A0A077ZNN3_TRITR Loading...

SPRY domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZNN3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 267 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	34	Very low	33.3	Very low	234 Å²	234	148 Å²	148	100%	1.153	76%	0.755	S	S	*	*				0	114.6	0	-69.5	-161	-104.2	0	0	108.1
2	P	32	Very low	33.9	Very low	136 Å²	136	139.1 Å²	139.1	88%	0.883	72%	0.716	S	S	*	*			trans	-95.3	126.3	171.1	32.3	-22.2	0	0	0	109.6
3	V	28.9	Very low	34.6	Very low	134 Å²	134	137.2 Å²	137.2	81%	0.812	70%	0.704	S	S	*	*			trans	-102.8	131.1	174.3	-171.1	0	0	0	0	108.6
4	S	28.3	Very low	35.3	Very low	98 Å²	98	136.1 Å²	136.1	69%	0.685	69%	0.694	S	S	*	*			trans	-26	139.3	179.2	56.5	0	0	0	0	120.7
5	F	28.9	Very low	36.4	Very low	218 Å²	218	133.7 Å²	133.7	96%	0.956	68%	0.677	S	S	*	*			trans	-68.6	118.3	145.5	-93.5	-94.2	0	0	0	109.3
6	S	33.9	Very low	37.5	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	66%	0.662	S	S	*	*			trans	-75	140.2	176.5	48.2	0	0	0	0	110.9	L8	S6-L8 PolarHBondContact O-N 3.2Å
7	F	30.6	Very low	38.7	Very low	207 Å²	207	125.8 Å²	125.8	91%	0.908	64%	0.642	S	S	*	*			trans	-67.1	88.7	174	-151.6	-97.3	0	0	0	108.4	S9	F7-S9 PolarHBondContact O-N 2.76Å; F7-S9 VanDerWaalsContact O-N 3.14Å
8	L	33.6	Very low	40	Very low	104 Å²	104	126.6 Å²	126.6	55%	0.545	64%	0.643	S	S	.	*			trans	-62.4	114.4	164.7	-84.5	163.5	0	0	0	107.1	S6	S6-L8 PolarHBondContact O-N 3.2Å
9	S	39.6	Very low	41.1	Very low	49 Å²	49	125.3 Å²	125.3	34%	0.343	64%	0.638	S	S	.	*			trans	-62.4	149.4	-177.1	76.8	0	0	0	0	110.5	F7 Y11 S12 M13	F7-S9 PolarHBondContact O-N 2.76Å; F7-S9 VanDerWaalsContact O-N 3.14Å; S9-Y11 PolarHBondContact O-N 2.81Å; S9-S12 WeakPolarHBondContact O-CB 3.19Å; S9-S12 PolarHBondContact O-N 3.46Å; S9-S12 PolarHBondContact OG-N 3.05Å; S9-S12 PolarHBondContact OG-OG 3.06Å; S9-M13 PolarHBondContact O-N 3.25Å
10	R	42.3	Very low	42.1	Very low	207 Å²	207	122.9 Å²	122.9	78%	0.781	62%	0.624	S	S	*	*	H	α-helix	trans	-50.6	-34.2	174	-75.2	-174.3	-173	178.8	1.7	112.6	S12 M13 E14	R10-S12 VanDerWaalsContact C-N 3.35Å; R10-S12 PolarHBondContact O-N 3.33Å; R10-M13 PolarHBondContact O-N 3.48Å; R10-E14 WeakPolarHBondContact O-CB 3.43Å; R10-E14 VanDerWaalsContact O-CG 3.29Å; R10-E14 WeakPolarHBondContact O-CG 3.36Å; R10-E14 PolarHBondContact O-N 3.47Å
11	Y	34	Very low	43.6	Very low	146 Å²	146	120.9 Å²	120.9	57%	0.573	62%	0.615	S	S	*	*	H	α-helix	trans	-64.6	-36.6	177.4	-173.4	-103.9	0	0	0	113.2	S9 K15	S9-Y11 PolarHBondContact O-N 2.81Å; Y11-K15 HydrophobicContact CD1-CD 4.43Å; Y11-K15 HydrophobicContact CE1-CD 3.81Å; Y11-K15 HydrophobicContact CE1-CG 4.42Å; Y11-K15 VanDerWaalsContact CZ-CE 3.46Å; Y11-K15 WeakPolarHBondContact O-CB 3.27Å; Y11-K15 PolarHBondContact O-N 2.92Å; Y11-K15 WeakPolarHBondContact OH-CE 3.27Å; Y11-K15 PolarHBondContact OH-NZ 2.96Å
12	S	40.3	Very low	46	Very low	41 Å²	41	115.3 Å²	115.3	29%	0.287	58%	0.584	S	S	.	*	H	α-helix	trans	-66.6	-45.3	173.9	-57.4	0	0	0	0	110.6	S9 R10 E14 K15 E16	S9-S12 WeakPolarHBondContact O-CB 3.19Å; S9-S12 PolarHBondContact O-N 3.46Å; S9-S12 PolarHBondContact OG-N 3.05Å; S9-S12 PolarHBondContact OG-OG 3.06Å; R10-S12 VanDerWaalsContact C-N 3.35Å; R10-S12 PolarHBondContact O-N 3.33Å; S12-E14 PolarHBondContact O-N 3.44Å; S12-K15 PolarHBondContact O-N 3.06Å; S12-E16 WeakPolarHBondContact O-CB 3.46Å; S12-E16 VanDerWaalsContact O-CG 3.29Å; S12-E16 WeakPolarHBondContact O-CG 3.42Å; S12-E16 PolarHBondContact O-N 3.24Å
13	M	42.9	Very low	48.6	Very low	114 Å²	114	110.5 Å²	110.5	56%	0.562	55%	0.551	S	S	*	*	H	α-helix	trans	-64.2	-38.1	176.9	-63.9	-178.5	67.5	0	0	112.7	S9 R10 E16 A17	S9-M13 PolarHBondContact O-N 3.25Å; R10-M13 PolarHBondContact O-N 3.48Å; M13-E16 PolarHBondContact O-N 3.4Å; M13-A17 WeakPolarHBondContact O-CB 3.47Å; M13-A17 PolarHBondContact O-N 2.76Å
14	E	44.9	Very low	51.4	Low	122 Å²	122	106.2 Å²	106.2	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-66.9	-42.9	176.6	-77.2	168	-172.3	0	0	111.5	R10 S12 A17 E18	R10-E14 WeakPolarHBondContact O-CB 3.43Å; R10-E14 VanDerWaalsContact O-CG 3.29Å; R10-E14 WeakPolarHBondContact O-CG 3.36Å; R10-E14 PolarHBondContact O-N 3.47Å; S12-E14 PolarHBondContact O-N 3.44Å; E14-A17 PolarHBondContact O-N 2.97Å; E14-E18 WeakPolarHBondContact O-CB 3.19Å; E14-E18 PolarHBondContact O-N 3.26Å
15	K	51.9	Low	54.4	Low	100 Å²	100	107.1 Å²	107.1	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-65.6	-39.1	173.8	-85.7	-168.8	167.2	178.4	0	113.1	Y11 S12 E18 N19	Y11-K15 HydrophobicContact CD1-CD 4.43Å; Y11-K15 HydrophobicContact CE1-CD 3.81Å; Y11-K15 HydrophobicContact CE1-CG 4.42Å; Y11-K15 VanDerWaalsContact CZ-CE 3.46Å; Y11-K15 WeakPolarHBondContact O-CB 3.27Å; Y11-K15 PolarHBondContact O-N 2.92Å; Y11-K15 WeakPolarHBondContact OH-CE 3.27Å; Y11-K15 PolarHBondContact OH-NZ 2.96Å; S12-K15 PolarHBondContact O-N 3.06Å; K15-E18 PolarHBondContact O-N 2.98Å; K15-N19 WeakPolarHBondContact O-CB 3.27Å; K15-N19 PolarHBondContact O-N 3.35Å; K15-N19 PolarHBondContact O-ND2 3.32Å
16	E	54.5	Low	57.3	Low	94 Å²	94	101.3 Å²	101.3	44%	0.439	49%	0.488	S	S	.	.	H	α-helix	trans	-60.7	-52.7	173.6	-77	164.1	-170.7	0	0	109.2	S12 M13 E18 N19 E20	S12-E16 WeakPolarHBondContact O-CB 3.46Å; S12-E16 VanDerWaalsContact O-CG 3.29Å; S12-E16 WeakPolarHBondContact O-CG 3.42Å; S12-E16 PolarHBondContact O-N 3.24Å; M13-E16 PolarHBondContact O-N 3.4Å; E16-E18 VanDerWaalsContact C-N 3.3Å; E16-E18 PolarHBondContact O-N 3.46Å; E16-N19 PolarHBondContact O-N 3.37Å; E16-N19 VanDerWaalsContact O-N 3.09Å; E16-E20 WeakPolarHBondContact O-CB 3.46Å; E16-E20 WeakPolarHBondContact O-CG 3.39Å; E16-E20 PolarHBondContact O-N 2.61Å
17	A	58.3	Low	60.1	Low	39 Å²	39	97 Å²	97	32%	0.322	46%	0.457	S	S	.	.	H	α-helix	trans	-59.9	-34.9	177.2	0	0	0	0	0	113.7	M13 E14 N21	M13-A17 WeakPolarHBondContact O-CB 3.47Å; M13-A17 PolarHBondContact O-N 2.76Å; E14-A17 PolarHBondContact O-N 2.97Å; A17-N21 WeakPolarHBondContact O-CB 3.37Å; A17-N21 PolarHBondContact O-N 3.04Å; A17-N21 PolarHBondContact O-ND2 2.98Å
18	E	61.3	Low	63.1	Low	140 Å²	140	87.2 Å²	87.2	65%	0.654	41%	0.414	S	S	*	.	H	α-helix	trans	-68.6	-41.7	174.9	-168.3	172.9	-165.1	0	0	111.7	E14 K15 E16 N21 K22	E14-E18 WeakPolarHBondContact O-CB 3.19Å; E14-E18 PolarHBondContact O-N 3.26Å; K15-E18 PolarHBondContact O-N 2.98Å; E16-E18 VanDerWaalsContact C-N 3.3Å; E16-E18 PolarHBondContact O-N 3.46Å; E18-N21 PolarHBondContact O-N 3.49Å; E18-K22 PolarHBondContact O-N 3.39Å; E18-K22 VanDerWaalsContact O-N 3.07Å
19	N	61.1	Low	65.9	Low	103 Å²	103	83.7 Å²	83.7	55%	0.551	40%	0.397	S	S	*	.	H	α-helix	trans	-68.7	-42.5	175.7	-77.5	-23.2	0	0	0	112.7	K15 E16 N21 K22 L23	K15-N19 WeakPolarHBondContact O-CB 3.27Å; K15-N19 PolarHBondContact O-N 3.35Å; K15-N19 PolarHBondContact O-ND2 3.32Å; E16-N19 PolarHBondContact O-N 3.37Å; E16-N19 VanDerWaalsContact O-N 3.09Å; N19-N21 PolarHBondContact O-N 3.48Å; N19-K22 WeakPolarHBondContact O-CB 3.47Å; N19-K22 PolarHBondContact O-N 3.42Å; N19-L23 PolarHBondContact O-N 2.82Å
20	E	60.7	Low	68.5	Low	76 Å²	76	84.4 Å²	84.4	36%	0.355	40%	0.395	S	S	.	.	H	α-helix	trans	-55.9	-41	174.5	-71.3	-179.5	168.1	0	0	110.6	E16 R24 Q183	E16-E20 WeakPolarHBondContact O-CB 3.46Å; E16-E20 WeakPolarHBondContact O-CG 3.39Å; E16-E20 PolarHBondContact O-N 2.61Å; E20-R24 WeakPolarHBondContact O-CG 3.38Å; E20-Q183 HydrophobicContact CG-CB 3.79Å; E20-Q183 HydrophobicContact CG-CG 3.85Å; E20-Q183 WeakPolarHBondContact OE1-CG 3.26Å
21	N	74.6	Confident	70.9	Confident	81 Å²	81	74.6 Å²	74.6	43%	0.433	36%	0.357	S	S	.	.	H	α-helix	trans	-72.8	-27.4	176.2	-80.2	-52.1	0	0	0	113.1	A17 E18 N19 K25	A17-N21 WeakPolarHBondContact O-CB 3.37Å; A17-N21 PolarHBondContact O-N 3.04Å; A17-N21 PolarHBondContact O-ND2 2.98Å; E18-N21 PolarHBondContact O-N 3.49Å; N19-N21 PolarHBondContact O-N 3.48Å; N21-K25 VanDerWaalsContact O-CB 3.3Å; N21-K25 WeakPolarHBondContact O-CB 3.45Å; N21-K25 VanDerWaalsContact O-CD 3.31Å; N21-K25 WeakPolarHBondContact O-CD 3.31Å; N21-K25 WeakPolarHBondContact O-CG 3.39Å; N21-K25 PolarHBondContact O-N 3.1Å; N21-K25 VanDerWaalsContact O-N 3.14Å
22	K	84.7	Confident	73.7	Confident	118 Å²	118	70 Å²	70	51%	0.513	35%	0.345	S	S	.	.	H	α-helix	trans	-69	-52.6	-179.5	-176.4	179.2	170.3	-177.4	0	111.7	E18 N19 R24 K25 E26	E18-K22 PolarHBondContact O-N 3.39Å; E18-K22 VanDerWaalsContact O-N 3.07Å; N19-K22 WeakPolarHBondContact O-CB 3.47Å; N19-K22 PolarHBondContact O-N 3.42Å; K22-R24 VanDerWaalsContact C-N 3.33Å; K22-R24 PolarHBondContact O-N 2.99Å; K22-K25 WeakPolarHBondContact O-CB 3.46Å; K22-K25 PolarHBondContact O-N 3.1Å; K22-K25 VanDerWaalsContact O-N 3.17Å; K22-E26 WeakPolarHBondContact CE-OE1 3.49Å; K22-E26 IonicContact NZ-OE1 3.9Å; K22-E26 WeakPolarHBondContact O-CG 3.37Å; K22-E26 PolarHBondContact O-N 3.02Å
23	L	86.4	Confident	76.1	Confident	35 Å²	35	74.5 Å²	74.5	18%	0.183	36%	0.361	C	S	.	.	H	α-helix	trans	-62.2	-42.1	-177.9	179.9	60.6	0	0	0	111.6	N19 K25 E26 L27 S184	N19-L23 PolarHBondContact O-N 2.82Å; L23-K25 VanDerWaalsContact C-N 3.32Å; L23-K25 PolarHBondContact O-N 2.69Å; L23-E26 PolarHBondContact O-N 2.87Å; L23-L27 HydrophobicContact CD1-CD1 3.89Å; L23-L27 HydrophobicContact CD1-CG 4.05Å; L23-L27 HydrophobicContact CG-CD1 3.88Å; L23-L27 HydrophobicContact CG-CG 4.42Å; L23-L27 WeakPolarHBondContact O-CG 3.39Å; L23-L27 PolarHBondContact O-N 3.48Å; L23-S184 WeakPolarHBondContact CD2-O 3.43Å
24	R	87.9	Confident	78.5	Confident	44 Å²	44	74.5 Å²	74.5	17%	0.166	36%	0.361	C	S	.	.	H	α-helix	trans	-64	-36.7	177.3	-63.5	179.4	79.9	-161.1	8.5	112.4	E20 K22 Y28 I38 P39	E20-R24 WeakPolarHBondContact O-CG 3.38Å; K22-R24 VanDerWaalsContact C-N 3.33Å; K22-R24 PolarHBondContact O-N 2.99Å; R24-Y28 PolarHBondContact O-N 3.13Å; R24-I38 VanDerWaalsContact NH2-C 3.32Å; R24-I38 VanDerWaalsContact NH2-CG2 3.29Å; R24-I38 PolarHBondContact NH2-O 2.89Å; R24-P39 PolarHBondContact NH2-O 3.22Å
25	K	90.1	Very high	80.8	Confident	117 Å²	117	75.8 Å²	75.8	51%	0.509	37%	0.372	S	S	.	.	H	α-helix	trans	-66.6	-38.1	173	-78.9	170.9	-174.5	-179.3	0	112.5	N21 K22 L23 P29 V32	N21-K25 VanDerWaalsContact O-CB 3.3Å; N21-K25 WeakPolarHBondContact O-CB 3.45Å; N21-K25 VanDerWaalsContact O-CD 3.31Å; N21-K25 WeakPolarHBondContact O-CD 3.31Å; N21-K25 WeakPolarHBondContact O-CG 3.39Å; N21-K25 PolarHBondContact O-N 3.1Å; N21-K25 VanDerWaalsContact O-N 3.14Å; K22-K25 WeakPolarHBondContact O-CB 3.46Å; K22-K25 PolarHBondContact O-N 3.1Å; K22-K25 VanDerWaalsContact O-N 3.17Å; L23-K25 VanDerWaalsContact C-N 3.32Å; L23-K25 PolarHBondContact O-N 2.69Å; K25-P29 WeakPolarHBondContact O-CA 3.35Å; K25-P29 WeakPolarHBondContact O-CB 3.42Å; K25-P29 WeakPolarHBondContact O-CD 3.47Å; K25-V32 HydrophobicContact CG-CG1 4.03Å; K25-V32 HydrophobicContact CG-CG2 4.16Å
26	E	90.5	Very high	82.7	Confident	96 Å²	96	72.4 Å²	72.4	45%	0.449	36%	0.362	S	S	.	.	H	α-helix	trans	-69.4	-40.6	177.5	-73.1	174.4	179.6	0	0	111.8	K22 L23	K22-E26 WeakPolarHBondContact CE-OE1 3.49Å; K22-E26 IonicContact NZ-OE1 3.9Å; K22-E26 WeakPolarHBondContact O-CG 3.37Å; K22-E26 PolarHBondContact O-N 3.02Å; L23-E26 PolarHBondContact O-N 2.87Å
27	L	91.7	Very high	84.6	Confident	4 Å²	4	73.2 Å²	73.2	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-78.5	-39.3	-178.7	-69.1	173.2	0	0	0	113.5	L23 P29 F186 I190 M191 H217	L23-L27 HydrophobicContact CD1-CD1 3.89Å; L23-L27 HydrophobicContact CD1-CG 4.05Å; L23-L27 HydrophobicContact CG-CD1 3.88Å; L23-L27 HydrophobicContact CG-CG 4.42Å; L23-L27 WeakPolarHBondContact O-CG 3.39Å; L23-L27 PolarHBondContact O-N 3.48Å; L27-P29 WeakPolarHBondContact O-CD 3.23Å; L27-F186 HydrophobicContact CD1-CD2 4.15Å; L27-F186 HydrophobicContact CD1-CE2 3.55Å; L27-I190 HydrophobicContact CD1-CG2 4.3Å; L27-I190 HydrophobicContact CD2-CG2 3.48Å; L27-I190 VanDerWaalsContact CD2-CG2 3.48Å; L27-M191 HydrophobicContact CD2-CE 4Å; L27-H217 PolarHBondContact O-ND1 2.9Å
28	Y	93.8	Very high	86.3	Confident	1 Å²	1	71.9 Å²	71.9	0%	0.004	36%	0.357	C	S	.	.			trans	-126.2	52.1	-171.8	-42.8	-52.8	0	0	0	112.7	R24 F30 A31 V32 I38 C77 L79 F80 Y81	R24-Y28 PolarHBondContact O-N 3.13Å; Y28-F30 VanDerWaalsContact C-N 3.3Å; Y28-F30 PolarHBondContact O-N 2.95Å; Y28-A31 PolarHBondContact O-N 2.89Å; Y28-A31 VanDerWaalsContact O-N 3.16Å; Y28-V32 WeakPolarHBondContact O-CG2 3.49Å; Y28-V32 PolarHBondContact O-N 3.48Å; Y28-I38 HydrophobicContact CD2-CD1 4.09Å; Y28-I38 HydrophobicContact CD2-CG2 4.17Å; Y28-I38 HydrophobicContact CE2-CG2 4.39Å; Y28-I38 HydrophobicContact CG-CD1 4.37Å; Y28-C77 HydrophobicContact CD1-CB 4.09Å; Y28-L79 WeakPolarHBondContact CE1-O 3.44Å; Y28-F80 HydrophobicContact CE1-CD2 4.5Å; Y28-F80 HydrophobicContact CE2-CD2 4.09Å; Y28-F80 HydrophobicContact CE2-CE2 4.33Å; Y28-F80 AromaticContact CZ-CD2 3.9Å; Y28-Y81 PolarHBondContact OH-N 3.24Å; Y28-Y81 PolarHBondContact OH-O 2.93Å
29	P	93.2	Very high	87.9	Confident	30 Å²	30	65.2 Å²	65.2	20%	0.195	33%	0.326	C	S	.	.	H	α-helix	trans	-59.3	-40.2	-172.5	21.5	-30.6	0	0	0	112.6	K25 L27 V32 Q33 K216 H217 P219	K25-P29 WeakPolarHBondContact O-CA 3.35Å; K25-P29 WeakPolarHBondContact O-CB 3.42Å; K25-P29 WeakPolarHBondContact O-CD 3.47Å; L27-P29 WeakPolarHBondContact O-CD 3.23Å; P29-V32 PolarHBondContact O-N 2.97Å; P29-Q33 WeakPolarHBondContact O-CB 3.3Å; P29-Q33 PolarHBondContact O-N 3.03Å; P29-K216 WeakPolarHBondContact CG-O 3.31Å; P29-H217 VanDerWaalsContact CG-O 3.25Å; P29-H217 WeakPolarHBondContact CG-O 3.32Å; P29-P219 HydrophobicContact CB-CG 4.17Å; P29-P219 HydrophobicContact CG-CG 4.31Å
30	F	93.1	Very high	89.4	Confident	65 Å²	65	61.7 Å²	61.7	29%	0.285	31%	0.309	S	S	.	.	H	α-helix	trans	-67	-42.1	177.4	-177	-112	0	0	0	113	Y28 V32 Q33 M34 A76 K216	Y28-F30 VanDerWaalsContact C-N 3.3Å; Y28-F30 PolarHBondContact O-N 2.95Å; F30-V32 VanDerWaalsContact C-N 3.3Å; F30-V32 PolarHBondContact O-N 3.14Å; F30-Q33 PolarHBondContact O-N 3.38Å; F30-M34 HydrophobicContact CD1-SD 4.01Å; F30-M34 HydrophobicContact CD2-CG 4.5Å; F30-M34 HydrophobicContact CE1-CG 4.24Å; F30-M34 HydrophobicContact CE1-SD 3.28Å; F30-M34 WeakPolarHBondContact CE1-SD 3.37Å; F30-M34 HydrophobicContact CE2-CG 4.18Å; F30-M34 HydrophobicContact CE2-SD 4.03Å; F30-M34 HydrophobicContact CZ-CG 4.05Å; F30-M34 HydrophobicContact CZ-SD 3.3Å; F30-M34 WeakPolarHBondContact CZ-SD 3.47Å; F30-M34 WeakPolarHBondContact O-CG 3.38Å; F30-M34 PolarHBondContact O-N 3.08Å; F30-A76 HydrophobicContact CD1-CB 3.87Å; F30-A76 HydrophobicContact CE1-CB 4.09Å; F30-K216 HydrophobicContact CB-CB 4.39Å; F30-K216 WeakPolarHBondContact CB-O 3.28Å; F30-K216 HydrophobicContact CD1-CG 4Å; F30-K216 HydrophobicContact CG-CG 4.5Å; F30-K216 PolarHBondContact N-O 3.17Å
31	A	93.6	Very high	91	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.1	-39.9	175.6	0	0	0	0	0	111.7	Y28 M34 D35 A36 I38 A76	Y28-A31 PolarHBondContact O-N 2.89Å; Y28-A31 VanDerWaalsContact O-N 3.16Å; A31-M34 PolarHBondContact O-N 2.81Å; A31-D35 PolarHBondContact O-N 3.34Å; A31-A36 HydrophobicContact CB-CB 4.12Å; A31-A36 VanDerWaalsContact O-CB 3.23Å; A31-A36 WeakPolarHBondContact O-CB 3.17Å; A31-A36 PolarHBondContact O-N 2.97Å; A31-I38 HydrophobicContact CB-CD1 3.64Å; A31-I38 HydrophobicContact CB-CG1 4.01Å; A31-A76 HydrophobicContact CB-CB 3.9Å
32	V	92.3	Very high	91.9	Very high	51 Å²	51	62.5 Å²	62.5	31%	0.309	31%	0.308	S	S	.	.	H	α-helix	trans	-66.6	-42.7	174.3	176.1	0	0	0	0	111.2	K25 Y28 P29 F30 M34 D35 I38	K25-V32 HydrophobicContact CG-CG1 4.03Å; K25-V32 HydrophobicContact CG-CG2 4.16Å; Y28-V32 WeakPolarHBondContact O-CG2 3.49Å; Y28-V32 PolarHBondContact O-N 3.48Å; P29-V32 PolarHBondContact O-N 2.97Å; F30-V32 VanDerWaalsContact C-N 3.3Å; F30-V32 PolarHBondContact O-N 3.14Å; V32-M34 PolarHBondContact O-N 3.25Å; V32-D35 PolarHBondContact O-N 3.47Å; V32-I38 HydrophobicContact CG2-CD1 4.16Å
33	Q	91	Very high	92.3	Very high	134 Å²	134	58.5 Å²	58.5	63%	0.626	29%	0.292	S	S	*	.	H	α-helix	trans	-60.7	-32.9	176.7	-179	-178.7	-9.7	0	0	112.6	P29 F30 D35	P29-Q33 WeakPolarHBondContact O-CB 3.3Å; P29-Q33 PolarHBondContact O-N 3.03Å; F30-Q33 PolarHBondContact O-N 3.38Å; Q33-D35 VanDerWaalsContact C-N 3.29Å
34	M	92.3	Very high	92.4	Very high	115 Å²	115	60.3 Å²	60.3	57%	0.567	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	5.4	176.9	-69	-167.1	77.3	0	0	114.2	F30 A31 V32 A36 A76	F30-M34 HydrophobicContact CD1-SD 4.01Å; F30-M34 HydrophobicContact CD2-CG 4.5Å; F30-M34 HydrophobicContact CE1-CG 4.24Å; F30-M34 HydrophobicContact CE1-SD 3.28Å; F30-M34 WeakPolarHBondContact CE1-SD 3.37Å; F30-M34 HydrophobicContact CE2-CG 4.18Å; F30-M34 HydrophobicContact CE2-SD 4.03Å; F30-M34 HydrophobicContact CZ-CG 4.05Å; F30-M34 HydrophobicContact CZ-SD 3.3Å; F30-M34 WeakPolarHBondContact CZ-SD 3.47Å; F30-M34 WeakPolarHBondContact O-CG 3.38Å; F30-M34 PolarHBondContact O-N 3.08Å; A31-M34 PolarHBondContact O-N 2.81Å; V32-M34 PolarHBondContact O-N 3.25Å; M34-A36 PolarHBondContact O-N 3.06Å; M34-A76 HydrophobicContact SD-CB 4.07Å
35	D	93	Very high	92.5	Very high	148 Å²	148	67.4 Å²	67.4	79%	0.791	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	35.3	-171.5	-65.5	-47.7	0	0	0	112.7	A31 V32 Q33	A31-D35 PolarHBondContact O-N 3.34Å; V32-D35 PolarHBondContact O-N 3.47Å; Q33-D35 VanDerWaalsContact C-N 3.29Å
36	A	93.3	Very high	92.4	Very high	29 Å²	29	64.1 Å²	64.1	24%	0.24	33%	0.326	C	S	.	.			trans	-69.4	141.5	-178.7	0	0	0	0	0	111.3	A31 M34 I38 P74 A76	A31-A36 HydrophobicContact CB-CB 4.12Å; A31-A36 VanDerWaalsContact O-CB 3.23Å; A31-A36 WeakPolarHBondContact O-CB 3.17Å; A31-A36 PolarHBondContact O-N 2.97Å; M34-A36 PolarHBondContact O-N 3.06Å; A36-I38 PolarHBondContact O-N 3.38Å; A36-P74 HydrophobicContact CB-CB 4.14Å; A36-P74 HydrophobicContact CB-CG 4.15Å; A36-A76 HydrophobicContact CB-CB 4.49Å
37	L	94.3	Very high	92.1	Very high	112 Å²	112	62.3 Å²	62.3	59%	0.586	32%	0.316	S	S	*	.			trans	-77.5	87.6	175.3	-61	173.2	0	0	0	109.9	F71	L37-F71 HydrophobicContact CB-CB 4.32Å; L37-F71 HydrophobicContact CB-CD1 3.73Å; L37-F71 HydrophobicContact CB-CD2 4.01Å; L37-F71 HydrophobicContact CB-CE1 4.02Å; L37-F71 HydrophobicContact CB-CE2 4.28Å; L37-F71 HydrophobicContact CB-CG 3.73Å; L37-F71 HydrophobicContact CB-CZ 4.28Å; L37-F71 HydrophobicContact CD1-CD1 3.91Å; L37-F71 HydrophobicContact CD1-CE1 3.65Å; L37-F71 HydrophobicContact CD1-CZ 4.27Å; L37-F71 HydrophobicContact CD2-CE1 4.28Å; L37-F71 HydrophobicContact CD2-CE2 4.42Å; L37-F71 HydrophobicContact CD2-CZ 4.06Å; L37-F71 HydrophobicContact CG-CD1 4.35Å; L37-F71 HydrophobicContact CG-CE1 4.2Å; L37-F71 HydrophobicContact CG-CZ 4.43Å; L37-F71 WeakPolarHBondContact O-CB 3.24Å
38	I	94	Very high	91.7	Very high	11 Å²	11	65.3 Å²	65.3	6%	0.056	33%	0.33	C	S	.	.			trans	-81.3	134.8	178.4	-55	169.5	0	0	0	108.7	R24 Y28 A31 V32 A36 S40 P74 F80	R24-I38 VanDerWaalsContact NH2-C 3.32Å; R24-I38 VanDerWaalsContact NH2-CG2 3.29Å; R24-I38 PolarHBondContact NH2-O 2.89Å; Y28-I38 HydrophobicContact CD2-CD1 4.09Å; Y28-I38 HydrophobicContact CD2-CG2 4.17Å; Y28-I38 HydrophobicContact CE2-CG2 4.39Å; Y28-I38 HydrophobicContact CG-CD1 4.37Å; A31-I38 HydrophobicContact CB-CD1 3.64Å; A31-I38 HydrophobicContact CB-CG1 4.01Å; V32-I38 HydrophobicContact CG2-CD1 4.16Å; A36-I38 PolarHBondContact O-N 3.38Å; I38-S40 PolarHBondContact O-N 3.42Å; I38-P74 HydrophobicContact CG1-CG 4.06Å; I38-F80 HydrophobicContact CG2-CD2 4.23Å; I38-F80 HydrophobicContact CG2-CE2 3.85Å
39	P	94.1	Very high	91.1	Very high	0 Å²	0	72 Å²	72	0%	0	36%	0.363	C	S	.	.			trans	-51.9	133.4	175.4	-23.7	31.3	0	0	0	111.6	R24 A69 D70 F71 V73 F80 P166 F181	R24-P39 PolarHBondContact NH2-O 3.22Å; P39-A69 HydrophobicContact CB-CB 3.98Å; P39-D70 WeakPolarHBondContact CA-OD1 3.13Å; P39-F71 WeakPolarHBondContact CG-O 3.46Å; P39-V73 HydrophobicContact CG-CG2 4.24Å; P39-F80 HydrophobicContact CB-CE2 4.36Å; P39-F80 HydrophobicContact CB-CZ 3.93Å; P39-F80 HydrophobicContact CG-CE2 4.2Å; P39-F80 HydrophobicContact CG-CZ 3.97Å; P39-P166 HydrophobicContact CB-CG 3.96Å; P39-P166 HydrophobicContact CG-CG 4.06Å; P39-F181 HydrophobicContact CB-CD1 4.36Å
40	S	93.7	Very high	90.2	Very high	28 Å²	28	73.8 Å²	73.8	20%	0.196	37%	0.368	C	S	.	.			trans	-135.3	-22.6	-173.8	72.4	0	0	0	0	113.9	I38 D70 F181 Q183	I38-S40 PolarHBondContact O-N 3.42Å; S40-D70 PolarHBondContact N-OD1 2.78Å; S40-D70 PolarHBondContact OG-OD2 2.87Å; S40-F181 WeakPolarHBondContact O-CD2 3.35Å; S40-Q183 PolarHBondContact O-NE2 3.23Å
41	Q	93.7	Very high	89.2	Confident	116 Å²	116	71.9 Å²	71.9	54%	0.542	36%	0.36	S	S	.	.	S	Bend	trans	-159.7	167.2	-178.5	58.5	-175.9	-5.5	0	0	110.4	A69 D70	Q41-A69 CarbonylContact O-C 3.58Å; Q41-A69 VanDerWaalsContact O-CA 3.31Å; Q41-A69 WeakPolarHBondContact O-CA 3.49Å; Q41-D70 HydrophobicContact CG-CB 4.27Å; Q41-D70 PolarHBondContact N-OD1 3.24Å; Q41-D70 PolarHBondContact O-N 3.32Å
42	W	93.8	Very high	87.6	Confident	59 Å²	59	79.2 Å²	79.2	22%	0.223	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	136.1	169.3	-62.8	126.5	0	0	0	111.6	P44 V67 A69 F82 I84 P166 V168 A179 F181	W42-P44 VanDerWaalsContact O-CD 3.3Å; W42-P44 WeakPolarHBondContact O-CD 3.22Å; W42-V67 HydrophobicContact CB-CG1 4.5Å; W42-V67 HydrophobicContact CB-CG2 3.82Å; W42-V67 HydrophobicContact CD2-CG1 3.87Å; W42-V67 HydrophobicContact CD2-CG2 4.46Å; W42-V67 HydrophobicContact CE3-CG1 3.9Å; W42-V67 HydrophobicContact CE3-CG2 4.3Å; W42-V67 HydrophobicContact CG-CG1 4.13Å; W42-V67 HydrophobicContact CG-CG2 4.31Å; W42-V67 HydrophobicContact CZ3-CG1 4.46Å; W42-A69 HydrophobicContact CE3-CB 4.46Å; W42-F82 HydrophobicContact CH2-CE2 4.5Å; W42-I84 HydrophobicContact CH2-CD1 4.12Å; W42-I84 HydrophobicContact CZ2-CD1 3.6Å; W42-P166 HydrophobicContact CZ3-CB 4.46Å; W42-V168 HydrophobicContact CD2-CG1 4.5Å; W42-V168 HydrophobicContact CH2-CB 3.87Å; W42-V168 HydrophobicContact CH2-CG1 3.74Å; W42-V168 HydrophobicContact CZ2-CB 3.9Å; W42-V168 HydrophobicContact CZ2-CG1 3.46Å; W42-V168 VanDerWaalsContact CZ2-CG1 3.46Å; W42-V168 HydrophobicContact CZ3-CG1 4.35Å; W42-A179 HydrophobicContact CZ2-CB 3.61Å; W42-F181 HydrophobicContact CD2-CE2 4.22Å; W42-F181 HydrophobicContact CD2-CZ 4.17Å; W42-F181 HydrophobicContact CE3-CE2 4.44Å; W42-F181 AromaticContact CE3-CZ 3.97Å; W42-F181 HydrophobicContact CE3-CZ 3.97Å; W42-F181 AromaticContact CH2-CZ 3.8Å; W42-F181 HydrophobicContact CH2-CZ 3.8Å; W42-F181 HydrophobicContact CZ2-CE2 4.38Å; W42-F181 HydrophobicContact CZ2-CZ 4.01Å; W42-F181 AromaticContact CZ3-CZ 3.78Å; W42-F181 HydrophobicContact CZ3-CZ 3.78Å
43	N	92.2	Very high	85.2	Confident	34 Å²	34	82.2 Å²	82.2	18%	0.182	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	115.9	178.3	-170.3	-32	0	0	0	110.1	K45 D46 R68	N43-K45 PolarHBondContact O-N 2.92Å; N43-K45 WeakPolarHBondContact OD1-CB 3.49Å; N43-K45 PolarHBondContact OD1-N 3.35Å; N43-D46 HydrophobicContact CB-CB 3.78Å; N43-D46 VanDerWaalsContact CG-CB 3.46Å; N43-D46 WeakPolarHBondContact ND2-CB 3.39Å; N43-D46 PolarHBondContact O-N 2.86Å; N43-D46 PolarHBondContact OD1-N 3.23Å; N43-D46 VanDerWaalsContact OD1-N 3.09Å; N43-R68 VanDerWaalsContact CB-O 3.26Å; N43-R68 WeakPolarHBondContact CB-O 3.48Å; N43-R68 PolarHBondContact N-O 3.39Å
44	P	88.8	Confident	83.2	Confident	72 Å²	72	79.6 Å²	79.6	47%	0.468	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-17.1	-177.3	28.7	-35.7	0	0	0	113.4	W42 K47	W42-P44 VanDerWaalsContact O-CD 3.3Å; W42-P44 WeakPolarHBondContact O-CD 3.22Å; P44-K47 WeakPolarHBondContact O-CE 3.19Å
45	K	90.4	Very high	81.1	Confident	193 Å²	193	80.9 Å²	80.9	84%	0.839	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	-31.2	178.7	-62.3	-179.7	-180	176.5	0	112.3	N43 K47	N43-K45 PolarHBondContact O-N 2.92Å; N43-K45 WeakPolarHBondContact OD1-CB 3.49Å; N43-K45 PolarHBondContact OD1-N 3.35Å; K45-K47 PolarHBondContact O-N 3.46Å
46	D	88	Confident	79.1	Confident	48 Å²	48	74.2 Å²	74.2	26%	0.257	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	70.7	-176.5	-164.3	7.4	0	0	0	112.2	N43 R68	N43-D46 HydrophobicContact CB-CB 3.78Å; N43-D46 VanDerWaalsContact CG-CB 3.46Å; N43-D46 WeakPolarHBondContact ND2-CB 3.39Å; N43-D46 PolarHBondContact O-N 2.86Å; N43-D46 PolarHBondContact OD1-N 3.23Å; N43-D46 VanDerWaalsContact OD1-N 3.09Å; D46-R68 PolarHBondContact O-N 3.49Å; D46-R68 VanDerWaalsContact O-N 3.09Å; D46-R68 IonicContact OD1-CZ 3.23Å; D46-R68 VanDerWaalsContact OD1-CZ 3.23Å; D46-R68 IonicContact OD1-NE 3.56Å; D46-R68 IonicContact OD1-NH2 2.67Å; D46-R68 PolarHBondContact OD1-NH2 3.39Å; D46-R68 IonicContact OD2-CZ 3.1Å; D46-R68 IonicContact OD2-NE 2.7Å; D46-R68 PolarHBondContact OD2-NE 3.29Å; D46-R68 IonicContact OD2-NH2 2.8Å; D46-R68 PolarHBondContact OD2-NH2 3.12Å
47	K	84.9	Confident	77.5	Confident	59 Å²	59	75.8 Å²	75.8	26%	0.257	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	152.3	-177.6	68.1	-179.1	-173.8	68.2	0	110.6	P44 K45 M51 K52 A66 V67	P44-K47 WeakPolarHBondContact O-CE 3.19Å; K45-K47 PolarHBondContact O-N 3.46Å; K47-M51 HydrophobicContact CB-CB 4.05Å; K47-M51 HydrophobicContact CD-CB 4.11Å; K47-M51 HydrophobicContact CG-CB 4.34Å; K47-M51 PolarHBondContact NZ-O 3.19Å; K47-K52 HydrophobicContact CD-CD 4.34Å; K47-K52 HydrophobicContact CD-CG 4.25Å; K47-K52 VanDerWaalsContact CE-CD 3.5Å; K47-K52 VanDerWaalsContact CE-CE 3.49Å; K47-A66 CarbonylContact C-O 3.59Å; K47-A66 WeakPolarHBondContact CA-O 3.29Å; K47-V67 HydrophobicContact CB-CB 3.74Å; K47-V67 HydrophobicContact CB-CG2 3.62Å
48	H	82.6	Confident	75.9	Confident	66 Å²	66	70.6 Å²	70.6	31%	0.306	35%	0.354	S	S	.	.			trans	-64.5	154.4	169.9	-167.7	-102	0	0	0	111.1	F50 M51 A65 A66	H48-F50 AromaticContact CE1-CD2 3.56Å; H48-F50 AromaticContact CE1-CE2 3.87Å; H48-F50 AromaticContact ND1-CD2 3.67Å; H48-F50 AromaticContact ND1-CG 3.88Å; H48-F50 PolarHBondContact O-N 3.05Å; H48-M51 WeakPolarHBondContact O-CB 3.33Å; H48-M51 PolarHBondContact O-N 2.81Å; H48-A65 HydrophobicContact CB-CB 3.88Å; H48-A66 PolarHBondContact N-O 2.96Å
49	M	80.6	Confident	74.5	Confident	141 Å²	141	78.6 Å²	78.6	70%	0.695	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.3	-173.9	68.2	-173.4	-54.4	0	0	113.9
50	F	75	Confident	73.4	Confident	68 Å²	68	80.7 Å²	80.7	30%	0.298	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.5	175.6	-59.1	-32.5	0	0	0	113.4	H48 K52 L53 A65	H48-F50 AromaticContact CE1-CD2 3.56Å; H48-F50 AromaticContact CE1-CE2 3.87Å; H48-F50 AromaticContact ND1-CD2 3.67Å; H48-F50 AromaticContact ND1-CG 3.88Å; H48-F50 PolarHBondContact O-N 3.05Å; F50-K52 PolarHBondContact O-N 3.47Å; F50-L53 CarbonylContact O-C 3.5Å; F50-L53 PolarHBondContact O-N 3.49Å; F50-L53 VanDerWaalsContact O-N 3.1Å; F50-A65 HydrophobicContact CB-CB 3.82Å
51	M	70.8	Confident	72.4	Confident	25 Å²	25	83.8 Å²	83.8	12%	0.123	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	122.7	169.5	-68.1	-56.1	-75.5	0	0	108.8	K47 H48 A65 A66 V67 V168 L170	K47-M51 HydrophobicContact CB-CB 4.05Å; K47-M51 HydrophobicContact CD-CB 4.11Å; K47-M51 HydrophobicContact CG-CB 4.34Å; K47-M51 PolarHBondContact NZ-O 3.19Å; H48-M51 WeakPolarHBondContact O-CB 3.33Å; H48-M51 PolarHBondContact O-N 2.81Å; M51-A65 HydrophobicContact CG-CB 4.01Å; M51-A65 HydrophobicContact SD-CB 4.15Å; M51-A66 WeakPolarHBondContact CG-O 3.26Å; M51-V67 HydrophobicContact CE-CB 4.17Å; M51-V67 HydrophobicContact CE-CG1 3.57Å; M51-V67 HydrophobicContact CG-CB 4.29Å; M51-V168 HydrophobicContact CE-CG1 4.43Å; M51-L170 HydrophobicContact CE-CD1 3.87Å; M51-L170 HydrophobicContact CE-CG 4.23Å; M51-L170 HydrophobicContact SD-CB 4.34Å; M51-L170 HydrophobicContact SD-CD1 4.04Å; M51-L170 HydrophobicContact SD-CG 4.22Å
52	K	60.9	Low	71.3	Confident	154 Å²	154	86 Å²	86	67%	0.67	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.4	-16	-167.2	-62.2	-174.7	177.6	174.6	0	115.6	K47 F50	K47-K52 HydrophobicContact CD-CD 4.34Å; K47-K52 HydrophobicContact CD-CG 4.25Å; K47-K52 VanDerWaalsContact CE-CD 3.5Å; K47-K52 VanDerWaalsContact CE-CE 3.49Å; F50-K52 PolarHBondContact O-N 3.47Å
53	L	42.9	Very low	70.5	Confident	114 Å²	114	84.2 Å²	84.2	60%	0.597	42%	0.417	S	S	*	.	S	Bend	trans	-142.4	111.3	-179.2	-67.7	170.3	0	0	0	109.8	F50 H55	F50-L53 CarbonylContact O-C 3.5Å; F50-L53 PolarHBondContact O-N 3.49Å; F50-L53 VanDerWaalsContact O-N 3.1Å; L53-H55 PolarHBondContact O-N 3.04Å
54	S	47.3	Very low	69.9	Low	79 Å²	79	83.5 Å²	83.5	55%	0.552	42%	0.416	S	S	*	.			trans	-62.7	37.7	-176.1	58.6	0	0	0	0	116.6
55	H	48.9	Very low	69.7	Low	142 Å²	142	80.3 Å²	80.3	66%	0.657	40%	0.395	S	S	*	.			trans	-125.9	26.4	-164.4	-59.4	86.6	0	0	0	113.9	L53	L53-H55 PolarHBondContact O-N 3.04Å
56	G	51.5	Low	69.5	Low	8 Å²	8	71.7 Å²	71.7	8%	0.082	36%	0.36	C	S	.	.			trans	-74.6	139.9	156.4	0	0	0	0	0	109.3	G58 P173	G56-G58 PolarHBondContact O-N 3.17Å; G56-G58 VanDerWaalsContact O-N 3.13Å; G56-P173 WeakPolarHBondContact O-CG 3.19Å
57	P	59.2	Low	69.6	Low	62 Å²	62	69.8 Å²	69.8	40%	0.403	35%	0.35	S	S	.	.			trans	-65.4	-16.2	179.3	26.6	-32.4	0	0	0	112.6	K59 D63 R91	P57-K59 HydrophobicContact CB-CD 4.1Å; P57-K59 HydrophobicContact CB-CG 4.02Å; P57-K59 PolarHBondContact O-N 3.07Å; P57-D63 WeakPolarHBondContact CD-OD1 3.39Å; P57-D63 WeakPolarHBondContact CG-OD1 3.49Å; P57-R91 PolarHBondContact O-NH1 3.4Å
58	G	61.5	Low	69.9	Low	3 Å²	3	71.7 Å²	71.7	3%	0.031	36%	0.356	C	S	.	.			trans	59.5	23.8	-179.2	0	0	0	0	0	112.5	G56 D63 R91 Q171	G56-G58 PolarHBondContact O-N 3.17Å; G56-G58 VanDerWaalsContact O-N 3.13Å; G58-D63 PolarHBondContact N-OD2 3.42Å; G58-R91 PolarHBondContact O-NH2 3.18Å; G58-Q171 VanDerWaalsContact CA-O 3.25Å; G58-Q171 WeakPolarHBondContact CA-O 3.46Å
59	K	64.4	Low	70.4	Confident	179 Å²	179	68.6 Å²	68.6	78%	0.778	34%	0.341	S	S	*	.	S	Bend	trans	-84.9	-23.7	-173.2	-74.2	178.5	-177.1	-177.2	0	112.1	P57 D63	P57-K59 HydrophobicContact CB-CD 4.1Å; P57-K59 HydrophobicContact CB-CG 4.02Å; P57-K59 PolarHBondContact O-N 3.07Å; K59-D63 PolarHBondContact N-OD2 3.01Å
60	S	70	Confident	71	Confident	45 Å²	45	63 Å²	63	32%	0.315	31%	0.314	S	S	.	.	S	Bend	trans	-143.8	166.6	178.7	72.1	0	0	0	0	111.3	K62 D63 Q171	S60-K62 PolarHBondContact O-N 2.96Å; S60-K62 WeakPolarHBondContact OG-CB 3.43Å; S60-K62 PolarHBondContact OG-N 2.9Å; S60-D63 PolarHBondContact N-OD2 3.14Å; S60-D63 WeakPolarHBondContact O-CB 3.23Å; S60-D63 PolarHBondContact O-N 3.4Å; S60-Q171 PolarHBondContact O-NE2 3.42Å
61	H	72.3	Confident	71.9	Confident	93 Å²	93	63.2 Å²	63.2	43%	0.431	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-55.7	-20.7	173.4	55.3	-94.1	0	0	0	113.1	D63 A64 W101	H61-D63 PolarHBondContact O-N 3.23Å; H61-A64 WeakPolarHBondContact O-CB 3.35Å; H61-A64 PolarHBondContact O-N 3.13Å; H61-A64 VanDerWaalsContact O-N 3.16Å; H61-W101 HydrophobicContact CB-CH2 4.06Å; H61-W101 HydrophobicContact CB-CZ2 3.83Å; H61-W101 AromaticContact CD2-CH2 3.61Å; H61-W101 AromaticContact CD2-CZ3 3.83Å; H61-W101 AromaticContact CE1-CH2 3.92Å; H61-W101 AromaticContact CG-CH2 3.52Å; H61-W101 AromaticContact CG-CZ2 3.83Å; H61-W101 AromaticContact ND1-CH2 3.72Å; H61-W101 AromaticContact NE2-CH2 3.91Å; H61-W101 AromaticContact NE2-CZ3 3.97Å
62	K	71.6	Confident	72.9	Confident	162 Å²	162	64.3 Å²	64.3	70%	0.704	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-69.2	-14.3	175.6	-57.8	-177.2	177.8	-179.8	0	113.7	S60 A64	S60-K62 PolarHBondContact O-N 2.96Å; S60-K62 WeakPolarHBondContact OG-CB 3.43Å; S60-K62 PolarHBondContact OG-N 2.9Å; K62-A64 VanDerWaalsContact C-N 3.31Å
63	D	76.8	Confident	74.4	Confident	22 Å²	22	57.1 Å²	57.1	12%	0.118	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-90.2	-1.6	176.5	-55.1	-50.3	0	0	0	111.9	P57 G58 K59 S60 H61	P57-D63 WeakPolarHBondContact CD-OD1 3.39Å; P57-D63 WeakPolarHBondContact CG-OD1 3.49Å; G58-D63 PolarHBondContact N-OD2 3.42Å; K59-D63 PolarHBondContact N-OD2 3.01Å; S60-D63 PolarHBondContact N-OD2 3.14Å; S60-D63 WeakPolarHBondContact O-CB 3.23Å; S60-D63 PolarHBondContact O-N 3.4Å; H61-D63 PolarHBondContact O-N 3.23Å
64	A	80	Confident	76.8	Confident	18 Å²	18	52.8 Å²	52.8	15%	0.149	27%	0.273	C	S	.	.			trans	-62	144.2	173.8	0	0	0	0	0	110.7	H61 K62 L170 Q171	H61-A64 WeakPolarHBondContact O-CB 3.35Å; H61-A64 PolarHBondContact O-N 3.13Å; H61-A64 VanDerWaalsContact O-N 3.16Å; K62-A64 VanDerWaalsContact C-N 3.31Å; A64-L170 CarbonylContact C-O 3.03Å; A64-L170 WeakPolarHBondContact CA-O 2.98Å; A64-Q171 HydrophobicContact CB-CB 4.4Å; A64-Q171 HydrophobicContact CB-CG 4.38Å
65	A	84.1	Confident	78.9	Confident	5 Å²	5	52.9 Å²	52.9	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	127.2	-176.6	0	0	0	0	0	109.2	H48 F50 M51 G169 L170	H48-A65 HydrophobicContact CB-CB 3.88Å; F50-A65 HydrophobicContact CB-CB 3.82Å; M51-A65 HydrophobicContact CG-CB 4.01Å; M51-A65 HydrophobicContact SD-CB 4.15Å; A65-G169 CarbonylContact O-C 3.57Å; A65-G169 VanDerWaalsContact O-CA 3.29Å; A65-G169 WeakPolarHBondContact O-CA 3.49Å; A65-L170 PolarHBondContact N-O 3.21Å; A65-L170 PolarHBondContact O-N 3.37Å
66	A	86.4	Confident	81	Confident	13 Å²	13	46.8 Å²	46.8	11%	0.107	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	160.1	177.8	0	0	0	0	0	113.6	K47 H48 M51 E99 I167 V168	K47-A66 CarbonylContact C-O 3.59Å; K47-A66 WeakPolarHBondContact CA-O 3.29Å; H48-A66 PolarHBondContact N-O 2.96Å; M51-A66 WeakPolarHBondContact CG-O 3.26Å; A66-E99 HydrophobicContact CB-CG 4.1Å; A66-E99 PolarHBondContact N-OE1 3.3Å; A66-I167 HydrophobicContact CB-CG2 4.02Å; A66-V168 VanDerWaalsContact CA-O 3.29Å; A66-V168 WeakPolarHBondContact CA-O 3.17Å
67	V	89.4	Confident	82.9	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.8	167.4	60	0	0	0	0	109.7	W42 K47 M51 I167 V168	W42-V67 HydrophobicContact CB-CG1 4.5Å; W42-V67 HydrophobicContact CB-CG2 3.82Å; W42-V67 HydrophobicContact CD2-CG1 3.87Å; W42-V67 HydrophobicContact CD2-CG2 4.46Å; W42-V67 HydrophobicContact CE3-CG1 3.9Å; W42-V67 HydrophobicContact CE3-CG2 4.3Å; W42-V67 HydrophobicContact CG-CG1 4.13Å; W42-V67 HydrophobicContact CG-CG2 4.31Å; W42-V67 HydrophobicContact CZ3-CG1 4.46Å; K47-V67 HydrophobicContact CB-CB 3.74Å; K47-V67 HydrophobicContact CB-CG2 3.62Å; M51-V67 HydrophobicContact CE-CB 4.17Å; M51-V67 HydrophobicContact CE-CG1 3.57Å; M51-V67 HydrophobicContact CG-CB 4.29Å; V67-I167 WeakPolarHBondContact O-CA 3.45Å; V67-V168 HydrophobicContact CG1-CG1 3.54Å; V67-V168 PolarHBondContact N-O 3.32Å; V67-V168 PolarHBondContact O-N 3.21Å
68	R	91.6	Very high	84.4	Confident	100 Å²	100	43.5 Å²	43.5	38%	0.377	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	155.1	172.7	-61.7	-160.8	-84.1	-88.5	-2.6	110.9	N43 D46 F165 P166 I167	N43-R68 VanDerWaalsContact CB-O 3.26Å; N43-R68 WeakPolarHBondContact CB-O 3.48Å; N43-R68 PolarHBondContact N-O 3.39Å; D46-R68 PolarHBondContact O-N 3.49Å; D46-R68 VanDerWaalsContact O-N 3.09Å; D46-R68 IonicContact OD1-CZ 3.23Å; D46-R68 VanDerWaalsContact OD1-CZ 3.23Å; D46-R68 IonicContact OD1-NE 3.56Å; D46-R68 IonicContact OD1-NH2 2.67Å; D46-R68 PolarHBondContact OD1-NH2 3.39Å; D46-R68 IonicContact OD2-CZ 3.1Å; D46-R68 IonicContact OD2-NE 2.7Å; D46-R68 PolarHBondContact OD2-NE 3.29Å; D46-R68 IonicContact OD2-NH2 2.8Å; D46-R68 PolarHBondContact OD2-NH2 3.12Å; R68-F165 HydrophobicContact CB-CB 4.27Å; R68-F165 HydrophobicContact CB-CD1 4.33Å; R68-F165 HydrophobicContact CG-CB 4.45Å; R68-P166 WeakPolarHBondContact CA-O 3.33Å; R68-I167 HydrophobicContact CB-CG1 4.49Å; R68-I167 HydrophobicContact CG-CD1 3.71Å; R68-I167 HydrophobicContact CG-CG1 3.85Å
69	A	93	Very high	85.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	166	167.7	0	0	0	0	0	111.7	P39 Q41 W42 F71 P166 F181	P39-A69 HydrophobicContact CB-CB 3.98Å; Q41-A69 CarbonylContact O-C 3.58Å; Q41-A69 VanDerWaalsContact O-CA 3.31Å; Q41-A69 WeakPolarHBondContact O-CA 3.49Å; W42-A69 HydrophobicContact CE3-CB 4.46Å; A69-F71 VanDerWaalsContact C-N 3.25Å; A69-F71 PolarHBondContact O-N 3.24Å; A69-P166 HydrophobicContact CB-CB 3.99Å; A69-P166 HydrophobicContact CB-CG 4.03Å; A69-P166 PolarHBondContact N-O 3.25Å; A69-F181 HydrophobicContact CB-CE1 4.29Å; A69-F181 HydrophobicContact CB-CZ 4.15Å
70	D	93.9	Very high	87.2	Confident	23 Å²	23	35.1 Å²	35.1	12%	0.123	19%	0.185	C	C	.	.	S	Bend	trans	-58.6	-31.7	177	53.5	-12.7	0	0	0	114	P39 S40 Q41	P39-D70 WeakPolarHBondContact CA-OD1 3.13Å; S40-D70 PolarHBondContact N-OD1 2.78Å; S40-D70 PolarHBondContact OG-OD2 2.87Å; Q41-D70 HydrophobicContact CG-CB 4.27Å; Q41-D70 PolarHBondContact N-OD1 3.24Å; Q41-D70 PolarHBondContact O-N 3.32Å
71	F	94.1	Very high	88.4	Confident	73 Å²	73	33 Å²	33	32%	0.32	17%	0.17	S	C	.	.	S	Bend	trans	-137.1	161.7	-179.9	-54.8	-69.3	0	0	0	112.9	L37 P39 A69 F165	L37-F71 HydrophobicContact CB-CB 4.32Å; L37-F71 HydrophobicContact CB-CD1 3.73Å; L37-F71 HydrophobicContact CB-CD2 4.01Å; L37-F71 HydrophobicContact CB-CE1 4.02Å; L37-F71 HydrophobicContact CB-CE2 4.28Å; L37-F71 HydrophobicContact CB-CG 3.73Å; L37-F71 HydrophobicContact CB-CZ 4.28Å; L37-F71 HydrophobicContact CD1-CD1 3.91Å; L37-F71 HydrophobicContact CD1-CE1 3.65Å; L37-F71 HydrophobicContact CD1-CZ 4.27Å; L37-F71 HydrophobicContact CD2-CE1 4.28Å; L37-F71 HydrophobicContact CD2-CE2 4.42Å; L37-F71 HydrophobicContact CD2-CZ 4.06Å; L37-F71 HydrophobicContact CG-CD1 4.35Å; L37-F71 HydrophobicContact CG-CE1 4.2Å; L37-F71 HydrophobicContact CG-CZ 4.43Å; L37-F71 WeakPolarHBondContact O-CB 3.24Å; P39-F71 WeakPolarHBondContact CG-O 3.46Å; A69-F71 VanDerWaalsContact C-N 3.25Å; A69-F71 PolarHBondContact O-N 3.24Å; F71-F165 WeakPolarHBondContact O-CD1 3.28Å
72	S	92.1	Very high	89.5	Confident	48 Å²	48	29.1 Å²	29.1	34%	0.336	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-76.1	152	165.9	56.6	0	0	0	0	109.8	P74	S72-P74 WeakPolarHBondContact O-CD 3.36Å
73	V	92.6	Very high	90.7	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.018	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-60.9	120.1	173.5	179.4	0	0	0	0	110.2	P39 C77 F80 M141 L164 P166	P39-V73 HydrophobicContact CG-CG2 4.24Å; V73-C77 HydrophobicContact CG1-CB 4.44Å; V73-F80 HydrophobicContact CB-CB 4.48Å; V73-F80 HydrophobicContact CB-CD1 4.42Å; V73-F80 HydrophobicContact CB-CG 4.4Å; V73-F80 HydrophobicContact CG1-CB 3.33Å; V73-F80 HydrophobicContact CG1-CD1 4.09Å; V73-F80 HydrophobicContact CG1-CD2 4.31Å; V73-F80 HydrophobicContact CG1-CG 3.66Å; V73-F80 HydrophobicContact CG2-CB 4.31Å; V73-F80 HydrophobicContact CG2-CD1 3.42Å; V73-F80 VanDerWaalsContact CG2-CD1 3.42Å; V73-F80 HydrophobicContact CG2-CE1 3.8Å; V73-F80 HydrophobicContact CG2-CG 3.84Å; V73-M141 HydrophobicContact CB-SD 4.15Å; V73-M141 HydrophobicContact CG1-CE 4.43Å; V73-M141 HydrophobicContact CG1-CG 3.93Å; V73-M141 HydrophobicContact CG1-SD 3.67Å; V73-M141 VanDerWaalsContact O-CE 3.29Å; V73-M141 WeakPolarHBondContact O-CE 3.42Å; V73-L164 WeakPolarHBondContact CG2-O 3.29Å; V73-L164 PolarHBondContact N-O 2.91Å; V73-P166 HydrophobicContact CG2-CG 4.29Å
74	P	92.6	Very high	91.6	Very high	24 Å²	24	21.3 Å²	21.3	16%	0.156	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-76.4	144.5	178.5	29.8	-32.2	0	0	0	110.8	A36 I38 S72 A76 C77	A36-P74 HydrophobicContact CB-CB 4.14Å; A36-P74 HydrophobicContact CB-CG 4.15Å; I38-P74 HydrophobicContact CG1-CG 4.06Å; S72-P74 WeakPolarHBondContact O-CD 3.36Å; P74-A76 PolarHBondContact O-N 2.67Å; P74-A76 VanDerWaalsContact O-N 3.13Å; P74-C77 VanDerWaalsContact CG-SG 3.57Å; P74-C77 WeakPolarHBondContact O-CB 3.47Å; P74-C77 PolarHBondContact O-N 3.38Å
75	V	91.3	Very high	92.4	Very high	80 Å²	80	22.2 Å²	22.2	49%	0.485	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-56.4	-31.4	176.1	175.8	0	0	0	0	111.8	C77 G78 M141	V75-C77 PolarHBondContact O-N 3.04Å; V75-C77 VanDerWaalsContact O-N 3.16Å; V75-G78 PolarHBondContact O-N 3.33Å; V75-G78 VanDerWaalsContact O-N 3.1Å; V75-M141 HydrophobicContact CB-CE 4.41Å; V75-M141 HydrophobicContact CG2-CE 3.74Å
76	A	92.6	Very high	92.9	Very high	15 Å²	15	22.2 Å²	22.2	12%	0.124	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-61.7	-18	177.9	0	0	0	0	0	113.9	F30 A31 M34 A36 P74 G78	F30-A76 HydrophobicContact CD1-CB 3.87Å; F30-A76 HydrophobicContact CE1-CB 4.09Å; A31-A76 HydrophobicContact CB-CB 3.9Å; M34-A76 HydrophobicContact SD-CB 4.07Å; A36-A76 HydrophobicContact CB-CB 4.49Å; P74-A76 PolarHBondContact O-N 2.67Å; P74-A76 VanDerWaalsContact O-N 3.13Å; A76-G78 PolarHBondContact O-N 3.1Å
77	C	92.6	Very high	93.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-67.3	-21.9	174	-79.4	0	0	0	0	113.2	Y28 V73 P74 V75 L79 F80 H217	Y28-C77 HydrophobicContact CD1-CB 4.09Å; V73-C77 HydrophobicContact CG1-CB 4.44Å; P74-C77 VanDerWaalsContact CG-SG 3.57Å; P74-C77 WeakPolarHBondContact O-CB 3.47Å; P74-C77 PolarHBondContact O-N 3.38Å; V75-C77 PolarHBondContact O-N 3.04Å; V75-C77 VanDerWaalsContact O-N 3.16Å; C77-L79 VanDerWaalsContact C-N 3.34Å; C77-L79 PolarHBondContact O-N 2.85Å; C77-F80 HydrophobicContact CB-CB 4.01Å; C77-H217 PolarHBondContact O-CE1 3.35Å
78	G	90.2	Very high	93.4	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	66.9	-91.8	-170.5	0	0	0	0	0	110.4	V75 A76 M141	V75-G78 PolarHBondContact O-N 3.33Å; V75-G78 VanDerWaalsContact O-N 3.1Å; A76-G78 PolarHBondContact O-N 3.1Å; G78-M141 WeakPolarHBondContact O-CB 3.33Å; G78-M141 PolarHBondContact O-N 3.29Å
79	L	91.3	Very high	93.2	Very high	7 Å²	7	26.4 Å²	26.4	4%	0.037	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	107.7	169.5	176.5	56.2	0	0	0	110.5	Y28 C77 N140 F147 I190 I194 H217	Y28-L79 WeakPolarHBondContact CE1-O 3.44Å; C77-L79 VanDerWaalsContact C-N 3.34Å; C77-L79 PolarHBondContact O-N 2.85Å; L79-N140 HydrophobicContact CD1-CB 4.11Å; L79-F147 HydrophobicContact CD1-CE1 3.78Å; L79-F147 HydrophobicContact CD1-CZ 4.36Å; L79-I190 HydrophobicContact CD2-CD1 3.59Å; L79-I190 HydrophobicContact CD2-CG1 4.41Å; L79-I190 HydrophobicContact CG-CD1 3.97Å; L79-I194 HydrophobicContact CB-CG1 4.37Å; L79-I194 HydrophobicContact CD2-CG1 3.84Å; L79-H217 PolarHBondContact N-NE2 3.15Å
80	F	93.2	Very high	92.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	150	173.9	176.7	-97.9	0	0	0	111.5	Y28 I38 P39 V73 C77 F82 G138 V139 P166 F181	Y28-F80 HydrophobicContact CE1-CD2 4.5Å; Y28-F80 HydrophobicContact CE2-CD2 4.09Å; Y28-F80 HydrophobicContact CE2-CE2 4.33Å; Y28-F80 AromaticContact CZ-CD2 3.9Å; I38-F80 HydrophobicContact CG2-CD2 4.23Å; I38-F80 HydrophobicContact CG2-CE2 3.85Å; P39-F80 HydrophobicContact CB-CE2 4.36Å; P39-F80 HydrophobicContact CB-CZ 3.93Å; P39-F80 HydrophobicContact CG-CE2 4.2Å; P39-F80 HydrophobicContact CG-CZ 3.97Å; V73-F80 HydrophobicContact CB-CB 4.48Å; V73-F80 HydrophobicContact CB-CD1 4.42Å; V73-F80 HydrophobicContact CB-CG 4.4Å; V73-F80 HydrophobicContact CG1-CB 3.33Å; V73-F80 HydrophobicContact CG1-CD1 4.09Å; V73-F80 HydrophobicContact CG1-CD2 4.31Å; V73-F80 HydrophobicContact CG1-CG 3.66Å; V73-F80 HydrophobicContact CG2-CB 4.31Å; V73-F80 HydrophobicContact CG2-CD1 3.42Å; V73-F80 VanDerWaalsContact CG2-CD1 3.42Å; V73-F80 HydrophobicContact CG2-CE1 3.8Å; V73-F80 HydrophobicContact CG2-CG 3.84Å; C77-F80 HydrophobicContact CB-CB 4.01Å; F80-F82 HydrophobicContact CD1-CD1 4.39Å; F80-F82 HydrophobicContact CE1-CB 4.19Å; F80-F82 AromaticContact CE1-CD1 3.68Å; F80-F82 HydrophobicContact CE1-CD1 3.68Å; F80-F82 HydrophobicContact CE1-CG 4.3Å; F80-F82 HydrophobicContact CZ-CB 4.33Å; F80-G138 CarbonylContact O-C 3.59Å; F80-G138 VanDerWaalsContact O-CA 3.29Å; F80-G138 WeakPolarHBondContact O-CA 3.44Å; F80-V139 PolarHBondContact N-O 2.93Å; F80-V139 PolarHBondContact O-N 2.85Å; F80-P166 HydrophobicContact CE1-CG 3.75Å; F80-P166 HydrophobicContact CZ-CG 4.18Å; F80-F181 HydrophobicContact CZ-CD1 4.2Å
81	Y	95	Very high	92.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	141.3	-178.8	-168	-103.4	0	0	0	112	Y28 E83 G136 C137 F147 T149 F186 Y188 I190	Y28-Y81 PolarHBondContact OH-N 3.24Å; Y28-Y81 PolarHBondContact OH-O 2.93Å; Y81-E83 HydrophobicContact CD1-CG 4.49Å; Y81-E83 HydrophobicContact CE1-CG 3.59Å; Y81-G136 WeakPolarHBondContact OH-CA 3.35Å; Y81-C137 WeakPolarHBondContact CA-O 3.36Å; Y81-C137 WeakPolarHBondContact CD2-O 3.2Å; Y81-F147 HydrophobicContact CD2-CE2 4.26Å; Y81-F147 HydrophobicContact CD2-CZ 4.26Å; Y81-F147 AromaticContact CE2-CE2 3.93Å; Y81-F147 HydrophobicContact CE2-CE2 3.93Å; Y81-F147 HydrophobicContact CE2-CZ 4.38Å; Y81-T149 HydrophobicContact CE2-CG2 3.92Å; Y81-T149 VanDerWaalsContact OH-CG2 3.26Å; Y81-T149 WeakPolarHBondContact OH-CG2 3.41Å; Y81-T149 PolarHBondContact OH-OG1 3.44Å; Y81-F186 HydrophobicContact CD1-CB 4.38Å; Y81-F186 AromaticContact CD1-CD1 3.93Å; Y81-F186 HydrophobicContact CD1-CD1 3.93Å; Y81-F186 AromaticContact CD1-CD2 3.61Å; Y81-F186 HydrophobicContact CD1-CD2 3.61Å; Y81-F186 HydrophobicContact CD1-CE1 4.06Å; Y81-F186 AromaticContact CD1-CE2 3.72Å; Y81-F186 HydrophobicContact CD1-CE2 3.72Å; Y81-F186 AromaticContact CD1-CG 3.71Å; Y81-F186 HydrophobicContact CD1-CG 3.71Å; Y81-F186 AromaticContact CD1-CZ 3.95Å; Y81-F186 HydrophobicContact CD1-CZ 3.95Å; Y81-F186 HydrophobicContact CE1-CB 4.05Å; Y81-F186 AromaticContact CE1-CD1 4Å; Y81-F186 HydrophobicContact CE1-CD1 4Å; Y81-F186 HydrophobicContact CE1-CD2 4.15Å; Y81-F186 HydrophobicContact CE1-CE1 4.5Å; Y81-F186 AromaticContact CE1-CG 3.81Å; Y81-F186 HydrophobicContact CE1-CG 3.81Å; Y81-F186 WeakPolarHBondContact O-CZ 3.15Å; Y81-Y188 HydrophobicContact CD2-CD1 4.47Å; Y81-Y188 HydrophobicContact CE1-CD1 4.19Å; Y81-Y188 HydrophobicContact CE1-CG 4.46Å; Y81-Y188 AromaticContact CE2-CD1 3.83Å; Y81-Y188 HydrophobicContact CE2-CD1 3.83Å; Y81-Y188 HydrophobicContact CE2-CG 4.48Å; Y81-Y188 AromaticContact CZ-CD1 3.65Å; Y81-Y188 AromaticContact CZ-CG 3.93Å; Y81-Y188 WeakPolarHBondContact OH-CB 3.33Å; Y81-I190 HydrophobicContact CD1-CB 4.27Å; Y81-I190 HydrophobicContact CD1-CG1 4.49Å; Y81-I190 HydrophobicContact CD2-CD1 3.88Å; Y81-I190 HydrophobicContact CD2-CG1 4.43Å; Y81-I190 HydrophobicContact CG-CB 4.26Å; Y81-I190 HydrophobicContact CG-CD1 3.96Å; Y81-I190 HydrophobicContact CG-CG1 4.01Å
82	F	95.4	Very high	91.5	Very high	12 Å²	12	32.2 Å²	32.2	5%	0.053	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.6	171.5	73.7	-76.2	0	0	0	110.4	W42 F80 I84 G136 C137 P166 N180 F181	W42-F82 HydrophobicContact CH2-CE2 4.5Å; F80-F82 HydrophobicContact CD1-CD1 4.39Å; F80-F82 HydrophobicContact CE1-CB 4.19Å; F80-F82 AromaticContact CE1-CD1 3.68Å; F80-F82 HydrophobicContact CE1-CD1 3.68Å; F80-F82 HydrophobicContact CE1-CG 4.3Å; F80-F82 HydrophobicContact CZ-CB 4.33Å; F82-I84 HydrophobicContact CD2-CD1 3.88Å; F82-I84 HydrophobicContact CD2-CG1 4.14Å; F82-I84 HydrophobicContact CE2-CD1 3.79Å; F82-I84 HydrophobicContact CE2-CG1 3.82Å; F82-G136 CarbonylContact O-C 3.59Å; F82-G136 VanDerWaalsContact O-CA 3.29Å; F82-G136 WeakPolarHBondContact O-CA 3.3Å; F82-C137 HydrophobicContact CD1-CB 3.97Å; F82-C137 WeakPolarHBondContact CD1-O 3.42Å; F82-C137 HydrophobicContact CE1-CB 3.38Å; F82-C137 HydrophobicContact CE2-CB 4.46Å; F82-C137 HydrophobicContact CZ-CB 3.65Å; F82-C137 PolarHBondContact N-O 3.32Å; F82-C137 VanDerWaalsContact N-O 3.15Å; F82-C137 PolarHBondContact O-N 2.74Å; F82-P166 HydrophobicContact CD1-CB 4.14Å; F82-P166 HydrophobicContact CD1-CG 4.31Å; F82-P166 HydrophobicContact CD2-CB 4.42Å; F82-P166 HydrophobicContact CE1-CB 3.74Å; F82-P166 HydrophobicContact CE1-CG 4.2Å; F82-P166 HydrophobicContact CE2-CB 4.09Å; F82-P166 HydrophobicContact CG-CB 4.45Å; F82-P166 HydrophobicContact CZ-CB 3.73Å; F82-N180 CarbonylContact C-O 3.46Å; F82-N180 WeakPolarHBondContact CA-O 3.41Å; F82-N180 WeakPolarHBondContact CB-O 3.45Å; F82-F181 HydrophobicContact CB-CD1 3.72Å; F82-F181 HydrophobicContact CB-CE1 4.06Å; F82-F181 HydrophobicContact CD2-CD1 4.43Å; F82-F181 AromaticContact CD2-CE1 3.94Å; F82-F181 HydrophobicContact CD2-CE1 3.94Å; F82-F181 HydrophobicContact CG-CD1 4.19Å; F82-F181 HydrophobicContact CG-CE1 4.02Å
83	E	97	Very high	90.1	Very high	5 Å²	5	30.1 Å²	30.1	2%	0.023	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	147.2	178.6	-73.3	-179.6	162	0	0	111.9	Y81 V134 I135 A179 N180 F186 V187 Y188	Y81-E83 HydrophobicContact CD1-CG 4.49Å; Y81-E83 HydrophobicContact CE1-CG 3.59Å; E83-V134 HydrophobicContact CB-CG1 3.84Å; E83-V134 HydrophobicContact CG-CG1 4.02Å; E83-I135 CarbonylContact C-O 3.56Å; E83-I135 WeakPolarHBondContact CA-O 3Å; E83-A179 CarbonylContact O-C 3.53Å; E83-A179 WeakPolarHBondContact O-CA 3.39Å; E83-N180 HydrophobicContact CB-CB 4.34Å; E83-N180 PolarHBondContact N-O 3.22Å; E83-N180 PolarHBondContact O-N 3.06Å; E83-F186 HydrophobicContact CB-CD1 4.14Å; E83-F186 HydrophobicContact CG-CD1 3.7Å; E83-F186 HydrophobicContact CG-CE1 4.36Å; E83-F186 HydrophobicContact CG-CG 4.45Å; E83-F186 WeakPolarHBondContact OE2-CA 3.41Å; E83-V187 VanDerWaalsContact CD-N 3.29Å; E83-V187 WeakPolarHBondContact OE1-CA 3.45Å; E83-V187 WeakPolarHBondContact OE1-CB 3.25Å; E83-V187 PolarHBondContact OE1-N 2.92Å; E83-V187 PolarHBondContact OE2-N 3.03Å; E83-Y188 PolarHBondContact OE1-N 3.25Å
84	I	95.6	Very high	88.6	Confident	14 Å²	14	31.6 Å²	31.6	7%	0.072	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	115.6	174.5	-55.6	-59.9	0	0	0	108.5	W42 F82 I86 I135 V177 E178 A179	W42-I84 HydrophobicContact CH2-CD1 4.12Å; W42-I84 HydrophobicContact CZ2-CD1 3.6Å; F82-I84 HydrophobicContact CD2-CD1 3.88Å; F82-I84 HydrophobicContact CD2-CG1 4.14Å; F82-I84 HydrophobicContact CE2-CD1 3.79Å; F82-I84 HydrophobicContact CE2-CG1 3.82Å; I84-I86 HydrophobicContact CG2-CD1 4.07Å; I84-I135 PolarHBondContact N-O 3.21Å; I84-I135 PolarHBondContact O-N 3.32Å; I84-V177 HydrophobicContact CG2-CB 3.69Å; I84-V177 HydrophobicContact CG2-CG1 4.03Å; I84-V177 HydrophobicContact CG2-CG2 4.28Å; I84-E178 CarbonylContact C-O 3.52Å; I84-E178 WeakPolarHBondContact CA-O 3.48Å; I84-A179 HydrophobicContact CD1-CB 3.59Å
85	T	96.1	Very high	87	Confident	38 Å²	38	30.8 Å²	30.8	23%	0.233	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	126.6	172.1	-56.8	0	0	0	0	109.4	I87 V134 V177 E178	T85-I87 HydrophobicContact CG2-CD1 3.85Å; T85-I87 PolarHBondContact O-N 3.28Å; T85-V134 HydrophobicContact CG2-CG2 4.27Å; T85-V177 CarbonylContact O-C 3.58Å; T85-V177 VanDerWaalsContact O-CA 3.26Å; T85-V177 WeakPolarHBondContact O-CA 3.32Å; T85-E178 PolarHBondContact N-O 3.21Å; T85-E178 PolarHBondContact O-N 2.8Å
86	I	94.4	Very high	85.3	Confident	4 Å²	4	27.6 Å²	27.6	2%	0.021	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	96	175.6	-48.6	-44.8	0	0	0	109.1	I84 L95 F129 T130 T131 G132 D133 V177	I84-I86 HydrophobicContact CG2-CD1 4.07Å; I86-L95 HydrophobicContact CB-CD1 4.3Å; I86-L95 HydrophobicContact CD1-CD1 3.77Å; I86-L95 HydrophobicContact CG1-CD1 3.91Å; I86-L95 HydrophobicContact CG2-CD1 3.4Å; I86-F129 HydrophobicContact CD1-CD2 4.32Å; I86-F129 HydrophobicContact CD1-CE2 4.39Å; I86-F129 HydrophobicContact CG1-CD2 4.13Å; I86-T130 WeakPolarHBondContact CB-O 3.38Å; I86-T131 WeakPolarHBondContact O-CA 3.47Å; I86-G132 PolarHBondContact O-N 2.94Å; I86-D133 PolarHBondContact N-O 3.33Å; I86-V177 HydrophobicContact CD1-CG1 3.84Å
87	I	94.4	Very high	83.2	Confident	84 Å²	84	27.5 Å²	27.5	43%	0.431	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	-37.4	178.1	-55.1	-60.3	0	0	0	110.8	T85 T131 V176 E178	T85-I87 HydrophobicContact CG2-CD1 3.85Å; T85-I87 PolarHBondContact O-N 3.28Å; I87-T131 WeakPolarHBondContact O-CG2 3.41Å; I87-V176 WeakPolarHBondContact CA-O 3.42Å; I87-V176 HydrophobicContact CB-CB 3.97Å; I87-V176 HydrophobicContact CB-CG1 3.79Å; I87-V176 WeakPolarHBondContact CB-O 3.21Å; I87-V176 HydrophobicContact CG1-CG1 4.23Å; I87-V176 HydrophobicContact CG2-CB 4.25Å; I87-V176 HydrophobicContact CG2-CG1 3.98Å; I87-V176 PolarHBondContact N-O 3.43Å; I87-E178 HydrophobicContact CD1-CB 4.09Å; I87-E178 HydrophobicContact CG1-CB 4.02Å
88	S	92	Very high	80.8	Confident	37 Å²	37	28.5 Å²	28.5	26%	0.259	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	130.9	175.6	170.6	0	0	0	0	109.9	G90 G174 E175 V176	S88-G90 PolarHBondContact O-N 3.27Å; S88-G90 PolarHBondContact OG-N 2.87Å; S88-G90 VanDerWaalsContact OG-N 3.09Å; S88-G174 VanDerWaalsContact CB-O 3.27Å; S88-G174 WeakPolarHBondContact CB-O 3.4Å; S88-G174 PolarHBondContact OG-O 3.39Å; S88-E175 CarbonylContact O-C 3.57Å; S88-E175 VanDerWaalsContact O-CA 3.3Å; S88-E175 WeakPolarHBondContact O-CA 3.46Å; S88-V176 PolarHBondContact N-O 3.46Å; S88-V176 PolarHBondContact O-N 2.87Å
89	K	88	Confident	78.5	Confident	87 Å²	87	32.3 Å²	32.3	38%	0.378	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-3.8	170.5	70.1	151.3	172.5	-177.1	0	114.1	G93 T130 T131 E175	K89-G93 WeakPolarHBondContact O-CA 3.33Å; K89-G93 PolarHBondContact O-N 3.31Å; K89-T130 WeakPolarHBondContact CD-OG1 3.19Å; K89-T131 PolarHBondContact N-OG1 2.81Å; K89-E175 WeakPolarHBondContact O-CG 3.29Å
90	G	87.6	Confident	76.4	Confident	22 Å²	22	32 Å²	32	23%	0.227	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	-141.5	-175.2	0	0	0	0	0	112.6	S88 P173 G174	S88-G90 PolarHBondContact O-N 3.27Å; S88-G90 PolarHBondContact OG-N 2.87Å; S88-G90 VanDerWaalsContact OG-N 3.09Å; G90-P173 WeakPolarHBondContact CA-O 3.46Å; G90-G174 WeakPolarHBondContact CA-O 3.44Å; G90-G174 PolarHBondContact N-O 2.86Å
91	R	82.9	Confident	74.4	Confident	119 Å²	119	39.1 Å²	39.1	45%	0.449	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-57.3	-175.3	-166.5	-178.3	69.5	-152.8	-3.3	112	P57 G58 T172 P173	P57-R91 PolarHBondContact O-NH1 3.4Å; G58-R91 PolarHBondContact O-NH2 3.18Å; R91-T172 PolarHBondContact N-OG1 3.46Å; R91-P173 PolarHBondContact N-O 2.81Å; R91-P173 VanDerWaalsContact N-O 3.11Å
92	D	74	Confident	72.7	Confident	77 Å²	77	44.4 Å²	44.4	41%	0.412	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115	-13	-168.8	-54.6	-43.3	0	0	0	113.1	L94 T172	D92-L94 VanDerWaalsContact C-N 3.34Å; D92-L94 HydrophobicContact CB-CD1 4.27Å; D92-L94 HydrophobicContact CB-CG 3.98Å; D92-T172 HydrophobicContact CB-CG2 3.87Å; D92-T172 PolarHBondContact N-OG1 3.46Å; D92-T172 WeakPolarHBondContact OD2-CG2 3.48Å
93	G	63.3	Low	71.4	Confident	5 Å²	5	53 Å²	53	5%	0.052	26%	0.26	C	S	.	.			trans	70.6	30	-177.2	0	0	0	0	0	113.6	K89 L95	K89-G93 WeakPolarHBondContact O-CA 3.33Å; K89-G93 PolarHBondContact O-N 3.31Å; G93-L95 PolarHBondContact O-N 3.27Å
94	L	61.7	Low	70.4	Confident	33 Å²	33	63.2 Å²	63.2	17%	0.173	30%	0.298	C	S	.	.			trans	-78.3	58.6	174.9	-61.2	176.7	0	0	0	109.2	D92 N96 D111 Q171 T172 E175	D92-L94 VanDerWaalsContact C-N 3.34Å; D92-L94 HydrophobicContact CB-CD1 4.27Å; D92-L94 HydrophobicContact CB-CG 3.98Å; L94-N96 PolarHBondContact O-N 3.38Å; L94-D111 HydrophobicContact CD2-CB 3.78Å; L94-D111 VanDerWaalsContact CD2-CG 3.49Å; L94-D111 WeakPolarHBondContact CD2-OD2 3.32Å; L94-Q171 HydrophobicContact CB-CB 3.9Å; L94-Q171 HydrophobicContact CB-CG 4.45Å; L94-Q171 HydrophobicContact CD1-CG 4.2Å; L94-T172 HydrophobicContact CB-CG2 4.12Å; L94-T172 HydrophobicContact CD1-CG2 3.72Å; L94-T172 HydrophobicContact CG-CG2 4.07Å; L94-E175 PolarHBondContact N-OE1 2.94Å
95	L	58.4	Low	69.7	Low	7 Å²	7	63.1 Å²	63.1	4%	0.037	30%	0.299	C	S	.	.			trans	-75.6	84.7	173.3	-62.3	167.6	0	0	0	106.5	I86 G93 G97 G110 F129 L170 E175 V177	I86-L95 HydrophobicContact CB-CD1 4.3Å; I86-L95 HydrophobicContact CD1-CD1 3.77Å; I86-L95 HydrophobicContact CG1-CD1 3.91Å; I86-L95 HydrophobicContact CG2-CD1 3.4Å; G93-L95 PolarHBondContact O-N 3.27Å; L95-G97 PolarHBondContact O-N 2.81Å; L95-G110 PolarHBondContact O-N 3.43Å; L95-G110 VanDerWaalsContact O-N 3.16Å; L95-F129 HydrophobicContact CB-CE2 3.92Å; L95-F129 HydrophobicContact CD1-CD2 4.24Å; L95-F129 HydrophobicContact CD1-CE2 4.15Å; L95-L170 HydrophobicContact CD2-CD2 3.43Å; L95-L170 VanDerWaalsContact CD2-CD2 3.43Å; L95-E175 HydrophobicContact CD2-CB 4.06Å; L95-E175 HydrophobicContact CD2-CG 3.92Å; L95-V177 HydrophobicContact CD2-CG1 3.93Å
96	N	55.6	Low	69.2	Low	13 Å²	13	63.3 Å²	63.3	7%	0.07	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-80.8	104.9	-178.2	-61.8	-32.8	0	0	0	107.4	L94 I98 H109 G169 Q171	L94-N96 PolarHBondContact O-N 3.38Å; N96-I98 PolarHBondContact O-N 3.49Å; N96-H109 PolarHBondContact OD1-CE1 2.91Å; N96-H109 VanDerWaalsContact OD1-CE1 3.23Å; N96-H109 PolarHBondContact OD1-ND1 3.25Å; N96-H109 VanDerWaalsContact OD1-ND1 3.09Å; N96-G169 CarbonylContact C-O 3.58Å; N96-G169 PolarHBondContact N-O 2.84Å; N96-G169 VanDerWaalsContact N-O 3.09Å; N96-G169 CarbonylContact O-C 3.52Å; N96-G169 WeakPolarHBondContact O-CA 3.26Å; N96-G169 PolarHBondContact O-N 2.92Å; N96-Q171 PolarHBondContact ND2-OE1 3.27Å
97	G	48.1	Very low	68.9	Low	14 Å²	14	63.1 Å²	63.1	14%	0.144	30%	0.295	C	S	.	.	S	Bend	trans	-55	102.6	151.9	0	0	0	0	0	106.6	L95 C100 G107 Y108 H109	L95-G97 PolarHBondContact O-N 2.81Å; G97-C100 PolarHBondContact O-SG 3.02Å; G97-G107 WeakPolarHBondContact O-CA 3.5Å; G97-Y108 PolarHBondContact N-O 3.26Å; G97-H109 PolarHBondContact O-CD2 3.04Å; G97-H109 PolarHBondContact O-NE2 3Å
98	I	42.7	Very low	68.8	Low	21 Å²	21	59.3 Å²	59.3	11%	0.108	28%	0.275	C	S	.	.	S	Bend	trans	77.3	139.8	170.6	-52.3	-149.4	0	0	0	115.8	N96 C100 Y106 I167	N96-I98 PolarHBondContact O-N 3.49Å; I98-C100 WeakPolarHBondContact CB-SG 3.46Å; I98-C100 HydrophobicContact CG2-CB 4.5Å; I98-C100 PolarHBondContact O-N 3.37Å; I98-Y106 WeakPolarHBondContact CD1-O 3.31Å; I98-Y106 WeakPolarHBondContact CG1-O 3.39Å; I98-I167 HydrophobicContact CD1-CB 4.03Å; I98-I167 HydrophobicContact CD1-CD1 4.12Å; I98-I167 HydrophobicContact CD1-CG1 4.32Å; I98-I167 HydrophobicContact CD1-CG2 4.48Å; I98-I167 HydrophobicContact CG1-CB 4.01Å; I98-I167 HydrophobicContact CG1-CG2 4.07Å
99	E	40.9	Very low	68.7	Low	80 Å²	80	58.1 Å²	58.1	37%	0.374	27%	0.265	S	S	.	.			trans	-59.9	74.7	152.5	-72.2	171.8	-168.6	0	0	108.4	A66 W101 S105	A66-E99 HydrophobicContact CB-CG 4.1Å; A66-E99 PolarHBondContact N-OE1 3.3Å; E99-W101 PolarHBondContact O-N 2.91Å; E99-S105 PolarHBondContact O-OG 2.99Å
100	C	49.3	Very low	68.9	Low	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	16.5	-167.8	-87.9	0	0	0	0	115.3	G97 I98 S105 G107 F116 S119	G97-C100 PolarHBondContact O-SG 3.02Å; I98-C100 WeakPolarHBondContact CB-SG 3.46Å; I98-C100 HydrophobicContact CG2-CB 4.5Å; I98-C100 PolarHBondContact O-N 3.37Å; C100-S105 WeakPolarHBondContact CA-OG 3.43Å; C100-G107 WeakPolarHBondContact SG-CA 3.3Å; C100-G107 PolarHBondContact SG-N 3.18Å; C100-G107 VanDerWaalsContact SG-N 3.36Å; C100-F116 HydrophobicContact CB-CB 3.45Å; C100-F116 VanDerWaalsContact CB-CB 3.45Å; C100-F116 HydrophobicContact CB-CD1 4.28Å; C100-F116 HydrophobicContact CB-CG 4.05Å; C100-F116 WeakPolarHBondContact SG-CB 3.32Å; C100-S119 CarbonylContact O-C 3.53Å; C100-S119 PolarHBondContact O-N 2.92Å; C100-S119 VanDerWaalsContact O-N 3.12Å
101	W	50.4	Low	68.9	Low	150 Å²	150	56.3 Å²	56.3	57%	0.568	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-15.1	-172.1	-61.9	44.8	0	0	0	110.4	H61 E99	H61-W101 HydrophobicContact CB-CH2 4.06Å; H61-W101 HydrophobicContact CB-CZ2 3.83Å; H61-W101 AromaticContact CD2-CH2 3.61Å; H61-W101 AromaticContact CD2-CZ3 3.83Å; H61-W101 AromaticContact CE1-CH2 3.92Å; H61-W101 AromaticContact CG-CH2 3.52Å; H61-W101 AromaticContact CG-CZ2 3.83Å; H61-W101 AromaticContact ND1-CH2 3.72Å; H61-W101 AromaticContact NE2-CH2 3.91Å; H61-W101 AromaticContact NE2-CZ3 3.97Å; E99-W101 PolarHBondContact O-N 2.91Å
102	D	59.3	Low	69.3	Low	110 Å²	110	53.4 Å²	53.4	59%	0.588	25%	0.248	S	C	*	.	S	Bend	trans	-98.1	150.1	179.2	-75.2	-29.1	0	0	0	112.9	S105	D102-S105 WeakPolarHBondContact O-CB 3.24Å; D102-S105 PolarHBondContact O-OG 2.87Å
103	K	68.4	Low	70.3	Confident	194 Å²	194	49.8 Å²	49.8	84%	0.843	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	139.1	177.2	-64.9	-179.1	180	179.3	0	110.3
104	R	75.9	Confident	71.7	Confident	218 Å²	218	51.2 Å²	51.2	82%	0.823	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	73	37.1	177.2	-50	175.5	177.2	166.3	-1.7	114	S118	R104-S118 WeakPolarHBondContact CA-OG 3.35Å; R104-S118 PolarHBondContact N-OG 3.16Å
105	S	80.7	Confident	73.1	Confident	13 Å²	13	50 Å²	50	9%	0.091	23%	0.23	C	C	.	.			trans	-131.9	142	-179.9	84.6	0	0	0	0	109	E99 C100 D102 S118	E99-S105 PolarHBondContact O-OG 2.99Å; C100-S105 WeakPolarHBondContact CA-OG 3.43Å; D102-S105 WeakPolarHBondContact O-CB 3.24Å; D102-S105 PolarHBondContact O-OG 2.87Å; S105-S118 PolarHBondContact N-OG 3Å; S105-S118 WeakPolarHBondContact O-CA 3.42Å; S105-S118 PolarHBondContact O-N 3.31Å; S105-S118 PolarHBondContact O-OG 2.96Å
106	Y	85.7	Confident	74.4	Confident	42 Å²	42	50.5 Å²	50.5	17%	0.165	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	118.9	-170.5	-56.6	-86.9	0	0	0	112.9	I98 F116 A117 Y148 F159 F160 G161 L164	I98-Y106 WeakPolarHBondContact CD1-O 3.31Å; I98-Y106 WeakPolarHBondContact CG1-O 3.39Å; Y106-F116 CarbonylContact C-O 3.48Å; Y106-F116 VanDerWaalsContact CA-O 3.31Å; Y106-F116 WeakPolarHBondContact CA-O 3.46Å; Y106-A117 HydrophobicContact CD1-CB 3.96Å; Y106-A117 HydrophobicContact CE1-CB 4.19Å; Y106-Y148 PolarHBondContact O-OH 2.98Å; Y106-F159 HydrophobicContact CD1-CB 3.6Å; Y106-F159 HydrophobicContact CD1-CD1 4.21Å; Y106-F159 AromaticContact CD1-CD2 3.94Å; Y106-F159 HydrophobicContact CD1-CD2 3.94Å; Y106-F159 AromaticContact CD1-CG 3.67Å; Y106-F159 HydrophobicContact CD1-CG 3.67Å; Y106-F159 HydrophobicContact CE1-CB 4.02Å; Y106-F159 HydrophobicContact CE1-CG 4.47Å; Y106-F159 HydrophobicContact CG-CB 4.47Å; Y106-F159 HydrophobicContact CG-CD2 4.29Å; Y106-F159 HydrophobicContact CG-CG 4.45Å; Y106-F160 WeakPolarHBondContact CE1-O 3.29Å; Y106-F160 PolarHBondContact OH-O 3.39Å; Y106-G161 WeakPolarHBondContact OH-CA 3.24Å; Y106-L164 HydrophobicContact CD2-CD1 4.21Å; Y106-L164 HydrophobicContact CD2-CD2 3.67Å; Y106-L164 HydrophobicContact CE2-CD2 3.7Å
107	G	88.1	Confident	75.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	154.3	-168.8	0	0	0	0	0	115.1	G97 C100 S115 F116 F159	G97-G107 WeakPolarHBondContact O-CA 3.5Å; C100-G107 WeakPolarHBondContact SG-CA 3.3Å; C100-G107 PolarHBondContact SG-N 3.18Å; C100-G107 VanDerWaalsContact SG-N 3.36Å; G107-S115 CarbonylContact O-C 3.2Å; G107-S115 VanDerWaalsContact O-CA 3.29Å; G107-S115 WeakPolarHBondContact O-CA 3.49Å; G107-F116 PolarHBondContact N-O 3.16Å; G107-F116 PolarHBondContact O-N 3.35Å; G107-F159 WeakPolarHBondContact O-CE2 3.31Å; G107-F159 VanDerWaalsContact O-CZ 3.3Å; G107-F159 WeakPolarHBondContact O-CZ 3.34Å
108	Y	91.6	Very high	77.5	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	121.3	166.2	175.3	-145	0	0	0	107.8	G97 G113 Y125 G126 P127 F129 I135 Y148 L155	G97-Y108 PolarHBondContact N-O 3.26Å; Y108-G113 WeakPolarHBondContact CE2-O 3.45Å; Y108-Y125 HydrophobicContact CD1-CE1 4.37Å; Y108-Y125 AromaticContact CD2-CD1 3.66Å; Y108-Y125 HydrophobicContact CD2-CD1 3.66Å; Y108-Y125 HydrophobicContact CD2-CE1 4.12Å; Y108-Y125 HydrophobicContact CE1-CE1 4.5Å; Y108-Y125 AromaticContact CE2-CD1 3.75Å; Y108-Y125 HydrophobicContact CE2-CD1 3.75Å; Y108-Y125 HydrophobicContact CE2-CE1 4.23Å; Y108-Y125 HydrophobicContact CG-CD1 4.16Å; Y108-Y125 HydrophobicContact CG-CE1 4.17Å; Y108-G126 WeakPolarHBondContact OH-CA 3.11Å; Y108-P127 WeakPolarHBondContact OH-CD 3.49Å; Y108-P127 PolarHBondContact OH-O 2.91Å; Y108-F129 HydrophobicContact CD1-CD1 4.23Å; Y108-F129 AromaticContact CD1-CE1 3.55Å; Y108-F129 HydrophobicContact CD1-CE1 3.55Å; Y108-F129 HydrophobicContact CD1-CZ 4.37Å; Y108-F129 HydrophobicContact CD2-CE1 4.12Å; Y108-F129 AromaticContact CE1-CD1 3.66Å; Y108-F129 HydrophobicContact CE1-CD1 3.66Å; Y108-F129 AromaticContact CE1-CE1 3.45Å; Y108-F129 HydrophobicContact CE1-CE1 3.45Å; Y108-F129 VanDerWaalsContact CE1-CE1 3.45Å; Y108-F129 HydrophobicContact CE2-CD1 4.4Å; Y108-F129 HydrophobicContact CE2-CE1 4.05Å; Y108-F129 AromaticContact CG-CE1 3.9Å; Y108-F129 HydrophobicContact CG-CE1 3.9Å; Y108-F129 AromaticContact CZ-CD1 3.78Å; Y108-F129 AromaticContact CZ-CE1 3.74Å; Y108-I135 HydrophobicContact CD1-CG2 4.01Å; Y108-I135 HydrophobicContact CE1-CD1 4.38Å; Y108-I135 HydrophobicContact CE1-CG2 4.24Å; Y108-Y148 AromaticContact CD1-CD1 3.84Å; Y108-Y148 HydrophobicContact CD1-CD1 3.84Å; Y108-Y148 HydrophobicContact CD1-CD2 4.33Å; Y108-Y148 HydrophobicContact CD1-CE1 4.47Å; Y108-Y148 AromaticContact CD1-CG 3.76Å; Y108-Y148 HydrophobicContact CD1-CG 3.76Å; Y108-Y148 HydrophobicContact CG-CD1 4.34Å; Y108-Y148 HydrophobicContact CG-CD2 4.34Å; Y108-Y148 HydrophobicContact CG-CG 4.2Å; Y108-L155 HydrophobicContact CE1-CD1 3.63Å; Y108-L155 WeakPolarHBondContact OH-CD1 3.39Å
109	H	90.8	Very high	79.3	Confident	12 Å²	12	54.1 Å²	54.1	6%	0.056	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-102.5	139.1	-170.5	-77.2	-148	0	0	0	111.9	N96 G97 D112 G113 N114 F116 F129	N96-H109 PolarHBondContact OD1-CE1 2.91Å; N96-H109 VanDerWaalsContact OD1-CE1 3.23Å; N96-H109 PolarHBondContact OD1-ND1 3.25Å; N96-H109 VanDerWaalsContact OD1-ND1 3.09Å; G97-H109 PolarHBondContact O-CD2 3.04Å; G97-H109 PolarHBondContact O-NE2 3Å; H109-D112 WeakPolarHBondContact CB-OD1 3.45Å; H109-G113 VanDerWaalsContact O-CA 3.3Å; H109-G113 WeakPolarHBondContact O-CA 3.3Å; H109-G113 PolarHBondContact O-N 3.25Å; H109-N114 PolarHBondContact N-O 2.8Å; H109-F116 HydrophobicContact CB-CD2 4.34Å; H109-F116 HydrophobicContact CB-CE2 3.79Å; H109-F116 AromaticContact CD2-CD2 3.51Å; H109-F116 AromaticContact CD2-CE2 3.71Å; H109-F116 AromaticContact CE1-CE2 3.83Å; H109-F116 AromaticContact CG-CD2 3.72Å; H109-F116 AromaticContact CG-CE2 3.39Å; H109-F116 AromaticContact ND1-CE2 3.48Å; H109-F116 WeakPolarHBondContact ND1-CE2 3.47Å; H109-F116 AromaticContact ND1-CZ 3.82Å; H109-F116 AromaticContact NE2-CD2 3.73Å; H109-F116 AromaticContact NE2-CE2 3.99Å; H109-F129 WeakPolarHBondContact O-CE1 3.28Å
110	G	91.2	Very high	81.3	Confident	2 Å²	2	52.1 Å²	52.1	2%	0.021	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-29.9	-173.3	0	0	0	0	0	115.1	L95 T128 F129	L95-G110 PolarHBondContact O-N 3.43Å; L95-G110 VanDerWaalsContact O-N 3.16Å; G110-T128 VanDerWaalsContact O-CA 3.31Å; G110-T128 WeakPolarHBondContact O-CA 3.48Å; G110-T128 VanDerWaalsContact O-CB 3.23Å; G110-T128 WeakPolarHBondContact O-CB 3.4Å; G110-F129 PolarHBondContact O-N 3.37Å
111	D	89.1	Confident	83	Confident	69 Å²	69	56.4 Å²	56.4	37%	0.369	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-35.4	-173.1	60.2	-60.4	0	0	0	113.5	L94 T128	L94-D111 HydrophobicContact CD2-CB 3.78Å; L94-D111 VanDerWaalsContact CD2-CG 3.49Å; L94-D111 WeakPolarHBondContact CD2-OD2 3.32Å; D111-T128 VanDerWaalsContact O-CG2 3.23Å; D111-T128 WeakPolarHBondContact O-CG2 3.41Å
112	D	91.4	Very high	84.8	Confident	58 Å²	58	50.2 Å²	50.2	31%	0.31	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-13.6	-177.1	65.6	4.5	0	0	0	114	H109 N114	H109-D112 WeakPolarHBondContact CB-OD1 3.45Å; D112-N114 PolarHBondContact O-N 3Å; D112-N114 WeakPolarHBondContact OD1-CB 3.34Å; D112-N114 PolarHBondContact OD1-N 2.67Å; D112-N114 WeakPolarHBondContact OD2-CB 3.26Å; D112-N114 PolarHBondContact OD2-ND2 3.11Å
113	G	93.2	Very high	86.3	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.01	27%	0.267	C	S	.	.			trans	70.5	14.8	-175.5	0	0	0	0	0	113.3	Y108 H109 G126	Y108-G113 WeakPolarHBondContact CE2-O 3.45Å; H109-G113 VanDerWaalsContact O-CA 3.3Å; H109-G113 WeakPolarHBondContact O-CA 3.3Å; H109-G113 PolarHBondContact O-N 3.25Å; G113-G126 WeakPolarHBondContact CA-O 3.46Å; G113-G126 PolarHBondContact O-N 3.4Å; G113-G126 VanDerWaalsContact O-O 3.09Å
114	N	93	Very high	87.6	Confident	35 Å²	35	47.1 Å²	47.1	19%	0.187	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	152	-179.5	-70	-35.1	0	0	0	111.8	H109 D112 F116 F123 P124	H109-N114 PolarHBondContact N-O 2.8Å; D112-N114 PolarHBondContact O-N 3Å; D112-N114 WeakPolarHBondContact OD1-CB 3.34Å; D112-N114 PolarHBondContact OD1-N 2.67Å; D112-N114 WeakPolarHBondContact OD2-CB 3.26Å; D112-N114 PolarHBondContact OD2-ND2 3.11Å; N114-F116 HydrophobicContact CB-CD2 4.37Å; N114-F116 HydrophobicContact CB-CE2 3.68Å; N114-F116 HydrophobicContact CB-CZ 4.21Å; N114-F123 CarbonylContact C-O 3.59Å; N114-F123 WeakPolarHBondContact CA-O 3.21Å; N114-F123 PolarHBondContact OD1-O 2.81Å; N114-P124 VanDerWaalsContact OD1-CA 3.26Å; N114-P124 WeakPolarHBondContact OD1-CA 3.31Å
115	S	91	Very high	88.4	Confident	8 Å²	8	39 Å²	39	6%	0.056	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	134.6	171.4	73.6	0	0	0	0	109.5	G107 G122 F123 Y125	G107-S115 CarbonylContact O-C 3.2Å; G107-S115 VanDerWaalsContact O-CA 3.29Å; G107-S115 WeakPolarHBondContact O-CA 3.49Å; S115-G122 CarbonylContact O-C 3.53Å; S115-G122 WeakPolarHBondContact O-CA 2.86Å; S115-F123 PolarHBondContact N-O 2.7Å; S115-F123 PolarHBondContact O-N 3.3Å; S115-F123 PolarHBondContact OG-O 3.13Å; S115-Y125 VanDerWaalsContact CB-CB 3.47Å
116	F	87.4	Confident	89.1	Confident	16 Å²	16	39.4 Å²	39.4	7%	0.07	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.3	178.3	-64.7	-105.5	0	0	0	110.6	C100 Y106 G107 H109 N114 G122 F159	C100-F116 HydrophobicContact CB-CB 3.45Å; C100-F116 VanDerWaalsContact CB-CB 3.45Å; C100-F116 HydrophobicContact CB-CD1 4.28Å; C100-F116 HydrophobicContact CB-CG 4.05Å; C100-F116 WeakPolarHBondContact SG-CB 3.32Å; Y106-F116 CarbonylContact C-O 3.48Å; Y106-F116 VanDerWaalsContact CA-O 3.31Å; Y106-F116 WeakPolarHBondContact CA-O 3.46Å; G107-F116 PolarHBondContact N-O 3.16Å; G107-F116 PolarHBondContact O-N 3.35Å; H109-F116 HydrophobicContact CB-CD2 4.34Å; H109-F116 HydrophobicContact CB-CE2 3.79Å; H109-F116 AromaticContact CD2-CD2 3.51Å; H109-F116 AromaticContact CD2-CE2 3.71Å; H109-F116 AromaticContact CE1-CE2 3.83Å; H109-F116 AromaticContact CG-CD2 3.72Å; H109-F116 AromaticContact CG-CE2 3.39Å; H109-F116 AromaticContact ND1-CE2 3.48Å; H109-F116 WeakPolarHBondContact ND1-CE2 3.47Å; H109-F116 AromaticContact ND1-CZ 3.82Å; H109-F116 AromaticContact NE2-CD2 3.73Å; H109-F116 AromaticContact NE2-CE2 3.99Å; N114-F116 HydrophobicContact CB-CD2 4.37Å; N114-F116 HydrophobicContact CB-CE2 3.68Å; N114-F116 HydrophobicContact CB-CZ 4.21Å; F116-G122 VanDerWaalsContact CE1-CA 3.42Å; F116-F159 VanDerWaalsContact C-CZ 3.46Å; F116-F159 VanDerWaalsContact N-CZ 3.28Å; F116-F159 VanDerWaalsContact O-CZ 3.24Å; F116-F159 WeakPolarHBondContact O-CZ 3.38Å
117	A	85.9	Confident	89.6	Confident	37 Å²	37	40.5 Å²	40.5	31%	0.306	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	101.4	177.9	0	0	0	0	0	111.1	Y106 S119 F159	Y106-A117 HydrophobicContact CD1-CB 3.96Å; Y106-A117 HydrophobicContact CE1-CB 4.19Å; A117-S119 WeakPolarHBondContact O-CB 3.43Å; A117-S119 PolarHBondContact O-N 2.91Å; A117-F159 HydrophobicContact CB-CD1 3.35Å; A117-F159 HydrophobicContact CB-CE1 3.42Å; A117-F159 VanDerWaalsContact CB-CE1 3.42Å; A117-F159 HydrophobicContact CB-CG 4.23Å; A117-F159 HydrophobicContact CB-CZ 4.34Å
118	S	82.4	Confident	89.9	Confident	47 Å²	47	44.2 Å²	44.2	33%	0.329	27%	0.274	S	S	.	.	S	Bend	trans	50	34.4	175.6	-61	0	0	0	0	112.9	R104 S105	R104-S118 WeakPolarHBondContact CA-OG 3.35Å; R104-S118 PolarHBondContact N-OG 3.16Å; S105-S118 PolarHBondContact N-OG 3Å; S105-S118 WeakPolarHBondContact O-CA 3.42Å; S105-S118 PolarHBondContact O-N 3.31Å; S105-S118 PolarHBondContact O-OG 2.96Å
119	S	81	Confident	90.1	Very high	41 Å²	41	44.7 Å²	44.7	29%	0.287	28%	0.276	S	S	.	.	S	Bend	trans	-158.4	137.6	-172	179.1	0	0	0	0	109.5	C100 A117 T121	C100-S119 CarbonylContact O-C 3.53Å; C100-S119 PolarHBondContact O-N 2.92Å; C100-S119 VanDerWaalsContact O-N 3.12Å; A117-S119 WeakPolarHBondContact O-CB 3.43Å; A117-S119 PolarHBondContact O-N 2.91Å; S119-T121 PolarHBondContact O-N 2.91Å; S119-T121 PolarHBondContact OG-N 2.88Å; S119-T121 VanDerWaalsContact OG-N 3.15Å
120	G	81	Confident	90.3	Very high	38 Å²	38	46.8 Å²	46.8	39%	0.392	29%	0.29	S	S	.	.	S	Bend	trans	-70.4	-1.4	170.9	0	0	0	0	0	114.1
121	T	86.6	Confident	90.5	Very high	89 Å²	89	50.1 Å²	50.1	55%	0.546	31%	0.31	S	S	.	.			trans	-95.8	115.9	173.6	-54	0	0	0	0	110	S119	S119-T121 PolarHBondContact O-N 2.91Å; S119-T121 PolarHBondContact OG-N 2.88Å; S119-T121 VanDerWaalsContact OG-N 3.15Å
122	G	87.9	Confident	90.9	Very high	20 Å²	20	49.6 Å²	49.6	21%	0.206	32%	0.321	C	S	.	.			trans	-80.4	152.2	175	0	0	0	0	0	112.6	S115 F116	S115-G122 CarbonylContact O-C 3.53Å; S115-G122 WeakPolarHBondContact O-CA 2.86Å; F116-G122 VanDerWaalsContact CE1-CA 3.42Å
123	F	91.1	Very high	91.2	Very high	122 Å²	122	47.9 Å²	47.9	54%	0.535	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.8	173.9	-66.4	-89.2	0	0	0	110.2	N114 S115 Y125	N114-F123 CarbonylContact C-O 3.59Å; N114-F123 WeakPolarHBondContact CA-O 3.21Å; N114-F123 PolarHBondContact OD1-O 2.81Å; S115-F123 PolarHBondContact N-O 2.7Å; S115-F123 PolarHBondContact O-N 3.3Å; S115-F123 PolarHBondContact OG-O 3.13Å; F123-Y125 PolarHBondContact O-N 2.86Å
124	P	94.1	Very high	91.4	Very high	118 Å²	118	48.7 Å²	48.7	77%	0.766	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.9	129.4	174.7	-26.8	34.9	0	0	0	111.6	N114	N114-P124 VanDerWaalsContact OD1-CA 3.26Å; N114-P124 WeakPolarHBondContact OD1-CA 3.31Å
125	Y	93.7	Very high	91.6	Very high	48 Å²	48	47.6 Å²	47.6	19%	0.188	31%	0.311	C	S	.	.			trans	-141.5	-62.4	-175.9	168.5	-120.1	0	0	0	112.7	Y108 S115 F123 Y148 L155 G156 P158	Y108-Y125 HydrophobicContact CD1-CE1 4.37Å; Y108-Y125 AromaticContact CD2-CD1 3.66Å; Y108-Y125 HydrophobicContact CD2-CD1 3.66Å; Y108-Y125 HydrophobicContact CD2-CE1 4.12Å; Y108-Y125 HydrophobicContact CE1-CE1 4.5Å; Y108-Y125 AromaticContact CE2-CD1 3.75Å; Y108-Y125 HydrophobicContact CE2-CD1 3.75Å; Y108-Y125 HydrophobicContact CE2-CE1 4.23Å; Y108-Y125 HydrophobicContact CG-CD1 4.16Å; Y108-Y125 HydrophobicContact CG-CE1 4.17Å; S115-Y125 VanDerWaalsContact CB-CB 3.47Å; F123-Y125 PolarHBondContact O-N 2.86Å; Y125-Y148 AromaticContact CE1-CD2 3.58Å; Y125-Y148 HydrophobicContact CE1-CD2 3.58Å; Y125-Y148 HydrophobicContact CE1-CE2 4.48Å; Y125-Y148 HydrophobicContact CE1-CG 4.13Å; Y125-Y148 AromaticContact CZ-CD2 3.94Å; Y125-Y148 PolarHBondContact OH-N 3.14Å; Y125-L155 HydrophobicContact CE1-CB 4.2Å; Y125-L155 HydrophobicContact CE1-CD1 4.33Å; Y125-L155 HydrophobicContact CE2-CB 4.29Å; Y125-L155 WeakPolarHBondContact CE2-O 3.21Å; Y125-L155 WeakPolarHBondContact OH-CB 3.29Å; Y125-G156 PolarHBondContact OH-O 2.92Å; Y125-P158 HydrophobicContact CD1-CB 4.36Å; Y125-P158 HydrophobicContact CD2-CB 3.76Å; Y125-P158 HydrophobicContact CD2-CG 4.37Å; Y125-P158 HydrophobicContact CE1-CB 4.32Å; Y125-P158 HydrophobicContact CE1-CG 4.09Å; Y125-P158 HydrophobicContact CE2-CB 3.72Å; Y125-P158 HydrophobicContact CE2-CG 3.86Å; Y125-P158 HydrophobicContact CG-CB 4.09Å; Y125-P158 WeakPolarHBondContact OH-CD 3.43Å
126	G	94.6	Very high	91.8	Very high	20 Å²	20	47.2 Å²	47.2	21%	0.206	31%	0.308	C	S	.	.	S	Bend	trans	-133.6	179	-172.5	0	0	0	0	0	112.8	Y108 G113	Y108-G126 WeakPolarHBondContact OH-CA 3.11Å; G113-G126 WeakPolarHBondContact CA-O 3.46Å; G113-G126 PolarHBondContact O-N 3.4Å; G113-G126 VanDerWaalsContact O-O 3.09Å
127	P	96.2	Very high	92.2	Very high	65 Å²	65	47.1 Å²	47.1	42%	0.422	31%	0.309	S	S	.	.			trans	-72	152.1	174	31	-35.9	0	0	0	111.8	Y108 K150 L155	Y108-P127 WeakPolarHBondContact OH-CD 3.49Å; Y108-P127 PolarHBondContact OH-O 2.91Å; P127-K150 HydrophobicContact CG-CD 3.68Å; P127-L155 HydrophobicContact CG-CD2 4.41Å
128	T	95.4	Very high	92.5	Very high	78 Å²	78	45.3 Å²	45.3	48%	0.479	29%	0.294	S	S	.	.			trans	-55.8	155.9	167.4	53.8	0	0	0	0	111.7	G110 D111 K150	G110-T128 VanDerWaalsContact O-CA 3.31Å; G110-T128 WeakPolarHBondContact O-CA 3.48Å; G110-T128 VanDerWaalsContact O-CB 3.23Å; G110-T128 WeakPolarHBondContact O-CB 3.4Å; D111-T128 VanDerWaalsContact O-CG2 3.23Å; D111-T128 WeakPolarHBondContact O-CG2 3.41Å; T128-K150 PolarHBondContact O-NZ 3.37Å
129	F	95	Very high	92.9	Very high	15 Å²	15	43.4 Å²	43.4	7%	0.066	28%	0.281	C	S	.	.			trans	-139.6	149.4	178.2	56.8	-99	0	0	0	112.7	I86 L95 Y108 H109 G110 D133 I135 K150	I86-F129 HydrophobicContact CD1-CD2 4.32Å; I86-F129 HydrophobicContact CD1-CE2 4.39Å; I86-F129 HydrophobicContact CG1-CD2 4.13Å; L95-F129 HydrophobicContact CB-CE2 3.92Å; L95-F129 HydrophobicContact CD1-CD2 4.24Å; L95-F129 HydrophobicContact CD1-CE2 4.15Å; Y108-F129 HydrophobicContact CD1-CD1 4.23Å; Y108-F129 AromaticContact CD1-CE1 3.55Å; Y108-F129 HydrophobicContact CD1-CE1 3.55Å; Y108-F129 HydrophobicContact CD1-CZ 4.37Å; Y108-F129 HydrophobicContact CD2-CE1 4.12Å; Y108-F129 AromaticContact CE1-CD1 3.66Å; Y108-F129 HydrophobicContact CE1-CD1 3.66Å; Y108-F129 AromaticContact CE1-CE1 3.45Å; Y108-F129 HydrophobicContact CE1-CE1 3.45Å; Y108-F129 VanDerWaalsContact CE1-CE1 3.45Å; Y108-F129 HydrophobicContact CE2-CD1 4.4Å; Y108-F129 HydrophobicContact CE2-CE1 4.05Å; Y108-F129 AromaticContact CG-CE1 3.9Å; Y108-F129 HydrophobicContact CG-CE1 3.9Å; Y108-F129 AromaticContact CZ-CD1 3.78Å; Y108-F129 AromaticContact CZ-CE1 3.74Å; H109-F129 WeakPolarHBondContact O-CE1 3.28Å; G110-F129 PolarHBondContact O-N 3.37Å; F129-D133 VanDerWaalsContact CA-OD2 3.24Å; F129-D133 WeakPolarHBondContact CA-OD2 3.48Å; F129-D133 HydrophobicContact CB-CB 4.1Å; F129-D133 WeakPolarHBondContact CB-OD2 3.37Å; F129-I135 HydrophobicContact CB-CD1 3.7Å; F129-I135 HydrophobicContact CB-CG1 4.1Å; F129-I135 HydrophobicContact CD1-CD1 3.74Å; F129-I135 HydrophobicContact CD1-CG1 3.93Å; F129-I135 HydrophobicContact CD2-CD1 4.25Å; F129-I135 HydrophobicContact CD2-CG1 3.73Å; F129-I135 HydrophobicContact CE1-CD1 4.42Å; F129-I135 HydrophobicContact CE1-CG1 4.26Å; F129-I135 HydrophobicContact CE2-CG1 4.06Å; F129-I135 HydrophobicContact CG-CD1 3.64Å; F129-I135 HydrophobicContact CG-CG1 3.65Å; F129-I135 HydrophobicContact CZ-CG1 4.31Å; F129-K150 HydrophobicContact CB-CD 4.47Å
130	T	95.6	Very high	93.3	Very high	55 Å²	55	42 Å²	42	34%	0.337	27%	0.27	S	S	.	.			trans	-149.1	-177.9	-168.1	-176.7	0	0	0	0	111.2	I86 K89 G132 D133	I86-T130 WeakPolarHBondContact CB-O 3.38Å; K89-T130 WeakPolarHBondContact CD-OG1 3.19Å; T130-G132 PolarHBondContact O-N 3.46Å; T130-D133 PolarHBondContact N-OD2 3.35Å; T130-D133 VanDerWaalsContact O-CB 3.32Å; T130-D133 WeakPolarHBondContact O-CB 3.27Å; T130-D133 PolarHBondContact O-N 3.01Å
131	T	95.8	Very high	93.5	Very high	72 Å²	72	41 Å²	41	44%	0.442	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.3	123.2	171.9	-55.9	0	0	0	0	112.4	I86 I87 K89	I86-T131 WeakPolarHBondContact O-CA 3.47Å; I87-T131 WeakPolarHBondContact O-CG2 3.41Å; K89-T131 PolarHBondContact N-OG1 2.81Å
132	G	96.6	Very high	93.3	Very high	59 Å²	59	40.3 Å²	40.3	61%	0.608	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	95	-16.1	179.8	0	0	0	0	0	114.9	I86 T130	I86-G132 PolarHBondContact O-N 2.94Å; T130-G132 PolarHBondContact O-N 3.46Å
133	D	97.7	Very high	93	Very high	22 Å²	22	42.7 Å²	42.7	12%	0.118	25%	0.254	C	S	.	.			trans	-75.6	149.9	173.5	-71.4	-44.6	0	0	0	111.5	I86 F129 T130 K150 N151	I86-D133 PolarHBondContact N-O 3.33Å; F129-D133 VanDerWaalsContact CA-OD2 3.24Å; F129-D133 WeakPolarHBondContact CA-OD2 3.48Å; F129-D133 HydrophobicContact CB-CB 4.1Å; F129-D133 WeakPolarHBondContact CB-OD2 3.37Å; T130-D133 PolarHBondContact N-OD2 3.35Å; T130-D133 VanDerWaalsContact O-CB 3.32Å; T130-D133 WeakPolarHBondContact O-CB 3.27Å; T130-D133 PolarHBondContact O-N 3.01Å; D133-K150 WeakPolarHBondContact OD1-CE 3.4Å; D133-K150 IonicContact OD1-NZ 3.52Å; D133-K150 WeakPolarHBondContact OD2-CE 3.42Å; D133-K150 IonicContact OD2-NZ 2.92Å; D133-K150 PolarHBondContact OD2-NZ 2.94Å; D133-N151 WeakPolarHBondContact CA-OD1 3.38Å; D133-N151 PolarHBondContact OD1-ND2 3.4Å
134	V	97.6	Very high	92.6	Very high	17 Å²	17	43.2 Å²	43.2	10%	0.103	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.3	170.2	-179.5	0	0	0	0	108.7	E83 T85 K150 N151 V187	E83-V134 HydrophobicContact CB-CG1 3.84Å; E83-V134 HydrophobicContact CG-CG1 4.02Å; T85-V134 HydrophobicContact CG2-CG2 4.27Å; V134-K150 WeakPolarHBondContact O-CA 3.47Å; V134-N151 PolarHBondContact N-OD1 3.48Å; V134-N151 PolarHBondContact O-N 2.82Å; V134-V187 HydrophobicContact CB-CG2 4.14Å; V134-V187 HydrophobicContact CG1-CB 4.41Å; V134-V187 HydrophobicContact CG1-CG2 3.92Å; V134-V187 HydrophobicContact CG2-CG2 4.06Å
135	I	97.1	Very high	92.3	Very high	13 Å²	13	38 Å²	38	7%	0.067	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.4	178.5	-57.4	-55.9	0	0	0	109.5	E83 I84 Y108 F129 Y148 T149 K150	E83-I135 CarbonylContact C-O 3.56Å; E83-I135 WeakPolarHBondContact CA-O 3Å; I84-I135 PolarHBondContact N-O 3.21Å; I84-I135 PolarHBondContact O-N 3.32Å; Y108-I135 HydrophobicContact CD1-CG2 4.01Å; Y108-I135 HydrophobicContact CE1-CD1 4.38Å; Y108-I135 HydrophobicContact CE1-CG2 4.24Å; F129-I135 HydrophobicContact CB-CD1 3.7Å; F129-I135 HydrophobicContact CB-CG1 4.1Å; F129-I135 HydrophobicContact CD1-CD1 3.74Å; F129-I135 HydrophobicContact CD1-CG1 3.93Å; F129-I135 HydrophobicContact CD2-CD1 4.25Å; F129-I135 HydrophobicContact CD2-CG1 3.73Å; F129-I135 HydrophobicContact CE1-CD1 4.42Å; F129-I135 HydrophobicContact CE1-CG1 4.26Å; F129-I135 HydrophobicContact CE2-CG1 4.06Å; F129-I135 HydrophobicContact CG-CD1 3.64Å; F129-I135 HydrophobicContact CG-CG1 3.65Å; F129-I135 HydrophobicContact CZ-CG1 4.31Å; I135-Y148 HydrophobicContact CG2-CD1 4.22Å; I135-T149 WeakPolarHBondContact CA-O 3.43Å; I135-K150 HydrophobicContact CD1-CB 3.85Å; I135-K150 HydrophobicContact CD1-CD 4.28Å; I135-K150 HydrophobicContact CD1-CG 3.77Å
136	G	96.3	Very high	92.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	157.3	173.5	0	0	0	0	0	112.8	Y81 F82 Y148 T149	Y81-G136 WeakPolarHBondContact OH-CA 3.35Å; F82-G136 CarbonylContact O-C 3.59Å; F82-G136 VanDerWaalsContact O-CA 3.29Å; F82-G136 WeakPolarHBondContact O-CA 3.3Å; G136-Y148 CarbonylContact O-C 3.47Å; G136-Y148 WeakPolarHBondContact O-CA 3.43Å; G136-Y148 WeakPolarHBondContact O-CB 3.39Å; G136-Y148 WeakPolarHBondContact O-CD1 3.39Å; G136-T149 VanDerWaalsContact CA-OG1 3.28Å; G136-T149 WeakPolarHBondContact CA-OG1 3.29Å; G136-T149 PolarHBondContact N-O 3.36Å; G136-T149 PolarHBondContact N-OG1 2.89Å; G136-T149 PolarHBondContact O-N 3.17Å
137	C	94.6	Very high	92	Very high	13 Å²	13	35.5 Å²	35.5	9%	0.088	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	116.7	174.7	176.2	0	0	0	0	109.4	Y81 F82 C146 F147 Y148	Y81-C137 WeakPolarHBondContact CA-O 3.36Å; Y81-C137 WeakPolarHBondContact CD2-O 3.2Å; F82-C137 HydrophobicContact CD1-CB 3.97Å; F82-C137 WeakPolarHBondContact CD1-O 3.42Å; F82-C137 HydrophobicContact CE1-CB 3.38Å; F82-C137 HydrophobicContact CE2-CB 4.46Å; F82-C137 HydrophobicContact CZ-CB 3.65Å; F82-C137 PolarHBondContact N-O 3.32Å; F82-C137 VanDerWaalsContact N-O 3.15Å; F82-C137 PolarHBondContact O-N 2.74Å; C137-C146 PolarHBondContact SG-SG 3.37Å; C137-F147 WeakPolarHBondContact CA-O 3.45Å; C137-Y148 HydrophobicContact CB-CD1 3.97Å; C137-Y148 HydrophobicContact CB-CE1 3.97Å
138	G	92.6	Very high	91.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134	176.7	0	0	0	0	0	111.5	F80 C146 F147	F80-G138 CarbonylContact O-C 3.59Å; F80-G138 VanDerWaalsContact O-CA 3.29Å; F80-G138 WeakPolarHBondContact O-CA 3.44Å; G138-C146 CarbonylContact O-C 3.53Å; G138-C146 WeakPolarHBondContact O-CA 3.41Å; G138-C146 PolarHBondContact O-SG 3.18Å; G138-C146 VanDerWaalsContact O-SG 3.39Å; G138-F147 PolarHBondContact N-O 2.76Å; G138-F147 PolarHBondContact O-N 3.19Å
139	V	90.6	Very high	92	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.042	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	110	-179.6	-175	0	0	0	0	108.9	F80 M141 L164	F80-V139 PolarHBondContact N-O 2.93Å; F80-V139 PolarHBondContact O-N 2.85Å; V139-M141 HydrophobicContact CG1-SD 3.78Å; V139-L164 HydrophobicContact CG1-CD1 4.48Å
140	N	88.4	Confident	92.1	Very high	12 Å²	12	30.6 Å²	30.6	6%	0.064	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	109.5	174.9	-173.8	-31.9	0	0	0	109.4	L79 E142 N143 R144 T145	L79-N140 HydrophobicContact CD1-CB 4.11Å; N140-E142 VanDerWaalsContact C-N 3.28Å; N140-E142 PolarHBondContact O-N 3.03Å; N140-E142 VanDerWaalsContact OD1-CB 3.26Å; N140-E142 WeakPolarHBondContact OD1-CB 3.44Å; N140-E142 PolarHBondContact OD1-N 3.09Å; N140-N143 WeakPolarHBondContact CB-OD1 3.36Å; N140-N143 PolarHBondContact ND2-OD1 3.18Å; N140-N143 PolarHBondContact OD1-N 2.74Å; N140-N143 PolarHBondContact OD1-OD1 2.94Å; N140-R144 WeakPolarHBondContact O-CA 3.33Å; N140-R144 PolarHBondContact O-N 3.12Å; N140-T145 PolarHBondContact N-O 3.18Å; N140-T145 PolarHBondContact O-N 3.15Å
141	M	87	Confident	92.2	Very high	16 Å²	16	31.3 Å²	31.3	8%	0.079	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.3	-177.2	-61.2	-61.5	-71	0	0	113.3	V73 V75 G78 V139	V73-M141 HydrophobicContact CB-SD 4.15Å; V73-M141 HydrophobicContact CG1-CE 4.43Å; V73-M141 HydrophobicContact CG1-CG 3.93Å; V73-M141 HydrophobicContact CG1-SD 3.67Å; V73-M141 VanDerWaalsContact O-CE 3.29Å; V73-M141 WeakPolarHBondContact O-CE 3.42Å; V75-M141 HydrophobicContact CB-CE 4.41Å; V75-M141 HydrophobicContact CG2-CE 3.74Å; G78-M141 WeakPolarHBondContact O-CB 3.33Å; G78-M141 PolarHBondContact O-N 3.29Å; V139-M141 HydrophobicContact CG1-SD 3.78Å
142	E	81.2	Confident	92.3	Very high	74 Å²	74	29.1 Å²	29.1	35%	0.346	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-58.7	179.4	-168	64.2	-138.5	0	0	110.8	N140 Q209 S212 K216	N140-E142 VanDerWaalsContact C-N 3.28Å; N140-E142 PolarHBondContact O-N 3.03Å; N140-E142 VanDerWaalsContact OD1-CB 3.26Å; N140-E142 WeakPolarHBondContact OD1-CB 3.44Å; N140-E142 PolarHBondContact OD1-N 3.09Å; E142-Q209 HydrophobicContact CG-CG 4.26Å; E142-S212 PolarHBondContact OE2-OG 2.74Å; E142-K216 IonicContact OE2-NZ 2.67Å; E142-K216 PolarHBondContact OE2-NZ 3.42Å
143	N	81.6	Confident	92.4	Very high	70 Å²	70	31.9 Å²	31.9	37%	0.374	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	2	-179.7	66.3	6.7	0	0	0	113.4	N140 T145	N140-N143 WeakPolarHBondContact CB-OD1 3.36Å; N140-N143 PolarHBondContact ND2-OD1 3.18Å; N140-N143 PolarHBondContact OD1-N 2.74Å; N140-N143 PolarHBondContact OD1-OD1 2.94Å; N143-T145 VanDerWaalsContact C-N 3.3Å; N143-T145 HydrophobicContact CB-CG2 4.41Å; N143-T145 PolarHBondContact O-N 2.8Å; N143-T145 WeakPolarHBondContact OD1-CG2 3.21Å; N143-T145 PolarHBondContact OD1-N 2.88Å; N143-T145 PolarHBondContact OD1-OG1 3.35Å
144	R	83.9	Confident	92.3	Very high	134 Å²	134	33.8 Å²	33.8	51%	0.506	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	37.4	173.7	-50.4	169.2	-179.2	-137.8	-4.6	111.8	N140 F160 G161 L162	N140-R144 WeakPolarHBondContact O-CA 3.33Å; N140-R144 PolarHBondContact O-N 3.12Å; R144-F160 CarbonylContact O-C 3.54Å; R144-F160 VanDerWaalsContact O-CA 3.24Å; R144-F160 WeakPolarHBondContact O-CA 3.46Å; R144-G161 CarbonylContact C-O 3.01Å; R144-G161 WeakPolarHBondContact CB-O 3.29Å; R144-G161 PolarHBondContact O-N 2.9Å; R144-L162 HydrophobicContact CB-CD2 4.13Å; R144-L162 HydrophobicContact CB-CG 4.25Å; R144-L162 HydrophobicContact CG-CD2 3.49Å; R144-L162 VanDerWaalsContact CG-CD2 3.49Å; R144-L162 HydrophobicContact CG-CG 4.05Å
145	T	87.4	Confident	92.2	Very high	8 Å²	8	35 Å²	35	5%	0.049	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	156.5	177.5	69.4	0	0	0	0	111.6	N140 N143 L157 F160	N140-T145 PolarHBondContact N-O 3.18Å; N140-T145 PolarHBondContact O-N 3.15Å; N143-T145 VanDerWaalsContact C-N 3.3Å; N143-T145 HydrophobicContact CB-CG2 4.41Å; N143-T145 PolarHBondContact O-N 2.8Å; N143-T145 WeakPolarHBondContact OD1-CG2 3.21Å; N143-T145 PolarHBondContact OD1-N 2.88Å; N143-T145 PolarHBondContact OD1-OG1 3.35Å; T145-L157 HydrophobicContact CG2-CD1 4.36Å; T145-F160 HydrophobicContact CG2-CD1 3.67Å; T145-F160 HydrophobicContact CG2-CE1 3.6Å
146	C	89.4	Confident	91.9	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.02	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	149.9	170.7	-170.8	0	0	0	0	108.6	C137 G138 L157 P158 F159	C137-C146 PolarHBondContact SG-SG 3.37Å; G138-C146 CarbonylContact O-C 3.53Å; G138-C146 WeakPolarHBondContact O-CA 3.41Å; G138-C146 PolarHBondContact O-SG 3.18Å; G138-C146 VanDerWaalsContact O-SG 3.39Å; C146-L157 WeakPolarHBondContact O-CD2 3.3Å; C146-P158 VanDerWaalsContact O-CD 3.3Å; C146-P158 WeakPolarHBondContact O-CD 3.35Å; C146-F159 PolarHBondContact N-O 2.92Å
147	F	91.7	Very high	91.5	Very high	12 Å²	12	40.9 Å²	40.9	5%	0.053	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	159.3	164.8	61.8	-87.3	0	0	0	110	L79 Y81 C137 G138 T149 G156 L157 Y188 I190	L79-F147 HydrophobicContact CD1-CE1 3.78Å; L79-F147 HydrophobicContact CD1-CZ 4.36Å; Y81-F147 HydrophobicContact CD2-CE2 4.26Å; Y81-F147 HydrophobicContact CD2-CZ 4.26Å; Y81-F147 AromaticContact CE2-CE2 3.93Å; Y81-F147 HydrophobicContact CE2-CE2 3.93Å; Y81-F147 HydrophobicContact CE2-CZ 4.38Å; C137-F147 WeakPolarHBondContact CA-O 3.45Å; G138-F147 PolarHBondContact N-O 2.76Å; G138-F147 PolarHBondContact O-N 3.19Å; F147-T149 HydrophobicContact CD2-CG2 3.94Å; F147-T149 HydrophobicContact CE2-CG2 3.79Å; F147-G156 WeakPolarHBondContact CB-O 2.87Å; F147-L157 HydrophobicContact CB-CD2 4.09Å; F147-Y188 HydrophobicContact CE2-CD1 4.46Å; F147-Y188 AromaticContact CE2-CE1 3.81Å; F147-Y188 HydrophobicContact CE2-CE1 3.81Å; F147-Y188 HydrophobicContact CZ-CE1 4.16Å; F147-I190 HydrophobicContact CZ-CD1 3.97Å
148	Y	94.5	Very high	90.8	Very high	21 Å²	21	41.7 Å²	41.7	8%	0.082	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	159.2	168.4	-63	-92.6	0	0	0	110.7	Y106 Y108 Y125 I135 G136 C137 L155 P158 F159	Y106-Y148 PolarHBondContact O-OH 2.98Å; Y108-Y148 AromaticContact CD1-CD1 3.84Å; Y108-Y148 HydrophobicContact CD1-CD1 3.84Å; Y108-Y148 HydrophobicContact CD1-CD2 4.33Å; Y108-Y148 HydrophobicContact CD1-CE1 4.47Å; Y108-Y148 AromaticContact CD1-CG 3.76Å; Y108-Y148 HydrophobicContact CD1-CG 3.76Å; Y108-Y148 HydrophobicContact CG-CD1 4.34Å; Y108-Y148 HydrophobicContact CG-CD2 4.34Å; Y108-Y148 HydrophobicContact CG-CG 4.2Å; Y125-Y148 AromaticContact CE1-CD2 3.58Å; Y125-Y148 HydrophobicContact CE1-CD2 3.58Å; Y125-Y148 HydrophobicContact CE1-CE2 4.48Å; Y125-Y148 HydrophobicContact CE1-CG 4.13Å; Y125-Y148 AromaticContact CZ-CD2 3.94Å; Y125-Y148 PolarHBondContact OH-N 3.14Å; I135-Y148 HydrophobicContact CG2-CD1 4.22Å; G136-Y148 CarbonylContact O-C 3.47Å; G136-Y148 WeakPolarHBondContact O-CA 3.43Å; G136-Y148 WeakPolarHBondContact O-CB 3.39Å; G136-Y148 WeakPolarHBondContact O-CD1 3.39Å; C137-Y148 HydrophobicContact CB-CD1 3.97Å; C137-Y148 HydrophobicContact CB-CE1 3.97Å; Y148-L155 WeakPolarHBondContact O-CB 3.36Å; Y148-L155 PolarHBondContact O-N 3.42Å; Y148-P158 HydrophobicContact CD2-CG 3.8Å; Y148-P158 HydrophobicContact CE2-CG 3.78Å; Y148-F159 HydrophobicContact CE2-CD2 4.41Å; Y148-F159 HydrophobicContact CE2-CE2 4.01Å
149	T	97.1	Very high	90	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	155.1	168.6	74.2	0	0	0	0	109.3	Y81 I135 G136 F147 I153 Y188	Y81-T149 HydrophobicContact CE2-CG2 3.92Å; Y81-T149 VanDerWaalsContact OH-CG2 3.26Å; Y81-T149 WeakPolarHBondContact OH-CG2 3.41Å; Y81-T149 PolarHBondContact OH-OG1 3.44Å; I135-T149 WeakPolarHBondContact CA-O 3.43Å; G136-T149 VanDerWaalsContact CA-OG1 3.28Å; G136-T149 WeakPolarHBondContact CA-OG1 3.29Å; G136-T149 PolarHBondContact N-O 3.36Å; G136-T149 PolarHBondContact N-OG1 2.89Å; G136-T149 PolarHBondContact O-N 3.17Å; F147-T149 HydrophobicContact CD2-CG2 3.94Å; F147-T149 HydrophobicContact CE2-CG2 3.79Å; T149-I153 CarbonylContact C-O 3.46Å; T149-I153 WeakPolarHBondContact CA-O 3.39Å; T149-I153 VanDerWaalsContact CB-O 3.29Å; T149-I153 WeakPolarHBondContact CB-O 3.19Å; T149-Y188 HydrophobicContact CG2-CD1 3.92Å; T149-Y188 HydrophobicContact CG2-CD2 3.81Å; T149-Y188 HydrophobicContact CG2-CE1 4.08Å; T149-Y188 HydrophobicContact CG2-CE2 3.97Å; T149-Y188 HydrophobicContact CG2-CG 3.76Å
150	K	97.8	Very high	89.3	Confident	35 Å²	35	49.1 Å²	49.1	15%	0.152	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.9	167.8	178.6	175.4	-174.9	177.3	0	109	P127 T128 F129 D133 V134 I135 G152 I153 L155	P127-K150 HydrophobicContact CG-CD 3.68Å; T128-K150 PolarHBondContact O-NZ 3.37Å; F129-K150 HydrophobicContact CB-CD 4.47Å; D133-K150 WeakPolarHBondContact OD1-CE 3.4Å; D133-K150 IonicContact OD1-NZ 3.52Å; D133-K150 WeakPolarHBondContact OD2-CE 3.42Å; D133-K150 IonicContact OD2-NZ 2.92Å; D133-K150 PolarHBondContact OD2-NZ 2.94Å; V134-K150 WeakPolarHBondContact O-CA 3.47Å; I135-K150 HydrophobicContact CD1-CB 3.85Å; I135-K150 HydrophobicContact CD1-CD 4.28Å; I135-K150 HydrophobicContact CD1-CG 3.77Å; K150-G152 PolarHBondContact O-N 3.19Å; K150-I153 PolarHBondContact N-O 2.95Å; K150-I153 WeakPolarHBondContact O-CB 3.44Å; K150-I153 PolarHBondContact O-N 3.4Å; K150-L155 HydrophobicContact CB-CD1 4.12Å; K150-L155 HydrophobicContact CB-CD2 4.3Å; K150-L155 HydrophobicContact CB-CG 4.48Å
151	N	98.2	Very high	88.2	Confident	70 Å²	70	48.9 Å²	48.9	37%	0.374	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	44.2	177.1	-57	-29.3	0	0	0	112.4	D133 V134	D133-N151 WeakPolarHBondContact CA-OD1 3.38Å; D133-N151 PolarHBondContact OD1-ND2 3.4Å; V134-N151 PolarHBondContact N-OD1 3.48Å; V134-N151 PolarHBondContact O-N 2.82Å
152	G	97.5	Very high	87.2	Confident	25 Å²	25	52 Å²	52	26%	0.258	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	9.3	179.9	0	0	0	0	0	115.7	K150 Y188	K150-G152 PolarHBondContact O-N 3.19Å; G152-Y188 VanDerWaalsContact O-CD2 3.32Å; G152-Y188 WeakPolarHBondContact O-CD2 3.41Å
153	I	97.6	Very high	86.6	Confident	118 Å²	118	53.4 Å²	53.4	61%	0.605	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	126.6	177.8	-56.8	174.2	0	0	0	109.8	T149 K150	T149-I153 CarbonylContact C-O 3.46Å; T149-I153 WeakPolarHBondContact CA-O 3.39Å; T149-I153 VanDerWaalsContact CB-O 3.29Å; T149-I153 WeakPolarHBondContact CB-O 3.19Å; K150-I153 PolarHBondContact N-O 2.95Å; K150-I153 WeakPolarHBondContact O-CB 3.44Å; K150-I153 PolarHBondContact O-N 3.4Å
154	N	95.7	Very high	86.6	Confident	62 Å²	62	51.3 Å²	51.3	33%	0.332	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.2	176.2	-163.6	-34.5	0	0	0	111.5	G156 Y188	N154-G156 PolarHBondContact OD1-N 3.45Å; N154-Y188 HydrophobicContact CB-CE2 4.1Å; N154-Y188 WeakPolarHBondContact CB-OH 3.34Å; N154-Y188 PolarHBondContact ND2-OH 3.09Å
155	L	95.4	Very high	86.9	Confident	41 Å²	41	48.5 Å²	48.5	22%	0.215	26%	0.26	C	S	.	.			trans	-98.4	0.6	-178.1	-57.6	179.2	0	0	0	113.3	Y108 Y125 P127 Y148 K150	Y108-L155 HydrophobicContact CE1-CD1 3.63Å; Y108-L155 WeakPolarHBondContact OH-CD1 3.39Å; Y125-L155 HydrophobicContact CE1-CB 4.2Å; Y125-L155 HydrophobicContact CE1-CD1 4.33Å; Y125-L155 HydrophobicContact CE2-CB 4.29Å; Y125-L155 WeakPolarHBondContact CE2-O 3.21Å; Y125-L155 WeakPolarHBondContact OH-CB 3.29Å; P127-L155 HydrophobicContact CG-CD2 4.41Å; Y148-L155 WeakPolarHBondContact O-CB 3.36Å; Y148-L155 PolarHBondContact O-N 3.42Å; K150-L155 HydrophobicContact CB-CD1 4.12Å; K150-L155 HydrophobicContact CB-CD2 4.3Å; K150-L155 HydrophobicContact CB-CG 4.48Å
156	G	92.2	Very high	87.1	Confident	32 Å²	32	48.4 Å²	48.4	33%	0.33	26%	0.259	S	S	.	.			trans	85.4	-174.2	-177.7	0	0	0	0	0	113.3	Y125 F147 N154 P158	Y125-G156 PolarHBondContact OH-O 2.92Å; F147-G156 WeakPolarHBondContact CB-O 2.87Å; N154-G156 PolarHBondContact OD1-N 3.45Å; G156-P158 WeakPolarHBondContact O-CD 3.34Å
157	L	87.7	Confident	87.1	Confident	105 Å²	105	50.1 Å²	50.1	55%	0.55	27%	0.268	S	S	.	.			trans	-93.7	110.8	-172.4	-60.1	176	0	0	0	111.6	T145 C146 F147	T145-L157 HydrophobicContact CG2-CD1 4.36Å; C146-L157 WeakPolarHBondContact O-CD2 3.3Å; F147-L157 HydrophobicContact CB-CD2 4.09Å
158	P	79.1	Confident	87	Confident	31 Å²	31	50.2 Å²	50.2	20%	0.201	27%	0.269	C	S	.	.			trans	-83.7	-32	171.4	30	-32.7	0	0	0	112.3	Y125 C146 Y148 G156	Y125-P158 HydrophobicContact CD1-CB 4.36Å; Y125-P158 HydrophobicContact CD2-CB 3.76Å; Y125-P158 HydrophobicContact CD2-CG 4.37Å; Y125-P158 HydrophobicContact CE1-CB 4.32Å; Y125-P158 HydrophobicContact CE1-CG 4.09Å; Y125-P158 HydrophobicContact CE2-CB 3.72Å; Y125-P158 HydrophobicContact CE2-CG 3.86Å; Y125-P158 HydrophobicContact CG-CB 4.09Å; Y125-P158 WeakPolarHBondContact OH-CD 3.43Å; C146-P158 VanDerWaalsContact O-CD 3.3Å; C146-P158 WeakPolarHBondContact O-CD 3.35Å; Y148-P158 HydrophobicContact CD2-CG 3.8Å; Y148-P158 HydrophobicContact CE2-CG 3.78Å; G156-P158 WeakPolarHBondContact O-CD 3.34Å
159	F	76.6	Confident	86.6	Confident	12 Å²	12	49.3 Å²	49.3	5%	0.053	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	162.3	-164.8	-41.6	-61.1	0	0	0	115.9	Y106 G107 F116 A117 C146 Y148	Y106-F159 HydrophobicContact CD1-CB 3.6Å; Y106-F159 HydrophobicContact CD1-CD1 4.21Å; Y106-F159 AromaticContact CD1-CD2 3.94Å; Y106-F159 HydrophobicContact CD1-CD2 3.94Å; Y106-F159 AromaticContact CD1-CG 3.67Å; Y106-F159 HydrophobicContact CD1-CG 3.67Å; Y106-F159 HydrophobicContact CE1-CB 4.02Å; Y106-F159 HydrophobicContact CE1-CG 4.47Å; Y106-F159 HydrophobicContact CG-CB 4.47Å; Y106-F159 HydrophobicContact CG-CD2 4.29Å; Y106-F159 HydrophobicContact CG-CG 4.45Å; G107-F159 WeakPolarHBondContact O-CE2 3.31Å; G107-F159 VanDerWaalsContact O-CZ 3.3Å; G107-F159 WeakPolarHBondContact O-CZ 3.34Å; F116-F159 VanDerWaalsContact C-CZ 3.46Å; F116-F159 VanDerWaalsContact N-CZ 3.28Å; F116-F159 VanDerWaalsContact O-CZ 3.24Å; F116-F159 WeakPolarHBondContact O-CZ 3.38Å; A117-F159 HydrophobicContact CB-CD1 3.35Å; A117-F159 HydrophobicContact CB-CE1 3.42Å; A117-F159 VanDerWaalsContact CB-CE1 3.42Å; A117-F159 HydrophobicContact CB-CG 4.23Å; A117-F159 HydrophobicContact CB-CZ 4.34Å; C146-F159 PolarHBondContact N-O 2.92Å; Y148-F159 HydrophobicContact CE2-CD2 4.41Å; Y148-F159 HydrophobicContact CE2-CE2 4.01Å
160	F	75	Confident	86.1	Confident	151 Å²	151	50.4 Å²	50.4	66%	0.662	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.8	163.2	-59.2	-91.2	0	0	0	109.4	Y106 R144 T145	Y106-F160 WeakPolarHBondContact CE1-O 3.29Å; Y106-F160 PolarHBondContact OH-O 3.39Å; R144-F160 CarbonylContact O-C 3.54Å; R144-F160 VanDerWaalsContact O-CA 3.24Å; R144-F160 WeakPolarHBondContact O-CA 3.46Å; T145-F160 HydrophobicContact CG2-CD1 3.67Å; T145-F160 HydrophobicContact CG2-CE1 3.6Å
161	G	66.7	Low	85.4	Confident	7 Å²	7	50 Å²	50	7%	0.072	27%	0.271	C	S	.	.			trans	-157.7	153.4	-175.5	0	0	0	0	0	113.3	Y106 R144	Y106-G161 WeakPolarHBondContact OH-CA 3.24Å; R144-G161 CarbonylContact C-O 3.01Å; R144-G161 WeakPolarHBondContact CB-O 3.29Å; R144-G161 PolarHBondContact O-N 2.9Å
162	L	65.9	Low	84.6	Confident	80 Å²	80	47.1 Å²	47.1	42%	0.419	26%	0.256	S	S	.	.	S	Bend	trans	-125.8	142.4	-174.5	-87.5	168	0	0	0	112.2	R144 L164	R144-L162 HydrophobicContact CB-CD2 4.13Å; R144-L162 HydrophobicContact CB-CG 4.25Å; R144-L162 HydrophobicContact CG-CD2 3.49Å; R144-L162 VanDerWaalsContact CG-CD2 3.49Å; R144-L162 HydrophobicContact CG-CG 4.05Å; L162-L164 VanDerWaalsContact C-N 3.33Å; L162-L164 WeakPolarHBondContact O-CD2 2.95Å; L162-L164 PolarHBondContact O-N 2.93Å
163	N	68	Low	83.9	Confident	104 Å²	104	48.2 Å²	48.2	56%	0.556	26%	0.258	S	S	*	.	S	Bend	trans	50	51.9	169.2	-61.1	-24.4	0	0	0	112.7
164	L	81.3	Confident	83.4	Confident	26 Å²	26	44.3 Å²	44.3	14%	0.136	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-83.5	142.2	-173	-57.7	177.6	0	0	0	110.4	V73 Y106 V139 L162	V73-L164 WeakPolarHBondContact CG2-O 3.29Å; V73-L164 PolarHBondContact N-O 2.91Å; Y106-L164 HydrophobicContact CD2-CD1 4.21Å; Y106-L164 HydrophobicContact CD2-CD2 3.67Å; Y106-L164 HydrophobicContact CE2-CD2 3.7Å; V139-L164 HydrophobicContact CG1-CD1 4.48Å; L162-L164 VanDerWaalsContact C-N 3.33Å; L162-L164 WeakPolarHBondContact O-CD2 2.95Å; L162-L164 PolarHBondContact O-N 2.93Å
165	F	90.2	Very high	83.1	Confident	76 Å²	76	42.1 Å²	42.1	33%	0.333	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-85.5	141.1	157.5	-75.5	-104.1	0	0	0	107.5	R68 F71 I167	R68-F165 HydrophobicContact CB-CB 4.27Å; R68-F165 HydrophobicContact CB-CD1 4.33Å; R68-F165 HydrophobicContact CG-CB 4.45Å; F71-F165 WeakPolarHBondContact O-CD1 3.28Å; F165-I167 HydrophobicContact CB-CG1 4.3Å; F165-I167 WeakPolarHBondContact O-CG1 3.37Å
166	P	90.9	Very high	82.8	Confident	5 Å²	5	43.5 Å²	43.5	3%	0.032	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-58.7	136.4	158.6	-23	33.8	0	0	0	109.9	P39 W42 R68 A69 V73 F80 F82 F181	P39-P166 HydrophobicContact CB-CG 3.96Å; P39-P166 HydrophobicContact CG-CG 4.06Å; W42-P166 HydrophobicContact CZ3-CB 4.46Å; R68-P166 WeakPolarHBondContact CA-O 3.33Å; A69-P166 HydrophobicContact CB-CB 3.99Å; A69-P166 HydrophobicContact CB-CG 4.03Å; A69-P166 PolarHBondContact N-O 3.25Å; V73-P166 HydrophobicContact CG2-CG 4.29Å; F80-P166 HydrophobicContact CE1-CG 3.75Å; F80-P166 HydrophobicContact CZ-CG 4.18Å; F82-P166 HydrophobicContact CD1-CB 4.14Å; F82-P166 HydrophobicContact CD1-CG 4.31Å; F82-P166 HydrophobicContact CD2-CB 4.42Å; F82-P166 HydrophobicContact CE1-CB 3.74Å; F82-P166 HydrophobicContact CE1-CG 4.2Å; F82-P166 HydrophobicContact CE2-CB 4.09Å; F82-P166 HydrophobicContact CG-CB 4.45Å; F82-P166 HydrophobicContact CZ-CB 3.73Å; P166-F181 HydrophobicContact CB-CE1 3.62Å; P166-F181 HydrophobicContact CB-CZ 4.22Å; P166-F181 HydrophobicContact CG-CE1 3.9Å
167	I	89.2	Confident	82.8	Confident	40 Å²	40	43.3 Å²	43.3	21%	0.205	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.5	-176.6	-55.4	-168.2	0	0	0	108.8	A66 V67 R68 I98 F165	A66-I167 HydrophobicContact CB-CG2 4.02Å; V67-I167 WeakPolarHBondContact O-CA 3.45Å; R68-I167 HydrophobicContact CB-CG1 4.49Å; R68-I167 HydrophobicContact CG-CD1 3.71Å; R68-I167 HydrophobicContact CG-CG1 3.85Å; I98-I167 HydrophobicContact CD1-CB 4.03Å; I98-I167 HydrophobicContact CD1-CD1 4.12Å; I98-I167 HydrophobicContact CD1-CG1 4.32Å; I98-I167 HydrophobicContact CD1-CG2 4.48Å; I98-I167 HydrophobicContact CG1-CB 4.01Å; I98-I167 HydrophobicContact CG1-CG2 4.07Å; F165-I167 HydrophobicContact CB-CG1 4.3Å; F165-I167 WeakPolarHBondContact O-CG1 3.37Å
168	V	89.9	Confident	83.1	Confident	14 Å²	14	44 Å²	44	9%	0.085	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.4	161.7	69.1	0	0	0	0	109.6	W42 M51 A66 V67 L170 V177	W42-V168 HydrophobicContact CD2-CG1 4.5Å; W42-V168 HydrophobicContact CH2-CB 3.87Å; W42-V168 HydrophobicContact CH2-CG1 3.74Å; W42-V168 HydrophobicContact CZ2-CB 3.9Å; W42-V168 HydrophobicContact CZ2-CG1 3.46Å; W42-V168 VanDerWaalsContact CZ2-CG1 3.46Å; W42-V168 HydrophobicContact CZ3-CG1 4.35Å; M51-V168 HydrophobicContact CE-CG1 4.43Å; A66-V168 VanDerWaalsContact CA-O 3.29Å; A66-V168 WeakPolarHBondContact CA-O 3.17Å; V67-V168 HydrophobicContact CG1-CG1 3.54Å; V67-V168 PolarHBondContact N-O 3.32Å; V67-V168 PolarHBondContact O-N 3.21Å; V168-L170 HydrophobicContact CG2-CD2 4.34Å; V168-V177 HydrophobicContact CG1-CG2 4.28Å; V168-V177 HydrophobicContact CG2-CG2 4.03Å
169	G	86.3	Confident	83.8	Confident	2 Å²	2	43.7 Å²	43.7	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.3	174.4	0	0	0	0	0	110.7	A65 N96	A65-G169 CarbonylContact O-C 3.57Å; A65-G169 VanDerWaalsContact O-CA 3.29Å; A65-G169 WeakPolarHBondContact O-CA 3.49Å; N96-G169 CarbonylContact C-O 3.58Å; N96-G169 PolarHBondContact N-O 2.84Å; N96-G169 VanDerWaalsContact N-O 3.09Å; N96-G169 CarbonylContact O-C 3.52Å; N96-G169 WeakPolarHBondContact O-CA 3.26Å; N96-G169 PolarHBondContact O-N 2.92Å
170	L	87	Confident	84.7	Confident	23 Å²	23	43.7 Å²	43.7	12%	0.12	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	155.7	177.6	-52.9	178.2	0	0	0	107.7	M51 A64 A65 L95 V168 E175 V177	M51-L170 HydrophobicContact CE-CD1 3.87Å; M51-L170 HydrophobicContact CE-CG 4.23Å; M51-L170 HydrophobicContact SD-CB 4.34Å; M51-L170 HydrophobicContact SD-CD1 4.04Å; M51-L170 HydrophobicContact SD-CG 4.22Å; A64-L170 CarbonylContact C-O 3.03Å; A64-L170 WeakPolarHBondContact CA-O 2.98Å; A65-L170 PolarHBondContact N-O 3.21Å; A65-L170 PolarHBondContact O-N 3.37Å; L95-L170 HydrophobicContact CD2-CD2 3.43Å; L95-L170 VanDerWaalsContact CD2-CD2 3.43Å; V168-L170 HydrophobicContact CG2-CD2 4.34Å; L170-E175 WeakPolarHBondContact CA-OE2 3.41Å; L170-E175 HydrophobicContact CB-CB 4.31Å; L170-E175 WeakPolarHBondContact CB-OE2 3.16Å; L170-E175 HydrophobicContact CD1-CB 4.35Å; L170-E175 HydrophobicContact CD2-CB 4.12Å; L170-E175 HydrophobicContact CG-CB 4.49Å; L170-V177 HydrophobicContact CD2-CG1 3.99Å; L170-V177 HydrophobicContact CD2-CG2 4.29Å
171	Q	82.8	Confident	85.6	Confident	26 Å²	26	36.6 Å²	36.6	12%	0.121	21%	0.207	C	C	.	.			trans	-137	-33.9	-177.4	-177.4	178.4	-13.8	0	0	113.3	G58 S60 A64 L94 N96 E175	G58-Q171 VanDerWaalsContact CA-O 3.25Å; G58-Q171 WeakPolarHBondContact CA-O 3.46Å; S60-Q171 PolarHBondContact O-NE2 3.42Å; A64-Q171 HydrophobicContact CB-CB 4.4Å; A64-Q171 HydrophobicContact CB-CG 4.38Å; L94-Q171 HydrophobicContact CB-CB 3.9Å; L94-Q171 HydrophobicContact CB-CG 4.45Å; L94-Q171 HydrophobicContact CD1-CG 4.2Å; N96-Q171 PolarHBondContact ND2-OE1 3.27Å; Q171-E175 PolarHBondContact N-OE2 3.29Å
172	T	80.8	Confident	86.9	Confident	10 Å²	10	36.3 Å²	36.3	6%	0.061	20%	0.203	C	C	.	.	S	Bend	trans	-108.2	150.9	-174.5	77.3	0	0	0	0	114	R91 D92 L94 G174 E175	R91-T172 PolarHBondContact N-OG1 3.46Å; D92-T172 HydrophobicContact CB-CG2 3.87Å; D92-T172 PolarHBondContact N-OG1 3.46Å; D92-T172 WeakPolarHBondContact OD2-CG2 3.48Å; L94-T172 HydrophobicContact CB-CG2 4.12Å; L94-T172 HydrophobicContact CD1-CG2 3.72Å; L94-T172 HydrophobicContact CG-CG2 4.07Å; T172-G174 PolarHBondContact O-N 2.9Å; T172-E175 WeakPolarHBondContact CB-OE1 3.1Å; T172-E175 VanDerWaalsContact N-CD 3.31Å; T172-E175 PolarHBondContact N-OE1 2.98Å; T172-E175 PolarHBondContact N-OE2 2.7Å; T172-E175 WeakPolarHBondContact O-CG 3.34Å; T172-E175 PolarHBondContact O-N 3.07Å; T172-E175 VanDerWaalsContact OG1-CD 3.29Å; T172-E175 PolarHBondContact OG1-OE1 3.44Å
173	P	84.4	Confident	88	Confident	48 Å²	48	35.3 Å²	35.3	31%	0.312	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	139.5	176.1	-27.6	35.3	0	0	0	112.8	G56 G90 R91 E175	G56-P173 WeakPolarHBondContact O-CG 3.19Å; G90-P173 WeakPolarHBondContact CA-O 3.46Å; R91-P173 PolarHBondContact N-O 2.81Å; R91-P173 VanDerWaalsContact N-O 3.11Å; P173-E175 VanDerWaalsContact C-N 3.3Å
174	G	86.4	Confident	89.2	Confident	35 Å²	35	33.2 Å²	33.2	36%	0.361	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	1.7	176.1	0	0	0	0	0	114.7	S88 G90 T172 V176	S88-G174 VanDerWaalsContact CB-O 3.27Å; S88-G174 WeakPolarHBondContact CB-O 3.4Å; S88-G174 PolarHBondContact OG-O 3.39Å; G90-G174 WeakPolarHBondContact CA-O 3.44Å; G90-G174 PolarHBondContact N-O 2.86Å; T172-G174 PolarHBondContact O-N 2.9Å; G174-V176 PolarHBondContact O-N 3.35Å
175	E	88.6	Confident	89.8	Confident	17 Å²	17	37.3 Å²	37.3	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	126.9	168.5	-75.7	166	-169.1	0	0	109.9	S88 K89 L94 L95 L170 Q171 T172 P173	S88-E175 CarbonylContact O-C 3.57Å; S88-E175 VanDerWaalsContact O-CA 3.3Å; S88-E175 WeakPolarHBondContact O-CA 3.46Å; K89-E175 WeakPolarHBondContact O-CG 3.29Å; L94-E175 PolarHBondContact N-OE1 2.94Å; L95-E175 HydrophobicContact CD2-CB 4.06Å; L95-E175 HydrophobicContact CD2-CG 3.92Å; L170-E175 WeakPolarHBondContact CA-OE2 3.41Å; L170-E175 HydrophobicContact CB-CB 4.31Å; L170-E175 WeakPolarHBondContact CB-OE2 3.16Å; L170-E175 HydrophobicContact CD1-CB 4.35Å; L170-E175 HydrophobicContact CD2-CB 4.12Å; L170-E175 HydrophobicContact CG-CB 4.49Å; Q171-E175 PolarHBondContact N-OE2 3.29Å; T172-E175 WeakPolarHBondContact CB-OE1 3.1Å; T172-E175 VanDerWaalsContact N-CD 3.31Å; T172-E175 PolarHBondContact N-OE1 2.98Å; T172-E175 PolarHBondContact N-OE2 2.7Å; T172-E175 WeakPolarHBondContact O-CG 3.34Å; T172-E175 PolarHBondContact O-N 3.07Å; T172-E175 VanDerWaalsContact OG1-CD 3.29Å; T172-E175 PolarHBondContact OG1-OE1 3.44Å; P173-E175 VanDerWaalsContact C-N 3.3Å
176	V	90.3	Very high	90.1	Very high	69 Å²	69	35 Å²	35	42%	0.418	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	131.5	179.9	-174.3	0	0	0	0	108	I87 S88 G174	I87-V176 WeakPolarHBondContact CA-O 3.42Å; I87-V176 HydrophobicContact CB-CB 3.97Å; I87-V176 HydrophobicContact CB-CG1 3.79Å; I87-V176 WeakPolarHBondContact CB-O 3.21Å; I87-V176 HydrophobicContact CG1-CG1 4.23Å; I87-V176 HydrophobicContact CG2-CB 4.25Å; I87-V176 HydrophobicContact CG2-CG1 3.98Å; I87-V176 PolarHBondContact N-O 3.43Å; S88-V176 PolarHBondContact N-O 3.46Å; S88-V176 PolarHBondContact O-N 2.87Å; G174-V176 PolarHBondContact O-N 3.35Å
177	V	92.5	Very high	90.4	Very high	28 Å²	28	38.6 Å²	38.6	17%	0.17	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151.2	178.2	-61.5	0	0	0	0	109.8	I84 T85 I86 L95 V168 L170	I84-V177 HydrophobicContact CG2-CB 3.69Å; I84-V177 HydrophobicContact CG2-CG1 4.03Å; I84-V177 HydrophobicContact CG2-CG2 4.28Å; T85-V177 CarbonylContact O-C 3.58Å; T85-V177 VanDerWaalsContact O-CA 3.26Å; T85-V177 WeakPolarHBondContact O-CA 3.32Å; I86-V177 HydrophobicContact CD1-CG1 3.84Å; L95-V177 HydrophobicContact CD2-CG1 3.93Å; V168-V177 HydrophobicContact CG1-CG2 4.28Å; V168-V177 HydrophobicContact CG2-CG2 4.03Å; L170-V177 HydrophobicContact CD2-CG1 3.99Å; L170-V177 HydrophobicContact CD2-CG2 4.29Å
178	E	93.5	Very high	90.8	Very high	121 Å²	121	37.6 Å²	37.6	57%	0.565	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.1	173.5	-176.4	173.3	-100.7	0	0	108.8	I84 T85 I87	I84-E178 CarbonylContact C-O 3.52Å; I84-E178 WeakPolarHBondContact CA-O 3.48Å; T85-E178 PolarHBondContact N-O 3.21Å; T85-E178 PolarHBondContact O-N 2.8Å; I87-E178 HydrophobicContact CD1-CB 4.09Å; I87-E178 HydrophobicContact CG1-CB 4.02Å
179	A	94.4	Very high	91	Very high	24 Å²	24	41.8 Å²	41.8	20%	0.198	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.7	-179.3	0	0	0	0	0	111	W42 E83 I84 F181	W42-A179 HydrophobicContact CZ2-CB 3.61Å; E83-A179 CarbonylContact O-C 3.53Å; E83-A179 WeakPolarHBondContact O-CA 3.39Å; I84-A179 HydrophobicContact CD1-CB 3.59Å; A179-F181 HydrophobicContact CB-CD2 4.15Å; A179-F181 HydrophobicContact CB-CE2 3.66Å; A179-F181 HydrophobicContact CB-CZ 4.22Å
180	N	95.4	Very high	91.4	Very high	12 Å²	12	42 Å²	42	6%	0.064	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	108.2	167.9	179.6	12.3	0	0	0	108.3	F82 E83 G182 Q183 S184 F186	F82-N180 CarbonylContact C-O 3.46Å; F82-N180 WeakPolarHBondContact CA-O 3.41Å; F82-N180 WeakPolarHBondContact CB-O 3.45Å; E83-N180 HydrophobicContact CB-CB 4.34Å; E83-N180 PolarHBondContact N-O 3.22Å; E83-N180 PolarHBondContact O-N 3.06Å; N180-G182 VanDerWaalsContact C-N 3.31Å; N180-G182 WeakPolarHBondContact OD1-CA 3.43Å; N180-G182 PolarHBondContact OD1-N 2.76Å; N180-Q183 PolarHBondContact OD1-N 2.8Å; N180-Q183 PolarHBondContact OD1-OE1 3.41Å; N180-S184 PolarHBondContact ND2-O 3.28Å; N180-S184 PolarHBondContact ND2-OG 2.48Å; N180-S184 VanDerWaalsContact ND2-OG 3.08Å; N180-S184 PolarHBondContact OD1-N 2.8Å; N180-S184 PolarHBondContact OD1-O 3.36Å; N180-F186 HydrophobicContact CB-CE1 4.35Å; N180-F186 VanDerWaalsContact ND2-CD1 3.34Å; N180-F186 WeakPolarHBondContact ND2-CD1 3.38Å; N180-F186 WeakPolarHBondContact O-CE1 3.29Å
181	F	93.8	Very high	91.6	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.009	25%	0.252	C	S	.	.	S	Bend	trans	-94.9	20.9	172.6	-68.2	-72.3	0	0	0	112.5	P39 S40 W42 A69 F80 F82 P166 A179	P39-F181 HydrophobicContact CB-CD1 4.36Å; S40-F181 WeakPolarHBondContact O-CD2 3.35Å; W42-F181 HydrophobicContact CD2-CE2 4.22Å; W42-F181 HydrophobicContact CD2-CZ 4.17Å; W42-F181 HydrophobicContact CE3-CE2 4.44Å; W42-F181 AromaticContact CE3-CZ 3.97Å; W42-F181 HydrophobicContact CE3-CZ 3.97Å; W42-F181 AromaticContact CH2-CZ 3.8Å; W42-F181 HydrophobicContact CH2-CZ 3.8Å; W42-F181 HydrophobicContact CZ2-CE2 4.38Å; W42-F181 HydrophobicContact CZ2-CZ 4.01Å; W42-F181 AromaticContact CZ3-CZ 3.78Å; W42-F181 HydrophobicContact CZ3-CZ 3.78Å; A69-F181 HydrophobicContact CB-CE1 4.29Å; A69-F181 HydrophobicContact CB-CZ 4.15Å; F80-F181 HydrophobicContact CZ-CD1 4.2Å; F82-F181 HydrophobicContact CB-CD1 3.72Å; F82-F181 HydrophobicContact CB-CE1 4.06Å; F82-F181 HydrophobicContact CD2-CD1 4.43Å; F82-F181 AromaticContact CD2-CE1 3.94Å; F82-F181 HydrophobicContact CD2-CE1 3.94Å; F82-F181 HydrophobicContact CG-CD1 4.19Å; F82-F181 HydrophobicContact CG-CE1 4.02Å; P166-F181 HydrophobicContact CB-CE1 3.62Å; P166-F181 HydrophobicContact CB-CZ 4.22Å; P166-F181 HydrophobicContact CG-CE1 3.9Å; A179-F181 HydrophobicContact CB-CD2 4.15Å; A179-F181 HydrophobicContact CB-CE2 3.66Å; A179-F181 HydrophobicContact CB-CZ 4.22Å
182	G	93.3	Very high	92.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	101.2	18.4	-174	0	0	0	0	0	113.7	N180 S184	N180-G182 VanDerWaalsContact C-N 3.31Å; N180-G182 WeakPolarHBondContact OD1-CA 3.43Å; N180-G182 PolarHBondContact OD1-N 2.76Å; G182-S184 VanDerWaalsContact C-N 3.32Å
183	Q	89.5	Confident	92.5	Very high	59 Å²	59	47.4 Å²	47.4	28%	0.276	27%	0.274	S	S	.	.	S	Bend	trans	-71	-31.3	170.9	-69.6	84.5	-0.4	0	0	112.4	E20 S40 N180	E20-Q183 HydrophobicContact CG-CB 3.79Å; E20-Q183 HydrophobicContact CG-CG 3.85Å; E20-Q183 WeakPolarHBondContact OE1-CG 3.26Å; S40-Q183 PolarHBondContact O-NE2 3.23Å; N180-Q183 PolarHBondContact OD1-N 2.8Å; N180-Q183 PolarHBondContact OD1-OE1 3.41Å
184	S	92.2	Very high	92.8	Very high	60 Å²	60	45.2 Å²	45.2	42%	0.42	26%	0.26	S	S	.	.	S	Bend	trans	-132.9	159.7	179.1	56.7	0	0	0	0	110.2	L23 N180 G182 F186	L23-S184 WeakPolarHBondContact CD2-O 3.43Å; N180-S184 PolarHBondContact ND2-O 3.28Å; N180-S184 PolarHBondContact ND2-OG 2.48Å; N180-S184 VanDerWaalsContact ND2-OG 3.08Å; N180-S184 PolarHBondContact OD1-N 2.8Å; N180-S184 PolarHBondContact OD1-O 3.36Å; G182-S184 VanDerWaalsContact C-N 3.32Å; S184-F186 PolarHBondContact O-N 3.03Å
185	P	93.7	Very high	93	Very high	112 Å²	112	47.6 Å²	47.6	73%	0.727	26%	0.264	S	S	*	.			trans	-52.9	136	174.4	-26	35.2	0	0	0	111.4
186	F	96.3	Very high	93.1	Very high	27 Å²	27	50.4 Å²	50.4	12%	0.118	28%	0.282	C	S	.	.			trans	-71.8	150.3	175	-64.9	-54.2	0	0	0	111.3	L27 Y81 E83 N180 S184 Y188 I190	L27-F186 HydrophobicContact CD1-CD2 4.15Å; L27-F186 HydrophobicContact CD1-CE2 3.55Å; Y81-F186 HydrophobicContact CD1-CB 4.38Å; Y81-F186 AromaticContact CD1-CD1 3.93Å; Y81-F186 HydrophobicContact CD1-CD1 3.93Å; Y81-F186 AromaticContact CD1-CD2 3.61Å; Y81-F186 HydrophobicContact CD1-CD2 3.61Å; Y81-F186 HydrophobicContact CD1-CE1 4.06Å; Y81-F186 AromaticContact CD1-CE2 3.72Å; Y81-F186 HydrophobicContact CD1-CE2 3.72Å; Y81-F186 AromaticContact CD1-CG 3.71Å; Y81-F186 HydrophobicContact CD1-CG 3.71Å; Y81-F186 AromaticContact CD1-CZ 3.95Å; Y81-F186 HydrophobicContact CD1-CZ 3.95Å; Y81-F186 HydrophobicContact CE1-CB 4.05Å; Y81-F186 AromaticContact CE1-CD1 4Å; Y81-F186 HydrophobicContact CE1-CD1 4Å; Y81-F186 HydrophobicContact CE1-CD2 4.15Å; Y81-F186 HydrophobicContact CE1-CE1 4.5Å; Y81-F186 AromaticContact CE1-CG 3.81Å; Y81-F186 HydrophobicContact CE1-CG 3.81Å; Y81-F186 WeakPolarHBondContact O-CZ 3.15Å; E83-F186 HydrophobicContact CB-CD1 4.14Å; E83-F186 HydrophobicContact CG-CD1 3.7Å; E83-F186 HydrophobicContact CG-CE1 4.36Å; E83-F186 HydrophobicContact CG-CG 4.45Å; E83-F186 WeakPolarHBondContact OE2-CA 3.41Å; N180-F186 HydrophobicContact CB-CE1 4.35Å; N180-F186 VanDerWaalsContact ND2-CD1 3.34Å; N180-F186 WeakPolarHBondContact ND2-CD1 3.38Å; N180-F186 WeakPolarHBondContact O-CE1 3.29Å; S184-F186 PolarHBondContact O-N 3.03Å; F186-Y188 VanDerWaalsContact C-N 3.27Å; F186-Y188 VanDerWaalsContact CB-O 3.29Å; F186-Y188 WeakPolarHBondContact CB-O 3.35Å; F186-I190 HydrophobicContact CD2-CG2 3.89Å; F186-I190 HydrophobicContact CE2-CG2 4.38Å
187	V	97.8	Very high	93	Very high	82 Å²	82	49.1 Å²	49.1	50%	0.497	28%	0.275	S	S	.	.	S	Bend	trans	-65.5	-37.9	167.1	-176.5	0	0	0	0	109.8	E83 V134	E83-V187 VanDerWaalsContact CD-N 3.29Å; E83-V187 WeakPolarHBondContact OE1-CA 3.45Å; E83-V187 WeakPolarHBondContact OE1-CB 3.25Å; E83-V187 PolarHBondContact OE1-N 2.92Å; E83-V187 PolarHBondContact OE2-N 3.03Å; V134-V187 HydrophobicContact CB-CG2 4.14Å; V134-V187 HydrophobicContact CG1-CB 4.41Å; V134-V187 HydrophobicContact CG1-CG2 3.92Å; V134-V187 HydrophobicContact CG2-CG2 4.06Å
188	Y	97.5	Very high	92.8	Very high	19 Å²	19	48.3 Å²	48.3	8%	0.075	27%	0.269	C	S	.	.	S	Bend	trans	-79.8	134	173.2	-170.3	-120.6	0	0	0	112.9	Y81 E83 F147 T149 G152 N154 F186 I190 D193	Y81-Y188 HydrophobicContact CD2-CD1 4.47Å; Y81-Y188 HydrophobicContact CE1-CD1 4.19Å; Y81-Y188 HydrophobicContact CE1-CG 4.46Å; Y81-Y188 AromaticContact CE2-CD1 3.83Å; Y81-Y188 HydrophobicContact CE2-CD1 3.83Å; Y81-Y188 HydrophobicContact CE2-CG 4.48Å; Y81-Y188 AromaticContact CZ-CD1 3.65Å; Y81-Y188 AromaticContact CZ-CG 3.93Å; Y81-Y188 WeakPolarHBondContact OH-CB 3.33Å; E83-Y188 PolarHBondContact OE1-N 3.25Å; F147-Y188 HydrophobicContact CE2-CD1 4.46Å; F147-Y188 AromaticContact CE2-CE1 3.81Å; F147-Y188 HydrophobicContact CE2-CE1 3.81Å; F147-Y188 HydrophobicContact CZ-CE1 4.16Å; T149-Y188 HydrophobicContact CG2-CD1 3.92Å; T149-Y188 HydrophobicContact CG2-CD2 3.81Å; T149-Y188 HydrophobicContact CG2-CE1 4.08Å; T149-Y188 HydrophobicContact CG2-CE2 3.97Å; T149-Y188 HydrophobicContact CG2-CG 3.76Å; G152-Y188 VanDerWaalsContact O-CD2 3.32Å; G152-Y188 WeakPolarHBondContact O-CD2 3.41Å; N154-Y188 HydrophobicContact CB-CE2 4.1Å; N154-Y188 WeakPolarHBondContact CB-OH 3.34Å; N154-Y188 PolarHBondContact ND2-OH 3.09Å; F186-Y188 VanDerWaalsContact C-N 3.27Å; F186-Y188 VanDerWaalsContact CB-O 3.29Å; F186-Y188 WeakPolarHBondContact CB-O 3.35Å; Y188-I190 VanDerWaalsContact C-N 3.26Å; Y188-I190 HydrophobicContact CD1-CB 4.1Å; Y188-I190 HydrophobicContact CD1-CD1 4.18Å; Y188-I190 HydrophobicContact CE1-CD1 4.04Å; Y188-I190 PolarHBondContact O-N 3.01Å; Y188-D193 HydrophobicContact CE1-CB 4.25Å; Y188-D193 WeakPolarHBondContact CE1-OD2 3.38Å; Y188-D193 VanDerWaalsContact CZ-OD2 3.27Å; Y188-D193 PolarHBondContact OH-OD1 2.81Å; Y188-D193 PolarHBondContact OH-OD2 2.85Å
189	N	95.4	Very high	92.6	Very high	101 Å²	101	49.5 Å²	49.5	54%	0.54	27%	0.268	S	S	.	.			trans	-80.9	73.9	173.9	-169.2	-3.4	0	0	0	111.3	M191 D192 D193	N189-M191 PolarHBondContact O-N 2.93Å; N189-D192 HydrophobicContact CB-CB 4.21Å; N189-D192 WeakPolarHBondContact ND2-CB 3.22Å; N189-D192 PolarHBondContact O-N 2.86Å; N189-D192 PolarHBondContact OD1-N 2.82Å; N189-D193 PolarHBondContact O-N 2.7Å
190	I	94.1	Very high	92.4	Very high	6 Å²	6	51 Å²	51	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-59.8	-28.7	-179.9	-172.3	62.1	0	0	0	113.2	L27 L79 Y81 F147 F186 Y188 D193 I194	L27-I190 HydrophobicContact CD1-CG2 4.3Å; L27-I190 HydrophobicContact CD2-CG2 3.48Å; L27-I190 VanDerWaalsContact CD2-CG2 3.48Å; L79-I190 HydrophobicContact CD2-CD1 3.59Å; L79-I190 HydrophobicContact CD2-CG1 4.41Å; L79-I190 HydrophobicContact CG-CD1 3.97Å; Y81-I190 HydrophobicContact CD1-CB 4.27Å; Y81-I190 HydrophobicContact CD1-CG1 4.49Å; Y81-I190 HydrophobicContact CD2-CD1 3.88Å; Y81-I190 HydrophobicContact CD2-CG1 4.43Å; Y81-I190 HydrophobicContact CG-CB 4.26Å; Y81-I190 HydrophobicContact CG-CD1 3.96Å; Y81-I190 HydrophobicContact CG-CG1 4.01Å; F147-I190 HydrophobicContact CZ-CD1 3.97Å; F186-I190 HydrophobicContact CD2-CG2 3.89Å; F186-I190 HydrophobicContact CE2-CG2 4.38Å; Y188-I190 VanDerWaalsContact C-N 3.26Å; Y188-I190 HydrophobicContact CD1-CB 4.1Å; Y188-I190 HydrophobicContact CD1-CD1 4.18Å; Y188-I190 HydrophobicContact CE1-CD1 4.04Å; Y188-I190 PolarHBondContact O-N 3.01Å; I190-D193 HydrophobicContact CD1-CB 4.45Å; I190-D193 WeakPolarHBondContact O-CB 3.48Å; I190-D193 PolarHBondContact O-N 2.88Å; I190-I194 HydrophobicContact CG1-CD1 4.42Å; I190-I194 WeakPolarHBondContact O-CG1 3.32Å; I190-I194 PolarHBondContact O-N 3.17Å; I190-I194 VanDerWaalsContact O-N 3.07Å
191	M	91.8	Very high	92.1	Very high	52 Å²	52	50.6 Å²	50.6	26%	0.256	28%	0.276	S	S	.	.	H	α-helix	trans	-68.8	-39.3	179.3	-170.8	63.9	81.5	0	0	111.7	L27 N189 D193 I194 L195 F218	L27-M191 HydrophobicContact CD2-CE 4Å; N189-M191 PolarHBondContact O-N 2.93Å; M191-D193 VanDerWaalsContact C-N 3.29Å; M191-D193 PolarHBondContact O-N 3.46Å; M191-I194 PolarHBondContact O-N 3.07Å; M191-I194 HydrophobicContact SD-CD1 4.4Å; M191-L195 HydrophobicContact CG-CD1 4.45Å; M191-L195 WeakPolarHBondContact O-CG 3.29Å; M191-L195 PolarHBondContact O-N 3.24Å; M191-F218 HydrophobicContact SD-CE1 4.26Å; M191-F218 HydrophobicContact SD-CZ 3.77Å
192	D	91.8	Very high	91.8	Very high	86 Å²	86	52.3 Å²	52.3	46%	0.46	29%	0.285	S	S	.	.	H	α-helix	trans	-60.8	-42	174.2	-169.8	60.5	0	0	0	110.9	N189 I194 L195 V196	N189-D192 HydrophobicContact CB-CB 4.21Å; N189-D192 WeakPolarHBondContact ND2-CB 3.22Å; N189-D192 PolarHBondContact O-N 2.86Å; N189-D192 PolarHBondContact OD1-N 2.82Å; D192-I194 PolarHBondContact O-N 3.44Å; D192-L195 PolarHBondContact O-N 2.98Å; D192-V196 WeakPolarHBondContact O-CB 3.47Å; D192-V196 VanDerWaalsContact O-CG2 3.27Å; D192-V196 WeakPolarHBondContact O-CG2 3.38Å; D192-V196 PolarHBondContact O-N 2.72Å
193	D	89.9	Confident	91.4	Very high	35 Å²	35	56.5 Å²	56.5	19%	0.187	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-41.8	175.5	-108.9	27.9	0	0	0	113.5	Y188 N189 I190 M191 T197	Y188-D193 HydrophobicContact CE1-CB 4.25Å; Y188-D193 WeakPolarHBondContact CE1-OD2 3.38Å; Y188-D193 VanDerWaalsContact CZ-OD2 3.27Å; Y188-D193 PolarHBondContact OH-OD1 2.81Å; Y188-D193 PolarHBondContact OH-OD2 2.85Å; N189-D193 PolarHBondContact O-N 2.7Å; I190-D193 HydrophobicContact CD1-CB 4.45Å; I190-D193 WeakPolarHBondContact O-CB 3.48Å; I190-D193 PolarHBondContact O-N 2.88Å; M191-D193 VanDerWaalsContact C-N 3.29Å; M191-D193 PolarHBondContact O-N 3.46Å; D193-T197 VanDerWaalsContact O-CB 3.28Å; D193-T197 WeakPolarHBondContact O-CB 3.44Å; D193-T197 PolarHBondContact O-N 3.3Å; D193-T197 PolarHBondContact O-OG1 3.23Å
194	I	90	Very high	91.4	Very high	3 Å²	3	58.6 Å²	58.6	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-60.6	-48.2	175.1	-68.2	164.1	0	0	0	109.6	L79 I190 M191 D192 T197 I198 H217 F218	L79-I194 HydrophobicContact CB-CG1 4.37Å; L79-I194 HydrophobicContact CD2-CG1 3.84Å; I190-I194 HydrophobicContact CG1-CD1 4.42Å; I190-I194 WeakPolarHBondContact O-CG1 3.32Å; I190-I194 PolarHBondContact O-N 3.17Å; I190-I194 VanDerWaalsContact O-N 3.07Å; M191-I194 PolarHBondContact O-N 3.07Å; M191-I194 HydrophobicContact SD-CD1 4.4Å; D192-I194 PolarHBondContact O-N 3.44Å; I194-T197 PolarHBondContact O-N 3.39Å; I194-I198 HydrophobicContact CG2-CD1 3.89Å; I194-I198 WeakPolarHBondContact O-CG1 3.38Å; I194-I198 PolarHBondContact O-N 2.7Å; I194-H217 HydrophobicContact CG2-CB 3.9Å; I194-F218 HydrophobicContact CG2-CE2 4Å
195	L	91.4	Very high	91.2	Very high	85 Å²	85	57 Å²	57	45%	0.445	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-43.8	-179.8	-69.6	171.7	0	0	0	112.2	M191 D192 T197 I198 R199 F218	M191-L195 HydrophobicContact CG-CD1 4.45Å; M191-L195 WeakPolarHBondContact O-CG 3.29Å; M191-L195 PolarHBondContact O-N 3.24Å; D192-L195 PolarHBondContact O-N 2.98Å; L195-T197 VanDerWaalsContact C-N 3.32Å; L195-T197 PolarHBondContact O-N 3.33Å; L195-I198 PolarHBondContact O-N 3.5Å; L195-R199 WeakPolarHBondContact O-CB 3.32Å; L195-R199 PolarHBondContact O-N 2.97Å; L195-F218 HydrophobicContact CD2-CE1 4.38Å; L195-F218 HydrophobicContact CD2-CE2 3.68Å; L195-F218 HydrophobicContact CD2-CZ 3.48Å; L195-F218 VanDerWaalsContact CD2-CZ 3.48Å; L195-F218 HydrophobicContact CG-CZ 4.13Å
196	V	89.8	Confident	91.1	Very high	75 Å²	75	55.6 Å²	55.6	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-41	175.4	169.3	0	0	0	0	110.6	D192 R199 S200	D192-V196 WeakPolarHBondContact O-CB 3.47Å; D192-V196 VanDerWaalsContact O-CG2 3.27Å; D192-V196 WeakPolarHBondContact O-CG2 3.38Å; D192-V196 PolarHBondContact O-N 2.72Å; V196-R199 PolarHBondContact O-N 2.89Å; V196-S200 PolarHBondContact O-N 3.21Å
197	T	88.4	Confident	90.9	Very high	42 Å²	42	54.5 Å²	54.5	26%	0.258	29%	0.291	S	S	.	.	H	α-helix	trans	-64.3	-48.3	177	-57.9	0	0	0	0	111.3	D193 I194 L195 R199 S200 C201 L213	D193-T197 VanDerWaalsContact O-CB 3.28Å; D193-T197 WeakPolarHBondContact O-CB 3.44Å; D193-T197 PolarHBondContact O-N 3.3Å; D193-T197 PolarHBondContact O-OG1 3.23Å; I194-T197 PolarHBondContact O-N 3.39Å; L195-T197 VanDerWaalsContact C-N 3.32Å; L195-T197 PolarHBondContact O-N 3.33Å; T197-R199 VanDerWaalsContact C-N 3.28Å; T197-R199 PolarHBondContact O-N 3.15Å; T197-S200 PolarHBondContact O-N 2.81Å; T197-C201 PolarHBondContact O-N 2.87Å; T197-C201 PolarHBondContact O-SG 2.98Å; T197-C201 VanDerWaalsContact O-SG 3.38Å; T197-L213 HydrophobicContact CG2-CD1 3.64Å
198	I	88.8	Confident	90.6	Very high	11 Å²	11	52.7 Å²	52.7	6%	0.056	28%	0.282	C	S	.	.	H	α-helix	trans	-56.1	-47.1	175.3	-70.4	164.6	0	0	0	110.1	I194 L195 S200 C201 I202 L213 L214 F218	I194-I198 HydrophobicContact CG2-CD1 3.89Å; I194-I198 WeakPolarHBondContact O-CG1 3.38Å; I194-I198 PolarHBondContact O-N 2.7Å; L195-I198 PolarHBondContact O-N 3.5Å; I198-S200 PolarHBondContact O-N 2.92Å; I198-C201 PolarHBondContact O-N 3.21Å; I198-I202 HydrophobicContact CG2-CD1 3.9Å; I198-I202 WeakPolarHBondContact O-CG1 3.47Å; I198-I202 PolarHBondContact O-N 3.05Å; I198-L213 HydrophobicContact CD1-CB 4.14Å; I198-L213 HydrophobicContact CG1-CB 3.57Å; I198-L213 HydrophobicContact CG1-CD1 4.09Å; I198-L213 HydrophobicContact CG1-CG 4.46Å; I198-L214 HydrophobicContact CD1-CD2 4.11Å; I198-L214 HydrophobicContact CD1-CG 4.29Å; I198-L214 HydrophobicContact CG2-CD1 4.29Å; I198-L214 HydrophobicContact CG2-CD2 4.01Å; I198-L214 HydrophobicContact CG2-CG 3.91Å; I198-F218 HydrophobicContact CD1-CD2 3.85Å; I198-F218 HydrophobicContact CD1-CE2 3.68Å
199	R	89.4	Confident	90.3	Very high	146 Å²	146	53.9 Å²	53.9	55%	0.551	29%	0.288	S	S	*	.	H	α-helix	trans	-60.8	-43.2	178.5	-177.4	-178.9	175.1	164.8	4.9	112.1	L195 V196 T197 I202 M203 F264	L195-R199 WeakPolarHBondContact O-CB 3.32Å; L195-R199 PolarHBondContact O-N 2.97Å; V196-R199 PolarHBondContact O-N 2.89Å; T197-R199 VanDerWaalsContact C-N 3.28Å; T197-R199 PolarHBondContact O-N 3.15Å; R199-I202 PolarHBondContact O-N 3.2Å; R199-M203 WeakPolarHBondContact O-CB 3.36Å; R199-M203 VanDerWaalsContact O-CG 3.24Å; R199-M203 WeakPolarHBondContact O-CG 3.47Å; R199-M203 PolarHBondContact O-N 3.21Å; R199-F264 HydrophobicContact CG-CE1 4.41Å; R199-F264 HydrophobicContact CG-CZ 4.05Å
200	S	89.5	Confident	90	Very high	56 Å²	56	49.1 Å²	49.1	39%	0.392	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-47.8	176.7	-158.5	0	0	0	0	110.9	V196 T197 I198 I202 M203 D204	V196-S200 PolarHBondContact O-N 3.21Å; T197-S200 PolarHBondContact O-N 2.81Å; I198-S200 PolarHBondContact O-N 2.92Å; S200-I202 VanDerWaalsContact C-N 3.28Å; S200-I202 PolarHBondContact O-N 2.64Å; S200-M203 PolarHBondContact O-N 2.89Å; S200-D204 WeakPolarHBondContact O-CB 3.34Å; S200-D204 VanDerWaalsContact O-CG 3.25Å; S200-D204 PolarHBondContact O-N 3.09Å; S200-D204 VanDerWaalsContact O-OD2 3.12Å; S200-D204 PolarHBondContact OG-OD2 3.36Å
201	C	89.1	Confident	89.9	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.027	27%	0.265	C	S	.	.	H	α-helix	trans	-56.3	-42.9	177.8	-70.3	0	0	0	0	111.8	T197 I198 G205 Q206 A210	T197-C201 PolarHBondContact O-N 2.87Å; T197-C201 PolarHBondContact O-SG 2.98Å; T197-C201 VanDerWaalsContact O-SG 3.38Å; I198-C201 PolarHBondContact O-N 3.21Å; C201-G205 PolarHBondContact O-N 2.86Å; C201-Q206 HydrophobicContact CB-CB 4.15Å; C201-Q206 CarbonylContact O-C 3.51Å; C201-Q206 WeakPolarHBondContact O-CA 3.48Å; C201-Q206 PolarHBondContact O-N 3.27Å; C201-A210 HydrophobicContact CB-CB 3.76Å
202	I	87.1	Confident	89.9	Confident	37 Å²	37	48.1 Å²	48.1	19%	0.19	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-46.3	175.5	-66	168.5	0	0	0	111.3	I198 R199 S200 D204 G205 A210 M260	I198-I202 HydrophobicContact CG2-CD1 3.9Å; I198-I202 WeakPolarHBondContact O-CG1 3.47Å; I198-I202 PolarHBondContact O-N 3.05Å; R199-I202 PolarHBondContact O-N 3.2Å; S200-I202 VanDerWaalsContact C-N 3.28Å; S200-I202 PolarHBondContact O-N 2.64Å; I202-D204 VanDerWaalsContact C-N 3.35Å; I202-D204 PolarHBondContact O-N 2.94Å; I202-G205 PolarHBondContact O-N 3.24Å; I202-A210 HydrophobicContact CD1-CB 4.43Å; I202-A210 HydrophobicContact CG1-CB 3.59Å; I202-M260 WeakPolarHBondContact O-CE 3.44Å
203	M	86.8	Confident	89.8	Confident	89 Å²	89	44.2 Å²	44.2	44%	0.438	24%	0.239	S	C	.	.	H	α-helix	trans	-66.8	-34.8	-178	-75.2	-64.1	-62.3	0	0	113.3	R199 S200 G205 F264	R199-M203 WeakPolarHBondContact O-CB 3.36Å; R199-M203 VanDerWaalsContact O-CG 3.24Å; R199-M203 WeakPolarHBondContact O-CG 3.47Å; R199-M203 PolarHBondContact O-N 3.21Å; S200-M203 PolarHBondContact O-N 2.89Å; M203-G205 VanDerWaalsContact C-N 3.25Å; M203-G205 PolarHBondContact O-N 3.16Å; M203-F264 HydrophobicContact CG-CE2 4.38Å; M203-F264 HydrophobicContact CG-CZ 4.3Å; M203-F264 HydrophobicContact SD-CE2 3.43Å; M203-F264 WeakPolarHBondContact SD-CE2 3.36Å; M203-F264 HydrophobicContact SD-CZ 3.88Å
204	D	89.3	Confident	89.9	Confident	102 Å²	102	43.1 Å²	43.1	55%	0.545	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-0.1	-179.2	-62.4	-34.7	0	0	0	112.2	S200 I202 Q206	S200-D204 WeakPolarHBondContact O-CB 3.34Å; S200-D204 VanDerWaalsContact O-CG 3.25Å; S200-D204 PolarHBondContact O-N 3.09Å; S200-D204 VanDerWaalsContact O-OD2 3.12Å; S200-D204 PolarHBondContact OG-OD2 3.36Å; I202-D204 VanDerWaalsContact C-N 3.35Å; I202-D204 PolarHBondContact O-N 2.94Å; D204-Q206 VanDerWaalsContact C-N 3.28Å; D204-Q206 HydrophobicContact CB-CG 4.34Å; D204-Q206 PolarHBondContact O-N 2.96Å
205	G	87.6	Confident	89.9	Confident	28 Å²	28	47.6 Å²	47.6	29%	0.289	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	11.9	-179.2	0	0	0	0	0	114.5	C201 I202 M203 I207	C201-G205 PolarHBondContact O-N 2.86Å; I202-G205 PolarHBondContact O-N 3.24Å; M203-G205 VanDerWaalsContact C-N 3.25Å; M203-G205 PolarHBondContact O-N 3.16Å; G205-I207 PolarHBondContact O-N 3.04Å
206	Q	90.7	Very high	89.9	Confident	82 Å²	82	44.5 Å²	44.5	38%	0.383	24%	0.237	S	C	.	.			trans	-83	61	175	-61.1	173.5	-2.2	0	0	110.3	C201 D204 S208 Q209 A210 E239	C201-Q206 HydrophobicContact CB-CB 4.15Å; C201-Q206 CarbonylContact O-C 3.51Å; C201-Q206 WeakPolarHBondContact O-CA 3.48Å; C201-Q206 PolarHBondContact O-N 3.27Å; D204-Q206 VanDerWaalsContact C-N 3.28Å; D204-Q206 HydrophobicContact CB-CG 4.34Å; D204-Q206 PolarHBondContact O-N 2.96Å; Q206-S208 PolarHBondContact O-N 2.87Å; Q206-Q209 HydrophobicContact CB-CB 4.3Å; Q206-Q209 PolarHBondContact O-N 3.09Å; Q206-A210 PolarHBondContact O-N 3.22Å; Q206-E239 VanDerWaalsContact C-OE1 3.26Å; Q206-E239 WeakPolarHBondContact CA-OE1 3.32Å
207	I	92.2	Very high	89.9	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-68	-37	-169.1	-55.2	-68.2	0	0	0	111.5	G205 Q209 A210 I211 L232 W235 Q236 E239 M260	G205-I207 PolarHBondContact O-N 3.04Å; I207-Q209 VanDerWaalsContact C-N 3.28Å; I207-Q209 PolarHBondContact O-N 2.97Å; I207-A210 WeakPolarHBondContact O-CB 3.35Å; I207-A210 PolarHBondContact O-N 3.04Å; I207-I211 HydrophobicContact CG2-CD1 3.86Å; I207-I211 HydrophobicContact CG2-CG1 4.25Å; I207-I211 VanDerWaalsContact O-CG1 3.31Å; I207-I211 WeakPolarHBondContact O-CG1 3.25Å; I207-I211 PolarHBondContact O-N 3.25Å; I207-L232 HydrophobicContact CG2-CD2 4.43Å; I207-W235 HydrophobicContact CB-CB 4.42Å; I207-W235 HydrophobicContact CD1-CB 3.87Å; I207-W235 HydrophobicContact CD1-CG 4.48Å; I207-W235 HydrophobicContact CG1-CB 3.8Å; I207-W235 HydrophobicContact CG2-CB 3.92Å; I207-Q236 HydrophobicContact CG2-CB 3.96Å; I207-E239 HydrophobicContact CB-CB 4.47Å; I207-E239 PolarHBondContact N-OE1 2.88Å; I207-M260 HydrophobicContact CD1-CE 4.49Å
208	S	92	Very high	89.9	Confident	44 Å²	44	41.6 Å²	41.6	31%	0.308	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-40.5	177	-68.7	0	0	0	0	111.3	Q206 S212 Q236 E239	Q206-S208 PolarHBondContact O-N 2.87Å; S208-S212 PolarHBondContact O-N 2.9Å; S208-Q236 WeakPolarHBondContact OG-CG 3.15Å; S208-Q236 PolarHBondContact OG-NE2 3.47Å; S208-E239 VanDerWaalsContact CB-OE2 3.27Å; S208-E239 WeakPolarHBondContact CB-OE2 3.4Å; S208-E239 VanDerWaalsContact N-CD 3.34Å; S208-E239 PolarHBondContact N-OE1 3.23Å; S208-E239 VanDerWaalsContact N-OE1 3.12Å; S208-E239 PolarHBondContact N-OE2 3.46Å; S208-E239 PolarHBondContact OG-OE2 3.34Å
209	Q	90.7	Very high	89.7	Confident	45 Å²	45	42 Å²	42	21%	0.21	22%	0.218	C	C	.	.	H	α-helix	trans	-68.7	-41.6	175.2	-172.4	176	-6.7	0	0	111.7	E142 Q206 I207 I211 S212 L213	E142-Q209 HydrophobicContact CG-CG 4.26Å; Q206-Q209 HydrophobicContact CB-CB 4.3Å; Q206-Q209 PolarHBondContact O-N 3.09Å; I207-Q209 VanDerWaalsContact C-N 3.28Å; I207-Q209 PolarHBondContact O-N 2.97Å; Q209-I211 PolarHBondContact O-N 2.91Å; Q209-S212 PolarHBondContact O-N 3.03Å; Q209-L213 HydrophobicContact CG-CD1 4.38Å; Q209-L213 WeakPolarHBondContact O-CG 3.32Å; Q209-L213 PolarHBondContact O-N 3.39Å
210	A	90.6	Very high	89.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-44.2	175.9	0	0	0	0	0	112.2	C201 I202 Q206 I207 L213 L214	C201-A210 HydrophobicContact CB-CB 3.76Å; I202-A210 HydrophobicContact CD1-CB 4.43Å; I202-A210 HydrophobicContact CG1-CB 3.59Å; Q206-A210 PolarHBondContact O-N 3.22Å; I207-A210 WeakPolarHBondContact O-CB 3.35Å; I207-A210 PolarHBondContact O-N 3.04Å; A210-L213 PolarHBondContact O-N 2.95Å; A210-L214 WeakPolarHBondContact O-CB 3.48Å; A210-L214 WeakPolarHBondContact O-CG 3.46Å; A210-L214 PolarHBondContact O-N 2.89Å
211	I	91	Very high	88.8	Confident	18 Å²	18	40.6 Å²	40.6	9%	0.092	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-49	175.9	-69.1	167.5	0	0	0	110.1	I207 Q209 L213 L214 E215 L232 Q236	I207-I211 HydrophobicContact CG2-CD1 3.86Å; I207-I211 HydrophobicContact CG2-CG1 4.25Å; I207-I211 VanDerWaalsContact O-CG1 3.31Å; I207-I211 WeakPolarHBondContact O-CG1 3.25Å; I207-I211 PolarHBondContact O-N 3.25Å; Q209-I211 PolarHBondContact O-N 2.91Å; I211-L213 VanDerWaalsContact C-N 3.29Å; I211-L213 PolarHBondContact O-N 2.88Å; I211-L214 PolarHBondContact O-N 2.79Å; I211-L214 VanDerWaalsContact O-N 3.15Å; I211-E215 HydrophobicContact CG2-CG 4.18Å; I211-E215 WeakPolarHBondContact O-CG 3.44Å; I211-E215 PolarHBondContact O-N 3.26Å; I211-L232 HydrophobicContact CD1-CB 4.05Å; I211-L232 HydrophobicContact CG1-CB 4.06Å; I211-L232 HydrophobicContact CG1-CD1 4.35Å; I211-L232 HydrophobicContact CG1-CD2 4.37Å; I211-L232 HydrophobicContact CG1-CG 4.5Å; I211-Q236 HydrophobicContact CD1-CB 3.97Å; I211-Q236 HydrophobicContact CD1-CG 4.3Å
212	S	91.8	Very high	88.1	Confident	20 Å²	20	40.9 Å²	40.9	14%	0.14	22%	0.217	C	C	.	.	H	α-helix	trans	-55.1	-43.2	177.6	176.1	0	0	0	0	112.3	E142 S208 Q209 K216	E142-S212 PolarHBondContact OE2-OG 2.74Å; S208-S212 PolarHBondContact O-N 2.9Å; Q209-S212 PolarHBondContact O-N 3.03Å; S212-K216 WeakPolarHBondContact O-CD 3.3Å; S212-K216 VanDerWaalsContact O-CG 3.23Å; S212-K216 WeakPolarHBondContact O-CG 3.23Å; S212-K216 PolarHBondContact O-N 3.48Å; S212-K216 WeakPolarHBondContact OG-CE 3.48Å; S212-K216 PolarHBondContact OG-NZ 2.83Å; S212-K216 VanDerWaalsContact OG-NZ 3.08Å
213	L	90.6	Very high	87.7	Confident	4 Å²	4	44 Å²	44	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-68.9	-42.2	177.6	-71.7	169.4	0	0	0	112.5	T197 I198 Q209 A210 I211 K216 H217	T197-L213 HydrophobicContact CG2-CD1 3.64Å; I198-L213 HydrophobicContact CD1-CB 4.14Å; I198-L213 HydrophobicContact CG1-CB 3.57Å; I198-L213 HydrophobicContact CG1-CD1 4.09Å; I198-L213 HydrophobicContact CG1-CG 4.46Å; Q209-L213 HydrophobicContact CG-CD1 4.38Å; Q209-L213 WeakPolarHBondContact O-CG 3.32Å; Q209-L213 PolarHBondContact O-N 3.39Å; A210-L213 PolarHBondContact O-N 2.95Å; I211-L213 VanDerWaalsContact C-N 3.29Å; I211-L213 PolarHBondContact O-N 2.88Å; L213-K216 PolarHBondContact O-N 2.95Å; L213-H217 PolarHBondContact O-CD2 3.42Å; L213-H217 PolarHBondContact O-N 3.1Å
214	L	90.8	Very high	87.5	Confident	11 Å²	11	45.5 Å²	45.5	6%	0.058	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-42.9	176.7	-77.9	165.7	0	0	0	111.8	I198 A210 I211 K216 F218 I222 M228 L232	I198-L214 HydrophobicContact CD1-CD2 4.11Å; I198-L214 HydrophobicContact CD1-CG 4.29Å; I198-L214 HydrophobicContact CG2-CD1 4.29Å; I198-L214 HydrophobicContact CG2-CD2 4.01Å; I198-L214 HydrophobicContact CG2-CG 3.91Å; A210-L214 WeakPolarHBondContact O-CB 3.48Å; A210-L214 WeakPolarHBondContact O-CG 3.46Å; A210-L214 PolarHBondContact O-N 2.89Å; I211-L214 PolarHBondContact O-N 2.79Å; I211-L214 VanDerWaalsContact O-N 3.15Å; L214-K216 VanDerWaalsContact C-N 3.27Å; L214-K216 PolarHBondContact O-N 3.44Å; L214-F218 HydrophobicContact CD2-CB 4.48Å; L214-F218 HydrophobicContact CD2-CD2 4.24Å; L214-F218 CarbonylContact O-C 3.49Å; L214-F218 WeakPolarHBondContact O-CA 3.47Å; L214-F218 PolarHBondContact O-N 3.09Å; L214-I222 HydrophobicContact CB-CD1 3.45Å; L214-I222 VanDerWaalsContact CB-CD1 3.45Å; L214-I222 HydrophobicContact CB-CG1 4.12Å; L214-I222 HydrophobicContact CD1-CD1 4.48Å; L214-M228 HydrophobicContact CD1-CE 4.26Å; L214-L232 HydrophobicContact CD1-CD1 3.82Å
215	E	90.9	Very high	87.3	Confident	97 Å²	97	44 Å²	44	45%	0.453	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-36.2	176.9	-71.1	179.3	157.7	0	0	111.6	I211 P219 I222	I211-E215 HydrophobicContact CG2-CG 4.18Å; I211-E215 WeakPolarHBondContact O-CG 3.44Å; I211-E215 PolarHBondContact O-N 3.26Å; E215-P219 WeakPolarHBondContact O-CB 3.36Å; E215-I222 HydrophobicContact CB-CD1 4.42Å; E215-I222 HydrophobicContact CG-CD1 3.51Å
216	K	90.9	Very high	87.2	Confident	20 Å²	20	48.9 Å²	48.9	9%	0.087	25%	0.253	C	S	.	.	H	α-helix	trans	-76.6	-42.4	-178.9	-71.1	171.9	-167.8	169	0	113.7	P29 F30 E142 S212 L213 L214	P29-K216 WeakPolarHBondContact CG-O 3.31Å; F30-K216 HydrophobicContact CB-CB 4.39Å; F30-K216 WeakPolarHBondContact CB-O 3.28Å; F30-K216 HydrophobicContact CD1-CG 4Å; F30-K216 HydrophobicContact CG-CG 4.5Å; F30-K216 PolarHBondContact N-O 3.17Å; E142-K216 IonicContact OE2-NZ 2.67Å; E142-K216 PolarHBondContact OE2-NZ 3.42Å; S212-K216 WeakPolarHBondContact O-CD 3.3Å; S212-K216 VanDerWaalsContact O-CG 3.23Å; S212-K216 WeakPolarHBondContact O-CG 3.23Å; S212-K216 PolarHBondContact O-N 3.48Å; S212-K216 WeakPolarHBondContact OG-CE 3.48Å; S212-K216 PolarHBondContact OG-NZ 2.83Å; S212-K216 VanDerWaalsContact OG-NZ 3.08Å; L213-K216 PolarHBondContact O-N 2.95Å; L214-K216 VanDerWaalsContact C-N 3.27Å; L214-K216 PolarHBondContact O-N 3.44Å
217	H	89	Confident	86.9	Confident	5 Å²	5	52.7 Å²	52.7	2%	0.023	27%	0.271	C	S	.	.	H	α-helix	trans	-103.7	-21.8	-171.8	-65.1	-71.2	0	0	0	114	L27 P29 C77 L79 I194 L213	L27-H217 PolarHBondContact O-ND1 2.9Å; P29-H217 VanDerWaalsContact CG-O 3.25Å; P29-H217 WeakPolarHBondContact CG-O 3.32Å; C77-H217 PolarHBondContact O-CE1 3.35Å; L79-H217 PolarHBondContact N-NE2 3.15Å; I194-H217 HydrophobicContact CG2-CB 3.9Å; L213-H217 PolarHBondContact O-CD2 3.42Å; L213-H217 PolarHBondContact O-N 3.1Å
218	F	89.5	Confident	86.6	Confident	52 Å²	52	53.6 Å²	53.6	23%	0.228	28%	0.276	C	S	.	.			trans	-140.2	51.3	-177.7	-55.3	-76.8	0	0	0	112.4	M191 I194 L195 I198 L214 M220 V221	M191-F218 HydrophobicContact SD-CE1 4.26Å; M191-F218 HydrophobicContact SD-CZ 3.77Å; I194-F218 HydrophobicContact CG2-CE2 4Å; L195-F218 HydrophobicContact CD2-CE1 4.38Å; L195-F218 HydrophobicContact CD2-CE2 3.68Å; L195-F218 HydrophobicContact CD2-CZ 3.48Å; L195-F218 VanDerWaalsContact CD2-CZ 3.48Å; L195-F218 HydrophobicContact CG-CZ 4.13Å; I198-F218 HydrophobicContact CD1-CD2 3.85Å; I198-F218 HydrophobicContact CD1-CE2 3.68Å; L214-F218 HydrophobicContact CD2-CB 4.48Å; L214-F218 HydrophobicContact CD2-CD2 4.24Å; L214-F218 CarbonylContact O-C 3.49Å; L214-F218 WeakPolarHBondContact O-CA 3.47Å; L214-F218 PolarHBondContact O-N 3.09Å; F218-M220 PolarHBondContact O-N 2.96Å; F218-M220 VanDerWaalsContact O-N 3.11Å; F218-V221 HydrophobicContact CB-CB 4.14Å; F218-V221 HydrophobicContact CB-CG2 3.86Å; F218-V221 WeakPolarHBondContact O-CB 3.44Å; F218-V221 PolarHBondContact O-N 3.31Å
219	P	84.2	Confident	86.2	Confident	19 Å²	19	55.5 Å²	55.5	12%	0.123	28%	0.278	C	S	.	.	H	α-helix	trans	-54.3	-39.2	-172.9	19.5	-31.9	0	0	0	113.1	P29 E215 V221 I222 D223	P29-P219 HydrophobicContact CB-CG 4.17Å; P29-P219 HydrophobicContact CG-CG 4.31Å; E215-P219 WeakPolarHBondContact O-CB 3.36Å; P219-V221 VanDerWaalsContact C-N 3.26Å; P219-V221 PolarHBondContact O-N 3.08Å; P219-I222 PolarHBondContact O-N 3.2Å; P219-D223 PolarHBondContact O-N 3.38Å; P219-D223 VanDerWaalsContact O-N 3.14Å
220	M	82	Confident	86	Confident	119 Å²	119	57.9 Å²	57.9	59%	0.586	29%	0.289	S	S	*	.	H	α-helix	trans	-64.7	-25.2	179.3	-62.3	-62.2	-62.8	0	0	113.7	F218 N224	F218-M220 PolarHBondContact O-N 2.96Å; F218-M220 VanDerWaalsContact O-N 3.11Å; M220-N224 WeakPolarHBondContact CE-ND2 3.23Å; M220-N224 WeakPolarHBondContact O-CB 3.11Å; M220-N224 PolarHBondContact O-N 2.85Å; M220-N224 PolarHBondContact O-ND2 2.73Å
221	V	78.2	Confident	85.9	Confident	54 Å²	54	60.9 Å²	60.9	33%	0.327	31%	0.305	S	S	.	.	H	α-helix	trans	-69.3	-44.8	179.2	172.9	0	0	0	0	110	F218 P219 D225 M228	F218-V221 HydrophobicContact CB-CB 4.14Å; F218-V221 HydrophobicContact CB-CG2 3.86Å; F218-V221 WeakPolarHBondContact O-CB 3.44Å; F218-V221 PolarHBondContact O-N 3.31Å; P219-V221 VanDerWaalsContact C-N 3.26Å; P219-V221 PolarHBondContact O-N 3.08Å; V221-D225 WeakPolarHBondContact O-CB 3.49Å; V221-D225 PolarHBondContact O-N 3.34Å; V221-M228 HydrophobicContact CG1-CE 4.04Å; V221-M228 HydrophobicContact CG1-SD 3.53Å; V221-M228 VanDerWaalsContact CG1-SD 3.53Å
222	I	75	Confident	85.8	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.046	30%	0.304	C	S	.	.	H	α-helix	trans	-69.5	-39.2	177.7	-69.3	176.6	0	0	0	111.1	L214 E215 P219 K229	L214-I222 HydrophobicContact CB-CD1 3.45Å; L214-I222 VanDerWaalsContact CB-CD1 3.45Å; L214-I222 HydrophobicContact CB-CG1 4.12Å; L214-I222 HydrophobicContact CD1-CD1 4.48Å; E215-I222 HydrophobicContact CB-CD1 4.42Å; E215-I222 HydrophobicContact CG-CD1 3.51Å; P219-I222 PolarHBondContact O-N 3.2Å; I222-K229 HydrophobicContact CG2-CB 4.46Å; I222-K229 HydrophobicContact CG2-CD 4.01Å; I222-K229 HydrophobicContact CG2-CG 4.11Å
223	D	77.8	Confident	85.6	Confident	103 Å²	103	64.8 Å²	64.8	55%	0.551	32%	0.322	S	S	*	.	H	α-helix	trans	-75.8	-31.7	-175.3	-74.2	-22.5	0	0	0	113.4	P219 K229	P219-D223 PolarHBondContact O-N 3.38Å; P219-D223 VanDerWaalsContact O-N 3.14Å; D223-K229 IonicContact OD1-NZ 3.87Å
224	N	83	Confident	85.6	Confident	120 Å²	120	68.3 Å²	68.3	64%	0.642	35%	0.346	S	S	*	.	H	α-helix	trans	-90.3	-23	-178.2	-65.8	-32.7	0	0	0	113.9	M220	M220-N224 WeakPolarHBondContact CE-ND2 3.23Å; M220-N224 WeakPolarHBondContact O-CB 3.11Å; M220-N224 PolarHBondContact O-N 2.85Å; M220-N224 PolarHBondContact O-ND2 2.73Å
225	D	85.4	Confident	85.5	Confident	70 Å²	70	69.8 Å²	69.8	37%	0.374	35%	0.351	S	S	.	.			trans	-108.7	87.9	179.9	-167.9	-22.5	0	0	0	111.4	V221 Q227 M228 K229	V221-D225 WeakPolarHBondContact O-CB 3.49Å; V221-D225 PolarHBondContact O-N 3.34Å; D225-Q227 PolarHBondContact O-N 2.74Å; D225-Q227 WeakPolarHBondContact OD1-CA 3.34Å; D225-Q227 WeakPolarHBondContact OD1-CB 3.29Å; D225-Q227 PolarHBondContact OD1-N 3.03Å; D225-M228 HydrophobicContact CB-CB 3.79Å; D225-M228 VanDerWaalsContact CG-CB 3.42Å; D225-M228 PolarHBondContact O-N 2.79Å; D225-M228 PolarHBondContact OD1-N 2.81Å; D225-K229 WeakPolarHBondContact O-CB 3.32Å; D225-K229 PolarHBondContact O-N 2.76Å
226	M	84.4	Confident	85.5	Confident	132 Å²	132	67.9 Å²	67.9	65%	0.65	34%	0.342	S	S	*	.	H	α-helix	trans	-61.3	-27.7	177.8	-173.5	167.4	165.9	0	0	112.5	H230	M226-H230 WeakPolarHBondContact CE-CE1 3.43Å; M226-H230 VanDerWaalsContact CG-CE1 3.43Å; M226-H230 WeakPolarHBondContact CG-CE1 3.26Å; M226-H230 WeakPolarHBondContact O-CB 3.4Å; M226-H230 PolarHBondContact O-N 2.91Å; M226-H230 PolarHBondContact O-ND1 2.76Å
227	Q	86	Confident	85.4	Confident	162 Å²	162	72.7 Å²	72.7	76%	0.757	36%	0.363	S	S	*	.	H	α-helix	trans	-72.4	-46.8	176.3	-63.3	-175.3	5.3	0	0	110.7	D225 K229 H230 L231	D225-Q227 PolarHBondContact O-N 2.74Å; D225-Q227 WeakPolarHBondContact OD1-CA 3.34Å; D225-Q227 WeakPolarHBondContact OD1-CB 3.29Å; D225-Q227 PolarHBondContact OD1-N 3.03Å; Q227-K229 VanDerWaalsContact C-N 3.32Å; Q227-K229 PolarHBondContact O-N 2.86Å; Q227-H230 PolarHBondContact O-N 2.9Å; Q227-L231 WeakPolarHBondContact O-CB 3.5Å; Q227-L231 PolarHBondContact O-N 3.4Å
228	M	84	Confident	85.4	Confident	22 Å²	22	76.2 Å²	76.2	11%	0.108	38%	0.382	C	S	.	.	H	α-helix	trans	-59.7	-44.3	174.7	-173.9	177.6	-176.4	0	0	111	L214 V221 D225 L231 L232 L267	L214-M228 HydrophobicContact CD1-CE 4.26Å; V221-M228 HydrophobicContact CG1-CE 4.04Å; V221-M228 HydrophobicContact CG1-SD 3.53Å; V221-M228 VanDerWaalsContact CG1-SD 3.53Å; D225-M228 HydrophobicContact CB-CB 3.79Å; D225-M228 VanDerWaalsContact CG-CB 3.42Å; D225-M228 PolarHBondContact O-N 2.79Å; D225-M228 PolarHBondContact OD1-N 2.81Å; M228-L231 PolarHBondContact O-N 2.96Å; M228-L232 HydrophobicContact CE-CD1 4.35Å; M228-L232 HydrophobicContact CG-CD1 4.13Å; M228-L232 WeakPolarHBondContact O-CB 3.16Å; M228-L232 WeakPolarHBondContact O-CG 3.3Å; M228-L232 PolarHBondContact O-N 2.7Å; M228-L267 HydrophobicContact CE-CD1 4.35Å
229	K	84.7	Confident	85.4	Confident	83 Å²	83	74.6 Å²	74.6	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-58.4	-49.8	175.9	-172.7	170.4	-171	159.6	0	112	I222 D223 D225 Q227 L231 L232 M233	I222-K229 HydrophobicContact CG2-CB 4.46Å; I222-K229 HydrophobicContact CG2-CD 4.01Å; I222-K229 HydrophobicContact CG2-CG 4.11Å; D223-K229 IonicContact OD1-NZ 3.87Å; D225-K229 WeakPolarHBondContact O-CB 3.32Å; D225-K229 PolarHBondContact O-N 2.76Å; Q227-K229 VanDerWaalsContact C-N 3.32Å; Q227-K229 PolarHBondContact O-N 2.86Å; K229-L231 VanDerWaalsContact C-N 3.32Å; K229-L231 PolarHBondContact O-N 3.18Å; K229-L232 PolarHBondContact O-N 3.24Å; K229-M233 HydrophobicContact CG-SD 4.29Å; K229-M233 VanDerWaalsContact O-CG 3.27Å; K229-M233 WeakPolarHBondContact O-CG 3.47Å; K229-M233 PolarHBondContact O-N 3.16Å
230	H	87.2	Confident	85.4	Confident	96 Å²	96	77.3 Å²	77.3	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-40.5	176.3	-68.4	151.3	0	0	0	112.5	M226 Q227 M233 C234	M226-H230 WeakPolarHBondContact CE-CE1 3.43Å; M226-H230 VanDerWaalsContact CG-CE1 3.43Å; M226-H230 WeakPolarHBondContact CG-CE1 3.26Å; M226-H230 WeakPolarHBondContact O-CB 3.4Å; M226-H230 PolarHBondContact O-N 2.91Å; M226-H230 PolarHBondContact O-ND1 2.76Å; Q227-H230 PolarHBondContact O-N 2.9Å; H230-M233 PolarHBondContact O-N 2.91Å; H230-C234 PolarHBondContact O-N 2.99Å; H230-C234 PolarHBondContact O-SG 2.87Å
231	L	88.2	Confident	85.5	Confident	62 Å²	62	76.1 Å²	76.1	33%	0.325	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-47.2	178.7	-176.1	62.3	0	0	0	111.1	Q227 M228 K229 M233 C234 W235 L263	Q227-L231 WeakPolarHBondContact O-CB 3.5Å; Q227-L231 PolarHBondContact O-N 3.4Å; M228-L231 PolarHBondContact O-N 2.96Å; K229-L231 VanDerWaalsContact C-N 3.32Å; K229-L231 PolarHBondContact O-N 3.18Å; L231-M233 VanDerWaalsContact C-N 3.34Å; L231-M233 PolarHBondContact O-N 2.82Å; L231-C234 WeakPolarHBondContact O-CB 3.4Å; L231-C234 PolarHBondContact O-N 2.83Å; L231-W235 PolarHBondContact O-N 2.98Å; L231-L263 HydrophobicContact CD2-CD1 3.36Å; L231-L263 HydrophobicContact CD2-CD2 3.65Å; L231-L263 HydrophobicContact CD2-CG 4.14Å
232	L	87.4	Confident	85.5	Confident	14 Å²	14	76.2 Å²	76.2	7%	0.073	38%	0.382	C	S	.	.	H	α-helix	trans	-59.6	-43.2	175.5	-73	171.4	0	0	0	111.6	I207 I211 L214 M228 K229 C234 W235 Q236	I207-L232 HydrophobicContact CG2-CD2 4.43Å; I211-L232 HydrophobicContact CD1-CB 4.05Å; I211-L232 HydrophobicContact CG1-CB 4.06Å; I211-L232 HydrophobicContact CG1-CD1 4.35Å; I211-L232 HydrophobicContact CG1-CD2 4.37Å; I211-L232 HydrophobicContact CG1-CG 4.5Å; L214-L232 HydrophobicContact CD1-CD1 3.82Å; M228-L232 HydrophobicContact CE-CD1 4.35Å; M228-L232 HydrophobicContact CG-CD1 4.13Å; M228-L232 WeakPolarHBondContact O-CB 3.16Å; M228-L232 WeakPolarHBondContact O-CG 3.3Å; M228-L232 PolarHBondContact O-N 2.7Å; K229-L232 PolarHBondContact O-N 3.24Å; L232-C234 PolarHBondContact O-N 2.95Å; L232-W235 PolarHBondContact O-N 3.06Å; L232-Q236 WeakPolarHBondContact O-CB 3.49Å; L232-Q236 PolarHBondContact O-N 2.65Å
233	M	88.7	Confident	85.3	Confident	106 Å²	106	81.7 Å²	81.7	52%	0.522	41%	0.408	S	S	.	.	H	α-helix	trans	-61.7	-41.2	175.6	-70.5	175.7	71.4	0	0	112.6	K229 H230 L231 Q236 F237	K229-M233 HydrophobicContact CG-SD 4.29Å; K229-M233 VanDerWaalsContact O-CG 3.27Å; K229-M233 WeakPolarHBondContact O-CG 3.47Å; K229-M233 PolarHBondContact O-N 3.16Å; H230-M233 PolarHBondContact O-N 2.91Å; L231-M233 VanDerWaalsContact C-N 3.34Å; L231-M233 PolarHBondContact O-N 2.82Å; M233-Q236 PolarHBondContact O-N 2.83Å; M233-F237 PolarHBondContact O-N 3.31Å
234	C	90.6	Very high	84.5	Confident	78 Å²	78	83 Å²	83	53%	0.527	41%	0.414	S	S	.	.	H	α-helix	trans	-62.5	-42.2	174.4	-73.6	0	0	0	0	111.8	H230 L231 L232 F237 I238	H230-C234 PolarHBondContact O-N 2.99Å; H230-C234 PolarHBondContact O-SG 2.87Å; L231-C234 WeakPolarHBondContact O-CB 3.4Å; L231-C234 PolarHBondContact O-N 2.83Å; L232-C234 PolarHBondContact O-N 2.95Å; C234-F237 WeakPolarHBondContact O-CB 3.24Å; C234-F237 PolarHBondContact O-N 2.9Å; C234-I238 WeakPolarHBondContact O-CG1 3.39Å; C234-I238 PolarHBondContact O-N 3.19Å; C234-I238 VanDerWaalsContact O-N 3.1Å
235	W	89.4	Confident	83.3	Confident	42 Å²	42	79 Å²	79	16%	0.159	40%	0.396	C	S	.	.	H	α-helix	trans	-70.2	-36	177.8	-76.7	115.7	0	0	0	112.7	I207 L231 L232 F237 I238 E239 M260	I207-W235 HydrophobicContact CB-CB 4.42Å; I207-W235 HydrophobicContact CD1-CB 3.87Å; I207-W235 HydrophobicContact CD1-CG 4.48Å; I207-W235 HydrophobicContact CG1-CB 3.8Å; I207-W235 HydrophobicContact CG2-CB 3.92Å; L231-W235 PolarHBondContact O-N 2.98Å; L232-W235 PolarHBondContact O-N 3.06Å; W235-F237 VanDerWaalsContact C-N 3.31Å; W235-F237 PolarHBondContact O-N 3.06Å; W235-I238 HydrophobicContact CD2-CD1 4.35Å; W235-I238 HydrophobicContact CE3-CB 4.5Å; W235-I238 HydrophobicContact CE3-CD1 3.76Å; W235-I238 HydrophobicContact CZ3-CD1 4.03Å; W235-I238 WeakPolarHBondContact O-CB 3.38Å; W235-I238 PolarHBondContact O-N 3.17Å; W235-I238 VanDerWaalsContact O-N 3.13Å; W235-E239 PolarHBondContact O-N 3.13Å; W235-M260 HydrophobicContact CD2-CE 4.38Å; W235-M260 HydrophobicContact CE3-CE 3.96Å; W235-M260 HydrophobicContact CH2-CE 4.19Å; W235-M260 HydrophobicContact CH2-CG 4.02Å; W235-M260 HydrophobicContact CZ2-CG 4.03Å; W235-M260 HydrophobicContact CZ3-CE 3.85Å
236	Q	90.2	Very high	81.7	Confident	58 Å²	58	85.2 Å²	85.2	27%	0.271	42%	0.415	S	S	.	.	H	α-helix	trans	-63.5	-39.2	173	-172.5	177.4	44.5	0	0	111.2	I207 S208 I211 L232 M233 I238 E239 I240	I207-Q236 HydrophobicContact CG2-CB 3.96Å; S208-Q236 WeakPolarHBondContact OG-CG 3.15Å; S208-Q236 PolarHBondContact OG-NE2 3.47Å; I211-Q236 HydrophobicContact CD1-CB 3.97Å; I211-Q236 HydrophobicContact CD1-CG 4.3Å; L232-Q236 WeakPolarHBondContact O-CB 3.49Å; L232-Q236 PolarHBondContact O-N 2.65Å; M233-Q236 PolarHBondContact O-N 2.83Å; Q236-I238 VanDerWaalsContact C-N 3.34Å; Q236-I238 PolarHBondContact O-N 3.47Å; Q236-E239 WeakPolarHBondContact O-CB 3.13Å; Q236-E239 PolarHBondContact O-N 3.28Å; Q236-I240 HydrophobicContact CG-CD1 4.12Å; Q236-I240 VanDerWaalsContact O-CG1 3.27Å; Q236-I240 WeakPolarHBondContact O-CG1 3.37Å; Q236-I240 PolarHBondContact O-N 3.22Å
237	F	89.8	Confident	80	Confident	121 Å²	121	88 Å²	88	53%	0.531	43%	0.427	S	S	.	.	H	α-helix	trans	-59.6	-45.2	171	-179.8	-89.2	0	0	0	111	M233 C234 W235 E239 I240 F241	M233-F237 PolarHBondContact O-N 3.31Å; C234-F237 WeakPolarHBondContact O-CB 3.24Å; C234-F237 PolarHBondContact O-N 2.9Å; W235-F237 VanDerWaalsContact C-N 3.31Å; W235-F237 PolarHBondContact O-N 3.06Å; F237-E239 PolarHBondContact O-N 3.04Å; F237-I240 PolarHBondContact O-N 3.36Å; F237-F241 AromaticContact CD1-CD2 3.92Å; F237-F241 HydrophobicContact CD1-CD2 3.92Å; F237-F241 HydrophobicContact CD1-CE2 4.11Å; F237-F241 HydrophobicContact CD2-CD2 4.03Å; F237-F241 AromaticContact CD2-CE2 3.58Å; F237-F241 HydrophobicContact CD2-CE2 3.58Å; F237-F241 AromaticContact CE1-CD2 3.7Å; F237-F241 HydrophobicContact CE1-CD2 3.7Å; F237-F241 AromaticContact CE1-CE2 3.62Å; F237-F241 HydrophobicContact CE1-CE2 3.62Å; F237-F241 HydrophobicContact CE1-CG 4.26Å; F237-F241 HydrophobicContact CE1-CZ 4.09Å; F237-F241 AromaticContact CE2-CD2 3.85Å; F237-F241 HydrophobicContact CE2-CD2 3.85Å; F237-F241 AromaticContact CE2-CE2 3.05Å; F237-F241 HydrophobicContact CE2-CE2 3.05Å; F237-F241 AromaticContact CE2-CZ 3.62Å; F237-F241 HydrophobicContact CE2-CZ 3.62Å; F237-F241 HydrophobicContact CG-CD2 4.08Å; F237-F241 HydrophobicContact CG-CE2 4.09Å; F237-F241 AromaticContact CZ-CD2 3.68Å; F237-F241 HydrophobicContact CZ-CD2 3.68Å; F237-F241 HydrophobicContact CZ-CE1 4.17Å; F237-F241 AromaticContact CZ-CE2 3.07Å; F237-F241 HydrophobicContact CZ-CE2 3.07Å; F237-F241 HydrophobicContact CZ-CG 4.43Å; F237-F241 AromaticContact CZ-CZ 3.34Å; F237-F241 HydrophobicContact CZ-CZ 3.34Å; F237-F241 WeakPolarHBondContact O-CD2 3.27Å; F237-F241 PolarHBondContact O-N 2.92Å
238	I	88.3	Confident	78.3	Confident	79 Å²	79	86.2 Å²	86.2	41%	0.405	43%	0.427	S	S	.	.	H	α-helix	trans	-61.7	-44.3	176.9	-66	165.8	0	0	0	111.6	C234 W235 Q236 F241 S242	C234-I238 WeakPolarHBondContact O-CG1 3.39Å; C234-I238 PolarHBondContact O-N 3.19Å; C234-I238 VanDerWaalsContact O-N 3.1Å; W235-I238 HydrophobicContact CD2-CD1 4.35Å; W235-I238 HydrophobicContact CE3-CB 4.5Å; W235-I238 HydrophobicContact CE3-CD1 3.76Å; W235-I238 HydrophobicContact CZ3-CD1 4.03Å; W235-I238 WeakPolarHBondContact O-CB 3.38Å; W235-I238 PolarHBondContact O-N 3.17Å; W235-I238 VanDerWaalsContact O-N 3.13Å; Q236-I238 VanDerWaalsContact C-N 3.34Å; Q236-I238 PolarHBondContact O-N 3.47Å; I238-F241 PolarHBondContact O-N 3.17Å; I238-S242 WeakPolarHBondContact O-CB 3.09Å; I238-S242 PolarHBondContact O-N 2.88Å; I238-S242 PolarHBondContact O-OG 2.94Å
239	E	88.7	Confident	76.7	Confident	18 Å²	18	88 Å²	88	8%	0.084	44%	0.437	C	S	.	.	H	α-helix	trans	-53.4	-56.7	174.6	174.7	-170	-143.3	0	0	110.6	Q206 I207 S208 W235 Q236 F237 F241 S242 E243	Q206-E239 VanDerWaalsContact C-OE1 3.26Å; Q206-E239 WeakPolarHBondContact CA-OE1 3.32Å; I207-E239 HydrophobicContact CB-CB 4.47Å; I207-E239 PolarHBondContact N-OE1 2.88Å; S208-E239 VanDerWaalsContact CB-OE2 3.27Å; S208-E239 WeakPolarHBondContact CB-OE2 3.4Å; S208-E239 VanDerWaalsContact N-CD 3.34Å; S208-E239 PolarHBondContact N-OE1 3.23Å; S208-E239 VanDerWaalsContact N-OE1 3.12Å; S208-E239 PolarHBondContact N-OE2 3.46Å; S208-E239 PolarHBondContact OG-OE2 3.34Å; W235-E239 PolarHBondContact O-N 3.13Å; Q236-E239 WeakPolarHBondContact O-CB 3.13Å; Q236-E239 PolarHBondContact O-N 3.28Å; F237-E239 PolarHBondContact O-N 3.04Å; E239-F241 VanDerWaalsContact C-N 3.29Å; E239-F241 PolarHBondContact O-N 2.84Å; E239-S242 PolarHBondContact O-N 3.37Å; E239-S242 PolarHBondContact O-OG 3.46Å; E239-E243 PolarHBondContact O-N 3.11Å; E239-E243 VanDerWaalsContact O-N 3.1Å
240	I	84.3	Confident	75.1	Confident	75 Å²	75	88.9 Å²	88.9	39%	0.385	45%	0.448	S	S	.	.	H	α-helix	trans	-56.2	-41.7	-180	-67.6	165.1	0	0	0	111.7	Q236 F237 N244	Q236-I240 HydrophobicContact CG-CD1 4.12Å; Q236-I240 VanDerWaalsContact O-CG1 3.27Å; Q236-I240 WeakPolarHBondContact O-CG1 3.37Å; Q236-I240 PolarHBondContact O-N 3.22Å; F237-I240 PolarHBondContact O-N 3.36Å; I240-N244 PolarHBondContact O-N 2.94Å; I240-N244 PolarHBondContact O-ND2 2.58Å
241	F	83.7	Confident	73.3	Confident	94 Å²	94	94.4 Å²	94.4	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-72.4	-32.6	179.1	-85.8	-102	0	0	0	112.6	F237 I238 E239 N244 S245 I249	F237-F241 AromaticContact CD1-CD2 3.92Å; F237-F241 HydrophobicContact CD1-CD2 3.92Å; F237-F241 HydrophobicContact CD1-CE2 4.11Å; F237-F241 HydrophobicContact CD2-CD2 4.03Å; F237-F241 AromaticContact CD2-CE2 3.58Å; F237-F241 HydrophobicContact CD2-CE2 3.58Å; F237-F241 AromaticContact CE1-CD2 3.7Å; F237-F241 HydrophobicContact CE1-CD2 3.7Å; F237-F241 AromaticContact CE1-CE2 3.62Å; F237-F241 HydrophobicContact CE1-CE2 3.62Å; F237-F241 HydrophobicContact CE1-CG 4.26Å; F237-F241 HydrophobicContact CE1-CZ 4.09Å; F237-F241 AromaticContact CE2-CD2 3.85Å; F237-F241 HydrophobicContact CE2-CD2 3.85Å; F237-F241 AromaticContact CE2-CE2 3.05Å; F237-F241 HydrophobicContact CE2-CE2 3.05Å; F237-F241 AromaticContact CE2-CZ 3.62Å; F237-F241 HydrophobicContact CE2-CZ 3.62Å; F237-F241 HydrophobicContact CG-CD2 4.08Å; F237-F241 HydrophobicContact CG-CE2 4.09Å; F237-F241 AromaticContact CZ-CD2 3.68Å; F237-F241 HydrophobicContact CZ-CD2 3.68Å; F237-F241 HydrophobicContact CZ-CE1 4.17Å; F237-F241 AromaticContact CZ-CE2 3.07Å; F237-F241 HydrophobicContact CZ-CE2 3.07Å; F237-F241 HydrophobicContact CZ-CG 4.43Å; F237-F241 AromaticContact CZ-CZ 3.34Å; F237-F241 HydrophobicContact CZ-CZ 3.34Å; F237-F241 WeakPolarHBondContact O-CD2 3.27Å; F237-F241 PolarHBondContact O-N 2.92Å; I238-F241 PolarHBondContact O-N 3.17Å; E239-F241 VanDerWaalsContact C-N 3.29Å; E239-F241 PolarHBondContact O-N 2.84Å; F241-N244 PolarHBondContact O-N 2.91Å; F241-S245 WeakPolarHBondContact O-CB 3.32Å; F241-S245 PolarHBondContact O-N 3.26Å; F241-S245 PolarHBondContact O-OG 3.4Å; F241-I249 HydrophobicContact CB-CD1 4.29Å
242	S	78.5	Confident	71.5	Confident	56 Å²	56	94.1 Å²	94.1	39%	0.392	48%	0.483	S	S	.	.	H	α-helix	trans	-68.1	-37.5	178.1	75.1	0	0	0	0	112.6	I238 E239 N244	I238-S242 WeakPolarHBondContact O-CB 3.09Å; I238-S242 PolarHBondContact O-N 2.88Å; I238-S242 PolarHBondContact O-OG 2.94Å; E239-S242 PolarHBondContact O-N 3.37Å; E239-S242 PolarHBondContact O-OG 3.46Å; S242-N244 VanDerWaalsContact C-N 3.32Å; S242-N244 PolarHBondContact O-N 3.04Å
243	E	71.2	Confident	69.7	Low	125 Å²	125	95.4 Å²	95.4	58%	0.584	50%	0.495	S	S	*	.	H	α-helix	trans	-67.5	-33	176.4	-67.9	-177	160.8	0	0	112.5	E239	E239-E243 PolarHBondContact O-N 3.11Å; E239-E243 VanDerWaalsContact O-N 3.1Å
244	N	61.5	Low	67.8	Low	129 Å²	129	99 Å²	99	69%	0.69	51%	0.508	S	S	*	.	H	α-helix	trans	-90.6	-7.3	-176.7	-71.8	-59.3	0	0	0	114.3	I240 F241 S242	I240-N244 PolarHBondContact O-N 2.94Å; I240-N244 PolarHBondContact O-ND2 2.58Å; F241-N244 PolarHBondContact O-N 2.91Å; S242-N244 VanDerWaalsContact C-N 3.32Å; S242-N244 PolarHBondContact O-N 3.04Å
245	S	56.6	Low	65.8	Low	37 Å²	37	99.1 Å²	99.1	26%	0.259	52%	0.515	S	S	.	.			trans	-134.5	61.1	-168	-41.9	0	0	0	0	112.7	F241 E247	F241-S245 WeakPolarHBondContact O-CB 3.32Å; F241-S245 PolarHBondContact O-N 3.26Å; F241-S245 PolarHBondContact O-OG 3.4Å; S245-E247 PolarHBondContact O-N 2.92Å
246	Y	52.8	Low	63.9	Low	200 Å²	200	98.9 Å²	98.9	78%	0.784	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.7	-178.3	-93.1	-88.5	0	0	0	114.9
247	E	49	Very low	62	Low	190 Å²	190	100.5 Å²	100.5	89%	0.888	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-10.5	-173.3	-74.3	-164.3	146.9	0	0	117.1	S245	S245-E247 PolarHBondContact O-N 2.92Å
248	V	49.6	Very low	60	Low	126 Å²	126	97 Å²	97	76%	0.764	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	-21.6	-169.6	-176.9	0	0	0	0	114.7
249	I	51.1	Low	58.1	Low	60 Å²	60	99.1 Å²	99.1	31%	0.308	54%	0.543	S	S	.	.	S	Bend	trans	-101.6	-16.7	-167.8	-61.4	178.5	0	0	0	114.3	F241 K251 G252 A253	F241-I249 HydrophobicContact CB-CD1 4.29Å; I249-K251 PolarHBondContact O-N 2.82Å; I249-G252 PolarHBondContact O-N 2.93Å; I249-A253 HydrophobicContact CG2-CB 4.08Å; I249-A253 PolarHBondContact O-N 2.93Å
250	V	50.7	Low	56.2	Low	101 Å²	101	99.9 Å²	99.9	61%	0.612	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-18.8	-173.2	-179.3	0	0	0	0	114
251	K	48.5	Very low	54.3	Low	212 Å²	212	103.7 Å²	103.7	92%	0.922	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-15.2	174.9	-75.9	-178.2	176.2	175.7	0	114.9	I249	I249-K251 PolarHBondContact O-N 2.82Å
252	G	50.3	Low	52.5	Low	55 Å²	55	106.7 Å²	106.7	57%	0.567	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-33	-179	0	0	0	0	0	114.9	I249 K254	I249-G252 PolarHBondContact O-N 2.93Å; G252-K254 PolarHBondContact O-N 2.92Å
253	A	50.9	Low	50.8	Low	41 Å²	41	107.8 Å²	107.8	34%	0.339	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-76.8	-14.4	-171.3	0	0	0	0	0	115.2	I249 A255 S256	I249-A253 HydrophobicContact CG2-CB 4.08Å; I249-A253 PolarHBondContact O-N 2.93Å; A253-A255 PolarHBondContact O-N 2.79Å; A253-A255 VanDerWaalsContact O-N 3.14Å; A253-S256 PolarHBondContact O-N 2.96Å; A253-S256 VanDerWaalsContact O-N 3.17Å; A253-S256 PolarHBondContact O-OG 3.14Å
254	K	47.9	Very low	49.7	Very low	181 Å²	181	105.5 Å²	105.5	79%	0.787	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-67.4	-11.6	176.3	-73.6	-174.2	178	-178.7	0	113.9	G252	G252-K254 PolarHBondContact O-N 2.92Å
255	A	48.7	Very low	48.9	Very low	82 Å²	82	108.6 Å²	108.6	68%	0.678	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-88.7	-19.7	174.1	0	0	0	0	0	113.8	A253	A253-A255 PolarHBondContact O-N 2.79Å; A253-A255 VanDerWaalsContact O-N 3.14Å
256	S	49.3	Very low	48.2	Very low	37 Å²	37	114.1 Å²	114.1	26%	0.259	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.7	-17.7	-175	60.9	0	0	0	0	114.3	A253 G258 L259	A253-S256 PolarHBondContact O-N 2.96Å; A253-S256 VanDerWaalsContact O-N 3.17Å; A253-S256 PolarHBondContact O-OG 3.14Å; S256-G258 PolarHBondContact O-N 3.23Å; S256-G258 VanDerWaalsContact O-N 3.17Å; S256-L259 PolarHBondContact O-N 2.69Å
257	V	51.1	Low	47.7	Very low	92 Å²	92	113.3 Å²	113.3	56%	0.558	61%	0.609	S	S	*	*	H	α-helix	trans	-60.4	-23.9	172.3	-175	0	0	0	0	111.8
258	G	48.1	Very low	47.6	Very low	48 Å²	48	109.5 Å²	109.5	50%	0.495	60%	0.595	S	S	.	*	H	α-helix	trans	-70.6	-30.4	174	0	0	0	0	0	114.4	S256	S256-G258 PolarHBondContact O-N 3.23Å; S256-G258 VanDerWaalsContact O-N 3.17Å
259	L	48.1	Very low	47.5	Very low	122 Å²	122	108.6 Å²	108.6	64%	0.639	59%	0.586	S	S	*	*	H	α-helix	trans	-80.6	-28.9	178.6	-94.9	105.4	0	0	0	112.9	S256 K261 M262	S256-L259 PolarHBondContact O-N 2.69Å; L259-K261 PolarHBondContact O-N 3.15Å; L259-M262 PolarHBondContact O-N 2.69Å
260	M	47.4	Very low	47.3	Very low	34 Å²	34	111.3 Å²	111.3	17%	0.167	60%	0.602	C	S	.	*	H	α-helix	trans	-57.7	-28.2	172.9	-93	-178.7	178.2	0	0	112.7	I202 I207 W235 M262	I202-M260 WeakPolarHBondContact O-CE 3.44Å; I207-M260 HydrophobicContact CD1-CE 4.49Å; W235-M260 HydrophobicContact CD2-CE 4.38Å; W235-M260 HydrophobicContact CE3-CE 3.96Å; W235-M260 HydrophobicContact CH2-CE 4.19Å; W235-M260 HydrophobicContact CH2-CG 4.02Å; W235-M260 HydrophobicContact CZ2-CG 4.03Å; W235-M260 HydrophobicContact CZ3-CE 3.85Å; M260-M262 VanDerWaalsContact C-N 3.27Å; M260-M262 PolarHBondContact O-N 2.97Å
261	K	45.2	Very low	47.1	Very low	156 Å²	156	111.9 Å²	111.9	68%	0.678	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-12.6	176.7	-71.1	-176.3	175.7	-179.1	0	114.4	L259	L259-K261 PolarHBondContact O-N 3.15Å
262	M	45.4	Very low	47.1	Very low	156 Å²	156	105.6 Å²	105.6	77%	0.768	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-19.3	-175.1	-141.5	-177.6	-84.7	0	0	113.3	L259 M260 F264	L259-M262 PolarHBondContact O-N 2.69Å; M260-M262 VanDerWaalsContact C-N 3.27Å; M260-M262 PolarHBondContact O-N 2.97Å; M262-F264 PolarHBondContact O-N 3.09Å
263	L	44	Very low	46.8	Very low	79 Å²	79	109 Å²	109	41%	0.414	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-75.1	-9.4	173.2	-147.1	73.2	0	0	0	112.9	L231 F265	L231-L263 HydrophobicContact CD2-CD1 3.36Å; L231-L263 HydrophobicContact CD2-CD2 3.65Å; L231-L263 HydrophobicContact CD2-CG 4.14Å; L263-F265 VanDerWaalsContact C-N 3.26Å; L263-F265 PolarHBondContact O-N 3.39Å
264	F	47.8	Very low	46.6	Very low	78 Å²	78	113.9 Å²	113.9	34%	0.342	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-73.9	-2.8	-171.4	-106.9	-74.6	0	0	0	116.5	R199 M203 M262	R199-F264 HydrophobicContact CG-CE1 4.41Å; R199-F264 HydrophobicContact CG-CZ 4.05Å; M203-F264 HydrophobicContact CG-CE2 4.38Å; M203-F264 HydrophobicContact CG-CZ 4.3Å; M203-F264 HydrophobicContact SD-CE2 3.43Å; M203-F264 WeakPolarHBondContact SD-CE2 3.36Å; M203-F264 HydrophobicContact SD-CZ 3.88Å; M262-F264 PolarHBondContact O-N 3.09Å
265	F	44	Very low	46.5	Very low	194 Å²	194	108.7 Å²	108.7	85%	0.851	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-107.3	6.4	-177.1	-93.8	-85.5	0	0	0	113.8	L263	L263-F265 VanDerWaalsContact C-N 3.26Å; L263-F265 PolarHBondContact O-N 3.39Å
266	L	42.9	Very low	46.3	Very low	152 Å²	152	110.9 Å²	110.9	80%	0.796	58%	0.577	S	S	*	*			trans	-123.2	-3.8	-172.2	-79.1	159.8	0	0	0	115.3
267	L	42.1	Very low	46	Very low	183 Å²	183	117.6 Å²	117.6	96%	0.958	61%	0.606	S	S	*	*			trans	-115.8	0	168.6	-67	173.4	0	0	0	109.1	M228	M228-L267 HydrophobicContact CE-CD1 4.35Å

Retrieved 267 of 267 residues in 54.1 ms (Link to these results)

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