A0A087XMW5_POEFO Loading...

Dual specificity protein phosphatase

AlphaFold DB , UniProt , Accession A0A087XMW5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 376 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	37.7	Very low	34.1	Very low	230 Å²	230	160.8 Å²	160.8	100%	1.133	82%	0.823	S	S	*	*				0	96.5	0	-76.5	179.3	76	0	0	108.3
2	Y	30.4	Very low	34.1	Very low	236 Å²	236	159.3 Å²	159.3	93%	0.925	83%	0.827	S	S	*	*			trans	-134.1	114.9	162.3	-95.7	-88.3	0	0	0	105.1	D4	Y2-D4 PolarHBondContact O-N 3.4Å
3	L	31.9	Very low	34	Very low	160 Å²	160	154.4 Å²	154.4	84%	0.838	81%	0.808	S	S	*	*			trans	-75.3	110.9	170.5	-93.6	129.6	0	0	0	107	L5	L3-L5 PolarHBondContact O-N 2.63Å
4	D	27.9	Very low	34.3	Very low	123 Å²	123	153.9 Å²	153.9	66%	0.658	80%	0.803	S	S	*	*			trans	-79	112.5	171.8	-165.3	-12.8	0	0	0	109	Y2 T6	Y2-D4 PolarHBondContact O-N 3.4Å; D4-T6 VanDerWaalsContact C-N 3.29Å; D4-T6 PolarHBondContact O-N 3.42Å; D4-T6 PolarHBondContact OD1-N 3.37Å; D4-T6 PolarHBondContact OD1-OG1 3.46Å
5	L	37.2	Very low	34.8	Very low	165 Å²	165	151.4 Å²	151.4	86%	0.864	80%	0.796	S	S	*	*			trans	-90.4	26.2	-175.7	-93.6	155.8	0	0	0	112.5	L3	L3-L5 PolarHBondContact O-N 2.63Å
6	T	32.9	Very low	35.8	Very low	106 Å²	106	150.3 Å²	150.3	65%	0.65	79%	0.789	S	S	*	*			trans	-117	12.5	-173.3	60	0	0	0	0	117.2	D4	D4-T6 VanDerWaalsContact C-N 3.29Å; D4-T6 PolarHBondContact O-N 3.42Å; D4-T6 PolarHBondContact OD1-N 3.37Å; D4-T6 PolarHBondContact OD1-OG1 3.46Å
7	L	34.3	Very low	37	Very low	150 Å²	150	147.6 Å²	147.6	79%	0.785	77%	0.773	S	S	*	*	S	Bend	trans	-121.9	99.8	162.7	-90.9	80.7	0	0	0	106.8
8	I	38.7	Very low	38.9	Very low	171 Å²	171	149.6 Å²	149.6	88%	0.877	78%	0.778	S	S	*	*	S	Bend		-157.9	88.2	77.4	-70.9	142.4	0	0	0	106.4
9	A	36.8	Very low	41.5	Very low	87 Å²	87	142.5 Å²	142.5	72%	0.719	74%	0.742	S	S	*	*	S	Bend	trans	-120.7	134.3	156.9	0	0	0	0	0	106.7
10	R	36.4	Very low	44	Very low	236 Å²	236	138.9 Å²	138.9	89%	0.891	73%	0.727	S	S	*	*			trans	86.4	77.8	177.7	-52.3	178.5	171.9	-170.8	-3.1	115.6
11	C	30.6	Very low	46.4	Very low	105 Å²	105	135.1 Å²	135.1	71%	0.709	71%	0.71	S	S	*	*			trans	-109	77.9	145.1	-145.9	0	0	0	0	108.2	T13	C11-T13 PolarHBondContact O-N 2.78Å; C11-T13 PolarHBondContact SG-OG1 2.97Å
12	T	34.2	Very low	49.1	Very low	142 Å²	142	124.9 Å²	124.9	87%	0.871	66%	0.66	S	S	*	*			trans	-76.6	59	161.4	31.3	0	0	0	0	109.4
13	T	32.5	Very low	52.2	Low	96 Å²	96	117 Å²	117	59%	0.589	63%	0.634	S	S	*	*			trans	-125.6	108	169.5	-17.7	0	0	0	0	104	C11 V15	C11-T13 PolarHBondContact O-N 2.78Å; C11-T13 PolarHBondContact SG-OG1 2.97Å; T13-V15 PolarHBondContact O-N 3.19Å
14	M	38.1	Very low	55.2	Low	148 Å²	148	109.6 Å²	109.6	73%	0.729	60%	0.595	S	S	*	*			trans	-57.8	90.7	164.1	-81	174.9	61.5	0	0	106.6	I16	M14-I16 VanDerWaalsContact C-N 3.28Å; M14-I16 PolarHBondContact O-N 3Å
15	V	42.4	Very low	58.4	Low	116 Å²	116	106.1 Å²	106.1	70%	0.703	58%	0.583	S	S	*	*			trans	-61.4	107.9	154	-177.2	0	0	0	0	102.8	T13 M17	T13-V15 PolarHBondContact O-N 3.19Å; V15-M17 PolarHBondContact O-N 3.02Å
16	I	50.2	Low	61.1	Low	133 Å²	133	100.9 Å²	100.9	68%	0.682	56%	0.561	S	S	*	*			trans	-59.8	96.5	163.3	-62.7	171.2	0	0	0	103	M14 E18	M14-I16 VanDerWaalsContact C-N 3.28Å; M14-I16 PolarHBondContact O-N 3Å; I16-E18 PolarHBondContact O-N 3.46Å
17	M	56.3	Low	64	Low	106 Å²	106	95.8 Å²	95.8	52%	0.522	53%	0.53	S	S	.	.			trans	-59.8	113.5	166.1	-76.7	175.9	61.4	0	0	104.4	V15 V19 C124	V15-M17 PolarHBondContact O-N 3.02Å; M17-V19 VanDerWaalsContact C-N 3.28Å; M17-V19 PolarHBondContact O-N 3.43Å; M17-C124 HydrophobicContact CE-CB 4.1Å; M17-C124 HydrophobicContact SD-CB 3.79Å
18	E	72.3	Confident	66.7	Low	182 Å²	182	91.9 Å²	91.9	85%	0.85	50%	0.504	S	S	*	.			trans	-63.3	99.8	168.4	-74.5	-171.2	161.8	0	0	106.4	I16 P20	I16-E18 PolarHBondContact O-N 3.46Å; E18-P20 WeakPolarHBondContact O-CD 3.42Å
19	V	86.7	Confident	69.2	Low	16 Å²	16	87.6 Å²	87.6	10%	0.097	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-75.6	119.6	174.7	179.6	0	0	0	0	107	M17 L107 V120 V132 I134	M17-V19 VanDerWaalsContact C-N 3.28Å; M17-V19 PolarHBondContact O-N 3.43Å; V19-L107 HydrophobicContact CB-CD2 4.23Å; V19-L107 HydrophobicContact CG2-CD2 4.07Å; V19-V120 HydrophobicContact CG2-CG1 3.61Å; V19-V132 HydrophobicContact CG1-CB 4.36Å; V19-V132 HydrophobicContact CG1-CG1 4Å; V19-V132 WeakPolarHBondContact CG1-O 3.25Å; V19-I134 HydrophobicContact CB-CD1 4.12Å; V19-I134 HydrophobicContact CG1-CD1 4.02Å; V19-I134 HydrophobicContact CG1-CG1 3.9Å
20	P	92.2	Very high	71.6	Confident	69 Å²	69	86.5 Å²	86.5	45%	0.448	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-64.5	152.1	-178.3	25.9	-34	0	0	0	111.4	E18 V132 F133 I134	E18-P20 WeakPolarHBondContact O-CD 3.42Å; P20-V132 WeakPolarHBondContact CD-O 3.47Å; P20-F133 HydrophobicContact CB-CD1 3.96Å; P20-F133 HydrophobicContact CB-CE1 4.08Å; P20-F133 HydrophobicContact CG-CD1 3.57Å; P20-F133 HydrophobicContact CG-CE1 3.62Å; P20-F133 HydrophobicContact CG-CG 4.48Å; P20-F133 VanDerWaalsContact O-CA 3.27Å; P20-F133 WeakPolarHBondContact O-CA 3.32Å; P20-I134 PolarHBondContact O-N 3.31Å
21	T	94	Very high	74.1	Confident	61 Å²	61	78 Å²	78	37%	0.374	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	154.5	172.4	56.3	0	0	0	0	110.6	T105 D106 I134	T21-T105 WeakPolarHBondContact CG2-O 3.43Å; T21-D106 HydrophobicContact CG2-CB 4.11Å; T21-I134 CarbonylContact C-O 3.49Å; T21-I134 VanDerWaalsContact CA-O 3.23Å; T21-I134 WeakPolarHBondContact CA-O 3.3Å
22	I	94.8	Very high	76.6	Confident	14 Å²	14	78.3 Å²	78.3	7%	0.072	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.6	172.2	-168.1	169.3	0	0	0	108.8	L30 V98 F133 I134 L135 Q136	I22-L30 HydrophobicContact CD1-CD1 3.34Å; I22-V98 HydrophobicContact CG2-CG1 3.7Å; I22-V98 HydrophobicContact CG2-CG2 4.25Å; I22-F133 HydrophobicContact CB-CB 4.09Å; I22-F133 HydrophobicContact CB-CD1 4.32Å; I22-F133 HydrophobicContact CB-CG 4.36Å; I22-F133 HydrophobicContact CG2-CB 3.86Å; I22-I134 PolarHBondContact N-O 2.79Å; I22-L135 HydrophobicContact CG2-CD1 4.46Å; I22-Q136 PolarHBondContact O-N 2.74Å
23	N	95.9	Very high	78.4	Confident	71 Å²	71	73.4 Å²	73.4	38%	0.38	41%	0.411	S	S	.	.			trans	-82.6	167	176.7	67.2	41.6	0	0	0	111.5	A25 S26 L27	N23-A25 VanDerWaalsContact C-N 3.34Å; N23-A25 PolarHBondContact O-N 2.73Å; N23-A25 PolarHBondContact OD1-N 2.89Å; N23-S26 PolarHBondContact O-N 3.19Å; N23-S26 WeakPolarHBondContact OD1-CB 3.33Å; N23-S26 PolarHBondContact OD1-N 2.98Å; N23-S26 PolarHBondContact OD1-OG 3.01Å; N23-S26 VanDerWaalsContact OD1-OG 3.09Å; N23-L27 PolarHBondContact O-N 2.83Å; N23-L27 VanDerWaalsContact O-N 3.07Å
24	C	95.2	Very high	79.5	Confident	5 Å²	5	77.1 Å²	77.1	3%	0.034	43%	0.427	C	S	.	.	H	α-helix	trans	-59.6	-41.5	-176.4	-55.2	0	0	0	0	112.7	L27 R28 F142 E145 Y146	C24-L27 PolarHBondContact O-N 3.01Å; C24-R28 PolarHBondContact O-N 3.47Å; C24-F142 HydrophobicContact CB-CD2 3.82Å; C24-F142 HydrophobicContact CB-CE2 4.45Å; C24-E145 PolarHBondContact SG-OE1 3.47Å; C24-Y146 HydrophobicContact CB-CD2 4Å; C24-Y146 HydrophobicContact CB-CE2 3.55Å
25	A	94.1	Very high	80.4	Confident	49 Å²	49	75.2 Å²	75.2	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-64.7	-42.4	-179.9	0	0	0	0	0	112.9	N23 R28 S29 Y146	N23-A25 VanDerWaalsContact C-N 3.34Å; N23-A25 PolarHBondContact O-N 2.73Å; N23-A25 PolarHBondContact OD1-N 2.89Å; A25-R28 WeakPolarHBondContact O-CB 3.45Å; A25-R28 PolarHBondContact O-N 2.91Å; A25-S29 PolarHBondContact O-N 3.03Å; A25-Y146 WeakPolarHBondContact CA-OH 3.29Å
26	S	93.5	Very high	81.2	Confident	55 Å²	55	73.8 Å²	73.8	39%	0.385	42%	0.417	S	S	.	.	H	α-helix	trans	-67.8	-38.9	176.9	-66.1	0	0	0	0	111.7	N23 S29 L30	N23-S26 PolarHBondContact O-N 3.19Å; N23-S26 WeakPolarHBondContact OD1-CB 3.33Å; N23-S26 PolarHBondContact OD1-N 2.98Å; N23-S26 PolarHBondContact OD1-OG 3.01Å; N23-S26 VanDerWaalsContact OD1-OG 3.09Å; S26-S29 PolarHBondContact O-N 3.35Å; S26-L30 PolarHBondContact O-N 3.26Å; S26-L30 VanDerWaalsContact O-N 3.08Å
27	L	93.7	Very high	82.5	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-61.5	-45.3	173.1	172.6	59.1	0	0	0	111.1	N23 C24 S29 L30 M31 V40 I54 V98 L135 F142	N23-L27 PolarHBondContact O-N 2.83Å; N23-L27 VanDerWaalsContact O-N 3.07Å; C24-L27 PolarHBondContact O-N 3.01Å; L27-S29 VanDerWaalsContact C-N 3.34Å; L27-S29 PolarHBondContact O-N 2.87Å; L27-L30 WeakPolarHBondContact O-CB 3.36Å; L27-L30 PolarHBondContact O-N 2.86Å; L27-M31 HydrophobicContact CD1-CG 4.03Å; L27-M31 HydrophobicContact CD1-SD 4.01Å; L27-M31 HydrophobicContact CG-SD 4.1Å; L27-M31 WeakPolarHBondContact O-CG 3.19Å; L27-M31 PolarHBondContact O-N 3.48Å; L27-V40 HydrophobicContact CD1-CG2 3.96Å; L27-I54 HydrophobicContact CD2-CD1 4Å; L27-V98 HydrophobicContact CD1-CB 4.13Å; L27-V98 HydrophobicContact CD1-CG1 4.16Å; L27-V98 HydrophobicContact CD1-CG2 3.97Å; L27-V98 HydrophobicContact CD2-CG1 4.31Å; L27-L135 HydrophobicContact CB-CD1 4.23Å; L27-L135 HydrophobicContact CD2-CD1 3.72Å; L27-L135 HydrophobicContact CD2-CD2 3.75Å; L27-L135 HydrophobicContact CD2-CG 4.27Å; L27-F142 HydrophobicContact CB-CE2 4.19Å; L27-F142 HydrophobicContact CD2-CD2 3.87Å; L27-F142 HydrophobicContact CD2-CE2 3.66Å; L27-F142 HydrophobicContact CD2-CZ 4.38Å; L27-F142 HydrophobicContact CG-CE2 3.9Å
28	R	91.9	Very high	84.1	Confident	67 Å²	67	63.6 Å²	63.6	25%	0.253	37%	0.369	S	S	.	.	H	α-helix	trans	-54.8	-50.3	175.2	170.1	178.2	-174	131.1	16.7	111.6	C24 A25 L30 M31 E32 E148 M149	C24-R28 PolarHBondContact O-N 3.47Å; A25-R28 WeakPolarHBondContact O-CB 3.45Å; A25-R28 PolarHBondContact O-N 2.91Å; R28-L30 VanDerWaalsContact C-N 3.25Å; R28-L30 PolarHBondContact O-N 3.23Å; R28-M31 PolarHBondContact O-N 3.38Å; R28-E32 HydrophobicContact CG-CG 4.32Å; R28-E32 WeakPolarHBondContact CG-OE2 3.47Å; R28-E32 IonicContact CZ-OE1 3.25Å; R28-E32 VanDerWaalsContact CZ-OE1 3.25Å; R28-E32 IonicContact NE-OE1 2.99Å; R28-E32 PolarHBondContact NE-OE1 2.81Å; R28-E32 IonicContact NE-OE2 3.25Å; R28-E32 PolarHBondContact NE-OE2 3.29Å; R28-E32 IonicContact NH2-OE1 2.78Å; R28-E32 PolarHBondContact NH2-OE1 3.31Å; R28-E32 PolarHBondContact O-N 3.15Å; R28-E148 IonicContact CZ-OE1 3.63Å; R28-E148 IonicContact NH1-OE1 2.72Å; R28-E148 PolarHBondContact NH1-OE1 2.69Å; R28-E148 IonicContact NH2-OE1 3.8Å; R28-M149 HydrophobicContact CB-SD 4.09Å; R28-M149 HydrophobicContact CG-CE 4.37Å; R28-M149 HydrophobicContact CG-SD 3.71Å
29	S	90.8	Very high	85	Confident	82 Å²	82	55.3 Å²	55.3	57%	0.573	33%	0.331	S	S	*	.	H	α-helix	trans	-61.1	-33.4	180	-174.1	0	0	0	0	112.9	A25 S26 L27 M31 G33	A25-S29 PolarHBondContact O-N 3.03Å; S26-S29 PolarHBondContact O-N 3.35Å; L27-S29 VanDerWaalsContact C-N 3.34Å; L27-S29 PolarHBondContact O-N 2.87Å; S29-M31 VanDerWaalsContact C-N 3.34Å; S29-G33 PolarHBondContact O-N 2.92Å
30	L	88.8	Confident	85.3	Confident	64 Å²	64	54.8 Å²	54.8	34%	0.335	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-31.8	174.6	-80.3	165.9	0	0	0	112.7	I22 S26 L27 R28 C38	I22-L30 HydrophobicContact CD1-CD1 3.34Å; S26-L30 PolarHBondContact O-N 3.26Å; S26-L30 VanDerWaalsContact O-N 3.08Å; L27-L30 WeakPolarHBondContact O-CB 3.36Å; L27-L30 PolarHBondContact O-N 2.86Å; R28-L30 VanDerWaalsContact C-N 3.25Å; R28-L30 PolarHBondContact O-N 3.23Å; L30-C38 HydrophobicContact CB-CB 4.09Å
31	M	87.1	Confident	85.4	Confident	58 Å²	58	51.5 Å²	51.5	29%	0.286	31%	0.306	S	S	.	.	H	α-helix	trans	-81.6	-30.5	-179.9	-69.3	-177.2	72.4	0	0	113.1	L27 R28 S29 V40 I54 S55 M149	L27-M31 HydrophobicContact CD1-CG 4.03Å; L27-M31 HydrophobicContact CD1-SD 4.01Å; L27-M31 HydrophobicContact CG-SD 4.1Å; L27-M31 WeakPolarHBondContact O-CG 3.19Å; L27-M31 PolarHBondContact O-N 3.48Å; R28-M31 PolarHBondContact O-N 3.38Å; S29-M31 VanDerWaalsContact C-N 3.34Å; M31-V40 HydrophobicContact CE-CG2 4.43Å; M31-V40 HydrophobicContact CG-CG2 4.45Å; M31-V40 HydrophobicContact SD-CG2 4.09Å; M31-I54 HydrophobicContact CE-CG2 3.63Å; M31-I54 HydrophobicContact SD-CG2 3.85Å; M31-S55 VanDerWaalsContact CE-O 3.25Å; M31-S55 WeakPolarHBondContact CE-O 3.35Å; M31-M149 HydrophobicContact CB-CE 4.06Å; M31-M149 HydrophobicContact CE-CE 4.31Å; M31-M149 HydrophobicContact SD-CE 4.09Å
32	E	84.6	Confident	85.4	Confident	110 Å²	110	48.6 Å²	48.6	51%	0.514	29%	0.288	S	S	.	.	S	Bend	trans	-85.9	-6.3	-179.6	-70.2	178	157.1	0	0	113.7	R28	R28-E32 HydrophobicContact CG-CG 4.32Å; R28-E32 WeakPolarHBondContact CG-OE2 3.47Å; R28-E32 IonicContact CZ-OE1 3.25Å; R28-E32 VanDerWaalsContact CZ-OE1 3.25Å; R28-E32 IonicContact NE-OE1 2.99Å; R28-E32 PolarHBondContact NE-OE1 2.81Å; R28-E32 IonicContact NE-OE2 3.25Å; R28-E32 PolarHBondContact NE-OE2 3.29Å; R28-E32 IonicContact NH2-OE1 2.78Å; R28-E32 PolarHBondContact NH2-OE1 3.31Å; R28-E32 PolarHBondContact O-N 3.15Å
33	G	71.2	Confident	85.2	Confident	39 Å²	39	48.2 Å²	48.2	40%	0.402	29%	0.287	S	S	.	.	S	Bend	trans	-67.3	150.2	-179.9	0	0	0	0	0	114.2	S29 V35	S29-G33 PolarHBondContact O-N 2.92Å; G33-V35 PolarHBondContact O-N 3.3Å
34	D	56.7	Low	84.9	Confident	174 Å²	174	45.6 Å²	45.6	93%	0.93	27%	0.272	S	S	*	.	S	Bend	trans	-61.2	-12.7	-177.4	-77.4	-34.5	0	0	0	114.9
35	V	56.2	Low	84.1	Confident	108 Å²	108	48.3 Å²	48.3	66%	0.655	29%	0.291	S	S	*	.	S	Bend	trans	-125.2	120.9	175.4	-168.7	0	0	0	0	108.3	G33 G37	G33-V35 PolarHBondContact O-N 3.3Å; V35-G37 PolarHBondContact O-N 3.19Å
36	P	59.7	Low	83.1	Confident	86 Å²	86	47.6 Å²	47.6	56%	0.558	28%	0.279	S	S	*	.			trans	-73.3	72.9	-179.5	29.5	-34.1	0	0	0	110.7	C38	P36-C38 VanDerWaalsContact C-N 3.3Å
37	G	77.7	Confident	81.7	Confident	8 Å²	8	47.7 Å²	47.7	8%	0.082	28%	0.275	C	S	.	.			trans	-85.5	1.7	179.5	0	0	0	0	0	113.8	V35 Y94 Q95 S96	V35-G37 PolarHBondContact O-N 3.19Å; G37-Y94 CarbonylContact O-C 3.52Å; G37-Y94 WeakPolarHBondContact O-CA 3.22Å; G37-Q95 PolarHBondContact O-N 3.42Å; G37-S96 PolarHBondContact O-N 3.06Å
38	C	88.8	Confident	81	Confident	18 Å²	18	49.2 Å²	49.2	12%	0.122	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.3	-175.6	-176.1	0	0	0	0	112.4	L30 P36 S96	L30-C38 HydrophobicContact CB-CB 4.09Å; P36-C38 VanDerWaalsContact C-N 3.3Å; C38-S96 WeakPolarHBondContact CA-O 3.41Å
39	L	91.3	Very high	80.6	Confident	7 Å²	7	47 Å²	47	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.9	170.2	177.7	63.6	0	0	0	110.1	L41 V80 T85 L89 Y94 S96 V97 V98	L39-L41 HydrophobicContact CD1-CD2 4.41Å; L39-L41 HydrophobicContact CD2-CD2 4.04Å; L39-L41 HydrophobicContact CD2-CG 4.37Å; L39-L41 HydrophobicContact CG-CD2 4.03Å; L39-L41 HydrophobicContact CG-CG 4.25Å; L39-V80 HydrophobicContact CD2-CG2 4.18Å; L39-T85 HydrophobicContact CD1-CG2 3.72Å; L39-T85 HydrophobicContact CD2-CG2 3.97Å; L39-L89 HydrophobicContact CD2-CD1 4.05Å; L39-Y94 HydrophobicContact CB-CD1 3.79Å; L39-Y94 HydrophobicContact CB-CD2 4.23Å; L39-Y94 HydrophobicContact CB-CE1 3.92Å; L39-Y94 HydrophobicContact CB-CE2 4.36Å; L39-Y94 HydrophobicContact CB-CG 3.95Å; L39-Y94 HydrophobicContact CD2-CD2 4.48Å; L39-Y94 HydrophobicContact CD2-CE2 4.42Å; L39-S96 PolarHBondContact N-O 3.29Å; L39-V97 HydrophobicContact CB-CG2 4.17Å; L39-V97 HydrophobicContact CD2-CG2 4.4Å; L39-V97 CarbonylContact O-C 3.52Å; L39-V97 WeakPolarHBondContact O-CA 3.47Å; L39-V98 PolarHBondContact O-N 3.3Å
40	V	94	Very high	80	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.03	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.8	177.2	-174.4	0	0	0	0	110.3	L27 M31 S57 T58 V98 L100	L27-V40 HydrophobicContact CD1-CG2 3.96Å; M31-V40 HydrophobicContact CE-CG2 4.43Å; M31-V40 HydrophobicContact CG-CG2 4.45Å; M31-V40 HydrophobicContact SD-CG2 4.09Å; V40-S57 WeakPolarHBondContact O-CA 3.41Å; V40-T58 PolarHBondContact O-N 2.89Å; V40-V98 CarbonylContact C-O 3.56Å; V40-V98 WeakPolarHBondContact CA-O 3.45Å; V40-L100 HydrophobicContact CG1-CD2 3.73Å
41	L	93.4	Very high	79.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113	-179.3	-64.4	-177.9	0	0	0	111.3	L39 T58 V60 I79 V80 V97 V98 L99 L100 L123	L39-L41 HydrophobicContact CD1-CD2 4.41Å; L39-L41 HydrophobicContact CD2-CD2 4.04Å; L39-L41 HydrophobicContact CD2-CG 4.37Å; L39-L41 HydrophobicContact CG-CD2 4.03Å; L39-L41 HydrophobicContact CG-CG 4.25Å; L41-T58 CarbonylContact C-O 3.59Å; L41-T58 WeakPolarHBondContact CA-O 3.37Å; L41-V60 HydrophobicContact CB-CG2 3.73Å; L41-V60 HydrophobicContact CD1-CG2 4.42Å; L41-V60 HydrophobicContact CD2-CG2 4.39Å; L41-V60 HydrophobicContact CG-CG2 4.41Å; L41-I79 HydrophobicContact CD1-CG2 3.6Å; L41-V80 HydrophobicContact CD1-CG2 4.49Å; L41-V80 HydrophobicContact CD2-CG2 4.21Å; L41-V97 HydrophobicContact CD1-CG1 3.63Å; L41-V97 HydrophobicContact CG-CG1 4.03Å; L41-V98 PolarHBondContact N-O 2.74Å; L41-L99 HydrophobicContact CB-CD2 4.48Å; L41-L99 HydrophobicContact CB-CG 4.26Å; L41-L99 HydrophobicContact CD1-CD2 4.42Å; L41-L99 HydrophobicContact CD1-CG 4.49Å; L41-L99 WeakPolarHBondContact O-CA 3.43Å; L41-L100 PolarHBondContact O-N 3.45Å; L41-L123 HydrophobicContact CD1-CD1 3.95Å
42	D	93.5	Very high	79.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	112.3	179.4	-169.3	-35.8	0	0	0	110.6	R44 F49 T58 N59 V60 L100	D42-R44 WeakPolarHBondContact OD1-CB 3.36Å; D42-R44 VanDerWaalsContact OD1-CG 3.24Å; D42-R44 WeakPolarHBondContact OD1-CG 3.49Å; D42-R44 PolarHBondContact OD1-N 3.05Å; D42-R44 IonicContact OD1-NE 3.19Å; D42-R44 PolarHBondContact OD1-NE 3.4Å; D42-R44 IonicContact OD2-CZ 3.39Å; D42-R44 IonicContact OD2-NE 3.05Å; D42-R44 PolarHBondContact OD2-NE 3.19Å; D42-R44 IonicContact OD2-NH2 2.79Å; D42-R44 PolarHBondContact OD2-NH2 3.05Å; D42-F49 HydrophobicContact CB-CD2 3.52Å; D42-F49 HydrophobicContact CB-CE2 3.77Å; D42-F49 WeakPolarHBondContact OD2-CD2 3.47Å; D42-T58 PolarHBondContact N-O 2.94Å; D42-N59 WeakPolarHBondContact O-CA 3.45Å; D42-N59 PolarHBondContact O-ND2 3.23Å; D42-V60 PolarHBondContact O-N 3.01Å; D42-L100 HydrophobicContact CB-CD1 4.08Å; D42-L100 HydrophobicContact CB-CG 4.35Å; D42-L100 VanDerWaalsContact CG-CD1 3.47Å
43	C	91.8	Very high	79.6	Confident	7 Å²	7	39.1 Å²	39.1	5%	0.047	24%	0.241	C	C	.	.			trans	-94.1	9.4	-177.9	-67.1	0	0	0	0	113.7	L100 T115 L116	C43-L100 WeakPolarHBondContact CA-O 3.24Å; C43-L100 VanDerWaalsContact CB-O 3.25Å; C43-L100 WeakPolarHBondContact CB-O 3.16Å; C43-L100 PolarHBondContact N-O 2.61Å; C43-T115 HydrophobicContact CB-CG2 3.63Å; C43-T115 WeakPolarHBondContact O-CB 3.4Å; C43-T115 WeakPolarHBondContact O-CG2 3.37Å; C43-L116 HydrophobicContact CB-CB 4.05Å; C43-L116 HydrophobicContact CB-CD1 4.32Å
44	R	89.5	Confident	80.7	Confident	16 Å²	16	37.3 Å²	37.3	6%	0.06	22%	0.222	C	C	.	.	S	Bend	trans	-71.8	171.5	172.3	-59	-179.2	-63	151.5	-1	111	D42 S52 N59 D101 E102	D42-R44 WeakPolarHBondContact OD1-CB 3.36Å; D42-R44 VanDerWaalsContact OD1-CG 3.24Å; D42-R44 WeakPolarHBondContact OD1-CG 3.49Å; D42-R44 PolarHBondContact OD1-N 3.05Å; D42-R44 IonicContact OD1-NE 3.19Å; D42-R44 PolarHBondContact OD1-NE 3.4Å; D42-R44 IonicContact OD2-CZ 3.39Å; D42-R44 IonicContact OD2-NE 3.05Å; D42-R44 PolarHBondContact OD2-NE 3.19Å; D42-R44 IonicContact OD2-NH2 2.79Å; D42-R44 PolarHBondContact OD2-NH2 3.05Å; R44-S52 PolarHBondContact NH2-O 3.27Å; R44-N59 PolarHBondContact O-ND2 3.27Å; R44-N59 VanDerWaalsContact O-ND2 3.17Å; R44-D101 VanDerWaalsContact CG-C 3.42Å; R44-E102 VanDerWaalsContact CD-CD 3.43Å; R44-E102 VanDerWaalsContact CD-OE1 3.3Å; R44-E102 WeakPolarHBondContact CD-OE1 3.24Å; R44-E102 WeakPolarHBondContact CD-OE2 3.28Å; R44-E102 HydrophobicContact CG-CB 4.39Å; R44-E102 IonicContact CZ-OE1 3.89Å; R44-E102 IonicContact NH1-OE1 2.98Å; R44-E102 PolarHBondContact NH1-OE1 3.28Å
45	S	77.8	Confident	82.3	Confident	62 Å²	62	31.6 Å²	31.6	43%	0.434	20%	0.196	S	C	.	.			trans	-57.6	149.1	174.6	79.9	0	0	0	0	110.1	L47 S48 F49	S45-L47 PolarHBondContact O-N 2.78Å; S45-L47 VanDerWaalsContact O-N 3.14Å; S45-L47 PolarHBondContact OG-N 3.25Å; S45-S48 PolarHBondContact O-N 2.99Å; S45-S48 VanDerWaalsContact O-N 3.09Å; S45-S48 PolarHBondContact OG-N 2.97Å; S45-S48 PolarHBondContact OG-OG 3.17Å; S45-F49 PolarHBondContact O-N 3.08Å
46	F	72.1	Confident	83.8	Confident	34 Å²	34	30 Å²	30	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-53.2	-36.7	174.3	177.4	-97	0	0	0	110.8	F49 N50 L192 N291	F46-F49 PolarHBondContact O-N 3.42Å; F46-N50 VanDerWaalsContact CD2-ND2 3.26Å; F46-N50 WeakPolarHBondContact CD2-ND2 3.33Å; F46-N50 WeakPolarHBondContact CE1-ND2 3.36Å; F46-N50 WeakPolarHBondContact CE2-ND2 3.33Å; F46-N50 VanDerWaalsContact CZ-CG 3.48Å; F46-N50 WeakPolarHBondContact CZ-ND2 3.47Å; F46-N50 PolarHBondContact O-N 3.02Å; F46-N50 PolarHBondContact O-ND2 3.37Å; F46-L192 HydrophobicContact CE1-CD2 4.31Å; F46-L192 HydrophobicContact CZ-CD2 4.41Å; F46-N291 HydrophobicContact CD1-CB 4.43Å; F46-N291 HydrophobicContact CE1-CB 4.48Å; F46-N291 WeakPolarHBondContact CE1-ND2 3.47Å; F46-N291 WeakPolarHBondContact CE2-ND2 3.35Å; F46-N291 WeakPolarHBondContact CZ-ND2 3.37Å
47	L	64.1	Low	85.3	Confident	57 Å²	57	26.4 Å²	26.4	30%	0.298	18%	0.178	S	C	.	.	H	α-helix	trans	-63.5	-49.7	177.5	-55.3	-171.1	0	0	0	112.1	S45 F49 N50 A51 F301	S45-L47 PolarHBondContact O-N 2.78Å; S45-L47 VanDerWaalsContact O-N 3.14Å; S45-L47 PolarHBondContact OG-N 3.25Å; L47-F49 VanDerWaalsContact C-N 3.31Å; L47-F49 PolarHBondContact O-N 3.38Å; L47-N50 PolarHBondContact O-N 2.98Å; L47-A51 WeakPolarHBondContact O-CB 3.23Å; L47-A51 PolarHBondContact O-N 3.35Å; L47-F301 HydrophobicContact CD1-CD2 4.34Å; L47-F301 HydrophobicContact CD2-CB 4.23Å; L47-F301 HydrophobicContact CD2-CD2 3.31Å; L47-F301 HydrophobicContact CD2-CE2 3.71Å; L47-F301 HydrophobicContact CD2-CG 3.89Å; L47-F301 HydrophobicContact CG-CD2 4.27Å
48	S	79.5	Confident	85.8	Confident	31 Å²	31	28 Å²	28	22%	0.217	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-44.3	176.7	-55.6	0	0	0	0	111.2	S45 A51 S52 E102	S45-S48 PolarHBondContact O-N 2.99Å; S45-S48 VanDerWaalsContact O-N 3.09Å; S45-S48 PolarHBondContact OG-N 2.97Å; S45-S48 PolarHBondContact OG-OG 3.17Å; S48-A51 WeakPolarHBondContact O-CB 3.49Å; S48-A51 PolarHBondContact O-N 3.28Å; S48-S52 PolarHBondContact O-N 2.81Å; S48-E102 PolarHBondContact OG-OE2 2.94Å
49	F	84.8	Confident	85.7	Confident	22 Å²	22	27.9 Å²	27.9	10%	0.096	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-44.8	178.3	179.3	-92.4	0	0	0	112.6	D42 S45 F46 L47 A51 S52 H53 S57 N59	D42-F49 HydrophobicContact CB-CD2 3.52Å; D42-F49 HydrophobicContact CB-CE2 3.77Å; D42-F49 WeakPolarHBondContact OD2-CD2 3.47Å; S45-F49 PolarHBondContact O-N 3.08Å; F46-F49 PolarHBondContact O-N 3.42Å; L47-F49 VanDerWaalsContact C-N 3.31Å; L47-F49 PolarHBondContact O-N 3.38Å; F49-A51 VanDerWaalsContact C-N 3.29Å; F49-A51 PolarHBondContact O-N 3.05Å; F49-S52 CarbonylContact O-C 3.59Å; F49-S52 VanDerWaalsContact O-C 3.31Å; F49-S52 PolarHBondContact O-N 3.09Å; F49-H53 HydrophobicContact CD2-CB 3.43Å; F49-H53 VanDerWaalsContact CD2-CB 3.43Å; F49-H53 AromaticContact CD2-CG 3.82Å; F49-H53 AromaticContact CE1-CE1 3.82Å; F49-H53 AromaticContact CE1-CG 3.98Å; F49-H53 AromaticContact CE1-ND1 3.83Å; F49-H53 AromaticContact CE1-NE2 3.98Å; F49-H53 HydrophobicContact CE2-CB 3.48Å; F49-H53 VanDerWaalsContact CE2-CB 3.48Å; F49-H53 AromaticContact CE2-CD2 3.6Å; F49-H53 AromaticContact CE2-CG 3.5Å; F49-H53 HydrophobicContact CG-CB 4.06Å; F49-H53 HydrophobicContact CZ-CB 4.1Å; F49-H53 AromaticContact CZ-CD2 3.41Å; F49-H53 VanDerWaalsContact CZ-CD2 3.41Å; F49-H53 WeakPolarHBondContact CZ-CD2 3.41Å; F49-H53 AromaticContact CZ-CE1 3.95Å; F49-H53 AromaticContact CZ-CG 3.58Å; F49-H53 AromaticContact CZ-ND1 3.91Å; F49-H53 AromaticContact CZ-NE2 3.68Å; F49-H53 WeakPolarHBondContact O-CB 3.36Å; F49-H53 PolarHBondContact O-ND1 3.07Å; F49-S57 WeakPolarHBondContact CE2-OG 3.36Å; F49-N59 HydrophobicContact CB-CB 4.24Å; F49-N59 HydrophobicContact CD1-CB 3.69Å; F49-N59 HydrophobicContact CD2-CB 3.69Å; F49-N59 HydrophobicContact CE1-CB 3.87Å; F49-N59 HydrophobicContact CE2-CB 3.85Å; F49-N59 HydrophobicContact CG-CB 3.59Å; F49-N59 HydrophobicContact CZ-CB 3.95Å
50	N	76.3	Confident	85.5	Confident	43 Å²	43	27.7 Å²	27.7	23%	0.23	18%	0.183	C	C	.	.	H	α-helix	trans	-75	-21.8	179.1	-74.5	-98.6	0	0	0	112.6	F46 L47	F46-N50 VanDerWaalsContact CD2-ND2 3.26Å; F46-N50 WeakPolarHBondContact CD2-ND2 3.33Å; F46-N50 WeakPolarHBondContact CE1-ND2 3.36Å; F46-N50 WeakPolarHBondContact CE2-ND2 3.33Å; F46-N50 VanDerWaalsContact CZ-CG 3.48Å; F46-N50 WeakPolarHBondContact CZ-ND2 3.47Å; F46-N50 PolarHBondContact O-N 3.02Å; F46-N50 PolarHBondContact O-ND2 3.37Å; L47-N50 PolarHBondContact O-N 2.98Å
51	A	76.4	Confident	84.3	Confident	48 Å²	48	32.6 Å²	32.6	40%	0.397	20%	0.201	S	C	.	.	H	α-helix	trans	-67.4	-43.6	171.8	0	0	0	0	0	111	L47 S48 F49 A153	L47-A51 WeakPolarHBondContact O-CB 3.23Å; L47-A51 PolarHBondContact O-N 3.35Å; S48-A51 WeakPolarHBondContact O-CB 3.49Å; S48-A51 PolarHBondContact O-N 3.28Å; F49-A51 VanDerWaalsContact C-N 3.29Å; F49-A51 PolarHBondContact O-N 3.05Å; A51-A153 WeakPolarHBondContact O-CA 3.35Å; A51-A153 VanDerWaalsContact O-CB 3.23Å; A51-A153 WeakPolarHBondContact O-CB 3.35Å
52	S	84.8	Confident	83	Confident	20 Å²	20	33.7 Å²	33.7	14%	0.14	21%	0.206	C	C	.	.			trans	-171.2	145.9	170.9	179.2	0	0	0	0	108.5	R44 S48 F49 F139 T151	R44-S52 PolarHBondContact NH2-O 3.27Å; S48-S52 PolarHBondContact O-N 2.81Å; F49-S52 CarbonylContact O-C 3.59Å; F49-S52 VanDerWaalsContact O-C 3.31Å; F49-S52 PolarHBondContact O-N 3.09Å; S52-F139 WeakPolarHBondContact OG-CZ 3.27Å; S52-T151 PolarHBondContact OG-O 3.27Å
53	H	92.4	Very high	81.2	Confident	37 Å²	37	35 Å²	35	17%	0.171	22%	0.215	C	C	.	.			trans	-153.1	166.3	179	57.3	-85	0	0	0	111.1	F49 S55 F139 C150 T151	F49-H53 HydrophobicContact CD2-CB 3.43Å; F49-H53 VanDerWaalsContact CD2-CB 3.43Å; F49-H53 AromaticContact CD2-CG 3.82Å; F49-H53 AromaticContact CE1-CE1 3.82Å; F49-H53 AromaticContact CE1-CG 3.98Å; F49-H53 AromaticContact CE1-ND1 3.83Å; F49-H53 AromaticContact CE1-NE2 3.98Å; F49-H53 HydrophobicContact CE2-CB 3.48Å; F49-H53 VanDerWaalsContact CE2-CB 3.48Å; F49-H53 AromaticContact CE2-CD2 3.6Å; F49-H53 AromaticContact CE2-CG 3.5Å; F49-H53 HydrophobicContact CG-CB 4.06Å; F49-H53 HydrophobicContact CZ-CB 4.1Å; F49-H53 AromaticContact CZ-CD2 3.41Å; F49-H53 VanDerWaalsContact CZ-CD2 3.41Å; F49-H53 WeakPolarHBondContact CZ-CD2 3.41Å; F49-H53 AromaticContact CZ-CE1 3.95Å; F49-H53 AromaticContact CZ-CG 3.58Å; F49-H53 AromaticContact CZ-ND1 3.91Å; F49-H53 AromaticContact CZ-NE2 3.68Å; F49-H53 WeakPolarHBondContact O-CB 3.36Å; F49-H53 PolarHBondContact O-ND1 3.07Å; H53-S55 PolarHBondContact O-N 3.03Å; H53-F139 VanDerWaalsContact C-CE2 3.49Å; H53-F139 VanDerWaalsContact CA-CE2 3.41Å; H53-C150 CarbonylContact O-C 3.56Å; H53-C150 VanDerWaalsContact O-CA 3.3Å; H53-C150 WeakPolarHBondContact O-CA 2.88Å; H53-T151 PolarHBondContact CE1-OG1 3.39Å; H53-T151 PolarHBondContact N-OG1 2.98Å; H53-T151 PolarHBondContact ND1-OG1 2.92Å; H53-T151 VanDerWaalsContact ND1-OG1 3.14Å; H53-T151 WeakPolarHBondContact NE2-CG2 3.42Å; H53-T151 PolarHBondContact O-N 2.96Å; H53-T151 PolarHBondContact O-OG1 3.07Å; H53-T151 VanDerWaalsContact O-OG1 3.11Å
54	I	94.4	Very high	79.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-66.8	131.8	175.6	-58.8	-178.9	0	0	0	109	L27 M31 G56 S57 L100 L135 F139 F142	L27-I54 HydrophobicContact CD2-CD1 4Å; M31-I54 HydrophobicContact CE-CG2 3.63Å; M31-I54 HydrophobicContact SD-CG2 3.85Å; I54-G56 PolarHBondContact O-N 2.84Å; I54-S57 VanDerWaalsContact O-CB 3.23Å; I54-S57 WeakPolarHBondContact O-CB 3.44Å; I54-S57 PolarHBondContact O-N 2.86Å; I54-S57 PolarHBondContact O-OG 2.83Å; I54-L100 HydrophobicContact CD1-CD2 3.5Å; I54-L100 HydrophobicContact CG1-CD2 4.24Å; I54-L135 HydrophobicContact CD1-CD2 4.08Å; I54-F139 HydrophobicContact CG1-CD2 4Å; I54-F139 HydrophobicContact CG1-CE2 3.98Å; I54-F142 HydrophobicContact CD1-CB 4.33Å; I54-F142 HydrophobicContact CD1-CD1 3.43Å; I54-F142 VanDerWaalsContact CD1-CD1 3.43Å; I54-F142 HydrophobicContact CD1-CD2 4.13Å; I54-F142 HydrophobicContact CD1-CE1 3.66Å; I54-F142 HydrophobicContact CD1-CE2 4.33Å; I54-F142 HydrophobicContact CD1-CG 3.69Å; I54-F142 HydrophobicContact CD1-CZ 4.11Å; I54-F142 HydrophobicContact CG1-CD1 3.63Å; I54-F142 HydrophobicContact CG1-CE1 3.79Å; I54-F142 HydrophobicContact CG1-CG 4.35Å; I54-F142 HydrophobicContact CG2-CE1 4.03Å; I54-F142 HydrophobicContact CG2-CZ 4.39Å
55	S	89.8	Confident	77.6	Confident	55 Å²	55	39.6 Å²	39.6	39%	0.385	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	132	-179.1	-59.9	0	0	0	0	111.1	M31 H53 S57 M149	M31-S55 VanDerWaalsContact CE-O 3.25Å; M31-S55 WeakPolarHBondContact CE-O 3.35Å; H53-S55 PolarHBondContact O-N 3.03Å; S55-S57 VanDerWaalsContact C-N 3.26Å; S55-S57 PolarHBondContact O-N 3.26Å; S55-M149 VanDerWaalsContact CB-O 3.23Å; S55-M149 WeakPolarHBondContact CB-O 3.22Å; S55-M149 PolarHBondContact N-O 3.48Å; S55-M149 PolarHBondContact OG-O 2.87Å
56	G	86.5	Confident	76.6	Confident	74 Å²	74	37.8 Å²	37.8	76%	0.763	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	79	-1.7	-176.5	0	0	0	0	0	115.3	I54	I54-G56 PolarHBondContact O-N 2.84Å
57	S	91.5	Very high	76.1	Confident	11 Å²	11	41.1 Å²	41.1	8%	0.077	24%	0.241	C	C	.	.			trans	-74.3	153.4	172.3	67	0	0	0	0	112.5	V40 F49 I54 S55	V40-S57 WeakPolarHBondContact O-CA 3.41Å; F49-S57 WeakPolarHBondContact CE2-OG 3.36Å; I54-S57 VanDerWaalsContact O-CB 3.23Å; I54-S57 WeakPolarHBondContact O-CB 3.44Å; I54-S57 PolarHBondContact O-N 2.86Å; I54-S57 PolarHBondContact O-OG 2.83Å; S55-S57 VanDerWaalsContact C-N 3.26Å; S55-S57 PolarHBondContact O-N 3.26Å
58	T	88.3	Confident	75.9	Confident	41 Å²	41	48.2 Å²	48.2	25%	0.252	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	128	177.6	-60.9	0	0	0	0	110.3	V40 L41 D42 V60	V40-T58 PolarHBondContact O-N 2.89Å; L41-T58 CarbonylContact C-O 3.59Å; L41-T58 WeakPolarHBondContact CA-O 3.37Å; D42-T58 PolarHBondContact N-O 2.94Å; T58-V60 PolarHBondContact O-N 3.47Å
59	N	88.3	Confident	74.7	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.08	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	128.1	174.9	-177.8	-123	0	0	0	111.8	D42 R44 F49	D42-N59 WeakPolarHBondContact O-CA 3.45Å; D42-N59 PolarHBondContact O-ND2 3.23Å; R44-N59 PolarHBondContact O-ND2 3.27Å; R44-N59 VanDerWaalsContact O-ND2 3.17Å; F49-N59 HydrophobicContact CB-CB 4.24Å; F49-N59 HydrophobicContact CD1-CB 3.69Å; F49-N59 HydrophobicContact CD2-CB 3.69Å; F49-N59 HydrophobicContact CE1-CB 3.87Å; F49-N59 HydrophobicContact CE2-CB 3.85Å; F49-N59 HydrophobicContact CG-CB 3.59Å; F49-N59 HydrophobicContact CZ-CB 3.95Å
60	V	86.3	Confident	73.5	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.024	28%	0.279	C	S	.	.			trans	-79.2	120.5	175.9	-178.8	0	0	0	0	109.8	L41 D42 T58 F62 I79 T115 A119	L41-V60 HydrophobicContact CB-CG2 3.73Å; L41-V60 HydrophobicContact CD1-CG2 4.42Å; L41-V60 HydrophobicContact CD2-CG2 4.39Å; L41-V60 HydrophobicContact CG-CG2 4.41Å; D42-V60 PolarHBondContact O-N 3.01Å; T58-V60 PolarHBondContact O-N 3.47Å; V60-F62 HydrophobicContact CG1-CD2 4.03Å; V60-F62 HydrophobicContact CG1-CE1 4.02Å; V60-F62 HydrophobicContact CG1-CE2 3.3Å; V60-F62 HydrophobicContact CG1-CZ 3.31Å; V60-I79 HydrophobicContact CG1-CG2 4.19Å; V60-I79 HydrophobicContact CG2-CG2 4.18Å; V60-T115 HydrophobicContact CB-CG2 4.04Å; V60-T115 HydrophobicContact CG1-CG2 3.96Å; V60-A119 HydrophobicContact CG1-CB 4.2Å
61	R	68.5	Low	72.3	Confident	107 Å²	107	62 Å²	62	40%	0.404	31%	0.312	S	S	.	.			trans	-102.7	100.2	-175.7	-67.5	-152.9	179.8	176.4	3.5	112.7	T290	R61-T290 PolarHBondContact NH1-O 3.39Å; R61-T290 VanDerWaalsContact NH1-O 3.11Å
62	F	66.4	Low	71.2	Confident	24 Å²	24	62.5 Å²	62.5	11%	0.105	32%	0.322	C	S	.	.			trans	-105.9	102.8	164.2	-57.5	-51.5	0	0	0	110.7	V60 V66 L74 H78 I79 T115 L118 A119	V60-F62 HydrophobicContact CG1-CD2 4.03Å; V60-F62 HydrophobicContact CG1-CE1 4.02Å; V60-F62 HydrophobicContact CG1-CE2 3.3Å; V60-F62 HydrophobicContact CG1-CZ 3.31Å; F62-V66 HydrophobicContact CD1-CG1 4.16Å; F62-L74 HydrophobicContact CD1-CD1 3.9Å; F62-L74 HydrophobicContact CE1-CD1 3.59Å; F62-L74 HydrophobicContact CZ-CD1 4.13Å; F62-H78 HydrophobicContact CE1-CB 4.45Å; F62-I79 HydrophobicContact CE1-CG1 4.43Å; F62-I79 HydrophobicContact CZ-CG1 4.31Å; F62-T115 HydrophobicContact CD2-CG2 3.29Å; F62-T115 HydrophobicContact CE2-CG2 3.41Å; F62-T115 VanDerWaalsContact CE2-CG2 3.41Å; F62-T115 WeakPolarHBondContact CE2-O 3.43Å; F62-T115 HydrophobicContact CG-CG2 4.48Å; F62-L118 HydrophobicContact CD2-CB 4.22Å; F62-L118 HydrophobicContact CD2-CD1 4.26Å; F62-L118 HydrophobicContact CE2-CB 3.81Å; F62-L118 HydrophobicContact CZ-CB 4.06Å; F62-A119 HydrophobicContact CE2-CB 4.09Å; F62-A119 HydrophobicContact CZ-CB 3.96Å
63	S	56.5	Low	69.9	Low	27 Å²	27	63.4 Å²	63.4	19%	0.189	33%	0.334	C	S	.	.			trans	-66.3	152.6	163.4	67	0	0	0	0	109.7	I65 V66 R67	S63-I65 PolarHBondContact O-N 3.06Å; S63-I65 WeakPolarHBondContact OG-CG2 3.25Å; S63-V66 PolarHBondContact O-N 2.92Å; S63-V66 VanDerWaalsContact OG-CG2 3.28Å; S63-V66 WeakPolarHBondContact OG-CG2 3.41Å; S63-V66 PolarHBondContact OG-N 2.8Å; S63-R67 PolarHBondContact O-N 3.22Å
64	T	53.8	Low	68.7	Low	83 Å²	83	62.6 Å²	62.6	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-55.4	-26.3	174.7	50.9	0	0	0	0	112.2	R68	T64-R68 WeakPolarHBondContact O-CB 3.25Å; T64-R68 VanDerWaalsContact O-CG 3.26Å; T64-R68 WeakPolarHBondContact O-CG 3.15Å; T64-R68 PolarHBondContact O-N 3.38Å
65	I	50.9	Low	67.7	Low	36 Å²	36	63.9 Å²	63.9	19%	0.185	35%	0.345	C	S	.	.	H	α-helix	trans	-74	-42.6	175.7	-129.1	158.2	0	0	0	112.6	S63 R67 R68 R69 L327	S63-I65 PolarHBondContact O-N 3.06Å; S63-I65 WeakPolarHBondContact OG-CG2 3.25Å; I65-R67 VanDerWaalsContact C-N 3.27Å; I65-R67 PolarHBondContact O-N 3.25Å; I65-R68 PolarHBondContact O-N 3.34Å; I65-R69 WeakPolarHBondContact O-CB 3.22Å; I65-R69 VanDerWaalsContact O-CG 3.29Å; I65-R69 WeakPolarHBondContact O-CG 3.47Å; I65-R69 PolarHBondContact O-N 3.05Å; I65-L327 WeakPolarHBondContact CD1-O 3.39Å
66	V	57.1	Low	67.1	Low	25 Å²	25	62.2 Å²	62.2	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-41.3	175.3	168.2	0	0	0	0	109.2	F62 S63 R68 R69 A70 L74 H78	F62-V66 HydrophobicContact CD1-CG1 4.16Å; S63-V66 PolarHBondContact O-N 2.92Å; S63-V66 VanDerWaalsContact OG-CG2 3.28Å; S63-V66 WeakPolarHBondContact OG-CG2 3.41Å; S63-V66 PolarHBondContact OG-N 2.8Å; V66-R68 PolarHBondContact O-N 3.26Å; V66-R69 PolarHBondContact O-N 3.02Å; V66-A70 WeakPolarHBondContact O-CB 3.35Å; V66-A70 PolarHBondContact O-N 3.16Å; V66-L74 HydrophobicContact CG1-CD2 3.32Å; V66-H78 HydrophobicContact CG1-CB 4.2Å
67	R	62.2	Low	66.5	Low	104 Å²	104	63.1 Å²	63.1	39%	0.392	32%	0.315	S	S	.	.	H	α-helix	trans	-62	-42.3	174.5	-166.7	178.6	-64.4	179	1.5	113	S63 I65 D113 L118	S63-R67 PolarHBondContact O-N 3.22Å; I65-R67 VanDerWaalsContact C-N 3.27Å; I65-R67 PolarHBondContact O-N 3.25Å; R67-D113 VanDerWaalsContact CZ-O 3.27Å; R67-D113 PolarHBondContact NH1-O 3.36Å; R67-L118 HydrophobicContact CG-CD1 3.97Å
68	R	58.6	Low	65.6	Low	206 Å²	206	66 Å²	66	78%	0.777	33%	0.328	S	S	*	.	H	α-helix	trans	-71.1	-31.2	178.7	-76.7	174.5	-179.4	-175.9	0.7	113.3	T64 I65 V66	T64-R68 WeakPolarHBondContact O-CB 3.25Å; T64-R68 VanDerWaalsContact O-CG 3.26Å; T64-R68 WeakPolarHBondContact O-CG 3.15Å; T64-R68 PolarHBondContact O-N 3.38Å; I65-R68 PolarHBondContact O-N 3.34Å; V66-R68 PolarHBondContact O-N 3.26Å
69	R	55.5	Low	65.1	Low	120 Å²	120	64 Å²	64	45%	0.453	32%	0.316	S	S	.	.	H	α-helix	trans	-85.9	-23	-177.4	-71.3	176.1	-174.9	-162.6	-1.7	114	I65 V66 R71 S330 T331	I65-R69 WeakPolarHBondContact O-CB 3.22Å; I65-R69 VanDerWaalsContact O-CG 3.29Å; I65-R69 WeakPolarHBondContact O-CG 3.47Å; I65-R69 PolarHBondContact O-N 3.05Å; V66-R69 PolarHBondContact O-N 3.02Å; R69-R71 PolarHBondContact O-N 3.02Å; R69-S330 PolarHBondContact NH1-O 2.76Å; R69-S330 PolarHBondContact NH2-O 3.06Å; R69-T331 PolarHBondContact NH2-OG1 2.63Å
70	A	59.2	Low	64.8	Low	21 Å²	21	63.3 Å²	63.3	17%	0.174	31%	0.312	C	S	.	.			trans	-56.3	-25.3	-176.9	0	0	0	0	0	114.5	V66 G72 G73 L74	V66-A70 WeakPolarHBondContact O-CB 3.35Å; V66-A70 PolarHBondContact O-N 3.16Å; A70-G72 CarbonylContact O-C 3.31Å; A70-G72 PolarHBondContact O-N 2.72Å; A70-G73 PolarHBondContact O-N 3.38Å; A70-L74 HydrophobicContact CB-CD2 3.58Å; A70-L74 HydrophobicContact CB-CG 3.72Å
71	R	51.2	Low	63.9	Low	243 Å²	243	66.7 Å²	66.7	92%	0.917	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	30.6	42	176.6	-70.3	-168.1	177.3	-170.6	1	114.9	R69	R69-R71 PolarHBondContact O-N 3.02Å
72	G	52.4	Low	64.3	Low	60 Å²	60	65.1 Å²	65.1	62%	0.619	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.6	7	-179.3	0	0	0	0	0	117.9	A70 R125	A70-G72 CarbonylContact O-C 3.31Å; A70-G72 PolarHBondContact O-N 2.72Å; G72-R125 PolarHBondContact O-NH1 3.48Å; G72-R125 PolarHBondContact O-NH2 3.37Å
73	G	57.8	Low	65	Low	38 Å²	38	69.9 Å²	69.9	39%	0.392	36%	0.356	S	S	.	.			trans	-174	144.3	169.2	0	0	0	0	0	114.5	A70	A70-G73 PolarHBondContact O-N 3.38Å
74	L	68.5	Low	66.2	Low	21 Å²	21	73.9 Å²	73.9	11%	0.11	38%	0.375	C	S	.	.			trans	-114.3	139.4	175.3	-73.1	161.9	0	0	0	109.6	F62 V66 A70 L118 A122	F62-L74 HydrophobicContact CD1-CD1 3.9Å; F62-L74 HydrophobicContact CE1-CD1 3.59Å; F62-L74 HydrophobicContact CZ-CD1 4.13Å; V66-L74 HydrophobicContact CG1-CD2 3.32Å; A70-L74 HydrophobicContact CB-CD2 3.58Å; A70-L74 HydrophobicContact CB-CG 3.72Å; L74-L118 HydrophobicContact CD1-CB 3.74Å; L74-L118 HydrophobicContact CD1-CD1 4.25Å; L74-L118 HydrophobicContact CD1-CD2 4Å; L74-L118 HydrophobicContact CD1-CG 4.21Å; L74-A122 HydrophobicContact CB-CB 3.97Å; L74-A122 WeakPolarHBondContact O-CB 3.26Å
75	G	72.3	Confident	67.6	Low	27 Å²	27	71 Å²	71	28%	0.278	36%	0.357	S	S	.	.			trans	-77.6	157.7	172.2	0	0	0	0	0	112.4	E77 H78	G75-E77 VanDerWaalsContact CA-OE2 3.22Å; G75-E77 WeakPolarHBondContact CA-OE2 3.37Å; G75-E77 PolarHBondContact O-N 2.86Å; G75-H78 PolarHBondContact O-N 2.91Å; G75-H78 VanDerWaalsContact O-N 3.17Å
76	L	78.2	Confident	69.4	Low	19 Å²	19	71.4 Å²	71.4	10%	0.099	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-61.2	-27.8	-179.9	-75.6	178.6	0	0	0	112.9	H78 I79 V80 R86 L89 L90 L123 S126	L76-H78 PolarHBondContact O-N 3.36Å; L76-H78 VanDerWaalsContact O-N 3.16Å; L76-I79 HydrophobicContact CD2-CD1 3.91Å; L76-I79 PolarHBondContact O-N 3.38Å; L76-V80 PolarHBondContact O-N 2.83Å; L76-R86 HydrophobicContact CB-CG 4.49Å; L76-L89 HydrophobicContact CD1-CD2 4.37Å; L76-L89 HydrophobicContact CD2-CD2 4.22Å; L76-L90 HydrophobicContact CD1-CD2 3.67Å; L76-L90 HydrophobicContact CD1-CG 4.36Å; L76-L123 HydrophobicContact CD2-CD2 3.69Å; L76-L123 HydrophobicContact CD2-CG 4.39Å; L76-S126 WeakPolarHBondContact CD1-OG 3.33Å
77	E	73.7	Confident	70.7	Confident	93 Å²	93	74 Å²	74	44%	0.435	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-59.6	-22.4	176.5	68.3	-80.5	-172.9	0	0	113.7	G75 P81	G75-E77 VanDerWaalsContact CA-OE2 3.22Å; G75-E77 WeakPolarHBondContact CA-OE2 3.37Å; G75-E77 PolarHBondContact O-N 2.86Å; E77-P81 WeakPolarHBondContact O-CA 3.4Å
78	H	72.9	Confident	71.8	Confident	72 Å²	72	72.8 Å²	72.8	33%	0.333	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-91	-18.7	176.5	-61.7	-41	0	0	0	113.3	F62 V66 G75 L76	F62-H78 HydrophobicContact CE1-CB 4.45Å; V66-H78 HydrophobicContact CG1-CB 4.2Å; G75-H78 PolarHBondContact O-N 2.91Å; G75-H78 VanDerWaalsContact O-N 3.17Å; L76-H78 PolarHBondContact O-N 3.36Å; L76-H78 VanDerWaalsContact O-N 3.16Å
79	I	77.6	Confident	73	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-46.5	177.6	-50.8	171	0	0	0	109.7	L41 V60 F62 L76 P81 A119 A122 L123	L41-I79 HydrophobicContact CD1-CG2 3.6Å; V60-I79 HydrophobicContact CG1-CG2 4.19Å; V60-I79 HydrophobicContact CG2-CG2 4.18Å; F62-I79 HydrophobicContact CE1-CG1 4.43Å; F62-I79 HydrophobicContact CZ-CG1 4.31Å; L76-I79 HydrophobicContact CD2-CD1 3.91Å; L76-I79 PolarHBondContact O-N 3.38Å; I79-P81 WeakPolarHBondContact O-CD 3.39Å; I79-A119 HydrophobicContact CG2-CB 4.29Å; I79-A122 HydrophobicContact CD1-CB 3.32Å; I79-A122 HydrophobicContact CG1-CB 4.19Å; I79-L123 HydrophobicContact CD1-CD2 4.46Å; I79-L123 HydrophobicContact CD1-CG 3.96Å
80	V	80.3	Confident	74.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.			trans	-120.9	86.7	-178.5	-171.7	0	0	0	0	107.4	L39 L41 L76 N82 T85 R86 L89	L39-V80 HydrophobicContact CD2-CG2 4.18Å; L41-V80 HydrophobicContact CD1-CG2 4.49Å; L41-V80 HydrophobicContact CD2-CG2 4.21Å; L76-V80 PolarHBondContact O-N 2.83Å; V80-N82 VanDerWaalsContact C-N 3.3Å; V80-N82 PolarHBondContact O-N 2.87Å; V80-T85 HydrophobicContact CG1-CG2 3.56Å; V80-R86 HydrophobicContact CB-CB 4.32Å; V80-R86 HydrophobicContact CG1-CB 4.1Å; V80-R86 PolarHBondContact O-NH1 3.05Å; V80-L89 HydrophobicContact CG2-CD2 4.38Å
81	P	67.5	Low	75.6	Confident	74 Å²	74	64.4 Å²	64.4	48%	0.481	35%	0.347	S	S	.	.			trans	-69.1	-30.5	-177	23.9	-31.1	0	0	0	112.3	E77 I79 E83 R86	E77-P81 WeakPolarHBondContact O-CA 3.4Å; I79-P81 WeakPolarHBondContact O-CD 3.39Å; P81-E83 PolarHBondContact O-N 2.86Å; P81-R86 PolarHBondContact O-NH1 3.24Å
82	N	78.1	Confident	77.1	Confident	75 Å²	75	55.1 Å²	55.1	40%	0.401	33%	0.327	S	S	.	.			trans	-64.5	120.8	174.4	-178	-64	0	0	0	109.8	V80 D84 T85 R86	V80-N82 VanDerWaalsContact C-N 3.3Å; V80-N82 PolarHBondContact O-N 2.87Å; N82-D84 WeakPolarHBondContact OD1-CA 3.48Å; N82-D84 WeakPolarHBondContact OD1-CB 3.46Å; N82-D84 PolarHBondContact OD1-N 2.87Å; N82-T85 PolarHBondContact OD1-N 3.28Å; N82-T85 PolarHBondContact OD1-OG1 3.32Å; N82-R86 WeakPolarHBondContact O-CB 3.47Å; N82-R86 PolarHBondContact O-N 2.93Å
83	E	80.4	Confident	78.6	Confident	123 Å²	123	56.8 Å²	56.8	58%	0.575	32%	0.319	S	S	*	.	H	α-helix	trans	-67.7	-39.7	-175.8	-176.3	166.8	-168.5	0	0	112.4	P81 R86 N87	P81-E83 PolarHBondContact O-N 2.86Å; E83-R86 PolarHBondContact O-N 3.39Å; E83-N87 WeakPolarHBondContact O-CB 3.15Å; E83-N87 PolarHBondContact O-N 3.37Å; E83-N87 PolarHBondContact O-ND2 2.98Å
84	D	82.3	Confident	79.9	Confident	112 Å²	112	55.9 Å²	55.9	60%	0.599	30%	0.303	S	S	*	.	H	α-helix	trans	-62	-50.8	176.3	-57.4	-52.9	0	0	0	110.9	N82 R86 N87 R88	N82-D84 WeakPolarHBondContact OD1-CA 3.48Å; N82-D84 WeakPolarHBondContact OD1-CB 3.46Å; N82-D84 PolarHBondContact OD1-N 2.87Å; D84-R86 VanDerWaalsContact C-N 3.27Å; D84-R86 PolarHBondContact O-N 2.96Å; D84-N87 PolarHBondContact O-N 3.17Å; D84-N87 VanDerWaalsContact O-N 3.15Å; D84-R88 WeakPolarHBondContact O-CB 3.43Å; D84-R88 WeakPolarHBondContact O-CG 3.35Å; D84-R88 PolarHBondContact O-N 3.02Å
85	T	83.8	Confident	80.7	Confident	22 Å²	22	61.7 Å²	61.7	14%	0.135	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-40	177.1	-51.4	0	0	0	0	111.2	L39 V80 N82 R88 L89 Y94	L39-T85 HydrophobicContact CD1-CG2 3.72Å; L39-T85 HydrophobicContact CD2-CG2 3.97Å; V80-T85 HydrophobicContact CG1-CG2 3.56Å; N82-T85 PolarHBondContact OD1-N 3.28Å; N82-T85 PolarHBondContact OD1-OG1 3.32Å; T85-R88 PolarHBondContact O-N 3.49Å; T85-L89 WeakPolarHBondContact O-CB 3.33Å; T85-L89 PolarHBondContact O-N 2.98Å; T85-Y94 HydrophobicContact CG2-CE2 4.01Å
86	R	86.9	Confident	81.6	Confident	45 Å²	45	60.7 Å²	60.7	17%	0.17	32%	0.319	C	S	.	.	H	α-helix	trans	-67.4	-40.5	177.2	-176.8	174.3	62.2	-118.5	2.5	111.6	L76 V80 P81 N82 E83 D84 L89 L90	L76-R86 HydrophobicContact CB-CG 4.49Å; V80-R86 HydrophobicContact CB-CB 4.32Å; V80-R86 HydrophobicContact CG1-CB 4.1Å; V80-R86 PolarHBondContact O-NH1 3.05Å; P81-R86 PolarHBondContact O-NH1 3.24Å; N82-R86 WeakPolarHBondContact O-CB 3.47Å; N82-R86 PolarHBondContact O-N 2.93Å; E83-R86 PolarHBondContact O-N 3.39Å; D84-R86 VanDerWaalsContact C-N 3.27Å; D84-R86 PolarHBondContact O-N 2.96Å; R86-L89 WeakPolarHBondContact O-CB 3.44Å; R86-L89 PolarHBondContact O-N 2.72Å; R86-L90 HydrophobicContact CG-CD1 4.14Å; R86-L90 WeakPolarHBondContact O-CB 3.23Å; R86-L90 VanDerWaalsContact O-CG 3.28Å; R86-L90 WeakPolarHBondContact O-CG 3.22Å; R86-L90 PolarHBondContact O-N 3.12Å
87	N	85.6	Confident	82.3	Confident	78 Å²	78	59.8 Å²	59.8	42%	0.417	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-41.1	176.5	-70.8	-20.7	0	0	0	111.2	E83 D84 L89 L90 S91	E83-N87 WeakPolarHBondContact O-CB 3.15Å; E83-N87 PolarHBondContact O-N 3.37Å; E83-N87 PolarHBondContact O-ND2 2.98Å; D84-N87 PolarHBondContact O-N 3.17Å; D84-N87 VanDerWaalsContact O-N 3.15Å; N87-L89 VanDerWaalsContact C-N 3.32Å; N87-L89 PolarHBondContact O-N 3.13Å; N87-L90 PolarHBondContact O-N 3.5Å; N87-S91 WeakPolarHBondContact O-CB 3.38Å; N87-S91 PolarHBondContact O-N 2.82Å; N87-S91 PolarHBondContact O-OG 3.11Å
88	R	85.4	Confident	83.3	Confident	80 Å²	80	55.4 Å²	55.4	30%	0.302	29%	0.293	S	S	.	.	H	α-helix	trans	-62.9	-37.2	173.2	-67.1	179.9	66.1	-154.9	-9.3	112.7	D84 T85 S91 G92 E93 Y94	D84-R88 WeakPolarHBondContact O-CB 3.43Å; D84-R88 WeakPolarHBondContact O-CG 3.35Å; D84-R88 PolarHBondContact O-N 3.02Å; T85-R88 PolarHBondContact O-N 3.49Å; R88-S91 VanDerWaalsContact CA-OG 3.3Å; R88-S91 WeakPolarHBondContact CA-OG 3.42Å; R88-S91 PolarHBondContact O-OG 3.36Å; R88-G92 PolarHBondContact O-N 2.78Å; R88-E93 HydrophobicContact CB-CB 4.25Å; R88-E93 WeakPolarHBondContact CG-OE2 3.29Å; R88-E93 IonicContact CZ-OE2 2.78Å; R88-E93 IonicContact NE-OE2 3.67Å; R88-E93 PolarHBondContact NE-OE2 3.49Å; R88-E93 IonicContact NH2-OE2 3.65Å; R88-E93 WeakPolarHBondContact O-CB 3.23Å; R88-E93 PolarHBondContact O-N 2.83Å; R88-Y94 HydrophobicContact CB-CD2 4.21Å; R88-Y94 HydrophobicContact CB-CE2 3.72Å; R88-Y94 PolarHBondContact NH1-OH 2.9Å
89	L	84.4	Confident	84.3	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.3	-47.8	172.3	-171.2	76.8	0	0	0	110.9	L39 L76 V80 T85 R86 N87 G92 Y94 V97 L123 I130	L39-L89 HydrophobicContact CD2-CD1 4.05Å; L76-L89 HydrophobicContact CD1-CD2 4.37Å; L76-L89 HydrophobicContact CD2-CD2 4.22Å; V80-L89 HydrophobicContact CG2-CD2 4.38Å; T85-L89 WeakPolarHBondContact O-CB 3.33Å; T85-L89 PolarHBondContact O-N 2.98Å; R86-L89 WeakPolarHBondContact O-CB 3.44Å; R86-L89 PolarHBondContact O-N 2.72Å; N87-L89 VanDerWaalsContact C-N 3.32Å; N87-L89 PolarHBondContact O-N 3.13Å; L89-G92 PolarHBondContact O-N 2.84Å; L89-Y94 HydrophobicContact CB-CD2 4.13Å; L89-Y94 HydrophobicContact CD1-CD2 4.06Å; L89-Y94 HydrophobicContact CD1-CG 4.48Å; L89-V97 HydrophobicContact CD1-CG2 3.47Å; L89-V97 VanDerWaalsContact CD1-CG2 3.47Å; L89-L123 HydrophobicContact CD2-CD2 4.08Å; L89-I130 HydrophobicContact CD1-CD1 3.37Å; L89-I130 HydrophobicContact CG-CD1 3.61Å; L89-I130 WeakPolarHBondContact O-CD1 3.3Å
90	L	83.4	Confident	85.2	Confident	95 Å²	95	52 Å²	52	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-70.9	-30.3	-179.4	-69.5	171.6	0	0	0	113.4	L76 R86 N87 G92	L76-L90 HydrophobicContact CD1-CD2 3.67Å; L76-L90 HydrophobicContact CD1-CG 4.36Å; R86-L90 HydrophobicContact CG-CD1 4.14Å; R86-L90 WeakPolarHBondContact O-CB 3.23Å; R86-L90 VanDerWaalsContact O-CG 3.28Å; R86-L90 WeakPolarHBondContact O-CG 3.22Å; R86-L90 PolarHBondContact O-N 3.12Å; N87-L90 PolarHBondContact O-N 3.5Å; L90-G92 PolarHBondContact O-N 3.44Å
91	S	84.4	Confident	85.8	Confident	75 Å²	75	53.2 Å²	53.2	52%	0.524	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-10.1	176	66.8	0	0	0	0	113.2	N87 R88 E93	N87-S91 WeakPolarHBondContact O-CB 3.38Å; N87-S91 PolarHBondContact O-N 2.82Å; N87-S91 PolarHBondContact O-OG 3.11Å; R88-S91 VanDerWaalsContact CA-OG 3.3Å; R88-S91 WeakPolarHBondContact CA-OG 3.42Å; R88-S91 PolarHBondContact O-OG 3.36Å; S91-E93 WeakPolarHBondContact OG-CG 3.43Å; S91-E93 PolarHBondContact OG-OE1 2.83Å
92	G	82.3	Confident	86.9	Confident	48 Å²	48	53.3 Å²	53.3	50%	0.495	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	17.4	-179.4	0	0	0	0	0	114.1	R88 L89 L90 Y94	R88-G92 PolarHBondContact O-N 2.78Å; L89-G92 PolarHBondContact O-N 2.84Å; L90-G92 PolarHBondContact O-N 3.44Å; G92-Y94 PolarHBondContact O-N 3.05Å
93	E	84.4	Confident	87.6	Confident	96 Å²	96	59.1 Å²	59.1	45%	0.449	30%	0.295	S	S	.	.			trans	-67	-29.3	173.7	-73.6	171	-126.9	0	0	112.3	R88 S91	R88-E93 HydrophobicContact CB-CB 4.25Å; R88-E93 WeakPolarHBondContact CG-OE2 3.29Å; R88-E93 IonicContact CZ-OE2 2.78Å; R88-E93 IonicContact NE-OE2 3.67Å; R88-E93 PolarHBondContact NE-OE2 3.49Å; R88-E93 IonicContact NH2-OE2 3.65Å; R88-E93 WeakPolarHBondContact O-CB 3.23Å; R88-E93 PolarHBondContact O-N 2.83Å; S91-E93 WeakPolarHBondContact OG-CG 3.43Å; S91-E93 PolarHBondContact OG-OE1 2.83Å
94	Y	86.1	Confident	88.1	Confident	18 Å²	18	53.6 Å²	53.6	7%	0.071	27%	0.27	C	S	.	.			trans	-90.8	116.9	169.9	-63.2	-67	0	0	0	110	G37 L39 T85 R88 L89 G92	G37-Y94 CarbonylContact O-C 3.52Å; G37-Y94 WeakPolarHBondContact O-CA 3.22Å; L39-Y94 HydrophobicContact CB-CD1 3.79Å; L39-Y94 HydrophobicContact CB-CD2 4.23Å; L39-Y94 HydrophobicContact CB-CE1 3.92Å; L39-Y94 HydrophobicContact CB-CE2 4.36Å; L39-Y94 HydrophobicContact CB-CG 3.95Å; L39-Y94 HydrophobicContact CD2-CD2 4.48Å; L39-Y94 HydrophobicContact CD2-CE2 4.42Å; T85-Y94 HydrophobicContact CG2-CE2 4.01Å; R88-Y94 HydrophobicContact CB-CD2 4.21Å; R88-Y94 HydrophobicContact CB-CE2 3.72Å; R88-Y94 PolarHBondContact NH1-OH 2.9Å; L89-Y94 HydrophobicContact CB-CD2 4.13Å; L89-Y94 HydrophobicContact CD1-CD2 4.06Å; L89-Y94 HydrophobicContact CD1-CG 4.48Å; G92-Y94 PolarHBondContact O-N 3.05Å
95	Q	85.4	Confident	88.5	Confident	144 Å²	144	50.5 Å²	50.5	67%	0.673	26%	0.255	S	S	*	.	S	Bend	trans	-77.9	-29.5	173.6	-64	174	12.5	0	0	111.3	G37 S131	G37-Q95 PolarHBondContact O-N 3.42Å; Q95-S131 PolarHBondContact O-N 3.31Å
96	S	90.1	Very high	88.7	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	146.9	-179.4	58.2	0	0	0	0	113.5	G37 C38 L39 S131	G37-S96 PolarHBondContact O-N 3.06Å; C38-S96 WeakPolarHBondContact CA-O 3.41Å; L39-S96 PolarHBondContact N-O 3.29Å; S96-S131 CarbonylContact C-O 3.53Å; S96-S131 WeakPolarHBondContact CA-O 3.49Å
97	V	92.9	Very high	88.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.2	168.4	174.4	0	0	0	0	108.4	L39 L41 L89 L99 L123 I130 S131 V132 F133	L39-V97 HydrophobicContact CB-CG2 4.17Å; L39-V97 HydrophobicContact CD2-CG2 4.4Å; L39-V97 CarbonylContact O-C 3.52Å; L39-V97 WeakPolarHBondContact O-CA 3.47Å; L41-V97 HydrophobicContact CD1-CG1 3.63Å; L41-V97 HydrophobicContact CG-CG1 4.03Å; L89-V97 HydrophobicContact CD1-CG2 3.47Å; L89-V97 VanDerWaalsContact CD1-CG2 3.47Å; V97-L99 HydrophobicContact CG1-CD1 4.16Å; V97-L99 HydrophobicContact CG1-CG 4.45Å; V97-L123 HydrophobicContact CG1-CD1 3.82Å; V97-I130 HydrophobicContact CB-CG2 4.27Å; V97-I130 HydrophobicContact CG2-CG2 3.69Å; V97-S131 PolarHBondContact N-O 3.12Å; V97-V132 CarbonylContact O-C 3.55Å; V97-V132 WeakPolarHBondContact O-CA 3.29Å; V97-F133 PolarHBondContact O-N 3.05Å
98	V	94.6	Very high	88.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.5	177.1	-176.9	0	0	0	0	108.9	I22 L27 L39 V40 L41 F133 L135	I22-V98 HydrophobicContact CG2-CG1 3.7Å; I22-V98 HydrophobicContact CG2-CG2 4.25Å; L27-V98 HydrophobicContact CD1-CB 4.13Å; L27-V98 HydrophobicContact CD1-CG1 4.16Å; L27-V98 HydrophobicContact CD1-CG2 3.97Å; L27-V98 HydrophobicContact CD2-CG1 4.31Å; L39-V98 PolarHBondContact O-N 3.3Å; V40-V98 CarbonylContact C-O 3.56Å; V40-V98 WeakPolarHBondContact CA-O 3.45Å; L41-V98 PolarHBondContact N-O 2.74Å; V98-F133 WeakPolarHBondContact CA-O 3.5Å; V98-F133 HydrophobicContact CG2-CB 4.24Å; V98-L135 HydrophobicContact CG1-CB 4.13Å
99	L	95.1	Very high	88.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	144.8	173.7	-58.1	99	0	0	0	110.4	L41 V97 L116 A119 V120 L123 V132 F133 I134 L135	L41-L99 HydrophobicContact CB-CD2 4.48Å; L41-L99 HydrophobicContact CB-CG 4.26Å; L41-L99 HydrophobicContact CD1-CD2 4.42Å; L41-L99 HydrophobicContact CD1-CG 4.49Å; L41-L99 WeakPolarHBondContact O-CA 3.43Å; V97-L99 HydrophobicContact CG1-CD1 4.16Å; V97-L99 HydrophobicContact CG1-CG 4.45Å; L99-L116 HydrophobicContact CB-CD1 3.49Å; L99-L116 VanDerWaalsContact CB-CD1 3.49Å; L99-L116 HydrophobicContact CD2-CD1 4.29Å; L99-A119 HydrophobicContact CD2-CB 3.35Å; L99-V120 HydrophobicContact CD1-CG2 4.09Å; L99-V120 HydrophobicContact CD2-CG2 4.18Å; L99-L123 HydrophobicContact CD1-CD1 3.84Å; L99-L123 HydrophobicContact CD2-CD1 3.94Å; L99-L123 HydrophobicContact CG-CD1 4.25Å; L99-V132 HydrophobicContact CD1-CG1 3.35Å; L99-F133 PolarHBondContact N-O 3.36Å; L99-I134 CarbonylContact O-C 3.5Å; L99-I134 WeakPolarHBondContact O-CA 3.46Å; L99-L135 PolarHBondContact O-N 2.74Å
100	L	95.2	Very high	88.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150.1	176.1	68.3	91.1	0	0	0	111	V40 L41 D42 C43 I54 L135 F139	V40-L100 HydrophobicContact CG1-CD2 3.73Å; L41-L100 PolarHBondContact O-N 3.45Å; D42-L100 HydrophobicContact CB-CD1 4.08Å; D42-L100 HydrophobicContact CB-CG 4.35Å; D42-L100 VanDerWaalsContact CG-CD1 3.47Å; C43-L100 WeakPolarHBondContact CA-O 3.24Å; C43-L100 VanDerWaalsContact CB-O 3.25Å; C43-L100 WeakPolarHBondContact CB-O 3.16Å; C43-L100 PolarHBondContact N-O 2.61Å; I54-L100 HydrophobicContact CD1-CD2 3.5Å; I54-L100 HydrophobicContact CG1-CD2 4.24Å; L100-L135 HydrophobicContact CB-CB 3.74Å; L100-L135 HydrophobicContact CB-CD2 3.85Å; L100-L135 HydrophobicContact CB-CG 4.43Å; L100-L135 HydrophobicContact CD2-CD2 3.91Å; L100-L135 HydrophobicContact CG-CD2 4.49Å; L100-F139 HydrophobicContact CD1-CB 3.9Å
101	D	93.1	Very high	88.5	Confident	27 Å²	27	57.1 Å²	57.1	14%	0.144	31%	0.305	C	S	.	.			trans	-119.9	-156.8	165.2	75.2	-2	0	0	0	109.9	R44 R103 S104 L116 G138 F139	R44-D101 VanDerWaalsContact CG-C 3.42Å; D101-R103 PolarHBondContact OD1-N 3Å; D101-S104 VanDerWaalsContact CG-OG 3.31Å; D101-S104 VanDerWaalsContact OD1-CB 3.24Å; D101-S104 WeakPolarHBondContact OD1-CB 3.33Å; D101-S104 PolarHBondContact OD1-N 3.11Å; D101-S104 PolarHBondContact OD1-OG 3.42Å; D101-S104 VanDerWaalsContact OD2-CB 3.26Å; D101-S104 WeakPolarHBondContact OD2-CB 3.28Å; D101-S104 PolarHBondContact OD2-OG 3.35Å; D101-L116 HydrophobicContact CB-CB 4.44Å; D101-L116 HydrophobicContact CB-CD2 4.04Å; D101-G138 CarbonylContact O-C 3.43Å; D101-G138 WeakPolarHBondContact O-CA 3.3Å; D101-F139 PolarHBondContact O-N 3.21Å
102	E	90.8	Very high	88.1	Confident	75 Å²	75	62.3 Å²	62.3	35%	0.35	32%	0.318	S	S	.	.	S	Bend	trans	-69.7	-43.7	-178.3	-154.4	75.3	-111.5	0	0	112.6	R44 S48 F139 D140	R44-E102 VanDerWaalsContact CD-CD 3.43Å; R44-E102 VanDerWaalsContact CD-OE1 3.3Å; R44-E102 WeakPolarHBondContact CD-OE1 3.24Å; R44-E102 WeakPolarHBondContact CD-OE2 3.28Å; R44-E102 HydrophobicContact CG-CB 4.39Å; R44-E102 IonicContact CZ-OE1 3.89Å; R44-E102 IonicContact NH1-OE1 2.98Å; R44-E102 PolarHBondContact NH1-OE1 3.28Å; S48-E102 PolarHBondContact OG-OE2 2.94Å; E102-F139 PolarHBondContact O-N 3.43Å; E102-D140 VanDerWaalsContact O-CB 3.29Å; E102-D140 WeakPolarHBondContact O-CB 3.37Å; E102-D140 PolarHBondContact O-N 3.49Å; E102-D140 VanDerWaalsContact O-N 3.09Å
103	R	93.1	Very high	87.7	Confident	197 Å²	197	66 Å²	66	74%	0.743	33%	0.327	S	S	*	.	S	Bend	trans	-157	1.7	-163.7	64.6	-178	178.7	175.5	0.4	116.2	D101 T105	D101-R103 PolarHBondContact OD1-N 3Å; R103-T105 PolarHBondContact O-N 3.42Å
104	S	91.4	Very high	87.4	Confident	8 Å²	8	62 Å²	62	6%	0.056	31%	0.311	C	S	.	.			trans	-67.6	134.2	-176.9	-65.4	0	0	0	0	110	D101 G137 G138	D101-S104 VanDerWaalsContact CG-OG 3.31Å; D101-S104 VanDerWaalsContact OD1-CB 3.24Å; D101-S104 WeakPolarHBondContact OD1-CB 3.33Å; D101-S104 PolarHBondContact OD1-N 3.11Å; D101-S104 PolarHBondContact OD1-OG 3.42Å; D101-S104 VanDerWaalsContact OD2-CB 3.26Å; D101-S104 WeakPolarHBondContact OD2-CB 3.28Å; D101-S104 PolarHBondContact OD2-OG 3.35Å; S104-G137 PolarHBondContact O-N 2.85Å; S104-G138 PolarHBondContact O-N 2.8Å
105	T	89.5	Confident	87.4	Confident	47 Å²	47	62.4 Å²	62.4	29%	0.288	32%	0.316	S	S	.	.	S	Bend	trans	-88.3	-22.8	177.2	51.1	0	0	0	0	112.7	T21 R103 Q109 Q136	T21-T105 WeakPolarHBondContact CG2-O 3.43Å; R103-T105 PolarHBondContact O-N 3.42Å; T105-Q109 PolarHBondContact OG1-NE2 3.19Å; T105-Q109 PolarHBondContact OG1-OE1 2.94Å; T105-Q136 HydrophobicContact CG2-CG 4.47Å
106	D	88.8	Confident	87.6	Confident	60 Å²	60	55.9 Å²	55.9	32%	0.321	29%	0.285	S	S	.	.	S	Bend	trans	-152.3	175.3	178.6	60.5	51.1	0	0	0	110.7	T21 G108 Q109	T21-D106 HydrophobicContact CG2-CB 4.11Å; D106-G108 VanDerWaalsContact C-N 3.26Å; D106-G108 PolarHBondContact O-N 3.35Å; D106-G108 WeakPolarHBondContact OD1-CA 3.25Å; D106-G108 PolarHBondContact OD1-N 2.79Å; D106-Q109 PolarHBondContact OD1-N 3.05Å
107	L	86.1	Confident	87.4	Confident	26 Å²	26	57 Å²	57	14%	0.136	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.6	177.2	-164.4	59.7	0	0	0	113.1	V19 A110 M117 V120 I134	V19-L107 HydrophobicContact CB-CD2 4.23Å; V19-L107 HydrophobicContact CG2-CD2 4.07Å; L107-A110 HydrophobicContact CD1-CB 4.49Å; L107-A110 WeakPolarHBondContact O-CB 3.46Å; L107-A110 PolarHBondContact O-N 2.86Å; L107-M117 HydrophobicContact CD1-CE 4.28Å; L107-M117 HydrophobicContact CD1-SD 3.22Å; L107-M117 WeakPolarHBondContact CD1-SD 3.4Å; L107-M117 HydrophobicContact CD2-SD 4.37Å; L107-M117 HydrophobicContact CG-CE 4.27Å; L107-M117 HydrophobicContact CG-SD 3.58Å; L107-M117 VanDerWaalsContact CG-SD 3.58Å; L107-V120 HydrophobicContact CD1-CB 4.34Å; L107-V120 HydrophobicContact CD1-CG1 4.25Å; L107-V120 HydrophobicContact CD1-CG2 3.99Å; L107-V120 HydrophobicContact CD2-CG1 4.08Å; L107-I134 HydrophobicContact CB-CD1 3.42Å; L107-I134 VanDerWaalsContact CB-CD1 3.42Å; L107-I134 HydrophobicContact CD1-CD1 3.54Å; L107-I134 HydrophobicContact CD2-CD1 4.43Å; L107-I134 HydrophobicContact CG-CD1 3.94Å
108	G	84.7	Confident	87	Confident	71 Å²	71	58.6 Å²	58.6	73%	0.732	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-29.6	-178.7	0	0	0	0	0	113.4	D106 A110	D106-G108 VanDerWaalsContact C-N 3.26Å; D106-G108 PolarHBondContact O-N 3.35Å; D106-G108 WeakPolarHBondContact OD1-CA 3.25Å; D106-G108 PolarHBondContact OD1-N 2.79Å; G108-A110 VanDerWaalsContact C-N 3.34Å
109	Q	85.4	Confident	86.7	Confident	116 Å²	116	58.6 Å²	58.6	54%	0.542	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-14.9	174.1	-66.6	-177.1	14.9	0	0	113.4	T105 D106	T105-Q109 PolarHBondContact OG1-NE2 3.19Å; T105-Q109 PolarHBondContact OG1-OE1 2.94Å; D106-Q109 PolarHBondContact OD1-N 3.05Å
110	A	84	Confident	86.4	Confident	8 Å²	8	58.7 Å²	58.7	7%	0.066	30%	0.299	C	S	.	.	S	Bend	trans	-66.6	142.4	178.2	0	0	0	0	0	111.1	L107 G108 K112 L116 M117	L107-A110 HydrophobicContact CD1-CB 4.49Å; L107-A110 WeakPolarHBondContact O-CB 3.46Å; L107-A110 PolarHBondContact O-N 2.86Å; G108-A110 VanDerWaalsContact C-N 3.34Å; A110-K112 PolarHBondContact O-N 3.15Å; A110-L116 HydrophobicContact CB-CD2 3.83Å; A110-L116 HydrophobicContact CB-CG 4.4Å; A110-M117 HydrophobicContact CB-CG 3.93Å; A110-M117 HydrophobicContact CB-SD 3.94Å
111	K	81.4	Confident	85.9	Confident	177 Å²	177	61.3 Å²	61.3	77%	0.77	31%	0.313	S	S	*	.			trans	-60.4	126.6	173.1	-69.1	-178.8	-179.7	177.9	0	109.2	D113 G114 M117	K111-D113 PolarHBondContact O-N 3.36Å; K111-D113 VanDerWaalsContact O-N 3.14Å; K111-G114 WeakPolarHBondContact O-CA 3.26Å; K111-G114 PolarHBondContact O-N 2.83Å; K111-M117 WeakPolarHBondContact O-CG 3.39Å
112	K	76.4	Confident	85.5	Confident	184 Å²	184	60.3 Å²	60.3	80%	0.8	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-39.4	-178.6	-69.1	-172.6	178.1	-177.8	0	113.9	A110 M117	A110-K112 PolarHBondContact O-N 3.15Å; K112-M117 WeakPolarHBondContact O-CB 3.19Å
113	D	73.9	Confident	85.2	Confident	127 Å²	127	57 Å²	57	68%	0.679	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	15.3	176.8	-57.4	-42.7	0	0	0	113.5	R67 K111	R67-D113 VanDerWaalsContact CZ-O 3.27Å; R67-D113 PolarHBondContact NH1-O 3.36Å; K111-D113 PolarHBondContact O-N 3.36Å; K111-D113 VanDerWaalsContact O-N 3.14Å
114	G	77.6	Confident	84.7	Confident	12 Å²	12	49.1 Å²	49.1	12%	0.124	27%	0.268	C	S	.	.	S	Bend	trans	-76.4	159.5	-178.8	0	0	0	0	0	112.8	K111 L116 M117 L118	K111-G114 WeakPolarHBondContact O-CA 3.26Å; K111-G114 PolarHBondContact O-N 2.83Å; G114-L116 VanDerWaalsContact C-N 3.27Å; G114-L116 PolarHBondContact O-N 3.35Å; G114-M117 PolarHBondContact O-N 2.89Å; G114-L118 WeakPolarHBondContact O-CG 3.2Å; G114-L118 PolarHBondContact O-N 3.07Å; G114-L118 VanDerWaalsContact O-N 3.12Å
115	T	85.3	Confident	84.1	Confident	26 Å²	26	55.9 Å²	55.9	16%	0.16	29%	0.292	C	S	.	.	H	α-helix	trans	-53	-45.7	176	-58	0	0	0	0	111.3	C43 V60 F62 M117 L118 A119	C43-T115 HydrophobicContact CB-CG2 3.63Å; C43-T115 WeakPolarHBondContact O-CB 3.4Å; C43-T115 WeakPolarHBondContact O-CG2 3.37Å; V60-T115 HydrophobicContact CB-CG2 4.04Å; V60-T115 HydrophobicContact CG1-CG2 3.96Å; F62-T115 HydrophobicContact CD2-CG2 3.29Å; F62-T115 HydrophobicContact CE2-CG2 3.41Å; F62-T115 VanDerWaalsContact CE2-CG2 3.41Å; F62-T115 WeakPolarHBondContact CE2-O 3.43Å; F62-T115 HydrophobicContact CG-CG2 4.48Å; T115-M117 PolarHBondContact O-N 3Å; T115-L118 PolarHBondContact O-N 2.77Å; T115-A119 WeakPolarHBondContact O-CB 3.05Å; T115-A119 PolarHBondContact O-N 3.22Å
116	L	89.4	Confident	83.3	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-56.1	-51.5	179.2	-177.8	60.6	0	0	0	112.7	C43 L99 D101 A110 G114 L118 A119 V120 I134	C43-L116 HydrophobicContact CB-CB 4.05Å; C43-L116 HydrophobicContact CB-CD1 4.32Å; L99-L116 HydrophobicContact CB-CD1 3.49Å; L99-L116 VanDerWaalsContact CB-CD1 3.49Å; L99-L116 HydrophobicContact CD2-CD1 4.29Å; D101-L116 HydrophobicContact CB-CB 4.44Å; D101-L116 HydrophobicContact CB-CD2 4.04Å; A110-L116 HydrophobicContact CB-CD2 3.83Å; A110-L116 HydrophobicContact CB-CG 4.4Å; G114-L116 VanDerWaalsContact C-N 3.27Å; G114-L116 PolarHBondContact O-N 3.35Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 3.45Å; L116-A119 PolarHBondContact O-N 3.21Å; L116-V120 HydrophobicContact CD1-CG2 4.41Å; L116-V120 WeakPolarHBondContact O-CB 3.41Å; L116-V120 WeakPolarHBondContact O-CG2 3.33Å; L116-V120 PolarHBondContact O-N 2.85Å; L116-I134 HydrophobicContact CD2-CG2 4.34Å
117	M	87.1	Confident	82.1	Confident	31 Å²	31	58.3 Å²	58.3	15%	0.153	31%	0.312	C	S	.	.	H	α-helix	trans	-60.5	-40.7	178.6	-72.9	-61.4	-56.6	0	0	112.6	L107 A110 K111 K112 G114 T115 N121	L107-M117 HydrophobicContact CD1-CE 4.28Å; L107-M117 HydrophobicContact CD1-SD 3.22Å; L107-M117 WeakPolarHBondContact CD1-SD 3.4Å; L107-M117 HydrophobicContact CD2-SD 4.37Å; L107-M117 HydrophobicContact CG-CE 4.27Å; L107-M117 HydrophobicContact CG-SD 3.58Å; L107-M117 VanDerWaalsContact CG-SD 3.58Å; A110-M117 HydrophobicContact CB-CG 3.93Å; A110-M117 HydrophobicContact CB-SD 3.94Å; K111-M117 WeakPolarHBondContact O-CG 3.39Å; K112-M117 WeakPolarHBondContact O-CB 3.19Å; G114-M117 PolarHBondContact O-N 2.89Å; T115-M117 PolarHBondContact O-N 3Å; M117-N121 WeakPolarHBondContact O-CB 3.28Å; M117-N121 PolarHBondContact O-N 2.79Å; M117-N121 PolarHBondContact O-ND2 3.1Å
118	L	84.4	Confident	81.1	Confident	32 Å²	32	58.3 Å²	58.3	17%	0.168	32%	0.315	C	S	.	.	H	α-helix	trans	-66.5	-43.3	179.7	-72.8	174.2	0	0	0	112	F62 R67 L74 G114 T115 L116 N121 A122	F62-L118 HydrophobicContact CD2-CB 4.22Å; F62-L118 HydrophobicContact CD2-CD1 4.26Å; F62-L118 HydrophobicContact CE2-CB 3.81Å; F62-L118 HydrophobicContact CZ-CB 4.06Å; R67-L118 HydrophobicContact CG-CD1 3.97Å; L74-L118 HydrophobicContact CD1-CB 3.74Å; L74-L118 HydrophobicContact CD1-CD1 4.25Å; L74-L118 HydrophobicContact CD1-CD2 4Å; L74-L118 HydrophobicContact CD1-CG 4.21Å; G114-L118 WeakPolarHBondContact O-CG 3.2Å; G114-L118 PolarHBondContact O-N 3.07Å; G114-L118 VanDerWaalsContact O-N 3.12Å; T115-L118 PolarHBondContact O-N 2.77Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 3.45Å; L118-N121 PolarHBondContact O-N 3.07Å; L118-A122 WeakPolarHBondContact O-CB 3.38Å; L118-A122 PolarHBondContact O-N 3.3Å; L118-A122 VanDerWaalsContact O-N 3.13Å
119	A	87.9	Confident	80.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.6	-45	177.4	0	0	0	0	0	111.5	V60 F62 I79 L99 T115 L116 N121 A122 L123	V60-A119 HydrophobicContact CG1-CB 4.2Å; F62-A119 HydrophobicContact CE2-CB 4.09Å; F62-A119 HydrophobicContact CZ-CB 3.96Å; I79-A119 HydrophobicContact CG2-CB 4.29Å; L99-A119 HydrophobicContact CD2-CB 3.35Å; T115-A119 WeakPolarHBondContact O-CB 3.05Å; T115-A119 PolarHBondContact O-N 3.22Å; L116-A119 PolarHBondContact O-N 3.21Å; A119-N121 PolarHBondContact O-N 3.28Å; A119-A122 PolarHBondContact O-N 3.39Å; A119-L123 WeakPolarHBondContact O-CG 3.49Å; A119-L123 PolarHBondContact O-N 3.47Å
120	V	88.9	Confident	80.4	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.018	30%	0.304	C	S	.	.	H	α-helix	trans	-56.2	-52.3	174.2	164.4	0	0	0	0	111.1	V19 L99 L107 L116 A122 L123 C124	V19-V120 HydrophobicContact CG2-CG1 3.61Å; L99-V120 HydrophobicContact CD1-CG2 4.09Å; L99-V120 HydrophobicContact CD2-CG2 4.18Å; L107-V120 HydrophobicContact CD1-CB 4.34Å; L107-V120 HydrophobicContact CD1-CG1 4.25Å; L107-V120 HydrophobicContact CD1-CG2 3.99Å; L107-V120 HydrophobicContact CD2-CG1 4.08Å; L116-V120 HydrophobicContact CD1-CG2 4.41Å; L116-V120 WeakPolarHBondContact O-CB 3.41Å; L116-V120 WeakPolarHBondContact O-CG2 3.33Å; L116-V120 PolarHBondContact O-N 2.85Å; V120-A122 PolarHBondContact O-N 3.48Å; V120-L123 PolarHBondContact O-N 2.85Å; V120-C124 WeakPolarHBondContact O-CB 3.25Å; V120-C124 PolarHBondContact O-N 2.76Å; V120-C124 PolarHBondContact O-SG 2.87Å; V120-C124 VanDerWaalsContact O-SG 3.34Å
121	N	85.3	Confident	80.6	Confident	55 Å²	55	57.4 Å²	57.4	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-59.3	-35.7	-178.7	-78.3	-35.9	0	0	0	112.9	M117 L118 A119 R125	M117-N121 WeakPolarHBondContact O-CB 3.28Å; M117-N121 PolarHBondContact O-N 2.79Å; M117-N121 PolarHBondContact O-ND2 3.1Å; L118-N121 PolarHBondContact O-N 3.07Å; A119-N121 PolarHBondContact O-N 3.28Å; N121-R125 VanDerWaalsContact O-CD 3.25Å; N121-R125 WeakPolarHBondContact O-CD 3.47Å; N121-R125 WeakPolarHBondContact O-CG 3.45Å; N121-R125 PolarHBondContact O-N 3.13Å
122	A	83.6	Confident	81.1	Confident	6 Å²	6	49.9 Å²	49.9	5%	0.05	29%	0.29	C	S	.	.	H	α-helix	trans	-78	-37	-179	0	0	0	0	0	112.5	L74 I79 L118 A119 V120 S126	L74-A122 HydrophobicContact CB-CB 3.97Å; L74-A122 WeakPolarHBondContact O-CB 3.26Å; I79-A122 HydrophobicContact CD1-CB 3.32Å; I79-A122 HydrophobicContact CG1-CB 4.19Å; L118-A122 WeakPolarHBondContact O-CB 3.38Å; L118-A122 PolarHBondContact O-N 3.3Å; L118-A122 VanDerWaalsContact O-N 3.13Å; A119-A122 PolarHBondContact O-N 3.39Å; V120-A122 PolarHBondContact O-N 3.48Å; A122-S126 PolarHBondContact O-N 3.41Å
123	L	85.7	Confident	81.9	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-66.5	-45.1	172.9	-73.6	162.7	0	0	0	112	L41 L76 I79 L89 V97 L99 A119 V120 R125 S126 V132	L41-L123 HydrophobicContact CD1-CD1 3.95Å; L76-L123 HydrophobicContact CD2-CD2 3.69Å; L76-L123 HydrophobicContact CD2-CG 4.39Å; I79-L123 HydrophobicContact CD1-CD2 4.46Å; I79-L123 HydrophobicContact CD1-CG 3.96Å; L89-L123 HydrophobicContact CD2-CD2 4.08Å; V97-L123 HydrophobicContact CG1-CD1 3.82Å; L99-L123 HydrophobicContact CD1-CD1 3.84Å; L99-L123 HydrophobicContact CD2-CD1 3.94Å; L99-L123 HydrophobicContact CG-CD1 4.25Å; A119-L123 WeakPolarHBondContact O-CG 3.49Å; A119-L123 PolarHBondContact O-N 3.47Å; V120-L123 PolarHBondContact O-N 2.85Å; L123-R125 PolarHBondContact O-N 3.4Å; L123-S126 WeakPolarHBondContact O-CB 3.49Å; L123-S126 PolarHBondContact O-N 2.87Å; L123-V132 HydrophobicContact CB-CG2 4.14Å
124	C	82.3	Confident	82.9	Confident	32 Å²	32	37.4 Å²	37.4	22%	0.216	23%	0.23	C	C	.	.	H	α-helix	trans	-67	-20.3	-179.6	-68.6	0	0	0	0	113.9	M17 V120	M17-C124 HydrophobicContact CE-CB 4.1Å; M17-C124 HydrophobicContact SD-CB 3.79Å; V120-C124 WeakPolarHBondContact O-CB 3.25Å; V120-C124 PolarHBondContact O-N 2.76Å; V120-C124 PolarHBondContact O-SG 2.87Å; V120-C124 VanDerWaalsContact O-SG 3.34Å
125	R	79.1	Confident	83.8	Confident	151 Å²	151	36.8 Å²	36.8	57%	0.57	22%	0.224	S	C	*	.	H	α-helix	trans	-86.7	-15.8	174.1	-73	171.7	-176.3	-158.5	8.6	113.4	G72 N121 L123	G72-R125 PolarHBondContact O-NH1 3.48Å; G72-R125 PolarHBondContact O-NH2 3.37Å; N121-R125 VanDerWaalsContact O-CD 3.25Å; N121-R125 WeakPolarHBondContact O-CD 3.47Å; N121-R125 WeakPolarHBondContact O-CG 3.45Å; N121-R125 PolarHBondContact O-N 3.13Å; L123-R125 PolarHBondContact O-N 3.4Å
126	S	72.1	Confident	84.3	Confident	21 Å²	21	40 Å²	40	15%	0.147	24%	0.237	C	C	.	.	S	Bend	trans	-74.1	136.2	177.8	-178.2	0	0	0	0	109.2	L76 A122 L123 C128	L76-S126 WeakPolarHBondContact CD1-OG 3.33Å; A122-S126 PolarHBondContact O-N 3.41Å; L123-S126 WeakPolarHBondContact O-CB 3.49Å; L123-S126 PolarHBondContact O-N 2.87Å; S126-C128 WeakPolarHBondContact CB-SG 3.41Å; S126-C128 PolarHBondContact O-N 3.28Å; S126-C128 PolarHBondContact OG-SG 3.33Å
127	P	64.1	Low	84.4	Confident	136 Å²	136	40 Å²	40	88%	0.883	24%	0.238	S	C	*	.	S	Bend	trans	-71.3	15.4	-178.6	30.7	-36.3	0	0	0	113.8
128	C	64.1	Low	84.8	Confident	27 Å²	27	38.5 Å²	38.5	18%	0.182	23%	0.231	C	C	.	.			trans	-81.7	122.3	179.1	56.2	0	0	0	0	109	S126 I130	S126-C128 WeakPolarHBondContact CB-SG 3.41Å; S126-C128 PolarHBondContact O-N 3.28Å; S126-C128 PolarHBondContact OG-SG 3.33Å; C128-I130 HydrophobicContact CB-CD1 3.57Å; C128-I130 HydrophobicContact CB-CG1 3.74Å; C128-I130 PolarHBondContact O-N 3.22Å; C128-I130 VanDerWaalsContact SG-CD1 3.55Å
129	G	72.1	Confident	85.3	Confident	91 Å²	91	37.5 Å²	37.5	94%	0.938	23%	0.225	S	C	*	.			trans	-69.8	41.9	180	0	0	0	0	0	114.3
130	I	83.6	Confident	85.6	Confident	23 Å²	23	42 Å²	42	12%	0.118	25%	0.249	C	C	.	.			trans	-91.4	136.7	-172	-59.3	177.3	0	0	0	109	L89 V97 C128 V132	L89-I130 HydrophobicContact CD1-CD1 3.37Å; L89-I130 HydrophobicContact CG-CD1 3.61Å; L89-I130 WeakPolarHBondContact O-CD1 3.3Å; V97-I130 HydrophobicContact CB-CG2 4.27Å; V97-I130 HydrophobicContact CG2-CG2 3.69Å; C128-I130 HydrophobicContact CB-CD1 3.57Å; C128-I130 HydrophobicContact CB-CG1 3.74Å; C128-I130 PolarHBondContact O-N 3.22Å; C128-I130 VanDerWaalsContact SG-CD1 3.55Å; I130-V132 PolarHBondContact O-N 3.48Å
131	S	88.7	Confident	85.9	Confident	62 Å²	62	43.9 Å²	43.9	43%	0.434	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	113.9	173.8	-58.7	0	0	0	0	110	Q95 S96 V97	Q95-S131 PolarHBondContact O-N 3.31Å; S96-S131 CarbonylContact C-O 3.53Å; S96-S131 WeakPolarHBondContact CA-O 3.49Å; V97-S131 PolarHBondContact N-O 3.12Å
132	V	91.6	Very high	86.4	Confident	18 Å²	18	41.2 Å²	41.2	11%	0.109	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.1	178.4	-175.5	0	0	0	0	109.2	V19 P20 V97 L99 L123 I130	V19-V132 HydrophobicContact CG1-CB 4.36Å; V19-V132 HydrophobicContact CG1-CG1 4Å; V19-V132 WeakPolarHBondContact CG1-O 3.25Å; P20-V132 WeakPolarHBondContact CD-O 3.47Å; V97-V132 CarbonylContact O-C 3.55Å; V97-V132 WeakPolarHBondContact O-CA 3.29Å; L99-V132 HydrophobicContact CD1-CG1 3.35Å; L123-V132 HydrophobicContact CB-CG2 4.14Å; I130-V132 PolarHBondContact O-N 3.48Å
133	F	93.7	Very high	86.9	Confident	49 Å²	49	42.3 Å²	42.3	22%	0.215	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	158.9	178.2	-59.4	-88.4	0	0	0	112	P20 I22 V97 V98 L99	P20-F133 HydrophobicContact CB-CD1 3.96Å; P20-F133 HydrophobicContact CB-CE1 4.08Å; P20-F133 HydrophobicContact CG-CD1 3.57Å; P20-F133 HydrophobicContact CG-CE1 3.62Å; P20-F133 HydrophobicContact CG-CG 4.48Å; P20-F133 VanDerWaalsContact O-CA 3.27Å; P20-F133 WeakPolarHBondContact O-CA 3.32Å; I22-F133 HydrophobicContact CB-CB 4.09Å; I22-F133 HydrophobicContact CB-CD1 4.32Å; I22-F133 HydrophobicContact CB-CG 4.36Å; I22-F133 HydrophobicContact CG2-CB 3.86Å; V97-F133 PolarHBondContact O-N 3.05Å; V98-F133 WeakPolarHBondContact CA-O 3.5Å; V98-F133 HydrophobicContact CG2-CB 4.24Å; L99-F133 PolarHBondContact N-O 3.36Å
134	I	94.8	Very high	87.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132	170.4	-58.9	163.3	0	0	0	109.2	V19 P20 T21 I22 L99 L107 L116 Q136	V19-I134 HydrophobicContact CB-CD1 4.12Å; V19-I134 HydrophobicContact CG1-CD1 4.02Å; V19-I134 HydrophobicContact CG1-CG1 3.9Å; P20-I134 PolarHBondContact O-N 3.31Å; T21-I134 CarbonylContact C-O 3.49Å; T21-I134 VanDerWaalsContact CA-O 3.23Å; T21-I134 WeakPolarHBondContact CA-O 3.3Å; I22-I134 PolarHBondContact N-O 2.79Å; L99-I134 CarbonylContact O-C 3.5Å; L99-I134 WeakPolarHBondContact O-CA 3.46Å; L107-I134 HydrophobicContact CB-CD1 3.42Å; L107-I134 VanDerWaalsContact CB-CD1 3.42Å; L107-I134 HydrophobicContact CD1-CD1 3.54Å; L107-I134 HydrophobicContact CD2-CD1 4.43Å; L107-I134 HydrophobicContact CG-CD1 3.94Å; L116-I134 HydrophobicContact CD2-CG2 4.34Å; I134-Q136 PolarHBondContact O-N 3.06Å
135	L	96.4	Very high	88	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	115.3	175.3	-177.1	57.9	0	0	0	110.4	I22 L27 I54 V98 L99 L100 G137 G138 F142	I22-L135 HydrophobicContact CG2-CD1 4.46Å; L27-L135 HydrophobicContact CB-CD1 4.23Å; L27-L135 HydrophobicContact CD2-CD1 3.72Å; L27-L135 HydrophobicContact CD2-CD2 3.75Å; L27-L135 HydrophobicContact CD2-CG 4.27Å; I54-L135 HydrophobicContact CD1-CD2 4.08Å; V98-L135 HydrophobicContact CG1-CB 4.13Å; L99-L135 PolarHBondContact O-N 2.74Å; L100-L135 HydrophobicContact CB-CB 3.74Å; L100-L135 HydrophobicContact CB-CD2 3.85Å; L100-L135 HydrophobicContact CB-CG 4.43Å; L100-L135 HydrophobicContact CD2-CD2 3.91Å; L100-L135 HydrophobicContact CG-CD2 4.49Å; L135-G137 PolarHBondContact O-N 3.02Å; L135-G138 PolarHBondContact O-N 3.18Å; L135-G138 VanDerWaalsContact O-N 3.15Å; L135-F142 HydrophobicContact CD1-CD2 4.3Å; L135-F142 HydrophobicContact CD2-CB 3.9Å; L135-F142 HydrophobicContact CD2-CD2 4.14Å; L135-F142 HydrophobicContact CD2-CG 4.22Å
136	Q	95.1	Very high	88.7	Confident	93 Å²	93	44.5 Å²	44.5	44%	0.435	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	121.5	178.2	-176.1	177	11.4	0	0	110.2	I22 T105 I134 G138	I22-Q136 PolarHBondContact O-N 2.74Å; T105-Q136 HydrophobicContact CG2-CG 4.47Å; I134-Q136 PolarHBondContact O-N 3.06Å; Q136-G138 VanDerWaalsContact C-N 3.29Å
137	G	92.1	Very high	89.7	Confident	5 Å²	5	47.2 Å²	47.2	5%	0.052	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	5.4	178.7	0	0	0	0	0	113.6	S104 L135 S141	S104-G137 PolarHBondContact O-N 2.85Å; L135-G137 PolarHBondContact O-N 3.02Å; G137-S141 VanDerWaalsContact CA-OG 3.29Å; G137-S141 WeakPolarHBondContact CA-OG 3.46Å; G137-S141 WeakPolarHBondContact O-CB 3.42Å; G137-S141 PolarHBondContact O-N 3.42Å; G137-S141 PolarHBondContact O-OG 2.68Å
138	G	94.6	Very high	91	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	60.5	-157.4	174	0	0	0	0	0	114.3	D101 S104 L135 Q136 D140 F142	D101-G138 CarbonylContact O-C 3.43Å; D101-G138 WeakPolarHBondContact O-CA 3.3Å; S104-G138 PolarHBondContact O-N 2.8Å; L135-G138 PolarHBondContact O-N 3.18Å; L135-G138 VanDerWaalsContact O-N 3.15Å; Q136-G138 VanDerWaalsContact C-N 3.29Å; G138-D140 VanDerWaalsContact C-N 3.34Å; G138-F142 PolarHBondContact O-N 3.42Å
139	F	95.6	Very high	92.4	Very high	12 Å²	12	46.2 Å²	46.2	5%	0.053	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-36.1	177.9	-175.3	-103.2	0	0	0	112.9	S52 H53 I54 L100 D101 E102 S141 F142 S143 C150	S52-F139 WeakPolarHBondContact OG-CZ 3.27Å; H53-F139 VanDerWaalsContact C-CE2 3.49Å; H53-F139 VanDerWaalsContact CA-CE2 3.41Å; I54-F139 HydrophobicContact CG1-CD2 4Å; I54-F139 HydrophobicContact CG1-CE2 3.98Å; L100-F139 HydrophobicContact CD1-CB 3.9Å; D101-F139 PolarHBondContact O-N 3.21Å; E102-F139 PolarHBondContact O-N 3.43Å; F139-S141 PolarHBondContact O-N 3.14Å; F139-F142 PolarHBondContact O-N 3.19Å; F139-S143 VanDerWaalsContact O-CB 3.26Å; F139-S143 WeakPolarHBondContact O-CB 3.31Å; F139-S143 PolarHBondContact O-N 3.28Å; F139-S143 PolarHBondContact O-OG 2.94Å; F139-C150 HydrophobicContact CE2-CB 4.45Å; F139-C150 HydrophobicContact CZ-CB 4.29Å
140	D	93.4	Very high	93.3	Very high	94 Å²	94	42.3 Å²	42.3	50%	0.503	23%	0.234	S	C	.	.	H	α-helix	trans	-60.4	-46.3	-176.1	-170.6	49.2	0	0	0	111.7	E102 G138 S143 S144	E102-D140 VanDerWaalsContact O-CB 3.29Å; E102-D140 WeakPolarHBondContact O-CB 3.37Å; E102-D140 PolarHBondContact O-N 3.49Å; E102-D140 VanDerWaalsContact O-N 3.09Å; G138-D140 VanDerWaalsContact C-N 3.34Å; D140-S143 PolarHBondContact O-OG 2.88Å; D140-S144 WeakPolarHBondContact O-CB 3.37Å; D140-S144 PolarHBondContact O-N 3.19Å; D140-S144 PolarHBondContact O-OG 2.94Å
141	S	95.9	Very high	93.5	Very high	42 Å²	42	43.2 Å²	43.2	29%	0.294	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-46.4	177.4	-56.6	0	0	0	0	111.5	G137 F139 S143 S144 E145	G137-S141 VanDerWaalsContact CA-OG 3.29Å; G137-S141 WeakPolarHBondContact CA-OG 3.46Å; G137-S141 WeakPolarHBondContact O-CB 3.42Å; G137-S141 PolarHBondContact O-N 3.42Å; G137-S141 PolarHBondContact O-OG 2.68Å; F139-S141 PolarHBondContact O-N 3.14Å; S141-S143 PolarHBondContact O-N 3.09Å; S141-S144 PolarHBondContact O-N 2.93Å; S141-E145 PolarHBondContact O-N 2.92Å
142	F	96.2	Very high	92.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.6	-43.9	-178.4	-171	-82.8	0	0	0	112.8	C24 L27 I54 L135 G138 F139 S144 E145 Y146 M149	C24-F142 HydrophobicContact CB-CD2 3.82Å; C24-F142 HydrophobicContact CB-CE2 4.45Å; L27-F142 HydrophobicContact CB-CE2 4.19Å; L27-F142 HydrophobicContact CD2-CD2 3.87Å; L27-F142 HydrophobicContact CD2-CE2 3.66Å; L27-F142 HydrophobicContact CD2-CZ 4.38Å; L27-F142 HydrophobicContact CG-CE2 3.9Å; I54-F142 HydrophobicContact CD1-CB 4.33Å; I54-F142 HydrophobicContact CD1-CD1 3.43Å; I54-F142 VanDerWaalsContact CD1-CD1 3.43Å; I54-F142 HydrophobicContact CD1-CD2 4.13Å; I54-F142 HydrophobicContact CD1-CE1 3.66Å; I54-F142 HydrophobicContact CD1-CE2 4.33Å; I54-F142 HydrophobicContact CD1-CG 3.69Å; I54-F142 HydrophobicContact CD1-CZ 4.11Å; I54-F142 HydrophobicContact CG1-CD1 3.63Å; I54-F142 HydrophobicContact CG1-CE1 3.79Å; I54-F142 HydrophobicContact CG1-CG 4.35Å; I54-F142 HydrophobicContact CG2-CE1 4.03Å; I54-F142 HydrophobicContact CG2-CZ 4.39Å; L135-F142 HydrophobicContact CD1-CD2 4.3Å; L135-F142 HydrophobicContact CD2-CB 3.9Å; L135-F142 HydrophobicContact CD2-CD2 4.14Å; L135-F142 HydrophobicContact CD2-CG 4.22Å; G138-F142 PolarHBondContact O-N 3.42Å; F139-F142 PolarHBondContact O-N 3.19Å; F142-S144 VanDerWaalsContact C-N 3.27Å; F142-S144 PolarHBondContact O-N 2.81Å; F142-E145 PolarHBondContact O-N 3.45Å; F142-Y146 HydrophobicContact CD2-CD2 4.15Å; F142-Y146 AromaticContact CE2-CD2 3.94Å; F142-Y146 HydrophobicContact CE2-CD2 3.94Å; F142-Y146 HydrophobicContact CZ-CD2 4.17Å; F142-Y146 PolarHBondContact O-N 2.83Å; F142-M149 HydrophobicContact CE1-CB 4.01Å; F142-M149 HydrophobicContact CZ-CB 4.36Å; F142-M149 HydrophobicContact CZ-SD 4.1Å
143	S	94.5	Very high	90.9	Very high	29 Å²	29	51.1 Å²	51.1	20%	0.203	28%	0.276	C	S	.	.	H	α-helix	trans	-68.2	-27.2	179	62.1	0	0	0	0	113	F139 D140 S141 P147	F139-S143 VanDerWaalsContact O-CB 3.26Å; F139-S143 WeakPolarHBondContact O-CB 3.31Å; F139-S143 PolarHBondContact O-N 3.28Å; F139-S143 PolarHBondContact O-OG 2.94Å; D140-S143 PolarHBondContact O-OG 2.88Å; S141-S143 PolarHBondContact O-N 3.09Å; S143-P147 WeakPolarHBondContact O-CA 2.9Å; S143-P147 WeakPolarHBondContact O-CB 2.93Å
144	S	94.1	Very high	88.2	Confident	88 Å²	88	52 Å²	52	62%	0.615	29%	0.288	S	S	*	.	H	α-helix	trans	-73.3	-39.3	172.9	-62.4	0	0	0	0	112.5	D140 S141 F142	D140-S144 WeakPolarHBondContact O-CB 3.37Å; D140-S144 PolarHBondContact O-N 3.19Å; D140-S144 PolarHBondContact O-OG 2.94Å; S141-S144 PolarHBondContact O-N 2.93Å; F142-S144 VanDerWaalsContact C-N 3.27Å; F142-S144 PolarHBondContact O-N 2.81Å
145	E	96.3	Very high	85.3	Confident	104 Å²	104	56.2 Å²	56.2	49%	0.486	32%	0.315	S	S	.	.	H	α-helix	trans	-81	-36.9	-179.5	-71.2	179.4	-122.2	0	0	113.4	C24 S141 F142 P147	C24-E145 PolarHBondContact SG-OE1 3.47Å; S141-E145 PolarHBondContact O-N 2.92Å; F142-E145 PolarHBondContact O-N 3.45Å; E145-P147 VanDerWaalsContact C-CD 3.48Å
146	Y	94.5	Very high	82.4	Confident	40 Å²	40	61.3 Å²	61.3	16%	0.157	35%	0.348	C	S	.	.			trans	-132.6	58.7	-173.2	-55.8	-65.3	0	0	0	112.5	C24 A25 F142 E148 M149	C24-Y146 HydrophobicContact CB-CD2 4Å; C24-Y146 HydrophobicContact CB-CE2 3.55Å; A25-Y146 WeakPolarHBondContact CA-OH 3.29Å; F142-Y146 HydrophobicContact CD2-CD2 4.15Å; F142-Y146 AromaticContact CE2-CD2 3.94Å; F142-Y146 HydrophobicContact CE2-CD2 3.94Å; F142-Y146 HydrophobicContact CZ-CD2 4.17Å; F142-Y146 PolarHBondContact O-N 2.83Å; Y146-E148 VanDerWaalsContact C-OE2 3.27Å; Y146-E148 WeakPolarHBondContact CA-OE2 3.26Å; Y146-E148 PolarHBondContact O-N 2.78Å; Y146-E148 VanDerWaalsContact O-N 3.12Å; Y146-M149 PolarHBondContact O-N 3.31Å
147	P	91.9	Very high	79.5	Confident	79 Å²	79	64.9 Å²	64.9	51%	0.513	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25.9	-177.3	25.3	-35.4	0	0	0	113.4	S143 E145 M149 C150	S143-P147 WeakPolarHBondContact O-CA 2.9Å; S143-P147 WeakPolarHBondContact O-CB 2.93Å; E145-P147 VanDerWaalsContact C-CD 3.48Å; P147-M149 VanDerWaalsContact C-N 3.28Å; P147-M149 PolarHBondContact O-N 2.97Å; P147-C150 PolarHBondContact O-N 3.43Å
148	E	92.4	Very high	76.8	Confident	114 Å²	114	67.4 Å²	67.4	53%	0.533	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-69.4	-22.9	177.8	74.3	-74.7	179.6	0	0	114	R28 Y146	R28-E148 IonicContact CZ-OE1 3.63Å; R28-E148 IonicContact NH1-OE1 2.72Å; R28-E148 PolarHBondContact NH1-OE1 2.69Å; R28-E148 IonicContact NH2-OE1 3.8Å; Y146-E148 VanDerWaalsContact C-OE2 3.27Å; Y146-E148 WeakPolarHBondContact CA-OE2 3.26Å; Y146-E148 PolarHBondContact O-N 2.78Å; Y146-E148 VanDerWaalsContact O-N 3.12Å
149	M	92.3	Very high	73.9	Confident	27 Å²	27	72.6 Å²	72.6	13%	0.133	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-90.3	-12	178.2	-64.7	-169.9	73.9	0	0	112.3	R28 M31 S55 F142 Y146 P147	R28-M149 HydrophobicContact CB-SD 4.09Å; R28-M149 HydrophobicContact CG-CE 4.37Å; R28-M149 HydrophobicContact CG-SD 3.71Å; M31-M149 HydrophobicContact CB-CE 4.06Å; M31-M149 HydrophobicContact CE-CE 4.31Å; M31-M149 HydrophobicContact SD-CE 4.09Å; S55-M149 VanDerWaalsContact CB-O 3.23Å; S55-M149 WeakPolarHBondContact CB-O 3.22Å; S55-M149 PolarHBondContact N-O 3.48Å; S55-M149 PolarHBondContact OG-O 2.87Å; F142-M149 HydrophobicContact CE1-CB 4.01Å; F142-M149 HydrophobicContact CZ-CB 4.36Å; F142-M149 HydrophobicContact CZ-SD 4.1Å; Y146-M149 PolarHBondContact O-N 3.31Å; P147-M149 VanDerWaalsContact C-N 3.28Å; P147-M149 PolarHBondContact O-N 2.97Å
150	C	92.3	Very high	71	Confident	9 Å²	9	77.1 Å²	77.1	6%	0.061	45%	0.452	C	S	.	.	B	Isolated β-bridge	trans	-84.1	146.1	173.6	-63	0	0	0	0	110.4	H53 F139 P147 K152	H53-C150 CarbonylContact O-C 3.56Å; H53-C150 VanDerWaalsContact O-CA 3.3Å; H53-C150 WeakPolarHBondContact O-CA 2.88Å; F139-C150 HydrophobicContact CE2-CB 4.45Å; F139-C150 HydrophobicContact CZ-CB 4.29Å; P147-C150 PolarHBondContact O-N 3.43Å; C150-K152 PolarHBondContact O-N 3.44Å; C150-K152 VanDerWaalsContact O-N 3.11Å
151	T	88.1	Confident	68.1	Low	43 Å²	43	78.1 Å²	78.1	26%	0.264	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-56.6	122.8	160.9	57.9	0	0	0	0	106.1	S52 H53 A153	S52-T151 PolarHBondContact OG-O 3.27Å; H53-T151 PolarHBondContact CE1-OG1 3.39Å; H53-T151 PolarHBondContact N-OG1 2.98Å; H53-T151 PolarHBondContact ND1-OG1 2.92Å; H53-T151 VanDerWaalsContact ND1-OG1 3.14Å; H53-T151 WeakPolarHBondContact NE2-CG2 3.42Å; H53-T151 PolarHBondContact O-N 2.96Å; H53-T151 PolarHBondContact O-OG1 3.07Å; H53-T151 VanDerWaalsContact O-OG1 3.11Å; T151-A153 PolarHBondContact O-N 3.09Å
152	K	71.7	Confident	65.2	Low	192 Å²	192	81.1 Å²	81.1	84%	0.835	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-50.9	125.1	171.5	-66.2	-179.2	-178.4	178.6	0	104.9	C150 S154	C150-K152 PolarHBondContact O-N 3.44Å; C150-K152 VanDerWaalsContact O-N 3.11Å; K152-S154 VanDerWaalsContact C-N 3.29Å; K152-S154 PolarHBondContact O-N 3.36Å
153	A	52.4	Low	62.5	Low	53 Å²	53	87.9 Å²	87.9	44%	0.438	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-48.2	116.2	155.2	0	0	0	0	0	103.4	A51 T151 P155	A51-A153 WeakPolarHBondContact O-CA 3.35Å; A51-A153 VanDerWaalsContact O-CB 3.23Å; A51-A153 WeakPolarHBondContact O-CB 3.35Å; T151-A153 PolarHBondContact O-N 3.09Å; A153-P155 WeakPolarHBondContact O-CD 3.28Å
154	S	36.9	Very low	59.7	Low	67 Å²	67	91.4 Å²	91.4	47%	0.469	54%	0.537	S	S	.	.			trans	-56.9	108.7	159.6	47.6	0	0	0	0	101.9	K152	K152-S154 VanDerWaalsContact C-N 3.29Å; K152-S154 PolarHBondContact O-N 3.36Å
155	P	33.8	Very low	56.9	Low	90 Å²	90	91.7 Å²	91.7	58%	0.584	55%	0.545	S	S	*	.			trans	-49.4	144.8	141.9	29.6	-33	0	0	0	103.3	A153 Q157	A153-P155 WeakPolarHBondContact O-CD 3.28Å; P155-Q157 PolarHBondContact O-N 3.47Å
156	P	35.5	Very low	53.9	Low	106 Å²	106	98 Å²	98	69%	0.688	56%	0.564	S	S	*	*			trans	-44	121.8	158.4	22.1	-30.5	0	0	0	104.4	G158	P156-G158 PolarHBondContact O-N 2.73Å
157	Q	34.7	Very low	50.9	Low	168 Å²	168	102.6 Å²	102.6	79%	0.785	59%	0.591	S	S	*	*			trans	-65.4	67.6	154	-77	175.7	-7.1	0	0	104.3	P155 L159	P155-Q157 PolarHBondContact O-N 3.47Å; Q157-L159 PolarHBondContact O-N 3.09Å
158	G	35.2	Very low	48.3	Very low	58 Å²	58	105.1 Å²	105.1	60%	0.598	61%	0.608	S	S	*	*				-48.3	92.6	120.9	0	0	0	0	0	104.3	P156 S160	P156-G158 PolarHBondContact O-N 2.73Å; G158-S160 PolarHBondContact O-N 3.17Å
159	L	34.3	Very low	45.7	Very low	110 Å²	110	108.4 Å²	108.4	58%	0.576	62%	0.623	S	S	*	*				-37	99.6	128	-67	163	0	0	0	104.4	Q157 L161 M211	Q157-L159 PolarHBondContact O-N 3.09Å; L159-L161 PolarHBondContact O-N 3.14Å; L159-M211 HydrophobicContact CD1-SD 3.94Å
160	S	34.5	Very low	43.1	Very low	107 Å²	107	112.2 Å²	112.2	75%	0.748	65%	0.652	S	S	*	*			trans	-56.2	96	146.2	62.5	0	0	0	0	101.8	G158 S162	G158-S160 PolarHBondContact O-N 3.17Å; S160-S162 PolarHBondContact O-N 2.55Å
161	L	33.6	Very low	40.6	Very low	115 Å²	115	116.9 Å²	116.9	60%	0.602	69%	0.692	S	S	*	*			trans	-55.5	96.5	163	-78.8	161.9	0	0	0	102.9	L159 L163	L159-L161 PolarHBondContact O-N 3.14Å; L161-L163 HydrophobicContact CB-CD1 3.95Å; L161-L163 HydrophobicContact CD2-CD1 4.35Å; L161-L163 PolarHBondContact O-N 2.89Å
162	S	33.6	Very low	38.2	Very low	104 Å²	104	121.7 Å²	121.7	73%	0.727	72%	0.716	S	S	*	*			trans	-70.5	71.1	159.6	-162.9	0	0	0	0	104.7	S160 S164	S160-S162 PolarHBondContact O-N 2.55Å; S162-S164 PolarHBondContact O-N 3.38Å; S162-S164 VanDerWaalsContact O-N 3.13Å
163	L	40.5	Very low	36.6	Very low	142 Å²	142	118.3 Å²	118.3	74%	0.743	71%	0.713	S	S	*	*			trans	-62.9	106.9	144	-96.1	82	0	0	0	102.8	L161 A165	L161-L163 HydrophobicContact CB-CD1 3.95Å; L161-L163 HydrophobicContact CD2-CD1 4.35Å; L161-L163 PolarHBondContact O-N 2.89Å; L163-A165 PolarHBondContact O-N 3.49Å
164	S	34.3	Very low	36.1	Very low	103 Å²	103	123.4 Å²	123.4	72%	0.72	73%	0.733	S	S	*	*			trans	-38.6	109.5	178	-45.6	0	0	0	0	109.1	S162 R166	S162-S164 PolarHBondContact O-N 3.38Å; S162-S164 VanDerWaalsContact O-N 3.13Å; S164-R166 PolarHBondContact O-N 2.87Å
165	A	35.8	Very low	36	Very low	94 Å²	94	126.2 Å²	126.2	78%	0.777	75%	0.752	S	S	*	*			trans	-61	97.3	167.3	0	0	0	0	0	105.7	L163 N167	L163-A165 PolarHBondContact O-N 3.49Å; A165-N167 PolarHBondContact O-N 2.64Å
166	R	33.2	Very low	36.4	Very low	237 Å²	237	126.8 Å²	126.8	89%	0.894	76%	0.758	S	S	*	*			trans	-60.9	123.9	159.5	-88	-175.1	176.3	-163	-0.9	105.6	S164	S164-R166 PolarHBondContact O-N 2.87Å
167	N	32.9	Very low	36.6	Very low	137 Å²	137	127 Å²	127	73%	0.733	76%	0.759	S	S	*	*			trans	-38.7	136.3	172.2	-72.1	-22	0	0	0	111.1	A165 E169	A165-N167 PolarHBondContact O-N 2.64Å; N167-E169 PolarHBondContact O-N 3.11Å
168	P	37.3	Very low	37.1	Very low	131 Å²	131	124.3 Å²	124.3	85%	0.851	76%	0.757	S	S	*	*	S	Bend	trans	-79.6	61.1	172.1	34.4	-32.6	0	0	0	109.9
169	E	36.4	Very low	37.9	Very low	184 Å²	184	129 Å²	129	86%	0.86	77%	0.769	S	S	*	*			trans	-140.6	53.5	169.4	-75.9	-162.8	152.2	0	0	110.6	N167	N167-E169 PolarHBondContact O-N 3.11Å
170	S	37.3	Very low	38.9	Very low	107 Å²	107	126.6 Å²	126.6	75%	0.748	76%	0.759	S	S	*	*			trans	-168	91.2	153	57.1	0	0	0	0	107.3	D172	S170-D172 PolarHBondContact O-N 3.16Å
171	A	40	Very low	39.9	Very low	107 Å²	107	123.8 Å²	123.8	88%	0.884	74%	0.738	S	S	*	*			trans	-63.5	105.8	169.5	0	0	0	0	0	108.6
172	D	38	Very low	41.1	Very low	143 Å²	143	124.3 Å²	124.3	77%	0.765	74%	0.741	S	S	*	*			trans	-101.2	112.4	161.5	-136	-17.1	0	0	0	106.2	S170 N174	S170-D172 PolarHBondContact O-N 3.16Å; D172-N174 PolarHBondContact O-N 3.25Å
173	P	37.7	Very low	42.6	Very low	122 Å²	122	122.8 Å²	122.8	79%	0.792	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	12.1	-164	-15.8	29.7	0	0	0	115.9
174	N	42.8	Very low	43.7	Very low	160 Å²	160	116.9 Å²	116.9	86%	0.856	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	26	-160	-127.4	17.5	0	0	0	116.8	D172	D172-N174 PolarHBondContact O-N 3.25Å
175	C	34.5	Very low	45.1	Very low	126 Å²	126	117.6 Å²	117.6	85%	0.851	68%	0.681	S	S	*	*			trans	-116	110.2	170.8	-152.1	0	0	0	0	111.1
176	S	41.7	Very low	47	Very low	102 Å²	102	115.3 Å²	115.3	71%	0.713	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-56.9	141.1	178.4	-48.5	0	0	0	0	111.9	C178	S176-C178 PolarHBondContact O-N 2.78Å
177	P	40.7	Very low	49.4	Very low	109 Å²	109	105.1 Å²	105.1	71%	0.708	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-63.1	136.5	175.3	27.3	-33.1	0	0	0	109.6	N179	P177-N179 PolarHBondContact O-N 3.14Å; P177-N179 VanDerWaalsContact O-N 3.13Å
178	C	44.8	Very low	52.3	Low	112 Å²	112	99.4 Å²	99.4	76%	0.757	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-57.3	116.4	177.6	45.9	0	0	0	0	110.5	S176 T180	S176-C178 PolarHBondContact O-N 2.78Å; C178-T180 PolarHBondContact O-N 3.03Å
179	N	51.4	Low	54.9	Low	158 Å²	158	94.4 Å²	94.4	85%	0.845	57%	0.573	S	S	*	*			trans	-70.7	25	-172.2	-72.7	-41.6	0	0	0	115.2	P177 P181	P177-N179 PolarHBondContact O-N 3.14Å; P177-N179 VanDerWaalsContact O-N 3.13Å; N179-P181 WeakPolarHBondContact O-CD 3.41Å
180	T	55.3	Low	57.6	Low	58 Å²	58	88.5 Å²	88.5	36%	0.356	55%	0.545	S	S	.	.			trans	-74.8	124	177	45.2	0	0	0	0	110.2	C178	C178-T180 PolarHBondContact O-N 3.03Å
181	P	56.2	Low	60.4	Low	49 Å²	49	83.6 Å²	83.6	32%	0.318	51%	0.51	S	S	.	.			trans	-54.2	150.2	177	-24.7	33.4	0	0	0	112.2	N179 Y183 D184 Q185	N179-P181 WeakPolarHBondContact O-CD 3.41Å; P181-Y183 HydrophobicContact CB-CD1 3.8Å; P181-Y183 HydrophobicContact CB-CD2 4.15Å; P181-Y183 HydrophobicContact CB-CE1 3.36Å; P181-Y183 HydrophobicContact CB-CE2 3.74Å; P181-Y183 HydrophobicContact CB-CG 4.17Å; P181-Y183 HydrophobicContact CG-CE1 4.14Å; P181-Y183 HydrophobicContact CG-CE2 4.07Å; P181-Y183 PolarHBondContact O-N 3.03Å; P181-D184 PolarHBondContact O-N 3.23Å; P181-Q185 PolarHBondContact O-N 2.95Å
182	L	59.7	Low	62.8	Low	126 Å²	126	78.8 Å²	78.8	66%	0.66	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-53.7	-31.3	-178.1	-174	65.5	0	0	0	113.4	D184 Q185	L182-D184 VanDerWaalsContact C-N 3.3Å; L182-D184 PolarHBondContact O-N 3.12Å; L182-Q185 WeakPolarHBondContact O-CB 3.31Å; L182-Q185 PolarHBondContact O-N 3.23Å
183	Y	63.6	Low	65.2	Low	71 Å²	71	75.4 Å²	75.4	28%	0.278	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-76.4	-13.9	179.2	56.2	-105.9	0	0	0	114.7	P181 A274 I276 R306	P181-Y183 HydrophobicContact CB-CD1 3.8Å; P181-Y183 HydrophobicContact CB-CD2 4.15Å; P181-Y183 HydrophobicContact CB-CE1 3.36Å; P181-Y183 HydrophobicContact CB-CE2 3.74Å; P181-Y183 HydrophobicContact CB-CG 4.17Å; P181-Y183 HydrophobicContact CG-CE1 4.14Å; P181-Y183 HydrophobicContact CG-CE2 4.07Å; P181-Y183 PolarHBondContact O-N 3.03Å; Y183-A274 HydrophobicContact CD1-CB 4.4Å; Y183-A274 HydrophobicContact CD2-CB 3.98Å; Y183-A274 HydrophobicContact CE1-CB 4.37Å; Y183-A274 HydrophobicContact CE2-CB 3.97Å; Y183-A274 HydrophobicContact CG-CB 4.21Å; Y183-I276 HydrophobicContact CD1-CD1 4.19Å; Y183-I276 HydrophobicContact CG-CD1 4.34Å; Y183-R306 PolarHBondContact O-NH2 3.06Å
184	D	64.6	Low	68	Low	19 Å²	19	71 Å²	71	10%	0.102	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-99.6	2.8	175.3	-67.7	-30.5	0	0	0	112	P181 L182 G186 S199 Y201	P181-D184 PolarHBondContact O-N 3.23Å; L182-D184 VanDerWaalsContact C-N 3.3Å; L182-D184 PolarHBondContact O-N 3.12Å; D184-G186 PolarHBondContact O-N 3.45Å; D184-S199 WeakPolarHBondContact OD1-CB 3.36Å; D184-S199 PolarHBondContact OD1-OG 3.25Å; D184-Y201 HydrophobicContact CB-CD1 3.84Å; D184-Y201 HydrophobicContact CB-CG 4.14Å; D184-Y201 WeakPolarHBondContact OD1-CB 3.45Å
185	Q	64.2	Low	70.6	Confident	118 Å²	118	63.3 Å²	63.3	55%	0.551	38%	0.383	S	S	*	.	S	Bend	trans	-75.5	123.3	171.7	-63.1	-178.3	14.6	0	0	109.3	P181 L182	P181-Q185 PolarHBondContact O-N 2.95Å; L182-Q185 WeakPolarHBondContact O-CB 3.31Å; L182-Q185 PolarHBondContact O-N 3.23Å
186	G	75.5	Confident	73.7	Confident	45 Å²	45	57.7 Å²	57.7	46%	0.464	34%	0.344	S	S	.	.	S	Bend	trans	98.6	-151.4	-175.8	0	0	0	0	0	112.8	D184 H202	D184-G186 PolarHBondContact O-N 3.45Å; G186-H202 PolarHBondContact O-NE2 3.05Å
187	G	83.5	Confident	76.4	Confident	24 Å²	24	52.8 Å²	52.8	25%	0.247	31%	0.31	C	S	.	.			trans	-130.5	-176	178.6	0	0	0	0	0	113.4	V189 M208	G187-V189 PolarHBondContact O-N 2.97Å; G187-M208 VanDerWaalsContact CA-CE 3.41Å
188	P	92.3	Very high	79	Confident	17 Å²	17	47.6 Å²	47.6	11%	0.11	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-46.4	138.3	166.2	-29	36.5	0	0	0	111.7	Y196 H202 L212 F269	P188-Y196 HydrophobicContact CB-CD1 4.32Å; P188-H202 HydrophobicContact CG-CB 3.85Å; P188-L212 HydrophobicContact CB-CD1 3.68Å; P188-L212 HydrophobicContact CG-CD1 3.71Å; P188-F269 HydrophobicContact CB-CD2 3.94Å; P188-F269 HydrophobicContact CB-CE2 3.56Å; P188-F269 HydrophobicContact CB-CZ 4.38Å; P188-F269 HydrophobicContact CG-CD2 4.24Å; P188-F269 HydrophobicContact CG-CE2 3.72Å; P188-F269 HydrophobicContact CG-CZ 4.08Å
189	V	92.5	Very high	81.4	Confident	26 Å²	26	42.3 Å²	42.3	16%	0.158	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.3	179	177.3	0	0	0	0	108.9	G187 I191 Y196 L197 R305 R306	G187-V189 PolarHBondContact O-N 2.97Å; V189-I191 HydrophobicContact CG1-CD1 4.26Å; V189-I191 PolarHBondContact O-N 2.81Å; V189-Y196 CarbonylContact O-C 3.17Å; V189-Y196 VanDerWaalsContact O-CA 3.31Å; V189-Y196 WeakPolarHBondContact O-CA 3.25Å; V189-L197 PolarHBondContact N-O 2.73Å; V189-L197 PolarHBondContact O-N 3.35Å; V189-R305 HydrophobicContact CG1-CB 3.55Å; V189-R305 VanDerWaalsContact CG1-O 3.32Å; V189-R305 WeakPolarHBondContact CG1-O 3.5Å; V189-R306 HydrophobicContact CB-CB 4.47Å; V189-R306 HydrophobicContact CG1-CB 4.42Å; V189-R306 HydrophobicContact CG2-CB 4.2Å; V189-R306 HydrophobicContact CG2-CG 4.43Å
190	E	94.1	Very high	83.5	Confident	60 Å²	60	35.3 Å²	35.3	28%	0.28	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	118.9	173.4	-167.5	174.4	139.7	0	0	110.6	L192 P193 Y196 R305	E190-L192 VanDerWaalsContact CG-O 3.25Å; E190-L192 WeakPolarHBondContact CG-O 3.5Å; E190-P193 WeakPolarHBondContact OE1-CA 3.29Å; E190-Y196 HydrophobicContact CB-CD1 3.91Å; E190-Y196 HydrophobicContact CB-CE1 3.48Å; E190-Y196 VanDerWaalsContact CB-CE1 3.48Å; E190-Y196 HydrophobicContact CG-CD1 4.33Å; E190-Y196 HydrophobicContact CG-CE1 3.73Å; E190-Y196 HydrophobicContact CG-CE2 4.3Å; E190-Y196 PolarHBondContact OE2-OH 3.08Å; E190-R305 VanDerWaalsContact O-CD 3.29Å; E190-R305 WeakPolarHBondContact O-CD 3.44Å
191	I	94.6	Very high	85.3	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-47.7	173.8	-56.1	-52.1	0	0	0	109.7	V189 L195 L197 L287 F301 V302 R305	V189-I191 HydrophobicContact CG1-CD1 4.26Å; V189-I191 PolarHBondContact O-N 2.81Å; I191-L195 WeakPolarHBondContact CA-O 3.4Å; I191-L195 HydrophobicContact CB-CD2 4.45Å; I191-L195 HydrophobicContact CB-CG 4.37Å; I191-L195 WeakPolarHBondContact CB-O 3.31Å; I191-L195 HydrophobicContact CG2-CD2 4.37Å; I191-L195 PolarHBondContact N-O 2.9Å; I191-L197 HydrophobicContact CD1-CB 4.04Å; I191-L197 HydrophobicContact CD1-CD2 4.26Å; I191-L197 HydrophobicContact CG1-CB 3.76Å; I191-L287 HydrophobicContact CG2-CD1 4.14Å; I191-F301 HydrophobicContact CG2-CD1 4.31Å; I191-F301 HydrophobicContact CG2-CE1 3.78Å; I191-F301 VanDerWaalsContact O-CE1 3.24Å; I191-F301 WeakPolarHBondContact O-CE1 3.42Å; I191-F301 VanDerWaalsContact O-CZ 3.26Å; I191-F301 WeakPolarHBondContact O-CZ 3.26Å; I191-V302 HydrophobicContact CD1-CG1 3.86Å; I191-V302 HydrophobicContact CG2-CG2 4.22Å; I191-R305 HydrophobicContact CD1-CB 4.24Å
192	L	90.5	Very high	87.1	Confident	7 Å²	7	34.1 Å²	34.1	4%	0.037	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	165.2	170.5	-61.6	172.6	0	0	0	108.2	F46 E190 F194 L195 Y286 L287 F301	F46-L192 HydrophobicContact CE1-CD2 4.31Å; F46-L192 HydrophobicContact CZ-CD2 4.41Å; E190-L192 VanDerWaalsContact CG-O 3.25Å; E190-L192 WeakPolarHBondContact CG-O 3.5Å; L192-F194 HydrophobicContact CB-CD1 4.38Å; L192-F194 HydrophobicContact CB-CE1 4.03Å; L192-F194 HydrophobicContact CB-CZ 4.18Å; L192-F194 HydrophobicContact CD1-CE1 4.12Å; L192-F194 HydrophobicContact CD1-CE2 4.26Å; L192-F194 HydrophobicContact CD1-CZ 3.61Å; L192-F194 PolarHBondContact O-N 3.48Å; L192-L195 HydrophobicContact CB-CB 4.06Å; L192-L195 HydrophobicContact CD1-CD2 4.44Å; L192-L195 PolarHBondContact N-O 2.85Å; L192-L195 VanDerWaalsContact N-O 3.1Å; L192-L195 PolarHBondContact O-N 3.14Å; L192-L195 VanDerWaalsContact O-O 3.1Å; L192-Y286 HydrophobicContact CD1-CD1 4.28Å; L192-Y286 HydrophobicContact CD1-CE1 3.8Å; L192-L287 HydrophobicContact CD1-CD2 3.93Å; L192-L287 HydrophobicContact CD2-CD2 4.28Å; L192-L287 HydrophobicContact CG-CD2 4.23Å; L192-F301 HydrophobicContact CD2-CE1 4.44Å; L192-F301 HydrophobicContact CD2-CZ 4.3Å
193	P	89.9	Confident	88.9	Confident	72 Å²	72	28.1 Å²	28.1	47%	0.468	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-18.5	-178.6	-30.1	37	0	0	0	116.1	E190	E190-P193 WeakPolarHBondContact OE1-CA 3.29Å
194	F	95	Very high	90.4	Very high	28 Å²	28	26.7 Å²	26.7	12%	0.123	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121	3.2	178.9	61.2	-91.9	0	0	0	113.5	L192 I258 R262 R267 V268 Y286	L192-F194 HydrophobicContact CB-CD1 4.38Å; L192-F194 HydrophobicContact CB-CE1 4.03Å; L192-F194 HydrophobicContact CB-CZ 4.18Å; L192-F194 HydrophobicContact CD1-CE1 4.12Å; L192-F194 HydrophobicContact CD1-CE2 4.26Å; L192-F194 HydrophobicContact CD1-CZ 3.61Å; L192-F194 PolarHBondContact O-N 3.48Å; F194-I258 HydrophobicContact CD2-CG2 4.15Å; F194-I258 HydrophobicContact CE2-CG2 3.81Å; F194-R262 HydrophobicContact CB-CG 4.44Å; F194-R262 HydrophobicContact CD1-CG 3.79Å; F194-R262 HydrophobicContact CD2-CB 3.77Å; F194-R262 HydrophobicContact CD2-CG 3.8Å; F194-R262 HydrophobicContact CE1-CG 3.96Å; F194-R262 HydrophobicContact CE2-CB 4.09Å; F194-R262 HydrophobicContact CE2-CG 3.97Å; F194-R262 HydrophobicContact CG-CB 4.07Å; F194-R262 HydrophobicContact CG-CG 3.72Å; F194-R262 HydrophobicContact CZ-CG 4.05Å; F194-R267 CarbonylContact O-C 3.54Å; F194-R267 WeakPolarHBondContact O-CA 3.47Å; F194-V268 PolarHBondContact O-N 3.34Å; F194-Y286 AromaticContact CE2-CE1 3.85Å; F194-Y286 HydrophobicContact CE2-CE1 3.85Å; F194-Y286 AromaticContact CE2-CZ 3.79Å; F194-Y286 VanDerWaalsContact CE2-OH 3.29Å; F194-Y286 WeakPolarHBondContact CE2-OH 3.47Å; F194-Y286 AromaticContact CZ-CE1 3.93Å; F194-Y286 HydrophobicContact CZ-CE1 3.93Å; F194-Y286 WeakPolarHBondContact CZ-OH 3.08Å
195	L	98.4	Very high	91.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	115.9	-174.1	-178.9	64.2	0	0	0	110.7	I191 L192 I258 V268 V270 Y286	I191-L195 WeakPolarHBondContact CA-O 3.4Å; I191-L195 HydrophobicContact CB-CD2 4.45Å; I191-L195 HydrophobicContact CB-CG 4.37Å; I191-L195 WeakPolarHBondContact CB-O 3.31Å; I191-L195 HydrophobicContact CG2-CD2 4.37Å; I191-L195 PolarHBondContact N-O 2.9Å; L192-L195 HydrophobicContact CB-CB 4.06Å; L192-L195 HydrophobicContact CD1-CD2 4.44Å; L192-L195 PolarHBondContact N-O 2.85Å; L192-L195 VanDerWaalsContact N-O 3.1Å; L192-L195 PolarHBondContact O-N 3.14Å; L192-L195 VanDerWaalsContact O-O 3.1Å; L195-I258 HydrophobicContact CD1-CD1 3.99Å; L195-I258 HydrophobicContact CD1-CG1 4.33Å; L195-I258 HydrophobicContact CD1-CG2 4.28Å; L195-V268 WeakPolarHBondContact CA-O 2.95Å; L195-V268 HydrophobicContact CD1-CB 4.42Å; L195-V270 HydrophobicContact CD1-CG2 3.57Å; L195-Y286 HydrophobicContact CD2-CD1 3.69Å; L195-Y286 HydrophobicContact CD2-CE1 4.21Å; L195-Y286 HydrophobicContact CD2-CG 4.29Å
196	Y	98.6	Very high	93.3	Very high	7 Å²	7	26.6 Å²	26.6	3%	0.027	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	149.6	-179.5	-68.8	-101	0	0	0	111.1	P188 V189 E190 L212 I214 R267 V268 V270	P188-Y196 HydrophobicContact CB-CD1 4.32Å; V189-Y196 CarbonylContact O-C 3.17Å; V189-Y196 VanDerWaalsContact O-CA 3.31Å; V189-Y196 WeakPolarHBondContact O-CA 3.25Å; E190-Y196 HydrophobicContact CB-CD1 3.91Å; E190-Y196 HydrophobicContact CB-CE1 3.48Å; E190-Y196 VanDerWaalsContact CB-CE1 3.48Å; E190-Y196 HydrophobicContact CG-CD1 4.33Å; E190-Y196 HydrophobicContact CG-CE1 3.73Å; E190-Y196 HydrophobicContact CG-CE2 4.3Å; E190-Y196 PolarHBondContact OE2-OH 3.08Å; Y196-L212 HydrophobicContact CD1-CD1 4.27Å; Y196-L212 HydrophobicContact CE1-CD1 4.39Å; Y196-L212 HydrophobicContact CE1-CD2 3.97Å; Y196-I214 HydrophobicContact CD2-CD1 3.56Å; Y196-I214 HydrophobicContact CE2-CD1 4.11Å; Y196-I214 HydrophobicContact CG-CD1 3.98Å; Y196-R267 HydrophobicContact CE2-CB 4.44Å; Y196-R267 PolarHBondContact OH-NH1 3.14Å; Y196-V268 PolarHBondContact N-O 3.46Å; Y196-V270 PolarHBondContact O-N 3.38Å
197	L	98.4	Very high	94	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.3	-178.9	173	62.9	0	0	0	111.2	V189 I191 V270 S279 A280 V302 I309	V189-L197 PolarHBondContact N-O 2.73Å; V189-L197 PolarHBondContact O-N 3.35Å; I191-L197 HydrophobicContact CD1-CB 4.04Å; I191-L197 HydrophobicContact CD1-CD2 4.26Å; I191-L197 HydrophobicContact CG1-CB 3.76Å; L197-V270 WeakPolarHBondContact CA-O 3.39Å; L197-S279 VanDerWaalsContact CD1-CB 3.49Å; L197-S279 VanDerWaalsContact CD1-OG 3.24Å; L197-S279 WeakPolarHBondContact CD1-OG 3.46Å; L197-A280 HydrophobicContact CD2-CB 4.2Å; L197-V302 HydrophobicContact CD2-CG1 3.76Å; L197-I309 HydrophobicContact CD2-CG2 3.93Å
198	G	96.3	Very high	94.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	-166	175.9	0	0	0	0	0	115.6	F269 V270 H271 G275	G198-F269 VanDerWaalsContact N-CE2 3.28Å; G198-V270 PolarHBondContact N-O 3.42Å; G198-V270 VanDerWaalsContact N-O 3.15Å; G198-H271 WeakPolarHBondContact O-CA 3.32Å; G198-H271 WeakPolarHBondContact O-CB 3.12Å; G198-G275 WeakPolarHBondContact O-CA 2.76Å
199	S	95.4	Very high	94.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.			trans	-100.3	174.1	-179	64.8	0	0	0	0	112	D184 Y201 H202 A203 C272 Q273	D184-S199 WeakPolarHBondContact OD1-CB 3.36Å; D184-S199 PolarHBondContact OD1-OG 3.25Å; S199-Y201 PolarHBondContact O-N 3.45Å; S199-H202 PolarHBondContact N-ND1 2.77Å; S199-H202 PolarHBondContact O-N 3.03Å; S199-H202 PolarHBondContact OG-N 2.96Å; S199-H202 PolarHBondContact OG-ND1 3.44Å; S199-A203 PolarHBondContact O-N 2.86Å; S199-A203 VanDerWaalsContact O-N 3.14Å; S199-C272 CarbonylContact C-O 3.54Å; S199-Q273 WeakPolarHBondContact CB-O 3.39Å
200	A	94.9	Very high	94.6	Very high	12 Å²	12	30.8 Å²	30.8	10%	0.099	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-31.3	175	0	0	0	0	0	111.5	H202 A203 S204 C224 C272 Q273	A200-H202 PolarHBondContact O-N 3.25Å; A200-A203 WeakPolarHBondContact O-CB 3.49Å; A200-A203 PolarHBondContact O-N 3.14Å; A200-S204 PolarHBondContact O-N 3.43Å; A200-C224 HydrophobicContact CB-CB 4.15Å; A200-C272 PolarHBondContact N-O 3.16Å; A200-Q273 PolarHBondContact N-O 3.15Å
201	Y	92.6	Very high	94.5	Very high	81 Å²	81	34.5 Å²	34.5	32%	0.318	17%	0.174	S	C	.	.	H	α-helix	trans	-56.9	-50.5	171.8	174.2	-105.4	0	0	0	110.7	D184 S199 A203 S204 R205	D184-Y201 HydrophobicContact CB-CD1 3.84Å; D184-Y201 HydrophobicContact CB-CG 4.14Å; D184-Y201 WeakPolarHBondContact OD1-CB 3.45Å; S199-Y201 PolarHBondContact O-N 3.45Å; Y201-A203 VanDerWaalsContact C-N 3.29Å; Y201-A203 PolarHBondContact O-N 3.09Å; Y201-S204 WeakPolarHBondContact O-CB 3.17Å; Y201-S204 PolarHBondContact O-N 3.22Å; Y201-S204 VanDerWaalsContact O-N 3.08Å; Y201-S204 PolarHBondContact O-OG 3.09Å; Y201-R205 WeakPolarHBondContact O-CG 3.36Å; Y201-R205 PolarHBondContact OH-NH1 2.77Å
202	H	94.9	Very high	94.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-35.6	176.8	-55.7	149.7	0	0	0	112.8	G186 P188 S199 A200 S204 R205 F269	G186-H202 PolarHBondContact O-NE2 3.05Å; P188-H202 HydrophobicContact CG-CB 3.85Å; S199-H202 PolarHBondContact N-ND1 2.77Å; S199-H202 PolarHBondContact O-N 3.03Å; S199-H202 PolarHBondContact OG-N 2.96Å; S199-H202 PolarHBondContact OG-ND1 3.44Å; A200-H202 PolarHBondContact O-N 3.25Å; H202-S204 PolarHBondContact O-N 2.88Å; H202-R205 PolarHBondContact O-N 2.91Å; H202-F269 HydrophobicContact CB-CE1 4.3Å; H202-F269 HydrophobicContact CB-CZ 3.73Å
203	A	96.9	Very high	94.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-28.5	175.7	0	0	0	0	0	112.9	S199 A200 Y201 R205 L209 L217 F269	S199-A203 PolarHBondContact O-N 2.86Å; S199-A203 VanDerWaalsContact O-N 3.14Å; A200-A203 WeakPolarHBondContact O-CB 3.49Å; A200-A203 PolarHBondContact O-N 3.14Å; Y201-A203 VanDerWaalsContact C-N 3.29Å; Y201-A203 PolarHBondContact O-N 3.09Å; A203-R205 PolarHBondContact O-N 2.81Å; A203-L209 WeakPolarHBondContact O-CD1 3.31Å; A203-L217 HydrophobicContact CB-CD2 4.38Å; A203-F269 HydrophobicContact CB-CE1 3.88Å
204	S	95.3	Very high	94.9	Very high	42 Å²	42	34.1 Å²	34.1	29%	0.294	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-5.3	177.3	76.6	0	0	0	0	113.9	A200 Y201 H202 F228	A200-S204 PolarHBondContact O-N 3.43Å; Y201-S204 WeakPolarHBondContact O-CB 3.17Å; Y201-S204 PolarHBondContact O-N 3.22Å; Y201-S204 VanDerWaalsContact O-N 3.08Å; Y201-S204 PolarHBondContact O-OG 3.09Å; H202-S204 PolarHBondContact O-N 2.88Å; S204-F228 WeakPolarHBondContact O-CZ 3.03Å
205	R	94.9	Very high	95.1	Very high	76 Å²	76	35.9 Å²	35.9	29%	0.287	19%	0.189	S	C	.	.			trans	-102.2	81.9	-174.8	-66	-63.8	-58.7	-86.5	-2	111.4	Y201 H202 A203 D207 M208 L209	Y201-R205 WeakPolarHBondContact O-CG 3.36Å; Y201-R205 PolarHBondContact OH-NH1 2.77Å; H202-R205 PolarHBondContact O-N 2.91Å; A203-R205 PolarHBondContact O-N 2.81Å; R205-D207 VanDerWaalsContact C-OD1 3.32Å; R205-D207 WeakPolarHBondContact CA-OD1 3.38Å; R205-D207 WeakPolarHBondContact CB-OD1 3.25Å; R205-D207 IonicContact CZ-OD1 3.79Å; R205-D207 IonicContact CZ-OD2 3.6Å; R205-D207 IonicContact NE-OD1 3.06Å; R205-D207 PolarHBondContact NE-OD1 2.88Å; R205-D207 IonicContact NE-OD2 3.63Å; R205-D207 IonicContact NH2-OD1 3.65Å; R205-D207 IonicContact NH2-OD2 2.74Å; R205-D207 PolarHBondContact NH2-OD2 2.93Å; R205-D207 PolarHBondContact O-N 3.1Å; R205-M208 HydrophobicContact CB-CB 3.96Å; R205-M208 HydrophobicContact CB-CG 3.81Å; R205-M208 HydrophobicContact CB-SD 3.71Å; R205-M208 HydrophobicContact CG-SD 3.93Å; R205-M208 WeakPolarHBondContact O-CB 3.23Å; R205-M208 PolarHBondContact O-N 3.3Å; R205-L209 WeakPolarHBondContact O-CG 3.26Å; R205-L209 PolarHBondContact O-N 2.81Å
206	K	94.3	Very high	95.1	Very high	59 Å²	59	35.9 Å²	35.9	26%	0.257	19%	0.189	S	C	.	.	H	α-helix	trans	-55.2	-40.4	-179.7	-178.2	161.8	177.7	52.2	0	113	M208 L209 D210 F228 F232	K206-M208 VanDerWaalsContact C-N 3.26Å; K206-M208 PolarHBondContact O-N 2.92Å; K206-L209 PolarHBondContact O-N 2.8Å; K206-D210 WeakPolarHBondContact CE-OD2 3.45Å; K206-D210 VanDerWaalsContact CG-OD2 3.31Å; K206-D210 WeakPolarHBondContact CG-OD2 3.45Å; K206-D210 IonicContact NZ-OD1 2.9Å; K206-D210 PolarHBondContact NZ-OD1 3.17Å; K206-D210 IonicContact NZ-OD2 3.14Å; K206-D210 PolarHBondContact NZ-OD2 2.98Å; K206-D210 VanDerWaalsContact NZ-OD2 3.14Å; K206-D210 WeakPolarHBondContact O-CB 3.1Å; K206-D210 VanDerWaalsContact O-CG 3.27Å; K206-D210 PolarHBondContact O-N 2.99Å; K206-F228 HydrophobicContact CB-CD1 4.13Å; K206-F228 HydrophobicContact CB-CD2 3.91Å; K206-F228 HydrophobicContact CB-CE1 3.8Å; K206-F228 HydrophobicContact CB-CE2 3.57Å; K206-F228 HydrophobicContact CB-CG 4.19Å; K206-F228 HydrophobicContact CB-CZ 3.53Å; K206-F228 HydrophobicContact CD-CB 4.4Å; K206-F228 HydrophobicContact CD-CD1 3.74Å; K206-F228 HydrophobicContact CD-CD2 4.47Å; K206-F228 HydrophobicContact CD-CE1 4.12Å; K206-F228 HydrophobicContact CD-CG 3.94Å; K206-F228 HydrophobicContact CG-CD1 4.46Å; K206-F228 HydrophobicContact CG-CD2 4.46Å; K206-F228 HydrophobicContact CG-CG 4.42Å; K206-F232 HydrophobicContact CG-CE2 4.47Å; K206-F232 HydrophobicContact CG-CZ 4.43Å
207	D	91.2	Very high	95.1	Very high	86 Å²	86	35.6 Å²	35.6	46%	0.46	19%	0.188	S	C	.	.	H	α-helix	trans	-54.1	-42.6	175.3	58.8	-41.6	0	0	0	112.4	R205 M211	R205-D207 VanDerWaalsContact C-OD1 3.32Å; R205-D207 WeakPolarHBondContact CA-OD1 3.38Å; R205-D207 WeakPolarHBondContact CB-OD1 3.25Å; R205-D207 IonicContact CZ-OD1 3.79Å; R205-D207 IonicContact CZ-OD2 3.6Å; R205-D207 IonicContact NE-OD1 3.06Å; R205-D207 PolarHBondContact NE-OD1 2.88Å; R205-D207 IonicContact NE-OD2 3.63Å; R205-D207 IonicContact NH2-OD1 3.65Å; R205-D207 IonicContact NH2-OD2 2.74Å; R205-D207 PolarHBondContact NH2-OD2 2.93Å; R205-D207 PolarHBondContact O-N 3.1Å; D207-M211 WeakPolarHBondContact O-CB 3.41Å; D207-M211 PolarHBondContact O-N 3.42Å; D207-M211 VanDerWaalsContact O-N 3.16Å
208	M	93.3	Very high	95.1	Very high	32 Å²	32	35.6 Å²	35.6	16%	0.158	19%	0.188	C	C	.	.	H	α-helix	trans	-73.3	-41.5	178	-61.9	-178	67.2	0	0	112.1	G187 R205 K206 M211 L212	G187-M208 VanDerWaalsContact CA-CE 3.41Å; R205-M208 HydrophobicContact CB-CB 3.96Å; R205-M208 HydrophobicContact CB-CG 3.81Å; R205-M208 HydrophobicContact CB-SD 3.71Å; R205-M208 HydrophobicContact CG-SD 3.93Å; R205-M208 WeakPolarHBondContact O-CB 3.23Å; R205-M208 PolarHBondContact O-N 3.3Å; K206-M208 VanDerWaalsContact C-N 3.26Å; K206-M208 PolarHBondContact O-N 2.92Å; M208-M211 PolarHBondContact O-N 3.38Å; M208-L212 WeakPolarHBondContact O-CB 3.08Å; M208-L212 VanDerWaalsContact O-CG 3.31Å; M208-L212 WeakPolarHBondContact O-CG 3.48Å; M208-L212 PolarHBondContact O-N 3.33Å; M208-L212 VanDerWaalsContact O-N 3.08Å
209	L	95.7	Very high	95.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-45.1	178.4	-64	176.9	0	0	0	111.5	A203 R205 K206 L212 G213 I214 L217 F232 F269	A203-L209 WeakPolarHBondContact O-CD1 3.31Å; R205-L209 WeakPolarHBondContact O-CG 3.26Å; R205-L209 PolarHBondContact O-N 2.81Å; K206-L209 PolarHBondContact O-N 2.8Å; L209-L212 PolarHBondContact O-N 2.89Å; L209-G213 PolarHBondContact O-N 3.01Å; L209-I214 HydrophobicContact CB-CB 4.23Å; L209-I214 HydrophobicContact CB-CG1 4.45Å; L209-I214 HydrophobicContact CD2-CB 4.37Å; L209-I214 HydrophobicContact CD2-CG1 4.05Å; L209-I214 HydrophobicContact CD2-CG2 4.41Å; L209-I214 WeakPolarHBondContact O-CB 3.43Å; L209-I214 PolarHBondContact O-N 3.08Å; L209-L217 HydrophobicContact CD1-CD1 4.44Å; L209-L217 HydrophobicContact CD1-CD2 3.83Å; L209-L217 HydrophobicContact CD2-CD2 4.35Å; L209-F232 HydrophobicContact CB-CE1 4.25Å; L209-F232 HydrophobicContact CB-CE2 4.3Å; L209-F232 HydrophobicContact CB-CZ 3.68Å; L209-F232 HydrophobicContact CD1-CD2 4.46Å; L209-F232 HydrophobicContact CD1-CE2 3.8Å; L209-F232 HydrophobicContact CD1-CZ 4.04Å; L209-F269 HydrophobicContact CD2-CB 4.38Å; L209-F269 HydrophobicContact CD2-CD1 3.71Å; L209-F269 HydrophobicContact CD2-CE1 4.2Å; L209-F269 HydrophobicContact CD2-CG 4.09Å
210	D	91.6	Very high	95.4	Very high	82 Å²	82	35.7 Å²	35.7	44%	0.439	19%	0.189	S	C	.	.	H	α-helix	trans	-64.8	-42.5	178.5	-68.7	-15.3	0	0	0	110.6	K206 L212 G213 F232	K206-D210 WeakPolarHBondContact CE-OD2 3.45Å; K206-D210 VanDerWaalsContact CG-OD2 3.31Å; K206-D210 WeakPolarHBondContact CG-OD2 3.45Å; K206-D210 IonicContact NZ-OD1 2.9Å; K206-D210 PolarHBondContact NZ-OD1 3.17Å; K206-D210 IonicContact NZ-OD2 3.14Å; K206-D210 PolarHBondContact NZ-OD2 2.98Å; K206-D210 VanDerWaalsContact NZ-OD2 3.14Å; K206-D210 WeakPolarHBondContact O-CB 3.1Å; K206-D210 VanDerWaalsContact O-CG 3.27Å; K206-D210 PolarHBondContact O-N 2.99Å; D210-L212 VanDerWaalsContact C-N 3.31Å; D210-L212 PolarHBondContact O-N 3.32Å; D210-G213 PolarHBondContact O-N 3.48Å; D210-F232 VanDerWaalsContact OD1-CZ 3.25Å; D210-F232 WeakPolarHBondContact OD1-CZ 3.46Å
211	M	91.3	Very high	95.3	Very high	138 Å²	138	35.4 Å²	35.4	68%	0.68	19%	0.186	S	C	*	.	H	α-helix	trans	-62.3	-36.4	177.4	-175.9	179.7	-62.9	0	0	113	L159 D207 M208 G213	L159-M211 HydrophobicContact CD1-SD 3.94Å; D207-M211 WeakPolarHBondContact O-CB 3.41Å; D207-M211 PolarHBondContact O-N 3.42Å; D207-M211 VanDerWaalsContact O-N 3.16Å; M208-M211 PolarHBondContact O-N 3.38Å; M211-G213 PolarHBondContact O-N 3.08Å
212	L	91.5	Very high	95.2	Very high	32 Å²	32	34.2 Å²	34.2	17%	0.168	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-4.9	176.5	-69.3	172.9	0	0	0	113.1	P188 Y196 M208 L209 D210 I214 R267	P188-L212 HydrophobicContact CB-CD1 3.68Å; P188-L212 HydrophobicContact CG-CD1 3.71Å; Y196-L212 HydrophobicContact CD1-CD1 4.27Å; Y196-L212 HydrophobicContact CE1-CD1 4.39Å; Y196-L212 HydrophobicContact CE1-CD2 3.97Å; M208-L212 WeakPolarHBondContact O-CB 3.08Å; M208-L212 VanDerWaalsContact O-CG 3.31Å; M208-L212 WeakPolarHBondContact O-CG 3.48Å; M208-L212 PolarHBondContact O-N 3.33Å; M208-L212 VanDerWaalsContact O-N 3.08Å; L209-L212 PolarHBondContact O-N 2.89Å; D210-L212 VanDerWaalsContact C-N 3.31Å; D210-L212 PolarHBondContact O-N 3.32Å; L212-I214 VanDerWaalsContact C-N 3.3Å; L212-I214 HydrophobicContact CB-CD1 4.26Å; L212-I214 HydrophobicContact CB-CG1 3.97Å; L212-R267 VanDerWaalsContact O-CD 3.25Å; L212-R267 WeakPolarHBondContact O-CD 3.44Å; L212-R267 PolarHBondContact O-NH1 3.48Å
213	G	95.4	Very high	94.7	Very high	34 Å²	34	39.4 Å²	39.4	35%	0.351	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	31.5	-176.2	0	0	0	0	0	112.7	L209 D210 M211 T215 R267	L209-G213 PolarHBondContact O-N 3.01Å; D210-G213 PolarHBondContact O-N 3.48Å; M211-G213 PolarHBondContact O-N 3.08Å; G213-T215 PolarHBondContact O-N 2.88Å; G213-R267 WeakPolarHBondContact O-CB 3.24Å; G213-R267 WeakPolarHBondContact O-CD 3.26Å
214	I	98.1	Very high	94.2	Very high	7 Å²	7	40 Å²	40	4%	0.036	22%	0.221	C	C	.	.			trans	-66	129.8	176.3	-60.7	-55.2	0	0	0	108.9	Y196 L209 L212 A216 L217 F232 R267 F269	Y196-I214 HydrophobicContact CD2-CD1 3.56Å; Y196-I214 HydrophobicContact CE2-CD1 4.11Å; Y196-I214 HydrophobicContact CG-CD1 3.98Å; L209-I214 HydrophobicContact CB-CB 4.23Å; L209-I214 HydrophobicContact CB-CG1 4.45Å; L209-I214 HydrophobicContact CD2-CB 4.37Å; L209-I214 HydrophobicContact CD2-CG1 4.05Å; L209-I214 HydrophobicContact CD2-CG2 4.41Å; L209-I214 WeakPolarHBondContact O-CB 3.43Å; L209-I214 PolarHBondContact O-N 3.08Å; L212-I214 VanDerWaalsContact C-N 3.3Å; L212-I214 HydrophobicContact CB-CD1 4.26Å; L212-I214 HydrophobicContact CB-CG1 3.97Å; I214-A216 VanDerWaalsContact CG2-O 3.26Å; I214-A216 WeakPolarHBondContact CG2-O 2.95Å; I214-L217 HydrophobicContact CG2-CD1 3.85Å; I214-L217 HydrophobicContact CG2-CG 4.24Å; I214-F232 WeakPolarHBondContact O-CD1 3.21Å; I214-F232 WeakPolarHBondContact O-CE1 3.5Å; I214-R267 HydrophobicContact CD1-CB 4.06Å; I214-F269 HydrophobicContact CD1-CB 3.96Å; I214-F269 HydrophobicContact CG1-CB 4.12Å; I214-F269 HydrophobicContact CG2-CB 3.82Å
215	T	98.3	Very high	94	Very high	66 Å²	66	42.1 Å²	42.1	41%	0.405	23%	0.234	S	C	.	.			trans	-111.2	-20.7	177.6	58.5	0	0	0	0	111.9	G213 L233 G266 R267	G213-T215 PolarHBondContact O-N 2.88Å; T215-L233 PolarHBondContact O-N 2.81Å; T215-L233 VanDerWaalsContact O-N 3.09Å; T215-G266 VanDerWaalsContact OG1-CA 3.25Å; T215-G266 WeakPolarHBondContact OG1-CA 3.48Å; T215-R267 PolarHBondContact N-O 3.35Å; T215-R267 PolarHBondContact OG1-N 2.9Å; T215-R267 PolarHBondContact OG1-O 3.39Å
216	A	98.7	Very high	94.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151.9	-177.7	0	0	0	0	0	112.8	I214 L233 F257 V261 R267 V268 F269	I214-A216 VanDerWaalsContact CG2-O 3.26Å; I214-A216 WeakPolarHBondContact CG2-O 2.95Å; A216-L233 CarbonylContact C-O 3.54Å; A216-L233 WeakPolarHBondContact CA-O 3.4Å; A216-L233 HydrophobicContact CB-CB 3.96Å; A216-L233 HydrophobicContact CB-CD2 4.48Å; A216-L233 WeakPolarHBondContact CB-O 3.36Å; A216-F257 HydrophobicContact CB-CE1 3.92Å; A216-F257 HydrophobicContact CB-CZ 3.93Å; A216-V261 HydrophobicContact CB-CB 4.4Å; A216-V261 HydrophobicContact CB-CG1 3.97Å; A216-V261 HydrophobicContact CB-CG2 3.57Å; A216-R267 PolarHBondContact N-O 2.58Å; A216-R267 VanDerWaalsContact N-O 3.09Å; A216-V268 HydrophobicContact CB-CG2 4.35Å; A216-V268 CarbonylContact O-C 3.58Å; A216-V268 VanDerWaalsContact O-CA 3.31Å; A216-V268 WeakPolarHBondContact O-CA 3.45Å; A216-F269 PolarHBondContact O-N 2.87Å
217	L	98.7	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	141.2	179.6	-72	89.8	0	0	0	111.1	A203 L209 I214 F232 L233 Y234 K235 F269	A203-L217 HydrophobicContact CB-CD2 4.38Å; L209-L217 HydrophobicContact CD1-CD1 4.44Å; L209-L217 HydrophobicContact CD1-CD2 3.83Å; L209-L217 HydrophobicContact CD2-CD2 4.35Å; I214-L217 HydrophobicContact CG2-CD1 3.85Å; I214-L217 HydrophobicContact CG2-CG 4.24Å; L217-F232 HydrophobicContact CD1-CB 3.33Å; L217-F232 HydrophobicContact CD1-CD1 3.95Å; L217-F232 HydrophobicContact CD1-CD2 3.72Å; L217-F232 HydrophobicContact CD1-CE2 4.49Å; L217-F232 HydrophobicContact CD1-CG 3.4Å; L217-F232 VanDerWaalsContact CD1-CG 3.4Å; L217-L233 PolarHBondContact N-O 3.32Å; L217-Y234 HydrophobicContact CB-CD1 3.91Å; L217-Y234 HydrophobicContact CB-CD2 4.43Å; L217-Y234 HydrophobicContact CB-CE1 3.52Å; L217-Y234 HydrophobicContact CB-CE2 4.1Å; L217-Y234 HydrophobicContact CB-CG 4.36Å; L217-Y234 HydrophobicContact CD1-CE2 4.02Å; L217-Y234 HydrophobicContact CD2-CE1 4.27Å; L217-Y234 HydrophobicContact CD2-CE2 4.5Å; L217-Y234 VanDerWaalsContact CD2-OH 3.29Å; L217-Y234 WeakPolarHBondContact CD2-OH 3.26Å; L217-Y234 HydrophobicContact CG-CE1 4.37Å; L217-Y234 HydrophobicContact CG-CE2 4.41Å; L217-Y234 CarbonylContact O-C 3.57Å; L217-Y234 WeakPolarHBondContact O-CA 3.46Å; L217-K235 PolarHBondContact O-N 3.2Å; L217-F269 CarbonylContact C-O 3.35Å; L217-F269 VanDerWaalsContact CA-O 3.28Å; L217-F269 WeakPolarHBondContact CA-O 3.25Å; L217-F269 HydrophobicContact CD2-CD1 3.7Å; L217-F269 HydrophobicContact CD2-CE1 4.5Å; L217-F269 HydrophobicContact CG-CB 4.25Å; L217-F269 HydrophobicContact CG-CD1 4.23Å
218	I	98.8	Very high	94.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.6	165.5	-51.3	-174	0	0	0	108.4	V220 K235 I237 A254 F257 I258 V268 F269 V270 H271	I218-V220 HydrophobicContact CG2-CG2 3.82Å; I218-K235 CarbonylContact C-O 3.34Å; I218-K235 VanDerWaalsContact CA-O 3.29Å; I218-K235 WeakPolarHBondContact CA-O 3.44Å; I218-K235 HydrophobicContact CG1-CB 4.15Å; I218-K235 HydrophobicContact CG2-CB 4.34Å; I218-K235 HydrophobicContact CG2-CG 4.48Å; I218-I237 HydrophobicContact CG2-CD1 3.61Å; I218-I237 HydrophobicContact CG2-CG1 4.18Å; I218-A254 HydrophobicContact CD1-CB 4.46Å; I218-F257 HydrophobicContact CD1-CD1 3.69Å; I218-F257 HydrophobicContact CD1-CE1 4.31Å; I218-F257 HydrophobicContact CG1-CD1 3.65Å; I218-F257 HydrophobicContact CG1-CE1 3.75Å; I218-I258 HydrophobicContact CD1-CD1 4.07Å; I218-I258 HydrophobicContact CD1-CG1 3.7Å; I218-V268 HydrophobicContact CD1-CG1 4.11Å; I218-V268 HydrophobicContact CG1-CG1 3.81Å; I218-F269 PolarHBondContact N-O 3.23Å; I218-V270 HydrophobicContact CB-CB 4.47Å; I218-V270 HydrophobicContact CB-CG1 4.2Å; I218-V270 HydrophobicContact CB-CG2 4.19Å; I218-V270 HydrophobicContact CD1-CG2 4.06Å; I218-V270 HydrophobicContact CG1-CG2 4.25Å; I218-H271 PolarHBondContact O-CD2 3.49Å; I218-H271 PolarHBondContact O-N 2.92Å
219	N	98.6	Very high	94.4	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	104.1	172.9	-179.4	4.5	0	0	0	109.6	S221 C224 N226 K235 I237 H271	N219-S221 VanDerWaalsContact C-N 3.26Å; N219-S221 PolarHBondContact O-N 3.4Å; N219-S221 WeakPolarHBondContact OD1-CB 3.47Å; N219-S221 PolarHBondContact OD1-N 3.4Å; N219-C224 PolarHBondContact ND2-O 2.92Å; N219-N226 WeakPolarHBondContact CB-OD1 3.37Å; N219-N226 PolarHBondContact ND2-OD1 3.34Å; N219-K235 PolarHBondContact N-O 3.35Å; N219-I237 PolarHBondContact O-N 2.68Å; N219-H271 WeakPolarHBondContact CB-NE2 3.09Å; N219-H271 VanDerWaalsContact CG-CE1 3.49Å; N219-H271 PolarHBondContact OD1-CE1 3.44Å
220	V	98.4	Very high	94.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.283	C	S	.	.			trans	-94.2	51.1	179.3	-158.5	0	0	0	0	109.9	I218 I237 I247 V270 H271 C272 R278 I282	I218-V220 HydrophobicContact CG2-CG2 3.82Å; V220-I237 CarbonylContact C-O 3.58Å; V220-I237 WeakPolarHBondContact CA-O 3.06Å; V220-I237 HydrophobicContact CG1-CB 4.23Å; V220-I237 HydrophobicContact CG1-CG2 3.96Å; V220-I247 HydrophobicContact CG1-CD1 3.99Å; V220-V270 HydrophobicContact CG2-CG1 3.77Å; V220-H271 PolarHBondContact N-O 2.89Å; V220-C272 HydrophobicContact CB-CB 4.37Å; V220-C272 WeakPolarHBondContact O-CB 3.48Å; V220-R278 HydrophobicContact CB-CB 4.16Å; V220-R278 HydrophobicContact CG1-CB 3.84Å; V220-R278 WeakPolarHBondContact O-CD 3.49Å; V220-R278 PolarHBondContact O-NE 3.07Å; V220-I282 HydrophobicContact CG1-CG1 3.95Å; V220-I282 HydrophobicContact CG2-CG1 3.81Å
221	S	93.8	Very high	94.5	Very high	6 Å²	6	50.7 Å²	50.7	4%	0.042	29%	0.285	C	S	.	.			trans	-150	141.5	179.3	-165	0	0	0	0	111.7	N219 N223 C224 I237 R278	N219-S221 VanDerWaalsContact C-N 3.26Å; N219-S221 PolarHBondContact O-N 3.4Å; N219-S221 WeakPolarHBondContact OD1-CB 3.47Å; N219-S221 PolarHBondContact OD1-N 3.4Å; S221-N223 PolarHBondContact OG-N 3.01Å; S221-C224 PolarHBondContact OG-SG 3.44Å; S221-C224 VanDerWaalsContact OG-SG 3.42Å; S221-I237 PolarHBondContact N-O 2.79Å; S221-R278 PolarHBondContact OG-NH1 2.86Å
222	S	89.4	Confident	94.8	Very high	55 Å²	55	44.8 Å²	44.8	39%	0.385	26%	0.255	S	S	.	.	S	Bend	trans	-84.6	-13.9	167.9	45.8	0	0	0	0	113.5	E240	S222-E240 WeakPolarHBondContact OG-CG 3.15Å
223	N	84.9	Confident	95.1	Very high	109 Å²	109	48 Å²	48	58%	0.583	27%	0.273	S	S	*	.	S	Bend	trans	-110	-3.8	-169.7	-48.8	80.1	0	0	0	113.4	S221	S221-N223 PolarHBondContact OG-N 3.01Å
224	C	86.4	Confident	95.2	Very high	12 Å²	12	48 Å²	48	8%	0.081	26%	0.262	C	S	.	.	S	Bend	trans	-111	132	178.9	-53.7	0	0	0	0	109.5	A200 N219 S221 Q273	A200-C224 HydrophobicContact CB-CB 4.15Å; N219-C224 PolarHBondContact ND2-O 2.92Å; S221-C224 PolarHBondContact OG-SG 3.44Å; S221-C224 VanDerWaalsContact OG-SG 3.42Å; C224-Q273 VanDerWaalsContact SG-CA 3.6Å; C224-Q273 VanDerWaalsContact SG-CD 3.57Å; C224-Q273 PolarHBondContact SG-OE1 3.05Å
225	P	90.3	Very high	95.2	Very high	87 Å²	87	50 Å²	50	57%	0.565	27%	0.271	S	S	*	.			trans	-69.8	156.1	172.7	31	-34.6	0	0	0	111.2
226	N	96.7	Very high	95.2	Very high	28 Å²	28	49.6 Å²	49.6	15%	0.15	27%	0.27	C	S	.	.			trans	-75.3	146.8	163.4	-65.5	-12.5	0	0	0	108.8	N219 E229 Y234 S236	N219-N226 WeakPolarHBondContact CB-OD1 3.37Å; N219-N226 PolarHBondContact ND2-OD1 3.34Å; N226-E229 HydrophobicContact CB-CG 3.49Å; N226-E229 VanDerWaalsContact CB-CG 3.49Å; N226-E229 WeakPolarHBondContact CB-OE1 3.18Å; N226-E229 PolarHBondContact ND2-OE2 2.69Å; N226-Y234 HydrophobicContact CB-CD1 3.81Å; N226-Y234 HydrophobicContact CB-CE1 3.6Å; N226-Y234 HydrophobicContact CB-CE2 4.49Å; N226-Y234 HydrophobicContact CB-CG 4.34Å; N226-S236 PolarHBondContact ND2-OG 2.84Å; N226-S236 PolarHBondContact OD1-OG 2.86Å
227	H	94.3	Very high	95.2	Very high	62 Å²	62	49.6 Å²	49.6	29%	0.287	27%	0.27	S	S	.	.			trans	-120.1	140.3	179.2	-68.2	-74.9	0	0	0	109.7	E229 Y234	H227-E229 VanDerWaalsContact C-N 3.32Å; H227-E229 PolarHBondContact O-N 3.45Å; H227-Y234 PolarHBondContact N-OH 3.02Å; H227-Y234 VanDerWaalsContact N-OH 3.1Å; H227-Y234 WeakPolarHBondContact O-CE2 3.28Å; H227-Y234 VanDerWaalsContact O-CZ 3.29Å; H227-Y234 PolarHBondContact O-OH 3.27Å
228	F	96.1	Very high	95	Very high	74 Å²	74	53.3 Å²	53.3	33%	0.325	30%	0.295	S	S	.	.			trans	58.1	41.2	175.5	-34.2	-71.6	0	0	0	113.5	S204 K206 D230 S231 F232	S204-F228 WeakPolarHBondContact O-CZ 3.03Å; K206-F228 HydrophobicContact CB-CD1 4.13Å; K206-F228 HydrophobicContact CB-CD2 3.91Å; K206-F228 HydrophobicContact CB-CE1 3.8Å; K206-F228 HydrophobicContact CB-CE2 3.57Å; K206-F228 HydrophobicContact CB-CG 4.19Å; K206-F228 HydrophobicContact CB-CZ 3.53Å; K206-F228 HydrophobicContact CD-CB 4.4Å; K206-F228 HydrophobicContact CD-CD1 3.74Å; K206-F228 HydrophobicContact CD-CD2 4.47Å; K206-F228 HydrophobicContact CD-CE1 4.12Å; K206-F228 HydrophobicContact CD-CG 3.94Å; K206-F228 HydrophobicContact CG-CD1 4.46Å; K206-F228 HydrophobicContact CG-CD2 4.46Å; K206-F228 HydrophobicContact CG-CG 4.42Å; F228-D230 PolarHBondContact O-N 2.89Å; F228-D230 VanDerWaalsContact O-N 3.14Å; F228-S231 WeakPolarHBondContact O-CA 3.04Å; F228-S231 WeakPolarHBondContact O-CB 3.36Å; F228-S231 PolarHBondContact O-N 3.49Å; F228-F232 HydrophobicContact CB-CD2 3.81Å; F228-F232 HydrophobicContact CB-CE2 3.78Å; F228-F232 HydrophobicContact CD2-CE2 4.03Å; F228-F232 HydrophobicContact CG-CE2 4.23Å; F228-F232 PolarHBondContact O-N 2.83Å
229	E	94.8	Very high	94.9	Very high	114 Å²	114	53.7 Å²	53.7	53%	0.533	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.4	-179.1	-65	-172.4	-102.6	0	0	113.2	N226 H227 S231 Y234	N226-E229 HydrophobicContact CB-CG 3.49Å; N226-E229 VanDerWaalsContact CB-CG 3.49Å; N226-E229 WeakPolarHBondContact CB-OE1 3.18Å; N226-E229 PolarHBondContact ND2-OE2 2.69Å; H227-E229 VanDerWaalsContact C-N 3.32Å; H227-E229 PolarHBondContact O-N 3.45Å; E229-S231 VanDerWaalsContact C-N 3.26Å; E229-S231 PolarHBondContact O-N 2.74Å; E229-Y234 HydrophobicContact CB-CD2 4.43Å; E229-Y234 HydrophobicContact CG-CD2 3.98Å; E229-Y234 HydrophobicContact CG-CE2 4.18Å; E229-Y234 HydrophobicContact CG-CG 4.38Å
230	D	94.4	Very high	94.6	Very high	170 Å²	170	58.4 Å²	58.4	91%	0.909	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-15.7	173.8	-56.5	-44.1	0	0	0	113.2	F228	F228-D230 PolarHBondContact O-N 2.89Å; F228-D230 VanDerWaalsContact O-N 3.14Å
231	S	95.1	Very high	94.3	Very high	67 Å²	67	61.8 Å²	61.8	47%	0.469	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-23.6	-176.3	-61.1	0	0	0	0	114.1	F228 E229	F228-S231 WeakPolarHBondContact O-CA 3.04Å; F228-S231 WeakPolarHBondContact O-CB 3.36Å; F228-S231 PolarHBondContact O-N 3.49Å; E229-S231 VanDerWaalsContact C-N 3.26Å; E229-S231 PolarHBondContact O-N 2.74Å
232	F	97.6	Very high	94	Very high	14 Å²	14	63.8 Å²	63.8	6%	0.061	35%	0.347	C	S	.	.	S	Bend	trans	-132.4	147.6	-174.2	-55.4	-71.8	0	0	0	111.3	K206 L209 D210 I214 L217 F228 Y234	K206-F232 HydrophobicContact CG-CE2 4.47Å; K206-F232 HydrophobicContact CG-CZ 4.43Å; L209-F232 HydrophobicContact CB-CE1 4.25Å; L209-F232 HydrophobicContact CB-CE2 4.3Å; L209-F232 HydrophobicContact CB-CZ 3.68Å; L209-F232 HydrophobicContact CD1-CD2 4.46Å; L209-F232 HydrophobicContact CD1-CE2 3.8Å; L209-F232 HydrophobicContact CD1-CZ 4.04Å; D210-F232 VanDerWaalsContact OD1-CZ 3.25Å; D210-F232 WeakPolarHBondContact OD1-CZ 3.46Å; I214-F232 WeakPolarHBondContact O-CD1 3.21Å; I214-F232 WeakPolarHBondContact O-CE1 3.5Å; L217-F232 HydrophobicContact CD1-CB 3.33Å; L217-F232 HydrophobicContact CD1-CD1 3.95Å; L217-F232 HydrophobicContact CD1-CD2 3.72Å; L217-F232 HydrophobicContact CD1-CE2 4.49Å; L217-F232 HydrophobicContact CD1-CG 3.4Å; L217-F232 VanDerWaalsContact CD1-CG 3.4Å; F228-F232 HydrophobicContact CB-CD2 3.81Å; F228-F232 HydrophobicContact CB-CE2 3.78Å; F228-F232 HydrophobicContact CD2-CE2 4.03Å; F228-F232 HydrophobicContact CG-CE2 4.23Å; F228-F232 PolarHBondContact O-N 2.83Å; F232-Y234 HydrophobicContact CB-CD2 4.23Å; F232-Y234 HydrophobicContact CB-CE2 4.05Å; F232-Y234 WeakPolarHBondContact O-CD2 3.42Å; F232-Y234 PolarHBondContact O-N 2.91Å
233	L	97.9	Very high	93.6	Very high	101 Å²	101	67.7 Å²	67.7	53%	0.529	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	126.2	170.8	-179.3	68.2	0	0	0	109.9	T215 A216 L217 F257 V261	T215-L233 PolarHBondContact O-N 2.81Å; T215-L233 VanDerWaalsContact O-N 3.09Å; A216-L233 CarbonylContact C-O 3.54Å; A216-L233 WeakPolarHBondContact CA-O 3.4Å; A216-L233 HydrophobicContact CB-CB 3.96Å; A216-L233 HydrophobicContact CB-CD2 4.48Å; A216-L233 WeakPolarHBondContact CB-O 3.36Å; L217-L233 PolarHBondContact N-O 3.32Å; L233-F257 HydrophobicContact CD2-CE2 3.66Å; L233-F257 HydrophobicContact CD2-CZ 3.82Å; L233-F257 HydrophobicContact CG-CE2 3.84Å; L233-F257 HydrophobicContact CG-CZ 3.82Å; L233-V261 HydrophobicContact CD2-CG2 4.18Å
234	Y	97.8	Very high	93.8	Very high	33 Å²	33	70.9 Å²	70.9	13%	0.129	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	143	-176.9	-97.7	-90.8	0	0	0	113.9	L217 N226 H227 E229 F232	L217-Y234 HydrophobicContact CB-CD1 3.91Å; L217-Y234 HydrophobicContact CB-CD2 4.43Å; L217-Y234 HydrophobicContact CB-CE1 3.52Å; L217-Y234 HydrophobicContact CB-CE2 4.1Å; L217-Y234 HydrophobicContact CB-CG 4.36Å; L217-Y234 HydrophobicContact CD1-CE2 4.02Å; L217-Y234 HydrophobicContact CD2-CE1 4.27Å; L217-Y234 HydrophobicContact CD2-CE2 4.5Å; L217-Y234 VanDerWaalsContact CD2-OH 3.29Å; L217-Y234 WeakPolarHBondContact CD2-OH 3.26Å; L217-Y234 HydrophobicContact CG-CE1 4.37Å; L217-Y234 HydrophobicContact CG-CE2 4.41Å; L217-Y234 CarbonylContact O-C 3.57Å; L217-Y234 WeakPolarHBondContact O-CA 3.46Å; N226-Y234 HydrophobicContact CB-CD1 3.81Å; N226-Y234 HydrophobicContact CB-CE1 3.6Å; N226-Y234 HydrophobicContact CB-CE2 4.49Å; N226-Y234 HydrophobicContact CB-CG 4.34Å; H227-Y234 PolarHBondContact N-OH 3.02Å; H227-Y234 VanDerWaalsContact N-OH 3.1Å; H227-Y234 WeakPolarHBondContact O-CE2 3.28Å; H227-Y234 VanDerWaalsContact O-CZ 3.29Å; H227-Y234 PolarHBondContact O-OH 3.27Å; E229-Y234 HydrophobicContact CB-CD2 4.43Å; E229-Y234 HydrophobicContact CG-CD2 3.98Å; E229-Y234 HydrophobicContact CG-CE2 4.18Å; E229-Y234 HydrophobicContact CG-CG 4.38Å; F232-Y234 HydrophobicContact CB-CD2 4.23Å; F232-Y234 HydrophobicContact CB-CE2 4.05Å; F232-Y234 WeakPolarHBondContact O-CD2 3.42Å; F232-Y234 PolarHBondContact O-N 2.91Å
235	K	98.3	Very high	94.2	Very high	49 Å²	49	71.1 Å²	71.1	21%	0.213	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.4	162.6	-171.7	71.1	176.3	-170.7	0	109.6	L217 I218 N219 I237 E253 F257	L217-K235 PolarHBondContact O-N 3.2Å; I218-K235 CarbonylContact C-O 3.34Å; I218-K235 VanDerWaalsContact CA-O 3.29Å; I218-K235 WeakPolarHBondContact CA-O 3.44Å; I218-K235 HydrophobicContact CG1-CB 4.15Å; I218-K235 HydrophobicContact CG2-CB 4.34Å; I218-K235 HydrophobicContact CG2-CG 4.48Å; N219-K235 PolarHBondContact N-O 3.35Å; K235-I237 HydrophobicContact CG-CG1 4.36Å; K235-E253 WeakPolarHBondContact CE-OE1 3.49Å; K235-E253 IonicContact NZ-OE1 2.58Å; K235-E253 PolarHBondContact NZ-OE1 3.41Å; K235-F257 HydrophobicContact CB-CD1 4.05Å; K235-F257 HydrophobicContact CB-CD2 3.93Å; K235-F257 HydrophobicContact CB-CE1 3.95Å; K235-F257 HydrophobicContact CB-CE2 3.84Å; K235-F257 HydrophobicContact CB-CG 4.02Å; K235-F257 HydrophobicContact CB-CZ 3.83Å; K235-F257 HydrophobicContact CD-CD2 4.13Å; K235-F257 HydrophobicContact CG-CD2 4.3Å; K235-F257 HydrophobicContact CG-CG 4.29Å
236	S	98.1	Very high	94.5	Very high	57 Å²	57	70.8 Å²	70.8	40%	0.399	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.3	175.2	-62.8	0	0	0	0	110.5	N226	N226-S236 PolarHBondContact ND2-OG 2.84Å; N226-S236 PolarHBondContact OD1-OG 2.86Å
237	I	97.9	Very high	94.6	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.357	C	S	.	.			trans	-119.1	91.2	176.1	-63.2	173.7	0	0	0	106.4	I218 N219 V220 S221 K235 V239 W250 A254	I218-I237 HydrophobicContact CG2-CD1 3.61Å; I218-I237 HydrophobicContact CG2-CG1 4.18Å; N219-I237 PolarHBondContact O-N 2.68Å; V220-I237 CarbonylContact C-O 3.58Å; V220-I237 WeakPolarHBondContact CA-O 3.06Å; V220-I237 HydrophobicContact CG1-CB 4.23Å; V220-I237 HydrophobicContact CG1-CG2 3.96Å; S221-I237 PolarHBondContact N-O 2.79Å; K235-I237 HydrophobicContact CG-CG1 4.36Å; I237-V239 HydrophobicContact CG2-CB 4.37Å; I237-V239 HydrophobicContact CG2-CG2 3.59Å; I237-V239 PolarHBondContact O-N 3.05Å; I237-W250 HydrophobicContact CB-CD2 4.48Å; I237-W250 HydrophobicContact CB-CE3 4.49Å; I237-W250 HydrophobicContact CD1-CB 4.33Å; I237-W250 HydrophobicContact CG1-CD2 4.41Å; I237-W250 HydrophobicContact CG1-CE3 4.02Å; I237-W250 HydrophobicContact CG2-CB 3.78Å; I237-W250 HydrophobicContact CG2-CD2 3.68Å; I237-W250 HydrophobicContact CG2-CE3 4.15Å; I237-W250 HydrophobicContact CG2-CG 3.5Å; I237-W250 VanDerWaalsContact CG2-CG 3.5Å; I237-A254 HydrophobicContact CD1-CB 3.74Å
238	P	96.3	Very high	94.7	Very high	79 Å²	79	68.2 Å²	68.2	51%	0.513	36%	0.355	S	S	.	.			trans	-78	73.4	-169.3	32.4	-36	0	0	0	111.3
239	V	94.8	Very high	94.8	Very high	7 Å²	7	67.9 Å²	67.9	4%	0.042	36%	0.362	C	S	.	.			trans	-110.3	132	-177	171.3	0	0	0	0	110.3	I237 A245 I247 R278 F315	I237-V239 HydrophobicContact CG2-CB 4.37Å; I237-V239 HydrophobicContact CG2-CG2 3.59Å; I237-V239 PolarHBondContact O-N 3.05Å; V239-A245 HydrophobicContact CG1-CB 4.03Å; V239-I247 HydrophobicContact CG1-CB 4.05Å; V239-I247 HydrophobicContact CG1-CD1 4.21Å; V239-I247 HydrophobicContact CG1-CG1 4.14Å; V239-I247 HydrophobicContact CG2-CG1 4.45Å; V239-R278 HydrophobicContact CG1-CG 4.42Å; V239-R278 WeakPolarHBondContact O-CD 3.47Å; V239-R278 PolarHBondContact O-NH1 3.37Å; V239-F315 HydrophobicContact CG1-CZ 3.9Å
240	E	93.6	Very high	95	Very high	102 Å²	102	65.7 Å²	65.7	48%	0.477	35%	0.349	S	S	.	.			trans	-82.2	149.3	171.7	-66.7	-173.1	173	0	0	111.4	S222 N242 A245 F315	S222-E240 WeakPolarHBondContact OG-CG 3.15Å; E240-N242 VanDerWaalsContact C-N 3.3Å; E240-N242 VanDerWaalsContact CB-ND2 3.32Å; E240-N242 WeakPolarHBondContact CB-ND2 2.9Å; E240-N242 PolarHBondContact O-N 3.35Å; E240-N242 VanDerWaalsContact O-N 3.11Å; E240-N242 PolarHBondContact OE2-ND2 2.81Å; E240-A245 WeakPolarHBondContact O-CB 3.49Å; E240-F315 WeakPolarHBondContact O-CZ 3.37Å
241	D	91.8	Very high	95.2	Very high	72 Å²	72	57.6 Å²	57.6	39%	0.385	31%	0.306	S	S	.	.	S	Bend	trans	-89.2	66.7	179	-163.3	12.8	0	0	0	111.3	S277 R278 N312	D241-S277 VanDerWaalsContact OD1-CB 3.29Å; D241-S277 WeakPolarHBondContact OD1-CB 3.44Å; D241-S277 PolarHBondContact OD1-OG 3.16Å; D241-S277 WeakPolarHBondContact OD2-CB 3.49Å; D241-S277 PolarHBondContact OD2-OG 3.47Å; D241-R278 HydrophobicContact CB-CG 4.06Å; D241-N312 PolarHBondContact OD1-ND2 2.77Å
242	N	88.4	Confident	95.3	Very high	48 Å²	48	58.1 Å²	58.1	26%	0.257	30%	0.303	S	S	.	.	S	Bend	trans	-141.1	169.3	178.9	70.3	56.9	0	0	0	111.5	E240 K244 A245	E240-N242 VanDerWaalsContact C-N 3.3Å; E240-N242 VanDerWaalsContact CB-ND2 3.32Å; E240-N242 WeakPolarHBondContact CB-ND2 2.9Å; E240-N242 PolarHBondContact O-N 3.35Å; E240-N242 VanDerWaalsContact O-N 3.11Å; E240-N242 PolarHBondContact OE2-ND2 2.81Å; N242-K244 PolarHBondContact O-N 3.1Å; N242-K244 WeakPolarHBondContact OD1-CA 3.42Å; N242-K244 WeakPolarHBondContact OD1-CB 3.31Å; N242-K244 PolarHBondContact OD1-N 3.39Å; N242-A245 PolarHBondContact O-N 2.84Å; N242-A245 PolarHBondContact OD1-N 3.3Å
243	H	80.9	Confident	95.3	Very high	136 Å²	136	61 Å²	61	63%	0.63	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.1	-173.8	61	-87.3	0	0	0	114.5	S314	H243-S314 WeakPolarHBondContact O-CB 3.42Å; H243-S314 PolarHBondContact O-OG 3.01Å
244	K	89.2	Confident	95.3	Very high	176 Å²	176	56.1 Å²	56.1	77%	0.765	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-17.4	-179.1	-57.7	-176.4	178.8	178.1	0	112.9	N242	N242-K244 PolarHBondContact O-N 3.1Å; N242-K244 WeakPolarHBondContact OD1-CA 3.42Å; N242-K244 WeakPolarHBondContact OD1-CB 3.31Å; N242-K244 PolarHBondContact OD1-N 3.39Å
245	A	94.1	Very high	95.3	Very high	18 Å²	18	55 Å²	55	15%	0.149	29%	0.287	C	S	.	.			trans	-72.6	132.1	-177.3	0	0	0	0	0	110.9	V239 E240 N242 F315 Q318	V239-A245 HydrophobicContact CG1-CB 4.03Å; E240-A245 WeakPolarHBondContact O-CB 3.49Å; N242-A245 PolarHBondContact O-N 2.84Å; N242-A245 PolarHBondContact OD1-N 3.3Å; A245-F315 HydrophobicContact CB-CE1 4.06Å; A245-F315 HydrophobicContact CB-CZ 4.23Å; A245-Q318 PolarHBondContact O-NE2 2.95Å
246	D	96.4	Very high	95.3	Very high	79 Å²	79	59 Å²	59	42%	0.422	31%	0.307	S	S	.	.			trans	-94.1	102.1	169.5	175.5	26.3	0	0	0	109	S248 S249 Q318	D246-S248 WeakPolarHBondContact OD1-CB 3.47Å; D246-S248 PolarHBondContact OD1-N 2.88Å; D246-S248 PolarHBondContact OD1-OG 3Å; D246-S249 VanDerWaalsContact CG-OG 3.31Å; D246-S249 PolarHBondContact O-OG 3.41Å; D246-S249 PolarHBondContact OD1-N 3.47Å; D246-S249 WeakPolarHBondContact OD2-CB 3.47Å; D246-S249 PolarHBondContact OD2-OG 3.11Å; D246-Q318 PolarHBondContact OD1-OE1 2.85Å
247	I	98.1	Very high	95.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.294	C	S	.	.			trans	-90.2	-19.3	174.6	-165.3	168.5	0	0	0	111.2	V220 V239 S249 W250 F251 R278 T281 I282 F315	V220-I247 HydrophobicContact CG1-CD1 3.99Å; V239-I247 HydrophobicContact CG1-CB 4.05Å; V239-I247 HydrophobicContact CG1-CD1 4.21Å; V239-I247 HydrophobicContact CG1-CG1 4.14Å; V239-I247 HydrophobicContact CG2-CG1 4.45Å; I247-S249 VanDerWaalsContact C-N 3.35Å; I247-S249 PolarHBondContact O-N 2.86Å; I247-W250 WeakPolarHBondContact O-CB 3.29Å; I247-W250 PolarHBondContact O-N 2.89Å; I247-W250 VanDerWaalsContact O-N 3.15Å; I247-F251 HydrophobicContact CG1-CE1 4.17Å; I247-F251 HydrophobicContact CG2-CE1 3.98Å; I247-F251 HydrophobicContact CG2-CZ 4.06Å; I247-F251 WeakPolarHBondContact O-CD1 3.28Å; I247-F251 WeakPolarHBondContact O-CE1 3.49Å; I247-R278 HydrophobicContact CD1-CB 4.27Å; I247-R278 HydrophobicContact CD1-CG 4.45Å; I247-T281 HydrophobicContact CD1-CG2 4.11Å; I247-T281 HydrophobicContact CG2-CG2 3.87Å; I247-I282 HydrophobicContact CD1-CD1 4.18Å; I247-I282 HydrophobicContact CD1-CG1 4.36Å; I247-I282 HydrophobicContact CG1-CD1 4.04Å; I247-F315 HydrophobicContact CB-CD1 4.08Å; I247-F315 HydrophobicContact CB-CE1 3.79Å; I247-F315 HydrophobicContact CB-CZ 4.11Å; I247-F315 HydrophobicContact CD1-CD2 4.36Å; I247-F315 HydrophobicContact CD1-CE2 4.08Å; I247-F315 HydrophobicContact CD1-CZ 4.23Å; I247-F315 HydrophobicContact CG2-CB 4.3Å; I247-F315 HydrophobicContact CG2-CD1 3.32Å; I247-F315 HydrophobicContact CG2-CD2 4.3Å; I247-F315 HydrophobicContact CG2-CE1 3.58Å; I247-F315 HydrophobicContact CG2-CG 3.72Å; I247-F315 HydrophobicContact CG2-CZ 4.19Å
248	S	97.8	Very high	95.3	Very high	36 Å²	36	57.6 Å²	57.6	25%	0.252	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-67.7	-33.1	-175	73	0	0	0	0	113.6	D246 W250 F251	D246-S248 WeakPolarHBondContact OD1-CB 3.47Å; D246-S248 PolarHBondContact OD1-N 2.88Å; D246-S248 PolarHBondContact OD1-OG 3Å; S248-W250 PolarHBondContact O-N 3.15Å; S248-W250 VanDerWaalsContact O-N 3.15Å; S248-F251 WeakPolarHBondContact O-CB 3.15Å; S248-F251 WeakPolarHBondContact O-CG 3.29Å; S248-F251 PolarHBondContact O-N 2.92Å; S248-F251 VanDerWaalsContact O-N 3.07Å
249	S	97.8	Very high	95.3	Very high	68 Å²	68	55.9 Å²	55.9	48%	0.476	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.8	-24.1	173.8	43	0	0	0	0	113.2	D246 I247	D246-S249 VanDerWaalsContact CG-OG 3.31Å; D246-S249 PolarHBondContact O-OG 3.41Å; D246-S249 PolarHBondContact OD1-N 3.47Å; D246-S249 WeakPolarHBondContact OD2-CB 3.47Å; D246-S249 PolarHBondContact OD2-OG 3.11Å; I247-S249 VanDerWaalsContact C-N 3.35Å; I247-S249 PolarHBondContact O-N 2.86Å
250	W	98.4	Very high	95.4	Very high	68 Å²	68	58.4 Å²	58.4	26%	0.258	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-91.1	-7.6	179.3	-62.7	94.2	0	0	0	114.1	I237 I247 S248 N252 E253 A254	I237-W250 HydrophobicContact CB-CD2 4.48Å; I237-W250 HydrophobicContact CB-CE3 4.49Å; I237-W250 HydrophobicContact CD1-CB 4.33Å; I237-W250 HydrophobicContact CG1-CD2 4.41Å; I237-W250 HydrophobicContact CG1-CE3 4.02Å; I237-W250 HydrophobicContact CG2-CB 3.78Å; I237-W250 HydrophobicContact CG2-CD2 3.68Å; I237-W250 HydrophobicContact CG2-CE3 4.15Å; I237-W250 HydrophobicContact CG2-CG 3.5Å; I237-W250 VanDerWaalsContact CG2-CG 3.5Å; I247-W250 WeakPolarHBondContact O-CB 3.29Å; I247-W250 PolarHBondContact O-N 2.89Å; I247-W250 VanDerWaalsContact O-N 3.15Å; S248-W250 PolarHBondContact O-N 3.15Å; S248-W250 VanDerWaalsContact O-N 3.15Å; W250-N252 PolarHBondContact O-N 3.34Å; W250-E253 WeakPolarHBondContact CZ3-OE2 3.4Å; W250-E253 PolarHBondContact O-N 3.42Å; W250-A254 WeakPolarHBondContact O-CB 3.43Å; W250-A254 PolarHBondContact O-N 2.98Å
251	F	98.4	Very high	95.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.4	-51	-173.6	-70.1	-15.8	0	0	0	112.2	I247 S248 E253 A254 I255 T281 I282 A285 L319 F322	I247-F251 HydrophobicContact CG1-CE1 4.17Å; I247-F251 HydrophobicContact CG2-CE1 3.98Å; I247-F251 HydrophobicContact CG2-CZ 4.06Å; I247-F251 WeakPolarHBondContact O-CD1 3.28Å; I247-F251 WeakPolarHBondContact O-CE1 3.49Å; S248-F251 WeakPolarHBondContact O-CB 3.15Å; S248-F251 WeakPolarHBondContact O-CG 3.29Å; S248-F251 PolarHBondContact O-N 2.92Å; S248-F251 VanDerWaalsContact O-N 3.07Å; F251-E253 VanDerWaalsContact C-N 3.34Å; F251-E253 PolarHBondContact O-N 3.43Å; F251-A254 PolarHBondContact O-N 2.89Å; F251-I255 HydrophobicContact CB-CD1 4.34Å; F251-I255 WeakPolarHBondContact O-CB 3.31Å; F251-I255 WeakPolarHBondContact O-CD1 3.48Å; F251-I255 WeakPolarHBondContact O-CG1 3.29Å; F251-I255 PolarHBondContact O-N 3.41Å; F251-T281 HydrophobicContact CE1-CG2 3.8Å; F251-T281 HydrophobicContact CZ-CG2 3.77Å; F251-I282 HydrophobicContact CD1-CD1 3.85Å; F251-I282 HydrophobicContact CE1-CD1 4.09Å; F251-A285 HydrophobicContact CB-CB 4.23Å; F251-A285 HydrophobicContact CD1-CB 3.66Å; F251-A285 HydrophobicContact CD2-CB 3.87Å; F251-A285 HydrophobicContact CE1-CB 3.87Å; F251-A285 HydrophobicContact CE2-CB 4.08Å; F251-A285 HydrophobicContact CG-CB 3.66Å; F251-A285 HydrophobicContact CZ-CB 4.07Å; F251-L319 HydrophobicContact CE2-CD2 4.06Å; F251-L319 HydrophobicContact CZ-CD2 3.74Å; F251-L319 HydrophobicContact CZ-CG 4.27Å; F251-F322 HydrophobicContact CB-CD2 4.46Å; F251-F322 HydrophobicContact CB-CE1 4.49Å; F251-F322 HydrophobicContact CB-CE2 4.03Å; F251-F322 HydrophobicContact CB-CZ 4.04Å; F251-F322 HydrophobicContact CD2-CB 3.84Å; F251-F322 AromaticContact CD2-CD1 3.76Å; F251-F322 HydrophobicContact CD2-CD1 3.76Å; F251-F322 AromaticContact CD2-CD2 3.65Å; F251-F322 HydrophobicContact CD2-CD2 3.65Å; F251-F322 HydrophobicContact CD2-CE1 4.15Å; F251-F322 HydrophobicContact CD2-CE2 4.04Å; F251-F322 AromaticContact CD2-CG 3.47Å; F251-F322 HydrophobicContact CD2-CG 3.47Å; F251-F322 VanDerWaalsContact CD2-CG 3.47Å; F251-F322 HydrophobicContact CD2-CZ 4.27Å; F251-F322 HydrophobicContact CE2-CB 3.76Å; F251-F322 HydrophobicContact CE2-CD1 4.16Å; F251-F322 HydrophobicContact CE2-CD2 4.44Å; F251-F322 AromaticContact CE2-CG 3.89Å; F251-F322 HydrophobicContact CE2-CG 3.89Å
252	N	96.8	Very high	95.5	Very high	78 Å²	78	55.7 Å²	55.7	42%	0.417	28%	0.279	S	S	.	.	H	α-helix	trans	-61.7	-44.3	-177.9	-67.7	-38.3	0	0	0	111.7	W250 A254 I255 E256	W250-N252 PolarHBondContact O-N 3.34Å; N252-A254 PolarHBondContact O-N 3.29Å; N252-I255 PolarHBondContact O-N 2.98Å; N252-E256 WeakPolarHBondContact O-CB 3.33Å; N252-E256 VanDerWaalsContact O-CG 3.31Å; N252-E256 WeakPolarHBondContact O-CG 3.33Å; N252-E256 PolarHBondContact O-N 3.5Å
253	E	98.1	Very high	95.6	Very high	73 Å²	73	59.1 Å²	59.1	34%	0.341	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-40.3	-179.6	-172.7	177.6	177.2	0	0	112.5	K235 W250 F251 F257	K235-E253 WeakPolarHBondContact CE-OE1 3.49Å; K235-E253 IonicContact NZ-OE1 2.58Å; K235-E253 PolarHBondContact NZ-OE1 3.41Å; W250-E253 WeakPolarHBondContact CZ3-OE2 3.4Å; W250-E253 PolarHBondContact O-N 3.42Å; F251-E253 VanDerWaalsContact C-N 3.34Å; F251-E253 PolarHBondContact O-N 3.43Å; E253-F257 WeakPolarHBondContact O-CB 3.42Å; E253-F257 PolarHBondContact O-N 3.42Å; E253-F257 VanDerWaalsContact O-N 3.08Å
254	A	98.6	Very high	96.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-42.1	173.7	0	0	0	0	0	111.5	I218 I237 W250 F251 N252 F257 I258 I282	I218-A254 HydrophobicContact CD1-CB 4.46Å; I237-A254 HydrophobicContact CD1-CB 3.74Å; W250-A254 WeakPolarHBondContact O-CB 3.43Å; W250-A254 PolarHBondContact O-N 2.98Å; F251-A254 PolarHBondContact O-N 2.89Å; N252-A254 PolarHBondContact O-N 3.29Å; A254-F257 PolarHBondContact O-N 3.07Å; A254-I258 VanDerWaalsContact O-CG1 3.25Å; A254-I258 WeakPolarHBondContact O-CG1 3.45Å; A254-I258 PolarHBondContact O-N 2.8Å; A254-I282 HydrophobicContact CB-CD1 4.2Å; A254-I282 HydrophobicContact CB-CG2 3.78Å
255	I	98.2	Very high	95.9	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.041	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-46.6	-179.9	-68.2	161.1	0	0	0	111	F251 N252 F257 I258 D259 Y286 R289 T290 F322	F251-I255 HydrophobicContact CB-CD1 4.34Å; F251-I255 WeakPolarHBondContact O-CB 3.31Å; F251-I255 WeakPolarHBondContact O-CD1 3.48Å; F251-I255 WeakPolarHBondContact O-CG1 3.29Å; F251-I255 PolarHBondContact O-N 3.41Å; N252-I255 PolarHBondContact O-N 2.98Å; I255-F257 VanDerWaalsContact C-N 3.3Å; I255-F257 PolarHBondContact O-N 3.45Å; I255-I258 PolarHBondContact O-N 3.49Å; I255-I258 VanDerWaalsContact O-N 3.17Å; I255-D259 PolarHBondContact O-N 2.78Å; I255-Y286 HydrophobicContact CB-CD2 4.17Å; I255-Y286 HydrophobicContact CG1-CD2 3.96Å; I255-Y286 HydrophobicContact CG2-CD2 3.92Å; I255-Y286 HydrophobicContact CG2-CE2 4.12Å; I255-R289 HydrophobicContact CD1-CB 3.71Å; I255-R289 HydrophobicContact CD1-CG 3.93Å; I255-R289 HydrophobicContact CG2-CG 4.11Å; I255-T290 HydrophobicContact CG2-CG2 4.32Å; I255-F322 HydrophobicContact CD1-CE1 4.27Å; I255-F322 HydrophobicContact CD1-CZ 3.85Å
256	E	97.7	Very high	95.8	Very high	135 Å²	135	53.7 Å²	53.7	63%	0.631	30%	0.298	S	S	*	.	H	α-helix	trans	-60.9	-39.5	176.8	-74.5	170.8	-168.7	0	0	111.8	N252 D259 S260	N252-E256 WeakPolarHBondContact O-CB 3.33Å; N252-E256 VanDerWaalsContact O-CG 3.31Å; N252-E256 WeakPolarHBondContact O-CG 3.33Å; N252-E256 PolarHBondContact O-N 3.5Å; E256-D259 PolarHBondContact O-N 3.46Å; E256-S260 VanDerWaalsContact O-CB 3.28Å; E256-S260 WeakPolarHBondContact O-CB 3.48Å; E256-S260 PolarHBondContact O-N 3.06Å
257	F	98.6	Very high	95.9	Very high	26 Å²	26	54.6 Å²	54.6	11%	0.114	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-45	173.8	-176.7	-91.8	0	0	0	111.8	A216 I218 L233 K235 E253 A254 I255 S260 V261 V268	A216-F257 HydrophobicContact CB-CE1 3.92Å; A216-F257 HydrophobicContact CB-CZ 3.93Å; I218-F257 HydrophobicContact CD1-CD1 3.69Å; I218-F257 HydrophobicContact CD1-CE1 4.31Å; I218-F257 HydrophobicContact CG1-CD1 3.65Å; I218-F257 HydrophobicContact CG1-CE1 3.75Å; L233-F257 HydrophobicContact CD2-CE2 3.66Å; L233-F257 HydrophobicContact CD2-CZ 3.82Å; L233-F257 HydrophobicContact CG-CE2 3.84Å; L233-F257 HydrophobicContact CG-CZ 3.82Å; K235-F257 HydrophobicContact CB-CD1 4.05Å; K235-F257 HydrophobicContact CB-CD2 3.93Å; K235-F257 HydrophobicContact CB-CE1 3.95Å; K235-F257 HydrophobicContact CB-CE2 3.84Å; K235-F257 HydrophobicContact CB-CG 4.02Å; K235-F257 HydrophobicContact CB-CZ 3.83Å; K235-F257 HydrophobicContact CD-CD2 4.13Å; K235-F257 HydrophobicContact CG-CD2 4.3Å; K235-F257 HydrophobicContact CG-CG 4.29Å; E253-F257 WeakPolarHBondContact O-CB 3.42Å; E253-F257 PolarHBondContact O-N 3.42Å; E253-F257 VanDerWaalsContact O-N 3.08Å; A254-F257 PolarHBondContact O-N 3.07Å; I255-F257 VanDerWaalsContact C-N 3.3Å; I255-F257 PolarHBondContact O-N 3.45Å; F257-S260 PolarHBondContact O-N 3.36Å; F257-V261 HydrophobicContact CD1-CG2 4.38Å; F257-V261 HydrophobicContact CE1-CG2 4.07Å; F257-V261 HydrophobicContact CZ-CG2 4.27Å; F257-V261 WeakPolarHBondContact O-CG2 3.39Å; F257-V261 PolarHBondContact O-N 3.14Å; F257-V261 VanDerWaalsContact O-N 3.09Å; F257-V268 HydrophobicContact CE1-CG1 4.4Å
258	I	98.4	Very high	95.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.8	-47.1	177.8	-65	163.1	0	0	0	110.8	F194 L195 I218 A254 I255 S260 V261 R262 V268 V270 I282 Y286	F194-I258 HydrophobicContact CD2-CG2 4.15Å; F194-I258 HydrophobicContact CE2-CG2 3.81Å; L195-I258 HydrophobicContact CD1-CD1 3.99Å; L195-I258 HydrophobicContact CD1-CG1 4.33Å; L195-I258 HydrophobicContact CD1-CG2 4.28Å; I218-I258 HydrophobicContact CD1-CD1 4.07Å; I218-I258 HydrophobicContact CD1-CG1 3.7Å; A254-I258 VanDerWaalsContact O-CG1 3.25Å; A254-I258 WeakPolarHBondContact O-CG1 3.45Å; A254-I258 PolarHBondContact O-N 2.8Å; I255-I258 PolarHBondContact O-N 3.49Å; I255-I258 VanDerWaalsContact O-N 3.17Å; I258-S260 VanDerWaalsContact C-N 3.34Å; I258-S260 PolarHBondContact O-N 3.15Å; I258-V261 PolarHBondContact O-N 3.25Å; I258-R262 VanDerWaalsContact O-CB 3.31Å; I258-R262 WeakPolarHBondContact O-CB 3.29Å; I258-R262 PolarHBondContact O-N 3.32Å; I258-V268 HydrophobicContact CG1-CG1 4.23Å; I258-V268 HydrophobicContact CG2-CG2 4.48Å; I258-V270 HydrophobicContact CD1-CG2 4.42Å; I258-I282 HydrophobicContact CD1-CG2 4.4Å; I258-Y286 HydrophobicContact CB-CD2 3.9Å; I258-Y286 HydrophobicContact CB-CE2 3.63Å; I258-Y286 HydrophobicContact CD1-CD2 3.67Å; I258-Y286 HydrophobicContact CD1-CE2 4.3Å; I258-Y286 HydrophobicContact CD1-CG 3.99Å; I258-Y286 HydrophobicContact CG1-CD2 4.38Å; I258-Y286 HydrophobicContact CG2-CD2 3.86Å; I258-Y286 HydrophobicContact CG2-CE1 4.14Å; I258-Y286 HydrophobicContact CG2-CE2 3.35Å; I258-Y286 HydrophobicContact CG2-CG 4.47Å
259	D	95.1	Very high	96	Very high	43 Å²	43	52.9 Å²	52.9	23%	0.23	28%	0.283	C	S	.	.	H	α-helix	trans	-64.4	-39	179.5	-79.7	-21.1	0	0	0	111.8	I255 E256 R262 N263 Y286	I255-D259 PolarHBondContact O-N 2.78Å; E256-D259 PolarHBondContact O-N 3.46Å; D259-R262 PolarHBondContact O-N 3.17Å; D259-N263 VanDerWaalsContact O-CB 3.28Å; D259-N263 WeakPolarHBondContact O-CB 3.41Å; D259-N263 PolarHBondContact O-N 2.63Å; D259-N263 PolarHBondContact O-ND2 2.74Å; D259-N263 VanDerWaalsContact O-ND2 3.13Å; D259-N263 PolarHBondContact O-OD1 2.76Å; D259-Y286 WeakPolarHBondContact OD1-CE2 3.19Å; D259-Y286 PolarHBondContact OD1-OH 2.87Å
260	S	96.4	Very high	96	Very high	61 Å²	61	49.6 Å²	49.6	43%	0.427	26%	0.261	S	S	.	.	H	α-helix	trans	-59.2	-49.1	174.9	179.9	0	0	0	0	111.9	E256 F257 I258 N263 N264	E256-S260 VanDerWaalsContact O-CB 3.28Å; E256-S260 WeakPolarHBondContact O-CB 3.48Å; E256-S260 PolarHBondContact O-N 3.06Å; F257-S260 PolarHBondContact O-N 3.36Å; I258-S260 VanDerWaalsContact C-N 3.34Å; I258-S260 PolarHBondContact O-N 3.15Å; S260-N263 PolarHBondContact O-N 3.13Å; S260-N264 PolarHBondContact O-N 3.06Å; S260-N264 PolarHBondContact O-ND2 3.08Å; S260-N264 VanDerWaalsContact O-ND2 3.1Å
261	V	95.8	Very high	96	Very high	6 Å²	6	46.4 Å²	46.4	4%	0.036	25%	0.249	C	C	.	.	H	α-helix	trans	-64.4	-43.9	178.4	175.2	0	0	0	0	111	A216 L233 F257 I258 N263 N264 G265 G266 V268	A216-V261 HydrophobicContact CB-CB 4.4Å; A216-V261 HydrophobicContact CB-CG1 3.97Å; A216-V261 HydrophobicContact CB-CG2 3.57Å; L233-V261 HydrophobicContact CD2-CG2 4.18Å; F257-V261 HydrophobicContact CD1-CG2 4.38Å; F257-V261 HydrophobicContact CE1-CG2 4.07Å; F257-V261 HydrophobicContact CZ-CG2 4.27Å; F257-V261 WeakPolarHBondContact O-CG2 3.39Å; F257-V261 PolarHBondContact O-N 3.14Å; F257-V261 VanDerWaalsContact O-N 3.09Å; I258-V261 PolarHBondContact O-N 3.25Å; V261-N263 PolarHBondContact O-N 2.73Å; V261-N264 CarbonylContact O-C 3.6Å; V261-N264 PolarHBondContact O-N 3.42Å; V261-G265 PolarHBondContact O-N 3.03Å; V261-G266 WeakPolarHBondContact O-CA 3.4Å; V261-G266 PolarHBondContact O-N 3.18Å; V261-V268 HydrophobicContact CB-CG2 3.45Å; V261-V268 VanDerWaalsContact CB-CG2 3.45Å; V261-V268 HydrophobicContact CG1-CG2 3.45Å; V261-V268 VanDerWaalsContact CG1-CG2 3.45Å; V261-V268 HydrophobicContact CG2-CG2 3.89Å
262	R	92.5	Very high	96	Very high	110 Å²	110	46.5 Å²	46.5	42%	0.415	25%	0.249	S	C	.	.	H	α-helix	trans	-58.4	-46.6	176.7	178.3	-164.6	177.1	-151.1	-11	111.9	F194 I258 D259 N264 G265	F194-R262 HydrophobicContact CB-CG 4.44Å; F194-R262 HydrophobicContact CD1-CG 3.79Å; F194-R262 HydrophobicContact CD2-CB 3.77Å; F194-R262 HydrophobicContact CD2-CG 3.8Å; F194-R262 HydrophobicContact CE1-CG 3.96Å; F194-R262 HydrophobicContact CE2-CB 4.09Å; F194-R262 HydrophobicContact CE2-CG 3.97Å; F194-R262 HydrophobicContact CG-CB 4.07Å; F194-R262 HydrophobicContact CG-CG 3.72Å; F194-R262 HydrophobicContact CZ-CG 4.05Å; I258-R262 VanDerWaalsContact O-CB 3.31Å; I258-R262 WeakPolarHBondContact O-CB 3.29Å; I258-R262 PolarHBondContact O-N 3.32Å; D259-R262 PolarHBondContact O-N 3.17Å; R262-N264 PolarHBondContact O-N 3.17Å; R262-G265 PolarHBondContact O-N 3.35Å
263	N	89.6	Confident	95.7	Very high	121 Å²	121	46.8 Å²	46.8	65%	0.647	25%	0.248	S	C	*	.	H	α-helix	trans	-65.2	-25	-178.4	-69.5	-20.3	0	0	0	112.1	D259 S260 V261 G265	D259-N263 VanDerWaalsContact O-CB 3.28Å; D259-N263 WeakPolarHBondContact O-CB 3.41Å; D259-N263 PolarHBondContact O-N 2.63Å; D259-N263 PolarHBondContact O-ND2 2.74Å; D259-N263 VanDerWaalsContact O-ND2 3.13Å; D259-N263 PolarHBondContact O-OD1 2.76Å; S260-N263 PolarHBondContact O-N 3.13Å; V261-N263 PolarHBondContact O-N 2.73Å; N263-G265 VanDerWaalsContact C-N 3.28Å
264	N	91.7	Very high	95.3	Very high	135 Å²	135	44.2 Å²	44.2	72%	0.722	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	10	172.9	-64.6	-32.2	0	0	0	113.3	S260 V261 R262 G266	S260-N264 PolarHBondContact O-N 3.06Å; S260-N264 PolarHBondContact O-ND2 3.08Å; S260-N264 VanDerWaalsContact O-ND2 3.1Å; V261-N264 CarbonylContact O-C 3.6Å; V261-N264 PolarHBondContact O-N 3.42Å; R262-N264 PolarHBondContact O-N 3.17Å; N264-G266 PolarHBondContact O-N 3.35Å
265	G	85.4	Confident	95.1	Very high	71 Å²	71	44.2 Å²	44.2	73%	0.732	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.6	11.2	-179.7	0	0	0	0	0	114.7	V261 R262 N263	V261-G265 PolarHBondContact O-N 3.03Å; R262-G265 PolarHBondContact O-N 3.35Å; N263-G265 VanDerWaalsContact C-N 3.28Å
266	G	93.2	Very high	94.7	Very high	9 Å²	9	46 Å²	46	9%	0.093	25%	0.248	C	C	.	.			trans	-85	178.9	179.7	0	0	0	0	0	113.8	T215 V261 N264	T215-G266 VanDerWaalsContact OG1-CA 3.25Å; T215-G266 WeakPolarHBondContact OG1-CA 3.48Å; V261-G266 WeakPolarHBondContact O-CA 3.4Å; V261-G266 PolarHBondContact O-N 3.18Å; N264-G266 PolarHBondContact O-N 3.35Å
267	R	97.8	Very high	94.6	Very high	98 Å²	98	39.7 Å²	39.7	37%	0.37	22%	0.219	S	C	.	.			trans	-130.3	135.4	177.4	-54.8	-179.7	176.9	-165.9	-6.5	110.5	F194 Y196 L212 G213 I214 T215 A216	F194-R267 CarbonylContact O-C 3.54Å; F194-R267 WeakPolarHBondContact O-CA 3.47Å; Y196-R267 HydrophobicContact CE2-CB 4.44Å; Y196-R267 PolarHBondContact OH-NH1 3.14Å; L212-R267 VanDerWaalsContact O-CD 3.25Å; L212-R267 WeakPolarHBondContact O-CD 3.44Å; L212-R267 PolarHBondContact O-NH1 3.48Å; G213-R267 WeakPolarHBondContact O-CB 3.24Å; G213-R267 WeakPolarHBondContact O-CD 3.26Å; I214-R267 HydrophobicContact CD1-CB 4.06Å; T215-R267 PolarHBondContact N-O 3.35Å; T215-R267 PolarHBondContact OG1-N 2.9Å; T215-R267 PolarHBondContact OG1-O 3.39Å; A216-R267 PolarHBondContact N-O 2.58Å; A216-R267 VanDerWaalsContact N-O 3.09Å
268	V	98.8	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.2	-176.8	-174.7	0	0	0	0	110.2	F194 L195 Y196 A216 I218 F257 I258 V261 V270	F194-V268 PolarHBondContact O-N 3.34Å; L195-V268 WeakPolarHBondContact CA-O 2.95Å; L195-V268 HydrophobicContact CD1-CB 4.42Å; Y196-V268 PolarHBondContact N-O 3.46Å; A216-V268 HydrophobicContact CB-CG2 4.35Å; A216-V268 CarbonylContact O-C 3.58Å; A216-V268 VanDerWaalsContact O-CA 3.31Å; A216-V268 WeakPolarHBondContact O-CA 3.45Å; I218-V268 HydrophobicContact CD1-CG1 4.11Å; I218-V268 HydrophobicContact CG1-CG1 3.81Å; F257-V268 HydrophobicContact CE1-CG1 4.4Å; I258-V268 HydrophobicContact CG1-CG1 4.23Å; I258-V268 HydrophobicContact CG2-CG2 4.48Å; V261-V268 HydrophobicContact CB-CG2 3.45Å; V261-V268 VanDerWaalsContact CB-CG2 3.45Å; V261-V268 HydrophobicContact CG1-CG2 3.45Å; V261-V268 VanDerWaalsContact CG1-CG2 3.45Å; V261-V268 HydrophobicContact CG2-CG2 3.89Å; V268-V270 HydrophobicContact CG1-CG2 4.04Å
269	F	98.8	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.4	168.1	176.9	-119.1	0	0	0	110.8	P188 G198 H202 A203 L209 I214 A216 L217 I218 H271	P188-F269 HydrophobicContact CB-CD2 3.94Å; P188-F269 HydrophobicContact CB-CE2 3.56Å; P188-F269 HydrophobicContact CB-CZ 4.38Å; P188-F269 HydrophobicContact CG-CD2 4.24Å; P188-F269 HydrophobicContact CG-CE2 3.72Å; P188-F269 HydrophobicContact CG-CZ 4.08Å; G198-F269 VanDerWaalsContact N-CE2 3.28Å; H202-F269 HydrophobicContact CB-CE1 4.3Å; H202-F269 HydrophobicContact CB-CZ 3.73Å; A203-F269 HydrophobicContact CB-CE1 3.88Å; L209-F269 HydrophobicContact CD2-CB 4.38Å; L209-F269 HydrophobicContact CD2-CD1 3.71Å; L209-F269 HydrophobicContact CD2-CE1 4.2Å; L209-F269 HydrophobicContact CD2-CG 4.09Å; I214-F269 HydrophobicContact CD1-CB 3.96Å; I214-F269 HydrophobicContact CG1-CB 4.12Å; I214-F269 HydrophobicContact CG2-CB 3.82Å; A216-F269 PolarHBondContact O-N 2.87Å; L217-F269 CarbonylContact C-O 3.35Å; L217-F269 VanDerWaalsContact CA-O 3.28Å; L217-F269 WeakPolarHBondContact CA-O 3.25Å; L217-F269 HydrophobicContact CD2-CD1 3.7Å; L217-F269 HydrophobicContact CD2-CE1 4.5Å; L217-F269 HydrophobicContact CG-CB 4.25Å; L217-F269 HydrophobicContact CG-CD1 4.23Å; I218-F269 PolarHBondContact N-O 3.23Å; F269-H271 HydrophobicContact CD1-CB 4.27Å; F269-H271 HydrophobicContact CE1-CB 3.59Å; F269-H271 HydrophobicContact CZ-CB 3.77Å
270	V	98.8	Very high	94.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.6	177.6	-172.4	0	0	0	0	108.9	L195 Y196 L197 G198 I218 V220 I258 V268 I282	L195-V270 HydrophobicContact CD1-CG2 3.57Å; Y196-V270 PolarHBondContact O-N 3.38Å; L197-V270 WeakPolarHBondContact CA-O 3.39Å; G198-V270 PolarHBondContact N-O 3.42Å; G198-V270 VanDerWaalsContact N-O 3.15Å; I218-V270 HydrophobicContact CB-CB 4.47Å; I218-V270 HydrophobicContact CB-CG1 4.2Å; I218-V270 HydrophobicContact CB-CG2 4.19Å; I218-V270 HydrophobicContact CD1-CG2 4.06Å; I218-V270 HydrophobicContact CG1-CG2 4.25Å; V220-V270 HydrophobicContact CG2-CG1 3.77Å; I258-V270 HydrophobicContact CD1-CG2 4.42Å; V268-V270 HydrophobicContact CG1-CG2 4.04Å; V270-I282 HydrophobicContact CG1-CB 4.12Å; V270-I282 HydrophobicContact CG1-CG2 4.07Å
271	H	98.4	Very high	94.9	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	160.6	-180	77.7	93	0	0	0	112.5	G198 I218 N219 V220 F269 S279	G198-H271 WeakPolarHBondContact O-CA 3.32Å; G198-H271 WeakPolarHBondContact O-CB 3.12Å; I218-H271 PolarHBondContact O-CD2 3.49Å; I218-H271 PolarHBondContact O-N 2.92Å; N219-H271 WeakPolarHBondContact CB-NE2 3.09Å; N219-H271 VanDerWaalsContact CG-CE1 3.49Å; N219-H271 PolarHBondContact OD1-CE1 3.44Å; V220-H271 PolarHBondContact N-O 2.89Å; F269-H271 HydrophobicContact CD1-CB 4.27Å; F269-H271 HydrophobicContact CE1-CB 3.59Å; F269-H271 HydrophobicContact CZ-CB 3.77Å; H271-S279 VanDerWaalsContact C-CB 3.48Å
272	C	96.9	Very high	95	Very high	2 Å²	2	34 Å²	34	1%	0.014	18%	0.184	C	C	.	.			trans	-136.5	-157.5	164.7	69.3	0	0	0	0	107.2	S199 A200 V220 G275 R278 S279	S199-C272 CarbonylContact C-O 3.54Å; A200-C272 PolarHBondContact N-O 3.16Å; V220-C272 HydrophobicContact CB-CB 4.37Å; V220-C272 WeakPolarHBondContact O-CB 3.48Å; C272-G275 PolarHBondContact SG-N 2.84Å; C272-R278 HydrophobicContact CB-CB 3.74Å; C272-S279 PolarHBondContact SG-OG 3.45Å
273	Q	91.8	Very high	95.3	Very high	83 Å²	83	28.7 Å²	28.7	39%	0.388	16%	0.164	S	C	.	.	S	Bend	trans	-57.9	-58.9	176.7	-175.2	68.6	61.5	0	0	112.7	S199 A200 C224 R278	S199-Q273 WeakPolarHBondContact CB-O 3.39Å; A200-Q273 PolarHBondContact N-O 3.15Å; C224-Q273 VanDerWaalsContact SG-CA 3.6Å; C224-Q273 VanDerWaalsContact SG-CD 3.57Å; C224-Q273 PolarHBondContact SG-OE1 3.05Å; Q273-R278 VanDerWaalsContact CB-NH2 3.33Å
274	A	89	Confident	95.8	Very high	19 Å²	19	23 Å²	23	16%	0.157	13%	0.133	C	C	.	.	S	Bend	trans	-108.9	-9.1	-171.6	0	0	0	0	0	114.2	Y183 I276 R306	Y183-A274 HydrophobicContact CD1-CB 4.4Å; Y183-A274 HydrophobicContact CD2-CB 3.98Å; Y183-A274 HydrophobicContact CE1-CB 4.37Å; Y183-A274 HydrophobicContact CE2-CB 3.97Å; Y183-A274 HydrophobicContact CG-CB 4.21Å; A274-I276 VanDerWaalsContact C-N 3.31Å; A274-I276 HydrophobicContact CB-CB 4.45Å; A274-I276 HydrophobicContact CB-CD1 3.87Å; A274-I276 HydrophobicContact CB-CG1 4.06Å; A274-I276 PolarHBondContact O-N 3.45Å; A274-R306 PolarHBondContact O-NH2 3.03Å; A274-R306 VanDerWaalsContact O-NH2 3.14Å
275	G	93.9	Very high	96.1	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	66.1	31.2	-174.6	0	0	0	0	0	114	G198 C272 S279 R306	G198-G275 WeakPolarHBondContact O-CA 2.76Å; C272-G275 PolarHBondContact SG-N 2.84Å; G275-S279 WeakPolarHBondContact CA-OG 3.36Å; G275-R306 PolarHBondContact O-NE 2.68Å
276	I	90.3	Very high	96.7	Very high	46 Å²	46	13.2 Å²	13.2	24%	0.236	6%	0.064	C	C	.	.	S	Bend	trans	-109.8	-49.9	-175.2	-69.3	172.7	0	0	0	111.6	Y183 A274 A280 I308 I309 S310	Y183-I276 HydrophobicContact CD1-CD1 4.19Å; Y183-I276 HydrophobicContact CG-CD1 4.34Å; A274-I276 VanDerWaalsContact C-N 3.31Å; A274-I276 HydrophobicContact CB-CB 4.45Å; A274-I276 HydrophobicContact CB-CD1 3.87Å; A274-I276 HydrophobicContact CB-CG1 4.06Å; A274-I276 PolarHBondContact O-N 3.45Å; I276-A280 WeakPolarHBondContact O-CB 3.43Å; I276-I308 HydrophobicContact CD1-CD1 4.48Å; I276-I308 HydrophobicContact CG1-CD1 4Å; I276-I308 HydrophobicContact CG1-CG1 4.37Å; I276-I308 WeakPolarHBondContact CG2-O 3.42Å; I276-I309 WeakPolarHBondContact O-CA 3.5Å; I276-S310 CarbonylContact O-C 3.59Å; I276-S310 PolarHBondContact O-N 3.3Å
277	S	96.3	Very high	96.8	Very high	3 Å²	3	13 Å²	13	2%	0.021	6%	0.061	C	C	.	.	S	Bend	trans	-111.3	-82.7	-170.9	172.6	0	0	0	0	111.7	D241 S279 A280 T281 N312 F315	D241-S277 VanDerWaalsContact OD1-CB 3.29Å; D241-S277 WeakPolarHBondContact OD1-CB 3.44Å; D241-S277 PolarHBondContact OD1-OG 3.16Å; D241-S277 WeakPolarHBondContact OD2-CB 3.49Å; D241-S277 PolarHBondContact OD2-OG 3.47Å; S277-S279 PolarHBondContact O-N 2.88Å; S277-A280 WeakPolarHBondContact O-CB 3.48Å; S277-A280 PolarHBondContact O-N 3.2Å; S277-A280 VanDerWaalsContact O-N 3.08Å; S277-T281 PolarHBondContact O-N 3.08Å; S277-T281 PolarHBondContact O-OG1 3.28Å; S277-N312 PolarHBondContact OG-N 2.93Å; S277-N312 VanDerWaalsContact OG-N 3.12Å; S277-F315 WeakPolarHBondContact OG-CD2 3.48Å
278	R	98.5	Very high	96.6	Very high	14 Å²	14	8.3 Å²	8.3	5%	0.053	4%	0.043	C	C	.	.	H	α-helix	trans	-46.7	-56.8	-174.6	-69.5	171.4	-69.9	-169	-10.8	115.7	V220 S221 V239 D241 I247 C272 Q273 A280 T281 I282 F315	V220-R278 HydrophobicContact CB-CB 4.16Å; V220-R278 HydrophobicContact CG1-CB 3.84Å; V220-R278 WeakPolarHBondContact O-CD 3.49Å; V220-R278 PolarHBondContact O-NE 3.07Å; S221-R278 PolarHBondContact OG-NH1 2.86Å; V239-R278 HydrophobicContact CG1-CG 4.42Å; V239-R278 WeakPolarHBondContact O-CD 3.47Å; V239-R278 PolarHBondContact O-NH1 3.37Å; D241-R278 HydrophobicContact CB-CG 4.06Å; I247-R278 HydrophobicContact CD1-CB 4.27Å; I247-R278 HydrophobicContact CD1-CG 4.45Å; C272-R278 HydrophobicContact CB-CB 3.74Å; Q273-R278 VanDerWaalsContact CB-NH2 3.33Å; R278-A280 PolarHBondContact O-N 2.81Å; R278-T281 WeakPolarHBondContact O-CB 3.33Å; R278-T281 PolarHBondContact O-N 3.5Å; R278-I282 PolarHBondContact O-N 2.84Å; R278-F315 HydrophobicContact CB-CE2 4.41Å; R278-F315 HydrophobicContact CG-CE2 3.54Å; R278-F315 HydrophobicContact CG-CZ 4.09Å
279	S	98.5	Very high	96.3	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-67.7	-35.5	-179.2	49.7	0	0	0	0	112.7	L197 H271 C272 G275 S277 T281 I282 C283	L197-S279 VanDerWaalsContact CD1-CB 3.49Å; L197-S279 VanDerWaalsContact CD1-OG 3.24Å; L197-S279 WeakPolarHBondContact CD1-OG 3.46Å; H271-S279 VanDerWaalsContact C-CB 3.48Å; C272-S279 PolarHBondContact SG-OG 3.45Å; G275-S279 WeakPolarHBondContact CA-OG 3.36Å; S277-S279 PolarHBondContact O-N 2.88Å; S279-T281 VanDerWaalsContact C-N 3.33Å; S279-I282 PolarHBondContact O-N 3.45Å; S279-C283 PolarHBondContact O-N 3.15Å; S279-C283 VanDerWaalsContact O-N 3.11Å; S279-C283 PolarHBondContact O-SG 3.2Å; S279-C283 VanDerWaalsContact O-SG 3.41Å
280	A	98.3	Very high	95.7	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.8	-41.9	173.4	0	0	0	0	0	111	L197 I276 S277 R278 I282 C283 L284 I309	L197-A280 HydrophobicContact CD2-CB 4.2Å; I276-A280 WeakPolarHBondContact O-CB 3.43Å; S277-A280 WeakPolarHBondContact O-CB 3.48Å; S277-A280 PolarHBondContact O-N 3.2Å; S277-A280 VanDerWaalsContact O-N 3.08Å; R278-A280 PolarHBondContact O-N 2.81Å; A280-I282 VanDerWaalsContact C-N 3.33Å; A280-I282 PolarHBondContact O-N 3.28Å; A280-C283 WeakPolarHBondContact O-CB 3.44Å; A280-C283 PolarHBondContact O-N 3.02Å; A280-C283 VanDerWaalsContact O-N 3.15Å; A280-L284 VanDerWaalsContact O-CG 3.27Å; A280-L284 WeakPolarHBondContact O-CG 3.16Å; A280-L284 PolarHBondContact O-N 2.81Å; A280-I309 HydrophobicContact CB-CB 4.02Å; A280-I309 HydrophobicContact CB-CG2 3.78Å
281	T	98.6	Very high	94.9	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-56.2	-44.9	175	-53.9	0	0	0	0	112	I247 F251 S277 R278 S279 L284 A285 F315 L319	I247-T281 HydrophobicContact CD1-CG2 4.11Å; I247-T281 HydrophobicContact CG2-CG2 3.87Å; F251-T281 HydrophobicContact CE1-CG2 3.8Å; F251-T281 HydrophobicContact CZ-CG2 3.77Å; S277-T281 PolarHBondContact O-N 3.08Å; S277-T281 PolarHBondContact O-OG1 3.28Å; R278-T281 WeakPolarHBondContact O-CB 3.33Å; R278-T281 PolarHBondContact O-N 3.5Å; S279-T281 VanDerWaalsContact C-N 3.33Å; T281-L284 PolarHBondContact O-N 2.81Å; T281-A285 WeakPolarHBondContact O-CB 3.06Å; T281-A285 PolarHBondContact O-N 3.28Å; T281-F315 HydrophobicContact CG2-CB 4Å; T281-F315 HydrophobicContact CG2-CG 4.4Å; T281-L319 HydrophobicContact CG2-CD1 3.81Å; T281-L319 HydrophobicContact CG2-CD2 3.87Å; T281-L319 HydrophobicContact CG2-CG 3.79Å
282	I	98.8	Very high	94.1	Very high	1 Å²	1	20 Å²	20	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-62	-44.7	176.1	-64.3	-57.1	0	0	0	111.1	V220 I247 F251 A254 I258 V270 R278 S279 A280 L284 A285 Y286	V220-I282 HydrophobicContact CG1-CG1 3.95Å; V220-I282 HydrophobicContact CG2-CG1 3.81Å; I247-I282 HydrophobicContact CD1-CD1 4.18Å; I247-I282 HydrophobicContact CD1-CG1 4.36Å; I247-I282 HydrophobicContact CG1-CD1 4.04Å; F251-I282 HydrophobicContact CD1-CD1 3.85Å; F251-I282 HydrophobicContact CE1-CD1 4.09Å; A254-I282 HydrophobicContact CB-CD1 4.2Å; A254-I282 HydrophobicContact CB-CG2 3.78Å; I258-I282 HydrophobicContact CD1-CG2 4.4Å; V270-I282 HydrophobicContact CG1-CB 4.12Å; V270-I282 HydrophobicContact CG1-CG2 4.07Å; R278-I282 PolarHBondContact O-N 2.84Å; S279-I282 PolarHBondContact O-N 3.45Å; A280-I282 VanDerWaalsContact C-N 3.33Å; A280-I282 PolarHBondContact O-N 3.28Å; I282-L284 VanDerWaalsContact C-N 3.33Å; I282-L284 PolarHBondContact O-N 3.14Å; I282-A285 PolarHBondContact O-N 3.34Å; I282-Y286 WeakPolarHBondContact O-CB 3.27Å; I282-Y286 PolarHBondContact O-N 3.4Å
283	C	98.7	Very high	93.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.2	-40.1	176.4	-66.1	0	0	0	0	112.4	S279 A280 Y286 L287	S279-C283 PolarHBondContact O-N 3.15Å; S279-C283 VanDerWaalsContact O-N 3.11Å; S279-C283 PolarHBondContact O-SG 3.2Å; S279-C283 VanDerWaalsContact O-SG 3.41Å; A280-C283 WeakPolarHBondContact O-CB 3.44Å; A280-C283 PolarHBondContact O-N 3.02Å; A280-C283 VanDerWaalsContact O-N 3.15Å; C283-Y286 PolarHBondContact O-N 3.32Å; C283-L287 WeakPolarHBondContact O-CG 3.49Å; C283-L287 PolarHBondContact O-N 3.32Å
284	L	98.5	Very high	93.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.3	-45.9	176.9	-66.9	170.3	0	0	0	111.6	A280 T281 I282 Y286 L287 M288 L295 A298 F299 V302 P311 L319	A280-L284 VanDerWaalsContact O-CG 3.27Å; A280-L284 WeakPolarHBondContact O-CG 3.16Å; A280-L284 PolarHBondContact O-N 2.81Å; T281-L284 PolarHBondContact O-N 2.81Å; I282-L284 VanDerWaalsContact C-N 3.33Å; I282-L284 PolarHBondContact O-N 3.14Å; L284-Y286 VanDerWaalsContact C-N 3.3Å; L284-Y286 PolarHBondContact O-N 3.21Å; L284-L287 PolarHBondContact O-N 2.81Å; L284-M288 WeakPolarHBondContact O-CG 3.32Å; L284-M288 PolarHBondContact O-N 3.28Å; L284-L295 HydrophobicContact CB-CD1 4.48Å; L284-L295 HydrophobicContact CD1-CD1 4.47Å; L284-A298 HydrophobicContact CD2-CB 3.92Å; L284-A298 VanDerWaalsContact CD2-O 3.29Å; L284-A298 WeakPolarHBondContact CD2-O 3.18Å; L284-F299 HydrophobicContact CD1-CD2 4.05Å; L284-F299 HydrophobicContact CD2-CB 4.32Å; L284-V302 HydrophobicContact CD2-CB 4.22Å; L284-V302 HydrophobicContact CD2-CG2 3.78Å; L284-P311 HydrophobicContact CD1-CG 3.85Å; L284-L319 HydrophobicContact CB-CD1 4.14Å; L284-L319 HydrophobicContact CB-CD2 4.09Å; L284-L319 HydrophobicContact CD1-CD1 3.78Å
285	A	98.4	Very high	93.4	Very high	1 Å²	1	21 Å²	21	1%	0.008	9%	0.093	C	C	.	.	H	α-helix	trans	-58.7	-43.7	175.2	0	0	0	0	0	111.3	F251 T281 I282 M288 R289 L319 F322	F251-A285 HydrophobicContact CB-CB 4.23Å; F251-A285 HydrophobicContact CD1-CB 3.66Å; F251-A285 HydrophobicContact CD2-CB 3.87Å; F251-A285 HydrophobicContact CE1-CB 3.87Å; F251-A285 HydrophobicContact CE2-CB 4.08Å; F251-A285 HydrophobicContact CG-CB 3.66Å; F251-A285 HydrophobicContact CZ-CB 4.07Å; T281-A285 WeakPolarHBondContact O-CB 3.06Å; T281-A285 PolarHBondContact O-N 3.28Å; I282-A285 PolarHBondContact O-N 3.34Å; A285-M288 PolarHBondContact O-N 3.44Å; A285-R289 WeakPolarHBondContact O-CB 3.44Å; A285-R289 PolarHBondContact O-N 3.15Å; A285-L319 HydrophobicContact CB-CD2 3.98Å; A285-F322 HydrophobicContact CB-CD1 4.11Å; A285-F322 HydrophobicContact CB-CE1 3.91Å; A285-F322 WeakPolarHBondContact O-CE1 3.08Å
286	Y	98.4	Very high	92.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57	-54.8	175.1	-176	-96.4	0	0	0	111.6	L192 F194 L195 I255 I258 D259 I282 C283 L284 M288 R289 T290	L192-Y286 HydrophobicContact CD1-CD1 4.28Å; L192-Y286 HydrophobicContact CD1-CE1 3.8Å; F194-Y286 AromaticContact CE2-CE1 3.85Å; F194-Y286 HydrophobicContact CE2-CE1 3.85Å; F194-Y286 AromaticContact CE2-CZ 3.79Å; F194-Y286 VanDerWaalsContact CE2-OH 3.29Å; F194-Y286 WeakPolarHBondContact CE2-OH 3.47Å; F194-Y286 AromaticContact CZ-CE1 3.93Å; F194-Y286 HydrophobicContact CZ-CE1 3.93Å; F194-Y286 WeakPolarHBondContact CZ-OH 3.08Å; L195-Y286 HydrophobicContact CD2-CD1 3.69Å; L195-Y286 HydrophobicContact CD2-CE1 4.21Å; L195-Y286 HydrophobicContact CD2-CG 4.29Å; I255-Y286 HydrophobicContact CB-CD2 4.17Å; I255-Y286 HydrophobicContact CG1-CD2 3.96Å; I255-Y286 HydrophobicContact CG2-CD2 3.92Å; I255-Y286 HydrophobicContact CG2-CE2 4.12Å; I258-Y286 HydrophobicContact CB-CD2 3.9Å; I258-Y286 HydrophobicContact CB-CE2 3.63Å; I258-Y286 HydrophobicContact CD1-CD2 3.67Å; I258-Y286 HydrophobicContact CD1-CE2 4.3Å; I258-Y286 HydrophobicContact CD1-CG 3.99Å; I258-Y286 HydrophobicContact CG1-CD2 4.38Å; I258-Y286 HydrophobicContact CG2-CD2 3.86Å; I258-Y286 HydrophobicContact CG2-CE1 4.14Å; I258-Y286 HydrophobicContact CG2-CE2 3.35Å; I258-Y286 HydrophobicContact CG2-CG 4.47Å; D259-Y286 WeakPolarHBondContact OD1-CE2 3.19Å; D259-Y286 PolarHBondContact OD1-OH 2.87Å; I282-Y286 WeakPolarHBondContact O-CB 3.27Å; I282-Y286 PolarHBondContact O-N 3.4Å; C283-Y286 PolarHBondContact O-N 3.32Å; L284-Y286 VanDerWaalsContact C-N 3.3Å; L284-Y286 PolarHBondContact O-N 3.21Å; Y286-M288 PolarHBondContact O-N 3.39Å; Y286-R289 PolarHBondContact O-N 2.94Å; Y286-R289 VanDerWaalsContact O-N 3.08Å; Y286-T290 HydrophobicContact CD2-CG2 4.08Å; Y286-T290 HydrophobicContact CE1-CG2 4.16Å; Y286-T290 WeakPolarHBondContact CE1-OG1 3.33Å; Y286-T290 HydrophobicContact CE2-CG2 3.59Å; Y286-T290 PolarHBondContact O-N 3.27Å; Y286-T290 PolarHBondContact O-OG1 2.76Å
287	L	95.3	Very high	92.2	Very high	5 Å²	5	27.9 Å²	27.9	3%	0.026	13%	0.128	C	C	.	.	H	α-helix	trans	-57.4	-45.5	179.8	-69	171.5	0	0	0	112.4	I191 L192 C283 L284 R289 N291 V293 A298 F301 V302	I191-L287 HydrophobicContact CG2-CD1 4.14Å; L192-L287 HydrophobicContact CD1-CD2 3.93Å; L192-L287 HydrophobicContact CD2-CD2 4.28Å; L192-L287 HydrophobicContact CG-CD2 4.23Å; C283-L287 WeakPolarHBondContact O-CG 3.49Å; C283-L287 PolarHBondContact O-N 3.32Å; L284-L287 PolarHBondContact O-N 2.81Å; L287-R289 VanDerWaalsContact C-N 3.32Å; L287-R289 PolarHBondContact O-N 3.32Å; L287-N291 WeakPolarHBondContact O-CA 3.41Å; L287-N291 WeakPolarHBondContact O-CB 3.24Å; L287-N291 PolarHBondContact O-N 3.36Å; L287-N291 PolarHBondContact O-OD1 3.23Å; L287-V293 HydrophobicContact CB-CG2 4.44Å; L287-A298 HydrophobicContact CB-CB 4.11Å; L287-A298 HydrophobicContact CD1-CB 4.41Å; L287-F301 HydrophobicContact CD1-CD1 3.68Å; L287-F301 HydrophobicContact CD1-CE1 4.17Å; L287-F301 HydrophobicContact CD2-CE1 4.36Å; L287-V302 HydrophobicContact CD1-CG2 3.55Å
288	M	94.6	Very high	92	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-42.6	176.9	-70.9	-170.8	-70.8	0	0	111.8	L284 A285 Y286 R292 L295 A298 L319 F322 E323 V326	L284-M288 WeakPolarHBondContact O-CG 3.32Å; L284-M288 PolarHBondContact O-N 3.28Å; A285-M288 PolarHBondContact O-N 3.44Å; Y286-M288 PolarHBondContact O-N 3.39Å; M288-R292 WeakPolarHBondContact O-CA 3.47Å; M288-R292 PolarHBondContact O-N 2.62Å; M288-L295 HydrophobicContact CE-CD1 4.01Å; M288-L295 HydrophobicContact SD-CB 3.66Å; M288-L295 HydrophobicContact SD-CD1 3.99Å; M288-L295 HydrophobicContact SD-CG 4.37Å; M288-A298 HydrophobicContact CG-CB 4.17Å; M288-L319 HydrophobicContact CE-CB 4.08Å; M288-L319 HydrophobicContact CE-CD2 3.49Å; M288-L319 VanDerWaalsContact CE-CD2 3.49Å; M288-L319 HydrophobicContact CE-CG 4.36Å; M288-F322 HydrophobicContact CE-CD1 4.04Å; M288-E323 HydrophobicContact SD-CB 3.78Å; M288-E323 HydrophobicContact SD-CG 4.19Å; M288-V326 WeakPolarHBondContact O-CG1 3.37Å
289	R	91.9	Very high	91.4	Very high	95 Å²	95	29.3 Å²	29.3	36%	0.358	14%	0.135	S	C	.	.	H	α-helix	trans	-68.1	-53.5	-179.9	-177	63	166.5	177	-3.2	113	I255 A285 Y286 L287 F322 V326	I255-R289 HydrophobicContact CD1-CB 3.71Å; I255-R289 HydrophobicContact CD1-CG 3.93Å; I255-R289 HydrophobicContact CG2-CG 4.11Å; A285-R289 WeakPolarHBondContact O-CB 3.44Å; A285-R289 PolarHBondContact O-N 3.15Å; Y286-R289 PolarHBondContact O-N 2.94Å; Y286-R289 VanDerWaalsContact O-N 3.08Å; L287-R289 VanDerWaalsContact C-N 3.32Å; L287-R289 PolarHBondContact O-N 3.32Å; R289-F322 HydrophobicContact CB-CE1 4.3Å; R289-F322 HydrophobicContact CB-CZ 4.3Å; R289-V326 HydrophobicContact CB-CG1 4.44Å
290	T	84.9	Confident	90.6	Very high	29 Å²	29	34.2 Å²	34.2	18%	0.178	16%	0.157	C	C	.	.	H	α-helix	trans	-84.4	-25.3	-170.5	54	0	0	0	0	113.2	R61 I255 Y286	R61-T290 PolarHBondContact NH1-O 3.39Å; R61-T290 VanDerWaalsContact NH1-O 3.11Å; I255-T290 HydrophobicContact CG2-CG2 4.32Å; Y286-T290 HydrophobicContact CD2-CG2 4.08Å; Y286-T290 HydrophobicContact CE1-CG2 4.16Å; Y286-T290 WeakPolarHBondContact CE1-OG1 3.33Å; Y286-T290 HydrophobicContact CE2-CG2 3.59Å; Y286-T290 PolarHBondContact O-N 3.27Å; Y286-T290 PolarHBondContact O-OG1 2.76Å
291	N	81.9	Confident	89.8	Confident	22 Å²	22	34.5 Å²	34.5	12%	0.118	16%	0.159	C	C	.	.	H	α-helix	trans	-108.7	-7.2	-177.2	-52.7	80.4	0	0	0	112.8	F46 L287 V293	F46-N291 HydrophobicContact CD1-CB 4.43Å; F46-N291 HydrophobicContact CE1-CB 4.48Å; F46-N291 WeakPolarHBondContact CE1-ND2 3.47Å; F46-N291 WeakPolarHBondContact CE2-ND2 3.35Å; F46-N291 WeakPolarHBondContact CZ-ND2 3.37Å; L287-N291 WeakPolarHBondContact O-CA 3.41Å; L287-N291 WeakPolarHBondContact O-CB 3.24Å; L287-N291 PolarHBondContact O-N 3.36Å; L287-N291 PolarHBondContact O-OD1 3.23Å; N291-V293 HydrophobicContact CB-CG1 4.2Å; N291-V293 HydrophobicContact CB-CG2 4.3Å; N291-V293 PolarHBondContact O-N 3.06Å; N291-V293 VanDerWaalsContact O-N 3.16Å
292	R	83.6	Confident	89.4	Confident	99 Å²	99	34.5 Å²	34.5	37%	0.374	16%	0.159	S	C	.	.			trans	53.8	31.8	179.2	-57.4	-63.3	-166.7	106.1	7.8	112.7	M288 L327 S330	M288-R292 WeakPolarHBondContact O-CA 3.47Å; M288-R292 PolarHBondContact O-N 2.62Å; R292-L327 HydrophobicContact CB-CD2 4.49Å; R292-S330 PolarHBondContact NH1-OG 3.27Å; R292-S330 VanDerWaalsContact NH1-OG 3.12Å
293	V	80.6	Confident	88.7	Confident	18 Å²	18	37.6 Å²	37.6	11%	0.109	17%	0.172	C	C	.	.			trans	-89.1	158.2	173	-65	0	0	0	0	109.7	L287 N291 E297 A298	L287-V293 HydrophobicContact CB-CG2 4.44Å; N291-V293 HydrophobicContact CB-CG1 4.2Å; N291-V293 HydrophobicContact CB-CG2 4.3Å; N291-V293 PolarHBondContact O-N 3.06Å; N291-V293 VanDerWaalsContact O-N 3.16Å; V293-E297 HydrophobicContact CB-CB 4.22Å; V293-A298 HydrophobicContact CG2-CB 4.04Å
294	K	88.6	Confident	87.9	Confident	100 Å²	100	44.5 Å²	44.5	44%	0.435	20%	0.204	S	C	.	.			trans	-74.2	165.3	172.8	-71.9	-175.4	-178.7	-179.9	0	111.8	D296 E297 A298 E323 L327	K294-D296 WeakPolarHBondContact CB-OD1 3.34Å; K294-D296 PolarHBondContact O-N 2.88Å; K294-E297 PolarHBondContact O-N 2.99Å; K294-A298 WeakPolarHBondContact O-CB 3.27Å; K294-A298 PolarHBondContact O-N 2.98Å; K294-E323 WeakPolarHBondContact CA-OE1 3.2Å; K294-E323 WeakPolarHBondContact CB-OE1 3.49Å; K294-E323 WeakPolarHBondContact CG-OE1 3.34Å; K294-L327 HydrophobicContact CG-CD1 4.2Å
295	L	92.9	Very high	87.4	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-40.8	179.4	178.6	54.7	0	0	0	112.4	L284 M288 A298 F299 M316 L319 L320 E323	L284-L295 HydrophobicContact CB-CD1 4.48Å; L284-L295 HydrophobicContact CD1-CD1 4.47Å; M288-L295 HydrophobicContact CE-CD1 4.01Å; M288-L295 HydrophobicContact SD-CB 3.66Å; M288-L295 HydrophobicContact SD-CD1 3.99Å; M288-L295 HydrophobicContact SD-CG 4.37Å; L295-A298 PolarHBondContact O-N 3.3Å; L295-F299 WeakPolarHBondContact O-CB 3.49Å; L295-F299 PolarHBondContact O-N 2.89Å; L295-M316 HydrophobicContact CD1-SD 4.36Å; L295-M316 HydrophobicContact CD2-SD 3.61Å; L295-M316 HydrophobicContact CG-SD 4.19Å; L295-L319 HydrophobicContact CD1-CB 3.87Å; L295-L319 HydrophobicContact CD1-CD1 3.93Å; L295-L319 HydrophobicContact CD1-CG 4.38Å; L295-L319 HydrophobicContact CD2-CB 3.7Å; L295-L319 HydrophobicContact CG-CB 4.44Å; L295-L320 HydrophobicContact CD2-CD2 3.66Å; L295-L320 HydrophobicContact CD2-CG 3.68Å; L295-E323 PolarHBondContact N-OE1 3.37Å
296	D	80.4	Confident	86.9	Confident	97 Å²	97	49 Å²	49	52%	0.519	22%	0.221	S	C	.	.	H	α-helix	trans	-60.6	-47.1	177.4	58.7	-18.4	0	0	0	111.7	K294 F299 E300	K294-D296 WeakPolarHBondContact CB-OD1 3.34Å; K294-D296 PolarHBondContact O-N 2.88Å; D296-F299 PolarHBondContact O-N 2.79Å; D296-E300 PolarHBondContact O-N 2.96Å
297	E	79.6	Confident	86.3	Confident	93 Å²	93	53.1 Å²	53.1	44%	0.435	25%	0.25	S	C	.	.	H	α-helix	trans	-62.9	-45.2	176.3	-67.1	175.4	-153.8	0	0	112.1	V293 K294 F299 F301	V293-E297 HydrophobicContact CB-CB 4.22Å; K294-E297 PolarHBondContact O-N 2.99Å; E297-F299 VanDerWaalsContact C-N 3.33Å; E297-F299 PolarHBondContact O-N 3.31Å; E297-F301 WeakPolarHBondContact O-CB 3.45Å; E297-F301 PolarHBondContact O-N 3.47Å; E297-F301 VanDerWaalsContact O-N 3.15Å
298	A	91.1	Very high	85.7	Confident	2 Å²	2	55.3 Å²	55.3	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-40.9	176.4	0	0	0	0	0	111.5	L284 L287 M288 V293 K294 L295 F301 V302	L284-A298 HydrophobicContact CD2-CB 3.92Å; L284-A298 VanDerWaalsContact CD2-O 3.29Å; L284-A298 WeakPolarHBondContact CD2-O 3.18Å; L287-A298 HydrophobicContact CB-CB 4.11Å; L287-A298 HydrophobicContact CD1-CB 4.41Å; M288-A298 HydrophobicContact CG-CB 4.17Å; V293-A298 HydrophobicContact CG2-CB 4.04Å; K294-A298 WeakPolarHBondContact O-CB 3.27Å; K294-A298 PolarHBondContact O-N 2.98Å; L295-A298 PolarHBondContact O-N 3.3Å; A298-F301 PolarHBondContact O-N 3.48Å; A298-V302 WeakPolarHBondContact O-CG2 3.21Å; A298-V302 PolarHBondContact O-N 3.5Å; A298-V302 VanDerWaalsContact O-N 3.14Å
299	F	86.9	Confident	85.5	Confident	46 Å²	46	55.3 Å²	55.3	20%	0.202	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-51.6	-179.6	-173.7	-91.1	0	0	0	111.5	L284 L295 D296 E297 F301 V302 K303 I309 P311 M316	L284-F299 HydrophobicContact CD1-CD2 4.05Å; L284-F299 HydrophobicContact CD2-CB 4.32Å; L295-F299 WeakPolarHBondContact O-CB 3.49Å; L295-F299 PolarHBondContact O-N 2.89Å; D296-F299 PolarHBondContact O-N 2.79Å; E297-F299 VanDerWaalsContact C-N 3.33Å; E297-F299 PolarHBondContact O-N 3.31Å; F299-F301 VanDerWaalsContact C-N 3.28Å; F299-F301 PolarHBondContact O-N 2.65Å; F299-V302 PolarHBondContact O-N 3.24Å; F299-K303 HydrophobicContact CD1-CB 4.48Å; F299-K303 HydrophobicContact CE1-CB 4.35Å; F299-K303 HydrophobicContact CE1-CD 4.27Å; F299-K303 HydrophobicContact CE1-CG 4.35Å; F299-K303 HydrophobicContact CZ-CD 4.4Å; F299-K303 WeakPolarHBondContact O-CB 3.28Å; F299-K303 PolarHBondContact O-N 2.58Å; F299-I309 HydrophobicContact CD2-CD1 4.33Å; F299-I309 HydrophobicContact CE2-CD1 4.15Å; F299-I309 HydrophobicContact CE2-CG1 4.4Å; F299-I309 HydrophobicContact CZ-CD1 4.49Å; F299-I309 HydrophobicContact CZ-CG1 4.44Å; F299-P311 HydrophobicContact CE2-CG 4.39Å; F299-M316 HydrophobicContact CD2-CE 3.95Å; F299-M316 HydrophobicContact CE2-CE 3.9Å
300	E	79.8	Confident	85.3	Confident	103 Å²	103	54.3 Å²	54.3	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-41.5	177.5	-74.4	-57.5	134.2	0	0	111.8	D296 V302 K303 Q304	D296-E300 PolarHBondContact O-N 2.96Å; E300-V302 PolarHBondContact O-N 3.49Å; E300-K303 PolarHBondContact O-N 3.38Å; E300-Q304 VanDerWaalsContact O-CG 3.27Å; E300-Q304 WeakPolarHBondContact O-CG 3.43Å; E300-Q304 PolarHBondContact O-N 2.81Å
301	F	81.8	Confident	85.6	Confident	6 Å²	6	53.4 Å²	53.4	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-60.5	-45.3	178.8	177.8	-99.6	0	0	0	113.5	L47 I191 L192 L287 E297 A298 F299 R305	L47-F301 HydrophobicContact CD1-CD2 4.34Å; L47-F301 HydrophobicContact CD2-CB 4.23Å; L47-F301 HydrophobicContact CD2-CD2 3.31Å; L47-F301 HydrophobicContact CD2-CE2 3.71Å; L47-F301 HydrophobicContact CD2-CG 3.89Å; L47-F301 HydrophobicContact CG-CD2 4.27Å; I191-F301 HydrophobicContact CG2-CD1 4.31Å; I191-F301 HydrophobicContact CG2-CE1 3.78Å; I191-F301 VanDerWaalsContact O-CE1 3.24Å; I191-F301 WeakPolarHBondContact O-CE1 3.42Å; I191-F301 VanDerWaalsContact O-CZ 3.26Å; I191-F301 WeakPolarHBondContact O-CZ 3.26Å; L192-F301 HydrophobicContact CD2-CE1 4.44Å; L192-F301 HydrophobicContact CD2-CZ 4.3Å; L287-F301 HydrophobicContact CD1-CD1 3.68Å; L287-F301 HydrophobicContact CD1-CE1 4.17Å; L287-F301 HydrophobicContact CD2-CE1 4.36Å; E297-F301 WeakPolarHBondContact O-CB 3.45Å; E297-F301 PolarHBondContact O-N 3.47Å; E297-F301 VanDerWaalsContact O-N 3.15Å; A298-F301 PolarHBondContact O-N 3.48Å; F299-F301 VanDerWaalsContact C-N 3.28Å; F299-F301 PolarHBondContact O-N 2.65Å; F301-R305 VanDerWaalsContact CE2-NH2 3.29Å; F301-R305 PolarHBondContact O-NH1 2.82Å
302	V	90.8	Very high	86	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-74.1	-35.9	178	-174.5	0	0	0	0	110.1	I191 L197 L284 L287 A298 F299 E300 Q304 R305 R306 I309	I191-V302 HydrophobicContact CD1-CG1 3.86Å; I191-V302 HydrophobicContact CG2-CG2 4.22Å; L197-V302 HydrophobicContact CD2-CG1 3.76Å; L284-V302 HydrophobicContact CD2-CB 4.22Å; L284-V302 HydrophobicContact CD2-CG2 3.78Å; L287-V302 HydrophobicContact CD1-CG2 3.55Å; A298-V302 WeakPolarHBondContact O-CG2 3.21Å; A298-V302 PolarHBondContact O-N 3.5Å; A298-V302 VanDerWaalsContact O-N 3.14Å; F299-V302 PolarHBondContact O-N 3.24Å; E300-V302 PolarHBondContact O-N 3.49Å; V302-Q304 PolarHBondContact O-N 3.03Å; V302-R305 PolarHBondContact O-N 2.82Å; V302-R305 VanDerWaalsContact O-N 3.16Å; V302-R306 PolarHBondContact O-N 3.45Å; V302-I309 HydrophobicContact CB-CD1 3.65Å; V302-I309 HydrophobicContact CG1-CD1 3.61Å; V302-I309 HydrophobicContact CG1-CG2 4.11Å
303	K	84.2	Confident	85.9	Confident	66 Å²	66	58.5 Å²	58.5	29%	0.287	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-40.2	178.9	-170.7	68.4	164.4	-178.1	0	112.3	F299 E300 R305 R306 S307 I309	F299-K303 HydrophobicContact CD1-CB 4.48Å; F299-K303 HydrophobicContact CE1-CB 4.35Å; F299-K303 HydrophobicContact CE1-CD 4.27Å; F299-K303 HydrophobicContact CE1-CG 4.35Å; F299-K303 HydrophobicContact CZ-CD 4.4Å; F299-K303 WeakPolarHBondContact O-CB 3.28Å; F299-K303 PolarHBondContact O-N 2.58Å; E300-K303 PolarHBondContact O-N 3.38Å; K303-R305 PolarHBondContact O-N 3.14Å; K303-R306 CarbonylContact O-C 3.6Å; K303-R306 PolarHBondContact O-N 2.97Å; K303-S307 WeakPolarHBondContact CD-O 3.17Å; K303-S307 WeakPolarHBondContact CE-O 3.38Å; K303-S307 PolarHBondContact NZ-O 3.42Å; K303-S307 WeakPolarHBondContact O-CA 3.48Å; K303-S307 PolarHBondContact O-N 3.5Å; K303-S307 VanDerWaalsContact O-N 3.07Å; K303-I309 HydrophobicContact CB-CD1 4.04Å; K303-I309 HydrophobicContact CB-CG1 4.2Å; K303-I309 HydrophobicContact CD-CD1 4.33Å; K303-I309 HydrophobicContact CD-CG1 3.59Å; K303-I309 PolarHBondContact NZ-O 2.89Å
304	Q	81.3	Confident	86.4	Confident	145 Å²	145	59.3 Å²	59.3	68%	0.678	30%	0.295	S	S	*	.	H	α-helix	trans	-61.8	-30.4	175.9	-74.3	170.9	13.5	0	0	112.8	E300 V302	E300-Q304 VanDerWaalsContact O-CG 3.27Å; E300-Q304 WeakPolarHBondContact O-CG 3.43Å; E300-Q304 PolarHBondContact O-N 2.81Å; V302-Q304 PolarHBondContact O-N 3.03Å
305	R	87.9	Confident	86.8	Confident	79 Å²	79	54.5 Å²	54.5	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-88.1	-38	-179.9	-71.1	167.4	166.6	62.8	7.3	112.2	V189 E190 I191 F301 V302 K303	V189-R305 HydrophobicContact CG1-CB 3.55Å; V189-R305 VanDerWaalsContact CG1-O 3.32Å; V189-R305 WeakPolarHBondContact CG1-O 3.5Å; E190-R305 VanDerWaalsContact O-CD 3.29Å; E190-R305 WeakPolarHBondContact O-CD 3.44Å; I191-R305 HydrophobicContact CD1-CB 4.24Å; F301-R305 VanDerWaalsContact CE2-NH2 3.29Å; F301-R305 PolarHBondContact O-NH1 2.82Å; V302-R305 PolarHBondContact O-N 2.82Å; V302-R305 VanDerWaalsContact O-N 3.16Å; K303-R305 PolarHBondContact O-N 3.14Å
306	R	89	Confident	86.8	Confident	15 Å²	15	56.4 Å²	56.4	6%	0.057	28%	0.284	C	S	.	.			trans	-133.5	89.8	176.3	-172	169.4	179.7	80.6	-3.1	109.3	Y183 V189 A274 G275 V302 K303 I308 I309	Y183-R306 PolarHBondContact O-NH2 3.06Å; V189-R306 HydrophobicContact CB-CB 4.47Å; V189-R306 HydrophobicContact CG1-CB 4.42Å; V189-R306 HydrophobicContact CG2-CB 4.2Å; V189-R306 HydrophobicContact CG2-CG 4.43Å; A274-R306 PolarHBondContact O-NH2 3.03Å; A274-R306 VanDerWaalsContact O-NH2 3.14Å; G275-R306 PolarHBondContact O-NE 2.68Å; V302-R306 PolarHBondContact O-N 3.45Å; K303-R306 CarbonylContact O-C 3.6Å; K303-R306 PolarHBondContact O-N 2.97Å; R306-I308 HydrophobicContact CG-CD1 4.42Å; R306-I308 HydrophobicContact CG-CG1 3.68Å; R306-I308 VanDerWaalsContact CZ-CD1 3.45Å; R306-I308 VanDerWaalsContact NH2-CD1 3.26Å; R306-I308 PolarHBondContact O-N 3.32Å; R306-I309 HydrophobicContact CB-CG2 3.98Å; R306-I309 HydrophobicContact CG-CG2 3.99Å; R306-I309 WeakPolarHBondContact O-CG2 3.41Å; R306-I309 PolarHBondContact O-N 3.07Å; R306-I309 VanDerWaalsContact O-N 3.07Å
307	S	84.4	Confident	86.9	Confident	87 Å²	87	53.5 Å²	53.5	61%	0.608	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.4	-174.2	62	0	0	0	0	114.6	K303	K303-S307 WeakPolarHBondContact CD-O 3.17Å; K303-S307 WeakPolarHBondContact CE-O 3.38Å; K303-S307 PolarHBondContact NZ-O 3.42Å; K303-S307 WeakPolarHBondContact O-CA 3.48Å; K303-S307 PolarHBondContact O-N 3.5Å; K303-S307 VanDerWaalsContact O-N 3.07Å
308	I	83.4	Confident	87.8	Confident	52 Å²	52	50.1 Å²	50.1	27%	0.267	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-4.9	-179.3	61.5	165.2	0	0	0	114.1	I276 R306 S310	I276-I308 HydrophobicContact CD1-CD1 4.48Å; I276-I308 HydrophobicContact CG1-CD1 4Å; I276-I308 HydrophobicContact CG1-CG1 4.37Å; I276-I308 WeakPolarHBondContact CG2-O 3.42Å; R306-I308 HydrophobicContact CG-CD1 4.42Å; R306-I308 HydrophobicContact CG-CG1 3.68Å; R306-I308 VanDerWaalsContact CZ-CD1 3.45Å; R306-I308 VanDerWaalsContact NH2-CD1 3.26Å; R306-I308 PolarHBondContact O-N 3.32Å; I308-S310 PolarHBondContact O-N 3.38Å
309	I	91.1	Very high	88.1	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.261	C	S	.	.			trans	-58.8	139.4	178.4	67.7	169.5	0	0	0	110.5	L197 I276 A280 F299 V302 K303 R306	L197-I309 HydrophobicContact CD2-CG2 3.93Å; I276-I309 WeakPolarHBondContact O-CA 3.5Å; A280-I309 HydrophobicContact CB-CB 4.02Å; A280-I309 HydrophobicContact CB-CG2 3.78Å; F299-I309 HydrophobicContact CD2-CD1 4.33Å; F299-I309 HydrophobicContact CE2-CD1 4.15Å; F299-I309 HydrophobicContact CE2-CG1 4.4Å; F299-I309 HydrophobicContact CZ-CD1 4.49Å; F299-I309 HydrophobicContact CZ-CG1 4.44Å; V302-I309 HydrophobicContact CB-CD1 3.65Å; V302-I309 HydrophobicContact CG1-CD1 3.61Å; V302-I309 HydrophobicContact CG1-CG2 4.11Å; K303-I309 HydrophobicContact CB-CD1 4.04Å; K303-I309 HydrophobicContact CB-CG1 4.2Å; K303-I309 HydrophobicContact CD-CD1 4.33Å; K303-I309 HydrophobicContact CD-CG1 3.59Å; K303-I309 PolarHBondContact NZ-O 2.89Å; R306-I309 HydrophobicContact CB-CG2 3.98Å; R306-I309 HydrophobicContact CG-CG2 3.99Å; R306-I309 WeakPolarHBondContact O-CG2 3.41Å; R306-I309 PolarHBondContact O-N 3.07Å; R306-I309 VanDerWaalsContact O-N 3.07Å
310	S	86.7	Confident	88.3	Confident	74 Å²	74	52.1 Å²	52.1	52%	0.517	27%	0.273	S	S	.	.			trans	-164.1	77	-179.6	-171.7	0	0	0	0	108.2	I276 I308 N312	I276-S310 CarbonylContact O-C 3.59Å; I276-S310 PolarHBondContact O-N 3.3Å; I308-S310 PolarHBondContact O-N 3.38Å; S310-N312 PolarHBondContact O-N 2.81Å
311	P	92.8	Very high	89	Confident	10 Å²	10	52.6 Å²	52.6	7%	0.065	28%	0.275	C	S	.	.			trans	-49.5	139.3	168.9	-23.5	34.9	0	0	0	110.5	L284 F299 F315 M316	L284-P311 HydrophobicContact CD1-CG 3.85Å; F299-P311 HydrophobicContact CE2-CG 4.39Å; P311-F315 HydrophobicContact CB-CB 4.34Å; P311-M316 HydrophobicContact CB-CE 4.14Å; P311-M316 HydrophobicContact CG-CE 4.1Å
312	N	89.7	Confident	89.8	Confident	31 Å²	31	52.7 Å²	52.7	17%	0.166	28%	0.276	C	S	.	.			trans	-62.7	157.8	175.2	77.2	58.1	0	0	0	110.7	D241 S277 S310 S314 F315 M316	D241-N312 PolarHBondContact OD1-ND2 2.77Å; S277-N312 PolarHBondContact OG-N 2.93Å; S277-N312 VanDerWaalsContact OG-N 3.12Å; S310-N312 PolarHBondContact O-N 2.81Å; N312-S314 VanDerWaalsContact C-N 3.26Å; N312-S314 PolarHBondContact O-N 3.25Å; N312-S314 WeakPolarHBondContact OD1-CA 3.42Å; N312-S314 VanDerWaalsContact OD1-CB 3.31Å; N312-S314 WeakPolarHBondContact OD1-CB 3.03Å; N312-S314 PolarHBondContact OD1-N 2.86Å; N312-F315 WeakPolarHBondContact ND2-CD2 3.43Å; N312-F315 WeakPolarHBondContact ND2-CE2 3.07Å; N312-F315 WeakPolarHBondContact ND2-CG 3.37Å; N312-F315 WeakPolarHBondContact ND2-CZ 3.19Å; N312-F315 PolarHBondContact O-N 3.12Å; N312-F315 PolarHBondContact OD1-N 2.64Å; N312-M316 PolarHBondContact O-N 2.93Å
313	F	80.9	Confident	90	Very high	196 Å²	196	54.4 Å²	54.4	86%	0.86	28%	0.284	S	S	*	.	H	α-helix	trans	-58.7	-33.4	-175	-69.6	-71.6	0	0	0	114.1	M316 G317	F313-M316 PolarHBondContact O-N 3.07Å; F313-G317 PolarHBondContact O-N 3.37Å
314	S	90.4	Very high	90.3	Very high	35 Å²	35	54.4 Å²	54.4	25%	0.245	29%	0.292	C	S	.	.	H	α-helix	trans	-66.8	-44.1	176.3	-176.9	0	0	0	0	110.9	H243 N312 M316 G317 Q318	H243-S314 WeakPolarHBondContact O-CB 3.42Å; H243-S314 PolarHBondContact O-OG 3.01Å; N312-S314 VanDerWaalsContact C-N 3.26Å; N312-S314 PolarHBondContact O-N 3.25Å; N312-S314 WeakPolarHBondContact OD1-CA 3.42Å; N312-S314 VanDerWaalsContact OD1-CB 3.31Å; N312-S314 WeakPolarHBondContact OD1-CB 3.03Å; N312-S314 PolarHBondContact OD1-N 2.86Å; S314-M316 VanDerWaalsContact C-N 3.31Å; S314-M316 PolarHBondContact O-N 2.93Å; S314-G317 PolarHBondContact O-N 2.93Å; S314-Q318 WeakPolarHBondContact O-CG 3.43Å; S314-Q318 PolarHBondContact O-N 3.43Å; S314-Q318 PolarHBondContact OG-NE2 3.44Å
315	F	97	Very high	90.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-35.8	174.7	-65.9	-9.3	0	0	0	112.3	V239 E240 A245 I247 S277 R278 T281 P311 N312 G317 Q318 L319	V239-F315 HydrophobicContact CG1-CZ 3.9Å; E240-F315 WeakPolarHBondContact O-CZ 3.37Å; A245-F315 HydrophobicContact CB-CE1 4.06Å; A245-F315 HydrophobicContact CB-CZ 4.23Å; I247-F315 HydrophobicContact CB-CD1 4.08Å; I247-F315 HydrophobicContact CB-CE1 3.79Å; I247-F315 HydrophobicContact CB-CZ 4.11Å; I247-F315 HydrophobicContact CD1-CD2 4.36Å; I247-F315 HydrophobicContact CD1-CE2 4.08Å; I247-F315 HydrophobicContact CD1-CZ 4.23Å; I247-F315 HydrophobicContact CG2-CB 4.3Å; I247-F315 HydrophobicContact CG2-CD1 3.32Å; I247-F315 HydrophobicContact CG2-CD2 4.3Å; I247-F315 HydrophobicContact CG2-CE1 3.58Å; I247-F315 HydrophobicContact CG2-CG 3.72Å; I247-F315 HydrophobicContact CG2-CZ 4.19Å; S277-F315 WeakPolarHBondContact OG-CD2 3.48Å; R278-F315 HydrophobicContact CB-CE2 4.41Å; R278-F315 HydrophobicContact CG-CE2 3.54Å; R278-F315 HydrophobicContact CG-CZ 4.09Å; T281-F315 HydrophobicContact CG2-CB 4Å; T281-F315 HydrophobicContact CG2-CG 4.4Å; P311-F315 HydrophobicContact CB-CB 4.34Å; N312-F315 WeakPolarHBondContact ND2-CD2 3.43Å; N312-F315 WeakPolarHBondContact ND2-CE2 3.07Å; N312-F315 WeakPolarHBondContact ND2-CG 3.37Å; N312-F315 WeakPolarHBondContact ND2-CZ 3.19Å; N312-F315 PolarHBondContact O-N 3.12Å; N312-F315 PolarHBondContact OD1-N 2.64Å; F315-G317 VanDerWaalsContact C-N 3.35Å; F315-Q318 PolarHBondContact O-N 3.48Å; F315-L319 WeakPolarHBondContact O-CB 3.29Å; F315-L319 VanDerWaalsContact O-CG 3.28Å; F315-L319 WeakPolarHBondContact O-CG 3.17Å; F315-L319 PolarHBondContact O-N 3.11Å
316	M	93.6	Very high	90.7	Very high	47 Å²	47	48.4 Å²	48.4	23%	0.232	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-42.9	173	-166.5	59.5	66.2	0	0	111.5	L295 F299 P311 N312 F313 S314 L319 L320	L295-M316 HydrophobicContact CD1-SD 4.36Å; L295-M316 HydrophobicContact CD2-SD 3.61Å; L295-M316 HydrophobicContact CG-SD 4.19Å; F299-M316 HydrophobicContact CD2-CE 3.95Å; F299-M316 HydrophobicContact CE2-CE 3.9Å; P311-M316 HydrophobicContact CB-CE 4.14Å; P311-M316 HydrophobicContact CG-CE 4.1Å; N312-M316 PolarHBondContact O-N 2.93Å; F313-M316 PolarHBondContact O-N 3.07Å; S314-M316 VanDerWaalsContact C-N 3.31Å; S314-M316 PolarHBondContact O-N 2.93Å; M316-L319 PolarHBondContact O-N 3.3Å; M316-L319 HydrophobicContact SD-CD1 4.5Å; M316-L320 WeakPolarHBondContact O-CG 3.5Å; M316-L320 PolarHBondContact O-N 2.84Å
317	G	83.1	Confident	90.4	Very high	37 Å²	37	49.7 Å²	49.7	38%	0.381	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-42.4	173.4	0	0	0	0	0	113	F313 S314 F315 L320 Q321	F313-G317 PolarHBondContact O-N 3.37Å; S314-G317 PolarHBondContact O-N 2.93Å; F315-G317 VanDerWaalsContact C-N 3.35Å; G317-L320 PolarHBondContact O-N 3.2Å; G317-Q321 PolarHBondContact O-N 2.9Å
318	Q	97.1	Very high	89.7	Confident	22 Å²	22	48.1 Å²	48.1	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-38.8	175.2	-74.4	176.6	52.2	0	0	112.5	A245 D246 S314 F315 Q321 F322	A245-Q318 PolarHBondContact O-NE2 2.95Å; D246-Q318 PolarHBondContact OD1-OE1 2.85Å; S314-Q318 WeakPolarHBondContact O-CG 3.43Å; S314-Q318 PolarHBondContact O-N 3.43Å; S314-Q318 PolarHBondContact OG-NE2 3.44Å; F315-Q318 PolarHBondContact O-N 3.48Å; Q318-Q321 PolarHBondContact O-N 3.33Å; Q318-F322 WeakPolarHBondContact O-CB 3.18Å; Q318-F322 PolarHBondContact O-N 3.18Å
319	L	97.6	Very high	88.4	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.4	-40.6	174.1	-74.6	168.5	0	0	0	112	F251 T281 L284 A285 M288 L295 F315 M316 Q321 F322 E323	F251-L319 HydrophobicContact CE2-CD2 4.06Å; F251-L319 HydrophobicContact CZ-CD2 3.74Å; F251-L319 HydrophobicContact CZ-CG 4.27Å; T281-L319 HydrophobicContact CG2-CD1 3.81Å; T281-L319 HydrophobicContact CG2-CD2 3.87Å; T281-L319 HydrophobicContact CG2-CG 3.79Å; L284-L319 HydrophobicContact CB-CD1 4.14Å; L284-L319 HydrophobicContact CB-CD2 4.09Å; L284-L319 HydrophobicContact CD1-CD1 3.78Å; A285-L319 HydrophobicContact CB-CD2 3.98Å; M288-L319 HydrophobicContact CE-CB 4.08Å; M288-L319 HydrophobicContact CE-CD2 3.49Å; M288-L319 VanDerWaalsContact CE-CD2 3.49Å; M288-L319 HydrophobicContact CE-CG 4.36Å; L295-L319 HydrophobicContact CD1-CB 3.87Å; L295-L319 HydrophobicContact CD1-CD1 3.93Å; L295-L319 HydrophobicContact CD1-CG 4.38Å; L295-L319 HydrophobicContact CD2-CB 3.7Å; L295-L319 HydrophobicContact CG-CB 4.44Å; F315-L319 WeakPolarHBondContact O-CB 3.29Å; F315-L319 VanDerWaalsContact O-CG 3.28Å; F315-L319 WeakPolarHBondContact O-CG 3.17Å; F315-L319 PolarHBondContact O-N 3.11Å; M316-L319 PolarHBondContact O-N 3.3Å; M316-L319 HydrophobicContact SD-CD1 4.5Å; L319-Q321 VanDerWaalsContact C-N 3.34Å; L319-F322 PolarHBondContact O-N 3.01Å; L319-E323 WeakPolarHBondContact O-CB 3.39Å; L319-E323 PolarHBondContact O-N 3.46Å
320	L	92.7	Very high	86.4	Confident	90 Å²	90	50.5 Å²	50.5	47%	0.471	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-41.6	174	-74	167.7	0	0	0	111.6	L295 M316 G317 E323 S324	L295-L320 HydrophobicContact CD2-CD2 3.66Å; L295-L320 HydrophobicContact CD2-CG 3.68Å; M316-L320 WeakPolarHBondContact O-CG 3.5Å; M316-L320 PolarHBondContact O-N 2.84Å; G317-L320 PolarHBondContact O-N 3.2Å; L320-E323 WeakPolarHBondContact O-CB 3.41Å; L320-E323 PolarHBondContact O-N 2.88Å; L320-S324 PolarHBondContact O-N 3.46Å; L320-S324 VanDerWaalsContact O-N 3.14Å
321	Q	94.6	Very high	84.3	Confident	112 Å²	112	51.3 Å²	51.3	52%	0.523	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-44	174.5	-171.3	-179.5	1.3	0	0	110.9	G317 Q318 L319 S324 Q325	G317-Q321 PolarHBondContact O-N 2.9Å; Q318-Q321 PolarHBondContact O-N 3.33Å; L319-Q321 VanDerWaalsContact C-N 3.34Å; Q321-S324 WeakPolarHBondContact O-CB 3.41Å; Q321-S324 PolarHBondContact O-N 2.9Å; Q321-S324 PolarHBondContact O-OG 2.92Å; Q321-Q325 WeakPolarHBondContact O-CG 3.48Å; Q321-Q325 PolarHBondContact O-N 2.81Å; Q321-Q325 VanDerWaalsContact O-N 3.17Å
322	F	96.9	Very high	81.6	Confident	9 Å²	9	56.3 Å²	56.3	4%	0.039	33%	0.325	C	S	.	.	H	α-helix	trans	-65.1	-40.1	177.6	-175.9	-113.2	0	0	0	112.7	F251 I255 A285 M288 R289 Q318 L319 S324 Q325 V326	F251-F322 HydrophobicContact CB-CD2 4.46Å; F251-F322 HydrophobicContact CB-CE1 4.49Å; F251-F322 HydrophobicContact CB-CE2 4.03Å; F251-F322 HydrophobicContact CB-CZ 4.04Å; F251-F322 HydrophobicContact CD2-CB 3.84Å; F251-F322 AromaticContact CD2-CD1 3.76Å; F251-F322 HydrophobicContact CD2-CD1 3.76Å; F251-F322 AromaticContact CD2-CD2 3.65Å; F251-F322 HydrophobicContact CD2-CD2 3.65Å; F251-F322 HydrophobicContact CD2-CE1 4.15Å; F251-F322 HydrophobicContact CD2-CE2 4.04Å; F251-F322 AromaticContact CD2-CG 3.47Å; F251-F322 HydrophobicContact CD2-CG 3.47Å; F251-F322 VanDerWaalsContact CD2-CG 3.47Å; F251-F322 HydrophobicContact CD2-CZ 4.27Å; F251-F322 HydrophobicContact CE2-CB 3.76Å; F251-F322 HydrophobicContact CE2-CD1 4.16Å; F251-F322 HydrophobicContact CE2-CD2 4.44Å; F251-F322 AromaticContact CE2-CG 3.89Å; F251-F322 HydrophobicContact CE2-CG 3.89Å; I255-F322 HydrophobicContact CD1-CE1 4.27Å; I255-F322 HydrophobicContact CD1-CZ 3.85Å; A285-F322 HydrophobicContact CB-CD1 4.11Å; A285-F322 HydrophobicContact CB-CE1 3.91Å; A285-F322 WeakPolarHBondContact O-CE1 3.08Å; M288-F322 HydrophobicContact CE-CD1 4.04Å; R289-F322 HydrophobicContact CB-CE1 4.3Å; R289-F322 HydrophobicContact CB-CZ 4.3Å; Q318-F322 WeakPolarHBondContact O-CB 3.18Å; Q318-F322 PolarHBondContact O-N 3.18Å; L319-F322 PolarHBondContact O-N 3.01Å; F322-S324 VanDerWaalsContact C-N 3.27Å; F322-S324 PolarHBondContact O-N 2.82Å; F322-Q325 WeakPolarHBondContact O-CB 3.08Å; F322-Q325 PolarHBondContact O-N 3.27Å; F322-V326 HydrophobicContact CD1-CG2 3.85Å; F322-V326 HydrophobicContact CD2-CG2 3.94Å; F322-V326 HydrophobicContact CE1-CG2 3.47Å; F322-V326 VanDerWaalsContact CE1-CG2 3.47Å; F322-V326 HydrophobicContact CE2-CG2 3.57Å; F322-V326 HydrophobicContact CG-CG2 4.09Å; F322-V326 HydrophobicContact CZ-CG2 3.33Å; F322-V326 WeakPolarHBondContact O-CB 3.44Å; F322-V326 WeakPolarHBondContact O-CG2 3.48Å; F322-V326 PolarHBondContact O-N 2.97Å
323	E	95.2	Very high	78.9	Confident	36 Å²	36	60.5 Å²	60.5	17%	0.168	36%	0.357	C	S	.	.	H	α-helix	trans	-52.7	-49	171.9	-179.3	-170.9	-131.1	0	0	110.2	M288 K294 L295 L319 L320 Q325 V326 L327	M288-E323 HydrophobicContact SD-CB 3.78Å; M288-E323 HydrophobicContact SD-CG 4.19Å; K294-E323 WeakPolarHBondContact CA-OE1 3.2Å; K294-E323 WeakPolarHBondContact CB-OE1 3.49Å; K294-E323 WeakPolarHBondContact CG-OE1 3.34Å; L295-E323 PolarHBondContact N-OE1 3.37Å; L319-E323 WeakPolarHBondContact O-CB 3.39Å; L319-E323 PolarHBondContact O-N 3.46Å; L320-E323 WeakPolarHBondContact O-CB 3.41Å; L320-E323 PolarHBondContact O-N 2.88Å; E323-Q325 VanDerWaalsContact C-N 3.29Å; E323-Q325 PolarHBondContact O-N 3.03Å; E323-V326 PolarHBondContact O-N 3.19Å; E323-L327 HydrophobicContact CG-CD1 3.57Å; E323-L327 HydrophobicContact CG-CG 4.14Å; E323-L327 VanDerWaalsContact O-CB 3.26Å; E323-L327 WeakPolarHBondContact O-CB 3.32Å; E323-L327 VanDerWaalsContact O-CG 3.28Å; E323-L327 WeakPolarHBondContact O-CG 3.31Å; E323-L327 PolarHBondContact O-N 2.91Å
324	S	91	Very high	76.9	Confident	65 Å²	65	56.5 Å²	56.5	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-58.9	-40.9	178.1	80.7	0	0	0	0	111.8	L320 Q321 F322 A328	L320-S324 PolarHBondContact O-N 3.46Å; L320-S324 VanDerWaalsContact O-N 3.14Å; Q321-S324 WeakPolarHBondContact O-CB 3.41Å; Q321-S324 PolarHBondContact O-N 2.9Å; Q321-S324 PolarHBondContact O-OG 2.92Å; F322-S324 VanDerWaalsContact C-N 3.27Å; F322-S324 PolarHBondContact O-N 2.82Å; S324-A328 WeakPolarHBondContact O-CA 3.44Å; S324-A328 WeakPolarHBondContact O-CB 3.4Å; S324-A328 PolarHBondContact O-N 2.91Å
325	Q	90.9	Very high	74.4	Confident	97 Å²	97	64 Å²	64	45%	0.453	38%	0.384	S	S	.	.	H	α-helix	trans	-69.4	-46.5	179.3	-65.1	169.6	17	0	0	111.9	Q321 F322 E323 A328 S329	Q321-Q325 WeakPolarHBondContact O-CG 3.48Å; Q321-Q325 PolarHBondContact O-N 2.81Å; Q321-Q325 VanDerWaalsContact O-N 3.17Å; F322-Q325 WeakPolarHBondContact O-CB 3.08Å; F322-Q325 PolarHBondContact O-N 3.27Å; E323-Q325 VanDerWaalsContact C-N 3.29Å; E323-Q325 PolarHBondContact O-N 3.03Å; Q325-A328 PolarHBondContact O-N 3.32Å; Q325-S329 WeakPolarHBondContact O-CB 3.45Å; Q325-S329 PolarHBondContact O-N 3.23Å; Q325-S329 PolarHBondContact O-OG 3.13Å
326	V	87.6	Confident	71.4	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.006	42%	0.422	C	S	.	.	H	α-helix	trans	-69.1	-35.6	-177.4	170.3	0	0	0	0	111.8	M288 R289 F322 E323 S329	M288-V326 WeakPolarHBondContact O-CG1 3.37Å; R289-V326 HydrophobicContact CB-CG1 4.44Å; F322-V326 HydrophobicContact CD1-CG2 3.85Å; F322-V326 HydrophobicContact CD2-CG2 3.94Å; F322-V326 HydrophobicContact CE1-CG2 3.47Å; F322-V326 VanDerWaalsContact CE1-CG2 3.47Å; F322-V326 HydrophobicContact CE2-CG2 3.57Å; F322-V326 HydrophobicContact CG-CG2 4.09Å; F322-V326 HydrophobicContact CZ-CG2 3.33Å; F322-V326 WeakPolarHBondContact O-CB 3.44Å; F322-V326 WeakPolarHBondContact O-CG2 3.48Å; F322-V326 PolarHBondContact O-N 2.97Å; E323-V326 PolarHBondContact O-N 3.19Å; V326-S329 PolarHBondContact O-OG 2.92Å
327	L	81.1	Confident	68.4	Low	42 Å²	42	70.1 Å²	70.1	22%	0.22	45%	0.45	C	S	.	.	H	α-helix	trans	-86.2	-27.2	178.4	-58	-174.6	0	0	0	112.2	I65 R292 K294 E323	I65-L327 WeakPolarHBondContact CD1-O 3.39Å; R292-L327 HydrophobicContact CB-CD2 4.49Å; K294-L327 HydrophobicContact CG-CD1 4.2Å; E323-L327 HydrophobicContact CG-CD1 3.57Å; E323-L327 HydrophobicContact CG-CG 4.14Å; E323-L327 VanDerWaalsContact O-CB 3.26Å; E323-L327 WeakPolarHBondContact O-CB 3.32Å; E323-L327 VanDerWaalsContact O-CG 3.28Å; E323-L327 WeakPolarHBondContact O-CG 3.31Å; E323-L327 PolarHBondContact O-N 2.91Å
328	A	71.2	Confident	66	Low	55 Å²	55	73.7 Å²	73.7	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-89	-28.5	178.2	0	0	0	0	0	115.1	S324 Q325 S330 T331	S324-A328 WeakPolarHBondContact O-CA 3.44Å; S324-A328 WeakPolarHBondContact O-CB 3.4Å; S324-A328 PolarHBondContact O-N 2.91Å; Q325-A328 PolarHBondContact O-N 3.32Å; A328-S330 PolarHBondContact O-N 2.88Å; A328-T331 WeakPolarHBondContact O-CB 3.47Å; A328-T331 PolarHBondContact O-N 2.91Å; A328-T331 PolarHBondContact O-OG1 3.47Å
329	S	54.5	Low	63.2	Low	69 Å²	69	78.9 Å²	78.9	48%	0.483	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	2.7	-177.1	51.3	0	0	0	0	115.5	Q325 V326	Q325-S329 WeakPolarHBondContact O-CB 3.45Å; Q325-S329 PolarHBondContact O-N 3.23Å; Q325-S329 PolarHBondContact O-OG 3.13Å; V326-S329 PolarHBondContact O-OG 2.92Å
330	S	49.8	Very low	60.3	Low	33 Å²	33	83.1 Å²	83.1	23%	0.231	54%	0.54	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-5.9	169.9	-46.2	0	0	0	0	112.6	R69 R292 A328	R69-S330 PolarHBondContact NH1-O 2.76Å; R69-S330 PolarHBondContact NH2-O 3.06Å; R292-S330 PolarHBondContact NH1-OG 3.27Å; R292-S330 VanDerWaalsContact NH1-OG 3.12Å; A328-S330 PolarHBondContact O-N 2.88Å
331	T	42.4	Very low	57.5	Low	90 Å²	90	86.4 Å²	86.4	55%	0.552	56%	0.556	S	S	*	*	S	Bend	trans	-98	-9.5	-164	-29.4	0	0	0	0	115.9	R69 A328	R69-T331 PolarHBondContact NH2-OG1 2.63Å; A328-T331 WeakPolarHBondContact O-CB 3.47Å; A328-T331 PolarHBondContact O-N 2.91Å; A328-T331 PolarHBondContact O-OG1 3.47Å
332	C	35.6	Very low	54.4	Low	116 Å²	116	85.6 Å²	85.6	78%	0.784	56%	0.563	S	S	*	*	S	Bend	trans	-144.8	81.4	-179.7	-63.2	0	0	0	0	111.8
333	S	32.8	Very low	51.2	Low	119 Å²	119	94.8 Å²	94.8	83%	0.832	60%	0.603	S	S	*	*	S	Bend	trans	-158.5	54.3	164.8	-71.6	0	0	0	0	110.4
334	S	39.9	Very low	48	Very low	111 Å²	111	98.1 Å²	98.1	78%	0.776	63%	0.63	S	S	*	*			trans	-170.1	85.1	166.6	43	0	0	0	0	107.4
335	E	37.6	Very low	45	Very low	192 Å²	192	99.4 Å²	99.4	90%	0.897	64%	0.639	S	S	*	*			trans	179.1	89.1	153.2	-92	-53	119.1	0	0	106.3
336	A	33.6	Very low	42	Very low	96 Å²	96	100.6 Å²	100.6	79%	0.793	65%	0.653	S	S	*	*			trans	179.9	68.5	149.2	0	0	0	0	0	109.1
337	G	32.2	Very low	39.1	Very low	80 Å²	80	106 Å²	106	83%	0.825	69%	0.686	S	S	*	*			trans	-71.4	126.1	154.7	0	0	0	0	0	108.7
338	S	32.4	Very low	36.6	Very low	112 Å²	112	112.5 Å²	112.5	78%	0.783	71%	0.713	S	S	*	*			trans	-62.1	172.6	179.2	-49	0	0	0	0	113.8
339	P	38.3	Very low	34.5	Very low	132 Å²	132	116.4 Å²	116.4	86%	0.857	73%	0.726	S	S	*	*				-124.4	145.9	118.9	29.7	-18.2	0	0	0	112.4
340	A	36	Very low	33.6	Very low	88 Å²	88	122.3 Å²	122.3	73%	0.727	74%	0.743	S	S	*	*			trans	-71.2	155.2	-176.7	0	0	0	0	0	113.7
341	I	33.7	Very low	32.9	Very low	159 Å²	159	126 Å²	126	82%	0.815	77%	0.766	S	S	*	*				177.1	120.3	120.1	-88.6	158	0	0	0	111.6
342	S	29.2	Very low	32.4	Very low	95 Å²	95	127.8 Å²	127.8	66%	0.664	78%	0.777	S	S	*	*			trans	58.5	127.9	145.6	79.6	0	0	0	0	124.5
343	K	30.6	Very low	32.3	Very low	203 Å²	203	127.5 Å²	127.5	88%	0.883	78%	0.776	S	S	*	*			trans	84.1	116	135.4	-76.1	176.2	-177.8	-178.5	0	120.9
344	S	28	Very low	32.1	Very low	106 Å²	106	128.5 Å²	128.5	74%	0.741	77%	0.771	S	S	*	*			trans	85.6	121.1	131.5	-155.4	0	0	0	0	120.5
345	S	27.1	Very low	31.8	Very low	92 Å²	92	129.2 Å²	129.2	64%	0.643	77%	0.773	S	S	*	*			trans	66.7	126.9	134.5	65	0	0	0	0	121.5
346	T	28.1	Very low	31.5	Very low	121 Å²	121	125.3 Å²	125.3	74%	0.742	76%	0.762	S	S	*	*			trans	69.9	110.2	142.8	27.8	0	0	0	0	120.4
347	V	28	Very low	31.4	Very low	115 Å²	115	129.3 Å²	129.3	70%	0.697	76%	0.764	S	S	*	*				56.7	127.7	110.2	178.2	0	0	0	0	120.2
348	F	27.9	Very low	31.3	Very low	179 Å²	179	129 Å²	129	79%	0.785	75%	0.754	S	S	*	*			trans	87	130	149.6	-89.1	-57.6	0	0	0	123.2
349	N	27.3	Very low	31.2	Very low	136 Å²	136	129.1 Å²	129.1	73%	0.727	75%	0.754	S	S	*	*			trans	86.8	134.2	131.9	-91.5	-3.3	0	0	0	123.4
350	F	35.3	Very low	30.9	Very low	194 Å²	194	128.8 Å²	128.8	85%	0.851	76%	0.755	S	S	*	*			trans	-49.6	153.5	157.6	-90.1	-95.1	0	0	0	113
351	P	35.9	Very low	30.7	Very low	110 Å²	110	128.1 Å²	128.1	71%	0.714	76%	0.757	S	S	*	*			trans	-132.3	131	141.6	29.5	-12.7	0	0	0	113.4
352	V	31.9	Very low	30.6	Very low	127 Å²	127	129.1 Å²	129.1	77%	0.77	76%	0.758	S	S	*	*			trans	-78.1	143.6	148.2	171.9	0	0	0	0	107
353	S	32.2	Very low	30.7	Very low	111 Å²	111	131.5 Å²	131.5	78%	0.776	76%	0.762	S	S	*	*			trans	-139.2	119	168.1	-60.5	0	0	0	0	111
354	I	29.6	Very low	30.7	Very low	139 Å²	139	127.8 Å²	127.8	71%	0.713	76%	0.762	S	S	*	*			trans	-99.2	143.4	163.1	-61.5	171.5	0	0	0	106.7	V356	I354-V356 HydrophobicContact CG2-CG2 4.01Å
355	P	33.6	Very low	30.9	Very low	127 Å²	127	131.5 Å²	131.5	83%	0.825	77%	0.765	S	S	*	*			trans	-105.2	140.1	155.4	13.9	5.4	0	0	0	111.8
356	V	30	Very low	31	Very low	109 Å²	109	136.6 Å²	136.6	66%	0.661	77%	0.77	S	S	*	*			trans	-121	145.6	175	-179.1	0	0	0	0	109.8	I354	I354-V356 HydrophobicContact CG2-CG2 4.01Å
357	H	31.4	Very low	31.1	Very low	180 Å²	180	137.9 Å²	137.9	83%	0.833	77%	0.768	S	S	*	*			trans	129.4	138.9	148.2	-77.8	-66.5	0	0	0	113.1
358	A	30.9	Very low	31.5	Very low	75 Å²	75	137.4 Å²	137.4	62%	0.62	77%	0.77	S	S	*	*			cis	-163.3	148.8	-10.3	0	0	0	0	0	110.7
359	S	30.3	Very low	32.4	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	77%	0.767	S	S	*	*			trans	58.9	117.3	144.6	61.9	0	0	0	0	122.4
360	S	32.7	Very low	32.7	Very low	126 Å²	126	134.6 Å²	134.6	88%	0.881	77%	0.767	S	S	*	*				-173.9	128.2	115.9	49.6	0	0	0	0	112.1
361	G	30.7	Very low	32.7	Very low	74 Å²	74	131.1 Å²	131.1	76%	0.763	76%	0.762	S	S	*	*			trans	114.8	92.8	145.7	0	0	0	0	0	119.9
362	Q	31.2	Very low	32.6	Very low	180 Å²	180	131.6 Å²	131.6	84%	0.841	76%	0.763	S	S	*	*			trans	42.1	102.1	138.9	-67.4	178.7	-31.1	0	0	120
363	L	31.9	Very low	32.8	Very low	144 Å²	144	130.6 Å²	130.6	75%	0.754	76%	0.762	S	S	*	*				72.4	113.6	91.2	-75.6	171.2	0	0	0	116.1
364	S	31.8	Very low	34.1	Very low	126 Å²	126	130.6 Å²	130.6	88%	0.881	76%	0.759	S	S	*	*				-170.7	148.4	124.8	23.8	0	0	0	0	112.9
365	F	31.3	Very low	34.7	Very low	183 Å²	183	129 Å²	129	80%	0.803	76%	0.76	S	S	*	*			trans	-83.9	146.6	-160	-97.8	-110.2	0	0	0	115.3
366	R	28.1	Very low	34.8	Very low	199 Å²	199	132.9 Å²	132.9	75%	0.751	79%	0.788	S	S	*	*			trans	23.1	132.2	136.6	-82.5	-174.1	151.1	-158	-6.5	122.5
367	H	31.1	Very low	35.1	Very low	148 Å²	148	134.1 Å²	134.1	69%	0.685	79%	0.794	S	S	*	*			trans	81.7	118.9	135.2	-71.7	-48.7	0	0	0	120.8
368	S	35.6	Very low	35.3	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	79%	0.792	S	S	*	*			trans	-37.9	170.3	154.7	-37.5	0	0	0	0	113.9
369	P	48.1	Very low	35.5	Very low	111 Å²	111	134.8 Å²	134.8	72%	0.721	80%	0.802	S	S	*	*			cis	-155.7	-166.8	41.3	31.4	-2.6	0	0	0	116.9
370	I	33.1	Very low	35.8	Very low	145 Å²	145	136.1 Å²	136.1	74%	0.744	80%	0.803	S	S	*	*			trans	110.1	114.8	147.7	-63.5	170.2	0	0	0	118.5
371	T	34.7	Very low	36	Very low	121 Å²	121	136.7 Å²	136.7	74%	0.742	80%	0.798	S	S	*	*			trans	56.5	136.9	142.7	-149.7	0	0	0	0	119
372	T	34.3	Very low	36.4	Very low	119 Å²	119	140.9 Å²	140.9	73%	0.73	80%	0.8	S	S	*	*				-164.1	141.1	56	46.4	0	0	0	0	112
373	S	36.8	Very low	36.7	Very low	107 Å²	107	138.1 Å²	138.1	75%	0.748	80%	0.797	S	S	*	*			trans	-76	-179.2	149.8	49.1	0	0	0	0	110.5
374	P	59.4	Low	37.1	Very low	111 Å²	111	137.6 Å²	137.6	72%	0.721	80%	0.801	S	S	*	*			cis	-136.3	179.6	3.1	38.8	-19.3	0	0	0	114.4
375	S	40.8	Very low	37.5	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	79%	0.794	S	S	*	*				162.4	132.8	118.4	-65.4	0	0	0	0	113
376	C	37.1	Very low	38.1	Very low	208 Å²	208	134.5 Å²	134.5	100%	1.405	79%	0.793	S	S	*	*			trans	71	0	158.7	-61.8	0	0	0	0	119.9

Retrieved 376 of 376 residues in 137.3 ms (Link to these results)

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