	S	Bend	trans	-149.3	138	-175.8	50.2	-91.7	0	0	0	111	Y241 T280 H284 P288 P289 D292 R295	Y241-F282 WeakPolarHBondContact OH-CA 3.17Å; Y241-F282 PolarHBondContact OH-N 2.91Å; T280-F282 WeakPolarHBondContact OG1-CD1 3.17Å; T280-F282 WeakPolarHBondContact OG1-CE1 3.3Å; T280-F282 WeakPolarHBondContact OG1-CZ 3.09Å; F282-H284 PolarHBondContact O-N 3.04Å; F282-P288 HydrophobicContact CD2-CB 4.36Å; F282-P288 HydrophobicContact CE2-CB 3.43Å; F282-P288 VanDerWaalsContact CE2-CB 3.43Å; F282-P288 HydrophobicContact CZ-CB 3.57Å; F282-P289 HydrophobicContact CD1-CG 4.12Å; F282-P289 HydrophobicContact CE1-CG 4.47Å; F282-P289 HydrophobicContact CG-CG 4.4Å; F282-D292 HydrophobicContact CE1-CB 4.44Å; F282-R295 HydrophobicContact CE2-CB 4.29Å; F282-R295 HydrophobicContact CZ-CB 3.85Å; F282-R295 PolarHBondContact O-NH1 3.41Å
283	D	96.9	Very high	94.8	Very high	18 Å²	18	47.5 Å²	47.5	10%	0.096	28%	0.283	C	S	.	.			trans	-45.8	132	-175	-66.1	-17.8	0	0	0	112.1	R187 Y241 T256 W285 L286 R295	R187-D283 IonicContact CZ-OD1 2.79Å; R187-D283 IonicContact CZ-OD2 3.38Å; R187-D283 IonicContact NE-OD1 3.48Å; R187-D283 PolarHBondContact NE-OD1 2.86Å; R187-D283 IonicContact NE-OD2 3.88Å; R187-D283 IonicContact NH2-OD1 2.6Å; R187-D283 PolarHBondContact NH2-OD1 3.25Å; R187-D283 IonicContact NH2-OD2 3.26Å; R187-D283 PolarHBondContact NH2-OD2 2.93Å; Y241-D283 WeakPolarHBondContact CE1-OD1 3.24Å; Y241-D283 PolarHBondContact OH-N 2.96Å; Y241-D283 PolarHBondContact OH-OD1 3.03Å; Y241-D283 VanDerWaalsContact OH-OD1 3.11Å; T256-D283 WeakPolarHBondContact CG2-OD1 3.4Å; D283-W285 HydrophobicContact CB-CD2 3.88Å; D283-W285 HydrophobicContact CB-CE3 4.1Å; D283-W285 HydrophobicContact CB-CH2 3.9Å; D283-W285 HydrophobicContact CB-CZ2 3.63Å; D283-W285 HydrophobicContact CB-CZ3 4.1Å; D283-W285 VanDerWaalsContact CG-CZ2 3.4Å; D283-W285 PolarHBondContact O-N 3.26Å; D283-W285 VanDerWaalsContact OD2-CZ2 3.23Å; D283-W285 WeakPolarHBondContact OD2-CZ2 2.9Å; D283-L286 HydrophobicContact CB-CB 4.36Å; D283-L286 HydrophobicContact CB-CD1 3.93Å; D283-L286 HydrophobicContact CB-CG 3.96Å; D283-L286 PolarHBondContact O-N 2.89Å; D283-R295 PolarHBondContact O-NH1 2.87Å; D283-R295 VanDerWaalsContact O-NH1 3.16Å
284	H	96.8	Very high	95	Very high	44 Å²	44	45.5 Å²	45.5	20%	0.204	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.2	-173.8	71	79.6	0	0	0	113.7	D264 W266 F282 L286 R295	D264-H284 IonicContact OD2-CD2 2.72Å; D264-H284 IonicContact OD2-CE1 3.82Å; D264-H284 IonicContact OD2-NE2 2.63Å; D264-H284 PolarHBondContact OD2-NE2 2.83Å; W266-H284 AromaticContact CD2-CD2 3.96Å; W266-H284 AromaticContact CD2-CG 3.97Å; W266-H284 HydrophobicContact CE3-CB 3.9Å; W266-H284 AromaticContact CE3-CD2 3.76Å; W266-H284 AromaticContact CE3-CG 3.73Å; W266-H284 AromaticContact CG-NE2 3.82Å; W266-H284 HydrophobicContact CH2-CB 4.24Å; W266-H284 HydrophobicContact CZ3-CB 3.74Å; F282-H284 PolarHBondContact O-N 3.04Å; H284-L286 VanDerWaalsContact C-N 3.31Å; H284-R295 VanDerWaalsContact CA-NH1 3.32Å
285	W	97.2	Very high	95	Very high	122 Å²	122	46.3 Å²	46.3	46%	0.462	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.1	176.2	62.5	87.1	0	0	0	114.2	T256 A263 D264 D283	T256-W285 HydrophobicContact CG2-CH2 3.69Å; T256-W285 HydrophobicContact CG2-CZ3 4.08Å; A263-W285 HydrophobicContact CB-CH2 4.17Å; D264-W285 HydrophobicContact CB-CE3 4.28Å; D264-W285 HydrophobicContact CB-CH2 3.99Å; D264-W285 HydrophobicContact CB-CZ3 3.44Å; D264-W285 VanDerWaalsContact CB-CZ3 3.44Å; D283-W285 HydrophobicContact CB-CD2 3.88Å; D283-W285 HydrophobicContact CB-CE3 4.1Å; D283-W285 HydrophobicContact CB-CH2 3.9Å; D283-W285 HydrophobicContact CB-CZ2 3.63Å; D283-W285 HydrophobicContact CB-CZ3 4.1Å; D283-W285 VanDerWaalsContact CG-CZ2 3.4Å; D283-W285 PolarHBondContact O-N 3.26Å; D283-W285 VanDerWaalsContact OD2-CZ2 3.23Å; D283-W285 WeakPolarHBondContact OD2-CZ2 2.9Å
286	L	94.6	Very high	95	Very high	84 Å²	84	50.6 Å²	50.6	44%	0.44	28%	0.28	S	S	.	.	S	Bend	trans	-99.9	151.5	176.8	-63.3	-178	0	0	0	111.2	D283 H284 R295	D283-L286 HydrophobicContact CB-CB 4.36Å; D283-L286 HydrophobicContact CB-CD1 3.93Å; D283-L286 HydrophobicContact CB-CG 3.96Å; D283-L286 PolarHBondContact O-N 2.89Å; H284-L286 VanDerWaalsContact C-N 3.31Å; L286-R295 PolarHBondContact O-NH2 2.9Å
287	P	90.8	Very high	94.9	Very high	108 Å²	108	50.8 Å²	50.8	70%	0.701	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-61	142.6	171.3	26.4	-33.9	0	0	0	110.5
288	P	89.4	Confident	94.9	Very high	54 Å²	54	49.9 Å²	49.9	35%	0.351	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-60.4	147.6	174	25.3	-32.6	0	0	0	111.1	F282 A290	F282-P288 HydrophobicContact CD2-CB 4.36Å; F282-P288 HydrophobicContact CE2-CB 3.43Å; F282-P288 VanDerWaalsContact CE2-CB 3.43Å; F282-P288 HydrophobicContact CZ-CB 3.57Å; P288-A290 PolarHBondContact O-N 3.42Å
289	P	89.6	Confident	94.9	Very high	58 Å²	58	52 Å²	52	38%	0.377	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-55.2	138.4	166.8	-21.7	32.4	0	0	0	110.7	F282 S291 D292	F282-P289 HydrophobicContact CD1-CG 4.12Å; F282-P289 HydrophobicContact CE1-CG 4.47Å; F282-P289 HydrophobicContact CG-CG 4.4Å; P289-S291 PolarHBondContact O-N 3.44Å; P289-D292 HydrophobicContact CB-CB 4.32Å; P289-D292 PolarHBondContact O-N 2.6Å
290	A	90.2	Very high	94.9	Very high	95 Å²	95	59.3 Å²	59.3	79%	0.785	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.7	-176.7	0	0	0	0	0	114.2	P288 H293	P288-A290 PolarHBondContact O-N 3.42Å; A290-H293 PolarHBondContact O-NE2 3.37Å
291	S	89.4	Confident	94.9	Very high	115 Å²	115	59.6 Å²	59.6	80%	0.804	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.4	177.9	53.8	0	0	0	0	114.2	P289	P289-S291 PolarHBondContact O-N 3.44Å
292	D	92.1	Very high	95.1	Very high	28 Å²	28	58.4 Å²	58.4	15%	0.15	32%	0.32	C	S	.	.			trans	-126.7	98.5	-174.7	-172.1	-6.1	0	0	0	112.3	F282 P289 R294	F282-D292 HydrophobicContact CE1-CB 4.44Å; P289-D292 HydrophobicContact CB-CB 4.32Å; P289-D292 PolarHBondContact O-N 2.6Å; D292-R294 WeakPolarHBondContact OD1-CB 3.47Å; D292-R294 VanDerWaalsContact OD1-CG 3.22Å; D292-R294 WeakPolarHBondContact OD1-CG 2.95Å; D292-R294 IonicContact OD1-CZ 2.7Å; D292-R294 PolarHBondContact OD1-N 3.28Å; D292-R294 VanDerWaalsContact OD1-N 3.14Å; D292-R294 IonicContact OD1-NE 3.76Å; D292-R294 PolarHBondContact OD1-NE 3.4Å; D292-R294 IonicContact OD1-NH2 3.54Å; D292-R294 IonicContact OD2-CZ 3.75Å; D292-R294 IonicContact OD2-NE 2.88Å; D292-R294 PolarHBondContact OD2-NE 3.31Å; D292-R294 IonicContact OD2-NH2 3.85Å; D292-R294 PolarHBondContact OD2-NH2 3.25Å
293	H	95.3	Very high	95.3	Very high	89 Å²	89	62 Å²	62	41%	0.412	34%	0.34	S	S	.	.			trans	-97.6	14.5	-178.2	-60.6	-77	0	0	0	114.1	A290 E296 T297 P323	A290-H293 PolarHBondContact O-NE2 3.37Å; H293-E296 IonicContact ND1-OE2 3.29Å; H293-E296 PolarHBondContact ND1-OE2 3.22Å; H293-E296 PolarHBondContact O-N 3.26Å; H293-T297 WeakPolarHBondContact O-CB 3.35Å; H293-T297 PolarHBondContact O-N 2.9Å; H293-T297 PolarHBondContact O-OG1 3.4Å; H293-P323 HydrophobicContact CB-CG 4.2Å
294	R	96.6	Very high	95.4	Very high	10 Å²	10	64 Å²	64	4%	0.038	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-47.3	-175.2	-68.4	177.9	-62.9	134.6	1.5	112.4	C118 T119 D137 T280 N281 D292 T297 A298 P323 I324	C118-R294 VanDerWaalsContact C-NH1 3.28Å; C118-R294 PolarHBondContact O-NH1 2.54Å; T119-R294 PolarHBondContact OG1-NH1 2.81Å; D137-R294 IonicContact OD2-NH1 3.18Å; T280-R294 HydrophobicContact CG2-CB 3.91Å; N281-R294 PolarHBondContact OD1-NH1 2.94Å; N281-R294 PolarHBondContact OD1-NH2 2.85Å; D292-R294 WeakPolarHBondContact OD1-CB 3.47Å; D292-R294 VanDerWaalsContact OD1-CG 3.22Å; D292-R294 WeakPolarHBondContact OD1-CG 2.95Å; D292-R294 IonicContact OD1-CZ 2.7Å; D292-R294 PolarHBondContact OD1-N 3.28Å; D292-R294 VanDerWaalsContact OD1-N 3.14Å; D292-R294 IonicContact OD1-NE 3.76Å; D292-R294 PolarHBondContact OD1-NE 3.4Å; D292-R294 IonicContact OD1-NH2 3.54Å; D292-R294 IonicContact OD2-CZ 3.75Å; D292-R294 IonicContact OD2-NE 2.88Å; D292-R294 PolarHBondContact OD2-NE 3.31Å; D292-R294 IonicContact OD2-NH2 3.85Å; D292-R294 PolarHBondContact OD2-NH2 3.25Å; R294-T297 PolarHBondContact O-N 2.99Å; R294-A298 WeakPolarHBondContact O-CB 3.47Å; R294-A298 PolarHBondContact O-N 3.3Å; R294-P323 HydrophobicContact CG-CB 4.31Å; R294-P323 HydrophobicContact CG-CG 4.05Å; R294-P323 WeakPolarHBondContact CG-O 2.99Å; R294-I324 HydrophobicContact CB-CG1 4.45Å
295	R	97.1	Very high	95.4	Very high	27 Å²	27	62.4 Å²	62.4	10%	0.102	35%	0.353	C	S	.	.	H	α-helix	trans	-63.3	-44.2	179.5	-170.2	172.9	76.9	-167.6	6.8	112.2	V278 T280 F282 D283 H284 L286 A298 N299	V278-R295 HydrophobicContact CB-CG 4.43Å; V278-R295 HydrophobicContact CG1-CG 4.02Å; T280-R295 HydrophobicContact CG2-CB 4.1Å; F282-R295 HydrophobicContact CE2-CB 4.29Å; F282-R295 HydrophobicContact CZ-CB 3.85Å; F282-R295 PolarHBondContact O-NH1 3.41Å; D283-R295 PolarHBondContact O-NH1 2.87Å; D283-R295 VanDerWaalsContact O-NH1 3.16Å; H284-R295 VanDerWaalsContact CA-NH1 3.32Å; L286-R295 PolarHBondContact O-NH2 2.9Å; R295-A298 PolarHBondContact O-N 3.03Å; R295-N299 WeakPolarHBondContact O-CB 3.49Å; R295-N299 VanDerWaalsContact O-CG 3.23Å; R295-N299 PolarHBondContact O-N 3.27Å; R295-N299 PolarHBondContact O-ND2 2.94Å
296	E	97.2	Very high	95.5	Very high	112 Å²	112	57.6 Å²	57.6	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-47.3	177.4	-175.6	-173.5	172.9	0	0	111.5	H293 A298 N299 K300	H293-E296 IonicContact ND1-OE2 3.29Å; H293-E296 PolarHBondContact ND1-OE2 3.22Å; H293-E296 PolarHBondContact O-N 3.26Å; E296-A298 VanDerWaalsContact C-N 3.35Å; E296-A298 PolarHBondContact O-N 3.39Å; E296-N299 PolarHBondContact O-N 3.33Å; E296-K300 WeakPolarHBondContact O-CB 3.49Å; E296-K300 PolarHBondContact O-N 3.23Å
297	T	97.7	Very high	95.6	Very high	34 Å²	34	54.6 Å²	54.6	21%	0.209	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-43.4	179.1	-57.3	0	0	0	0	111.3	H293 R294 K300 A301 L321 P323 I324	H293-T297 WeakPolarHBondContact O-CB 3.35Å; H293-T297 PolarHBondContact O-N 2.9Å; H293-T297 PolarHBondContact O-OG1 3.4Å; R294-T297 PolarHBondContact O-N 2.99Å; T297-K300 PolarHBondContact O-N 2.83Å; T297-A301 WeakPolarHBondContact O-CB 3.33Å; T297-A301 PolarHBondContact O-N 3.36Å; T297-L321 HydrophobicContact CG2-CB 4.33Å; T297-P323 WeakPolarHBondContact OG1-CD 3.29Å; T297-I324 HydrophobicContact CG2-CD1 3.98Å; T297-I324 HydrophobicContact CG2-CG1 4.3Å
298	A	98.2	Very high	95.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.8	-47.5	178.4	0	0	0	0	0	111.3	I121 V278 R294 R295 E296 K300 A301 L302 V318 I324	I121-A298 HydrophobicContact CD1-CB 4.29Å; V278-A298 HydrophobicContact CG1-CB 3.73Å; V278-A298 HydrophobicContact CG2-CB 4.09Å; R294-A298 WeakPolarHBondContact O-CB 3.47Å; R294-A298 PolarHBondContact O-N 3.3Å; R295-A298 PolarHBondContact O-N 3.03Å; E296-A298 VanDerWaalsContact C-N 3.35Å; E296-A298 PolarHBondContact O-N 3.39Å; A298-K300 VanDerWaalsContact C-N 3.34Å; A298-K300 PolarHBondContact O-N 3.08Å; A298-A301 PolarHBondContact O-N 3.36Å; A298-L302 WeakPolarHBondContact O-CB 3.48Å; A298-L302 WeakPolarHBondContact O-CG 3.39Å; A298-L302 PolarHBondContact O-N 3.39Å; A298-V318 HydrophobicContact CB-CG1 4.39Å; A298-I324 HydrophobicContact CB-CD1 3.65Å; A298-I324 HydrophobicContact CB-CG1 4.3Å
299	N	98.4	Very high	96.3	Very high	47 Å²	47	58 Å²	58	25%	0.251	33%	0.33	S	S	.	.	H	α-helix	trans	-57.9	-45.8	176.2	-74.3	-22.1	0	0	0	111.7	Y276 V278 R295 E296 A301 L302 N303	Y276-N299 VanDerWaalsContact CE2-OD1 3.29Å; Y276-N299 WeakPolarHBondContact CE2-OD1 3.23Å; V278-N299 VanDerWaalsContact CG2-OD1 3.3Å; V278-N299 WeakPolarHBondContact CG2-OD1 3.26Å; R295-N299 WeakPolarHBondContact O-CB 3.49Å; R295-N299 VanDerWaalsContact O-CG 3.23Å; R295-N299 PolarHBondContact O-N 3.27Å; R295-N299 PolarHBondContact O-ND2 2.94Å; E296-N299 PolarHBondContact O-N 3.33Å; N299-A301 VanDerWaalsContact C-N 3.35Å; N299-A301 PolarHBondContact O-N 3.03Å; N299-L302 PolarHBondContact O-N 3.44Å; N299-N303 WeakPolarHBondContact O-CB 3.39Å; N299-N303 VanDerWaalsContact O-CG 3.28Å; N299-N303 PolarHBondContact O-N 2.78Å; N299-N303 PolarHBondContact O-ND2 2.76Å
300	K	98.5	Very high	96.7	Very high	153 Å²	153	55.4 Å²	55.4	67%	0.665	31%	0.313	S	S	*	.	H	α-helix	trans	-61.7	-43	178.2	-174.8	177.4	179.7	179.4	0	111.8	E296 T297 A298 A304	E296-K300 WeakPolarHBondContact O-CB 3.49Å; E296-K300 PolarHBondContact O-N 3.23Å; T297-K300 PolarHBondContact O-N 2.83Å; A298-K300 VanDerWaalsContact C-N 3.34Å; A298-K300 PolarHBondContact O-N 3.08Å; K300-A304 WeakPolarHBondContact O-CB 3.44Å; K300-A304 PolarHBondContact O-N 2.88Å
301	A	98.5	Very high	97.1	Very high	6 Å²	6	53.7 Å²	53.7	5%	0.05	29%	0.291	C	S	.	.	H	α-helix	trans	-70.4	-38.6	-180	0	0	0	0	0	112.9	T297 A298 N299 A304 T305 V318 L321	T297-A301 WeakPolarHBondContact O-CB 3.33Å; T297-A301 PolarHBondContact O-N 3.36Å; A298-A301 PolarHBondContact O-N 3.36Å; N299-A301 VanDerWaalsContact C-N 3.35Å; N299-A301 PolarHBondContact O-N 3.03Å; A301-A304 PolarHBondContact O-N 2.83Å; A301-T305 WeakPolarHBondContact O-CB 3.32Å; A301-T305 PolarHBondContact O-N 2.61Å; A301-T305 PolarHBondContact O-OG1 3.34Å; A301-V318 HydrophobicContact CB-CG1 4.11Å; A301-V318 HydrophobicContact CB-CG2 3.94Å; A301-L321 HydrophobicContact CB-CD1 3.36Å
302	L	98.6	Very high	97.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-44.3	174	-72.3	165.6	0	0	0	111.2	I121 T123 W275 Y276 V278 A298 N299 A304 T305 G306 I310 V318	I121-L302 HydrophobicContact CD1-CD1 4.4Å; I121-L302 HydrophobicContact CG2-CD1 3.79Å; I121-L302 HydrophobicContact CG2-CD2 4.37Å; T123-L302 HydrophobicContact CG2-CD2 4.06Å; W275-L302 HydrophobicContact CH2-CB 4.15Å; W275-L302 HydrophobicContact CH2-CD2 4.42Å; W275-L302 WeakPolarHBondContact CH2-O 3.47Å; W275-L302 WeakPolarHBondContact CZ2-O 3.49Å; Y276-L302 HydrophobicContact CD1-CB 4Å; Y276-L302 HydrophobicContact CD1-CD1 4.29Å; Y276-L302 HydrophobicContact CD2-CD1 3.58Å; Y276-L302 HydrophobicContact CE1-CB 3.85Å; Y276-L302 HydrophobicContact CE2-CB 4.44Å; Y276-L302 HydrophobicContact CE2-CD1 3.93Å; Y276-L302 HydrophobicContact CG-CB 4.36Å; Y276-L302 HydrophobicContact CG-CD1 3.79Å; V278-L302 HydrophobicContact CG2-CD1 3.4Å; A298-L302 WeakPolarHBondContact O-CB 3.48Å; A298-L302 WeakPolarHBondContact O-CG 3.39Å; A298-L302 PolarHBondContact O-N 3.39Å; N299-L302 PolarHBondContact O-N 3.44Å; L302-A304 VanDerWaalsContact C-N 3.33Å; L302-A304 PolarHBondContact O-N 2.57Å; L302-T305 WeakPolarHBondContact O-CB 3.39Å; L302-T305 PolarHBondContact O-N 3Å; L302-G306 PolarHBondContact O-N 2.92Å; L302-I310 HydrophobicContact CD2-CD1 3.97Å; L302-V318 HydrophobicContact CD2-CG2 4.19Å; L302-V318 HydrophobicContact CG-CG1 4.3Å; L302-V318 HydrophobicContact CG-CG2 4.43Å
303	N	98.4	Very high	97.6	Very high	98 Å²	98	51.5 Å²	51.5	52%	0.524	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-40.5	174.5	-75.9	-29.7	0	0	0	112.4	Y276 N299 G306	Y276-N303 PolarHBondContact OH-ND2 3.26Å; Y276-N303 PolarHBondContact OH-OD1 3.23Å; Y276-N303 VanDerWaalsContact OH-OD1 3.09Å; N299-N303 WeakPolarHBondContact O-CB 3.39Å; N299-N303 VanDerWaalsContact O-CG 3.28Å; N299-N303 PolarHBondContact O-N 2.78Å; N299-N303 PolarHBondContact O-ND2 2.76Å; N303-G306 PolarHBondContact O-N 3.45Å
304	A	98.2	Very high	97.7	Very high	61 Å²	61	49.7 Å²	49.7	50%	0.504	26%	0.26	S	S	.	.	H	α-helix	trans	-68.9	-33.4	175.9	0	0	0	0	0	113	L8 K300 A301 L302	L8-A304 HydrophobicContact CD2-CB 3.74Å; K300-A304 WeakPolarHBondContact O-CB 3.44Å; K300-A304 PolarHBondContact O-N 2.88Å; A301-A304 PolarHBondContact O-N 2.83Å; L302-A304 VanDerWaalsContact C-N 3.33Å; L302-A304 PolarHBondContact O-N 2.57Å
305	T	98.1	Very high	97.8	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-68	-44.5	174.7	-59.9	0	0	0	0	110.7	A301 L302 H309 I310 K314	A301-T305 WeakPolarHBondContact O-CB 3.32Å; A301-T305 PolarHBondContact O-N 2.61Å; A301-T305 PolarHBondContact O-OG1 3.34Å; L302-T305 WeakPolarHBondContact O-CB 3.39Å; L302-T305 PolarHBondContact O-N 3Å; T305-H309 HydrophobicContact CG2-CB 4.27Å; T305-H309 WeakPolarHBondContact O-CB 3.48Å; T305-H309 PolarHBondContact O-ND1 3.49Å; T305-I310 HydrophobicContact CG2-CD1 4.27Å; T305-K314 HydrophobicContact CG2-CB 3.86Å; T305-K314 HydrophobicContact CG2-CD 4.5Å; T305-K314 HydrophobicContact CG2-CG 4.01Å
306	G	97.9	Very high	97.8	Very high	21 Å²	21	48.3 Å²	48.3	22%	0.216	26%	0.255	C	S	.	.			trans	76.3	154	-177.3	0	0	0	0	0	113.4	L302 N303 D308 H309 I310	L302-G306 PolarHBondContact O-N 2.92Å; N303-G306 PolarHBondContact O-N 3.45Å; G306-D308 PolarHBondContact O-N 3.24Å; G306-H309 PolarHBondContact O-N 2.73Å; G306-I310 PolarHBondContact O-N 3.19Å
307	Q	98	Very high	97.7	Very high	22 Å²	22	43.7 Å²	43.7	10%	0.103	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.5	-177.6	-165	-178.7	13	0	0	113	Q124 D125 K126 W275 H309 I310	Q124-Q307 VanDerWaalsContact O-CG 3.3Å; Q124-Q307 WeakPolarHBondContact O-CG 3.42Å; Q124-Q307 PolarHBondContact O-NE2 2.84Å; D125-Q307 PolarHBondContact O-NE2 2.97Å; K126-Q307 HydrophobicContact CD-CG 4.18Å; K126-Q307 VanDerWaalsContact CE-OE1 3.24Å; K126-Q307 HydrophobicContact CG-CG 4.31Å; W275-Q307 VanDerWaalsContact CB-CD 3.49Å; W275-Q307 HydrophobicContact CB-CG 3.91Å; W275-Q307 VanDerWaalsContact CB-NE2 3.33Å; W275-Q307 HydrophobicContact CD2-CB 3.69Å; W275-Q307 HydrophobicContact CD2-CG 3.72Å; W275-Q307 HydrophobicContact CE3-CB 4.14Å; W275-Q307 HydrophobicContact CE3-CG 3.98Å; W275-Q307 HydrophobicContact CG-CB 3.9Å; W275-Q307 HydrophobicContact CG-CG 3.69Å; W275-Q307 HydrophobicContact CZ2-CB 4.36Å; Q307-H309 VanDerWaalsContact C-N 3.27Å; Q307-H309 PolarHBondContact O-N 3.16Å; Q307-I310 WeakPolarHBondContact O-CG2 3.03Å
308	D	97.2	Very high	97.7	Very high	112 Å²	112	42 Å²	42	60%	0.599	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-21.2	-177	-59.5	-11	0	0	0	112.7	K126 G306	K126-D308 WeakPolarHBondContact CE-OD1 3.43Å; K126-D308 WeakPolarHBondContact CG-OD1 3.25Å; G306-D308 PolarHBondContact O-N 3.24Å
309	H	97.6	Very high	97.7	Very high	120 Å²	120	42 Å²	42	56%	0.556	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-6.3	-175.2	-49.8	107.2	0	0	0	113.5	T305 G306 Q307 N311 K314	T305-H309 HydrophobicContact CG2-CB 4.27Å; T305-H309 WeakPolarHBondContact O-CB 3.48Å; T305-H309 PolarHBondContact O-ND1 3.49Å; G306-H309 PolarHBondContact O-N 2.73Å; Q307-H309 VanDerWaalsContact C-N 3.27Å; Q307-H309 PolarHBondContact O-N 3.16Å; H309-N311 PolarHBondContact O-N 3.03Å; H309-N311 PolarHBondContact O-ND2 2.87Å; H309-K314 WeakPolarHBondContact O-CG 3.28Å
310	I	98.4	Very high	97.6	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.021	21%	0.214	C	C	.	.			trans	-65.3	131.3	-178.8	-167.2	62.7	0	0	0	110.3	T123 D125 F131 W275 L302 T305 G306 Q307 K314 L315	T123-I310 HydrophobicContact CG2-CD1 4.42Å; T123-I310 HydrophobicContact CG2-CG1 4.13Å; D125-I310 HydrophobicContact CB-CG2 3.81Å; F131-I310 WeakPolarHBondContact CE2-O 3.45Å; W275-I310 HydrophobicContact CE3-CG2 4.26Å; W275-I310 HydrophobicContact CH2-CB 4.49Å; W275-I310 HydrophobicContact CZ3-CB 3.89Å; W275-I310 HydrophobicContact CZ3-CG1 4.04Å; W275-I310 HydrophobicContact CZ3-CG2 3.89Å; L302-I310 HydrophobicContact CD2-CD1 3.97Å; T305-I310 HydrophobicContact CG2-CD1 4.27Å; G306-I310 PolarHBondContact O-N 3.19Å; Q307-I310 WeakPolarHBondContact O-CG2 3.03Å; I310-K314 HydrophobicContact CD1-CB 4.12Å; I310-L315 HydrophobicContact CD1-CB 4.42Å
311	N	97.5	Very high	97.4	Very high	60 Å²	60	34.3 Å²	34.3	32%	0.321	19%	0.19	S	C	.	.	S	Bend	trans	-157.5	-179.1	174.6	60.2	43.7	0	0	0	108.3	F131 H309 D313 K314 L315	F131-N311 HydrophobicContact CZ-CB 4.44Å; H309-N311 PolarHBondContact O-N 3.03Å; H309-N311 PolarHBondContact O-ND2 2.87Å; N311-D313 VanDerWaalsContact C-N 3.29Å; N311-D313 PolarHBondContact O-N 2.69Å; N311-D313 WeakPolarHBondContact OD1-CA 3.3Å; N311-D313 WeakPolarHBondContact OD1-CB 3.39Å; N311-D313 PolarHBondContact OD1-N 3.18Å; N311-K314 PolarHBondContact O-N 3.28Å; N311-K314 PolarHBondContact OD1-N 2.83Å; N311-L315 WeakPolarHBondContact O-CB 3.29Å; N311-L315 PolarHBondContact O-N 3.48Å
312	M	96.1	Very high	97.2	Very high	19 Å²	19	40.5 Å²	40.5	9%	0.094	22%	0.217	C	C	.	.	H	α-helix	trans	-57.8	-37.5	-179	-66.9	-77.1	-73.4	0	0	113.6	F131 Y316 V334 M335 N342	F131-M312 HydrophobicContact CB-SD 4.18Å; F131-M312 HydrophobicContact CD1-CG 3.66Å; F131-M312 HydrophobicContact CD1-SD 3.87Å; F131-M312 HydrophobicContact CE1-CG 4.13Å; F131-M312 HydrophobicContact CG-CG 4.45Å; F131-M312 HydrophobicContact CG-SD 4.43Å; M312-Y316 WeakPolarHBondContact O-CB 3.32Å; M312-Y316 PolarHBondContact O-N 3.16Å; M312-V334 HydrophobicContact CE-CB 3.64Å; M312-V334 HydrophobicContact CE-CG2 3.74Å; M312-V334 HydrophobicContact SD-CB 4.18Å; M312-M335 VanDerWaalsContact CE-N 3.3Å; M312-N342 HydrophobicContact CE-CB 4.19Å; M312-N342 VanDerWaalsContact CE-O 3.26Å; M312-N342 WeakPolarHBondContact CE-O 3.41Å
313	D	96.2	Very high	97	Very high	77 Å²	77	41.9 Å²	41.9	41%	0.412	23%	0.226	S	C	.	.	H	α-helix	trans	-69.3	-47.5	177.5	-73.1	-45.8	0	0	0	111.3	R19 N311 L315 Y316 Q317	R19-D313 IonicContact CZ-OD1 3.33Å; R19-D313 IonicContact NE-OD1 2.69Å; R19-D313 IonicContact NH1-OD1 3.92Å; R19-D313 PolarHBondContact NH1-OD1 3.25Å; N311-D313 VanDerWaalsContact C-N 3.29Å; N311-D313 PolarHBondContact O-N 2.69Å; N311-D313 WeakPolarHBondContact OD1-CA 3.3Å; N311-D313 WeakPolarHBondContact OD1-CB 3.39Å; N311-D313 PolarHBondContact OD1-N 3.18Å; D313-L315 VanDerWaalsContact C-N 3.27Å; D313-L315 PolarHBondContact O-N 2.89Å; D313-Y316 WeakPolarHBondContact O-CB 3.42Å; D313-Y316 PolarHBondContact O-N 2.88Å; D313-Q317 VanDerWaalsContact O-CG 3.29Å; D313-Q317 WeakPolarHBondContact O-CG 3.35Å; D313-Q317 PolarHBondContact O-N 3Å
314	K	97.8	Very high	96.9	Very high	51 Å²	51	37.2 Å²	37.2	22%	0.222	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-36.9	177	-67.1	-53	-175.3	179.5	0	112	T305 H309 I310 N311 Q317 V318	T305-K314 HydrophobicContact CG2-CB 3.86Å; T305-K314 HydrophobicContact CG2-CD 4.5Å; T305-K314 HydrophobicContact CG2-CG 4.01Å; H309-K314 WeakPolarHBondContact O-CG 3.28Å; I310-K314 HydrophobicContact CD1-CB 4.12Å; N311-K314 PolarHBondContact O-N 3.28Å; N311-K314 PolarHBondContact OD1-N 2.83Å; K314-Q317 WeakPolarHBondContact O-CB 3.39Å; K314-Q317 PolarHBondContact O-N 3.42Å; K314-V318 WeakPolarHBondContact O-CG2 3.2Å; K314-V318 PolarHBondContact O-N 3.4Å
315	L	98	Very high	96.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-44.1	174.7	-170.6	54.6	0	0	0	112	I121 T123 F131 I310 N311 D313 Q317 V318 L319 V334	I121-L315 HydrophobicContact CB-CD1 3.87Å; I121-L315 HydrophobicContact CD1-CD1 4.14Å; I121-L315 HydrophobicContact CG2-CD1 3.7Å; T123-L315 HydrophobicContact CG2-CD1 4.17Å; F131-L315 HydrophobicContact CB-CD2 3.89Å; I310-L315 HydrophobicContact CD1-CB 4.42Å; N311-L315 WeakPolarHBondContact O-CB 3.29Å; N311-L315 PolarHBondContact O-N 3.48Å; D313-L315 VanDerWaalsContact C-N 3.27Å; D313-L315 PolarHBondContact O-N 2.89Å; L315-Q317 VanDerWaalsContact C-N 3.31Å; L315-Q317 PolarHBondContact O-N 3.43Å; L315-V318 PolarHBondContact O-N 3.2Å; L315-L319 HydrophobicContact CG-CD1 4.36Å; L315-L319 WeakPolarHBondContact O-CG 3.37Å; L315-L319 PolarHBondContact O-N 2.8Å; L315-V334 HydrophobicContact CG-CG1 4.46Å
316	Y	97.1	Very high	96.5	Very high	8 Å²	8	35.2 Å²	35.2	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-38.7	172.9	176.1	-97.9	0	0	0	112.5	R19 L22 M312 D313 L319 S320 T332 F346	R19-Y316 HydrophobicContact CG-CE1 4.43Å; L22-Y316 WeakPolarHBondContact CD1-OH 3.49Å; M312-Y316 WeakPolarHBondContact O-CB 3.32Å; M312-Y316 PolarHBondContact O-N 3.16Å; D313-Y316 WeakPolarHBondContact O-CB 3.42Å; D313-Y316 PolarHBondContact O-N 2.88Å; Y316-L319 CarbonylContact O-C 3.51Å; Y316-L319 PolarHBondContact O-N 2.89Å; Y316-S320 WeakPolarHBondContact O-CB 3.16Å; Y316-S320 PolarHBondContact O-N 3.38Å; Y316-S320 VanDerWaalsContact O-N 3.08Å; Y316-S320 PolarHBondContact O-OG 3.36Å; Y316-T332 HydrophobicContact CD2-CG2 3.74Å; Y316-T332 HydrophobicContact CE2-CG2 3.93Å; Y316-F346 AromaticContact CD2-CD2 3.82Å; Y316-F346 HydrophobicContact CD2-CD2 3.82Å; Y316-F346 AromaticContact CD2-CE2 3.99Å; Y316-F346 HydrophobicContact CD2-CE2 3.99Å; Y316-F346 HydrophobicContact CE2-CB 4.29Å; Y316-F346 AromaticContact CE2-CD2 3.52Å; Y316-F346 HydrophobicContact CE2-CD2 3.52Å; Y316-F346 HydrophobicContact CE2-CE2 4.05Å; Y316-F346 AromaticContact CE2-CG 3.95Å; Y316-F346 HydrophobicContact CE2-CG 3.95Å
317	Q	96	Very high	96.3	Very high	15 Å²	15	42.8 Å²	42.8	7%	0.07	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-45.3	176	-70.9	177.2	2.3	0	0	111.8	L12 C15 D313 K314 L315 L319 S320 L321	L12-Q317 HydrophobicContact CD2-CB 3.56Å; L12-Q317 HydrophobicContact CD2-CG 4.27Å; L12-Q317 VanDerWaalsContact CD2-OE1 3.27Å; L12-Q317 PolarHBondContact O-NE2 3.45Å; L12-Q317 PolarHBondContact O-OE1 3.27Å; C15-Q317 HydrophobicContact CB-CG 3.77Å; D313-Q317 VanDerWaalsContact O-CG 3.29Å; D313-Q317 WeakPolarHBondContact O-CG 3.35Å; D313-Q317 PolarHBondContact O-N 3Å; K314-Q317 WeakPolarHBondContact O-CB 3.39Å; K314-Q317 PolarHBondContact O-N 3.42Å; L315-Q317 VanDerWaalsContact C-N 3.31Å; L315-Q317 PolarHBondContact O-N 3.43Å; Q317-L319 VanDerWaalsContact C-N 3.33Å; Q317-L319 PolarHBondContact O-N 2.94Å; Q317-S320 WeakPolarHBondContact O-CB 3Å; Q317-S320 PolarHBondContact O-N 3.47Å; Q317-L321 PolarHBondContact O-N 3.01Å
318	V	97.7	Very high	96.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.4	-47.7	173.9	171.9	0	0	0	0	110.5	I121 A298 A301 L302 K314 L315 S320 L321 I324	I121-V318 HydrophobicContact CD1-CG1 3.78Å; A298-V318 HydrophobicContact CB-CG1 4.39Å; A301-V318 HydrophobicContact CB-CG1 4.11Å; A301-V318 HydrophobicContact CB-CG2 3.94Å; L302-V318 HydrophobicContact CD2-CG2 4.19Å; L302-V318 HydrophobicContact CG-CG1 4.3Å; L302-V318 HydrophobicContact CG-CG2 4.43Å; K314-V318 WeakPolarHBondContact O-CG2 3.2Å; K314-V318 PolarHBondContact O-N 3.4Å; L315-V318 PolarHBondContact O-N 3.2Å; V318-S320 PolarHBondContact O-N 3.09Å; V318-S320 VanDerWaalsContact O-N 3.08Å; V318-L321 PolarHBondContact O-N 3.2Å; V318-L321 VanDerWaalsContact O-N 3.15Å; V318-I324 HydrophobicContact CG1-CD1 4.2Å; V318-I324 VanDerWaalsContact O-CD1 3.29Å; V318-I324 WeakPolarHBondContact O-CD1 3.44Å
319	L	97.6	Very high	96	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-7.1	177.4	-69.8	165	0	0	0	114	T119 I121 G133 R134 N135 L315 Y316 Q317 I324 C325 T332 V334 R348	T119-L319 HydrophobicContact CG2-CD2 4.44Å; I121-L319 HydrophobicContact CD1-CD2 3.9Å; I121-L319 HydrophobicContact CD1-CG 4.23Å; I121-L319 HydrophobicContact CG1-CD2 4.34Å; G133-L319 VanDerWaalsContact C-CD1 3.48Å; R134-L319 VanDerWaalsContact N-CD1 3.34Å; N135-L319 PolarHBondContact ND2-O 3.31Å; L315-L319 HydrophobicContact CG-CD1 4.36Å; L315-L319 WeakPolarHBondContact O-CG 3.37Å; L315-L319 PolarHBondContact O-N 2.8Å; Y316-L319 CarbonylContact O-C 3.51Å; Y316-L319 PolarHBondContact O-N 2.89Å; Q317-L319 VanDerWaalsContact C-N 3.33Å; Q317-L319 PolarHBondContact O-N 2.94Å; L319-I324 HydrophobicContact CD2-CG2 4.07Å; L319-C325 WeakPolarHBondContact O-CB 3.11Å; L319-T332 HydrophobicContact CB-CG2 4Å; L319-T332 HydrophobicContact CD1-CG2 3.94Å; L319-V334 HydrophobicContact CD1-CG1 4.27Å; L319-R348 PolarHBondContact O-NH1 2.94Å
320	S	96.2	Very high	95.9	Very high	7 Å²	7	33.1 Å²	33.1	5%	0.049	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-11	176.7	-64.5	0	0	0	0	113.6	Y316 Q317 V318 R348	Y316-S320 WeakPolarHBondContact O-CB 3.16Å; Y316-S320 PolarHBondContact O-N 3.38Å; Y316-S320 VanDerWaalsContact O-N 3.08Å; Y316-S320 PolarHBondContact O-OG 3.36Å; Q317-S320 WeakPolarHBondContact O-CB 3Å; Q317-S320 PolarHBondContact O-N 3.47Å; V318-S320 PolarHBondContact O-N 3.09Å; V318-S320 VanDerWaalsContact O-N 3.08Å; S320-R348 PolarHBondContact OG-NH1 3.45Å; S320-R348 PolarHBondContact OG-NH2 3.46Å
321	L	95.3	Very high	95.9	Very high	30 Å²	30	33 Å²	33	16%	0.157	16%	0.156	C	C	.	.	S	Bend	trans	-72.1	142.5	-179.7	-60.3	173.6	0	0	0	111.3	T297 A301 Q317 V318 I324 C325	T297-L321 HydrophobicContact CG2-CB 4.33Å; A301-L321 HydrophobicContact CB-CD1 3.36Å; Q317-L321 PolarHBondContact O-N 3.01Å; V318-L321 PolarHBondContact O-N 3.2Å; V318-L321 VanDerWaalsContact O-N 3.15Å; L321-I324 HydrophobicContact CB-CD1 4.28Å; L321-I324 CarbonylContact O-C 3.44Å; L321-I324 WeakPolarHBondContact O-CA 3.15Å; L321-I324 VanDerWaalsContact O-CB 3.25Å; L321-I324 WeakPolarHBondContact O-CB 3.34Å; L321-I324 PolarHBondContact O-N 2.87Å; L321-C325 PolarHBondContact O-N 3.23Å
322	H	93.5	Very high	95.9	Very high	137 Å²	137	30.1 Å²	30.1	63%	0.634	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	138	167.2	-172.3	76.4	0	0	0	110.3
323	P	94.4	Very high	96	Very high	29 Å²	29	29.2 Å²	29.2	19%	0.188	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.1	9.2	3.1	37.1	-34.5	0	0	0	115	H293 R294 T297 C325 N326	H293-P323 HydrophobicContact CB-CG 4.2Å; R294-P323 HydrophobicContact CG-CB 4.31Å; R294-P323 HydrophobicContact CG-CG 4.05Å; R294-P323 WeakPolarHBondContact CG-O 2.99Å; T297-P323 WeakPolarHBondContact OG1-CD 3.29Å; P323-C325 VanDerWaalsContact C-N 3.33Å; P323-C325 PolarHBondContact O-N 2.98Å; P323-N326 PolarHBondContact O-ND2 3.41Å
324	I	96.1	Very high	96.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-46	178.5	-56.4	162.1	0	0	0	110.4	T119 N135 R294 T297 A298 V318 L319 L321	T119-I324 HydrophobicContact CG2-CG2 3.78Å; N135-I324 PolarHBondContact ND2-O 3.33Å; R294-I324 HydrophobicContact CB-CG1 4.45Å; T297-I324 HydrophobicContact CG2-CD1 3.98Å; T297-I324 HydrophobicContact CG2-CG1 4.3Å; A298-I324 HydrophobicContact CB-CD1 3.65Å; A298-I324 HydrophobicContact CB-CG1 4.3Å; V318-I324 HydrophobicContact CG1-CD1 4.2Å; V318-I324 VanDerWaalsContact O-CD1 3.29Å; V318-I324 WeakPolarHBondContact O-CD1 3.44Å; L319-I324 HydrophobicContact CD2-CG2 4.07Å; L321-I324 HydrophobicContact CB-CD1 4.28Å; L321-I324 CarbonylContact O-C 3.44Å; L321-I324 WeakPolarHBondContact O-CA 3.15Å; L321-I324 VanDerWaalsContact O-CB 3.25Å; L321-I324 WeakPolarHBondContact O-CB 3.34Å; L321-I324 PolarHBondContact O-N 2.87Å
325	C	95.4	Very high	96.2	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.014	11%	0.106	C	C	.	.	S	Bend	trans	-94.2	124	162.9	-148.5	0	0	0	0	109.1	L319 L321 P323 R348 C352	L319-C325 WeakPolarHBondContact O-CB 3.11Å; L321-C325 PolarHBondContact O-N 3.23Å; P323-C325 VanDerWaalsContact C-N 3.33Å; P323-C325 PolarHBondContact O-N 2.98Å; C325-R348 PolarHBondContact SG-NH1 3.13Å; C325-R348 PolarHBondContact SG-NH2 3.23Å; C325-C352 VanDerWaalsContact CA-SG 3.57Å; C325-C352 HydrophobicContact CB-CB 3.65Å; C325-C352 WeakPolarHBondContact CB-SG 3.5Å; C325-C352 WeakPolarHBondContact SG-CB 3.3Å; C325-C352 CovalentContact SG-SG 2.01Å; C325-C352 PolarHBondContact SG-SG 2.99Å
326	N	93.5	Very high	96.2	Very high	26 Å²	26	23.5 Å²	23.5	14%	0.139	11%	0.108	C	C	.	.			trans	-142.7	-173.7	-173	64	64.9	0	0	0	111.6	D137 P323 I328 T329 C352	D137-N326 PolarHBondContact OD2-ND2 3.34Å; P323-N326 PolarHBondContact O-ND2 3.41Å; N326-I328 PolarHBondContact O-N 3.38Å; N326-I328 WeakPolarHBondContact OD1-CG1 3.48Å; N326-I328 PolarHBondContact OD1-N 3.4Å; N326-T329 PolarHBondContact N-OG1 3.42Å; N326-T329 WeakPolarHBondContact O-CB 3.38Å; N326-T329 PolarHBondContact O-N 3.15Å; N326-T329 VanDerWaalsContact O-N 3.16Å; N326-T329 PolarHBondContact O-OG1 3.39Å; N326-T329 PolarHBondContact OD1-N 3.08Å; N326-C352 PolarHBondContact N-SG 3Å; N326-C352 VanDerWaalsContact N-SG 3.39Å; N326-C352 PolarHBondContact O-SG 3.36Å
327	R	92.9	Very high	96.2	Very high	179 Å²	179	23.1 Å²	23.1	68%	0.675	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-33.2	-174.3	-173.8	176.5	169.6	-175.8	-3	113.9	R144 Q350	R144-R327 PolarHBondContact NH2-O 2.94Å; R327-Q350 HydrophobicContact CG-CG 4.02Å
328	I	93	Very high	96.3	Very high	51 Å²	51	24.5 Å²	24.5	26%	0.262	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	0.5	-176	57.2	159	0	0	0	112.6	F117 D137 Y138 P139 N326 I330	F117-I328 HydrophobicContact CB-CD1 4.35Å; F117-I328 HydrophobicContact CD2-CD1 3.96Å; F117-I328 HydrophobicContact CG-CD1 4.42Å; D137-I328 CarbonylContact C-O 3.58Å; D137-I328 VanDerWaalsContact CA-O 3.32Å; D137-I328 WeakPolarHBondContact CA-O 3.45Å; D137-I328 HydrophobicContact CB-CD1 3.89Å; D137-I328 HydrophobicContact CB-CG1 3.89Å; Y138-I328 PolarHBondContact N-O 2.96Å; P139-I328 HydrophobicContact CB-CG2 4.21Å; N326-I328 PolarHBondContact O-N 3.38Å; N326-I328 WeakPolarHBondContact OD1-CG1 3.48Å; N326-I328 PolarHBondContact OD1-N 3.4Å; I328-I330 PolarHBondContact O-N 2.92Å
329	T	95.8	Very high	96.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	116.9	173	-52.1	0	0	0	0	111.2	N135 D137 R144 N326 R348	N135-T329 HydrophobicContact CB-CG2 4.02Å; D137-T329 WeakPolarHBondContact OD1-CA 3.5Å; D137-T329 WeakPolarHBondContact OD1-CB 3.42Å; D137-T329 WeakPolarHBondContact OD1-CG2 3.35Å; D137-T329 PolarHBondContact OD1-OG1 2.01Å; R144-T329 PolarHBondContact NE-O 2.84Å; R144-T329 PolarHBondContact NH2-O 2.87Å; N326-T329 PolarHBondContact N-OG1 3.42Å; N326-T329 WeakPolarHBondContact O-CB 3.38Å; N326-T329 PolarHBondContact O-N 3.15Å; N326-T329 VanDerWaalsContact O-N 3.16Å; N326-T329 PolarHBondContact O-OG1 3.39Å; N326-T329 PolarHBondContact OD1-N 3.08Å; T329-R348 HydrophobicContact CG2-CB 4.06Å; T329-R348 HydrophobicContact CG2-CG 3.78Å
330	I	96.1	Very high	96.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-51.4	-178.9	-58.8	-57.8	0	0	0	110.6	L136 L143 R144 T147 F165 I328 R348	L136-I330 HydrophobicContact CD2-CB 4.43Å; L136-I330 HydrophobicContact CD2-CG1 4.37Å; L136-I330 PolarHBondContact O-N 3.06Å; L143-I330 HydrophobicContact CB-CD1 4.17Å; L143-I330 HydrophobicContact CB-CG1 4.33Å; L143-I330 HydrophobicContact CB-CG2 4.09Å; R144-I330 HydrophobicContact CG-CD1 3.96Å; R144-I330 HydrophobicContact CG-CG2 3.96Å; T147-I330 WeakPolarHBondContact OG1-CG2 3.43Å; F165-I330 HydrophobicContact CE1-CG2 3.87Å; F165-I330 HydrophobicContact CZ-CG2 4.27Å; I328-I330 PolarHBondContact O-N 2.92Å; I330-R348 PolarHBondContact O-N 3.21Å
331	Y	97.2	Very high	95.9	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	159.8	-179.9	69.1	-107.7	0	0	0	112.3	N135 L136 T147 T163 F165 T173 T345 F346	N135-Y331 WeakPolarHBondContact CA-O 3.34Å; L136-Y331 HydrophobicContact CB-CD1 3.95Å; L136-Y331 HydrophobicContact CB-CD2 4.15Å; L136-Y331 HydrophobicContact CB-CE1 3.59Å; L136-Y331 HydrophobicContact CB-CE2 3.78Å; L136-Y331 HydrophobicContact CB-CG 4.22Å; L136-Y331 VanDerWaalsContact CB-CZ 3.49Å; L136-Y331 HydrophobicContact CD1-CE1 3.63Å; L136-Y331 WeakPolarHBondContact CD1-OH 3.45Å; L136-Y331 HydrophobicContact CD2-CE1 4.37Å; L136-Y331 HydrophobicContact CG-CE1 4.03Å; L136-Y331 PolarHBondContact N-O 3.32Å; T147-Y331 HydrophobicContact CG2-CD1 3.77Å; T147-Y331 HydrophobicContact CG2-CE1 4.48Å; T147-Y331 HydrophobicContact CG2-CG 4.22Å; T163-Y331 HydrophobicContact CG2-CD1 4.13Å; T163-Y331 HydrophobicContact CG2-CD2 4.11Å; T163-Y331 HydrophobicContact CG2-CE1 3.88Å; T163-Y331 HydrophobicContact CG2-CE2 3.88Å; T163-Y331 HydrophobicContact CG2-CG 4.25Å; F165-Y331 HydrophobicContact CE1-CD1 4.21Å; F165-Y331 HydrophobicContact CE1-CE1 4.09Å; F165-Y331 HydrophobicContact CZ-CD1 4.4Å; F165-Y331 AromaticContact CZ-CE1 3.99Å; F165-Y331 HydrophobicContact CZ-CE1 3.99Å; T173-Y331 PolarHBondContact OG1-OH 3.31Å; Y331-T345 HydrophobicContact CD2-CG2 3.93Å; Y331-T345 HydrophobicContact CG-CG2 4.06Å; Y331-F346 CarbonylContact C-O 3.52Å; Y331-F346 WeakPolarHBondContact CA-O 3.49Å; Y331-F346 WeakPolarHBondContact CB-O 3.38Å
332	T	98.1	Very high	95.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.2	170	-58.5	0	0	0	0	109	R134 N135 Y316 L319 T345 F346 R348	R134-T332 CarbonylContact O-C 3.58Å; R134-T332 VanDerWaalsContact O-CA 3.26Å; R134-T332 WeakPolarHBondContact O-CA 3.21Å; N135-T332 WeakPolarHBondContact OD1-CB 3.38Å; N135-T332 WeakPolarHBondContact OD1-CG2 3.29Å; N135-T332 PolarHBondContact OD1-OG1 2.76Å; Y316-T332 HydrophobicContact CD2-CG2 3.74Å; Y316-T332 HydrophobicContact CE2-CG2 3.93Å; L319-T332 HydrophobicContact CB-CG2 4Å; L319-T332 HydrophobicContact CD1-CG2 3.94Å; T332-T345 CarbonylContact O-C 3.49Å; T332-T345 VanDerWaalsContact O-CA 3.27Å; T332-T345 WeakPolarHBondContact O-CA 3.22Å; T332-F346 PolarHBondContact N-O 3.5Å; T332-F346 PolarHBondContact O-N 3.3Å; T332-R348 VanDerWaalsContact OG1-CD 3.28Å; T332-R348 WeakPolarHBondContact OG1-CD 3.41Å; T332-R348 WeakPolarHBondContact OG1-CG 3.38Å; T332-R348 PolarHBondContact OG1-NH1 3.29Å
333	T	98.5	Very high	95.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.5	171.6	-59	0	0	0	0	109.5	G133 R134 T173 M335 Y343 T344 T345	G133-T333 CarbonylContact C-O 3.55Å; G133-T333 WeakPolarHBondContact CA-O 3.47Å; R134-T333 PolarHBondContact N-O 3.42Å; R134-T333 PolarHBondContact O-N 3.47Å; T173-T333 HydrophobicContact CG2-CG2 3.83Å; T333-M335 HydrophobicContact CG2-CG 4.48Å; T333-M335 HydrophobicContact CG2-SD 4.34Å; T333-Y343 HydrophobicContact CG2-CE1 4.14Å; T333-Y343 HydrophobicContact CG2-CE2 4.12Å; T333-T344 CarbonylContact C-O 3.39Å; T333-T344 VanDerWaalsContact CA-O 3.3Å; T333-T344 WeakPolarHBondContact CA-O 3.4Å; T333-T345 PolarHBondContact OG1-OG1 3.49Å
334	V	98.4	Very high	95.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.5	165.6	-70.7	0	0	0	0	108.4	H132 M312 L315 L319 T344 F346	H132-V334 CarbonylContact O-C 3.49Å; M312-V334 HydrophobicContact CE-CB 3.64Å; M312-V334 HydrophobicContact CE-CG2 3.74Å; M312-V334 HydrophobicContact SD-CB 4.18Å; L315-V334 HydrophobicContact CG-CG1 4.46Å; L319-V334 HydrophobicContact CD1-CG1 4.27Å; V334-T344 PolarHBondContact N-O 3.47Å; V334-T344 PolarHBondContact O-N 3.38Å; V334-F346 HydrophobicContact CG2-CE2 4.31Å
335	M	98.5	Very high	95.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	154.4	-172.6	50.9	-174.8	174.7	0	0	111.9	H132 T173 M175 T181 M312 T333 Y343	H132-M335 HydrophobicContact CB-CE 4.43Å; H132-M335 HydrophobicContact CB-CG 4.14Å; H132-M335 PolarHBondContact N-O 3.4Å; H132-M335 WeakPolarHBondContact O-CG 3.25Å; H132-M335 PolarHBondContact O-N 2.96Å; T173-M335 HydrophobicContact CG2-CE 4.02Å; T173-M335 HydrophobicContact CG2-SD 4.36Å; M175-M335 HydrophobicContact CB-SD 4.35Å; M175-M335 HydrophobicContact SD-CB 4.39Å; T181-M335 HydrophobicContact CG2-CB 3.93Å; T181-M335 HydrophobicContact CG2-CE 4.5Å; T181-M335 HydrophobicContact CG2-CG 3.62Å; T181-M335 HydrophobicContact CG2-SD 3.75Å; M312-M335 VanDerWaalsContact CE-N 3.3Å; T333-M335 HydrophobicContact CG2-CG 4.48Å; T333-M335 HydrophobicContact CG2-SD 4.34Å; M335-Y343 HydrophobicContact CB-CD2 3.81Å; M335-Y343 HydrophobicContact CB-CE2 4.28Å; M335-Y343 HydrophobicContact SD-CD2 4.17Å; M335-Y343 HydrophobicContact SD-CE2 3.73Å
336	S	98.5	Very high	96	Very high	7 Å²	7	29.8 Å²	29.8	5%	0.049	18%	0.175	C	C	.	.			trans	-146.1	120.5	169.7	178.5	0	0	0	0	108.4	V130 A338 S339	V130-S336 WeakPolarHBondContact O-CB 3.33Å; V130-S336 PolarHBondContact O-OG 2.99Å; S336-A338 PolarHBondContact O-N 3.49Å; S336-S339 CarbonylContact O-C 3.56Å; S336-S339 PolarHBondContact O-N 2.8Å
337	A	98.3	Very high	96.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.7	-177.7	0	0	0	0	0	112.7	M175 N178 T181 V247 S339 P340	M175-A337 HydrophobicContact CG-CB 4.34Å; N178-A337 WeakPolarHBondContact CA-O 3.3Å; N178-A337 PolarHBondContact N-O 3Å; T181-A337 HydrophobicContact CG2-CB 4.05Å; V247-A337 HydrophobicContact CG1-CB 3.64Å; A337-S339 PolarHBondContact O-N 3.48Å; A337-P340 WeakPolarHBondContact O-CD 3.5Å; A337-P340 WeakPolarHBondContact O-CG 2.99Å
338	A	97.9	Very high	96.2	Very high	45 Å²	45	21.3 Å²	21.3	37%	0.372	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-12.7	174	0	0	0	0	0	113.3	V247 S336	V247-A338 HydrophobicContact CB-CB 4.15Å; V247-A338 HydrophobicContact CG1-CB 4.28Å; S336-A338 PolarHBondContact O-N 3.49Å
339	S	96.9	Very high	96	Very high	55 Å²	55	21.1 Å²	21.1	39%	0.385	15%	0.145	S	C	.	.	S	Bend	trans	-137.1	72.1	176	-66.2	0	0	0	0	110.4	S336 A337 G341 N342	S336-S339 CarbonylContact O-C 3.56Å; S336-S339 PolarHBondContact O-N 2.8Å; A337-S339 PolarHBondContact O-N 3.48Å; S339-G341 PolarHBondContact O-N 3.02Å; S339-N342 WeakPolarHBondContact O-CB 3.36Å; S339-N342 PolarHBondContact O-N 3.14Å
340	P	92.8	Very high	95.4	Very high	27 Å²	27	26.2 Å²	26.2	18%	0.175	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-58	-27.2	-171.3	-26.7	35.5	0	0	0	115.1	M175 P177 A337 N342 Y343	M175-P340 HydrophobicContact CE-CB 3.75Å; M175-P340 WeakPolarHBondContact CE-O 3.08Å; P177-P340 HydrophobicContact CB-CB 3.73Å; P177-P340 HydrophobicContact CB-CG 3.58Å; A337-P340 WeakPolarHBondContact O-CD 3.5Å; A337-P340 WeakPolarHBondContact O-CG 2.99Å; P340-N342 PolarHBondContact O-N 3.47Å; P340-N342 VanDerWaalsContact O-N 3.12Å; P340-Y343 PolarHBondContact O-N 2.98Å
341	G	92.4	Very high	94.3	Very high	77 Å²	77	27.4 Å²	27.4	79%	0.794	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-62.1	-14.8	174.3	0	0	0	0	0	114.3	S339	S339-G341 PolarHBondContact O-N 3.02Å
342	N	89.9	Confident	93.6	Very high	84 Å²	84	27.9 Å²	27.9	45%	0.449	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-98.9	16.4	-178.1	-63.9	-13.6	0	0	0	113.4	M312 S339 P340 T344	M312-N342 HydrophobicContact CE-CB 4.19Å; M312-N342 VanDerWaalsContact CE-O 3.26Å; M312-N342 WeakPolarHBondContact CE-O 3.41Å; S339-N342 WeakPolarHBondContact O-CB 3.36Å; S339-N342 PolarHBondContact O-N 3.14Å; P340-N342 PolarHBondContact O-N 3.47Å; P340-N342 VanDerWaalsContact O-N 3.12Å; N342-T344 PolarHBondContact O-N 2.97Å; N342-T344 VanDerWaalsContact O-N 3.16Å; N342-T344 PolarHBondContact O-OG1 3.48Å
343	Y	96.4	Very high	92.2	Very high	27 Å²	27	32.1 Å²	32.1	11%	0.106	20%	0.203	C	C	.	.			trans	-67.9	108.7	168.7	-171.4	-80.8	0	0	0	109.2	T163 M175 T333 M335 P340	T163-Y343 PolarHBondContact N-OH 3.46Å; T163-Y343 VanDerWaalsContact N-OH 3.07Å; T163-Y343 WeakPolarHBondContact OG1-CE1 3.34Å; T163-Y343 PolarHBondContact OG1-OH 3.09Å; M175-Y343 HydrophobicContact CB-CD2 3.65Å; M175-Y343 HydrophobicContact CB-CE2 3.87Å; M175-Y343 HydrophobicContact CE-CD2 3.92Å; M175-Y343 HydrophobicContact CE-CG 4.23Å; M175-Y343 HydrophobicContact SD-CD2 4.15Å; T333-Y343 HydrophobicContact CG2-CE1 4.14Å; T333-Y343 HydrophobicContact CG2-CE2 4.12Å; M335-Y343 HydrophobicContact CB-CD2 3.81Å; M335-Y343 HydrophobicContact CB-CE2 4.28Å; M335-Y343 HydrophobicContact SD-CD2 4.17Å; M335-Y343 HydrophobicContact SD-CE2 3.73Å; P340-Y343 PolarHBondContact O-N 2.98Å
344	T	96.3	Very high	89.9	Confident	36 Å²	36	40.3 Å²	40.3	22%	0.221	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129	-175.6	-45.1	0	0	0	0	111.5	T333 V334 N342 F346	T333-T344 CarbonylContact C-O 3.39Å; T333-T344 VanDerWaalsContact CA-O 3.3Å; T333-T344 WeakPolarHBondContact CA-O 3.4Å; V334-T344 PolarHBondContact N-O 3.47Å; V334-T344 PolarHBondContact O-N 3.38Å; N342-T344 PolarHBondContact O-N 2.97Å; N342-T344 VanDerWaalsContact O-N 3.16Å; N342-T344 PolarHBondContact O-OG1 3.48Å; T344-F346 HydrophobicContact CG2-CD2 4.34Å; T344-F346 HydrophobicContact CG2-CE1 3.98Å; T344-F346 HydrophobicContact CG2-CE2 3.5Å; T344-F346 VanDerWaalsContact CG2-CE2 3.5Å; T344-F346 HydrophobicContact CG2-CZ 3.27Å
345	T	97.9	Very high	87.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.7	174.2	-59.6	0	0	0	0	110.4	P25 N149 T163 Y331 T332 T333	P25-T345 WeakPolarHBondContact CD-O 3.47Å; P25-T345 HydrophobicContact CG-CG2 3.86Å; N149-T345 WeakPolarHBondContact OD1-CB 3.16Å; N149-T345 PolarHBondContact OD1-OG1 3.07Å; T163-T345 HydrophobicContact CG2-CG2 3.73Å; T163-T345 PolarHBondContact OG1-OG1 3.45Å; Y331-T345 HydrophobicContact CD2-CG2 3.93Å; Y331-T345 HydrophobicContact CG-CG2 4.06Å; T332-T345 CarbonylContact O-C 3.49Å; T332-T345 VanDerWaalsContact O-CA 3.27Å; T332-T345 WeakPolarHBondContact O-CA 3.22Å; T333-T345 PolarHBondContact OG1-OG1 3.49Å
346	F	96	Very high	84.3	Confident	9 Å²	9	52.1 Å²	52.1	4%	0.039	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.3	175.3	-56.1	-85.7	0	0	0	108.8	R19 L22 Y316 Y331 T332 V334 T344 R348	R19-F346 HydrophobicContact CG-CE1 3.75Å; R19-F346 HydrophobicContact CG-CZ 3.74Å; L22-F346 HydrophobicContact CB-CB 4.43Å; L22-F346 HydrophobicContact CB-CD1 4.18Å; L22-F346 HydrophobicContact CD1-CB 4.27Å; Y316-F346 AromaticContact CD2-CD2 3.82Å; Y316-F346 HydrophobicContact CD2-CD2 3.82Å; Y316-F346 AromaticContact CD2-CE2 3.99Å; Y316-F346 HydrophobicContact CD2-CE2 3.99Å; Y316-F346 HydrophobicContact CE2-CB 4.29Å; Y316-F346 AromaticContact CE2-CD2 3.52Å; Y316-F346 HydrophobicContact CE2-CD2 3.52Å; Y316-F346 HydrophobicContact CE2-CE2 4.05Å; Y316-F346 AromaticContact CE2-CG 3.95Å; Y316-F346 HydrophobicContact CE2-CG 3.95Å; Y331-F346 CarbonylContact C-O 3.52Å; Y331-F346 WeakPolarHBondContact CA-O 3.49Å; Y331-F346 WeakPolarHBondContact CB-O 3.38Å; T332-F346 PolarHBondContact N-O 3.5Å; T332-F346 PolarHBondContact O-N 3.3Å; V334-F346 HydrophobicContact CG2-CE2 4.31Å; T344-F346 HydrophobicContact CG2-CD2 4.34Å; T344-F346 HydrophobicContact CG2-CE1 3.98Å; T344-F346 HydrophobicContact CG2-CE2 3.5Å; T344-F346 VanDerWaalsContact CG2-CE2 3.5Å; T344-F346 HydrophobicContact CG2-CZ 3.27Å; F346-R348 PolarHBondContact O-N 3.17Å
347	I	96	Very high	83.6	Confident	22 Å²	22	54.4 Å²	54.4	11%	0.113	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.1	167.5	-63.1	164.7	0	0	0	107.2	P23 P25 R144 T147	P23-I347 HydrophobicContact CG-CB 4.31Å; P23-I347 PolarHBondContact O-N 2.98Å; P23-I347 VanDerWaalsContact O-N 3.08Å; P25-I347 HydrophobicContact CB-CD1 3.89Å; P25-I347 HydrophobicContact CB-CG1 4.1Å; R144-I347 HydrophobicContact CB-CG2 3.75Å; R144-I347 HydrophobicContact CG-CG2 4.04Å; R144-I347 WeakPolarHBondContact O-CD1 3.41Å; T147-I347 HydrophobicContact CG2-CG1 4.26Å
348	R	94.4	Very high	82.8	Confident	5 Å²	5	57.2 Å²	57.2	2%	0.019	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-91.4	133.1	-178.5	-57.4	-55.3	-68.4	-94.6	10.6	109.7	R144 L319 S320 C325 T329 I330 T332 F346	R144-R348 WeakPolarHBondContact CD-O 3.4Å; R144-R348 PolarHBondContact NE-O 2.97Å; L319-R348 PolarHBondContact O-NH1 2.94Å; S320-R348 PolarHBondContact OG-NH1 3.45Å; S320-R348 PolarHBondContact OG-NH2 3.46Å; C325-R348 PolarHBondContact SG-NH1 3.13Å; C325-R348 PolarHBondContact SG-NH2 3.23Å; T329-R348 HydrophobicContact CG2-CB 4.06Å; T329-R348 HydrophobicContact CG2-CG 3.78Å; I330-R348 PolarHBondContact O-N 3.21Å; T332-R348 VanDerWaalsContact OG1-CD 3.28Å; T332-R348 WeakPolarHBondContact OG1-CD 3.41Å; T332-R348 WeakPolarHBondContact OG1-CG 3.38Å; T332-R348 PolarHBondContact OG1-NH1 3.29Å; F346-R348 PolarHBondContact O-N 3.17Å
349	P	89.8	Confident	81.9	Confident	47 Å²	47	57.9 Å²	57.9	31%	0.305	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-63.7	156.2	174.1	28	-34.5	0	0	0	110	L22 G351 C352 F353	L22-P349 HydrophobicContact CD2-CG 4.27Å; P349-G351 PolarHBondContact O-N 2.91Å; P349-C352 WeakPolarHBondContact O-CA 3.44Å; P349-C352 PolarHBondContact O-N 3.44Å; P349-F353 HydrophobicContact CG-CD2 4.31Å; P349-F353 HydrophobicContact CG-CE2 4.13Å; P349-F353 HydrophobicContact CG-CZ 4.21Å
350	Q	83.8	Confident	81.1	Confident	107 Å²	107	58.1 Å²	58.1	50%	0.5	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	124.7	177	-178.7	176.4	-29.1	0	0	110.9	R327 C352	R327-Q350 HydrophobicContact CG-CG 4.02Å; Q350-C352 VanDerWaalsContact C-N 3.32Å
351	G	73.1	Confident	80.3	Confident	25 Å²	25	60 Å²	60	26%	0.258	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	-12.3	-176.3	0	0	0	0	0	114.1	P349	P349-G351 PolarHBondContact O-N 2.91Å
352	C	82.4	Confident	79.5	Confident	12 Å²	12	58.9 Å²	58.9	8%	0.081	31%	0.306	C	S	.	.			trans	54.8	168.2	-161	-53.2	0	0	0	0	111.6	C325 N326 P349 Q350 K354	C325-C352 VanDerWaalsContact CA-SG 3.57Å; C325-C352 HydrophobicContact CB-CB 3.65Å; C325-C352 WeakPolarHBondContact CB-SG 3.5Å; C325-C352 WeakPolarHBondContact SG-CB 3.3Å; C325-C352 CovalentContact SG-SG 2.01Å; C325-C352 PolarHBondContact SG-SG 2.99Å; N326-C352 PolarHBondContact N-SG 3Å; N326-C352 VanDerWaalsContact N-SG 3.39Å; N326-C352 PolarHBondContact O-SG 3.36Å; P349-C352 WeakPolarHBondContact O-CA 3.44Å; P349-C352 PolarHBondContact O-N 3.44Å; Q350-C352 VanDerWaalsContact C-N 3.32Å; C352-K354 PolarHBondContact O-N 3.35Å
353	F	67.1	Low	78.8	Confident	88 Å²	88	57.1 Å²	57.1	39%	0.386	30%	0.296	S	S	.	.			trans	-65.9	114	167.9	-65.6	-70.1	0	0	0	107	L18 L22 P349 T355	L18-F353 HydrophobicContact CD2-CD1 4.46Å; L18-F353 HydrophobicContact CD2-CD2 3.99Å; L18-F353 HydrophobicContact CD2-CE1 4.47Å; L18-F353 HydrophobicContact CD2-CE2 3.98Å; L18-F353 HydrophobicContact CD2-CG 4.23Å; L18-F353 HydrophobicContact CD2-CZ 4.24Å; L22-F353 HydrophobicContact CD1-CE2 4.42Å; L22-F353 HydrophobicContact CD2-CD2 4.47Å; L22-F353 HydrophobicContact CD2-CE2 3.5Å; L22-F353 VanDerWaalsContact CD2-CE2 3.5Å; L22-F353 HydrophobicContact CD2-CZ 4.08Å; L22-F353 HydrophobicContact CG-CE2 4.02Å; P349-F353 HydrophobicContact CG-CD2 4.31Å; P349-F353 HydrophobicContact CG-CE2 4.13Å; P349-F353 HydrophobicContact CG-CZ 4.21Å; F353-T355 PolarHBondContact O-N 3.26Å
354	K	51.7	Low	77.4	Confident	173 Å²	173	59.4 Å²	59.4	75%	0.752	31%	0.311	S	S	*	.			trans	-61.4	107.6	165.7	-76.1	-174.2	175.8	-175.2	0	106.2	C352 D356	C352-K354 PolarHBondContact O-N 3.35Å; K354-D356 PolarHBondContact O-N 3.32Å; K354-D356 VanDerWaalsContact O-N 3.13Å
355	T	43	Very low	75.9	Confident	51 Å²	51	61.3 Å²	61.3	31%	0.313	32%	0.318	S	S	.	.			trans	-74.8	91.9	157.5	54.3	0	0	0	0	104.5	F353	F353-T355 PolarHBondContact O-N 3.26Å
356	D	35.2	Very low	73.9	Confident	196 Å²	196	66.8 Å²	66.8	100%	1.048	35%	0.347	S	S	*	.			trans	-56	0	175.3	-72.3	-29.5	0	0	0	111.7	K354	K354-D356 PolarHBondContact O-N 3.32Å; K354-D356 VanDerWaalsContact O-N 3.13Å

Retrieved 356 of 356 residues in 575.2 ms (Link to these results)

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