A0A087Y950_POEFO Loading...

U3 small nucleolar RNA-associated protein 15 homolog

Ribosome biogenesis factor. Involved in nucleolar processing of pre-18S ribosomal RNA. Required for optimal pre-ribosomal RNA transcription by RNA polymerase I. Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome.

AlphaFold DB , UniProt , Accession A0A087Y950, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 535 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	44.9	Very low	68.5	Low	245 Å²	245	103.6 Å²	103.6	100%	1.207	57%	0.57	S	S	*	*				0	119.1	0	-73.4	-177.4	174.2	0	0	108.1	S3	M1-S3 PolarHBondContact O-N 3.22Å
2	A	51.6	Low	68.3	Low	106 Å²	106	98.4 Å²	98.4	88%	0.876	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-58	123.5	-179.5	0	0	0	0	0	110	F4	A2-F4 PolarHBondContact O-N 3.25Å
3	S	72	Confident	67.9	Low	102 Å²	102	98.6 Å²	98.6	71%	0.713	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-62.2	121	177.4	54.5	0	0	0	0	109.4	M1 K5	M1-S3 PolarHBondContact O-N 3.22Å; S3-K5 PolarHBondContact O-N 3.17Å; S3-K5 VanDerWaalsContact O-N 3.17Å
4	F	73.6	Confident	67.6	Low	49 Å²	49	103.1 Å²	103.1	22%	0.215	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-56.5	119.6	174.8	178.8	-92.6	0	0	0	109.7	A2 L366 D370 L373 K374	A2-F4 PolarHBondContact O-N 3.25Å; F4-L366 HydrophobicContact CD1-CD1 4.44Å; F4-L366 HydrophobicContact CD1-CD2 4.34Å; F4-D370 HydrophobicContact CE1-CB 3.87Å; F4-D370 WeakPolarHBondContact CE1-O 3.24Å; F4-D370 HydrophobicContact CZ-CB 4.42Å; F4-D370 WeakPolarHBondContact CZ-O 3.34Å; F4-L373 HydrophobicContact CE2-CB 3.93Å; F4-L373 HydrophobicContact CZ-CB 3.7Å; F4-K374 HydrophobicContact CB-CB 4.46Å; F4-K374 HydrophobicContact CB-CD 4.11Å; F4-K374 HydrophobicContact CB-CG 4.07Å; F4-K374 HydrophobicContact CD1-CB 4.3Å; F4-K374 HydrophobicContact CD2-CB 3.82Å; F4-K374 HydrophobicContact CD2-CG 4.19Å; F4-K374 HydrophobicContact CE2-CB 4.08Å; F4-K374 HydrophobicContact CG-CB 3.94Å; F4-K374 HydrophobicContact CG-CD 4.39Å; F4-K374 HydrophobicContact CG-CG 4.09Å; F4-K374 HydrophobicContact CZ-CB 4.44Å
5	K	77.4	Confident	67	Low	170 Å²	170	105.3 Å²	105.3	74%	0.739	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-83.4	127.8	173.7	-69.2	-178.9	-180	176.4	0	108.2	S3	S3-K5 PolarHBondContact O-N 3.17Å; S3-K5 VanDerWaalsContact O-N 3.17Å
6	P	76.8	Confident	66.6	Low	63 Å²	63	102.5 Å²	102.5	41%	0.409	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-60.6	150.2	177	26.5	-33.7	0	0	0	110.3	K8 L366	P6-K8 PolarHBondContact O-N 3.23Å; P6-L366 HydrophobicContact CB-CD2 4.27Å
7	T	74.7	Confident	66.3	Low	12 Å²	12	107.1 Å²	107.1	7%	0.074	59%	0.586	C	S	.	*	P	Polyproline II helix	trans	-58.8	127.3	178.6	57.7	0	0	0	0	109.8	I9 Y369 D370 L373 E404	T7-I9 PolarHBondContact O-N 3.12Å; T7-I9 VanDerWaalsContact O-N 3.11Å; T7-Y369 VanDerWaalsContact OG1-CE2 3.27Å; T7-Y369 WeakPolarHBondContact OG1-CE2 3.5Å; T7-D370 WeakPolarHBondContact CG2-OD1 3.43Å; T7-D370 PolarHBondContact N-OD1 3.28Å; T7-D370 PolarHBondContact OG1-OD1 3.5Å; T7-L373 HydrophobicContact CG2-CD1 3.44Å; T7-L373 VanDerWaalsContact CG2-CD1 3.44Å; T7-E404 HydrophobicContact CG2-CB 4.15Å; T7-E404 HydrophobicContact CG2-CG 3.96Å
8	K	75.6	Confident	66.2	Low	176 Å²	176	111.4 Å²	111.4	77%	0.765	60%	0.598	S	S	*	*			trans	-74.5	104.4	173.2	-70.3	-173.4	177.9	-173.9	0	108.2	P6 P10	P6-K8 PolarHBondContact O-N 3.23Å; K8-P10 VanDerWaalsContact O-CD 3.23Å; K8-P10 WeakPolarHBondContact O-CD 3.39Å
9	I	74	Confident	66.2	Low	61 Å²	61	109.8 Å²	109.8	31%	0.313	59%	0.593	S	S	.	*			trans	-68	117.1	172.7	-59.2	154.7	0	0	0	106.8	T7 V11 E396 I397	T7-I9 PolarHBondContact O-N 3.12Å; T7-I9 VanDerWaalsContact O-N 3.11Å; I9-V11 PolarHBondContact O-N 3.27Å; I9-V11 VanDerWaalsContact O-N 3.13Å; I9-E396 HydrophobicContact CG2-CB 4.17Å; I9-I397 HydrophobicContact CD1-CD1 4.48Å; I9-I397 HydrophobicContact CD1-CG1 3.93Å; I9-I397 HydrophobicContact CG1-CG1 4.35Å; I9-I397 HydrophobicContact CG2-CG1 4.34Å
10	P	67.4	Low	66.7	Low	27 Å²	27	107.7 Å²	107.7	18%	0.175	58%	0.583	C	S	.	*			trans	-61.7	117	174.9	24.5	-32.4	0	0	0	109.2	K8 Y12	K8-P10 VanDerWaalsContact O-CD 3.23Å; K8-P10 WeakPolarHBondContact O-CD 3.39Å; P10-Y12 HydrophobicContact CB-CD2 4.14Å; P10-Y12 HydrophobicContact CB-CE2 3.55Å; P10-Y12 HydrophobicContact CG-CD2 4.29Å; P10-Y12 HydrophobicContact CG-CE2 3.39Å; P10-Y12 VanDerWaalsContact O-CD2 3.27Å; P10-Y12 WeakPolarHBondContact O-CD2 3.47Å; P10-Y12 PolarHBondContact O-N 3.11Å
11	V	65.5	Low	67.1	Low	129 Å²	129	110.6 Å²	110.6	78%	0.782	59%	0.593	S	S	*	*			trans	-80.9	102.8	170.8	-179.5	0	0	0	0	106.5	I9	I9-V11 PolarHBondContact O-N 3.27Å; I9-V11 VanDerWaalsContact O-N 3.13Å
12	Y	66.6	Low	68.6	Low	41 Å²	41	100.9 Å²	100.9	16%	0.161	55%	0.546	C	S	.	.			trans	-81.8	131.3	174.9	-63	-90.2	0	0	0	109.5	P10 K14 R438 F439 I442	P10-Y12 HydrophobicContact CB-CD2 4.14Å; P10-Y12 HydrophobicContact CB-CE2 3.55Å; P10-Y12 HydrophobicContact CG-CD2 4.29Å; P10-Y12 HydrophobicContact CG-CE2 3.39Å; P10-Y12 VanDerWaalsContact O-CD2 3.27Å; P10-Y12 WeakPolarHBondContact O-CD2 3.47Å; P10-Y12 PolarHBondContact O-N 3.11Å; Y12-K14 PolarHBondContact O-N 2.88Å; Y12-R438 HydrophobicContact CD1-CB 3.72Å; Y12-R438 HydrophobicContact CD1-CG 4.25Å; Y12-R438 HydrophobicContact CE1-CB 4.12Å; Y12-R438 VanDerWaalsContact CE1-O 3.24Å; Y12-R438 WeakPolarHBondContact CE1-O 3.4Å; Y12-R438 HydrophobicContact CG-CB 4.01Å; Y12-R438 HydrophobicContact CG-CG 4.46Å; Y12-F439 AromaticContact CD2-CD1 3.98Å; Y12-F439 HydrophobicContact CD2-CD1 3.98Å; Y12-F439 AromaticContact CD2-CE1 3.31Å; Y12-F439 HydrophobicContact CD2-CE1 3.31Å; Y12-F439 HydrophobicContact CD2-CZ 4.17Å; Y12-F439 AromaticContact CE2-CD1 3.51Å; Y12-F439 HydrophobicContact CE2-CD1 3.51Å; Y12-F439 AromaticContact CE2-CE1 3.23Å; Y12-F439 HydrophobicContact CE2-CE1 3.23Å; Y12-F439 HydrophobicContact CE2-CZ 4.43Å; Y12-F439 HydrophobicContact CG-CE1 4.17Å; Y12-F439 AromaticContact CZ-CD1 3.87Å; Y12-I442 VanDerWaalsContact OH-CD1 3.31Å; Y12-I442 WeakPolarHBondContact OH-CD1 3.32Å
13	P	62.7	Low	70	Confident	101 Å²	101	96.6 Å²	96.6	66%	0.656	51%	0.509	S	S	*	.			trans	-62.6	126.8	173.2	26.8	-31.9	0	0	0	108.2	L15 R438	P13-L15 PolarHBondContact O-N 3.39Å; P13-R438 PolarHBondContact O-NE 3.06Å
14	K	63.4	Low	70.5	Confident	162 Å²	162	96 Å²	96	70%	0.704	50%	0.497	S	S	*	.			trans	-67.2	108.1	171.2	-68.8	-176.7	178.5	-175.2	0	108.3	Y12 G16	Y12-K14 PolarHBondContact O-N 2.88Å; K14-G16 PolarHBondContact O-N 2.87Å
15	L	59	Low	71	Confident	136 Å²	136	96.7 Å²	96.7	71%	0.712	50%	0.499	S	S	*	.	S	Bend	trans	-59.7	117.4	167.3	-70.2	163.9	0	0	0	107.3	P13	P13-L15 PolarHBondContact O-N 3.39Å
16	G	60.4	Low	71.2	Confident	60 Å²	60	88.8 Å²	88.8	62%	0.619	47%	0.465	S	S	*	.	S	Bend	trans	148.9	173.9	-171.8	0	0	0	0	0	111.6	K14 K18	K14-G16 PolarHBondContact O-N 2.87Å; G16-K18 PolarHBondContact O-N 3.45Å; G16-K18 VanDerWaalsContact O-N 3.1Å
17	E	61.8	Low	71.5	Confident	180 Å²	180	91.8 Å²	91.8	84%	0.841	47%	0.471	S	S	*	.	S	Bend	trans	-56	118.6	176.5	-167.6	176.4	-171.2	0	0	109.3	V19	E17-V19 PolarHBondContact O-N 2.91Å
18	K	63.8	Low	71.9	Confident	186 Å²	186	95 Å²	95	81%	0.809	49%	0.488	S	S	*	.			trans	-59.2	112	176.9	-72.9	-178.6	-179.9	176	0	106.9	G16 T20	G16-K18 PolarHBondContact O-N 3.45Å; G16-K18 VanDerWaalsContact O-N 3.1Å; K18-T20 VanDerWaalsContact C-N 3.28Å; K18-T20 PolarHBondContact O-N 3.38Å
19	V	66.4	Low	72.2	Confident	81 Å²	81	87.6 Å²	87.6	49%	0.491	46%	0.455	S	S	.	.			trans	-59.6	97.1	171.7	-176.4	0	0	0	0	106.4	E17 T23 L24	E17-V19 PolarHBondContact O-N 2.91Å; V19-T23 VanDerWaalsContact C-OG1 3.3Å; V19-T23 WeakPolarHBondContact CA-OG1 3.41Å; V19-T23 WeakPolarHBondContact CG1-OG1 3.49Å; V19-L24 HydrophobicContact CG1-CD2 3.67Å; V19-L24 HydrophobicContact CG1-CG 3.77Å
20	T	76.4	Confident	72.6	Confident	66 Å²	66	88.3 Å²	88.3	41%	0.405	46%	0.456	S	S	.	.			trans	-63.4	154.3	-179.3	57.2	0	0	0	0	109.2	K18 D22 T23 L24	K18-T20 VanDerWaalsContact C-N 3.28Å; K18-T20 PolarHBondContact O-N 3.38Å; T20-D22 PolarHBondContact O-N 3.18Å; T20-D22 VanDerWaalsContact O-N 3.15Å; T20-T23 PolarHBondContact N-OG1 3.21Å; T20-T23 PolarHBondContact O-N 3.33Å; T20-T23 PolarHBondContact O-OG1 3.15Å; T20-T23 VanDerWaalsContact OG1-CG2 3.24Å; T20-T23 WeakPolarHBondContact OG1-CG2 3.43Å; T20-T23 PolarHBondContact OG1-N 3.24Å; T20-T23 PolarHBondContact OG1-OG1 3.05Å; T20-L24 PolarHBondContact O-N 3.28Å; T20-L24 VanDerWaalsContact O-N 3.12Å
21	Q	76.1	Confident	73.1	Confident	170 Å²	170	91 Å²	91	79%	0.794	48%	0.481	S	S	*	.	H	α-helix	trans	-54.5	-35	176	-70.3	179.1	-12.6	0	0	111.3	L24 Y25	Q21-L24 WeakPolarHBondContact O-CB 3.36Å; Q21-L24 PolarHBondContact O-N 2.86Å; Q21-Y25 PolarHBondContact O-N 2.99Å
22	D	76.3	Confident	74	Confident	40 Å²	40	87.5 Å²	87.5	21%	0.214	46%	0.461	C	S	.	.	H	α-helix	trans	-63.8	-41.9	173.6	-63.5	11.9	0	0	0	112.9	T20 L24 Y25 W26 R265 V286	T20-D22 PolarHBondContact O-N 3.18Å; T20-D22 VanDerWaalsContact O-N 3.15Å; D22-L24 VanDerWaalsContact C-N 3.25Å; D22-L24 PolarHBondContact O-N 3.02Å; D22-Y25 VanDerWaalsContact O-CB 3.32Å; D22-Y25 WeakPolarHBondContact O-CB 3.47Å; D22-Y25 PolarHBondContact O-N 3.42Å; D22-Y25 VanDerWaalsContact O-N 3.13Å; D22-W26 PolarHBondContact O-N 2.89Å; D22-R265 IonicContact OD1-NH2 2.63Å; D22-R265 IonicContact OD2-CZ 3.47Å; D22-R265 VanDerWaalsContact OD2-CZ 3.27Å; D22-R265 IonicContact OD2-NE 3.8Å; D22-R265 PolarHBondContact OD2-NE 3.06Å; D22-R265 IonicContact OD2-NH2 2.88Å; D22-R265 PolarHBondContact OD2-NH2 3.39Å; D22-V286 HydrophobicContact CB-CG1 3.24Å
23	T	81.3	Confident	74.8	Confident	16 Å²	16	87.5 Å²	87.5	10%	0.098	47%	0.465	C	S	.	.	H	α-helix	trans	-64.3	-32.3	175	60.5	0	0	0	0	112.1	V19 T20 K27 V286	V19-T23 VanDerWaalsContact C-OG1 3.3Å; V19-T23 WeakPolarHBondContact CA-OG1 3.41Å; V19-T23 WeakPolarHBondContact CG1-OG1 3.49Å; T20-T23 PolarHBondContact N-OG1 3.21Å; T20-T23 PolarHBondContact O-N 3.33Å; T20-T23 PolarHBondContact O-OG1 3.15Å; T20-T23 VanDerWaalsContact OG1-CG2 3.24Å; T20-T23 WeakPolarHBondContact OG1-CG2 3.43Å; T20-T23 PolarHBondContact OG1-N 3.24Å; T20-T23 PolarHBondContact OG1-OG1 3.05Å; T23-K27 VanDerWaalsContact O-CB 3.25Å; T23-K27 WeakPolarHBondContact O-CB 3.24Å; T23-K27 WeakPolarHBondContact O-CG 3.42Å; T23-K27 PolarHBondContact O-N 3.19Å; T23-V286 WeakPolarHBondContact CG2-O 3.49Å
24	L	80.8	Confident	76	Confident	90 Å²	90	88.6 Å²	88.6	47%	0.471	46%	0.461	S	S	.	.	H	α-helix	trans	-68.8	-40.8	171.4	-67.6	173.1	0	0	0	111.3	V19 T20 Q21 D22 K27 N28	V19-L24 HydrophobicContact CG1-CD2 3.67Å; V19-L24 HydrophobicContact CG1-CG 3.77Å; T20-L24 PolarHBondContact O-N 3.28Å; T20-L24 VanDerWaalsContact O-N 3.12Å; Q21-L24 WeakPolarHBondContact O-CB 3.36Å; Q21-L24 PolarHBondContact O-N 2.86Å; D22-L24 VanDerWaalsContact C-N 3.25Å; D22-L24 PolarHBondContact O-N 3.02Å; L24-K27 PolarHBondContact O-N 3.04Å; L24-N28 PolarHBondContact O-N 3.19Å; L24-N28 PolarHBondContact O-ND2 3.04Å
25	Y	83.8	Confident	77.2	Confident	64 Å²	64	81.8 Å²	81.8	25%	0.251	43%	0.432	S	S	.	.	H	α-helix	trans	-56.4	-50.6	175.8	175.6	-94.7	0	0	0	111.3	Q21 D22 K27 N28 D304 R321	Q21-Y25 PolarHBondContact O-N 2.99Å; D22-Y25 VanDerWaalsContact O-CB 3.32Å; D22-Y25 WeakPolarHBondContact O-CB 3.47Å; D22-Y25 PolarHBondContact O-N 3.42Å; D22-Y25 VanDerWaalsContact O-N 3.13Å; Y25-K27 PolarHBondContact O-N 3.2Å; Y25-N28 WeakPolarHBondContact O-CB 3.18Å; Y25-N28 PolarHBondContact O-N 3.39Å; Y25-D304 WeakPolarHBondContact OH-CB 3.36Å; Y25-D304 PolarHBondContact OH-OD2 3.24Å; Y25-R321 VanDerWaalsContact CE2-NH1 3.33Å; Y25-R321 PolarHBondContact OH-NH1 2.98Å
26	W	82.5	Confident	78.5	Confident	3 Å²	3	83.9 Å²	83.9	1%	0.011	44%	0.436	C	S	.	.	H	α-helix	trans	-75.1	-23	179.2	-62.5	111.8	0	0	0	113.8	D22 N28 Y29 R265 L267 V277 H287 F289 I307	D22-W26 PolarHBondContact O-N 2.89Å; W26-N28 VanDerWaalsContact C-N 3.31Å; W26-Y29 HydrophobicContact CD2-CE2 4.38Å; W26-Y29 HydrophobicContact CE3-CD2 4.31Å; W26-Y29 AromaticContact CE3-CE2 3.42Å; W26-Y29 HydrophobicContact CE3-CE2 3.42Å; W26-Y29 VanDerWaalsContact CE3-CE2 3.42Å; W26-Y29 AromaticContact CE3-CZ 3.89Å; W26-Y29 AromaticContact CZ3-CE2 3.89Å; W26-Y29 HydrophobicContact CZ3-CE2 3.89Å; W26-Y29 AromaticContact CZ3-CZ 3.86Å; W26-Y29 WeakPolarHBondContact CZ3-OH 3.45Å; W26-Y29 VanDerWaalsContact O-CD2 3.26Å; W26-Y29 WeakPolarHBondContact O-CD2 3.17Å; W26-R265 HydrophobicContact CZ2-CB 4.38Å; W26-R265 HydrophobicContact CZ2-CG 4.31Å; W26-L267 HydrophobicContact CH2-CD2 4.48Å; W26-V277 HydrophobicContact CD2-CG2 4.3Å; W26-V277 HydrophobicContact CZ2-CG1 3.79Å; W26-H287 HydrophobicContact CB-CB 4.06Å; W26-H287 WeakPolarHBondContact CB-CD2 3.37Å; W26-H287 HydrophobicContact CG-CB 4.14Å; W26-F289 HydrophobicContact CB-CE1 4.43Å; W26-F289 HydrophobicContact CB-CZ 3.84Å; W26-F289 HydrophobicContact CD2-CE2 4.45Å; W26-F289 HydrophobicContact CD2-CZ 4.24Å; W26-F289 HydrophobicContact CE3-CE2 4.01Å; W26-F289 AromaticContact CE3-CZ 3.75Å; W26-F289 HydrophobicContact CE3-CZ 3.75Å; W26-F289 HydrophobicContact CG-CZ 4.32Å; W26-I307 HydrophobicContact CE3-CD1 4.13Å; W26-I307 HydrophobicContact CZ3-CD1 3.92Å
27	K	82.3	Confident	79.7	Confident	127 Å²	127	81.6 Å²	81.6	55%	0.552	41%	0.409	S	S	*	.	H	α-helix	trans	-74.1	-19.9	169.5	-79.6	177	179.2	179.5	0	113.3	T23 L24 Y25 Y29	T23-K27 VanDerWaalsContact O-CB 3.25Å; T23-K27 WeakPolarHBondContact O-CB 3.24Å; T23-K27 WeakPolarHBondContact O-CG 3.42Å; T23-K27 PolarHBondContact O-N 3.19Å; L24-K27 PolarHBondContact O-N 3.04Å; Y25-K27 PolarHBondContact O-N 3.2Å; K27-Y29 PolarHBondContact O-N 3.05Å
28	N	84.4	Confident	80.4	Confident	78 Å²	78	80.7 Å²	80.7	42%	0.417	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	10.2	-179.3	-77.8	-20.1	0	0	0	114.3	L24 Y25 W26 K322	L24-N28 PolarHBondContact O-N 3.19Å; L24-N28 PolarHBondContact O-ND2 3.04Å; Y25-N28 WeakPolarHBondContact O-CB 3.18Å; Y25-N28 PolarHBondContact O-N 3.39Å; W26-N28 VanDerWaalsContact C-N 3.31Å; N28-K322 WeakPolarHBondContact O-CB 3.28Å; N28-K322 PolarHBondContact O-N 2.7Å
29	Y	82.4	Confident	81.3	Confident	21 Å²	21	72.3 Å²	72.3	8%	0.082	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-73.6	141	170.9	-76.5	-100.2	0	0	0	111.6	W26 K27 D304 I307 K319 H320 R321	W26-Y29 HydrophobicContact CD2-CE2 4.38Å; W26-Y29 HydrophobicContact CE3-CD2 4.31Å; W26-Y29 AromaticContact CE3-CE2 3.42Å; W26-Y29 HydrophobicContact CE3-CE2 3.42Å; W26-Y29 VanDerWaalsContact CE3-CE2 3.42Å; W26-Y29 AromaticContact CE3-CZ 3.89Å; W26-Y29 AromaticContact CZ3-CE2 3.89Å; W26-Y29 HydrophobicContact CZ3-CE2 3.89Å; W26-Y29 AromaticContact CZ3-CZ 3.86Å; W26-Y29 WeakPolarHBondContact CZ3-OH 3.45Å; W26-Y29 VanDerWaalsContact O-CD2 3.26Å; W26-Y29 WeakPolarHBondContact O-CD2 3.17Å; K27-Y29 PolarHBondContact O-N 3.05Å; Y29-D304 PolarHBondContact OH-O 2.82Å; Y29-I307 HydrophobicContact CD1-CD1 4.03Å; Y29-I307 HydrophobicContact CD1-CG1 4.4Å; Y29-I307 HydrophobicContact CE1-CD1 3.62Å; Y29-I307 HydrophobicContact CE1-CG1 3.74Å; Y29-I307 HydrophobicContact CE2-CD1 4.2Å; Y29-I307 HydrophobicContact CG-CD1 4.49Å; Y29-K319 HydrophobicContact CD1-CB 3.92Å; Y29-H320 CarbonylContact C-O 3.57Å; Y29-H320 WeakPolarHBondContact CA-O 3.36Å; Y29-R321 HydrophobicContact CD1-CB 4.17Å; Y29-R321 HydrophobicContact CE1-CB 3.83Å; Y29-R321 HydrophobicContact CE1-CG 4.49Å; Y29-R321 HydrophobicContact CE2-CB 4.47Å; Y29-R321 HydrophobicContact CE2-CG 4.26Å
30	K	80.7	Confident	82.1	Confident	76 Å²	76	70.5 Å²	70.5	33%	0.33	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-61.7	161.3	172.1	-66.2	-179.8	-178.2	168.8	0	109.3	H320 K322 E326	K30-H320 WeakPolarHBondContact CB-O 3.36Å; K30-H320 HydrophobicContact CD-CB 4.29Å; K30-H320 PolarHBondContact N-O 3.44Å; K30-K322 HydrophobicContact CD-CG 4.15Å; K30-K322 HydrophobicContact CG-CD 4.15Å; K30-K322 HydrophobicContact CG-CG 3.35Å; K30-E326 IonicContact NZ-OE2 3.88Å; K30-E326 PolarHBondContact NZ-OE2 2.75Å
31	A	79.3	Confident	82.7	Confident	84 Å²	84	67.3 Å²	67.3	69%	0.694	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-54.7	140	173.5	0	0	0	0	0	109.8	V33	A31-V33 PolarHBondContact O-N 3.02Å
32	P	83.1	Confident	83.1	Confident	56 Å²	56	60.9 Å²	60.9	36%	0.364	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-63.8	129.8	-177.6	25	-32.4	0	0	0	110.5	S317 I318 K319	P32-S317 WeakPolarHBondContact CB-OG 3.2Å; P32-I318 CarbonylContact C-O 3.53Å; P32-I318 WeakPolarHBondContact CA-O 3.32Å; P32-K319 HydrophobicContact CB-CG 3.87Å
33	V	84.6	Confident	83.8	Confident	40 Å²	40	60.2 Å²	60.2	24%	0.242	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	124.5	167.1	-179.6	0	0	0	0	107.4	A31 I35 Q70 S317 I318	A31-V33 PolarHBondContact O-N 3.02Å; V33-I35 HydrophobicContact CG1-CG1 4.35Å; V33-Q70 HydrophobicContact CG1-CG 4.04Å; V33-S317 WeakPolarHBondContact O-CA 3.35Å; V33-I318 HydrophobicContact CB-CB 4.47Å; V33-I318 PolarHBondContact N-O 3.31Å; V33-I318 PolarHBondContact O-N 2.99Å
34	Q	88.3	Confident	84.3	Confident	124 Å²	124	59.6 Å²	59.6	58%	0.579	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.9	-179.7	-65.4	-179	7.4	0	0	109.6	I315 L316	Q34-I315 HydrophobicContact CB-CG2 3.94Å; Q34-I315 HydrophobicContact CG-CG2 4.26Å; Q34-L316 CarbonylContact C-O 3.52Å; Q34-L316 WeakPolarHBondContact CA-O 3.29Å
35	I	87.6	Confident	84.7	Confident	20 Å²	20	56.5 Å²	56.5	10%	0.103	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.5	176.4	-57.3	173.7	0	0	0	107.4	V33 Y65 Q70 I315 L316 I318	V33-I35 HydrophobicContact CG1-CG1 4.35Å; I35-Y65 HydrophobicContact CD1-CD1 4.45Å; I35-Y65 HydrophobicContact CD1-CE1 4.07Å; I35-Q70 HydrophobicContact CD1-CB 4.48Å; I35-I315 CarbonylContact O-C 3.57Å; I35-I315 WeakPolarHBondContact O-CA 3.42Å; I35-L316 HydrophobicContact CB-CB 4.35Å; I35-L316 PolarHBondContact N-O 3.24Å; I35-L316 PolarHBondContact O-N 3.35Å; I35-I318 HydrophobicContact CD1-CD1 3.59Å
36	K	86.9	Confident	85	Confident	179 Å²	179	54.2 Å²	54.2	78%	0.778	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	117.4	177.3	-173.3	177.5	179.7	-179.1	0	109.5
37	E	85	Confident	85.1	Confident	13 Å²	13	54.4 Å²	54.4	6%	0.061	28%	0.282	C	S	.	.			trans	-92.4	167.6	174.5	-65.3	-61.3	164.4	0	0	111.8	G39 V41 A58 H63 Y65 S314 L316	E37-G39 VanDerWaalsContact C-N 3.3Å; E37-G39 PolarHBondContact O-N 2.91Å; E37-V41 HydrophobicContact CG-CG2 4.29Å; E37-A58 HydrophobicContact CB-CB 4.17Å; E37-H63 IonicContact OE2-CD2 3Å; E37-H63 PolarHBondContact OE2-CD2 3.4Å; E37-H63 IonicContact OE2-CG 3.47Å; E37-H63 IonicContact OE2-NE2 2.86Å; E37-H63 PolarHBondContact OE2-NE2 3.11Å; E37-Y65 VanDerWaalsContact OE1-CE2 3.23Å; E37-Y65 WeakPolarHBondContact OE1-CE2 3.47Å; E37-Y65 PolarHBondContact OE1-OH 2.98Å; E37-S314 WeakPolarHBondContact CA-O 3.49Å; E37-S314 WeakPolarHBondContact CB-O 3.39Å; E37-S314 PolarHBondContact N-O 3.21Å; E37-S314 WeakPolarHBondContact O-CB 3.47Å; E37-L316 HydrophobicContact CG-CB 4.41Å
38	Y	77.2	Confident	85	Confident	161 Å²	161	51.3 Å²	51.3	63%	0.631	28%	0.275	S	S	*	.	S	Bend	trans	-71.2	-23.4	-179	-171	-96.8	0	0	0	113.5
39	G	81.7	Confident	85	Confident	9 Å²	9	50.8 Å²	50.8	9%	0.093	28%	0.275	C	S	.	.	S	Bend	trans	-158.8	-177.6	-178.8	0	0	0	0	0	112.9	E37 V41 S314	E37-G39 VanDerWaalsContact C-N 3.3Å; E37-G39 PolarHBondContact O-N 2.91Å; G39-V41 PolarHBondContact O-N 3.42Å; G39-S314 VanDerWaalsContact C-CB 3.47Å; G39-S314 WeakPolarHBondContact CA-OG 3.42Å; G39-S314 WeakPolarHBondContact O-CA 3.3Å; G39-S314 VanDerWaalsContact O-CB 3.25Å; G39-S314 WeakPolarHBondContact O-CB 3.38Å; G39-S314 PolarHBondContact O-OG 3.28Å
40	A	83.9	Confident	84.8	Confident	43 Å²	43	53.3 Å²	53.3	36%	0.355	30%	0.3	S	S	.	.			trans	-58.9	136.4	177.7	0	0	0	0	0	111	S42 F59 L296	A40-S42 PolarHBondContact O-N 2.86Å; A40-F59 PolarHBondContact O-N 2.96Å; A40-L296 HydrophobicContact CB-CD2 4.33Å
41	V	87.8	Confident	84.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	100	-176.2	-176.8	0	0	0	0	109.6	E37 G39 I44 V56 T57 L296 S297 L316	E37-V41 HydrophobicContact CG-CG2 4.29Å; G39-V41 PolarHBondContact O-N 3.42Å; V41-I44 HydrophobicContact CG1-CD1 3.87Å; V41-I44 HydrophobicContact CG1-CG1 3.57Å; V41-V56 HydrophobicContact CB-CG1 4.46Å; V41-V56 HydrophobicContact CG1-CG1 3.48Å; V41-V56 VanDerWaalsContact CG1-CG1 3.48Å; V41-V56 HydrophobicContact CG2-CG1 4.15Å; V41-T57 CarbonylContact C-O 3.58Å; V41-T57 WeakPolarHBondContact CA-O 3.37Å; V41-L296 VanDerWaalsContact O-CD2 3.29Å; V41-L296 WeakPolarHBondContact O-CD2 3.41Å; V41-L296 WeakPolarHBondContact O-CG 3.29Å; V41-S297 WeakPolarHBondContact CG1-OG 3.45Å; V41-S297 PolarHBondContact O-OG 2.99Å; V41-L316 HydrophobicContact CG1-CD1 4.4Å; V41-L316 HydrophobicContact CG2-CD1 4.47Å
42	S	86.2	Confident	84.7	Confident	34 Å²	34	50.6 Å²	50.6	24%	0.238	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-45	-173.7	48	0	0	0	0	112.5	A40 T57 A83 Y84	A40-S42 PolarHBondContact O-N 2.86Å; S42-T57 PolarHBondContact N-O 3.43Å; S42-T57 VanDerWaalsContact OG-CG2 3.27Å; S42-T57 WeakPolarHBondContact OG-CG2 3.39Å; S42-T57 PolarHBondContact OG-O 3.25Å; S42-A83 PolarHBondContact OG-O 2.85Å; S42-Y84 WeakPolarHBondContact CB-O 3.16Å; S42-Y84 PolarHBondContact OG-O 3.19Å
43	N	89.8	Confident	84.9	Confident	26 Å²	26	49.8 Å²	49.8	14%	0.139	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	150.9	178.2	-167.3	20.2	0	0	0	111.5	T57 Y84 C85	N43-T57 PolarHBondContact O-N 2.94Å; N43-Y84 WeakPolarHBondContact CB-O 3.27Å; N43-C85 HydrophobicContact CB-CB 4.42Å
44	I	91.6	Very high	85.1	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	132.7	174.9	-56.6	156.9	0	0	0	107.8	V41 F54 A55 V56 S297 A299 V308 G310 L316	V41-I44 HydrophobicContact CG1-CD1 3.87Å; V41-I44 HydrophobicContact CG1-CG1 3.57Å; I44-F54 HydrophobicContact CG2-CD2 4.34Å; I44-A55 VanDerWaalsContact CA-O 3.3Å; I44-A55 WeakPolarHBondContact CA-O 3.43Å; I44-V56 HydrophobicContact CG1-CG1 4.44Å; I44-V56 HydrophobicContact CG1-CG2 4.44Å; I44-V56 HydrophobicContact CG2-CG2 4.34Å; I44-S297 WeakPolarHBondContact CD1-OG 3.34Å; I44-A299 HydrophobicContact CB-CB 3.8Å; I44-A299 HydrophobicContact CG2-CB 3.52Å; I44-A299 WeakPolarHBondContact O-CB 3.23Å; I44-V308 HydrophobicContact CD1-CG1 3.94Å; I44-V308 HydrophobicContact CG2-CB 4.29Å; I44-V308 HydrophobicContact CG2-CG1 4.04Å; I44-G310 VanDerWaalsContact CD1-N 3.34Å; I44-L316 HydrophobicContact CD1-CD1 3.75Å; I44-L316 HydrophobicContact CG1-CD1 4.34Å
45	D	89.9	Confident	85.2	Confident	24 Å²	24	42 Å²	42	13%	0.128	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	140.9	178.6	-164.2	55.5	0	0	0	111.3	F54 A55 G86 R87 F88	D45-F54 CarbonylContact O-C 3.59Å; D45-F54 VanDerWaalsContact O-CA 3.27Å; D45-F54 WeakPolarHBondContact O-CA 3.31Å; D45-A55 PolarHBondContact N-O 2.9Å; D45-A55 PolarHBondContact O-N 2.99Å; D45-G86 WeakPolarHBondContact CB-O 3.44Å; D45-R87 WeakPolarHBondContact OD1-CD 3.49Å; D45-R87 IonicContact OD1-CZ 3.74Å; D45-R87 IonicContact OD1-NH1 3.32Å; D45-R87 PolarHBondContact OD1-NH1 3.33Å; D45-R87 WeakPolarHBondContact OD2-CA 3.46Å; D45-R87 WeakPolarHBondContact OD2-CD 3.36Å; D45-F88 PolarHBondContact OD2-N 3Å
46	F	89.6	Confident	85.3	Confident	17 Å²	17	41 Å²	41	8%	0.075	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.7	178.7	-84.6	-86.3	0	0	0	111.1	F54 A299 L300 A301 S306 V308	F46-F54 HydrophobicContact CD1-CB 3.59Å; F46-F54 HydrophobicContact CD1-CD1 4.5Å; F46-F54 HydrophobicContact CD1-CG 4.42Å; F46-F54 HydrophobicContact CD2-CB 4.41Å; F46-F54 HydrophobicContact CE1-CB 3.62Å; F46-F54 AromaticContact CE1-CD1 3.82Å; F46-F54 HydrophobicContact CE1-CD1 3.82Å; F46-F54 AromaticContact CE1-CG 3.97Å; F46-F54 HydrophobicContact CE1-CG 3.97Å; F46-F54 HydrophobicContact CE2-CB 4.44Å; F46-F54 HydrophobicContact CG-CB 4.01Å; F46-F54 HydrophobicContact CZ-CB 4.08Å; F46-F54 HydrophobicContact CZ-CD1 4.3Å; F46-F54 HydrophobicContact CZ-CG 4.25Å; F46-A299 HydrophobicContact CD2-CB 3.61Å; F46-A299 HydrophobicContact CE2-CB 3.62Å; F46-L300 VanDerWaalsContact CD2-O 3.3Å; F46-L300 WeakPolarHBondContact CD2-O 3.48Å; F46-L300 VanDerWaalsContact CE2-C 3.46Å; F46-A301 HydrophobicContact CD1-CB 4.1Å; F46-A301 HydrophobicContact CE1-CB 3.89Å; F46-A301 HydrophobicContact CZ-CB 4.18Å; F46-S306 WeakPolarHBondContact CE1-OG 3.45Å; F46-S306 WeakPolarHBondContact CZ-OG 3.44Å; F46-V308 HydrophobicContact CE1-CG2 4.5Å; F46-V308 HydrophobicContact CE2-CB 4.28Å; F46-V308 HydrophobicContact CE2-CG2 4.02Å; F46-V308 HydrophobicContact CZ-CB 4.25Å; F46-V308 HydrophobicContact CZ-CG2 3.49Å; F46-V308 VanDerWaalsContact CZ-CG2 3.49Å
47	S	85.8	Confident	85.4	Confident	7 Å²	7	32.5 Å²	32.5	5%	0.049	19%	0.193	C	C	.	.			trans	-65.6	129.1	164.9	176.2	0	0	0	0	109.5	V49 H52 N53	S47-V49 PolarHBondContact O-N 3.37Å; S47-V49 PolarHBondContact OG-N 3.18Å; S47-V49 PolarHBondContact OG-O 3.12Å; S47-H52 PolarHBondContact O-ND1 3.11Å; S47-N53 WeakPolarHBondContact CB-O 3.47Å; S47-N53 PolarHBondContact N-O 3.4Å
48	P	79.8	Confident	85.6	Confident	62 Å²	62	31.9 Å²	31.9	40%	0.403	19%	0.19	S	C	.	.	S	Bend	trans	-73.2	-10	175.8	28.8	-32.7	0	0	0	113	H52 S90	P48-H52 PolarHBondContact O-CE1 3.06Å; P48-H52 VanDerWaalsContact O-CE1 3.31Å; P48-S90 WeakPolarHBondContact CG-O 3.4Å
49	V	84.4	Confident	86	Confident	67 Å²	67	29.2 Å²	29.2	41%	0.406	18%	0.182	S	C	.	.	S	Bend	trans	-99.3	132.6	178.2	-176	0	0	0	0	110.2	S47 H52 S90	S47-V49 PolarHBondContact O-N 3.37Å; S47-V49 PolarHBondContact OG-N 3.18Å; S47-V49 PolarHBondContact OG-O 3.12Å; V49-H52 PolarHBondContact O-N 2.93Å; V49-S90 WeakPolarHBondContact CG2-O 3.38Å
50	A	77.9	Confident	86.3	Confident	73 Å²	73	30.1 Å²	30.1	60%	0.603	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	131	171.3	0	0	0	0	0	109.8	H52	A50-H52 VanDerWaalsContact CA-N 3.35Å
51	P	76.8	Confident	86.5	Confident	81 Å²	81	32.4 Å²	32.4	53%	0.526	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.9	23.6	21.3	34.6	-37.8	0	0	0	116.7	N53 P67	P51-N53 VanDerWaalsContact C-N 3.29Å; P51-N53 PolarHBondContact O-N 3.01Å; P51-P67 HydrophobicContact CB-CG 4.4Å; P51-P67 VanDerWaalsContact O-CD 3.26Å; P51-P67 WeakPolarHBondContact O-CD 3.23Å; P51-P67 WeakPolarHBondContact O-CG 3.43Å
52	H	82.1	Confident	86.7	Confident	22 Å²	22	32.4 Å²	32.4	10%	0.102	19%	0.186	C	C	.	.			trans	52.4	45.5	177.5	-60	-54.9	0	0	0	113.3	S47 P48 V49 A50 F54 D303	S47-H52 PolarHBondContact O-ND1 3.11Å; P48-H52 PolarHBondContact O-CE1 3.06Å; P48-H52 VanDerWaalsContact O-CE1 3.31Å; V49-H52 PolarHBondContact O-N 2.93Å; A50-H52 VanDerWaalsContact CA-N 3.35Å; H52-F54 PolarHBondContact O-N 3.5Å; H52-D303 IonicContact NE2-OD2 3.49Å
53	N	86.8	Confident	86.9	Confident	40 Å²	40	31.4 Å²	31.4	21%	0.214	18%	0.177	C	C	.	.			trans	-57.2	141.1	169.7	-65.5	-18.8	0	0	0	109.2	S47 P51 V64 Y65 F88	S47-N53 WeakPolarHBondContact CB-O 3.47Å; S47-N53 PolarHBondContact N-O 3.4Å; P51-N53 VanDerWaalsContact C-N 3.29Å; P51-N53 PolarHBondContact O-N 3.01Å; N53-V64 HydrophobicContact CB-CG1 4.07Å; N53-Y65 CarbonylContact C-O 3.56Å; N53-Y65 VanDerWaalsContact CA-O 3.23Å; N53-Y65 WeakPolarHBondContact CA-O 3.49Å; N53-Y65 WeakPolarHBondContact CB-O 3.44Å; N53-F88 WeakPolarHBondContact O-CE2 3.45Å
54	F	89	Confident	87	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.3	179.3	63.5	-87.5	0	0	0	110.8	I44 D45 F46 H52 V56 V64 Y65 G66 V308 L316 I318	I44-F54 HydrophobicContact CG2-CD2 4.34Å; D45-F54 CarbonylContact O-C 3.59Å; D45-F54 VanDerWaalsContact O-CA 3.27Å; D45-F54 WeakPolarHBondContact O-CA 3.31Å; F46-F54 HydrophobicContact CD1-CB 3.59Å; F46-F54 HydrophobicContact CD1-CD1 4.5Å; F46-F54 HydrophobicContact CD1-CG 4.42Å; F46-F54 HydrophobicContact CD2-CB 4.41Å; F46-F54 HydrophobicContact CE1-CB 3.62Å; F46-F54 AromaticContact CE1-CD1 3.82Å; F46-F54 HydrophobicContact CE1-CD1 3.82Å; F46-F54 AromaticContact CE1-CG 3.97Å; F46-F54 HydrophobicContact CE1-CG 3.97Å; F46-F54 HydrophobicContact CE2-CB 4.44Å; F46-F54 HydrophobicContact CG-CB 4.01Å; F46-F54 HydrophobicContact CZ-CB 4.08Å; F46-F54 HydrophobicContact CZ-CD1 4.3Å; F46-F54 HydrophobicContact CZ-CG 4.25Å; H52-F54 PolarHBondContact O-N 3.5Å; F54-V56 HydrophobicContact CD2-CG2 3.48Å; F54-V56 VanDerWaalsContact CD2-CG2 3.48Å; F54-V56 HydrophobicContact CE2-CG2 3.49Å; F54-V56 VanDerWaalsContact CE2-CG2 3.49Å; F54-V64 WeakPolarHBondContact O-CA 3.47Å; F54-Y65 HydrophobicContact CD2-CD2 4.33Å; F54-Y65 VanDerWaalsContact CE1-CB 3.47Å; F54-Y65 HydrophobicContact CE1-CG 4.47Å; F54-Y65 AromaticContact CE2-CD2 3.61Å; F54-Y65 HydrophobicContact CE2-CD2 3.61Å; F54-Y65 AromaticContact CE2-CG 3.72Å; F54-Y65 HydrophobicContact CE2-CG 3.72Å; F54-Y65 HydrophobicContact CZ-CD1 4.5Å; F54-Y65 HydrophobicContact CZ-CD2 4.06Å; F54-Y65 AromaticContact CZ-CG 3.67Å; F54-Y65 HydrophobicContact CZ-CG 3.67Å; F54-Y65 PolarHBondContact N-O 3.31Å; F54-Y65 PolarHBondContact O-N 3.33Å; F54-G66 WeakPolarHBondContact CE1-O 3.42Å; F54-V308 HydrophobicContact CD2-CG1 4.34Å; F54-V308 HydrophobicContact CD2-CG2 4.35Å; F54-V308 HydrophobicContact CE1-CG2 4.42Å; F54-V308 HydrophobicContact CE2-CG1 4.1Å; F54-V308 HydrophobicContact CE2-CG2 4.26Å; F54-V308 HydrophobicContact CG-CG2 4.5Å; F54-V308 HydrophobicContact CZ-CG2 4.29Å; F54-L316 HydrophobicContact CE2-CD2 3.94Å; F54-I318 HydrophobicContact CE1-CD1 4.41Å; F54-I318 HydrophobicContact CE2-CD1 4.37Å; F54-I318 HydrophobicContact CZ-CD1 3.59Å; F54-I318 HydrophobicContact CZ-CG1 4.36Å
55	A	88.9	Confident	86.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127	179.1	0	0	0	0	0	107.5	I44 D45 I62 H63 F88 L95	I44-A55 VanDerWaalsContact CA-O 3.3Å; I44-A55 WeakPolarHBondContact CA-O 3.43Å; D45-A55 PolarHBondContact N-O 2.9Å; D45-A55 PolarHBondContact O-N 2.99Å; A55-I62 HydrophobicContact CB-CG2 4.31Å; A55-H63 CarbonylContact C-O 3.56Å; A55-H63 WeakPolarHBondContact CA-O 3.35Å; A55-F88 HydrophobicContact CB-CD2 4.17Å; A55-F88 HydrophobicContact CB-CE2 3.42Å; A55-F88 VanDerWaalsContact CB-CE2 3.42Å; A55-F88 HydrophobicContact CB-CZ 3.72Å; A55-F88 VanDerWaalsContact N-CE2 3.35Å; A55-L95 HydrophobicContact CB-CD1 3.57Å
56	V	90.5	Very high	86.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115	177.9	-178.7	0	0	0	0	106.6	V41 I44 F54 I62 H63 Y65 L316	V41-V56 HydrophobicContact CB-CG1 4.46Å; V41-V56 HydrophobicContact CG1-CG1 3.48Å; V41-V56 VanDerWaalsContact CG1-CG1 3.48Å; V41-V56 HydrophobicContact CG2-CG1 4.15Å; I44-V56 HydrophobicContact CG1-CG1 4.44Å; I44-V56 HydrophobicContact CG1-CG2 4.44Å; I44-V56 HydrophobicContact CG2-CG2 4.34Å; F54-V56 HydrophobicContact CD2-CG2 3.48Å; F54-V56 VanDerWaalsContact CD2-CG2 3.48Å; F54-V56 HydrophobicContact CE2-CG2 3.49Å; F54-V56 VanDerWaalsContact CE2-CG2 3.49Å; V56-I62 WeakPolarHBondContact O-CA 3.42Å; V56-H63 PolarHBondContact N-O 3.1Å; V56-H63 PolarHBondContact O-N 3.41Å; V56-Y65 HydrophobicContact CB-CD2 4.25Å; V56-Y65 HydrophobicContact CB-CE2 4.21Å; V56-Y65 HydrophobicContact CG2-CD2 3.71Å; V56-Y65 HydrophobicContact CG2-CE2 4.03Å; V56-L316 HydrophobicContact CG1-CD1 4.06Å; V56-L316 HydrophobicContact CG1-CD2 4.42Å; V56-L316 HydrophobicContact CG2-CD1 4.19Å; V56-L316 HydrophobicContact CG2-CD2 3.83Å
57	T	89.9	Confident	86.2	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	118	174	-57.7	0	0	0	0	108.4	V41 S42 N43 I62 A83 G86	V41-T57 CarbonylContact C-O 3.58Å; V41-T57 WeakPolarHBondContact CA-O 3.37Å; S42-T57 PolarHBondContact N-O 3.43Å; S42-T57 VanDerWaalsContact OG-CG2 3.27Å; S42-T57 WeakPolarHBondContact OG-CG2 3.39Å; S42-T57 PolarHBondContact OG-O 3.25Å; N43-T57 PolarHBondContact O-N 2.94Å; T57-I62 HydrophobicContact CG2-CD1 4.48Å; T57-I62 HydrophobicContact CG2-CG1 3.96Å; T57-A83 HydrophobicContact CG2-CB 3.57Å; T57-A83 WeakPolarHBondContact CG2-O 3.47Å; T57-G86 PolarHBondContact OG1-N 3.05Å; T57-G86 VanDerWaalsContact OG1-N 3.14Å
58	A	87.4	Confident	85.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	105.4	-179	0	0	0	0	0	109.6	E37 S60 R61	E37-A58 HydrophobicContact CB-CB 4.17Å; A58-S60 PolarHBondContact O-N 3.24Å; A58-R61 CarbonylContact C-O 3.56Å; A58-R61 PolarHBondContact N-O 3.47Å; A58-R61 PolarHBondContact O-N 3.19Å; A58-R61 VanDerWaalsContact O-O 3.13Å
59	F	86.4	Confident	85.8	Confident	105 Å²	105	34.9 Å²	34.9	46%	0.461	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	-103.6	-180	-168.7	-109.8	0	0	0	112.9	A40 T82 A83	A40-F59 PolarHBondContact O-N 2.96Å; F59-T82 HydrophobicContact CD2-CG2 3.45Å; F59-T82 VanDerWaalsContact CD2-CG2 3.45Å; F59-T82 HydrophobicContact CE1-CG2 4.37Å; F59-T82 HydrophobicContact CE2-CG2 3.18Å; F59-T82 HydrophobicContact CG-CG2 4.18Å; F59-T82 HydrophobicContact CZ-CG2 3.68Å; F59-T82 CarbonylContact O-C 3.56Å; F59-T82 WeakPolarHBondContact O-CA 3.41Å; F59-A83 PolarHBondContact O-N 2.98Å
60	S	87.5	Confident	85.6	Confident	27 Å²	27	37.7 Å²	37.7	19%	0.189	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	11.6	-177.8	61.9	0	0	0	0	114.3	A58 F79	A58-S60 PolarHBondContact O-N 3.24Å; S60-F79 WeakPolarHBondContact O-CD2 3.4Å
61	R	89.6	Confident	85.9	Confident	91 Å²	91	41.4 Å²	41.4	34%	0.343	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.8	-177	-60	-176.9	-179.4	178.2	1.8	111.7	A58 T75 F76 T77	A58-R61 CarbonylContact C-O 3.56Å; A58-R61 PolarHBondContact N-O 3.47Å; A58-R61 PolarHBondContact O-N 3.19Å; A58-R61 VanDerWaalsContact O-O 3.13Å; R61-T75 HydrophobicContact CB-CG2 4.39Å; R61-F76 VanDerWaalsContact CA-O 3.29Å; R61-F76 WeakPolarHBondContact CA-O 3.27Å; R61-T77 HydrophobicContact CG-CG2 4.07Å
62	I	90.4	Very high	86.2	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.5	169.2	-58.9	178.3	0	0	0	107.9	A55 V56 T57 T75 F76 F79 A83 L95 A97	A55-I62 HydrophobicContact CB-CG2 4.31Å; V56-I62 WeakPolarHBondContact O-CA 3.42Å; T57-I62 HydrophobicContact CG2-CD1 4.48Å; T57-I62 HydrophobicContact CG2-CG1 3.96Å; I62-T75 CarbonylContact O-C 3.58Å; I62-T75 WeakPolarHBondContact O-CA 3.48Å; I62-F76 HydrophobicContact CB-CB 4.28Å; I62-F76 HydrophobicContact CB-CD2 4.09Å; I62-F76 HydrophobicContact CG2-CD2 4.19Å; I62-F76 PolarHBondContact N-O 2.99Å; I62-F76 VanDerWaalsContact N-O 3.11Å; I62-F76 PolarHBondContact O-N 3.23Å; I62-F79 HydrophobicContact CB-CE2 4.41Å; I62-F79 HydrophobicContact CD1-CE2 3.89Å; I62-F79 HydrophobicContact CD1-CZ 3.6Å; I62-F79 HydrophobicContact CG1-CE2 3.8Å; I62-F79 HydrophobicContact CG1-CZ 4.07Å; I62-A83 HydrophobicContact CG1-CB 4.45Å; I62-L95 HydrophobicContact CD1-CD2 3.93Å; I62-L95 HydrophobicContact CG2-CD1 4.13Å; I62-L95 HydrophobicContact CG2-CD2 4.3Å; I62-A97 HydrophobicContact CD1-CB 3.41Å; I62-A97 VanDerWaalsContact CD1-CB 3.41Å
63	H	91.1	Very high	86.4	Confident	13 Å²	13	43 Å²	43	6%	0.06	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.5	176.3	-68.9	-63.2	0	0	0	109.6	E37 A55 V56 Y65 P72 K74 T75	E37-H63 IonicContact OE2-CD2 3Å; E37-H63 PolarHBondContact OE2-CD2 3.4Å; E37-H63 IonicContact OE2-CG 3.47Å; E37-H63 IonicContact OE2-NE2 2.86Å; E37-H63 PolarHBondContact OE2-NE2 3.11Å; A55-H63 CarbonylContact C-O 3.56Å; A55-H63 WeakPolarHBondContact CA-O 3.35Å; V56-H63 PolarHBondContact N-O 3.1Å; V56-H63 PolarHBondContact O-N 3.41Å; H63-Y65 HydrophobicContact CB-CD2 4.12Å; H63-Y65 HydrophobicContact CB-CE2 3.56Å; H63-P72 HydrophobicContact CB-CB 4.16Å; H63-K74 CarbonylContact C-O 3.54Å; H63-K74 WeakPolarHBondContact CA-O 3.39Å; H63-T75 WeakPolarHBondContact CE1-CG2 3.3Å; H63-T75 PolarHBondContact CE1-OG1 3.12Å; H63-T75 VanDerWaalsContact CE1-OG1 3.27Å; H63-T75 WeakPolarHBondContact ND1-CG2 3.29Å; H63-T75 PolarHBondContact ND1-OG1 2.9Å
64	V	91.3	Very high	86.3	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.9	170.9	179.7	0	0	0	0	107.7	N53 F54 P72 V73 K74 F76 F88 L95	N53-V64 HydrophobicContact CB-CG1 4.07Å; F54-V64 WeakPolarHBondContact O-CA 3.47Å; V64-P72 CarbonylContact O-C 3.58Å; V64-V73 WeakPolarHBondContact O-CB 3.44Å; V64-V73 PolarHBondContact O-N 3.15Å; V64-K74 HydrophobicContact CB-CB 4.28Å; V64-K74 PolarHBondContact N-O 2.84Å; V64-K74 PolarHBondContact O-N 3.06Å; V64-F76 HydrophobicContact CG2-CE2 3.87Å; V64-F88 HydrophobicContact CG1-CZ 4.21Å; V64-F88 HydrophobicContact CG2-CZ 4.43Å; V64-L95 HydrophobicContact CG2-CD1 4.37Å
65	Y	89.8	Confident	86.3	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.02	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147	178.2	-75.2	-80.1	0	0	0	110.8	I35 E37 N53 F54 V56 H63 P72 L316	I35-Y65 HydrophobicContact CD1-CD1 4.45Å; I35-Y65 HydrophobicContact CD1-CE1 4.07Å; E37-Y65 VanDerWaalsContact OE1-CE2 3.23Å; E37-Y65 WeakPolarHBondContact OE1-CE2 3.47Å; E37-Y65 PolarHBondContact OE1-OH 2.98Å; N53-Y65 CarbonylContact C-O 3.56Å; N53-Y65 VanDerWaalsContact CA-O 3.23Å; N53-Y65 WeakPolarHBondContact CA-O 3.49Å; N53-Y65 WeakPolarHBondContact CB-O 3.44Å; F54-Y65 HydrophobicContact CD2-CD2 4.33Å; F54-Y65 VanDerWaalsContact CE1-CB 3.47Å; F54-Y65 HydrophobicContact CE1-CG 4.47Å; F54-Y65 AromaticContact CE2-CD2 3.61Å; F54-Y65 HydrophobicContact CE2-CD2 3.61Å; F54-Y65 AromaticContact CE2-CG 3.72Å; F54-Y65 HydrophobicContact CE2-CG 3.72Å; F54-Y65 HydrophobicContact CZ-CD1 4.5Å; F54-Y65 HydrophobicContact CZ-CD2 4.06Å; F54-Y65 AromaticContact CZ-CG 3.67Å; F54-Y65 HydrophobicContact CZ-CG 3.67Å; F54-Y65 PolarHBondContact N-O 3.31Å; F54-Y65 PolarHBondContact O-N 3.33Å; V56-Y65 HydrophobicContact CB-CD2 4.25Å; V56-Y65 HydrophobicContact CB-CE2 4.21Å; V56-Y65 HydrophobicContact CG2-CD2 3.71Å; V56-Y65 HydrophobicContact CG2-CE2 4.03Å; H63-Y65 HydrophobicContact CB-CD2 4.12Å; H63-Y65 HydrophobicContact CB-CE2 3.56Å; Y65-P72 HydrophobicContact CD1-CB 4.29Å; Y65-P72 HydrophobicContact CE1-CB 3.77Å; Y65-P72 HydrophobicContact CE1-CG 4.3Å; Y65-P72 VanDerWaalsContact CE1-N 3.33Å; Y65-P72 HydrophobicContact CE2-CB 4.43Å; Y65-L316 HydrophobicContact CD2-CD2 4.47Å; Y65-L316 HydrophobicContact CE2-CD2 4.28Å
66	G	84.8	Confident	86.2	Confident	6 Å²	6	46 Å²	46	6%	0.062	23%	0.231	C	C	.	.			trans	-77.4	160.7	164.4	0	0	0	0	0	110.4	F54 F68 S69	F54-G66 WeakPolarHBondContact CE1-O 3.42Å; G66-F68 VanDerWaalsContact C-N 3.28Å; G66-F68 PolarHBondContact O-N 3.13Å; G66-S69 PolarHBondContact O-N 3.17Å
67	P	79.5	Confident	85.9	Confident	20 Å²	20	49.3 Å²	49.3	13%	0.13	25%	0.251	C	S	.	.	S	Bend	trans	-57.4	-40.6	-176.6	24.3	-36.2	0	0	0	112.2	P51 H320	P51-P67 HydrophobicContact CB-CG 4.4Å; P51-P67 VanDerWaalsContact O-CD 3.26Å; P51-P67 WeakPolarHBondContact O-CD 3.23Å; P51-P67 WeakPolarHBondContact O-CG 3.43Å; P67-H320 PolarHBondContact O-CE1 2.96Å; P67-H320 PolarHBondContact O-NE2 3.46Å
68	F	79.1	Confident	85.3	Confident	131 Å²	131	58.2 Å²	58.2	58%	0.575	28%	0.284	S	S	*	.	S	Bend	trans	-111.6	-5.9	-178.7	-54.6	-74.6	0	0	0	114.1	G66 E305	G66-F68 VanDerWaalsContact C-N 3.28Å; G66-F68 PolarHBondContact O-N 3.13Å; F68-E305 WeakPolarHBondContact CZ-OE1 3.37Å
69	S	79.6	Confident	85	Confident	50 Å²	50	59 Å²	59	35%	0.35	29%	0.288	S	S	.	.			trans	-81	127	-177	-176.6	0	0	0	0	109.9	G66 E71	G66-S69 PolarHBondContact O-N 3.17Å; S69-E71 VanDerWaalsContact C-N 3.3Å; S69-E71 PolarHBondContact OG-N 2.95Å; S69-E71 PolarHBondContact OG-O 3.35Å
70	Q	79.1	Confident	84.7	Confident	126 Å²	126	62.9 Å²	62.9	59%	0.589	31%	0.305	S	S	*	.	S	Bend	trans	-80.4	-17.2	173.6	-61.1	-177.5	1	0	0	112.3	V33 I35	V33-Q70 HydrophobicContact CG1-CG 4.04Å; I35-Q70 HydrophobicContact CD1-CB 4.48Å
71	E	83.5	Confident	84.5	Confident	151 Å²	151	64.9 Å²	64.9	71%	0.706	31%	0.313	S	S	*	.	S	Bend	trans	-93.9	138.6	175.8	-63.4	-177.7	178.2	0	0	109.8	S69 V73	S69-E71 VanDerWaalsContact C-N 3.3Å; S69-E71 PolarHBondContact OG-N 2.95Å; S69-E71 PolarHBondContact OG-O 3.35Å; E71-V73 PolarHBondContact O-N 3.43Å
72	P	84.6	Confident	84.4	Confident	51 Å²	51	61.4 Å²	61.4	33%	0.331	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	121.6	175.7	27.1	-32.3	0	0	0	108.6	H63 V64 Y65 K74	H63-P72 HydrophobicContact CB-CB 4.16Å; V64-P72 CarbonylContact O-C 3.58Å; Y65-P72 HydrophobicContact CD1-CB 4.29Å; Y65-P72 HydrophobicContact CE1-CB 3.77Å; Y65-P72 HydrophobicContact CE1-CG 4.3Å; Y65-P72 VanDerWaalsContact CE1-N 3.33Å; Y65-P72 HydrophobicContact CE2-CB 4.43Å; P72-K74 PolarHBondContact O-N 3.17Å
73	V	85.9	Confident	84.3	Confident	85 Å²	85	61.5 Å²	61.5	52%	0.515	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	-40	176.2	-176.1	0	0	0	0	109.3	V64 E71	V64-V73 WeakPolarHBondContact O-CB 3.44Å; V64-V73 PolarHBondContact O-N 3.15Å; E71-V73 PolarHBondContact O-N 3.43Å
74	K	85.1	Confident	84.2	Confident	72 Å²	72	64.1 Å²	64.1	31%	0.313	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.6	178.5	-63.1	-171.5	179.8	-173.9	0	112.1	H63 V64 P72 V109 S110	H63-K74 CarbonylContact C-O 3.54Å; H63-K74 WeakPolarHBondContact CA-O 3.39Å; V64-K74 HydrophobicContact CB-CB 4.28Å; V64-K74 PolarHBondContact N-O 2.84Å; V64-K74 PolarHBondContact O-N 3.06Å; P72-K74 PolarHBondContact O-N 3.17Å; K74-V109 WeakPolarHBondContact CD-O 3.34Å; K74-V109 WeakPolarHBondContact CE-O 3.49Å; K74-V109 PolarHBondContact NZ-O 2.93Å; K74-S110 VanDerWaalsContact NZ-C 3.33Å; K74-S110 VanDerWaalsContact NZ-CA 3.32Å; K74-S110 PolarHBondContact NZ-O 3.46Å
75	T	89	Confident	83.9	Confident	29 Å²	29	64.2 Å²	64.2	18%	0.178	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	126.1	176.2	-56.6	0	0	0	0	109.7	R61 I62 H63 T77	R61-T75 HydrophobicContact CB-CG2 4.39Å; I62-T75 CarbonylContact O-C 3.58Å; I62-T75 WeakPolarHBondContact O-CA 3.48Å; H63-T75 WeakPolarHBondContact CE1-CG2 3.3Å; H63-T75 PolarHBondContact CE1-OG1 3.12Å; H63-T75 VanDerWaalsContact CE1-OG1 3.27Å; H63-T75 WeakPolarHBondContact ND1-CG2 3.29Å; H63-T75 PolarHBondContact ND1-OG1 2.9Å; T75-T77 HydrophobicContact CG2-CG2 3.65Å
76	F	87.3	Confident	83.9	Confident	3 Å²	3	64 Å²	64	1%	0.013	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	118.8	171.1	-58.1	-76.2	0	0	0	109.3	R61 I62 V64 F79 F107 G111	R61-F76 VanDerWaalsContact CA-O 3.29Å; R61-F76 WeakPolarHBondContact CA-O 3.27Å; I62-F76 HydrophobicContact CB-CB 4.28Å; I62-F76 HydrophobicContact CB-CD2 4.09Å; I62-F76 HydrophobicContact CG2-CD2 4.19Å; I62-F76 PolarHBondContact N-O 2.99Å; I62-F76 VanDerWaalsContact N-O 3.11Å; I62-F76 PolarHBondContact O-N 3.23Å; V64-F76 HydrophobicContact CG2-CE2 3.87Å; F76-F79 HydrophobicContact CB-CE2 4.02Å; F76-F107 HydrophobicContact CD1-CB 4.44Å; F76-F107 AromaticContact CD1-CD1 3.71Å; F76-F107 HydrophobicContact CD1-CD1 3.71Å; F76-F107 HydrophobicContact CD1-CE1 4.15Å; F76-F107 HydrophobicContact CD1-CG 4.09Å; F76-F107 HydrophobicContact CE1-CB 3.98Å; F76-F107 AromaticContact CE1-CD1 3.95Å; F76-F107 HydrophobicContact CE1-CD1 3.95Å; F76-F107 HydrophobicContact CE1-CG 4.13Å; F76-F107 HydrophobicContact CG-CD1 4.43Å; F76-F107 HydrophobicContact CZ-CB 4.14Å; F76-G111 WeakPolarHBondContact CE1-O 3.16Å
77	T	83.9	Confident	84.2	Confident	68 Å²	68	67 Å²	67	42%	0.417	32%	0.322	S	S	.	.			trans	-119.2	7.3	-174.8	58.7	0	0	0	0	113.9	R61 T75 F79	R61-T77 HydrophobicContact CG-CG2 4.07Å; T75-T77 HydrophobicContact CG2-CG2 3.65Å; T77-F79 PolarHBondContact O-N 3.38Å
78	R	76.6	Confident	84.7	Confident	188 Å²	188	66.7 Å²	66.7	71%	0.709	32%	0.318	S	S	*	.			trans	-86.5	21.7	-169.2	-60.9	-71.8	-86.5	-158.3	-6.6	113.4
79	F	80.7	Confident	85.2	Confident	16 Å²	16	62.1 Å²	62.1	7%	0.07	30%	0.297	C	S	.	.			trans	-90.8	134.5	176.7	-54	-70.1	0	0	0	108.7	S60 I62 F76 T77 D81 A97 C99 R105 F107	S60-F79 WeakPolarHBondContact O-CD2 3.4Å; I62-F79 HydrophobicContact CB-CE2 4.41Å; I62-F79 HydrophobicContact CD1-CE2 3.89Å; I62-F79 HydrophobicContact CD1-CZ 3.6Å; I62-F79 HydrophobicContact CG1-CE2 3.8Å; I62-F79 HydrophobicContact CG1-CZ 4.07Å; F76-F79 HydrophobicContact CB-CE2 4.02Å; T77-F79 PolarHBondContact O-N 3.38Å; F79-D81 WeakPolarHBondContact CB-O 3.44Å; F79-A97 HydrophobicContact CE1-CB 3.76Å; F79-A97 HydrophobicContact CZ-CB 3.73Å; F79-C99 WeakPolarHBondContact CD1-SG 3.15Å; F79-C99 VanDerWaalsContact CE1-SG 3.52Å; F79-R105 HydrophobicContact CE1-CB 4.45Å; F79-F107 AromaticContact CE1-CE2 3.62Å; F79-F107 HydrophobicContact CE1-CE2 3.62Å; F79-F107 AromaticContact CE1-CZ 3.71Å; F79-F107 HydrophobicContact CE1-CZ 3.71Å; F79-F107 HydrophobicContact CE2-CZ 4.45Å; F79-F107 HydrophobicContact CZ-CD2 4.46Å; F79-F107 AromaticContact CZ-CE2 3.39Å; F79-F107 HydrophobicContact CZ-CE2 3.39Å; F79-F107 AromaticContact CZ-CZ 3.58Å; F79-F107 HydrophobicContact CZ-CZ 3.58Å
80	K	79.8	Confident	85.5	Confident	187 Å²	187	62 Å²	62	81%	0.813	30%	0.297	S	S	*	.	S	Bend	trans	-78.6	-34.2	176.9	-178.4	-170.9	174.7	-167.7	0	109.9	D101	K80-D101 WeakPolarHBondContact CB-OD2 3.47Å; K80-D101 PolarHBondContact N-OD2 3.46Å
81	D	84.6	Confident	85.8	Confident	68 Å²	68	58.3 Å²	58.3	36%	0.364	28%	0.281	S	S	.	.	S	Bend	trans	-128.5	-163.4	178.2	-154.3	-17	0	0	0	111.4	F79 E100 D101	F79-D81 WeakPolarHBondContact CB-O 3.44Å; D81-E100 HydrophobicContact CB-CB 4.01Å; D81-E100 WeakPolarHBondContact OD2-CG 3.1Å; D81-D101 WeakPolarHBondContact CB-OD1 3.45Å
82	T	86.3	Confident	85.8	Confident	19 Å²	19	51.8 Å²	51.8	12%	0.117	25%	0.254	C	S	.	.			trans	-67.2	144.3	-177.4	66.5	0	0	0	0	113.2	F59 C99 E100	F59-T82 HydrophobicContact CD2-CG2 3.45Å; F59-T82 VanDerWaalsContact CD2-CG2 3.45Å; F59-T82 HydrophobicContact CE1-CG2 4.37Å; F59-T82 HydrophobicContact CE2-CG2 3.18Å; F59-T82 HydrophobicContact CG-CG2 4.18Å; F59-T82 HydrophobicContact CZ-CG2 3.68Å; F59-T82 CarbonylContact O-C 3.56Å; F59-T82 WeakPolarHBondContact O-CA 3.41Å; T82-C99 CarbonylContact O-C 3.17Å; T82-C99 VanDerWaalsContact O-CA 3.29Å; T82-C99 WeakPolarHBondContact O-CA 3.3Å; T82-E100 PolarHBondContact O-N 2.88Å; T82-E100 WeakPolarHBondContact OG1-CB 3.1Å
83	A	88.6	Confident	86	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	128	170.4	0	0	0	0	0	109	S42 T57 F59 I62 G98	S42-A83 PolarHBondContact OG-O 2.85Å; T57-A83 HydrophobicContact CG2-CB 3.57Å; T57-A83 WeakPolarHBondContact CG2-O 3.47Å; F59-A83 PolarHBondContact O-N 2.98Å; I62-A83 HydrophobicContact CG1-CB 4.45Å; A83-G98 WeakPolarHBondContact CA-O 3.42Å
84	Y	88.8	Confident	86.2	Confident	69 Å²	69	51.9 Å²	51.9	27%	0.271	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-37.8	-177.7	-72.1	-71.1	0	0	0	112.7	S42 N43 G98 E100 A124 H126	S42-Y84 WeakPolarHBondContact CB-O 3.16Å; S42-Y84 PolarHBondContact OG-O 3.19Å; N43-Y84 WeakPolarHBondContact CB-O 3.27Å; Y84-G98 PolarHBondContact N-O 3.05Å; Y84-E100 HydrophobicContact CE2-CB 4Å; Y84-E100 WeakPolarHBondContact CE2-OE2 3.24Å; Y84-E100 PolarHBondContact OH-OE2 3.26Å; Y84-A124 HydrophobicContact CE2-CB 4.11Å; Y84-H126 AromaticContact CD1-CE1 3.71Å; Y84-H126 AromaticContact CD1-ND1 3.39Å; Y84-H126 WeakPolarHBondContact CD1-ND1 3.49Å; Y84-H126 AromaticContact CD2-CE1 3.77Å; Y84-H126 AromaticContact CD2-ND1 3.71Å; Y84-H126 AromaticContact CE1-CE1 3.43Å; Y84-H126 VanDerWaalsContact CE1-CE1 3.43Å; Y84-H126 WeakPolarHBondContact CE1-CE1 3.44Å; Y84-H126 AromaticContact CE1-ND1 3.62Å; Y84-H126 AromaticContact CE2-CE1 3.49Å; Y84-H126 VanDerWaalsContact CE2-CE1 3.49Å; Y84-H126 WeakPolarHBondContact CE2-CE1 3.46Å; Y84-H126 AromaticContact CE2-ND1 3.91Å; Y84-H126 AromaticContact CG-CE1 3.86Å; Y84-H126 AromaticContact CG-ND1 3.43Å; Y84-H126 AromaticContact CZ-CE1 3.3Å; Y84-H126 AromaticContact CZ-ND1 3.87Å
85	C	86.1	Confident	86.6	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.027	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145.4	-175.5	51.3	0	0	0	0	111.1	N43 A97 G98 H126 T128	N43-C85 HydrophobicContact CB-CB 4.42Å; C85-A97 VanDerWaalsContact O-CA 3.26Å; C85-A97 WeakPolarHBondContact O-CA 3.39Å; C85-G98 PolarHBondContact O-N 3.04Å; C85-H126 PolarHBondContact SG-O 3.33Å; C85-T128 PolarHBondContact SG-N 3.06Å; C85-T128 PolarHBondContact SG-OG1 3.34Å
86	G	89.2	Confident	86.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	114.5	166.2	0	0	0	0	0	107.4	D45 T57 V96	D45-G86 WeakPolarHBondContact CB-O 3.44Å; T57-G86 PolarHBondContact OG1-N 3.05Å; T57-G86 VanDerWaalsContact OG1-N 3.14Å; G86-V96 VanDerWaalsContact CA-O 3.31Å; G86-V96 WeakPolarHBondContact CA-O 3.47Å
87	R	90.2	Very high	86.9	Confident	70 Å²	70	47 Å²	47	26%	0.264	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.3	178.2	-71.2	-61	-167.7	156.6	4.6	111.1	D45 L95 V96 T128	D45-R87 WeakPolarHBondContact OD1-CD 3.49Å; D45-R87 IonicContact OD1-CZ 3.74Å; D45-R87 IonicContact OD1-NH1 3.32Å; D45-R87 PolarHBondContact OD1-NH1 3.33Å; D45-R87 WeakPolarHBondContact OD2-CA 3.46Å; D45-R87 WeakPolarHBondContact OD2-CD 3.36Å; R87-L95 CarbonylContact O-C 3.46Å; R87-L95 VanDerWaalsContact O-CA 3.3Å; R87-L95 WeakPolarHBondContact O-CA 3.49Å; R87-V96 PolarHBondContact N-O 2.83Å; R87-V96 PolarHBondContact O-N 2.97Å; R87-T128 WeakPolarHBondContact CG-O 3.35Å
88	F	91.2	Very high	87.2	Confident	12 Å²	12	43.7 Å²	43.7	5%	0.053	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	147.2	169.9	-75.6	-73.2	0	0	0	111.7	D45 N53 A55 V64 L95 V109 F130	D45-F88 PolarHBondContact OD2-N 3Å; N53-F88 WeakPolarHBondContact O-CE2 3.45Å; A55-F88 HydrophobicContact CB-CD2 4.17Å; A55-F88 HydrophobicContact CB-CE2 3.42Å; A55-F88 VanDerWaalsContact CB-CE2 3.42Å; A55-F88 HydrophobicContact CB-CZ 3.72Å; A55-F88 VanDerWaalsContact N-CE2 3.35Å; V64-F88 HydrophobicContact CG1-CZ 4.21Å; V64-F88 HydrophobicContact CG2-CZ 4.43Å; F88-L95 HydrophobicContact CD1-CD1 4.41Å; F88-L95 HydrophobicContact CE1-CD1 4.01Å; F88-L95 HydrophobicContact CZ-CD1 4.16Å; F88-V109 HydrophobicContact CD1-CG2 4.08Å; F88-V109 HydrophobicContact CE1-CG2 3.64Å; F88-F130 WeakPolarHBondContact O-CD2 3.45Å
89	R	90.3	Very high	87.9	Confident	35 Å²	35	34.8 Å²	34.8	13%	0.132	17%	0.167	C	C	.	.			trans	-73.4	158.9	164.1	-157.1	174.1	75	170.6	-2.1	110.2	D91 G92 L94 F130 R134	R89-D91 IonicContact CZ-OD1 3.45Å; R89-D91 VanDerWaalsContact CZ-OD1 3.28Å; R89-D91 IonicContact CZ-OD2 3.95Å; R89-D91 IonicContact NE-OD1 2.73Å; R89-D91 PolarHBondContact NE-OD1 3.33Å; R89-D91 VanDerWaalsContact NH2-CG 3.32Å; R89-D91 IonicContact NH2-OD1 3.81Å; R89-D91 PolarHBondContact NH2-OD1 3.26Å; R89-D91 VanDerWaalsContact NH2-OD1 3.13Å; R89-D91 IonicContact NH2-OD2 3.48Å; R89-D91 PolarHBondContact NH2-OD2 3.34Å; R89-D91 PolarHBondContact O-N 3.11Å; R89-D91 VanDerWaalsContact O-N 3.09Å; R89-G92 PolarHBondContact O-N 3.2Å; R89-L94 HydrophobicContact CB-CB 4.06Å; R89-L94 PolarHBondContact N-O 3.23Å; R89-L94 VanDerWaalsContact NH1-CD1 3.3Å; R89-F130 HydrophobicContact CB-CD1 4.31Å; R89-F130 HydrophobicContact CB-CD2 3.95Å; R89-F130 HydrophobicContact CB-CE1 4.13Å; R89-F130 HydrophobicContact CB-CE2 3.75Å; R89-F130 HydrophobicContact CB-CG 4.18Å; R89-F130 HydrophobicContact CB-CZ 3.8Å; R89-F130 HydrophobicContact CG-CB 4.43Å; R89-F130 HydrophobicContact CG-CD1 3.86Å; R89-F130 HydrophobicContact CG-CD2 4.26Å; R89-F130 HydrophobicContact CG-CE1 3.98Å; R89-F130 HydrophobicContact CG-CE2 4.36Å; R89-F130 HydrophobicContact CG-CG 3.96Å; R89-F130 HydrophobicContact CG-CZ 4.17Å; R89-F130 VanDerWaalsContact N-CE2 3.34Å; R89-R134 HydrophobicContact CG-CB 4.27Å
90	S	84.8	Confident	88.4	Confident	49 Å²	49	37.3 Å²	37.3	34%	0.343	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-19.7	-178.5	54.6	0	0	0	0	115.6	P48 V49 R134	P48-S90 WeakPolarHBondContact CG-O 3.4Å; V49-S90 WeakPolarHBondContact CG2-O 3.38Å; S90-R134 WeakPolarHBondContact OG-CD 3.48Å; S90-R134 WeakPolarHBondContact OG-CG 3.19Å; S90-R134 PolarHBondContact OG-NE 2.93Å
91	D	84.9	Confident	88.8	Confident	47 Å²	47	30 Å²	30	25%	0.251	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-0.6	171.9	2.5	31	0	0	0	113.7	R89 Q93 R134	R89-D91 IonicContact CZ-OD1 3.45Å; R89-D91 VanDerWaalsContact CZ-OD1 3.28Å; R89-D91 IonicContact CZ-OD2 3.95Å; R89-D91 IonicContact NE-OD1 2.73Å; R89-D91 PolarHBondContact NE-OD1 3.33Å; R89-D91 VanDerWaalsContact NH2-CG 3.32Å; R89-D91 IonicContact NH2-OD1 3.81Å; R89-D91 PolarHBondContact NH2-OD1 3.26Å; R89-D91 VanDerWaalsContact NH2-OD1 3.13Å; R89-D91 IonicContact NH2-OD2 3.48Å; R89-D91 PolarHBondContact NH2-OD2 3.34Å; R89-D91 PolarHBondContact O-N 3.11Å; R89-D91 VanDerWaalsContact O-N 3.09Å; D91-Q93 PolarHBondContact O-N 3.04Å; D91-Q93 VanDerWaalsContact O-N 3.15Å; D91-R134 WeakPolarHBondContact OD1-CD 3.45Å; D91-R134 IonicContact OD1-NH1 3.27Å; D91-R134 IonicContact OD2-CZ 3.98Å; D91-R134 IonicContact OD2-NH1 3.51Å; D91-R134 PolarHBondContact OD2-NH1 3.48Å
92	G	84.8	Confident	89	Confident	14 Å²	14	28.2 Å²	28.2	14%	0.144	14%	0.142	C	C	.	.	S	Bend	trans	71.2	4.9	174.3	0	0	0	0	0	115.7	R89 V109	R89-G92 PolarHBondContact O-N 3.2Å; G92-V109 WeakPolarHBondContact O-CG2 3.34Å
93	Q	87.8	Confident	89.2	Confident	121 Å²	121	28 Å²	28	57%	0.565	14%	0.141	S	C	*	.	S	Bend	trans	-92.3	-28.7	-178	-67.1	-177.6	-8.6	0	0	113.7	D91 D108 V109	D91-Q93 PolarHBondContact O-N 3.04Å; D91-Q93 VanDerWaalsContact O-N 3.15Å; Q93-D108 VanDerWaalsContact O-OD1 3.09Å; Q93-V109 WeakPolarHBondContact O-CB 3.32Å; Q93-V109 VanDerWaalsContact O-CG2 3.27Å; Q93-V109 WeakPolarHBondContact O-CG2 3.3Å; Q93-V109 PolarHBondContact O-N 3.48Å
94	L	90.9	Very high	89.3	Confident	18 Å²	18	28 Å²	28	9%	0.094	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	145.2	-178.7	-64.2	-176.6	0	0	0	110.8	R89 L106 F107 D108 L115 F130	R89-L94 HydrophobicContact CB-CB 4.06Å; R89-L94 PolarHBondContact N-O 3.23Å; R89-L94 VanDerWaalsContact NH1-CD1 3.3Å; L94-L106 HydrophobicContact CB-CD1 4.08Å; L94-L106 HydrophobicContact CD1-CD1 4.22Å; L94-L106 HydrophobicContact CD1-CD2 4.35Å; L94-F107 WeakPolarHBondContact CA-O 3.47Å; L94-D108 HydrophobicContact CD2-CB 4.46Å; L94-L115 HydrophobicContact CD2-CD1 3.53Å; L94-F130 HydrophobicContact CB-CZ 4.11Å
95	L	91.8	Very high	89.5	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.9	175.4	-175.9	147	0	0	0	109.5	A55 I62 V64 R87 F88 A97 F107 V109	A55-L95 HydrophobicContact CB-CD1 3.57Å; I62-L95 HydrophobicContact CD1-CD2 3.93Å; I62-L95 HydrophobicContact CG2-CD1 4.13Å; I62-L95 HydrophobicContact CG2-CD2 4.3Å; V64-L95 HydrophobicContact CG2-CD1 4.37Å; R87-L95 CarbonylContact O-C 3.46Å; R87-L95 VanDerWaalsContact O-CA 3.3Å; R87-L95 WeakPolarHBondContact O-CA 3.49Å; F88-L95 HydrophobicContact CD1-CD1 4.41Å; F88-L95 HydrophobicContact CE1-CD1 4.01Å; F88-L95 HydrophobicContact CZ-CD1 4.16Å; L95-A97 HydrophobicContact CD2-CB 4.46Å; L95-F107 HydrophobicContact CB-CB 4.46Å; L95-F107 HydrophobicContact CD2-CD2 4.13Å; L95-F107 PolarHBondContact N-O 2.91Å; L95-F107 PolarHBondContact O-N 3.24Å; L95-V109 HydrophobicContact CB-CG2 4.36Å
96	V	91.9	Very high	89.8	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.2	173.7	170.6	0	0	0	0	109.5	G86 R87 V104 L106 T128 F130 I137	G86-V96 VanDerWaalsContact CA-O 3.31Å; G86-V96 WeakPolarHBondContact CA-O 3.47Å; R87-V96 PolarHBondContact N-O 2.83Å; R87-V96 PolarHBondContact O-N 2.97Å; V96-V104 HydrophobicContact CG1-CG1 3.5Å; V96-V104 VanDerWaalsContact CG1-CG1 3.5Å; V96-L106 HydrophobicContact CG2-CD1 3.39Å; V96-T128 HydrophobicContact CG1-CG2 3.86Å; V96-F130 HydrophobicContact CB-CE2 3.95Å; V96-F130 HydrophobicContact CB-CZ 4Å; V96-F130 HydrophobicContact CG2-CE1 3.64Å; V96-F130 HydrophobicContact CG2-CE2 3.61Å; V96-F130 HydrophobicContact CG2-CZ 3.14Å; V96-I137 HydrophobicContact CG1-CG2 4.14Å; V96-I137 HydrophobicContact CG2-CD1 3.5Å; V96-I137 HydrophobicContact CG2-CG1 4.08Å; V96-I137 HydrophobicContact CG2-CG2 4.49Å
97	A	91.6	Very high	89.9	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127	176.4	0	0	0	0	0	111.9	I62 F79 C85 L95 V104 R105 F107	I62-A97 HydrophobicContact CD1-CB 3.41Å; I62-A97 VanDerWaalsContact CD1-CB 3.41Å; F79-A97 HydrophobicContact CE1-CB 3.76Å; F79-A97 HydrophobicContact CZ-CB 3.73Å; C85-A97 VanDerWaalsContact O-CA 3.26Å; C85-A97 WeakPolarHBondContact O-CA 3.39Å; L95-A97 HydrophobicContact CD2-CB 4.46Å; A97-V104 WeakPolarHBondContact O-CA 3.2Å; A97-R105 PolarHBondContact N-O 3.33Å; A97-R105 PolarHBondContact O-N 3.33Å; A97-F107 HydrophobicContact CB-CD2 4.39Å; A97-F107 HydrophobicContact CB-CE2 3.99Å
98	G	90.8	Very high	89.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137.3	167.2	0	0	0	0	0	111.1	A83 Y84 C85 V125	A83-G98 WeakPolarHBondContact CA-O 3.42Å; Y84-G98 PolarHBondContact N-O 3.05Å; C85-G98 PolarHBondContact O-N 3.04Å; G98-V125 CarbonylContact C-O 3.58Å
99	C	90.5	Very high	89.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	158.3	-176.4	-62.6	0	0	0	0	112.5	F79 T82 D101 S102 R105 V125	F79-C99 WeakPolarHBondContact CD1-SG 3.15Å; F79-C99 VanDerWaalsContact CE1-SG 3.52Å; T82-C99 CarbonylContact O-C 3.17Å; T82-C99 VanDerWaalsContact O-CA 3.29Å; T82-C99 WeakPolarHBondContact O-CA 3.3Å; C99-D101 HydrophobicContact CB-CB 4.26Å; C99-D101 PolarHBondContact O-N 3.19Å; C99-S102 PolarHBondContact O-N 3.22Å; C99-R105 PolarHBondContact SG-NH1 3.2Å; C99-V125 PolarHBondContact O-N 3.25Å
100	E	90.9	Very high	89.3	Confident	69 Å²	69	27.1 Å²	27.1	32%	0.322	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.8	169.2	-173.3	68.1	-157.5	0	0	111.8	D81 T82 Y84 S102 A124	D81-E100 HydrophobicContact CB-CB 4.01Å; D81-E100 WeakPolarHBondContact OD2-CG 3.1Å; T82-E100 PolarHBondContact O-N 2.88Å; T82-E100 WeakPolarHBondContact OG1-CB 3.1Å; Y84-E100 HydrophobicContact CE2-CB 4Å; Y84-E100 WeakPolarHBondContact CE2-OE2 3.24Å; Y84-E100 PolarHBondContact OH-OE2 3.26Å; E100-S102 PolarHBondContact O-N 3.05Å; E100-A124 HydrophobicContact CG-CB 4.47Å; E100-A124 WeakPolarHBondContact OE2-CB 3.34Å
101	D	88	Confident	89.1	Confident	35 Å²	35	26 Å²	26	19%	0.187	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	4.8	176.1	-70	-34.7	0	0	0	115.1	K80 D81 C99 V103 R105	K80-D101 WeakPolarHBondContact CB-OD2 3.47Å; K80-D101 PolarHBondContact N-OD2 3.46Å; D81-D101 WeakPolarHBondContact CB-OD1 3.45Å; C99-D101 HydrophobicContact CB-CB 4.26Å; C99-D101 PolarHBondContact O-N 3.19Å; D101-V103 PolarHBondContact O-N 3.14Å; D101-R105 IonicContact OD2-CZ 3.28Å; D101-R105 IonicContact OD2-NH1 2.72Å; D101-R105 PolarHBondContact OD2-NH1 3.1Å; D101-R105 IonicContact OD2-NH2 3.13Å; D101-R105 PolarHBondContact OD2-NH2 3.46Å
102	S	88.8	Confident	88.6	Confident	29 Å²	29	32.5 Å²	32.5	20%	0.203	17%	0.172	C	C	.	.	S	Bend	trans	62.1	-1.5	-171.3	72	0	0	0	0	116.1	C99 E100 H121 K123	C99-S102 PolarHBondContact O-N 3.22Å; E100-S102 PolarHBondContact O-N 3.05Å; S102-H121 WeakPolarHBondContact CB-O 3.46Å; S102-H121 PolarHBondContact OG-O 3.09Å; S102-K123 VanDerWaalsContact CA-O 3.25Å; S102-K123 WeakPolarHBondContact CA-O 3.48Å; S102-K123 WeakPolarHBondContact CB-O 3.25Å
103	V	90.7	Very high	88.5	Confident	16 Å²	16	37 Å²	37	10%	0.097	20%	0.196	C	C	.	.			trans	-99.2	129.3	-179.4	-176.5	0	0	0	0	110.6	D101 R105 M117 K119	D101-V103 PolarHBondContact O-N 3.14Å; V103-R105 HydrophobicContact CG1-CG 4.19Å; V103-M117 HydrophobicContact CG1-CB 3.93Å; V103-M117 HydrophobicContact CG1-CE 3.69Å; V103-K119 HydrophobicContact CG1-CG 4.33Å; V103-K119 HydrophobicContact CG2-CG 4.14Å
104	V	92.1	Very high	88.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.7	170.1	-178.2	0	0	0	0	109.2	V96 A97 M117 F118 V125 T128 T139	V96-V104 HydrophobicContact CG1-CG1 3.5Å; V96-V104 VanDerWaalsContact CG1-CG1 3.5Å; A97-V104 WeakPolarHBondContact O-CA 3.2Å; V104-M117 WeakPolarHBondContact O-CA 3.43Å; V104-F118 HydrophobicContact CB-CB 4.25Å; V104-F118 HydrophobicContact CB-CD2 4.21Å; V104-F118 HydrophobicContact CG1-CD2 4.17Å; V104-F118 PolarHBondContact N-O 2.95Å; V104-F118 PolarHBondContact O-N 3.13Å; V104-V125 HydrophobicContact CG2-CB 4.1Å; V104-V125 HydrophobicContact CG2-CG1 3.78Å; V104-V125 HydrophobicContact CG2-CG2 3.85Å; V104-T128 HydrophobicContact CG1-CG2 3.95Å; V104-T128 HydrophobicContact CG2-CG2 4.27Å; V104-T139 HydrophobicContact CB-CG2 4.38Å; V104-T139 HydrophobicContact CG1-CG2 4.18Å; V104-T139 HydrophobicContact CG2-CG2 3.77Å
105	R	92.1	Very high	88.2	Confident	22 Å²	22	36.3 Å²	36.3	8%	0.083	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131.4	-176.1	-62.3	-176.9	179.1	85.1	-11.1	109.9	F79 A97 C99 D101 V103 F107 M117	F79-R105 HydrophobicContact CE1-CB 4.45Å; A97-R105 PolarHBondContact N-O 3.33Å; A97-R105 PolarHBondContact O-N 3.33Å; C99-R105 PolarHBondContact SG-NH1 3.2Å; D101-R105 IonicContact OD2-CZ 3.28Å; D101-R105 IonicContact OD2-NH1 2.72Å; D101-R105 PolarHBondContact OD2-NH1 3.1Å; D101-R105 IonicContact OD2-NH2 3.13Å; D101-R105 PolarHBondContact OD2-NH2 3.46Å; V103-R105 HydrophobicContact CG1-CG 4.19Å; R105-F107 HydrophobicContact CB-CD2 4.39Å; R105-F107 HydrophobicContact CB-CE2 3.56Å; R105-F107 HydrophobicContact CB-CZ 3.83Å; R105-M117 HydrophobicContact CG-CE 4.44Å; R105-M117 HydrophobicContact CG-CG 4.31Å
106	L	92.7	Very high	88.1	Confident	2 Å²	2	41 Å²	41	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127	173.4	-178.1	69	0	0	0	109	L94 V96 A114 L115 R116 F118 F130 I137 I151	L94-L106 HydrophobicContact CB-CD1 4.08Å; L94-L106 HydrophobicContact CD1-CD1 4.22Å; L94-L106 HydrophobicContact CD1-CD2 4.35Å; V96-L106 HydrophobicContact CG2-CD1 3.39Å; L106-A114 CarbonylContact O-C 3.48Å; L106-A114 WeakPolarHBondContact O-CA 3.41Å; L106-L115 PolarHBondContact O-N 2.9Å; L106-R116 HydrophobicContact CB-CB 4.32Å; L106-R116 HydrophobicContact CD2-CB 4.45Å; L106-R116 PolarHBondContact N-O 2.96Å; L106-R116 PolarHBondContact O-N 3.03Å; L106-F118 HydrophobicContact CB-CE2 4.09Å; L106-F130 HydrophobicContact CD1-CE1 4.25Å; L106-F130 HydrophobicContact CD1-CZ 3.94Å; L106-I137 HydrophobicContact CD1-CD1 4.43Å; L106-I151 HydrophobicContact CD2-CG2 3.7Å
107	F	91.3	Very high	88.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	144.6	177.1	-63.3	-82	0	0	0	110.2	F76 F79 L94 L95 A97 R105 A114	F76-F107 HydrophobicContact CD1-CB 4.44Å; F76-F107 AromaticContact CD1-CD1 3.71Å; F76-F107 HydrophobicContact CD1-CD1 3.71Å; F76-F107 HydrophobicContact CD1-CE1 4.15Å; F76-F107 HydrophobicContact CD1-CG 4.09Å; F76-F107 HydrophobicContact CE1-CB 3.98Å; F76-F107 AromaticContact CE1-CD1 3.95Å; F76-F107 HydrophobicContact CE1-CD1 3.95Å; F76-F107 HydrophobicContact CE1-CG 4.13Å; F76-F107 HydrophobicContact CG-CD1 4.43Å; F76-F107 HydrophobicContact CZ-CB 4.14Å; F79-F107 AromaticContact CE1-CE2 3.62Å; F79-F107 HydrophobicContact CE1-CE2 3.62Å; F79-F107 AromaticContact CE1-CZ 3.71Å; F79-F107 HydrophobicContact CE1-CZ 3.71Å; F79-F107 HydrophobicContact CE2-CZ 4.45Å; F79-F107 HydrophobicContact CZ-CD2 4.46Å; F79-F107 AromaticContact CZ-CE2 3.39Å; F79-F107 HydrophobicContact CZ-CE2 3.39Å; F79-F107 AromaticContact CZ-CZ 3.58Å; F79-F107 HydrophobicContact CZ-CZ 3.58Å; L94-F107 WeakPolarHBondContact CA-O 3.47Å; L95-F107 HydrophobicContact CB-CB 4.46Å; L95-F107 HydrophobicContact CD2-CD2 4.13Å; L95-F107 PolarHBondContact N-O 2.91Å; L95-F107 PolarHBondContact O-N 3.24Å; A97-F107 HydrophobicContact CB-CD2 4.39Å; A97-F107 HydrophobicContact CB-CE2 3.99Å; R105-F107 HydrophobicContact CB-CD2 4.39Å; R105-F107 HydrophobicContact CB-CE2 3.56Å; R105-F107 HydrophobicContact CB-CZ 3.83Å; F107-A114 HydrophobicContact CD1-CB 4.1Å; F107-A114 HydrophobicContact CE1-CB 3.68Å; F107-A114 HydrophobicContact CZ-CB 4.16Å
108	D	90.6	Very high	88	Confident	40 Å²	40	45.3 Å²	45.3	21%	0.214	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.7	158.3	-173.4	-4.3	0	0	0	108.2	Q93 L94 S110 G111 L115	Q93-D108 VanDerWaalsContact O-OD1 3.09Å; L94-D108 HydrophobicContact CD2-CB 4.46Å; D108-S110 VanDerWaalsContact CG-OG 3.29Å; D108-S110 PolarHBondContact O-N 3.22Å; D108-S110 PolarHBondContact OD1-N 3.05Å; D108-S110 PolarHBondContact OD1-OG 3.32Å; D108-S110 PolarHBondContact OD2-OG 3Å; D108-G111 PolarHBondContact O-N 3.09Å; D108-G111 VanDerWaalsContact O-O 3.06Å; D108-L115 HydrophobicContact CB-CD1 3.88Å; D108-L115 HydrophobicContact CB-CD2 4.27Å; D108-L115 HydrophobicContact CB-CG 4.05Å
109	V	85.3	Confident	88	Confident	21 Å²	21	52.8 Å²	52.8	13%	0.127	27%	0.271	C	S	.	.	S	Bend	trans	-63.6	-29.2	172.6	177	0	0	0	0	110.2	K74 F88 G92 Q93 L95	K74-V109 WeakPolarHBondContact CD-O 3.34Å; K74-V109 WeakPolarHBondContact CE-O 3.49Å; K74-V109 PolarHBondContact NZ-O 2.93Å; F88-V109 HydrophobicContact CD1-CG2 4.08Å; F88-V109 HydrophobicContact CE1-CG2 3.64Å; G92-V109 WeakPolarHBondContact O-CG2 3.34Å; Q93-V109 WeakPolarHBondContact O-CB 3.32Å; Q93-V109 VanDerWaalsContact O-CG2 3.27Å; Q93-V109 WeakPolarHBondContact O-CG2 3.3Å; Q93-V109 PolarHBondContact O-N 3.48Å; L95-V109 HydrophobicContact CB-CG2 4.36Å
110	S	83.8	Confident	87.7	Confident	86 Å²	86	54.3 Å²	54.3	60%	0.601	29%	0.287	S	S	*	.	S	Bend	trans	-73.6	-40.9	175.4	96.8	0	0	0	0	111.9	K74 D108	K74-S110 VanDerWaalsContact NZ-C 3.33Å; K74-S110 VanDerWaalsContact NZ-CA 3.32Å; K74-S110 PolarHBondContact NZ-O 3.46Å; D108-S110 VanDerWaalsContact CG-OG 3.29Å; D108-S110 PolarHBondContact O-N 3.22Å; D108-S110 PolarHBondContact OD1-N 3.05Å; D108-S110 PolarHBondContact OD1-OG 3.32Å; D108-S110 PolarHBondContact OD2-OG 3Å
111	G	79.1	Confident	87.7	Confident	26 Å²	26	51.4 Å²	51.4	27%	0.268	27%	0.273	S	S	.	.			trans	-84.1	171.3	-177.1	0	0	0	0	0	114.7	F76 D108	F76-G111 WeakPolarHBondContact CE1-O 3.16Å; D108-G111 PolarHBondContact O-N 3.09Å; D108-G111 VanDerWaalsContact O-O 3.06Å
112	R	75.3	Confident	87.8	Confident	184 Å²	184	55 Å²	55	69%	0.694	30%	0.296	S	S	*	.	S	Bend	trans	-111	-12.8	172.2	-158	179.1	-131	-152	5	112.9
113	V	81.9	Confident	88	Confident	107 Å²	107	57.6 Å²	57.6	65%	0.648	30%	0.304	S	S	*	.	S	Bend	trans	-98.7	144	-176	-175.1	0	0	0	0	108.7	L115	V113-L115 PolarHBondContact O-N 2.66Å
114	A	84.6	Confident	88	Confident	28 Å²	28	57 Å²	57	23%	0.231	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	123.9	170.7	0	0	0	0	0	108.8	L106 F107	L106-A114 CarbonylContact O-C 3.48Å; L106-A114 WeakPolarHBondContact O-CA 3.41Å; F107-A114 HydrophobicContact CD1-CB 4.1Å; F107-A114 HydrophobicContact CE1-CB 3.68Å; F107-A114 HydrophobicContact CZ-CB 4.16Å
115	L	88.4	Confident	88	Confident	98 Å²	98	57 Å²	57	51%	0.513	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	-45.8	175.1	-70.1	178.3	0	0	0	110.5	L94 L106 D108 V113	L94-L115 HydrophobicContact CD2-CD1 3.53Å; L106-L115 PolarHBondContact O-N 2.9Å; D108-L115 HydrophobicContact CB-CD1 3.88Å; D108-L115 HydrophobicContact CB-CD2 4.27Å; D108-L115 HydrophobicContact CB-CG 4.05Å; V113-L115 PolarHBondContact O-N 2.66Å
116	R	89.8	Confident	87.9	Confident	98 Å²	98	56.9 Å²	56.9	37%	0.37	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154	-177	-71.7	-172.7	169	132.1	1.9	111.4	L106 I151 P152	L106-R116 HydrophobicContact CB-CB 4.32Å; L106-R116 HydrophobicContact CD2-CB 4.45Å; L106-R116 PolarHBondContact N-O 2.96Å; L106-R116 PolarHBondContact O-N 3.03Å; R116-I151 VanDerWaalsContact CD-O 3.26Å; R116-I151 WeakPolarHBondContact CD-O 3.49Å; R116-I151 VanDerWaalsContact CZ-O 3.28Å; R116-I151 PolarHBondContact NE-O 3.09Å; R116-I151 VanDerWaalsContact NH1-C 3.32Å; R116-I151 PolarHBondContact NH1-O 3.13Å; R116-P152 PolarHBondContact NH1-O 2.89Å; R116-P152 PolarHBondContact NH2-O 3.33Å
117	M	91.2	Very high	87.6	Confident	88 Å²	88	57.3 Å²	57.3	43%	0.433	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.2	176.2	-62.3	-178.7	66.6	0	0	108	V103 V104 R105	V103-M117 HydrophobicContact CG1-CB 3.93Å; V103-M117 HydrophobicContact CG1-CE 3.69Å; V104-M117 WeakPolarHBondContact O-CA 3.43Å; R105-M117 HydrophobicContact CG-CE 4.44Å; R105-M117 HydrophobicContact CG-CG 4.31Å
118	F	91.1	Very high	87.6	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	115	176.9	-53.8	-88.8	0	0	0	108.5	V104 L106 I137 W149 I151 A154	V104-F118 HydrophobicContact CB-CB 4.25Å; V104-F118 HydrophobicContact CB-CD2 4.21Å; V104-F118 HydrophobicContact CG1-CD2 4.17Å; V104-F118 PolarHBondContact N-O 2.95Å; V104-F118 PolarHBondContact O-N 3.13Å; L106-F118 HydrophobicContact CB-CE2 4.09Å; F118-I137 HydrophobicContact CE2-CD1 3.56Å; F118-I137 HydrophobicContact CZ-CD1 3.66Å; F118-W149 HydrophobicContact CB-CD2 4.02Å; F118-W149 HydrophobicContact CB-CE3 3.97Å; F118-W149 HydrophobicContact CB-CH2 4.42Å; F118-W149 HydrophobicContact CB-CZ2 4.47Å; F118-W149 HydrophobicContact CB-CZ3 4.17Å; F118-W149 HydrophobicContact CD1-CB 4.01Å; F118-W149 AromaticContact CD1-CD2 3.97Å; F118-W149 HydrophobicContact CD1-CD2 3.97Å; F118-W149 AromaticContact CD1-CE3 3.68Å; F118-W149 HydrophobicContact CD1-CE3 3.68Å; F118-W149 HydrophobicContact CD1-CG 4.13Å; F118-W149 HydrophobicContact CD1-CZ3 4.45Å; F118-W149 HydrophobicContact CE1-CB 4.05Å; F118-W149 HydrophobicContact CG-CD2 4.26Å; F118-W149 HydrophobicContact CG-CE3 4.23Å; F118-W149 HydrophobicContact CG-CG 4.45Å; F118-I151 HydrophobicContact CZ-CG1 4.41Å; F118-A154 HydrophobicContact CD1-CB 4.23Å; F118-A154 HydrophobicContact CE1-CB 4.15Å
119	K	89.4	Confident	87.6	Confident	158 Å²	158	56.5 Å²	56.5	69%	0.687	30%	0.299	S	S	*	.			trans	-111.6	124.7	179	-63.3	-177.8	-179.9	178.4	0	108.3	V103	V103-K119 HydrophobicContact CG1-CG 4.33Å; V103-K119 HydrophobicContact CG2-CG 4.14Å
120	G	84.9	Confident	87.9	Confident	31 Å²	31	56.1 Å²	56.1	32%	0.32	30%	0.296	S	S	.	.			trans	174.9	-28.6	176.1	0	0	0	0	0	113.2	R147	G120-R147 PolarHBondContact O-NH1 3.37Å; G120-R147 PolarHBondContact O-NH2 3.43Å
121	H	90.4	Very high	88	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.042	27%	0.269	C	S	.	.			trans	-66.4	149.9	167.3	-73.5	-67.2	0	0	0	111.3	S102 V125 T139 S141 D143 T145 R147 W149	S102-H121 WeakPolarHBondContact CB-O 3.46Å; S102-H121 PolarHBondContact OG-O 3.09Å; H121-V125 HydrophobicContact CB-CG2 4.11Å; H121-T139 PolarHBondContact NE2-OG1 3.22Å; H121-S141 VanDerWaalsContact ND1-CB 3.3Å; H121-S141 WeakPolarHBondContact ND1-CB 3.39Å; H121-D143 WeakPolarHBondContact CA-OD2 3.31Å; H121-D143 IonicContact CG-OD2 3.97Å; H121-D143 IonicContact ND1-OD1 3.5Å; H121-D143 PolarHBondContact ND1-OD1 3.21Å; H121-D143 IonicContact ND1-OD2 3.75Å; H121-D143 PolarHBondContact ND1-OD2 3.2Å; H121-T145 PolarHBondContact CE1-OG1 2.99Å; H121-T145 PolarHBondContact ND1-OG1 3.27Å; H121-R147 VanDerWaalsContact CE1-CD 3.4Å; H121-R147 WeakPolarHBondContact CE1-CD 3.27Å; H121-W149 AromaticContact NE2-NE1 3.99Å
122	T	91.1	Very high	88.2	Confident	109 Å²	109	52.6 Å²	52.6	67%	0.669	27%	0.267	S	S	*	.	S	Bend	trans	-101.5	-20.2	179.4	56.4	0	0	0	0	113	D143	T122-D143 PolarHBondContact N-OD2 3.48Å; T122-D143 VanDerWaalsContact OG1-CB 3.26Å; T122-D143 WeakPolarHBondContact OG1-CB 3.42Å
123	K	92.4	Very high	88.3	Confident	84 Å²	84	46.4 Å²	46.4	37%	0.365	25%	0.248	S	C	.	.	S	Bend	trans	-129.2	178.9	-179.5	-68.3	-179.7	177.7	179.5	0	111.7	S102 S141 D142 D143	S102-K123 VanDerWaalsContact CA-O 3.25Å; S102-K123 WeakPolarHBondContact CA-O 3.48Å; S102-K123 WeakPolarHBondContact CB-O 3.25Å; K123-S141 PolarHBondContact O-OG 3.42Å; K123-D142 HydrophobicContact CB-CB 3.97Å; K123-D142 HydrophobicContact CD-CB 4.1Å; K123-D142 VanDerWaalsContact CD-O 3.22Å; K123-D142 WeakPolarHBondContact CD-O 3.19Å; K123-D142 PolarHBondContact NZ-O 2.96Å; K123-D143 HydrophobicContact CB-CB 4.2Å; K123-D143 HydrophobicContact CD-CB 4.42Å; K123-D143 HydrophobicContact CG-CB 4.39Å
124	A	90.9	Very high	88.4	Confident	3 Å²	3	46.2 Å²	46.2	3%	0.025	24%	0.236	C	C	.	.			trans	-52.6	136.8	180	0	0	0	0	0	113.6	Y84 E100 S141 D142	Y84-A124 HydrophobicContact CE2-CB 4.11Å; E100-A124 HydrophobicContact CG-CB 4.47Å; E100-A124 WeakPolarHBondContact OE2-CB 3.34Å; A124-S141 VanDerWaalsContact O-CA 3.3Å; A124-S141 WeakPolarHBondContact O-CA 3.28Å; A124-S141 PolarHBondContact O-OG 2.88Å; A124-S141 VanDerWaalsContact O-OG 3.05Å; A124-D142 PolarHBondContact O-N 2.93Å
125	V	92.1	Very high	88.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	108.3	177.6	-175.5	0	0	0	0	109.3	G98 C99 V104 H121 V127 T128 G140	G98-V125 CarbonylContact C-O 3.58Å; C99-V125 PolarHBondContact O-N 3.25Å; V104-V125 HydrophobicContact CG2-CB 4.1Å; V104-V125 HydrophobicContact CG2-CG1 3.78Å; V104-V125 HydrophobicContact CG2-CG2 3.85Å; H121-V125 HydrophobicContact CB-CG2 4.11Å; V125-V127 WeakPolarHBondContact CG1-O 3.5Å; V125-T128 HydrophobicContact CG1-CG2 3.86Å; V125-G140 WeakPolarHBondContact CG1-O 3.37Å
126	H	89.3	Confident	88.5	Confident	20 Å²	20	47 Å²	47	9%	0.093	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-35.4	179.3	-70.2	-75.3	0	0	0	112.3	Y84 C85 G140 D142 R168	Y84-H126 AromaticContact CD1-CE1 3.71Å; Y84-H126 AromaticContact CD1-ND1 3.39Å; Y84-H126 WeakPolarHBondContact CD1-ND1 3.49Å; Y84-H126 AromaticContact CD2-CE1 3.77Å; Y84-H126 AromaticContact CD2-ND1 3.71Å; Y84-H126 AromaticContact CE1-CE1 3.43Å; Y84-H126 VanDerWaalsContact CE1-CE1 3.43Å; Y84-H126 WeakPolarHBondContact CE1-CE1 3.44Å; Y84-H126 AromaticContact CE1-ND1 3.62Å; Y84-H126 AromaticContact CE2-CE1 3.49Å; Y84-H126 VanDerWaalsContact CE2-CE1 3.49Å; Y84-H126 WeakPolarHBondContact CE2-CE1 3.46Å; Y84-H126 AromaticContact CE2-ND1 3.91Å; Y84-H126 AromaticContact CG-CE1 3.86Å; Y84-H126 AromaticContact CG-ND1 3.43Å; Y84-H126 AromaticContact CZ-CE1 3.3Å; Y84-H126 AromaticContact CZ-ND1 3.87Å; C85-H126 PolarHBondContact SG-O 3.33Å; H126-G140 PolarHBondContact N-O 3.1Å; H126-G140 VanDerWaalsContact N-O 3.14Å; H126-D142 VanDerWaalsContact CD2-CG 3.43Å; H126-D142 IonicContact CD2-OD1 3.43Å; H126-D142 PolarHBondContact CD2-OD1 2.97Å; H126-D142 IonicContact CD2-OD2 3.91Å; H126-D142 PolarHBondContact CD2-OD2 3.45Å; H126-D142 IonicContact CE1-OD2 3.16Å; H126-D142 VanDerWaalsContact NE2-CG 3.26Å; H126-D142 IonicContact NE2-OD1 3.78Å; H126-D142 PolarHBondContact NE2-OD1 3.38Å; H126-D142 IonicContact NE2-OD2 3.79Å; H126-D142 PolarHBondContact NE2-OD2 3.18Å; H126-R168 PolarHBondContact CE1-NH1 3.29Å; H126-R168 PolarHBondContact ND1-NH1 2.87Å; H126-R168 PolarHBondContact NE2-NH1 3.47Å
127	V	87.8	Confident	88.6	Confident	11 Å²	11	42.4 Å²	42.4	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.2	-172.8	-172.6	0	0	0	0	109.7	V125 T139 G140 I167 R168 C169	V125-V127 WeakPolarHBondContact CG1-O 3.5Å; V127-T139 CarbonylContact O-C 3.56Å; V127-T139 VanDerWaalsContact O-CA 3.32Å; V127-T139 WeakPolarHBondContact O-CA 3.4Å; V127-G140 PolarHBondContact N-O 3.37Å; V127-G140 PolarHBondContact O-N 3.49Å; V127-I167 HydrophobicContact CG2-CG2 4.38Å; V127-R168 WeakPolarHBondContact CG2-O 3.32Å; V127-C169 VanDerWaalsContact CG2-CA 3.43Å
128	T	91.3	Very high	88.5	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136	164.6	63.2	0	0	0	0	108.5	C85 R87 V96 V104 V125 L138 T139	C85-T128 PolarHBondContact SG-N 3.06Å; C85-T128 PolarHBondContact SG-OG1 3.34Å; R87-T128 WeakPolarHBondContact CG-O 3.35Å; V96-T128 HydrophobicContact CG1-CG2 3.86Å; V104-T128 HydrophobicContact CG1-CG2 3.95Å; V104-T128 HydrophobicContact CG2-CG2 4.27Å; V125-T128 HydrophobicContact CG1-CG2 3.86Å; T128-L138 CarbonylContact C-O 3.58Å; T128-L138 VanDerWaalsContact CA-O 3.3Å; T128-L138 WeakPolarHBondContact CA-O 3.45Å; T128-T139 HydrophobicContact CG2-CG2 4.24Å
129	D	90.4	Very high	88.5	Confident	21 Å²	21	38.2 Å²	38.2	11%	0.112	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155	175.9	-161.8	15.6	0	0	0	111.1	I137 L138 T172	D129-I137 WeakPolarHBondContact O-CA 3.42Å; D129-L138 PolarHBondContact N-O 3.1Å; D129-L138 PolarHBondContact O-N 3.29Å; D129-T172 HydrophobicContact CB-CG2 3.98Å; D129-T172 VanDerWaalsContact CG-OG1 3.27Å; D129-T172 WeakPolarHBondContact OD2-CB 3.47Å; D129-T172 PolarHBondContact OD2-N 3.24Å; D129-T172 PolarHBondContact OD2-OG1 3.35Å
130	F	90.4	Very high	88.6	Confident	13 Å²	13	30.7 Å²	30.7	6%	0.057	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.7	178.5	-76.1	-80	0	0	0	110.9	F88 R89 L94 V96 L106 I137 I151 T172	F88-F130 WeakPolarHBondContact O-CD2 3.45Å; R89-F130 HydrophobicContact CB-CD1 4.31Å; R89-F130 HydrophobicContact CB-CD2 3.95Å; R89-F130 HydrophobicContact CB-CE1 4.13Å; R89-F130 HydrophobicContact CB-CE2 3.75Å; R89-F130 HydrophobicContact CB-CG 4.18Å; R89-F130 HydrophobicContact CB-CZ 3.8Å; R89-F130 HydrophobicContact CG-CB 4.43Å; R89-F130 HydrophobicContact CG-CD1 3.86Å; R89-F130 HydrophobicContact CG-CD2 4.26Å; R89-F130 HydrophobicContact CG-CE1 3.98Å; R89-F130 HydrophobicContact CG-CE2 4.36Å; R89-F130 HydrophobicContact CG-CG 3.96Å; R89-F130 HydrophobicContact CG-CZ 4.17Å; R89-F130 VanDerWaalsContact N-CE2 3.34Å; L94-F130 HydrophobicContact CB-CZ 4.11Å; V96-F130 HydrophobicContact CB-CE2 3.95Å; V96-F130 HydrophobicContact CB-CZ 4Å; V96-F130 HydrophobicContact CG2-CE1 3.64Å; V96-F130 HydrophobicContact CG2-CE2 3.61Å; V96-F130 HydrophobicContact CG2-CZ 3.14Å; L106-F130 HydrophobicContact CD1-CE1 4.25Å; L106-F130 HydrophobicContact CD1-CZ 3.94Å; F130-I137 HydrophobicContact CD1-CG1 3.83Å; F130-I137 HydrophobicContact CE1-CD1 4.15Å; F130-I137 HydrophobicContact CE1-CG1 3.81Å; F130-I151 HydrophobicContact CD1-CD1 4.19Å; F130-I151 HydrophobicContact CE1-CD1 3.82Å; F130-T172 PolarHBondContact O-OG1 3.14Å
131	T	86.9	Confident	88.9	Confident	5 Å²	5	29.2 Å²	29.2	3%	0.031	14%	0.142	C	C	.	.			trans	-65.5	158.2	169.6	59.3	0	0	0	0	112	D133 R134 Q136 L148	T131-D133 PolarHBondContact O-N 2.77Å; T131-R134 PolarHBondContact O-N 2.96Å; T131-Q136 HydrophobicContact CG2-CB 3.83Å; T131-Q136 PolarHBondContact N-O 3.02Å; T131-Q136 WeakPolarHBondContact OG1-CB 3.37Å; T131-Q136 PolarHBondContact OG1-N 2.83Å; T131-Q136 PolarHBondContact OG1-O 3.03Å; T131-L148 HydrophobicContact CG2-CD1 3.95Å
132	S	83.6	Confident	88.9	Confident	33 Å²	33	29.6 Å²	29.6	23%	0.231	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-33.3	179.6	63.4	0	0	0	0	114	R134 K174 R177	S132-R134 WeakPolarHBondContact O-CG 3.49Å; S132-R134 PolarHBondContact O-N 2.96Å; S132-K174 WeakPolarHBondContact CB-O 3.42Å; S132-R177 WeakPolarHBondContact OG-CA 3.18Å; S132-R177 PolarHBondContact OG-N 2.95Å
133	D	77.5	Confident	88.9	Confident	55 Å²	55	25.3 Å²	25.3	29%	0.294	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-2.9	179.3	-164	31	0	0	0	113.2	T131 Y135 R177	T131-D133 PolarHBondContact O-N 2.77Å; D133-Y135 HydrophobicContact CB-CD2 4.48Å; D133-Y135 WeakPolarHBondContact O-CD2 3.49Å; D133-Y135 VanDerWaalsContact O-CE2 3.28Å; D133-Y135 WeakPolarHBondContact O-CE2 3.38Å; D133-Y135 PolarHBondContact O-N 3.32Å; D133-R177 HydrophobicContact CB-CB 4.27Å; D133-R177 HydrophobicContact CB-CG 3.7Å; D133-R177 IonicContact OD2-CZ 3.43Å; D133-R177 IonicContact OD2-NE 3.71Å; D133-R177 PolarHBondContact OD2-NE 3.25Å; D133-R177 IonicContact OD2-NH1 2.71Å; D133-R177 PolarHBondContact OD2-NH1 2.79Å; D133-R177 IonicContact OD2-NH2 3.46Å
134	R	81.9	Confident	88.7	Confident	103 Å²	103	25.2 Å²	25.2	39%	0.389	12%	0.115	S	C	.	.	S	Bend	trans	66.2	-9.6	172.1	-40.7	-175.7	-162.5	-155.8	-5.8	116	R89 S90 D91 T131 S132 I151	R89-R134 HydrophobicContact CG-CB 4.27Å; S90-R134 WeakPolarHBondContact OG-CD 3.48Å; S90-R134 WeakPolarHBondContact OG-CG 3.19Å; S90-R134 PolarHBondContact OG-NE 2.93Å; D91-R134 WeakPolarHBondContact OD1-CD 3.45Å; D91-R134 IonicContact OD1-NH1 3.27Å; D91-R134 IonicContact OD2-CZ 3.98Å; D91-R134 IonicContact OD2-NH1 3.51Å; D91-R134 PolarHBondContact OD2-NH1 3.48Å; T131-R134 PolarHBondContact O-N 2.96Å; S132-R134 WeakPolarHBondContact O-CG 3.49Å; S132-R134 PolarHBondContact O-N 2.96Å; R134-I151 VanDerWaalsContact O-CD1 3.26Å; R134-I151 WeakPolarHBondContact O-CD1 3.35Å
135	Y	86.2	Confident	88.7	Confident	132 Å²	132	25.4 Å²	25.4	52%	0.518	12%	0.116	S	C	.	.	S	Bend	trans	-91.6	-20.2	178.8	-59.6	-69.7	0	0	0	113.2	D133 I151	D133-Y135 HydrophobicContact CB-CD2 4.48Å; D133-Y135 WeakPolarHBondContact O-CD2 3.49Å; D133-Y135 VanDerWaalsContact O-CE2 3.28Å; D133-Y135 WeakPolarHBondContact O-CE2 3.38Å; D133-Y135 PolarHBondContact O-N 3.32Å; Y135-I151 VanDerWaalsContact O-CB 3.24Å; Y135-I151 WeakPolarHBondContact O-CB 3.44Å; Y135-I151 WeakPolarHBondContact O-CD1 3.32Å; Y135-I151 WeakPolarHBondContact O-CG1 3.46Å; Y135-I151 PolarHBondContact O-N 3.2Å
136	Q	89.8	Confident	88.6	Confident	11 Å²	11	25.4 Å²	25.4	5%	0.051	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	146.9	-177.1	-54.5	171.2	-42	0	0	112.6	T131 L148 W149 L157 R177	T131-Q136 HydrophobicContact CG2-CB 3.83Å; T131-Q136 PolarHBondContact N-O 3.02Å; T131-Q136 WeakPolarHBondContact OG1-CB 3.37Å; T131-Q136 PolarHBondContact OG1-N 2.83Å; T131-Q136 PolarHBondContact OG1-O 3.03Å; Q136-L148 HydrophobicContact CB-CD1 3.91Å; Q136-L148 HydrophobicContact CB-CG 4.28Å; Q136-W149 CarbonylContact C-O 3.58Å; Q136-W149 WeakPolarHBondContact CA-O 3.48Å; Q136-W149 WeakPolarHBondContact CB-O 3.24Å; Q136-L157 HydrophobicContact CG-CD1 4.01Å; Q136-R177 VanDerWaalsContact CD-NH2 3.25Å
137	I	91.2	Very high	88.6	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.4	176.2	-61.2	164.3	0	0	0	108.6	V96 L106 F118 D129 F130 T139 L148 W149 I151	V96-I137 HydrophobicContact CG1-CG2 4.14Å; V96-I137 HydrophobicContact CG2-CD1 3.5Å; V96-I137 HydrophobicContact CG2-CG1 4.08Å; V96-I137 HydrophobicContact CG2-CG2 4.49Å; L106-I137 HydrophobicContact CD1-CD1 4.43Å; F118-I137 HydrophobicContact CE2-CD1 3.56Å; F118-I137 HydrophobicContact CZ-CD1 3.66Å; D129-I137 WeakPolarHBondContact O-CA 3.42Å; F130-I137 HydrophobicContact CD1-CG1 3.83Å; F130-I137 HydrophobicContact CE1-CD1 4.15Å; F130-I137 HydrophobicContact CE1-CG1 3.81Å; I137-T139 HydrophobicContact CG2-CG2 3.85Å; I137-L148 WeakPolarHBondContact O-CA 3.4Å; I137-W149 HydrophobicContact CB-CB 4.37Å; I137-W149 PolarHBondContact N-O 2.82Å; I137-W149 PolarHBondContact O-N 2.7Å; I137-I151 HydrophobicContact CD1-CD1 3.99Å; I137-I151 HydrophobicContact CD1-CG1 3.56Å; I137-I151 HydrophobicContact CG1-CD1 3.86Å; I137-I151 HydrophobicContact CG1-CG1 3.74Å
138	L	90.7	Very high	88.8	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	134	167.9	-179.3	70.2	0	0	0	109.4	T128 D129 T172 F180 T182	T128-L138 CarbonylContact C-O 3.58Å; T128-L138 VanDerWaalsContact CA-O 3.3Å; T128-L138 WeakPolarHBondContact CA-O 3.45Å; D129-L138 PolarHBondContact N-O 3.1Å; D129-L138 PolarHBondContact O-N 3.29Å; L138-T172 HydrophobicContact CB-CG2 3.83Å; L138-T172 HydrophobicContact CD2-CG2 3.68Å; L138-T172 HydrophobicContact CG-CG2 4.43Å; L138-F180 HydrophobicContact CD1-CD2 3.58Å; L138-F180 HydrophobicContact CD1-CE2 3.74Å; L138-F180 HydrophobicContact CD1-CG 4.12Å; L138-F180 HydrophobicContact CD1-CZ 4.42Å; L138-F180 HydrophobicContact CD2-CB 3.82Å; L138-F180 HydrophobicContact CD2-CD2 3.7Å; L138-F180 HydrophobicContact CD2-CG 4Å; L138-F180 HydrophobicContact CG-CD2 4.31Å; L138-T182 HydrophobicContact CD2-CG2 4.02Å
139	T	91.3	Very high	88.8	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.2	175.9	61.4	0	0	0	0	110.5	V104 H121 V127 T128 I137 C146 R147 W149	V104-T139 HydrophobicContact CB-CG2 4.38Å; V104-T139 HydrophobicContact CG1-CG2 4.18Å; V104-T139 HydrophobicContact CG2-CG2 3.77Å; H121-T139 PolarHBondContact NE2-OG1 3.22Å; V127-T139 CarbonylContact O-C 3.56Å; V127-T139 VanDerWaalsContact O-CA 3.32Å; V127-T139 WeakPolarHBondContact O-CA 3.4Å; T128-T139 HydrophobicContact CG2-CG2 4.24Å; I137-T139 HydrophobicContact CG2-CG2 3.85Å; T139-C146 CarbonylContact O-C 3.56Å; T139-C146 VanDerWaalsContact O-CA 3.28Å; T139-C146 WeakPolarHBondContact O-CA 3.29Å; T139-R147 PolarHBondContact N-O 3Å; T139-R147 PolarHBondContact O-N 3.45Å; T139-R147 PolarHBondContact OG1-O 3.33Å; T139-W149 PolarHBondContact OG1-NE1 3.38Å
140	G	90.6	Very high	88.9	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.01	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.7	176.1	0	0	0	0	0	110.2	V125 H126 V127	V125-G140 WeakPolarHBondContact CG1-O 3.37Å; H126-G140 PolarHBondContact N-O 3.1Å; H126-G140 VanDerWaalsContact N-O 3.14Å; V127-G140 PolarHBondContact N-O 3.37Å; V127-G140 PolarHBondContact O-N 3.49Å
141	S	91.3	Very high	88.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	161.3	-169.1	172.8	0	0	0	0	112.5	H121 K123 A124 D143 Y144 T145	H121-S141 VanDerWaalsContact ND1-CB 3.3Å; H121-S141 WeakPolarHBondContact ND1-CB 3.39Å; K123-S141 PolarHBondContact O-OG 3.42Å; A124-S141 VanDerWaalsContact O-CA 3.3Å; A124-S141 WeakPolarHBondContact O-CA 3.28Å; A124-S141 PolarHBondContact O-OG 2.88Å; A124-S141 VanDerWaalsContact O-OG 3.05Å; S141-D143 WeakPolarHBondContact CB-OD1 3.24Å; S141-D143 PolarHBondContact O-N 2.65Å; S141-D143 VanDerWaalsContact OG-CG 3.26Å; S141-D143 PolarHBondContact OG-N 3.15Å; S141-D143 PolarHBondContact OG-OD1 3.32Å; S141-Y144 PolarHBondContact O-N 3.47Å; S141-T145 PolarHBondContact N-O 3.12Å
142	D	90.8	Very high	88.9	Confident	17 Å²	17	27.9 Å²	27.9	9%	0.091	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-3.4	171.4	-77.4	-11	0	0	0	112.7	K123 A124 H126 Y144 Y166 R168	K123-D142 HydrophobicContact CB-CB 3.97Å; K123-D142 HydrophobicContact CD-CB 4.1Å; K123-D142 VanDerWaalsContact CD-O 3.22Å; K123-D142 WeakPolarHBondContact CD-O 3.19Å; K123-D142 PolarHBondContact NZ-O 2.96Å; A124-D142 PolarHBondContact O-N 2.93Å; H126-D142 VanDerWaalsContact CD2-CG 3.43Å; H126-D142 IonicContact CD2-OD1 3.43Å; H126-D142 PolarHBondContact CD2-OD1 2.97Å; H126-D142 IonicContact CD2-OD2 3.91Å; H126-D142 PolarHBondContact CD2-OD2 3.45Å; H126-D142 IonicContact CE1-OD2 3.16Å; H126-D142 VanDerWaalsContact NE2-CG 3.26Å; H126-D142 IonicContact NE2-OD1 3.78Å; H126-D142 PolarHBondContact NE2-OD1 3.38Å; H126-D142 IonicContact NE2-OD2 3.79Å; H126-D142 PolarHBondContact NE2-OD2 3.18Å; D142-Y144 PolarHBondContact O-N 3.17Å; D142-Y166 HydrophobicContact CB-CD1 3.73Å; D142-Y166 HydrophobicContact CB-CE1 4.14Å; D142-Y166 HydrophobicContact CB-CG 4.36Å; D142-Y166 WeakPolarHBondContact O-CD1 3.47Å; D142-Y166 WeakPolarHBondContact O-CE1 3.28Å; D142-Y166 WeakPolarHBondContact OD1-CB 3.22Å; D142-R168 IonicContact OD1-CZ 2.95Å; D142-R168 IonicContact OD1-NE 3.71Å; D142-R168 IonicContact OD1-NH1 3.46Å; D142-R168 IonicContact OD1-NH2 3.97Å; D142-R168 PolarHBondContact OD1-NH2 2.75Å; D142-R168 VanDerWaalsContact OD1-NH2 3.16Å; D142-R168 IonicContact OD2-CZ 3.26Å; D142-R168 IonicContact OD2-NH1 3.07Å; D142-R168 IonicContact OD2-NH2 3.97Å; D142-R168 PolarHBondContact OD2-NH2 3.31Å; D142-R168 VanDerWaalsContact OD2-NH2 3.15Å
143	D	89.9	Confident	89	Confident	18 Å²	18	32.1 Å²	32.1	10%	0.096	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	8.6	170.3	69.3	10.5	0	0	0	113.9	H121 T122 K123 S141 T145 R147	H121-D143 WeakPolarHBondContact CA-OD2 3.31Å; H121-D143 IonicContact CG-OD2 3.97Å; H121-D143 IonicContact ND1-OD1 3.5Å; H121-D143 PolarHBondContact ND1-OD1 3.21Å; H121-D143 IonicContact ND1-OD2 3.75Å; H121-D143 PolarHBondContact ND1-OD2 3.2Å; T122-D143 PolarHBondContact N-OD2 3.48Å; T122-D143 VanDerWaalsContact OG1-CB 3.26Å; T122-D143 WeakPolarHBondContact OG1-CB 3.42Å; K123-D143 HydrophobicContact CB-CB 4.2Å; K123-D143 HydrophobicContact CD-CB 4.42Å; K123-D143 HydrophobicContact CG-CB 4.39Å; S141-D143 WeakPolarHBondContact CB-OD1 3.24Å; S141-D143 PolarHBondContact O-N 2.65Å; S141-D143 VanDerWaalsContact OG-CG 3.26Å; S141-D143 PolarHBondContact OG-N 3.15Å; S141-D143 PolarHBondContact OG-OD1 3.32Å; D143-T145 WeakPolarHBondContact O-CG2 3.04Å; D143-T145 PolarHBondContact O-N 3.17Å; D143-T145 WeakPolarHBondContact OD1-CA 3.24Å; D143-T145 VanDerWaalsContact OD1-CB 3.3Å; D143-T145 WeakPolarHBondContact OD1-CB 3.45Å; D143-T145 PolarHBondContact OD1-N 2.95Å; D143-T145 PolarHBondContact OD1-OG1 3.4Å; D143-T145 PolarHBondContact OD2-OG1 3.1Å; D143-R147 IonicContact OD2-NH2 3.24Å
144	Y	89.4	Confident	89.4	Confident	82 Å²	82	31.3 Å²	31.3	32%	0.322	15%	0.152	S	C	.	.	S	Bend	trans	66.2	9.1	-178.5	-39.3	-43.9	0	0	0	113.7	S141 D142 D165 Y166 I167	S141-Y144 PolarHBondContact O-N 3.47Å; D142-Y144 PolarHBondContact O-N 3.17Å; Y144-D165 VanDerWaalsContact CD1-CA 3.49Å; Y144-D165 WeakPolarHBondContact CD1-O 3.44Å; Y144-D165 VanDerWaalsContact CE1-C 3.49Å; Y144-D165 VanDerWaalsContact CE1-CA 3.48Å; Y144-Y166 AromaticContact CD1-CD1 4Å; Y144-Y166 HydrophobicContact CD1-CD1 4Å; Y144-Y166 HydrophobicContact CD1-CE1 4.48Å; Y144-Y166 AromaticContact CE1-CD1 3.37Å; Y144-Y166 HydrophobicContact CE1-CD1 3.37Å; Y144-Y166 AromaticContact CE1-CE1 3.51Å; Y144-Y166 HydrophobicContact CE1-CE1 3.51Å; Y144-Y166 HydrophobicContact CE1-CG 4.38Å; Y144-I167 VanDerWaalsContact C-CD1 3.46Å
145	T	90	Very high	89.7	Confident	8 Å²	8	28.5 Å²	28.5	5%	0.049	15%	0.151	C	C	.	.			trans	-105.7	134	-179.7	77.7	0	0	0	0	111.5	H121 S141 D143 R147 T159 Y160 R161 I167	H121-T145 PolarHBondContact CE1-OG1 2.99Å; H121-T145 PolarHBondContact ND1-OG1 3.27Å; S141-T145 PolarHBondContact N-O 3.12Å; D143-T145 WeakPolarHBondContact O-CG2 3.04Å; D143-T145 PolarHBondContact O-N 3.17Å; D143-T145 WeakPolarHBondContact OD1-CA 3.24Å; D143-T145 VanDerWaalsContact OD1-CB 3.3Å; D143-T145 WeakPolarHBondContact OD1-CB 3.45Å; D143-T145 PolarHBondContact OD1-N 2.95Å; D143-T145 PolarHBondContact OD1-OG1 3.4Å; D143-T145 PolarHBondContact OD2-OG1 3.1Å; T145-R147 PolarHBondContact OG1-NE 2.87Å; T145-T159 HydrophobicContact CG2-CG2 4.43Å; T145-Y160 WeakPolarHBondContact CA-O 3.31Å; T145-R161 HydrophobicContact CG2-CG 3.77Å; T145-I167 VanDerWaalsContact C-CD1 3.46Å; T145-I167 WeakPolarHBondContact O-CD1 3.43Å
146	C	89.6	Confident	89.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132	161.6	-59.9	0	0	0	0	107.7	T139 Y160 I167 T182	T139-C146 CarbonylContact O-C 3.56Å; T139-C146 VanDerWaalsContact O-CA 3.28Å; T139-C146 WeakPolarHBondContact O-CA 3.29Å; C146-Y160 HydrophobicContact CB-CD2 4.41Å; C146-Y160 PolarHBondContact N-O 3.38Å; C146-Y160 PolarHBondContact O-N 2.99Å; C146-I167 WeakPolarHBondContact SG-CD1 3.4Å; C146-T182 HydrophobicContact CB-CG2 4.35Å; C146-T182 VanDerWaalsContact SG-CG2 3.58Å; C146-T182 PolarHBondContact SG-OG1 3.46Å
147	R	90.8	Very high	89.8	Confident	21 Å²	21	28.7 Å²	28.7	8%	0.079	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	141.5	179.9	-64	-178.7	-173.8	-154.1	15.1	111.1	G120 H121 T139 D143 T145 W149 E156 S158 T159	G120-R147 PolarHBondContact O-NH1 3.37Å; G120-R147 PolarHBondContact O-NH2 3.43Å; H121-R147 VanDerWaalsContact CE1-CD 3.4Å; H121-R147 WeakPolarHBondContact CE1-CD 3.27Å; T139-R147 PolarHBondContact N-O 3Å; T139-R147 PolarHBondContact O-N 3.45Å; T139-R147 PolarHBondContact OG1-O 3.33Å; D143-R147 IonicContact OD2-NH2 3.24Å; T145-R147 PolarHBondContact OG1-NE 2.87Å; R147-W149 HydrophobicContact CB-CZ2 4.31Å; R147-E156 WeakPolarHBondContact CD-OE1 3.49Å; R147-E156 VanDerWaalsContact CG-OE1 3.23Å; R147-E156 WeakPolarHBondContact CG-OE1 3.45Å; R147-E156 IonicContact CZ-OE1 3.61Å; R147-E156 IonicContact CZ-OE2 3.49Å; R147-E156 IonicContact NE-OE1 3.93Å; R147-E156 PolarHBondContact NE-OE1 3.04Å; R147-E156 IonicContact NE-OE2 3.15Å; R147-E156 IonicContact NH1-OE1 3.47Å; R147-E156 PolarHBondContact NH1-OE1 3.3Å; R147-E156 IonicContact NH1-OE2 2.82Å; R147-E156 PolarHBondContact NH1-OE2 3.26Å; R147-S158 WeakPolarHBondContact CA-O 3.47Å; R147-T159 HydrophobicContact CG-CG2 4.06Å
148	L	91	Very high	89.6	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.016	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.5	171.6	-169.7	68.8	0	0	0	108.8	T131 Q136 I137 L157 S158 A196	T131-L148 HydrophobicContact CG2-CD1 3.95Å; Q136-L148 HydrophobicContact CB-CD1 3.91Å; Q136-L148 HydrophobicContact CB-CG 4.28Å; I137-L148 WeakPolarHBondContact O-CA 3.4Å; L148-L157 HydrophobicContact CD2-CD1 4.33Å; L148-L157 HydrophobicContact CG-CD1 4.44Å; L148-L157 PolarHBondContact O-N 3.37Å; L148-S158 PolarHBondContact N-O 2.96Å; L148-A196 HydrophobicContact CD2-CB 4.16Å
149	W	91.8	Very high	89.6	Confident	6 Å²	6	33.1 Å²	33.1	2%	0.023	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.3	-177	-61.2	87.5	0	0	0	110.9	F118 H121 Q136 I137 T139 R147 A155 E156	F118-W149 HydrophobicContact CB-CD2 4.02Å; F118-W149 HydrophobicContact CB-CE3 3.97Å; F118-W149 HydrophobicContact CB-CH2 4.42Å; F118-W149 HydrophobicContact CB-CZ2 4.47Å; F118-W149 HydrophobicContact CB-CZ3 4.17Å; F118-W149 HydrophobicContact CD1-CB 4.01Å; F118-W149 AromaticContact CD1-CD2 3.97Å; F118-W149 HydrophobicContact CD1-CD2 3.97Å; F118-W149 AromaticContact CD1-CE3 3.68Å; F118-W149 HydrophobicContact CD1-CE3 3.68Å; F118-W149 HydrophobicContact CD1-CG 4.13Å; F118-W149 HydrophobicContact CD1-CZ3 4.45Å; F118-W149 HydrophobicContact CE1-CB 4.05Å; F118-W149 HydrophobicContact CG-CD2 4.26Å; F118-W149 HydrophobicContact CG-CE3 4.23Å; F118-W149 HydrophobicContact CG-CG 4.45Å; H121-W149 AromaticContact NE2-NE1 3.99Å; Q136-W149 CarbonylContact C-O 3.58Å; Q136-W149 WeakPolarHBondContact CA-O 3.48Å; Q136-W149 WeakPolarHBondContact CB-O 3.24Å; I137-W149 HydrophobicContact CB-CB 4.37Å; I137-W149 PolarHBondContact N-O 2.82Å; I137-W149 PolarHBondContact O-N 2.7Å; T139-W149 PolarHBondContact OG1-NE1 3.38Å; R147-W149 HydrophobicContact CB-CZ2 4.31Å; W149-A155 WeakPolarHBondContact CA-O 3.39Å; W149-E156 HydrophobicContact CE3-CB 3.97Å; W149-E156 HydrophobicContact CH2-CB 4.1Å; W149-E156 HydrophobicContact CZ3-CB 3.74Å
150	D	91.4	Very high	89.5	Confident	22 Å²	22	33.3 Å²	33.3	12%	0.118	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	123.5	168.7	-171	39.3	0	0	0	110.5	P152 N153 A154 A155 L157	D150-P152 VanDerWaalsContact OD1-CD 3.29Å; D150-P152 WeakPolarHBondContact OD1-CD 3.25Å; D150-N153 PolarHBondContact OD2-ND2 3.23Å; D150-A154 VanDerWaalsContact O-CA 3.31Å; D150-A154 WeakPolarHBondContact O-CA 3.48Å; D150-A154 PolarHBondContact O-N 2.84Å; D150-A155 PolarHBondContact N-O 3.26Å; D150-L157 HydrophobicContact CB-CD1 3.94Å; D150-L157 HydrophobicContact CB-CD2 4.1Å; D150-L157 HydrophobicContact CB-CG 3.93Å
151	I	90.1	Very high	89.3	Confident	13 Å²	13	42.1 Å²	42.1	7%	0.067	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-53	-177	-66.3	165.4	0	0	0	111.4	L106 R116 F118 F130 R134 Y135 I137 N153 A154	L106-I151 HydrophobicContact CD2-CG2 3.7Å; R116-I151 VanDerWaalsContact CD-O 3.26Å; R116-I151 WeakPolarHBondContact CD-O 3.49Å; R116-I151 VanDerWaalsContact CZ-O 3.28Å; R116-I151 PolarHBondContact NE-O 3.09Å; R116-I151 VanDerWaalsContact NH1-C 3.32Å; R116-I151 PolarHBondContact NH1-O 3.13Å; F118-I151 HydrophobicContact CZ-CG1 4.41Å; F130-I151 HydrophobicContact CD1-CD1 4.19Å; F130-I151 HydrophobicContact CE1-CD1 3.82Å; R134-I151 VanDerWaalsContact O-CD1 3.26Å; R134-I151 WeakPolarHBondContact O-CD1 3.35Å; Y135-I151 VanDerWaalsContact O-CB 3.24Å; Y135-I151 WeakPolarHBondContact O-CB 3.44Å; Y135-I151 WeakPolarHBondContact O-CD1 3.32Å; Y135-I151 WeakPolarHBondContact O-CG1 3.46Å; Y135-I151 PolarHBondContact O-N 3.2Å; I137-I151 HydrophobicContact CD1-CD1 3.99Å; I137-I151 HydrophobicContact CD1-CG1 3.56Å; I137-I151 HydrophobicContact CG1-CD1 3.86Å; I137-I151 HydrophobicContact CG1-CG1 3.74Å; I151-N153 PolarHBondContact O-N 3.04Å; I151-A154 PolarHBondContact O-N 2.84Å
152	P	88.3	Confident	88.9	Confident	58 Å²	58	45.6 Å²	45.6	38%	0.377	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-46.4	-178.4	-28.2	37.4	0	0	0	114.1	R116 D150	R116-P152 PolarHBondContact NH1-O 2.89Å; R116-P152 PolarHBondContact NH2-O 3.33Å; D150-P152 VanDerWaalsContact OD1-CD 3.29Å; D150-P152 WeakPolarHBondContact OD1-CD 3.25Å
153	N	86.3	Confident	88.6	Confident	122 Å²	122	45.3 Å²	45.3	65%	0.652	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-8.6	-174	-64.6	-53.6	0	0	0	113.6	D150 I151 A155	D150-N153 PolarHBondContact OD2-ND2 3.23Å; I151-N153 PolarHBondContact O-N 3.04Å; N153-A155 HydrophobicContact CB-CB 3.99Å; N153-A155 PolarHBondContact O-N 3.41Å; N153-A155 VanDerWaalsContact O-N 3.1Å
154	A	86	Confident	88.5	Confident	38 Å²	38	49.5 Å²	49.5	31%	0.314	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	25.1	-169.7	0	0	0	0	0	113.4	F118 D150 I151	F118-A154 HydrophobicContact CD1-CB 4.23Å; F118-A154 HydrophobicContact CE1-CB 4.15Å; D150-A154 VanDerWaalsContact O-CA 3.31Å; D150-A154 WeakPolarHBondContact O-CA 3.48Å; D150-A154 PolarHBondContact O-N 2.84Å; I151-A154 PolarHBondContact O-N 2.84Å
155	A	87.9	Confident	88.4	Confident	45 Å²	45	46.4 Å²	46.4	37%	0.372	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	148.7	-173.9	0	0	0	0	0	110.5	W149 D150 N153	W149-A155 WeakPolarHBondContact CA-O 3.39Å; D150-A155 PolarHBondContact N-O 3.26Å; N153-A155 HydrophobicContact CB-CB 3.99Å; N153-A155 PolarHBondContact O-N 3.41Å; N153-A155 VanDerWaalsContact O-N 3.1Å
156	E	89.1	Confident	88.4	Confident	63 Å²	63	49.6 Å²	49.6	29%	0.294	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	127.4	170.7	-177.6	171.7	-176.9	0	0	109.3	R147 W149 T159	R147-E156 WeakPolarHBondContact CD-OE1 3.49Å; R147-E156 VanDerWaalsContact CG-OE1 3.23Å; R147-E156 WeakPolarHBondContact CG-OE1 3.45Å; R147-E156 IonicContact CZ-OE1 3.61Å; R147-E156 IonicContact CZ-OE2 3.49Å; R147-E156 IonicContact NE-OE1 3.93Å; R147-E156 PolarHBondContact NE-OE1 3.04Å; R147-E156 IonicContact NE-OE2 3.15Å; R147-E156 IonicContact NH1-OE1 3.47Å; R147-E156 PolarHBondContact NH1-OE1 3.3Å; R147-E156 IonicContact NH1-OE2 2.82Å; R147-E156 PolarHBondContact NH1-OE2 3.26Å; W149-E156 HydrophobicContact CE3-CB 3.97Å; W149-E156 HydrophobicContact CH2-CB 4.1Å; W149-E156 HydrophobicContact CZ3-CB 3.74Å; E156-T159 WeakPolarHBondContact OE1-CB 3.38Å; E156-T159 PolarHBondContact OE1-OG1 3.27Å
157	L	88.1	Confident	88.4	Confident	84 Å²	84	49.7 Å²	49.7	44%	0.44	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-44.9	178.1	-66.9	174.8	0	0	0	111.7	Q136 L148 D150	Q136-L157 HydrophobicContact CG-CD1 4.01Å; L148-L157 HydrophobicContact CD2-CD1 4.33Å; L148-L157 HydrophobicContact CG-CD1 4.44Å; L148-L157 PolarHBondContact O-N 3.37Å; D150-L157 HydrophobicContact CB-CD1 3.94Å; D150-L157 HydrophobicContact CB-CD2 4.1Å; D150-L157 HydrophobicContact CB-CG 3.93Å
158	S	87.4	Confident	88.1	Confident	36 Å²	36	52.5 Å²	52.5	25%	0.252	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	140	-175.1	-49.2	0	0	0	0	110.9	R147 L148	R147-S158 WeakPolarHBondContact CA-O 3.47Å; L148-S158 PolarHBondContact N-O 2.96Å
159	T	89.9	Confident	87.9	Confident	58 Å²	58	52.9 Å²	52.9	36%	0.356	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.7	175.2	-36.9	0	0	0	0	109.4	T145 R147 E156 R161	T145-T159 HydrophobicContact CG2-CG2 4.43Å; R147-T159 HydrophobicContact CG-CG2 4.06Å; E156-T159 WeakPolarHBondContact OE1-CB 3.38Å; E156-T159 PolarHBondContact OE1-OG1 3.27Å; T159-R161 HydrophobicContact CG2-CG 4.07Å
160	Y	88.9	Confident	87.6	Confident	4 Å²	4	53 Å²	53	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.8	175.3	-55.9	-83.3	0	0	0	109.4	T145 C146 F180 F194 A196 A198	T145-Y160 WeakPolarHBondContact CA-O 3.31Å; C146-Y160 HydrophobicContact CB-CD2 4.41Å; C146-Y160 PolarHBondContact N-O 3.38Å; C146-Y160 PolarHBondContact O-N 2.99Å; Y160-F180 HydrophobicContact CD2-CE2 4.15Å; Y160-F180 AromaticContact CD2-CZ 3.76Å; Y160-F180 HydrophobicContact CD2-CZ 3.76Å; Y160-F180 HydrophobicContact CE1-CZ 4.32Å; Y160-F180 HydrophobicContact CE2-CE1 4.15Å; Y160-F180 HydrophobicContact CE2-CE2 4.16Å; Y160-F180 AromaticContact CE2-CZ 3.33Å; Y160-F180 HydrophobicContact CE2-CZ 3.33Å; Y160-F180 HydrophobicContact CG-CZ 4.44Å; Y160-F180 AromaticContact CZ-CZ 3.64Å; Y160-F194 AromaticContact CD1-CD1 3.68Å; Y160-F194 HydrophobicContact CD1-CD1 3.68Å; Y160-F194 AromaticContact CD1-CE1 3.94Å; Y160-F194 HydrophobicContact CD1-CE1 3.94Å; Y160-F194 HydrophobicContact CE1-CD1 4.19Å; Y160-F194 HydrophobicContact CG-CD1 4.07Å; Y160-F194 HydrophobicContact CG-CE1 4.16Å; Y160-A196 WeakPolarHBondContact OH-CA 3.2Å; Y160-A196 PolarHBondContact OH-O 3.2Å; Y160-A198 WeakPolarHBondContact CE1-O 3.43Å
161	R	87.4	Confident	87.3	Confident	186 Å²	186	52.9 Å²	52.9	70%	0.702	28%	0.279	S	S	*	.			trans	-121.4	51.4	-177.9	-58.2	-165.3	179.6	166.6	0.8	111.6	T145 T159	T145-R161 HydrophobicContact CG2-CG 3.77Å; T159-R161 HydrophobicContact CG2-CG 4.07Å
162	E	83.4	Confident	87	Confident	74 Å²	74	52.7 Å²	52.7	35%	0.346	28%	0.279	S	S	.	.			trans	-101.9	-21.7	-175.9	-72.3	-67	154	0	0	112.5	K192 F194	E162-K192 HydrophobicContact CB-CD 4.12Å; E162-K192 PolarHBondContact O-NZ 2.75Å; E162-K192 IonicContact OE2-NZ 2.89Å; E162-F194 HydrophobicContact CB-CE1 4.26Å; E162-F194 HydrophobicContact CB-CZ 4.09Å; E162-F194 HydrophobicContact CG-CE1 4.17Å
163	H	84.3	Confident	86.7	Confident	10 Å²	10	50 Å²	50	5%	0.046	26%	0.261	C	S	.	.			trans	-77.6	142.1	177.5	-70.4	-65.5	0	0	0	110.2	I167 T182 S184 F194	H163-I167 HydrophobicContact CB-CD1 4.46Å; H163-I167 HydrophobicContact CB-CG1 4.2Å; H163-T182 PolarHBondContact NE2-OG1 3.15Å; H163-S184 WeakPolarHBondContact ND1-CB 3.33Å; H163-F194 AromaticContact NE2-CE2 3.9Å
164	T	86.7	Confident	86.3	Confident	106 Å²	106	52.9 Å²	52.9	65%	0.65	27%	0.268	S	S	*	.	S	Bend	trans	-93.8	-15.6	179	48.8	0	0	0	0	112.5	D188	T164-D188 VanDerWaalsContact OG1-CB 3.25Å; T164-D188 WeakPolarHBondContact OG1-CB 3.4Å; T164-D188 PolarHBondContact OG1-OD2 3.46Å
165	D	88.8	Confident	86.1	Confident	17 Å²	17	56.9 Å²	56.9	9%	0.091	28%	0.283	C	S	.	.	S	Bend	trans	-139.8	-175.7	-178.6	-156.7	-3	0	0	0	112.1	Y144 I167 S184 S186 Y187 D188	Y144-D165 VanDerWaalsContact CD1-CA 3.49Å; Y144-D165 WeakPolarHBondContact CD1-O 3.44Å; Y144-D165 VanDerWaalsContact CE1-C 3.49Å; Y144-D165 VanDerWaalsContact CE1-CA 3.48Å; D165-I167 PolarHBondContact O-N 3.12Å; D165-S184 PolarHBondContact O-OG 3.49Å; D165-S186 VanDerWaalsContact CB-O 3.3Å; D165-S186 WeakPolarHBondContact CB-O 3.08Å; D165-S186 WeakPolarHBondContact OD2-CB 3.45Å; D165-S186 PolarHBondContact OD2-OG 3.24Å; D165-Y187 WeakPolarHBondContact OD2-CB 3.41Å; D165-Y187 WeakPolarHBondContact OD2-CD2 3.47Å; D165-Y187 PolarHBondContact OD2-N 3.44Å; D165-D188 PolarHBondContact N-OD2 3.05Å
166	Y	89.2	Confident	85.6	Confident	76 Å²	76	59 Å²	59	30%	0.298	29%	0.289	S	S	.	.			trans	-59.1	129.1	-171.2	-59.4	-32.4	0	0	0	114.2	D142 Y144 R168 S184 G185	D142-Y166 HydrophobicContact CB-CD1 3.73Å; D142-Y166 HydrophobicContact CB-CE1 4.14Å; D142-Y166 HydrophobicContact CB-CG 4.36Å; D142-Y166 WeakPolarHBondContact O-CD1 3.47Å; D142-Y166 WeakPolarHBondContact O-CE1 3.28Å; D142-Y166 WeakPolarHBondContact OD1-CB 3.22Å; Y144-Y166 AromaticContact CD1-CD1 4Å; Y144-Y166 HydrophobicContact CD1-CD1 4Å; Y144-Y166 HydrophobicContact CD1-CE1 4.48Å; Y144-Y166 AromaticContact CE1-CD1 3.37Å; Y144-Y166 HydrophobicContact CE1-CD1 3.37Å; Y144-Y166 AromaticContact CE1-CE1 3.51Å; Y144-Y166 HydrophobicContact CE1-CE1 3.51Å; Y144-Y166 HydrophobicContact CE1-CG 4.38Å; Y166-R168 VanDerWaalsContact CD2-NH2 3.29Å; Y166-R168 PolarHBondContact O-N 3.15Å; Y166-S184 CarbonylContact O-C 3.54Å; Y166-S184 WeakPolarHBondContact O-CA 3.41Å; Y166-S184 PolarHBondContact O-OG 3.08Å; Y166-G185 PolarHBondContact O-N 2.9Å
167	I	88.9	Confident	84.7	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	104.6	174.8	-60.7	147.4	0	0	0	109.2	V127 Y144 T145 C146 H163 D165	V127-I167 HydrophobicContact CG2-CG2 4.38Å; Y144-I167 VanDerWaalsContact C-CD1 3.46Å; T145-I167 VanDerWaalsContact C-CD1 3.46Å; T145-I167 WeakPolarHBondContact O-CD1 3.43Å; C146-I167 WeakPolarHBondContact SG-CD1 3.4Å; H163-I167 HydrophobicContact CB-CD1 4.46Å; H163-I167 HydrophobicContact CB-CG1 4.2Å; D165-I167 PolarHBondContact O-N 3.12Å
168	R	85.9	Confident	84.1	Confident	81 Å²	81	59 Å²	59	31%	0.306	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-29.8	-178.2	-61.6	-69.6	171.3	-179	-16.3	113.7	H126 V127 D142 Y166	H126-R168 PolarHBondContact CE1-NH1 3.29Å; H126-R168 PolarHBondContact ND1-NH1 2.87Å; H126-R168 PolarHBondContact NE2-NH1 3.47Å; V127-R168 WeakPolarHBondContact CG2-O 3.32Å; D142-R168 IonicContact OD1-CZ 2.95Å; D142-R168 IonicContact OD1-NE 3.71Å; D142-R168 IonicContact OD1-NH1 3.46Å; D142-R168 IonicContact OD1-NH2 3.97Å; D142-R168 PolarHBondContact OD1-NH2 2.75Å; D142-R168 VanDerWaalsContact OD1-NH2 3.16Å; D142-R168 IonicContact OD2-CZ 3.26Å; D142-R168 IonicContact OD2-NH1 3.07Å; D142-R168 IonicContact OD2-NH2 3.97Å; D142-R168 PolarHBondContact OD2-NH2 3.31Å; D142-R168 VanDerWaalsContact OD2-NH2 3.15Å; Y166-R168 VanDerWaalsContact CD2-NH2 3.29Å; Y166-R168 PolarHBondContact O-N 3.15Å
169	C	85.4	Confident	83.7	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.074	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	151.1	178.4	59.3	0	0	0	0	112.8	V127 A183 V211 E212	V127-C169 VanDerWaalsContact CG2-CA 3.43Å; C169-A183 PolarHBondContact O-N 3.43Å; C169-A183 WeakPolarHBondContact SG-CB 3.42Å; C169-V211 PolarHBondContact SG-O 3.35Å; C169-E212 WeakPolarHBondContact CB-O 3.44Å
170	G	86.1	Confident	83.2	Confident	8 Å²	8	56.6 Å²	56.6	8%	0.082	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	152.1	178.2	0	0	0	0	0	109.6	I181	G170-I181 CarbonylContact C-O 3.58Å; G170-I181 VanDerWaalsContact CA-O 3.29Å; G170-I181 WeakPolarHBondContact CA-O 3.18Å
171	V	85.2	Confident	82.5	Confident	19 Å²	19	56.5 Å²	56.5	12%	0.115	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	136.5	-177.6	65.4	0	0	0	0	109.1	I181 L214 L216 L223	V171-I181 HydrophobicContact CG1-CB 4.16Å; V171-I181 PolarHBondContact N-O 2.99Å; V171-I181 PolarHBondContact O-N 2.88Å; V171-I181 VanDerWaalsContact O-O 3.11Å; V171-L214 HydrophobicContact CG1-CB 4.11Å; V171-L216 HydrophobicContact CG1-CB 4.28Å; V171-L216 HydrophobicContact CG2-CB 4.32Å; V171-L223 HydrophobicContact CG1-CD1 4.5Å
172	T	84.4	Confident	81.8	Confident	10 Å²	10	47.7 Å²	47.7	6%	0.061	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	152.3	172.7	59.8	0	0	0	0	110.8	D129 F130 L138 F180	D129-T172 HydrophobicContact CB-CG2 3.98Å; D129-T172 VanDerWaalsContact CG-OG1 3.27Å; D129-T172 WeakPolarHBondContact OD2-CB 3.47Å; D129-T172 PolarHBondContact OD2-N 3.24Å; D129-T172 PolarHBondContact OD2-OG1 3.35Å; F130-T172 PolarHBondContact O-OG1 3.14Å; L138-T172 HydrophobicContact CB-CG2 3.83Å; L138-T172 HydrophobicContact CD2-CG2 3.68Å; L138-T172 HydrophobicContact CG-CG2 4.43Å; T172-F180 HydrophobicContact CG2-CB 4.08Å
173	S	82.3	Confident	81	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.014	22%	0.216	C	C	.	.			trans	-72.7	142.7	170.2	158.1	0	0	0	0	110.4	L175 N176 L179 E220	S173-L175 PolarHBondContact OG-N 3.5Å; S173-N176 WeakPolarHBondContact CB-O 3.36Å; S173-N176 WeakPolarHBondContact OG-CA 3.49Å; S173-N176 WeakPolarHBondContact OG-CB 3.38Å; S173-N176 PolarHBondContact OG-N 3.44Å; S173-N176 PolarHBondContact OG-O 3.23Å; S173-L179 VanDerWaalsContact CB-O 3.27Å; S173-L179 WeakPolarHBondContact CB-O 3.32Å; S173-L179 PolarHBondContact N-O 2.86Å; S173-L179 VanDerWaalsContact N-O 3.09Å; S173-E220 WeakPolarHBondContact CB-OE1 3.42Å; S173-E220 PolarHBondContact OG-OE1 3.1Å; S173-E220 PolarHBondContact OG-OE2 2.75Å
174	K	77.8	Confident	79.9	Confident	182 Å²	182	43.7 Å²	43.7	79%	0.791	21%	0.213	S	C	*	.	S	Bend	trans	-90.5	-24.4	179.1	-68.1	-174.8	-179.8	-179.4	0	112.3	S132 E220	S132-K174 WeakPolarHBondContact CB-O 3.42Å; K174-E220 PolarHBondContact N-OE1 3.39Å
175	L	80.1	Confident	78.4	Confident	122 Å²	122	39 Å²	39	64%	0.639	19%	0.186	S	C	*	.	S	Bend	trans	-92.1	-44.5	177.7	-58.6	167.3	0	0	0	111.1	S173 E220	S173-L175 PolarHBondContact OG-N 3.5Å; L175-E220 VanDerWaalsContact CB-OE1 3.22Å; L175-E220 WeakPolarHBondContact CB-OE1 3.29Å; L175-E220 HydrophobicContact CD1-CG 3.9Å; L175-E220 HydrophobicContact CG-CG 4.44Å; L175-E220 WeakPolarHBondContact CG-OE1 3.27Å; L175-E220 PolarHBondContact N-OE1 2.88Å
176	N	77.6	Confident	76.9	Confident	90 Å²	90	39.3 Å²	39.3	48%	0.481	19%	0.189	S	C	.	.			trans	-102.7	121.6	-176.7	-66.7	-53.5	0	0	0	111	S173 D178 L179 E220	S173-N176 WeakPolarHBondContact CB-O 3.36Å; S173-N176 WeakPolarHBondContact OG-CA 3.49Å; S173-N176 WeakPolarHBondContact OG-CB 3.38Å; S173-N176 PolarHBondContact OG-N 3.44Å; S173-N176 PolarHBondContact OG-O 3.23Å; N176-D178 VanDerWaalsContact C-N 3.32Å; N176-D178 PolarHBondContact O-N 3.1Å; N176-L179 HydrophobicContact CB-CB 4.05Å; N176-E220 PolarHBondContact ND2-OE2 3.39Å
177	R	71.4	Confident	75.7	Confident	98 Å²	98	45.1 Å²	45.1	37%	0.37	21%	0.212	S	C	.	.	S	Bend	trans	-63.6	-39.9	179.1	178	-169.8	173.2	176.5	-16.7	112.3	S132 D133 Q136	S132-R177 WeakPolarHBondContact OG-CA 3.18Å; S132-R177 PolarHBondContact OG-N 2.95Å; D133-R177 HydrophobicContact CB-CB 4.27Å; D133-R177 HydrophobicContact CB-CG 3.7Å; D133-R177 IonicContact OD2-CZ 3.43Å; D133-R177 IonicContact OD2-NE 3.71Å; D133-R177 PolarHBondContact OD2-NE 3.25Å; D133-R177 IonicContact OD2-NH1 2.71Å; D133-R177 PolarHBondContact OD2-NH1 2.79Å; D133-R177 IonicContact OD2-NH2 3.46Å; Q136-R177 VanDerWaalsContact CD-NH2 3.25Å
178	D	74.5	Confident	75	Confident	47 Å²	47	46.2 Å²	46.2	25%	0.251	22%	0.218	S	C	.	.	S	Bend	trans	-85.3	-17.1	-168.3	-55.6	-30.3	0	0	0	112.3	N176 D195 A196 R197	N176-D178 VanDerWaalsContact C-N 3.32Å; N176-D178 PolarHBondContact O-N 3.1Å; D178-D195 WeakPolarHBondContact CB-OD1 3.48Å; D178-D195 CarbonylContact O-C 3.56Å; D178-D195 VanDerWaalsContact O-CA 3.31Å; D178-D195 WeakPolarHBondContact O-CA 3.49Å; D178-A196 HydrophobicContact CB-CB 4.02Å; D178-A196 PolarHBondContact O-N 2.87Å; D178-R197 HydrophobicContact CB-CG 4.39Å; D178-R197 WeakPolarHBondContact OD2-CD 3.15Å; D178-R197 IonicContact OD2-CZ 3.9Å; D178-R197 IonicContact OD2-NE 3.04Å; D178-R197 PolarHBondContact OD2-NE 3.42Å
179	L	79.8	Confident	75	Confident	41 Å²	41	44.7 Å²	44.7	22%	0.215	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.4	-178.2	-176.9	65.6	0	0	0	110.9	S173 N176 V193	S173-L179 VanDerWaalsContact CB-O 3.27Å; S173-L179 WeakPolarHBondContact CB-O 3.32Å; S173-L179 PolarHBondContact N-O 2.86Å; S173-L179 VanDerWaalsContact N-O 3.09Å; N176-L179 HydrophobicContact CB-CB 4.05Å; L179-V193 HydrophobicContact CD1-CG1 3.48Å; L179-V193 VanDerWaalsContact CD1-CG1 3.48Å
180	F	78.3	Confident	75.1	Confident	3 Å²	3	45.2 Å²	45.2	1%	0.013	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	149.5	168.7	61.5	-84.4	0	0	0	111.3	L138 Y160 T172 T182 F194 A196	L138-F180 HydrophobicContact CD1-CD2 3.58Å; L138-F180 HydrophobicContact CD1-CE2 3.74Å; L138-F180 HydrophobicContact CD1-CG 4.12Å; L138-F180 HydrophobicContact CD1-CZ 4.42Å; L138-F180 HydrophobicContact CD2-CB 3.82Å; L138-F180 HydrophobicContact CD2-CD2 3.7Å; L138-F180 HydrophobicContact CD2-CG 4Å; L138-F180 HydrophobicContact CG-CD2 4.31Å; Y160-F180 HydrophobicContact CD2-CE2 4.15Å; Y160-F180 AromaticContact CD2-CZ 3.76Å; Y160-F180 HydrophobicContact CD2-CZ 3.76Å; Y160-F180 HydrophobicContact CE1-CZ 4.32Å; Y160-F180 HydrophobicContact CE2-CE1 4.15Å; Y160-F180 HydrophobicContact CE2-CE2 4.16Å; Y160-F180 AromaticContact CE2-CZ 3.33Å; Y160-F180 HydrophobicContact CE2-CZ 3.33Å; Y160-F180 HydrophobicContact CG-CZ 4.44Å; Y160-F180 AromaticContact CZ-CZ 3.64Å; T172-F180 HydrophobicContact CG2-CB 4.08Å; F180-T182 HydrophobicContact CD2-CG2 4.06Å; F180-T182 HydrophobicContact CE2-CG2 4.48Å; F180-F194 HydrophobicContact CD1-CB 4.3Å; F180-F194 HydrophobicContact CD2-CB 3.83Å; F180-F194 HydrophobicContact CD2-CD2 4.32Å; F180-F194 HydrophobicContact CD2-CG 4.4Å; F180-F194 HydrophobicContact CE1-CB 3.8Å; F180-F194 HydrophobicContact CE2-CB 3.29Å; F180-F194 AromaticContact CE2-CD2 3.85Å; F180-F194 HydrophobicContact CE2-CD2 3.85Å; F180-F194 AromaticContact CE2-CG 3.67Å; F180-F194 HydrophobicContact CE2-CG 3.67Å; F180-F194 HydrophobicContact CG-CB 4.29Å; F180-F194 HydrophobicContact CZ-CB 3.24Å; F180-F194 AromaticContact CZ-CG 3.93Å; F180-F194 HydrophobicContact CZ-CG 3.93Å; F180-F194 PolarHBondContact N-O 3.44Å; F180-F194 PolarHBondContact O-N 2.88Å; F180-F194 VanDerWaalsContact O-O 3.08Å; F180-A196 HydrophobicContact CE1-CB 4.06Å
181	I	74.9	Confident	75.2	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.8	-174.7	-55.5	176.4	0	0	0	106.7	G170 V171 V193 L214 L216 L223 L237	G170-I181 CarbonylContact C-O 3.58Å; G170-I181 VanDerWaalsContact CA-O 3.29Å; G170-I181 WeakPolarHBondContact CA-O 3.18Å; V171-I181 HydrophobicContact CG1-CB 4.16Å; V171-I181 PolarHBondContact N-O 2.99Å; V171-I181 PolarHBondContact O-N 2.88Å; V171-I181 VanDerWaalsContact O-O 3.11Å; I181-V193 HydrophobicContact CD1-CG2 4.3Å; I181-V193 HydrophobicContact CG1-CB 4.46Å; I181-V193 HydrophobicContact CG1-CG1 4.15Å; I181-V193 HydrophobicContact CG1-CG2 4.06Å; I181-V193 HydrophobicContact CG2-CG2 4.21Å; I181-L214 HydrophobicContact CG2-CD1 3.98Å; I181-L216 HydrophobicContact CD1-CD1 4.02Å; I181-L223 HydrophobicContact CD1-CD1 3.88Å; I181-L223 HydrophobicContact CD1-CD2 4.24Å; I181-L223 HydrophobicContact CG2-CD1 4.38Å; I181-L223 HydrophobicContact CG2-CD2 4.04Å; I181-L237 HydrophobicContact CD1-CD1 3.76Å; I181-L237 HydrophobicContact CD1-CD2 4.42Å
182	T	72.7	Confident	75.4	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.4	175.6	59.1	0	0	0	0	108.8	L138 C146 H163 F180 K192 F194	L138-T182 HydrophobicContact CD2-CG2 4.02Å; C146-T182 HydrophobicContact CB-CG2 4.35Å; C146-T182 VanDerWaalsContact SG-CG2 3.58Å; C146-T182 PolarHBondContact SG-OG1 3.46Å; H163-T182 PolarHBondContact NE2-OG1 3.15Å; F180-T182 HydrophobicContact CD2-CG2 4.06Å; F180-T182 HydrophobicContact CE2-CG2 4.48Å; T182-K192 PolarHBondContact N-O 3.38Å; T182-K192 PolarHBondContact O-N 3.42Å; T182-F194 WeakPolarHBondContact OG1-CD2 3.25Å; T182-F194 WeakPolarHBondContact OG1-CE2 3.29Å
183	A	66.6	Low	75.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.5	172.9	0	0	0	0	0	108.6	C169 L191 V211 L214	C169-A183 PolarHBondContact O-N 3.43Å; C169-A183 WeakPolarHBondContact SG-CB 3.42Å; A183-L191 HydrophobicContact CB-CD2 3.35Å; A183-V211 HydrophobicContact CB-CB 4.12Å; A183-V211 HydrophobicContact CB-CG1 4.02Å; A183-L214 HydrophobicContact CB-CD1 3.37Å; A183-L214 HydrophobicContact CB-CD2 4.44Å; A183-L214 HydrophobicContact CB-CG 3.86Å
184	S	61.7	Low	75.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	129.8	162	171.5	0	0	0	0	108.4	H163 D165 Y166 S186 D188 T190	H163-S184 WeakPolarHBondContact ND1-CB 3.33Å; D165-S184 PolarHBondContact O-OG 3.49Å; Y166-S184 CarbonylContact O-C 3.54Å; Y166-S184 WeakPolarHBondContact O-CA 3.41Å; Y166-S184 PolarHBondContact O-OG 3.08Å; S184-S186 VanDerWaalsContact C-N 3.35Å; S184-S186 PolarHBondContact OG-O 3.48Å; S184-D188 VanDerWaalsContact CB-CG 3.44Å; S184-D188 WeakPolarHBondContact CB-OD1 3.27Å; S184-D188 WeakPolarHBondContact CB-OD2 3.1Å; S184-D188 PolarHBondContact OG-OD1 3.13Å; S184-D188 PolarHBondContact OG-OD2 3.43Å; S184-T190 PolarHBondContact N-O 3Å; S184-T190 VanDerWaalsContact N-O 3.15Å
185	G	54.4	Low	76.3	Confident	7 Å²	7	37.5 Å²	37.5	7%	0.072	18%	0.18	C	C	.	.			trans	-95.6	12.9	-173.5	0	0	0	0	0	113.1	Y166 P210 V211	Y166-G185 PolarHBondContact O-N 2.9Å; G185-P210 WeakPolarHBondContact O-CB 3.04Å; G185-V211 WeakPolarHBondContact CA-O 3.27Å
186	S	57.8	Low	76.4	Confident	23 Å²	23	32.6 Å²	32.6	16%	0.161	16%	0.158	C	C	.	.	S	Bend	trans	-150.8	148.1	-178	-178.5	0	0	0	0	111	D165 S184 D188	D165-S186 VanDerWaalsContact CB-O 3.3Å; D165-S186 WeakPolarHBondContact CB-O 3.08Å; D165-S186 WeakPolarHBondContact OD2-CB 3.45Å; D165-S186 PolarHBondContact OD2-OG 3.24Å; S184-S186 VanDerWaalsContact C-N 3.35Å; S184-S186 PolarHBondContact OG-O 3.48Å; S186-D188 PolarHBondContact O-N 2.96Å
187	Y	64.1	Low	76.7	Confident	198 Å²	198	37.3 Å²	37.3	78%	0.776	17%	0.169	S	C	*	.	S	Bend	trans	27.3	-28.7	-175.1	-69.2	-73.9	0	0	0	122.6	D165 H189	D165-Y187 WeakPolarHBondContact OD2-CB 3.41Å; D165-Y187 WeakPolarHBondContact OD2-CD2 3.47Å; D165-Y187 PolarHBondContact OD2-N 3.44Å; Y187-H189 VanDerWaalsContact C-N 3.34Å
188	D	74.3	Confident	77.3	Confident	25 Å²	25	34.6 Å²	34.6	13%	0.134	17%	0.167	C	C	.	.	S	Bend	trans	-79.5	-19.3	175.1	69.5	39.8	0	0	0	112.8	T164 D165 S184 S186 T190	T164-D188 VanDerWaalsContact OG1-CB 3.25Å; T164-D188 WeakPolarHBondContact OG1-CB 3.4Å; T164-D188 PolarHBondContact OG1-OD2 3.46Å; D165-D188 PolarHBondContact N-OD2 3.05Å; S184-D188 VanDerWaalsContact CB-CG 3.44Å; S184-D188 WeakPolarHBondContact CB-OD1 3.27Å; S184-D188 WeakPolarHBondContact CB-OD2 3.1Å; S184-D188 PolarHBondContact OG-OD1 3.13Å; S184-D188 PolarHBondContact OG-OD2 3.43Å; S186-D188 PolarHBondContact O-N 2.96Å; D188-T190 HydrophobicContact CB-CG2 4.43Å; D188-T190 WeakPolarHBondContact O-CG2 3.27Å; D188-T190 PolarHBondContact O-N 3.28Å; D188-T190 PolarHBondContact OD1-N 3.18Å; D188-T190 PolarHBondContact OD1-OG1 3.33Å
189	H	85.9	Confident	77.4	Confident	49 Å²	49	40.9 Å²	40.9	23%	0.227	20%	0.195	C	C	.	.			trans	55.8	17.1	177	-52.6	-33.6	0	0	0	114.2	Y187 D206 H207 P210	Y187-H189 VanDerWaalsContact C-N 3.34Å; H189-D206 WeakPolarHBondContact CB-OD1 3.42Å; H189-H207 WeakPolarHBondContact O-CB 3.18Å; H189-H207 PolarHBondContact O-N 3.01Å; H189-P210 VanDerWaalsContact ND1-N 3.17Å
190	T	86.9	Confident	77.4	Confident	22 Å²	22	46.4 Å²	46.4	14%	0.135	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	140.9	-168.7	63.2	0	0	0	0	113.1	S184 D188 T204 M205	S184-T190 PolarHBondContact N-O 3Å; S184-T190 VanDerWaalsContact N-O 3.15Å; D188-T190 HydrophobicContact CB-CG2 4.43Å; D188-T190 WeakPolarHBondContact O-CG2 3.27Å; D188-T190 PolarHBondContact O-N 3.28Å; D188-T190 PolarHBondContact OD1-N 3.18Å; D188-T190 PolarHBondContact OD1-OG1 3.33Å; T190-T204 HydrophobicContact CG2-CG2 4.01Å; T190-M205 WeakPolarHBondContact CA-O 3.26Å
191	L	88.4	Confident	77.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.1	164.6	-50.7	173.7	0	0	0	107.2	A183 T204 M205 V211 L214 L223 W235	A183-L191 HydrophobicContact CB-CD2 3.35Å; L191-T204 CarbonylContact O-C 3.57Å; L191-T204 WeakPolarHBondContact O-CA 3.33Å; L191-M205 HydrophobicContact CB-CB 4.21Å; L191-M205 PolarHBondContact N-O 3.2Å; L191-M205 PolarHBondContact O-N 3.12Å; L191-V211 HydrophobicContact CD2-CB 4.21Å; L191-V211 HydrophobicContact CD2-CG1 3.9Å; L191-V211 HydrophobicContact CD2-CG2 3.81Å; L191-L214 HydrophobicContact CD1-CD2 4.27Å; L191-L214 HydrophobicContact CD2-CD1 4.26Å; L191-L214 HydrophobicContact CD2-CD2 3.54Å; L191-L214 HydrophobicContact CD2-CG 4.23Å; L191-L223 HydrophobicContact CD1-CD2 4.24Å; L191-W235 HydrophobicContact CD1-CZ2 4.27Å
192	K	88.4	Confident	78.1	Confident	24 Å²	24	51.6 Å²	51.6	10%	0.104	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131	176.3	-68	-170.4	176.8	-166.6	0	110.7	E162 T182 F194 M203 T204	E162-K192 HydrophobicContact CB-CD 4.12Å; E162-K192 PolarHBondContact O-NZ 2.75Å; E162-K192 IonicContact OE2-NZ 2.89Å; T182-K192 PolarHBondContact N-O 3.38Å; T182-K192 PolarHBondContact O-N 3.42Å; K192-F194 HydrophobicContact CB-CD2 4.23Å; K192-F194 HydrophobicContact CB-CE2 3.41Å; K192-F194 VanDerWaalsContact CB-CE2 3.41Å; K192-F194 HydrophobicContact CB-CZ 3.81Å; K192-F194 HydrophobicContact CD-CZ 4.14Å; K192-M203 WeakPolarHBondContact CA-O 3.29Å; K192-T204 HydrophobicContact CG-CG2 4.14Å
193	V	89.7	Confident	78.7	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	128.4	175.6	-178.4	0	0	0	0	108.2	L179 I181 V202 M203 M205 L237	L179-V193 HydrophobicContact CD1-CG1 3.48Å; L179-V193 VanDerWaalsContact CD1-CG1 3.48Å; I181-V193 HydrophobicContact CD1-CG2 4.3Å; I181-V193 HydrophobicContact CG1-CB 4.46Å; I181-V193 HydrophobicContact CG1-CG1 4.15Å; I181-V193 HydrophobicContact CG1-CG2 4.06Å; I181-V193 HydrophobicContact CG2-CG2 4.21Å; V193-V202 PolarHBondContact O-N 3.28Å; V193-M203 HydrophobicContact CB-CB 4.16Å; V193-M203 HydrophobicContact CB-CE 4.15Å; V193-M203 HydrophobicContact CG1-CE 4.08Å; V193-M203 HydrophobicContact CG2-CB 4.34Å; V193-M203 HydrophobicContact CG2-CE 4.08Å; V193-M203 PolarHBondContact N-O 3.48Å; V193-M203 PolarHBondContact O-N 2.87Å; V193-M205 HydrophobicContact CG2-SD 4.33Å; V193-L237 HydrophobicContact CG2-CD2 4.06Å
194	F	87.7	Confident	79.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	145	-177.7	-66.8	-87.4	0	0	0	110.6	Y160 E162 H163 F180 T182 K192	Y160-F194 AromaticContact CD1-CD1 3.68Å; Y160-F194 HydrophobicContact CD1-CD1 3.68Å; Y160-F194 AromaticContact CD1-CE1 3.94Å; Y160-F194 HydrophobicContact CD1-CE1 3.94Å; Y160-F194 HydrophobicContact CE1-CD1 4.19Å; Y160-F194 HydrophobicContact CG-CD1 4.07Å; Y160-F194 HydrophobicContact CG-CE1 4.16Å; E162-F194 HydrophobicContact CB-CE1 4.26Å; E162-F194 HydrophobicContact CB-CZ 4.09Å; E162-F194 HydrophobicContact CG-CE1 4.17Å; H163-F194 AromaticContact NE2-CE2 3.9Å; F180-F194 HydrophobicContact CD1-CB 4.3Å; F180-F194 HydrophobicContact CD2-CB 3.83Å; F180-F194 HydrophobicContact CD2-CD2 4.32Å; F180-F194 HydrophobicContact CD2-CG 4.4Å; F180-F194 HydrophobicContact CE1-CB 3.8Å; F180-F194 HydrophobicContact CE2-CB 3.29Å; F180-F194 AromaticContact CE2-CD2 3.85Å; F180-F194 HydrophobicContact CE2-CD2 3.85Å; F180-F194 AromaticContact CE2-CG 3.67Å; F180-F194 HydrophobicContact CE2-CG 3.67Å; F180-F194 HydrophobicContact CG-CB 4.29Å; F180-F194 HydrophobicContact CZ-CB 3.24Å; F180-F194 AromaticContact CZ-CG 3.93Å; F180-F194 HydrophobicContact CZ-CG 3.93Å; F180-F194 PolarHBondContact N-O 3.44Å; F180-F194 PolarHBondContact O-N 2.88Å; F180-F194 VanDerWaalsContact O-O 3.08Å; T182-F194 WeakPolarHBondContact OG1-CD2 3.25Å; T182-F194 WeakPolarHBondContact OG1-CE2 3.29Å; K192-F194 HydrophobicContact CB-CD2 4.23Å; K192-F194 HydrophobicContact CB-CE2 3.41Å; K192-F194 VanDerWaalsContact CB-CE2 3.41Å; K192-F194 HydrophobicContact CB-CZ 3.81Å; K192-F194 HydrophobicContact CD-CZ 4.14Å
195	D	86.8	Confident	81	Confident	32 Å²	32	57.9 Å²	57.9	17%	0.171	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125.7	167.4	-176.5	-26.5	0	0	0	106.7	D178 R197 A198 V202	D178-D195 WeakPolarHBondContact CB-OD1 3.48Å; D178-D195 CarbonylContact O-C 3.56Å; D178-D195 VanDerWaalsContact O-CA 3.31Å; D178-D195 WeakPolarHBondContact O-CA 3.49Å; D195-R197 PolarHBondContact O-N 3.45Å; D195-R197 WeakPolarHBondContact OD1-CB 3.4Å; D195-R197 IonicContact OD1-CZ 3.06Å; D195-R197 PolarHBondContact OD1-N 3.24Å; D195-R197 IonicContact OD1-NE 3.81Å; D195-R197 PolarHBondContact OD1-NE 2.9Å; D195-R197 IonicContact OD1-NH2 3.35Å; D195-R197 IonicContact OD2-CZ 2.72Å; D195-R197 IonicContact OD2-NE 3.87Å; D195-R197 PolarHBondContact OD2-NE 3.09Å; D195-R197 IonicContact OD2-NH2 3.94Å; D195-R197 PolarHBondContact OD2-NH2 2.68Å; D195-A198 HydrophobicContact CB-CB 4.48Å; D195-A198 PolarHBondContact O-N 3.32Å; D195-V202 HydrophobicContact CB-CG2 3.71Å
196	A	82	Confident	82.5	Confident	19 Å²	19	62.3 Å²	62.3	16%	0.157	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-19	-176.3	0	0	0	0	0	113.5	L148 Y160 D178 F180	L148-A196 HydrophobicContact CD2-CB 4.16Å; Y160-A196 WeakPolarHBondContact OH-CA 3.2Å; Y160-A196 PolarHBondContact OH-O 3.2Å; D178-A196 HydrophobicContact CB-CB 4.02Å; D178-A196 PolarHBondContact O-N 2.87Å; F180-A196 HydrophobicContact CE1-CB 4.06Å
197	R	84.3	Confident	83.6	Confident	189 Å²	189	61.4 Å²	61.4	71%	0.713	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-17.8	177.1	-59.5	171.6	-65.8	-176.7	1	112.7	D178 D195	D178-R197 HydrophobicContact CB-CG 4.39Å; D178-R197 WeakPolarHBondContact OD2-CD 3.15Å; D178-R197 IonicContact OD2-CZ 3.9Å; D178-R197 IonicContact OD2-NE 3.04Å; D178-R197 PolarHBondContact OD2-NE 3.42Å; D195-R197 PolarHBondContact O-N 3.45Å; D195-R197 WeakPolarHBondContact OD1-CB 3.4Å; D195-R197 IonicContact OD1-CZ 3.06Å; D195-R197 PolarHBondContact OD1-N 3.24Å; D195-R197 IonicContact OD1-NE 3.81Å; D195-R197 PolarHBondContact OD1-NE 2.9Å; D195-R197 IonicContact OD1-NH2 3.35Å; D195-R197 IonicContact OD2-CZ 2.72Å; D195-R197 IonicContact OD2-NE 3.87Å; D195-R197 PolarHBondContact OD2-NE 3.09Å; D195-R197 IonicContact OD2-NH2 3.94Å; D195-R197 PolarHBondContact OD2-NH2 2.68Å
198	A	84.2	Confident	84.5	Confident	40 Å²	40	53.9 Å²	53.9	33%	0.331	28%	0.284	S	S	.	.			trans	-110.2	134.5	-179.4	0	0	0	0	0	110.1	Y160 D195 K200	Y160-A198 WeakPolarHBondContact CE1-O 3.43Å; D195-A198 HydrophobicContact CB-CB 4.48Å; D195-A198 PolarHBondContact O-N 3.32Å; A198-K200 PolarHBondContact O-N 3.45Å
199	E	76.9	Confident	85	Confident	179 Å²	179	55.3 Å²	55.3	84%	0.836	29%	0.29	S	S	*	.	S	Bend	trans	-73.9	-12	177.3	-64.9	-174.1	164.3	0	0	113.3
200	K	80.2	Confident	85	Confident	157 Å²	157	54.9 Å²	54.9	68%	0.683	29%	0.291	S	S	*	.	S	Bend	trans	-111.6	155.5	-177.7	-65.7	-176	179.9	-179.3	0	111.9	A198 V202	A198-K200 PolarHBondContact O-N 3.45Å; K200-V202 PolarHBondContact O-N 2.95Å
201	S	82.3	Confident	85.1	Confident	29 Å²	29	53.9 Å²	53.9	20%	0.203	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	132.4	172.3	58.6	0	0	0	0	111.2
202	V	85.6	Confident	85	Confident	86 Å²	86	57.4 Å²	57.4	52%	0.521	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-42.5	178.7	-176	0	0	0	0	110.6	V193 D195 K200	V193-V202 PolarHBondContact O-N 3.28Å; D195-V202 HydrophobicContact CB-CG2 3.71Å; K200-V202 PolarHBondContact O-N 2.95Å
203	M	84.2	Confident	84.9	Confident	46 Å²	46	56.9 Å²	56.9	23%	0.227	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	145.2	179.9	-60	-174.4	-74.7	0	0	111.2	K192 V193 L237	K192-M203 WeakPolarHBondContact CA-O 3.29Å; V193-M203 HydrophobicContact CB-CB 4.16Å; V193-M203 HydrophobicContact CB-CE 4.15Å; V193-M203 HydrophobicContact CG1-CE 4.08Å; V193-M203 HydrophobicContact CG2-CB 4.34Å; V193-M203 HydrophobicContact CG2-CE 4.08Å; V193-M203 PolarHBondContact N-O 3.48Å; V193-M203 PolarHBondContact O-N 2.87Å; M203-L237 HydrophobicContact CE-CD2 4.23Å
204	T	88.8	Confident	84.9	Confident	80 Å²	80	57.5 Å²	57.5	49%	0.491	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	128.6	171.9	-57.6	0	0	0	0	108.4	T190 L191 K192	T190-T204 HydrophobicContact CG2-CG2 4.01Å; L191-T204 CarbonylContact O-C 3.57Å; L191-T204 WeakPolarHBondContact O-CA 3.33Å; K192-T204 HydrophobicContact CG-CG2 4.14Å
205	M	87.8	Confident	85	Confident	7 Å²	7	58.8 Å²	58.8	3%	0.034	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.5	-177	-53.8	155	58.8	0	0	109.1	T190 L191 V193 L223 W235 L237	T190-M205 WeakPolarHBondContact CA-O 3.26Å; L191-M205 HydrophobicContact CB-CB 4.21Å; L191-M205 PolarHBondContact N-O 3.2Å; L191-M205 PolarHBondContact O-N 3.12Å; V193-M205 HydrophobicContact CG2-SD 4.33Å; M205-L223 HydrophobicContact CE-CD2 4.35Å; M205-W235 HydrophobicContact CB-CH2 4.43Å; M205-W235 HydrophobicContact CB-CZ3 4.34Å; M205-W235 HydrophobicContact CE-CB 3.24Å; M205-W235 HydrophobicContact CE-CD2 3.15Å; M205-W235 HydrophobicContact CE-CE3 3.29Å; M205-W235 HydrophobicContact CE-CG 3.15Å; M205-W235 HydrophobicContact CE-CZ3 4.09Å; M205-L237 HydrophobicContact SD-CD2 4.17Å
206	D	85.3	Confident	85.1	Confident	100 Å²	100	58.2 Å²	58.2	54%	0.535	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.3	-175.6	-178.3	16.5	0	0	0	112.3	H189 G208 W235	H189-D206 WeakPolarHBondContact CB-OD1 3.42Å; D206-G208 WeakPolarHBondContact OD1-CA 3.43Å; D206-G208 PolarHBondContact OD1-N 3.49Å; D206-W235 VanDerWaalsContact O-CH2 3.27Å; D206-W235 WeakPolarHBondContact O-CH2 3.27Å
207	H	81.8	Confident	85.3	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.019	30%	0.301	C	S	.	.			trans	-83.1	-22.4	175.9	-165.9	92.1	0	0	0	112.4	H189 Q209 V211 S225 G227 K233	H189-H207 WeakPolarHBondContact O-CB 3.18Å; H189-H207 PolarHBondContact O-N 3.01Å; H207-Q209 PolarHBondContact O-N 2.99Å; H207-V211 HydrophobicContact CB-CG2 3.79Å; H207-S225 PolarHBondContact CE1-OG 3.45Å; H207-S225 PolarHBondContact ND1-OG 3.49Å; H207-G227 VanDerWaalsContact NE2-CA 3.28Å; H207-G227 WeakPolarHBondContact NE2-CA 3.48Å; H207-G227 PolarHBondContact NE2-N 2.8Å; H207-K233 VanDerWaalsContact O-CE 3.29Å; H207-K233 WeakPolarHBondContact O-CE 3.47Å; H207-K233 PolarHBondContact O-NZ 3.12Å
208	G	83.9	Confident	85.2	Confident	41 Å²	41	52.3 Å²	52.3	42%	0.423	29%	0.291	S	S	.	.	S	Bend	trans	72.3	2.7	-176.8	0	0	0	0	0	114.7	D206	D206-G208 WeakPolarHBondContact OD1-CA 3.43Å; D206-G208 PolarHBondContact OD1-N 3.49Å
209	Q	84.3	Confident	85.1	Confident	55 Å²	55	54.6 Å²	54.6	26%	0.257	31%	0.305	S	S	.	.	S	Bend	trans	-146.3	158.8	172.8	-63.3	-178.3	-33.7	0	0	109.5	H207 G229 Y231	H207-Q209 PolarHBondContact O-N 2.99Å; Q209-G229 VanDerWaalsContact CD-CA 3.42Å; Q209-G229 VanDerWaalsContact OE1-N 3.1Å; Q209-G229 PolarHBondContact OE1-O 3.26Å; Q209-Y231 VanDerWaalsContact OE1-CD2 3.24Å
210	P	86.3	Confident	85.2	Confident	40 Å²	40	47.1 Å²	47.1	26%	0.26	27%	0.27	S	S	.	.			trans	-58.1	142.7	177	-18	29.2	0	0	0	110.4	G185 H189 G227 C228	G185-P210 WeakPolarHBondContact O-CB 3.04Å; H189-P210 VanDerWaalsContact ND1-N 3.17Å; P210-G227 CarbonylContact O-C 3.53Å; P210-G227 WeakPolarHBondContact O-CA 3.48Å; P210-C228 HydrophobicContact CB-CB 3.84Å; P210-C228 HydrophobicContact CG-CB 4.19Å; P210-C228 WeakPolarHBondContact O-CB 3.22Å; P210-C228 PolarHBondContact O-N 3.25Å
211	V	87.3	Confident	85.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.4	-175.6	-176.5	0	0	0	0	110.2	C169 A183 G185 L191 H207 L214 A226	C169-V211 PolarHBondContact SG-O 3.35Å; A183-V211 HydrophobicContact CB-CB 4.12Å; A183-V211 HydrophobicContact CB-CG1 4.02Å; G185-V211 WeakPolarHBondContact CA-O 3.27Å; L191-V211 HydrophobicContact CD2-CB 4.21Å; L191-V211 HydrophobicContact CD2-CG1 3.9Å; L191-V211 HydrophobicContact CD2-CG2 3.81Å; H207-V211 HydrophobicContact CB-CG2 3.79Å; V211-L214 HydrophobicContact CG1-CD2 4.28Å; V211-L214 HydrophobicContact CG1-CG 4.36Å; V211-A226 WeakPolarHBondContact CG1-O 3.4Å
212	E	86.4	Confident	85.7	Confident	75 Å²	75	40.5 Å²	40.5	35%	0.35	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-38.3	-177.7	-69	-69.4	164.9	0	0	112	C169 A226 C228 I254	C169-E212 WeakPolarHBondContact CB-O 3.44Å; E212-A226 PolarHBondContact N-O 2.75Å; E212-C228 HydrophobicContact CG-CB 4Å; E212-C228 PolarHBondContact OE1-SG 3Å; E212-I254 WeakPolarHBondContact CB-O 3.3Å
213	S	87.4	Confident	85.8	Confident	12 Å²	12	36.4 Å²	36.4	8%	0.084	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	147.8	178.8	54.1	0	0	0	0	113.9	A226 T255 C256 L257	S213-A226 PolarHBondContact O-N 2.88Å; S213-A226 WeakPolarHBondContact OG-CB 3.21Å; S213-T255 WeakPolarHBondContact CB-O 3.09Å; S213-T255 PolarHBondContact OG-O 2.94Å; S213-C256 WeakPolarHBondContact OG-CA 3.5Å; S213-L257 PolarHBondContact OG-N 2.99Å
214	L	89.4	Confident	86.1	Confident	16 Å²	16	34.2 Å²	34.2	8%	0.084	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	147.2	174.3	-75.9	175.8	0	0	0	110.7	V171 I181 A183 L191 V211 L223 V224	V171-L214 HydrophobicContact CG1-CB 4.11Å; I181-L214 HydrophobicContact CG2-CD1 3.98Å; A183-L214 HydrophobicContact CB-CD1 3.37Å; A183-L214 HydrophobicContact CB-CD2 4.44Å; A183-L214 HydrophobicContact CB-CG 3.86Å; L191-L214 HydrophobicContact CD1-CD2 4.27Å; L191-L214 HydrophobicContact CD2-CD1 4.26Å; L191-L214 HydrophobicContact CD2-CD2 3.54Å; L191-L214 HydrophobicContact CD2-CG 4.23Å; V211-L214 HydrophobicContact CG1-CD2 4.28Å; V211-L214 HydrophobicContact CG1-CG 4.36Å; L214-L223 HydrophobicContact CD2-CD1 4.13Å; L214-L223 HydrophobicContact CD2-CD2 4.32Å; L214-L223 HydrophobicContact CD2-CG 4.35Å; L214-V224 WeakPolarHBondContact CA-O 3.49Å
215	L	89.6	Confident	86.1	Confident	28 Å²	28	30.4 Å²	30.4	15%	0.147	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	124.4	178.4	-178.2	70.7	0	0	0	110	V224 L257 L259 L266	L215-V224 HydrophobicContact CB-CB 4.38Å; L215-V224 PolarHBondContact N-O 3.35Å; L215-V224 PolarHBondContact O-N 3.08Å; L215-L257 HydrophobicContact CB-CB 4.1Å; L215-L257 HydrophobicContact CB-CD1 4.44Å; L215-L257 HydrophobicContact CD2-CB 3.97Å; L215-L259 HydrophobicContact CD1-CD1 4.44Å; L215-L259 HydrophobicContact CD1-CG 4.11Å; L215-L259 HydrophobicContact CD2-CB 4.42Å; L215-L259 HydrophobicContact CD2-CD1 4.21Å; L215-L259 HydrophobicContact CD2-CD2 3.56Å; L215-L259 HydrophobicContact CD2-CG 3.39Å; L215-L259 HydrophobicContact CG-CD1 4.2Å; L215-L259 HydrophobicContact CG-CD2 4.39Å; L215-L259 HydrophobicContact CG-CG 3.86Å; L215-L266 HydrophobicContact CD2-CD1 3.57Å
216	L	88.6	Confident	85.9	Confident	19 Å²	19	30 Å²	30	10%	0.099	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	136.4	173.9	-170	68.1	0	0	0	109.8	V171 I181 E220 L223 L237	V171-L216 HydrophobicContact CG1-CB 4.28Å; V171-L216 HydrophobicContact CG2-CB 4.32Å; I181-L216 HydrophobicContact CD1-CD1 4.02Å; L216-E220 HydrophobicContact CD2-CB 4.38Å; L216-E220 HydrophobicContact CD2-CG 3.95Å; L216-E220 HydrophobicContact CG-CG 4.47Å; L216-L223 HydrophobicContact CD1-CD1 4.39Å; L216-L237 HydrophobicContact CD1-CD1 3.67Å
217	Y	86.9	Confident	85.5	Confident	8 Å²	8	25.3 Å²	25.3	3%	0.031	16%	0.156	C	C	.	.			trans	-69.7	151.7	171.7	-87.4	-86.7	0	0	0	111.8	S219 E220 L222 V224 L259 G263 T280	Y217-S219 PolarHBondContact O-N 3.33Å; Y217-S219 VanDerWaalsContact O-N 3.12Å; Y217-E220 WeakPolarHBondContact O-CA 3.38Å; Y217-E220 PolarHBondContact O-N 2.88Å; Y217-L222 HydrophobicContact CD2-CB 3.4Å; Y217-L222 VanDerWaalsContact CD2-CB 3.4Å; Y217-L222 HydrophobicContact CD2-CD1 4.27Å; Y217-L222 HydrophobicContact CD2-CG 4.49Å; Y217-L222 HydrophobicContact CE2-CB 4.09Å; Y217-L222 HydrophobicContact CE2-CD1 4.39Å; Y217-L222 HydrophobicContact CG-CB 4.02Å; Y217-L222 PolarHBondContact N-O 3Å; Y217-V224 HydrophobicContact CD2-CG2 3.96Å; Y217-V224 HydrophobicContact CE2-CG2 3.37Å; Y217-L259 HydrophobicContact CD1-CD1 3.73Å; Y217-L259 HydrophobicContact CD1-CD2 4.01Å; Y217-L259 HydrophobicContact CE1-CD1 4.09Å; Y217-L259 HydrophobicContact CE1-CD2 3.47Å; Y217-L259 VanDerWaalsContact CE1-CD2 3.47Å; Y217-L259 HydrophobicContact CE1-CG 4.45Å; Y217-L259 HydrophobicContact CE2-CD2 4.38Å; Y217-L259 HydrophobicContact CG-CD1 4.09Å; Y217-G263 VanDerWaalsContact CE1-O 3.29Å; Y217-G263 WeakPolarHBondContact CE1-O 3.37Å; Y217-T280 HydrophobicContact CE1-CG2 3.57Å; Y217-T280 HydrophobicContact CE2-CG2 4.47Å; Y217-T280 VanDerWaalsContact OH-CG2 3.27Å; Y217-T280 WeakPolarHBondContact OH-CG2 3.47Å; Y217-T280 PolarHBondContact OH-OG1 3.18Å
218	P	82.9	Confident	84.7	Confident	77 Å²	77	26.6 Å²	26.6	50%	0.5	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.3	175.7	-24.7	33.3	0	0	0	113.8	E220 L259	P218-E220 VanDerWaalsContact C-N 3.28Å; P218-L259 HydrophobicContact CG-CD1 4.39Å
219	S	80.4	Confident	83.8	Confident	88 Å²	88	25.3 Å²	25.3	62%	0.615	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-6	175.1	57.2	0	0	0	0	113.9	Y217 G221	Y217-S219 PolarHBondContact O-N 3.33Å; Y217-S219 VanDerWaalsContact O-N 3.12Å; S219-G221 PolarHBondContact O-N 3.35Å
220	E	80.2	Confident	83.8	Confident	21 Å²	21	28.1 Å²	28.1	10%	0.098	16%	0.16	C	C	.	.	S	Bend	trans	58.2	-4.7	177	-56.7	-169.6	164.4	0	0	117.2	S173 K174 L175 N176 L216 Y217 P218 L237	S173-E220 WeakPolarHBondContact CB-OE1 3.42Å; S173-E220 PolarHBondContact OG-OE1 3.1Å; S173-E220 PolarHBondContact OG-OE2 2.75Å; K174-E220 PolarHBondContact N-OE1 3.39Å; L175-E220 VanDerWaalsContact CB-OE1 3.22Å; L175-E220 WeakPolarHBondContact CB-OE1 3.29Å; L175-E220 HydrophobicContact CD1-CG 3.9Å; L175-E220 HydrophobicContact CG-CG 4.44Å; L175-E220 WeakPolarHBondContact CG-OE1 3.27Å; L175-E220 PolarHBondContact N-OE1 2.88Å; N176-E220 PolarHBondContact ND2-OE2 3.39Å; L216-E220 HydrophobicContact CD2-CB 4.38Å; L216-E220 HydrophobicContact CD2-CG 3.95Å; L216-E220 HydrophobicContact CG-CG 4.47Å; Y217-E220 WeakPolarHBondContact O-CA 3.38Å; Y217-E220 PolarHBondContact O-N 2.88Å; P218-E220 VanDerWaalsContact C-N 3.28Å; E220-L237 WeakPolarHBondContact O-CD1 3.49Å
221	G	83.1	Confident	83.9	Confident	11 Å²	11	29.2 Å²	29.2	11%	0.113	16%	0.16	C	C	.	.	S	Bend	trans	-77.7	-21.3	174.1	0	0	0	0	0	113.7	S219 L237	S219-G221 PolarHBondContact O-N 3.35Å; G221-L237 PolarHBondContact O-N 2.73Å
222	L	89.1	Confident	84	Confident	36 Å²	36	29.3 Å²	29.3	19%	0.188	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.1	-174.7	-64.6	177.8	0	0	0	111.5	Y217 V234 W235 L244	Y217-L222 HydrophobicContact CD2-CB 3.4Å; Y217-L222 VanDerWaalsContact CD2-CB 3.4Å; Y217-L222 HydrophobicContact CD2-CD1 4.27Å; Y217-L222 HydrophobicContact CD2-CG 4.49Å; Y217-L222 HydrophobicContact CE2-CB 4.09Å; Y217-L222 HydrophobicContact CE2-CD1 4.39Å; Y217-L222 HydrophobicContact CG-CB 4.02Å; Y217-L222 PolarHBondContact N-O 3Å; L222-V234 HydrophobicContact CD2-CG1 4.34Å; L222-W235 WeakPolarHBondContact CA-O 3.46Å; L222-L244 HydrophobicContact CD2-CD1 3.42Å; L222-L244 VanDerWaalsContact CD2-CD1 3.42Å
223	L	89	Confident	84.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.1	172.6	176.7	71	0	0	0	109.5	V171 I181 L191 M205 L214 L216 V234 W235 L237	V171-L223 HydrophobicContact CG1-CD1 4.5Å; I181-L223 HydrophobicContact CD1-CD1 3.88Å; I181-L223 HydrophobicContact CD1-CD2 4.24Å; I181-L223 HydrophobicContact CG2-CD1 4.38Å; I181-L223 HydrophobicContact CG2-CD2 4.04Å; L191-L223 HydrophobicContact CD1-CD2 4.24Å; M205-L223 HydrophobicContact CE-CD2 4.35Å; L214-L223 HydrophobicContact CD2-CD1 4.13Å; L214-L223 HydrophobicContact CD2-CD2 4.32Å; L214-L223 HydrophobicContact CD2-CG 4.35Å; L216-L223 HydrophobicContact CD1-CD1 4.39Å; L223-V234 CarbonylContact O-C 3.59Å; L223-V234 WeakPolarHBondContact O-CA 3.48Å; L223-W235 HydrophobicContact CB-CB 4.27Å; L223-W235 PolarHBondContact N-O 3.45Å; L223-W235 PolarHBondContact O-N 3.12Å; L223-L237 HydrophobicContact CB-CD1 4.1Å; L223-L237 HydrophobicContact CB-CD2 4.13Å; L223-L237 HydrophobicContact CB-CG 4.03Å; L223-L237 HydrophobicContact CD2-CD2 4.27Å
224	V	89.6	Confident	84.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.2	171.9	-168	0	0	0	0	108.8	L214 L215 Y217 V232 K233 V234 L257 L266	L214-V224 WeakPolarHBondContact CA-O 3.49Å; L215-V224 HydrophobicContact CB-CB 4.38Å; L215-V224 PolarHBondContact N-O 3.35Å; L215-V224 PolarHBondContact O-N 3.08Å; Y217-V224 HydrophobicContact CD2-CG2 3.96Å; Y217-V224 HydrophobicContact CE2-CG2 3.37Å; V224-V232 HydrophobicContact CG1-CG1 3.24Å; V224-K233 WeakPolarHBondContact CA-O 3.44Å; V224-V234 HydrophobicContact CG1-CG2 4.29Å; V224-V234 HydrophobicContact CG2-CG1 4.46Å; V224-V234 HydrophobicContact CG2-CG2 4.2Å; V224-L257 HydrophobicContact CB-CD1 4.09Å; V224-L257 HydrophobicContact CG1-CD1 3.55Å; V224-L266 HydrophobicContact CG1-CD1 4.25Å; V224-L266 HydrophobicContact CG1-CD2 3.97Å; V224-L266 HydrophobicContact CG2-CD1 4.26Å; V224-L266 HydrophobicContact CG2-CD2 4.42Å
225	S	89.3	Confident	84.5	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.6	171.7	64.8	0	0	0	0	109.8	H207 V232 K233 W235	H207-S225 PolarHBondContact CE1-OG 3.45Å; H207-S225 PolarHBondContact ND1-OG 3.49Å; S225-V232 WeakPolarHBondContact O-CA 3.47Å; S225-K233 PolarHBondContact N-O 2.94Å; S225-K233 PolarHBondContact O-N 3.48Å; S225-K233 PolarHBondContact OG-O 2.53Å; S225-W235 PolarHBondContact OG-NE1 2.93Å
226	A	83.9	Confident	84.5	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	116.1	168	0	0	0	0	0	109.3	V211 E212 S213 I254 L257	V211-A226 WeakPolarHBondContact CG1-O 3.4Å; E212-A226 PolarHBondContact N-O 2.75Å; S213-A226 PolarHBondContact O-N 2.88Å; S213-A226 WeakPolarHBondContact OG-CB 3.21Å; A226-I254 HydrophobicContact CB-CB 3.94Å; A226-I254 HydrophobicContact CB-CG2 3.56Å; A226-L257 HydrophobicContact CB-CD1 3.52Å; A226-L257 HydrophobicContact CB-CD2 4.02Å; A226-L257 HydrophobicContact CB-CG 3.61Å
227	G	75.3	Confident	84.4	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	155.1	170.9	0	0	0	0	0	111.6	H207 P210 G229 Y231	H207-G227 VanDerWaalsContact NE2-CA 3.28Å; H207-G227 WeakPolarHBondContact NE2-CA 3.48Å; H207-G227 PolarHBondContact NE2-N 2.8Å; P210-G227 CarbonylContact O-C 3.53Å; P210-G227 WeakPolarHBondContact O-CA 3.48Å; G227-G229 VanDerWaalsContact C-N 3.26Å; G227-G229 CarbonylContact C-O 3.59Å; G227-Y231 PolarHBondContact N-O 3.07Å
228	C	66	Low	84.4	Confident	31 Å²	31	33 Å²	33	21%	0.209	18%	0.179	C	C	.	.	S	Bend	trans	-68.4	-28.7	167.6	-165	0	0	0	0	109.9	P210 E212 T253	P210-C228 HydrophobicContact CB-CB 3.84Å; P210-C228 HydrophobicContact CG-CB 4.19Å; P210-C228 WeakPolarHBondContact O-CB 3.22Å; P210-C228 PolarHBondContact O-N 3.25Å; E212-C228 HydrophobicContact CG-CB 4Å; E212-C228 PolarHBondContact OE1-SG 3Å; C228-T253 WeakPolarHBondContact O-CA 3.4Å; C228-T253 WeakPolarHBondContact O-CB 3.37Å; C228-T253 WeakPolarHBondContact O-CG2 3.15Å
229	G	65.4	Low	84.5	Confident	15 Å²	15	35.4 Å²	35.4	16%	0.155	18%	0.181	C	C	.	.	S	Bend	trans	-83.6	163.9	159.6	0	0	0	0	0	110.5	Q209 G227 Y231	Q209-G229 VanDerWaalsContact CD-CA 3.42Å; Q209-G229 VanDerWaalsContact OE1-N 3.1Å; Q209-G229 PolarHBondContact OE1-O 3.26Å; G227-G229 VanDerWaalsContact C-N 3.26Å; G227-G229 CarbonylContact C-O 3.59Å; G229-Y231 PolarHBondContact O-N 3.02Å
230	R	83.1	Confident	84.5	Confident	113 Å²	113	33.8 Å²	33.8	43%	0.426	18%	0.178	S	C	.	.	S	Bend	trans	-56.9	10.5	-161.5	-61.6	167.2	-177.7	141.8	-5.3	116.9	K248 H250 H251	R230-K248 HydrophobicContact CB-CG 4.39Å; R230-H250 WeakPolarHBondContact CB-O 3.38Å; R230-H250 WeakPolarHBondContact CG-O 3.47Å; R230-H251 WeakPolarHBondContact CD-O 3.2Å; R230-H251 PolarHBondContact NE-O 2.72Å
231	Y	88.4	Confident	84.4	Confident	64 Å²	64	33.2 Å²	33.2	25%	0.251	18%	0.178	S	C	.	.			trans	-104.2	132.4	-170.2	-56.4	-64.3	0	0	0	112	Q209 G227 G229 L246 L247 K248	Q209-Y231 VanDerWaalsContact OE1-CD2 3.24Å; G227-Y231 PolarHBondContact N-O 3.07Å; G229-Y231 PolarHBondContact O-N 3.02Å; Y231-L246 HydrophobicContact CD1-CD1 3.81Å; Y231-L246 HydrophobicContact CD1-CD2 4.14Å; Y231-L246 HydrophobicContact CD1-CG 3.97Å; Y231-L246 HydrophobicContact CE1-CD2 4.32Å; Y231-L246 HydrophobicContact CG-CD1 3.88Å; Y231-L247 CarbonylContact C-O 3.55Å; Y231-L247 VanDerWaalsContact CA-O 3.27Å; Y231-L247 WeakPolarHBondContact CA-O 3.39Å; Y231-K248 HydrophobicContact CD1-CB 3.79Å; Y231-K248 HydrophobicContact CD1-CD 4.49Å; Y231-K248 HydrophobicContact CD1-CG 3.88Å; Y231-K248 HydrophobicContact CE1-CB 3.75Å; Y231-K248 HydrophobicContact CE1-CD 3.65Å; Y231-K248 HydrophobicContact CE1-CG 3.51Å
232	V	90.4	Very high	84.6	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.3	156.7	-173.7	0	0	0	0	107.1	V224 S225 L247 I254 L257 L266	V224-V232 HydrophobicContact CG1-CG1 3.24Å; S225-V232 WeakPolarHBondContact O-CA 3.47Å; V232-L247 HydrophobicContact CB-CB 4.15Å; V232-L247 HydrophobicContact CB-CD1 4.4Å; V232-L247 PolarHBondContact N-O 3.09Å; V232-L247 PolarHBondContact O-N 3.28Å; V232-I254 HydrophobicContact CB-CD1 4.48Å; V232-I254 HydrophobicContact CG2-CD1 3.21Å; V232-L257 HydrophobicContact CG1-CD1 4.45Å; V232-L257 HydrophobicContact CG1-CD2 4.35Å; V232-L257 HydrophobicContact CG2-CD2 4.3Å; V232-L266 HydrophobicContact CG1-CD2 4.44Å
233	K	90.8	Very high	84.5	Confident	36 Å²	36	40.2 Å²	40.2	16%	0.157	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.8	171.1	-69.3	-173.9	-165.3	-176	0	109.4	H207 V224 S225 W235 V245 L246	H207-K233 VanDerWaalsContact O-CE 3.29Å; H207-K233 WeakPolarHBondContact O-CE 3.47Å; H207-K233 PolarHBondContact O-NZ 3.12Å; V224-K233 WeakPolarHBondContact CA-O 3.44Å; S225-K233 PolarHBondContact N-O 2.94Å; S225-K233 PolarHBondContact O-N 3.48Å; S225-K233 PolarHBondContact OG-O 2.53Å; K233-W235 HydrophobicContact CB-CZ2 4.13Å; K233-W235 HydrophobicContact CD-CH2 4.1Å; K233-W235 HydrophobicContact CD-CZ2 3.53Å; K233-W235 HydrophobicContact CG-CZ2 4.49Å; K233-V245 WeakPolarHBondContact CA-O 3.24Å; K233-L246 HydrophobicContact CD-CD1 4.12Å; K233-L246 HydrophobicContact CG-CD1 3.43Å; K233-L246 VanDerWaalsContact CG-CD1 3.43Å
234	V	91.5	Very high	84.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130	168.8	-175.6	0	0	0	0	107.9	L222 L223 V224 P243 L244 V245 Y283	L222-V234 HydrophobicContact CD2-CG1 4.34Å; L223-V234 CarbonylContact O-C 3.59Å; L223-V234 WeakPolarHBondContact O-CA 3.48Å; V224-V234 HydrophobicContact CG1-CG2 4.29Å; V224-V234 HydrophobicContact CG2-CG1 4.46Å; V224-V234 HydrophobicContact CG2-CG2 4.2Å; V234-P243 CarbonylContact O-C 3.08Å; V234-L244 PolarHBondContact O-N 2.86Å; V234-V245 HydrophobicContact CB-CB 4.43Å; V234-V245 PolarHBondContact N-O 3.15Å; V234-V245 PolarHBondContact O-N 3.2Å; V234-Y283 HydrophobicContact CG2-CD1 4.26Å; V234-Y283 HydrophobicContact CG2-CE1 3.67Å
235	W	90.5	Very high	84.3	Confident	10 Å²	10	46 Å²	46	4%	0.038	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143.9	-175.4	-54.7	95	0	0	0	110.9	L191 M205 D206 L222 L223 S225 K233 G241 Q242 P243	L191-W235 HydrophobicContact CD1-CZ2 4.27Å; M205-W235 HydrophobicContact CB-CH2 4.43Å; M205-W235 HydrophobicContact CB-CZ3 4.34Å; M205-W235 HydrophobicContact CE-CB 3.24Å; M205-W235 HydrophobicContact CE-CD2 3.15Å; M205-W235 HydrophobicContact CE-CE3 3.29Å; M205-W235 HydrophobicContact CE-CG 3.15Å; M205-W235 HydrophobicContact CE-CZ3 4.09Å; D206-W235 VanDerWaalsContact O-CH2 3.27Å; D206-W235 WeakPolarHBondContact O-CH2 3.27Å; L222-W235 WeakPolarHBondContact CA-O 3.46Å; L223-W235 HydrophobicContact CB-CB 4.27Å; L223-W235 PolarHBondContact N-O 3.45Å; L223-W235 PolarHBondContact O-N 3.12Å; S225-W235 PolarHBondContact OG-NE1 2.93Å; K233-W235 HydrophobicContact CB-CZ2 4.13Å; K233-W235 HydrophobicContact CD-CH2 4.1Å; K233-W235 HydrophobicContact CD-CZ2 3.53Å; K233-W235 HydrophobicContact CG-CZ2 4.49Å; W235-G241 VanDerWaalsContact CZ3-O 3.27Å; W235-G241 WeakPolarHBondContact CZ3-O 3.43Å; W235-Q242 WeakPolarHBondContact CA-O 3.43Å; W235-P243 HydrophobicContact CD2-CB 4.24Å; W235-P243 VanDerWaalsContact CE3-CA 3.5Å; W235-P243 HydrophobicContact CE3-CB 3.64Å; W235-P243 HydrophobicContact CE3-CG 4.21Å; W235-P243 VanDerWaalsContact CE3-N 3.33Å; W235-P243 HydrophobicContact CH2-CB 4.12Å; W235-P243 HydrophobicContact CH2-CG 4.37Å; W235-P243 HydrophobicContact CZ3-CB 3.6Å; W235-P243 HydrophobicContact CZ3-CG 3.77Å
236	D	90.3	Very high	84.3	Confident	19 Å²	19	50.9 Å²	50.9	10%	0.102	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	112.2	171	-167.7	-25.8	0	0	0	109.2	L238 K239 G241 Q242 L244	D236-L238 VanDerWaalsContact C-N 3.34Å; D236-L238 WeakPolarHBondContact OD1-CB 3.33Å; D236-L238 PolarHBondContact OD1-N 3.41Å; D236-K239 HydrophobicContact CB-CB 4.06Å; D236-K239 HydrophobicContact CB-CD 4.42Å; D236-K239 HydrophobicContact CB-CG 4.37Å; D236-K239 PolarHBondContact OD1-N 3.22Å; D236-K239 WeakPolarHBondContact OD2-CD 3.42Å; D236-K239 VanDerWaalsContact OD2-CE 3.29Å; D236-K239 WeakPolarHBondContact OD2-CE 3.35Å; D236-K239 VanDerWaalsContact OD2-CG 3.27Å; D236-K239 WeakPolarHBondContact OD2-CG 3.15Å; D236-K239 IonicContact OD2-NZ 2.83Å; D236-G241 VanDerWaalsContact O-CA 3.24Å; D236-G241 WeakPolarHBondContact O-CA 3.26Å; D236-G241 PolarHBondContact O-N 3.13Å; D236-Q242 PolarHBondContact N-O 2.68Å; D236-L244 HydrophobicContact CB-CD1 3.86Å; D236-L244 HydrophobicContact CB-CD2 3.99Å; D236-L244 HydrophobicContact CB-CG 3.8Å
237	L	86	Confident	84.6	Confident	19 Å²	19	51.6 Å²	51.6	10%	0.099	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-28.1	179.3	-67.8	177.1	0	0	0	111.8	I181 V193 M203 M205 L216 E220 G221 L223 G240	I181-L237 HydrophobicContact CD1-CD1 3.76Å; I181-L237 HydrophobicContact CD1-CD2 4.42Å; V193-L237 HydrophobicContact CG2-CD2 4.06Å; M203-L237 HydrophobicContact CE-CD2 4.23Å; M205-L237 HydrophobicContact SD-CD2 4.17Å; L216-L237 HydrophobicContact CD1-CD1 3.67Å; E220-L237 WeakPolarHBondContact O-CD1 3.49Å; G221-L237 PolarHBondContact O-N 2.73Å; L223-L237 HydrophobicContact CB-CD1 4.1Å; L223-L237 HydrophobicContact CB-CD2 4.13Å; L223-L237 HydrophobicContact CB-CG 4.03Å; L223-L237 HydrophobicContact CD2-CD2 4.27Å; L237-G240 PolarHBondContact O-N 3.47Å
238	L	86.8	Confident	85.2	Confident	152 Å²	152	57.3 Å²	57.3	80%	0.796	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-31.2	179.7	-63.3	173.4	0	0	0	111.5	D236 G240	D236-L238 VanDerWaalsContact C-N 3.34Å; D236-L238 WeakPolarHBondContact OD1-CB 3.33Å; D236-L238 PolarHBondContact OD1-N 3.41Å; L238-G240 PolarHBondContact O-N 3.2Å
239	K	84.6	Confident	86.3	Confident	128 Å²	128	58.9 Å²	58.9	56%	0.557	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	21.7	176.1	-66.4	-176.2	-172.6	175.7	0	114.1	D236	D236-K239 HydrophobicContact CB-CB 4.06Å; D236-K239 HydrophobicContact CB-CD 4.42Å; D236-K239 HydrophobicContact CB-CG 4.37Å; D236-K239 PolarHBondContact OD1-N 3.22Å; D236-K239 WeakPolarHBondContact OD2-CD 3.42Å; D236-K239 VanDerWaalsContact OD2-CE 3.29Å; D236-K239 WeakPolarHBondContact OD2-CE 3.35Å; D236-K239 VanDerWaalsContact OD2-CG 3.27Å; D236-K239 WeakPolarHBondContact OD2-CG 3.15Å; D236-K239 IonicContact OD2-NZ 2.83Å
240	G	80.4	Confident	87.4	Confident	53 Å²	53	58.5 Å²	58.5	55%	0.546	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	30.4	178.2	0	0	0	0	0	113.7	L237 L238	L237-G240 PolarHBondContact O-N 3.47Å; L238-G240 PolarHBondContact O-N 3.2Å
241	G	79.7	Confident	87.7	Confident	9 Å²	9	59.4 Å²	59.4	9%	0.093	31%	0.309	C	S	.	.	S	Bend	trans	80.5	31.8	173.3	0	0	0	0	0	114.5	W235 D236	W235-G241 VanDerWaalsContact CZ3-O 3.27Å; W235-G241 WeakPolarHBondContact CZ3-O 3.43Å; D236-G241 VanDerWaalsContact O-CA 3.24Å; D236-G241 WeakPolarHBondContact O-CA 3.26Å; D236-G241 PolarHBondContact O-N 3.13Å
242	Q	86	Confident	87.8	Confident	119 Å²	119	61.3 Å²	61.3	56%	0.556	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	138.6	171.9	-70	-175.7	-6.4	0	0	111.2	W235 D236 L244	W235-Q242 WeakPolarHBondContact CA-O 3.43Å; D236-Q242 PolarHBondContact N-O 2.68Å; Q242-L244 PolarHBondContact O-N 3.29Å
243	P	87.3	Confident	87.8	Confident	76 Å²	76	63.2 Å²	63.2	49%	0.494	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	119.1	175.5	28.8	-28	0	0	0	109.1	V234 W235	V234-P243 CarbonylContact O-C 3.08Å; W235-P243 HydrophobicContact CD2-CB 4.24Å; W235-P243 VanDerWaalsContact CE3-CA 3.5Å; W235-P243 HydrophobicContact CE3-CB 3.64Å; W235-P243 HydrophobicContact CE3-CG 4.21Å; W235-P243 VanDerWaalsContact CE3-N 3.33Å; W235-P243 HydrophobicContact CH2-CB 4.12Å; W235-P243 HydrophobicContact CH2-CG 4.37Å; W235-P243 HydrophobicContact CZ3-CB 3.6Å; W235-P243 HydrophobicContact CZ3-CG 3.77Å
244	L	87.1	Confident	87.8	Confident	79 Å²	79	61.5 Å²	61.5	41%	0.414	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-46	176.4	-67.6	176.4	0	0	0	111.6	L222 V234 D236 Q242	L222-L244 HydrophobicContact CD2-CD1 3.42Å; L222-L244 VanDerWaalsContact CD2-CD1 3.42Å; V234-L244 PolarHBondContact O-N 2.86Å; D236-L244 HydrophobicContact CB-CD1 3.86Å; D236-L244 HydrophobicContact CB-CD2 3.99Å; D236-L244 HydrophobicContact CB-CG 3.8Å; Q242-L244 PolarHBondContact O-N 3.29Å
245	V	87.6	Confident	87.7	Confident	43 Å²	43	62.4 Å²	62.4	26%	0.261	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	138.1	-171.6	-176.6	0	0	0	0	110.5	K233 V234 L247 Y283	K233-V245 WeakPolarHBondContact CA-O 3.24Å; V234-V245 HydrophobicContact CB-CB 4.43Å; V234-V245 PolarHBondContact N-O 3.15Å; V234-V245 PolarHBondContact O-N 3.2Å; V245-L247 HydrophobicContact CG1-CD2 3.61Å; V245-L247 HydrophobicContact CG1-CG 4.01Å; V245-Y283 HydrophobicContact CB-CD2 4.26Å; V245-Y283 HydrophobicContact CG1-CD2 4.25Å; V245-Y283 HydrophobicContact CG1-CG 4.24Å; V245-Y283 HydrophobicContact CG2-CD2 3.71Å; V245-Y283 HydrophobicContact CG2-CE2 3.92Å; V245-Y283 HydrophobicContact CG2-CG 4.48Å
246	L	90.1	Very high	87.6	Confident	102 Å²	102	62.9 Å²	62.9	53%	0.534	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.9	172	-177.9	73.8	0	0	0	109.2	Y231 K233	Y231-L246 HydrophobicContact CD1-CD1 3.81Å; Y231-L246 HydrophobicContact CD1-CD2 4.14Å; Y231-L246 HydrophobicContact CD1-CG 3.97Å; Y231-L246 HydrophobicContact CE1-CD2 4.32Å; Y231-L246 HydrophobicContact CG-CD1 3.88Å; K233-L246 HydrophobicContact CD-CD1 4.12Å; K233-L246 HydrophobicContact CG-CD1 3.43Å; K233-L246 VanDerWaalsContact CG-CD1 3.43Å
247	L	89.5	Confident	87.6	Confident	14 Å²	14	62.5 Å²	62.5	7%	0.073	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121	-179.7	-55.9	174.4	0	0	0	110.8	Y231 V232 V245 Y278 Y283	Y231-L247 CarbonylContact C-O 3.55Å; Y231-L247 VanDerWaalsContact CA-O 3.27Å; Y231-L247 WeakPolarHBondContact CA-O 3.39Å; V232-L247 HydrophobicContact CB-CB 4.15Å; V232-L247 HydrophobicContact CB-CD1 4.4Å; V232-L247 PolarHBondContact N-O 3.09Å; V232-L247 PolarHBondContact O-N 3.28Å; V245-L247 HydrophobicContact CG1-CD2 3.61Å; V245-L247 HydrophobicContact CG1-CG 4.01Å; L247-Y278 HydrophobicContact CD1-CD1 4.24Å; L247-Y278 HydrophobicContact CD1-CD2 4.37Å; L247-Y278 HydrophobicContact CD1-CE1 4.29Å; L247-Y278 HydrophobicContact CD1-CE2 4.37Å; L247-Y278 HydrophobicContact CD1-CG 4.3Å; L247-Y283 HydrophobicContact CD1-CD1 4.11Å
248	K	88.3	Confident	87.8	Confident	121 Å²	121	62 Å²	62	53%	0.526	33%	0.329	S	S	.	.			trans	-120.4	68	178.7	-168.6	-162.7	-172.8	169	0	111.1	R230 Y231	R230-K248 HydrophobicContact CB-CG 4.39Å; Y231-K248 HydrophobicContact CD1-CB 3.79Å; Y231-K248 HydrophobicContact CD1-CD 4.49Å; Y231-K248 HydrophobicContact CD1-CG 3.88Å; Y231-K248 HydrophobicContact CE1-CB 3.75Å; Y231-K248 HydrophobicContact CE1-CD 3.65Å; Y231-K248 HydrophobicContact CE1-CG 3.51Å
249	N	87.8	Confident	87.9	Confident	63 Å²	63	56.4 Å²	56.4	34%	0.337	30%	0.3	S	S	.	.			trans	-105.7	-20.6	-179.4	-61.6	-56.5	0	0	0	112.9	K276 Y278 V285	N249-K276 HydrophobicContact CB-CD 3.86Å; N249-K276 PolarHBondContact O-NZ 2.8Å; N249-Y278 HydrophobicContact CB-CE1 4.49Å; N249-Y278 WeakPolarHBondContact CB-OH 3.49Å; N249-Y278 WeakPolarHBondContact ND2-CE1 3.24Å; N249-Y278 PolarHBondContact ND2-OH 3.01Å; N249-V285 HydrophobicContact CB-CG2 4.26Å
250	H	89.7	Confident	87.7	Confident	7 Å²	7	50.4 Å²	50.4	3%	0.032	28%	0.275	C	S	.	.			trans	-86.8	150.9	-179.4	-75.5	-74.1	0	0	0	111.9	R230 I254 S268 S270 D272	R230-H250 WeakPolarHBondContact CB-O 3.38Å; R230-H250 WeakPolarHBondContact CG-O 3.47Å; H250-I254 HydrophobicContact CB-CD1 4.24Å; H250-I254 HydrophobicContact CB-CG1 4.02Å; H250-S268 PolarHBondContact CD2-OG 3.15Å; H250-S268 PolarHBondContact NE2-OG 3.25Å; H250-S270 WeakPolarHBondContact ND1-CB 3.42Å; H250-D272 WeakPolarHBondContact CA-OD2 3.5Å; H250-D272 WeakPolarHBondContact CB-OD2 3.36Å; H250-D272 IonicContact CG-OD2 3.48Å; H250-D272 IonicContact ND1-OD1 2.78Å; H250-D272 PolarHBondContact ND1-OD1 3.15Å; H250-D272 IonicContact ND1-OD2 3.55Å; H250-D272 PolarHBondContact ND1-OD2 3.06Å
251	H	89.1	Confident	87.4	Confident	133 Å²	133	49.8 Å²	49.8	62%	0.616	26%	0.262	S	S	*	.	S	Bend	trans	-92.2	-25.7	177.3	-164	80	0	0	0	112.2	R230 D272	R230-H251 WeakPolarHBondContact CD-O 3.2Å; R230-H251 PolarHBondContact NE-O 2.72Å; H251-D272 PolarHBondContact N-OD2 3.42Å; H251-D272 VanDerWaalsContact N-OD2 3.11Å
252	K	91.3	Very high	87.3	Confident	104 Å²	104	56.2 Å²	56.2	45%	0.452	29%	0.294	S	S	.	.	S	Bend	trans	-119	-174	176.6	-63.5	-172.3	-179.8	-180	0	111	L271 D272	K252-L271 HydrophobicContact CB-CB 4.07Å; K252-L271 HydrophobicContact CD-CB 4.31Å; K252-D272 HydrophobicContact CB-CB 4.03Å; K252-D272 HydrophobicContact CD-CB 4.37Å; K252-D272 HydrophobicContact CG-CB 4.09Å
253	T	89.4	Confident	86.9	Confident	41 Å²	41	51.1 Å²	51.1	25%	0.252	27%	0.273	S	S	.	.			trans	-64.6	140.3	-179.5	71.8	0	0	0	0	110.4	C228 S270 L271	C228-T253 WeakPolarHBondContact O-CA 3.4Å; C228-T253 WeakPolarHBondContact O-CB 3.37Å; C228-T253 WeakPolarHBondContact O-CG2 3.15Å; T253-S270 WeakPolarHBondContact O-CA 3.35Å; T253-S270 WeakPolarHBondContact O-CB 3.46Å; T253-S270 PolarHBondContact O-OG 3.49Å; T253-S270 VanDerWaalsContact O-OG 3.06Å; T253-L271 PolarHBondContact O-N 3.23Å
254	I	91.3	Very high	86.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	120.3	-179.8	-58.2	175.6	0	0	0	106.5	E212 A226 V232 H250 L257 A269	E212-I254 WeakPolarHBondContact CB-O 3.3Å; A226-I254 HydrophobicContact CB-CB 3.94Å; A226-I254 HydrophobicContact CB-CG2 3.56Å; V232-I254 HydrophobicContact CB-CD1 4.48Å; V232-I254 HydrophobicContact CG2-CD1 3.21Å; H250-I254 HydrophobicContact CB-CD1 4.24Å; H250-I254 HydrophobicContact CB-CG1 4.02Å; I254-L257 HydrophobicContact CG2-CD2 4.12Å; I254-A269 CarbonylContact C-O 3.59Å; I254-A269 WeakPolarHBondContact CA-O 3.4Å; I254-A269 WeakPolarHBondContact CG2-O 3.29Å
255	T	89.1	Confident	86.9	Confident	18 Å²	18	50.3 Å²	50.3	11%	0.11	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-41.4	-171.9	49	0	0	0	0	111.5	S213 A269 L271 I295 L296	S213-T255 WeakPolarHBondContact CB-O 3.09Å; S213-T255 PolarHBondContact OG-O 2.94Å; T255-A269 PolarHBondContact N-O 3.06Å; T255-A269 PolarHBondContact OG1-O 3.49Å; T255-L271 HydrophobicContact CG2-CD1 4.47Å; T255-I295 WeakPolarHBondContact CB-O 3.45Å; T255-I295 VanDerWaalsContact CG2-O 3.31Å; T255-I295 WeakPolarHBondContact CG2-O 3.33Å; T255-I295 PolarHBondContact OG1-O 3.3Å; T255-L296 WeakPolarHBondContact CB-O 2.89Å
256	C	88.1	Confident	87.1	Confident	20 Å²	20	48.3 Å²	48.3	14%	0.135	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	150.3	-174.6	-163.7	0	0	0	0	112.2	S213 A269 L298	S213-C256 WeakPolarHBondContact OG-CA 3.5Å; C256-A269 HydrophobicContact CB-CB 4.39Å; C256-A269 PolarHBondContact N-O 3.5Å; C256-A269 PolarHBondContact O-N 2.78Å; C256-L298 HydrophobicContact CB-CB 4.12Å; C256-L298 PolarHBondContact SG-O 2.93Å; C256-L298 VanDerWaalsContact SG-O 3.35Å
257	L	90.8	Very high	87.1	Confident	11 Å²	11	43.5 Å²	43.5	6%	0.058	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.5	174.2	-62.9	173.2	0	0	0	109.6	S213 L215 V224 A226 V232 I254 L267	S213-L257 PolarHBondContact OG-N 2.99Å; L215-L257 HydrophobicContact CB-CB 4.1Å; L215-L257 HydrophobicContact CB-CD1 4.44Å; L215-L257 HydrophobicContact CD2-CB 3.97Å; V224-L257 HydrophobicContact CB-CD1 4.09Å; V224-L257 HydrophobicContact CG1-CD1 3.55Å; A226-L257 HydrophobicContact CB-CD1 3.52Å; A226-L257 HydrophobicContact CB-CD2 4.02Å; A226-L257 HydrophobicContact CB-CG 3.61Å; V232-L257 HydrophobicContact CG1-CD1 4.45Å; V232-L257 HydrophobicContact CG1-CD2 4.35Å; V232-L257 HydrophobicContact CG2-CD2 4.3Å; I254-L257 HydrophobicContact CG2-CD2 4.12Å; L257-L267 WeakPolarHBondContact CA-O 3.32Å
258	A	89.8	Confident	87.3	Confident	9 Å²	9	42.8 Å²	42.8	7%	0.074	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	149.3	174.4	0	0	0	0	0	110.6	L267 L298	A258-L267 HydrophobicContact CB-CB 4.28Å; A258-L267 HydrophobicContact CB-CD1 4.33Å; A258-L267 PolarHBondContact N-O 3.1Å; A258-L267 WeakPolarHBondContact O-CB 3.27Å; A258-L267 PolarHBondContact O-N 3.35Å; A258-L298 HydrophobicContact CB-CD2 4.09Å; A258-L298 HydrophobicContact CB-CG 4.3Å
259	L	88.9	Confident	87.5	Confident	35 Å²	35	37 Å²	37	18%	0.183	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	144.1	171.1	-67.5	178.1	0	0	0	109.7	L215 Y217 P218 R265 L266 L300	L215-L259 HydrophobicContact CD1-CD1 4.44Å; L215-L259 HydrophobicContact CD1-CG 4.11Å; L215-L259 HydrophobicContact CD2-CB 4.42Å; L215-L259 HydrophobicContact CD2-CD1 4.21Å; L215-L259 HydrophobicContact CD2-CD2 3.56Å; L215-L259 HydrophobicContact CD2-CG 3.39Å; L215-L259 HydrophobicContact CG-CD1 4.2Å; L215-L259 HydrophobicContact CG-CD2 4.39Å; L215-L259 HydrophobicContact CG-CG 3.86Å; Y217-L259 HydrophobicContact CD1-CD1 3.73Å; Y217-L259 HydrophobicContact CD1-CD2 4.01Å; Y217-L259 HydrophobicContact CE1-CD1 4.09Å; Y217-L259 HydrophobicContact CE1-CD2 3.47Å; Y217-L259 VanDerWaalsContact CE1-CD2 3.47Å; Y217-L259 HydrophobicContact CE1-CG 4.45Å; Y217-L259 HydrophobicContact CE2-CD2 4.38Å; Y217-L259 HydrophobicContact CG-CD1 4.09Å; P218-L259 HydrophobicContact CG-CD1 4.39Å; L259-R265 WeakPolarHBondContact CA-O 3.17Å; L259-L266 HydrophobicContact CD2-CB 4.39Å; L259-L266 HydrophobicContact CD2-CD1 3.83Å; L259-L300 WeakPolarHBondContact O-CD2 3.41Å
260	G	80.9	Confident	87.7	Confident	2 Å²	2	34 Å²	34	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	164.8	172.3	0	0	0	0	0	113.1	N262 G263 E264 R265 D304	G260-N262 PolarHBondContact O-N 3.31Å; G260-G263 PolarHBondContact O-N 3.04Å; G260-G263 VanDerWaalsContact O-N 3.11Å; G260-E264 PolarHBondContact O-N 3.29Å; G260-R265 PolarHBondContact N-O 2.94Å; G260-R265 PolarHBondContact O-N 2.86Å; G260-R265 VanDerWaalsContact O-N 3.08Å; G260-D304 WeakPolarHBondContact CA-OD1 3.21Å
261	S	74.8	Confident	87.8	Confident	39 Å²	39	36.5 Å²	36.5	27%	0.273	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	50.9	55.1	179.6	-173.2	0	0	0	0	111.7	G263 E264 D304	S261-G263 PolarHBondContact O-N 3.41Å; S261-G263 VanDerWaalsContact O-N 3.09Å; S261-E264 WeakPolarHBondContact O-CB 3.35Å; S261-E264 WeakPolarHBondContact O-CG 3.31Å; S261-E264 PolarHBondContact O-N 2.87Å; S261-E264 VanDerWaalsContact O-N 3.08Å; S261-D304 WeakPolarHBondContact CA-OD2 3.46Å; S261-D304 WeakPolarHBondContact CB-OD2 3.39Å; S261-D304 VanDerWaalsContact N-CG 3.34Å; S261-D304 PolarHBondContact N-OD1 3.12Å; S261-D304 PolarHBondContact N-OD2 2.96Å; S261-D304 VanDerWaalsContact N-OD2 3.13Å
262	N	76.7	Confident	87.9	Confident	145 Å²	145	31.1 Å²	31.1	78%	0.775	17%	0.167	S	C	*	.	G	3₁₀ helix	trans	54	29.7	-179.1	-66.2	-28.7	0	0	0	115.1	G260	G260-N262 PolarHBondContact O-N 3.31Å
263	G	78.1	Confident	87.9	Confident	12 Å²	12	32.4 Å²	32.4	12%	0.124	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	92.1	9.3	178.3	0	0	0	0	0	114.5	Y217 G260 S261 T280	Y217-G263 VanDerWaalsContact CE1-O 3.29Å; Y217-G263 WeakPolarHBondContact CE1-O 3.37Å; G260-G263 PolarHBondContact O-N 3.04Å; G260-G263 VanDerWaalsContact O-N 3.11Å; S261-G263 PolarHBondContact O-N 3.41Å; S261-G263 VanDerWaalsContact O-N 3.09Å; G263-T280 PolarHBondContact O-OG1 3.17Å
264	E	85.3	Confident	88.1	Confident	110 Å²	110	33 Å²	33	51%	0.514	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-18.1	171.8	-63.9	-168.2	175	0	0	113.8	G260 S261 T280	G260-E264 PolarHBondContact O-N 3.29Å; S261-E264 WeakPolarHBondContact O-CB 3.35Å; S261-E264 WeakPolarHBondContact O-CG 3.31Å; S261-E264 PolarHBondContact O-N 2.87Å; S261-E264 VanDerWaalsContact O-N 3.08Å; E264-T280 VanDerWaalsContact C-OG1 3.26Å; E264-T280 PolarHBondContact O-N 3.04Å; E264-T280 VanDerWaalsContact O-N 3.08Å; E264-T280 PolarHBondContact O-OG1 3.28Å
265	R	88.8	Confident	88.2	Confident	28 Å²	28	33 Å²	33	11%	0.106	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.8	-177.4	-60.4	-64.6	179.1	-75.6	-8.9	110.3	D22 W26 L259 G260 V277 Y278	D22-R265 IonicContact OD1-NH2 2.63Å; D22-R265 IonicContact OD2-CZ 3.47Å; D22-R265 VanDerWaalsContact OD2-CZ 3.27Å; D22-R265 IonicContact OD2-NE 3.8Å; D22-R265 PolarHBondContact OD2-NE 3.06Å; D22-R265 IonicContact OD2-NH2 2.88Å; D22-R265 PolarHBondContact OD2-NH2 3.39Å; W26-R265 HydrophobicContact CZ2-CB 4.38Å; W26-R265 HydrophobicContact CZ2-CG 4.31Å; L259-R265 WeakPolarHBondContact CA-O 3.17Å; G260-R265 PolarHBondContact N-O 2.94Å; G260-R265 PolarHBondContact O-N 2.86Å; G260-R265 VanDerWaalsContact O-N 3.08Å; R265-V277 HydrophobicContact CB-CG1 4.14Å; R265-Y278 VanDerWaalsContact CA-O 3.27Å; R265-Y278 WeakPolarHBondContact CA-O 3.16Å; R265-Y278 WeakPolarHBondContact CD-O 3.47Å
266	L	91.2	Very high	88.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127	175.3	173.7	71.7	0	0	0	108.9	L215 V224 V232 L259 V277 Y278	L215-L266 HydrophobicContact CD2-CD1 3.57Å; V224-L266 HydrophobicContact CG1-CD1 4.25Å; V224-L266 HydrophobicContact CG1-CD2 3.97Å; V224-L266 HydrophobicContact CG2-CD1 4.26Å; V224-L266 HydrophobicContact CG2-CD2 4.42Å; V232-L266 HydrophobicContact CG1-CD2 4.44Å; L259-L266 HydrophobicContact CD2-CB 4.39Å; L259-L266 HydrophobicContact CD2-CD1 3.83Å; L266-V277 CarbonylContact O-C 3.59Å; L266-V277 WeakPolarHBondContact O-CA 3.41Å; L266-Y278 HydrophobicContact CB-CD2 4.49Å; L266-Y278 HydrophobicContact CD2-CD2 4.15Å; L266-Y278 HydrophobicContact CG-CD2 4.29Å; L266-Y278 PolarHBondContact N-O 3.16Å; L266-Y278 PolarHBondContact O-N 2.91Å
267	L	91.6	Very high	88.5	Confident	1 Å²	1	33 Å²	33	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.1	174.3	-59.3	169.8	0	0	0	109	W26 L257 A258 V275 K276 V277 L298 L300	W26-L267 HydrophobicContact CH2-CD2 4.48Å; L257-L267 WeakPolarHBondContact CA-O 3.32Å; A258-L267 HydrophobicContact CB-CB 4.28Å; A258-L267 HydrophobicContact CB-CD1 4.33Å; A258-L267 PolarHBondContact N-O 3.1Å; A258-L267 WeakPolarHBondContact O-CB 3.27Å; A258-L267 PolarHBondContact O-N 3.35Å; L267-V275 HydrophobicContact CB-CG1 4.33Å; L267-V275 HydrophobicContact CD2-CG1 4.36Å; L267-K276 WeakPolarHBondContact CA-O 3.5Å; L267-V277 HydrophobicContact CD2-CB 3.89Å; L267-V277 HydrophobicContact CD2-CG1 3.76Å; L267-V277 HydrophobicContact CD2-CG2 3.38Å; L267-L298 HydrophobicContact CB-CD2 3.69Å; L267-L298 HydrophobicContact CD1-CD2 4.39Å; L267-L300 HydrophobicContact CD1-CB 4.28Å; L267-L300 HydrophobicContact CD1-CD1 4.07Å; L267-L300 HydrophobicContact CD1-CD2 3.86Å; L267-L300 HydrophobicContact CD1-CG 4.32Å
268	S	92.4	Very high	88.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.8	169.4	63.5	0	0	0	0	110.8	H250 V275 K276 Y278	H250-S268 PolarHBondContact CD2-OG 3.15Å; H250-S268 PolarHBondContact NE2-OG 3.25Å; S268-V275 CarbonylContact O-C 3.53Å; S268-V275 VanDerWaalsContact O-CA 3.25Å; S268-V275 WeakPolarHBondContact O-CA 3.49Å; S268-K276 PolarHBondContact N-O 3.2Å; S268-K276 PolarHBondContact O-N 3.07Å; S268-Y278 WeakPolarHBondContact OG-CE2 3.41Å
269	A	92.7	Very high	88.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	139.2	174	0	0	0	0	0	110.4	I254 T255 C256 V275 I295 L298	I254-A269 CarbonylContact C-O 3.59Å; I254-A269 WeakPolarHBondContact CA-O 3.4Å; I254-A269 WeakPolarHBondContact CG2-O 3.29Å; T255-A269 PolarHBondContact N-O 3.06Å; T255-A269 PolarHBondContact OG1-O 3.49Å; C256-A269 HydrophobicContact CB-CB 4.39Å; C256-A269 PolarHBondContact N-O 3.5Å; C256-A269 PolarHBondContact O-N 2.78Å; A269-V275 HydrophobicContact CB-CG2 4.1Å; A269-I295 HydrophobicContact CB-CB 4.31Å; A269-I295 HydrophobicContact CB-CD1 4.48Å; A269-I295 HydrophobicContact CB-CG2 3.72Å; A269-L298 HydrophobicContact CB-CB 3.81Å; A269-L298 HydrophobicContact CB-CD2 3.98Å; A269-L298 HydrophobicContact CB-CG 4.45Å
270	S	92.3	Very high	88.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	158.2	-176.3	166.4	0	0	0	0	112.1	H250 T253 D272 R273 H274	H250-S270 WeakPolarHBondContact ND1-CB 3.42Å; T253-S270 WeakPolarHBondContact O-CA 3.35Å; T253-S270 WeakPolarHBondContact O-CB 3.46Å; T253-S270 PolarHBondContact O-OG 3.49Å; T253-S270 VanDerWaalsContact O-OG 3.06Å; S270-D272 WeakPolarHBondContact CB-OD1 3.31Å; S270-D272 PolarHBondContact O-N 3.49Å; S270-D272 VanDerWaalsContact O-N 3.13Å; S270-D272 PolarHBondContact OG-N 2.92Å; S270-D272 VanDerWaalsContact OG-N 3.13Å; S270-D272 PolarHBondContact OG-OD1 2.7Å; S270-D272 VanDerWaalsContact OG-OD1 3.08Å; S270-D272 PolarHBondContact OG-OD2 3.42Å; S270-R273 PolarHBondContact O-N 3.07Å; S270-R273 VanDerWaalsContact O-N 3.14Å; S270-H274 PolarHBondContact N-O 2.99Å
271	L	92	Very high	88.4	Confident	59 Å²	59	38.8 Å²	38.8	31%	0.309	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-10.3	171.9	-156.4	76.4	0	0	0	112.3	K252 T253 T255 R273 A294 T312	K252-L271 HydrophobicContact CB-CB 4.07Å; K252-L271 HydrophobicContact CD-CB 4.31Å; T253-L271 PolarHBondContact O-N 3.23Å; T255-L271 HydrophobicContact CG2-CD1 4.47Å; L271-R273 PolarHBondContact O-N 3.25Å; L271-A294 HydrophobicContact CD1-CB 3.59Å; L271-A294 HydrophobicContact CG-CB 3.86Å; L271-A294 WeakPolarHBondContact O-CB 3.27Å; L271-T312 HydrophobicContact CD1-CG2 4.49Å
272	D	90.4	Very high	89	Confident	20 Å²	20	40.9 Å²	40.9	11%	0.107	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	5.9	171.3	66.2	18.7	0	0	0	113.9	H250 H251 K252 S270 H274	H250-D272 WeakPolarHBondContact CA-OD2 3.5Å; H250-D272 WeakPolarHBondContact CB-OD2 3.36Å; H250-D272 IonicContact CG-OD2 3.48Å; H250-D272 IonicContact ND1-OD1 2.78Å; H250-D272 PolarHBondContact ND1-OD1 3.15Å; H250-D272 IonicContact ND1-OD2 3.55Å; H250-D272 PolarHBondContact ND1-OD2 3.06Å; H251-D272 PolarHBondContact N-OD2 3.42Å; H251-D272 VanDerWaalsContact N-OD2 3.11Å; K252-D272 HydrophobicContact CB-CB 4.03Å; K252-D272 HydrophobicContact CD-CB 4.37Å; K252-D272 HydrophobicContact CG-CB 4.09Å; S270-D272 WeakPolarHBondContact CB-OD1 3.31Å; S270-D272 PolarHBondContact O-N 3.49Å; S270-D272 VanDerWaalsContact O-N 3.13Å; S270-D272 PolarHBondContact OG-N 2.92Å; S270-D272 VanDerWaalsContact OG-N 3.13Å; S270-D272 PolarHBondContact OG-OD1 2.7Å; S270-D272 VanDerWaalsContact OG-OD1 3.08Å; S270-D272 PolarHBondContact OG-OD2 3.42Å; D272-H274 PolarHBondContact O-CE1 3.31Å; D272-H274 PolarHBondContact O-N 3.39Å; D272-H274 PolarHBondContact O-ND1 3.06Å; D272-H274 VanDerWaalsContact OD1-CB 3.24Å; D272-H274 WeakPolarHBondContact OD1-CB 3.43Å; D272-H274 IonicContact OD1-CG 3.89Å; D272-H274 PolarHBondContact OD1-N 3Å; D272-H274 IonicContact OD1-ND1 4Å; D272-H274 PolarHBondContact OD1-ND1 2.88Å
273	R	92.1	Very high	89.4	Confident	130 Å²	130	35.3 Å²	35.3	49%	0.491	18%	0.179	S	C	.	.	S	Bend	trans	73.9	1.7	-179.2	-40.8	-179.1	176.2	163.4	-2.7	114.8	S270 L271 Y291 A292 A293	S270-R273 PolarHBondContact O-N 3.07Å; S270-R273 VanDerWaalsContact O-N 3.14Å; L271-R273 PolarHBondContact O-N 3.25Å; R273-Y291 VanDerWaalsContact CB-O 3.3Å; R273-Y291 WeakPolarHBondContact CB-O 3.38Å; R273-Y291 WeakPolarHBondContact CD-O 3.4Å; R273-Y291 PolarHBondContact O-N 3.02Å; R273-Y291 VanDerWaalsContact O-N 3.15Å; R273-A292 PolarHBondContact NE-O 3.08Å; R273-A293 WeakPolarHBondContact CB-O 3.25Å; R273-A293 WeakPolarHBondContact CG-O 3.19Å
274	H	92.8	Very high	89.9	Confident	54 Å²	54	41.9 Å²	41.9	25%	0.25	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	141.4	-177.8	-61.9	82.4	0	0	0	111.4	S270 D272 N288 F289 D290	S270-H274 PolarHBondContact N-O 2.99Å; D272-H274 PolarHBondContact O-CE1 3.31Å; D272-H274 PolarHBondContact O-N 3.39Å; D272-H274 PolarHBondContact O-ND1 3.06Å; D272-H274 VanDerWaalsContact OD1-CB 3.24Å; D272-H274 WeakPolarHBondContact OD1-CB 3.43Å; D272-H274 IonicContact OD1-CG 3.89Å; D272-H274 PolarHBondContact OD1-N 3Å; D272-H274 IonicContact OD1-ND1 4Å; D272-H274 PolarHBondContact OD1-ND1 2.88Å; H274-N288 WeakPolarHBondContact CB-OD1 3.29Å; H274-N288 PolarHBondContact CD2-ND2 3.28Å; H274-N288 VanDerWaalsContact CD2-ND2 3.27Å; H274-N288 PolarHBondContact CD2-OD1 3.03Å; H274-F289 CarbonylContact C-O 3.55Å; H274-F289 VanDerWaalsContact CA-O 3.31Å; H274-F289 WeakPolarHBondContact CA-O 3.47Å; H274-D290 IonicContact NE2-OD1 3.66Å
275	V	92.8	Very high	90.1	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.6	161.8	-177.2	0	0	0	0	108.4	L267 S268 A269 N288 F289 Y291 I295 L298	L267-V275 HydrophobicContact CB-CG1 4.33Å; L267-V275 HydrophobicContact CD2-CG1 4.36Å; S268-V275 CarbonylContact O-C 3.53Å; S268-V275 VanDerWaalsContact O-CA 3.25Å; S268-V275 WeakPolarHBondContact O-CA 3.49Å; A269-V275 HydrophobicContact CB-CG2 4.1Å; V275-N288 WeakPolarHBondContact O-CA 3.27Å; V275-N288 PolarHBondContact O-OD1 3.45Å; V275-F289 HydrophobicContact CB-CB 4.14Å; V275-F289 HydrophobicContact CB-CD2 4.2Å; V275-F289 HydrophobicContact CG1-CD2 4.34Å; V275-F289 PolarHBondContact N-O 3.11Å; V275-F289 PolarHBondContact O-N 3.09Å; V275-Y291 HydrophobicContact CB-CE2 4.31Å; V275-Y291 HydrophobicContact CG2-CD2 4.17Å; V275-Y291 HydrophobicContact CG2-CE2 3.66Å; V275-I295 HydrophobicContact CG2-CD1 3.33Å; V275-L298 HydrophobicContact CG1-CD2 3.85Å; V275-L298 HydrophobicContact CG2-CD1 4.42Å
276	K	92.4	Very high	90.1	Very high	36 Å²	36	39.2 Å²	39.2	16%	0.157	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	134.2	177.4	-66.9	-173.8	179.6	-164.2	0	110.1	N249 L267 S268 Y278 V285	N249-K276 HydrophobicContact CB-CD 3.86Å; N249-K276 PolarHBondContact O-NZ 2.8Å; L267-K276 WeakPolarHBondContact CA-O 3.5Å; S268-K276 PolarHBondContact N-O 3.2Å; S268-K276 PolarHBondContact O-N 3.07Å; K276-Y278 HydrophobicContact CB-CE2 4.14Å; K276-V285 HydrophobicContact CD-CG2 4.41Å
277	V	92.4	Very high	89.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	124.4	174.2	-167.3	0	0	0	0	108.6	W26 R265 L266 L267 V286 H287 F289	W26-V277 HydrophobicContact CD2-CG2 4.3Å; W26-V277 HydrophobicContact CZ2-CG1 3.79Å; R265-V277 HydrophobicContact CB-CG1 4.14Å; L266-V277 CarbonylContact O-C 3.59Å; L266-V277 WeakPolarHBondContact O-CA 3.41Å; L267-V277 HydrophobicContact CD2-CB 3.89Å; L267-V277 HydrophobicContact CD2-CG1 3.76Å; L267-V277 HydrophobicContact CD2-CG2 3.38Å; V277-V286 PolarHBondContact O-N 3.49Å; V277-H287 HydrophobicContact CB-CB 4.26Å; V277-H287 HydrophobicContact CG2-CB 4.01Å; V277-H287 PolarHBondContact N-O 3.31Å; V277-H287 PolarHBondContact O-N 3.2Å; V277-F289 HydrophobicContact CG2-CD2 4.24Å; V277-F289 HydrophobicContact CG2-CE2 3.82Å
278	Y	91	Very high	89.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	149.9	173.7	-55.5	-78.4	0	0	0	111	L247 N249 R265 L266 S268 K276 K284 V285	L247-Y278 HydrophobicContact CD1-CD1 4.24Å; L247-Y278 HydrophobicContact CD1-CD2 4.37Å; L247-Y278 HydrophobicContact CD1-CE1 4.29Å; L247-Y278 HydrophobicContact CD1-CE2 4.37Å; L247-Y278 HydrophobicContact CD1-CG 4.3Å; N249-Y278 HydrophobicContact CB-CE1 4.49Å; N249-Y278 WeakPolarHBondContact CB-OH 3.49Å; N249-Y278 WeakPolarHBondContact ND2-CE1 3.24Å; N249-Y278 PolarHBondContact ND2-OH 3.01Å; R265-Y278 VanDerWaalsContact CA-O 3.27Å; R265-Y278 WeakPolarHBondContact CA-O 3.16Å; R265-Y278 WeakPolarHBondContact CD-O 3.47Å; L266-Y278 HydrophobicContact CB-CD2 4.49Å; L266-Y278 HydrophobicContact CD2-CD2 4.15Å; L266-Y278 HydrophobicContact CG-CD2 4.29Å; L266-Y278 PolarHBondContact N-O 3.16Å; L266-Y278 PolarHBondContact O-N 2.91Å; S268-Y278 WeakPolarHBondContact OG-CE2 3.41Å; K276-Y278 HydrophobicContact CB-CE2 4.14Å; Y278-K284 WeakPolarHBondContact CA-O 3.36Å; Y278-V285 HydrophobicContact CD1-CG2 3.99Å; Y278-V285 HydrophobicContact CE1-CB 4.35Å; Y278-V285 HydrophobicContact CE1-CG2 3.39Å
279	N	89.7	Confident	89.8	Confident	33 Å²	33	44.4 Å²	44.4	18%	0.176	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130.3	163.9	-174	-28	0	0	0	109.7	T281 Y283 K284 V286	N279-T281 VanDerWaalsContact C-N 3.3Å; N279-T281 PolarHBondContact O-N 3.05Å; N279-T281 PolarHBondContact OD1-N 3.38Å; N279-Y283 WeakPolarHBondContact O-CA 3.27Å; N279-Y283 PolarHBondContact O-N 3.38Å; N279-K284 PolarHBondContact N-O 2.77Å; N279-V286 HydrophobicContact CB-CG2 3.89Å
280	T	82.3	Confident	89.7	Confident	21 Å²	21	49.7 Å²	49.7	13%	0.129	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-29.6	-177.8	-60.2	0	0	0	0	113.6	Y217 G263 E264 Y283	Y217-T280 HydrophobicContact CE1-CG2 3.57Å; Y217-T280 HydrophobicContact CE2-CG2 4.47Å; Y217-T280 VanDerWaalsContact OH-CG2 3.27Å; Y217-T280 WeakPolarHBondContact OH-CG2 3.47Å; Y217-T280 PolarHBondContact OH-OG1 3.18Å; G263-T280 PolarHBondContact O-OG1 3.17Å; E264-T280 VanDerWaalsContact C-OG1 3.26Å; E264-T280 PolarHBondContact O-N 3.04Å; E264-T280 VanDerWaalsContact O-N 3.08Å; E264-T280 PolarHBondContact O-OG1 3.28Å; T280-Y283 WeakPolarHBondContact O-CE2 3.41Å; T280-Y283 PolarHBondContact O-OH 3.13Å
281	T	85.9	Confident	89.7	Confident	125 Å²	125	50.5 Å²	50.5	77%	0.767	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-36.2	-177	-49.5	0	0	0	0	112.8	N279	N279-T281 VanDerWaalsContact C-N 3.3Å; N279-T281 PolarHBondContact O-N 3.05Å; N279-T281 PolarHBondContact OD1-N 3.38Å
282	T	85.9	Confident	89.5	Confident	83 Å²	83	51.6 Å²	51.6	51%	0.509	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-12.3	-174.2	55.5	0	0	0	0	113.6	K284	T282-K284 PolarHBondContact O-N 2.77Å
283	Y	86.6	Confident	89.5	Confident	28 Å²	28	51 Å²	51	11%	0.11	27%	0.272	C	S	.	.			trans	48.8	25.6	-172.9	-61.8	-77.3	0	0	0	115.3	V234 V245 L247 N279 T280	V234-Y283 HydrophobicContact CG2-CD1 4.26Å; V234-Y283 HydrophobicContact CG2-CE1 3.67Å; V245-Y283 HydrophobicContact CB-CD2 4.26Å; V245-Y283 HydrophobicContact CG1-CD2 4.25Å; V245-Y283 HydrophobicContact CG1-CG 4.24Å; V245-Y283 HydrophobicContact CG2-CD2 3.71Å; V245-Y283 HydrophobicContact CG2-CE2 3.92Å; V245-Y283 HydrophobicContact CG2-CG 4.48Å; L247-Y283 HydrophobicContact CD1-CD1 4.11Å; N279-Y283 WeakPolarHBondContact O-CA 3.27Å; N279-Y283 PolarHBondContact O-N 3.38Å; T280-Y283 WeakPolarHBondContact O-CE2 3.41Å; T280-Y283 PolarHBondContact O-OH 3.13Å
284	K	88.4	Confident	89.5	Confident	151 Å²	151	45.6 Å²	45.6	66%	0.657	25%	0.254	S	S	*	.			trans	-81.9	145.5	172	-68.5	-175.3	178.6	-178.7	0	110.4	Y278 N279 T282 V286	Y278-K284 WeakPolarHBondContact CA-O 3.36Å; N279-K284 PolarHBondContact N-O 2.77Å; T282-K284 PolarHBondContact O-N 2.77Å; K284-V286 PolarHBondContact O-N 3.37Å
285	V	88.9	Confident	89.5	Confident	58 Å²	58	43 Å²	43	35%	0.352	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	123.5	171.8	-177.4	0	0	0	0	108	N249 K276 Y278	N249-V285 HydrophobicContact CB-CG2 4.26Å; K276-V285 HydrophobicContact CD-CG2 4.41Å; Y278-V285 HydrophobicContact CD1-CG2 3.99Å; Y278-V285 HydrophobicContact CE1-CB 4.35Å; Y278-V285 HydrophobicContact CE1-CG2 3.39Å
286	V	87.6	Confident	89.3	Confident	23 Å²	23	46 Å²	46	14%	0.139	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-46.9	177.8	176.9	0	0	0	0	110.4	D22 T23 V277 N279 K284	D22-V286 HydrophobicContact CB-CG1 3.24Å; T23-V286 WeakPolarHBondContact CG2-O 3.49Å; V277-V286 PolarHBondContact O-N 3.49Å; N279-V286 HydrophobicContact CB-CG2 3.89Å; K284-V286 PolarHBondContact O-N 3.37Å
287	H	87.9	Confident	89.2	Confident	29 Å²	29	44.3 Å²	44.3	13%	0.134	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.9	-177.2	-164.8	60.4	0	0	0	111.4	W26 V277 F289	W26-H287 HydrophobicContact CB-CB 4.06Å; W26-H287 WeakPolarHBondContact CB-CD2 3.37Å; W26-H287 HydrophobicContact CG-CB 4.14Å; V277-H287 HydrophobicContact CB-CB 4.26Å; V277-H287 HydrophobicContact CG2-CB 4.01Å; V277-H287 PolarHBondContact N-O 3.31Å; V277-H287 PolarHBondContact O-N 3.2Å; H287-F289 AromaticContact CD2-CD1 3.95Å; H287-F289 AromaticContact CD2-CE1 3.65Å; H287-F289 AromaticContact CD2-CE2 3.99Å; H287-F289 AromaticContact CD2-CZ 3.68Å; H287-F289 AromaticContact NE2-CD1 3.91Å; H287-F289 AromaticContact NE2-CE1 3.71Å
288	N	91.4	Very high	89.2	Confident	69 Å²	69	44.6 Å²	44.6	37%	0.369	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.8	179.3	-173.5	16.9	0	0	0	109.1	H274 V275	H274-N288 WeakPolarHBondContact CB-OD1 3.29Å; H274-N288 PolarHBondContact CD2-ND2 3.28Å; H274-N288 VanDerWaalsContact CD2-ND2 3.27Å; H274-N288 PolarHBondContact CD2-OD1 3.03Å; V275-N288 WeakPolarHBondContact O-CA 3.27Å; V275-N288 PolarHBondContact O-OD1 3.45Å
289	F	90.1	Very high	89.1	Confident	12 Å²	12	45 Å²	45	5%	0.053	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.5	170.2	-62.7	-72	0	0	0	109.7	W26 H274 V275 V277 H287 Y291 I307	W26-F289 HydrophobicContact CB-CE1 4.43Å; W26-F289 HydrophobicContact CB-CZ 3.84Å; W26-F289 HydrophobicContact CD2-CE2 4.45Å; W26-F289 HydrophobicContact CD2-CZ 4.24Å; W26-F289 HydrophobicContact CE3-CE2 4.01Å; W26-F289 AromaticContact CE3-CZ 3.75Å; W26-F289 HydrophobicContact CE3-CZ 3.75Å; W26-F289 HydrophobicContact CG-CZ 4.32Å; H274-F289 CarbonylContact C-O 3.55Å; H274-F289 VanDerWaalsContact CA-O 3.31Å; H274-F289 WeakPolarHBondContact CA-O 3.47Å; V275-F289 HydrophobicContact CB-CB 4.14Å; V275-F289 HydrophobicContact CB-CD2 4.2Å; V275-F289 HydrophobicContact CG1-CD2 4.34Å; V275-F289 PolarHBondContact N-O 3.11Å; V275-F289 PolarHBondContact O-N 3.09Å; V277-F289 HydrophobicContact CG2-CD2 4.24Å; V277-F289 HydrophobicContact CG2-CE2 3.82Å; H287-F289 AromaticContact CD2-CD1 3.95Å; H287-F289 AromaticContact CD2-CE1 3.65Å; H287-F289 AromaticContact CD2-CE2 3.99Å; H287-F289 AromaticContact CD2-CZ 3.68Å; H287-F289 AromaticContact NE2-CD1 3.91Å; H287-F289 AromaticContact NE2-CE1 3.71Å; F289-Y291 HydrophobicContact CB-CD2 4.38Å; F289-Y291 HydrophobicContact CB-CE2 3.66Å; F289-I307 HydrophobicContact CE2-CD1 3.94Å; F289-I307 HydrophobicContact CZ-CD1 3.85Å
290	D	91.6	Very high	89.1	Confident	111 Å²	111	44.3 Å²	44.3	59%	0.594	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	141.1	172.4	-171	19.8	0	0	0	110.7	H274	H274-D290 IonicContact NE2-OD1 3.66Å
291	Y	91.1	Very high	89.2	Confident	17 Å²	17	43.4 Å²	43.4	7%	0.067	25%	0.247	C	C	.	.			trans	-131.4	156.5	179.3	-68.6	-85.4	0	0	0	110.5	R273 V275 F289 A293 I295 V309 K319	R273-Y291 VanDerWaalsContact CB-O 3.3Å; R273-Y291 WeakPolarHBondContact CB-O 3.38Å; R273-Y291 WeakPolarHBondContact CD-O 3.4Å; R273-Y291 PolarHBondContact O-N 3.02Å; R273-Y291 VanDerWaalsContact O-N 3.15Å; V275-Y291 HydrophobicContact CB-CE2 4.31Å; V275-Y291 HydrophobicContact CG2-CD2 4.17Å; V275-Y291 HydrophobicContact CG2-CE2 3.66Å; F289-Y291 HydrophobicContact CB-CD2 4.38Å; F289-Y291 HydrophobicContact CB-CE2 3.66Å; Y291-A293 VanDerWaalsContact C-N 3.31Å; Y291-A293 PolarHBondContact O-N 3.43Å; Y291-I295 HydrophobicContact CD2-CD1 3.62Å; Y291-I295 HydrophobicContact CD2-CG1 4.47Å; Y291-I295 HydrophobicContact CE2-CD1 4.16Å; Y291-I295 HydrophobicContact CG-CD1 4.31Å; Y291-V309 HydrophobicContact CE1-CB 4.25Å; Y291-V309 HydrophobicContact CE1-CG2 4.02Å; Y291-V309 HydrophobicContact CE2-CG1 4.42Å; Y291-V309 HydrophobicContact CE2-CG2 4.01Å; Y291-V309 WeakPolarHBondContact OH-CG2 3.28Å; Y291-K319 VanDerWaalsContact CZ-NZ 3.31Å; Y291-K319 WeakPolarHBondContact OH-CD 3.5Å; Y291-K319 WeakPolarHBondContact OH-CE 3.16Å; Y291-K319 PolarHBondContact OH-NZ 3.08Å
292	A	88	Confident	88.8	Confident	82 Å²	82	40 Å²	40	68%	0.678	23%	0.227	S	C	*	.	S	Bend	trans	-71	-26.1	-175.5	0	0	0	0	0	113.6	R273	R273-A292 PolarHBondContact NE-O 3.08Å
293	A	90.9	Very high	88.5	Confident	8 Å²	8	40.6 Å²	40.6	7%	0.066	23%	0.227	C	C	.	.	S	Bend	trans	-132.6	166.8	-174.8	0	0	0	0	0	111.8	R273 Y291 M311 N313	R273-A293 WeakPolarHBondContact CB-O 3.25Å; R273-A293 WeakPolarHBondContact CG-O 3.19Å; Y291-A293 VanDerWaalsContact C-N 3.31Å; Y291-A293 PolarHBondContact O-N 3.43Å; A293-M311 HydrophobicContact CB-CB 4Å; A293-M311 HydrophobicContact CB-CG 4.29Å; A293-M311 HydrophobicContact CB-SD 3.98Å; A293-N313 HydrophobicContact CB-CB 4.38Å
294	A	92.1	Very high	88.2	Confident	16 Å²	16	39.4 Å²	39.4	13%	0.132	22%	0.222	C	C	.	.			trans	-68	142.9	-180	0	0	0	0	0	110.3	L271 M311 T312	L271-A294 HydrophobicContact CD1-CB 3.59Å; L271-A294 HydrophobicContact CG-CB 3.86Å; L271-A294 WeakPolarHBondContact O-CB 3.27Å; A294-M311 CarbonylContact O-C 3.44Å; A294-M311 VanDerWaalsContact O-CA 3.3Å; A294-M311 WeakPolarHBondContact O-CA 3.34Å; A294-T312 HydrophobicContact CB-CG2 3.93Å; A294-T312 PolarHBondContact O-N 3.08Å
295	I	92.5	Very high	88	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.5	-172.8	-58.4	168.1	0	0	0	108.8	T255 A269 V275 Y291 S297 V309	T255-I295 WeakPolarHBondContact CB-O 3.45Å; T255-I295 VanDerWaalsContact CG2-O 3.31Å; T255-I295 WeakPolarHBondContact CG2-O 3.33Å; T255-I295 PolarHBondContact OG1-O 3.3Å; A269-I295 HydrophobicContact CB-CB 4.31Å; A269-I295 HydrophobicContact CB-CD1 4.48Å; A269-I295 HydrophobicContact CB-CG2 3.72Å; V275-I295 HydrophobicContact CG2-CD1 3.33Å; Y291-I295 HydrophobicContact CD2-CD1 3.62Å; Y291-I295 HydrophobicContact CD2-CG1 4.47Å; Y291-I295 HydrophobicContact CE2-CD1 4.16Å; Y291-I295 HydrophobicContact CG-CD1 4.31Å; I295-S297 WeakPolarHBondContact CG2-O 3.26Å; I295-V309 HydrophobicContact CB-CG1 4.14Å; I295-V309 HydrophobicContact CD1-CG1 3.82Å; I295-V309 HydrophobicContact CG1-CG1 3.65Å; I295-V309 HydrophobicContact CG2-CG1 3.44Å; I295-V309 VanDerWaalsContact CG2-CG1 3.44Å
296	L	89.6	Confident	87.9	Confident	64 Å²	64	31.8 Å²	31.8	34%	0.335	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-42.1	176.5	-174.1	57.5	0	0	0	111.2	A40 V41 T255 G310	A40-L296 HydrophobicContact CB-CD2 4.33Å; V41-L296 VanDerWaalsContact O-CD2 3.29Å; V41-L296 WeakPolarHBondContact O-CD2 3.41Å; V41-L296 WeakPolarHBondContact O-CG 3.29Å; T255-L296 WeakPolarHBondContact CB-O 2.89Å; L296-G310 PolarHBondContact N-O 2.75Å
297	S	89.1	Confident	88.1	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.007	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145.2	-177.5	48	0	0	0	0	111.3	V41 I44 I295 G310	V41-S297 WeakPolarHBondContact CG1-OG 3.45Å; V41-S297 PolarHBondContact O-OG 2.99Å; I44-S297 WeakPolarHBondContact CD1-OG 3.34Å; I295-S297 WeakPolarHBondContact CG2-O 3.26Å; S297-G310 PolarHBondContact N-O 3.27Å; S297-G310 PolarHBondContact O-N 3.44Å
298	L	91.9	Very high	88.2	Confident	6 Å²	6	29.4 Å²	29.4	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	132.7	177.9	173.4	71.6	0	0	0	108.1	C256 A258 L267 A269 V275 I307 V309	C256-L298 HydrophobicContact CB-CB 4.12Å; C256-L298 PolarHBondContact SG-O 2.93Å; C256-L298 VanDerWaalsContact SG-O 3.35Å; A258-L298 HydrophobicContact CB-CD2 4.09Å; A258-L298 HydrophobicContact CB-CG 4.3Å; L267-L298 HydrophobicContact CB-CD2 3.69Å; L267-L298 HydrophobicContact CD1-CD2 4.39Å; A269-L298 HydrophobicContact CB-CB 3.81Å; A269-L298 HydrophobicContact CB-CD2 3.98Å; A269-L298 HydrophobicContact CB-CG 4.45Å; V275-L298 HydrophobicContact CG1-CD2 3.85Å; V275-L298 HydrophobicContact CG2-CD1 4.42Å; L298-I307 HydrophobicContact CD1-CG2 3.75Å; L298-V309 HydrophobicContact CD1-CG2 3.66Å
299	A	89.3	Confident	88.2	Confident	8 Å²	8	26.1 Å²	26.1	7%	0.066	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	151.3	170.5	0	0	0	0	0	110.7	I44 F46 V308	I44-A299 HydrophobicContact CB-CB 3.8Å; I44-A299 HydrophobicContact CG2-CB 3.52Å; I44-A299 WeakPolarHBondContact O-CB 3.23Å; F46-A299 HydrophobicContact CD2-CB 3.61Å; F46-A299 HydrophobicContact CE2-CB 3.62Å; A299-V308 PolarHBondContact N-O 3.13Å; A299-V308 PolarHBondContact O-N 2.94Å
300	L	89.3	Confident	88.3	Confident	19 Å²	19	25.5 Å²	25.5	10%	0.099	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.2	178.9	-170.4	75.4	0	0	0	109.4	F46 L259 L267 D304 I307	F46-L300 VanDerWaalsContact CD2-O 3.3Å; F46-L300 WeakPolarHBondContact CD2-O 3.48Å; F46-L300 VanDerWaalsContact CE2-C 3.46Å; L259-L300 WeakPolarHBondContact O-CD2 3.41Å; L267-L300 HydrophobicContact CD1-CB 4.28Å; L267-L300 HydrophobicContact CD1-CD1 4.07Å; L267-L300 HydrophobicContact CD1-CD2 3.86Å; L267-L300 HydrophobicContact CD1-CG 4.32Å; L300-D304 WeakPolarHBondContact CD2-OD1 3.46Å; L300-I307 HydrophobicContact CD1-CB 4.25Å; L300-I307 HydrophobicContact CD1-CD1 4.48Å; L300-I307 HydrophobicContact CD1-CG1 3.42Å; L300-I307 VanDerWaalsContact CD1-CG1 3.42Å
301	A	85.6	Confident	88.3	Confident	2 Å²	2	20.5 Å²	20.5	2%	0.017	13%	0.126	C	C	.	.			trans	-65.8	147.4	170.7	0	0	0	0	0	110.9	F46 D303 D304 S306	F46-A301 HydrophobicContact CD1-CB 4.1Å; F46-A301 HydrophobicContact CE1-CB 3.89Å; F46-A301 HydrophobicContact CZ-CB 4.18Å; A301-D303 PolarHBondContact O-N 3.35Å; A301-D303 VanDerWaalsContact O-N 3.08Å; A301-D304 PolarHBondContact O-N 3.22Å; A301-S306 PolarHBondContact N-O 3.08Å
302	P	78.2	Confident	88.3	Confident	54 Å²	54	22.3 Å²	22.3	35%	0.351	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-31	-179.9	-28.7	36.1	0	0	0	115.3
303	D	78.3	Confident	88.3	Confident	94 Å²	94	23.3 Å²	23.3	50%	0.503	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	13.7	-179.5	-66.4	-26.2	0	0	0	114.1	H52 A301 E305	H52-D303 IonicContact NE2-OD2 3.49Å; A301-D303 PolarHBondContact O-N 3.35Å; A301-D303 VanDerWaalsContact O-N 3.08Å; D303-E305 PolarHBondContact O-N 3.18Å
304	D	80.9	Confident	88.2	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.021	14%	0.139	C	C	.	.	S	Bend	trans	55.6	15	-170.6	-62.5	-14.6	0	0	0	114.1	Y25 Y29 G260 S261 L300 A301 S306	Y25-D304 WeakPolarHBondContact OH-CB 3.36Å; Y25-D304 PolarHBondContact OH-OD2 3.24Å; Y29-D304 PolarHBondContact OH-O 2.82Å; G260-D304 WeakPolarHBondContact CA-OD1 3.21Å; S261-D304 WeakPolarHBondContact CA-OD2 3.46Å; S261-D304 WeakPolarHBondContact CB-OD2 3.39Å; S261-D304 VanDerWaalsContact N-CG 3.34Å; S261-D304 PolarHBondContact N-OD1 3.12Å; S261-D304 PolarHBondContact N-OD2 2.96Å; S261-D304 VanDerWaalsContact N-OD2 3.13Å; L300-D304 WeakPolarHBondContact CD2-OD1 3.46Å; A301-D304 PolarHBondContact O-N 3.22Å; D304-S306 VanDerWaalsContact C-N 3.34Å; D304-S306 PolarHBondContact O-N 2.94Å
305	E	84.6	Confident	88.1	Confident	47 Å²	47	25.7 Å²	25.7	22%	0.22	14%	0.144	C	C	.	.			trans	-64.7	-39.7	-174	-179.6	169.9	-149.2	0	0	112	F68 D303 H320 R321	F68-E305 WeakPolarHBondContact CZ-OE1 3.37Å; D303-E305 PolarHBondContact O-N 3.18Å; E305-H320 CarbonylContact O-C 3.49Å; E305-H320 WeakPolarHBondContact O-CA 3.34Å; E305-R321 PolarHBondContact O-N 2.82Å
306	S	86.8	Confident	88.1	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.014	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.1	-179.8	61.4	0	0	0	0	111.9	F46 A301 D304 K319 H320	F46-S306 WeakPolarHBondContact CE1-OG 3.45Å; F46-S306 WeakPolarHBondContact CZ-OG 3.44Å; A301-S306 PolarHBondContact N-O 3.08Å; D304-S306 VanDerWaalsContact C-N 3.34Å; D304-S306 PolarHBondContact O-N 2.94Å; S306-K319 CarbonylContact C-O 3.6Å; S306-K319 VanDerWaalsContact CA-O 3.29Å; S306-K319 WeakPolarHBondContact CA-O 3.42Å; S306-H320 WeakPolarHBondContact CB-ND1 3.41Å
307	I	90.1	Very high	88.2	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.7	167	-55.2	165.5	0	0	0	106.6	W26 Y29 F289 L298 L300 V309 I318 K319	W26-I307 HydrophobicContact CE3-CD1 4.13Å; W26-I307 HydrophobicContact CZ3-CD1 3.92Å; Y29-I307 HydrophobicContact CD1-CD1 4.03Å; Y29-I307 HydrophobicContact CD1-CG1 4.4Å; Y29-I307 HydrophobicContact CE1-CD1 3.62Å; Y29-I307 HydrophobicContact CE1-CG1 3.74Å; Y29-I307 HydrophobicContact CE2-CD1 4.2Å; Y29-I307 HydrophobicContact CG-CD1 4.49Å; F289-I307 HydrophobicContact CE2-CD1 3.94Å; F289-I307 HydrophobicContact CZ-CD1 3.85Å; L298-I307 HydrophobicContact CD1-CG2 3.75Å; L300-I307 HydrophobicContact CD1-CB 4.25Å; L300-I307 HydrophobicContact CD1-CD1 4.48Å; L300-I307 HydrophobicContact CD1-CG1 3.42Å; L300-I307 VanDerWaalsContact CD1-CG1 3.42Å; I307-V309 HydrophobicContact CG2-CG2 3.97Å; I307-I318 WeakPolarHBondContact O-CA 3.49Å; I307-K319 HydrophobicContact CB-CB 4.39Å; I307-K319 PolarHBondContact N-O 2.72Å; I307-K319 PolarHBondContact O-N 3.47Å
308	V	91.3	Very high	88.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.4	177.5	-176.1	0	0	0	0	108.6	I44 F46 F54 A299 L316 S317 I318	I44-V308 HydrophobicContact CD1-CG1 3.94Å; I44-V308 HydrophobicContact CG2-CB 4.29Å; I44-V308 HydrophobicContact CG2-CG1 4.04Å; F46-V308 HydrophobicContact CE1-CG2 4.5Å; F46-V308 HydrophobicContact CE2-CB 4.28Å; F46-V308 HydrophobicContact CE2-CG2 4.02Å; F46-V308 HydrophobicContact CZ-CB 4.25Å; F46-V308 HydrophobicContact CZ-CG2 3.49Å; F46-V308 VanDerWaalsContact CZ-CG2 3.49Å; F54-V308 HydrophobicContact CD2-CG1 4.34Å; F54-V308 HydrophobicContact CD2-CG2 4.35Å; F54-V308 HydrophobicContact CE1-CG2 4.42Å; F54-V308 HydrophobicContact CE2-CG1 4.1Å; F54-V308 HydrophobicContact CE2-CG2 4.26Å; F54-V308 HydrophobicContact CG-CG2 4.5Å; F54-V308 HydrophobicContact CZ-CG2 4.29Å; A299-V308 PolarHBondContact N-O 3.13Å; A299-V308 PolarHBondContact O-N 2.94Å; V308-L316 HydrophobicContact CG1-CD1 3.42Å; V308-L316 VanDerWaalsContact CG1-CD1 3.42Å; V308-L316 HydrophobicContact CG1-CD2 4.08Å; V308-L316 HydrophobicContact CG1-CG 3.81Å; V308-S317 WeakPolarHBondContact CA-O 3.47Å; V308-I318 HydrophobicContact CG1-CG1 4.23Å; V308-I318 HydrophobicContact CG2-CG1 4.18Å; V308-I318 HydrophobicContact CG2-CG2 4.1Å
309	V	91.4	Very high	88.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	119.6	-176.1	-173.2	0	0	0	0	109.4	Y291 I295 L298 I307 S317	Y291-V309 HydrophobicContact CE1-CB 4.25Å; Y291-V309 HydrophobicContact CE1-CG2 4.02Å; Y291-V309 HydrophobicContact CE2-CG1 4.42Å; Y291-V309 HydrophobicContact CE2-CG2 4.01Å; Y291-V309 WeakPolarHBondContact OH-CG2 3.28Å; I295-V309 HydrophobicContact CB-CG1 4.14Å; I295-V309 HydrophobicContact CD1-CG1 3.82Å; I295-V309 HydrophobicContact CG1-CG1 3.65Å; I295-V309 HydrophobicContact CG2-CG1 3.44Å; I295-V309 VanDerWaalsContact CG2-CG1 3.44Å; L298-V309 HydrophobicContact CD1-CG2 3.66Å; I307-V309 HydrophobicContact CG2-CG2 3.97Å; V309-S317 PolarHBondContact N-O 2.82Å; V309-S317 PolarHBondContact O-N 3.03Å
310	G	92.8	Very high	87.9	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.9	173.3	0	0	0	0	0	110.4	I44 L296 S297	I44-G310 VanDerWaalsContact CD1-N 3.34Å; L296-G310 PolarHBondContact N-O 2.75Å; S297-G310 PolarHBondContact N-O 3.27Å; S297-G310 PolarHBondContact O-N 3.44Å
311	M	91.6	Very high	87.6	Confident	6 Å²	6	25.8 Å²	25.8	3%	0.03	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	159.3	178.2	-64.1	176.4	-75.4	0	0	111.9	A293 A294 N313 S314 I315	A293-M311 HydrophobicContact CB-CB 4Å; A293-M311 HydrophobicContact CB-CG 4.29Å; A293-M311 HydrophobicContact CB-SD 3.98Å; A294-M311 CarbonylContact O-C 3.44Å; A294-M311 VanDerWaalsContact O-CA 3.3Å; A294-M311 WeakPolarHBondContact O-CA 3.34Å; M311-N313 PolarHBondContact O-N 3.04Å; M311-S314 PolarHBondContact O-N 2.78Å; M311-I315 WeakPolarHBondContact CB-O 3.4Å; M311-I315 HydrophobicContact CE-CB 3.64Å; M311-I315 HydrophobicContact CE-CG2 3.34Å; M311-I315 WeakPolarHBondContact CE-O 3.41Å; M311-I315 PolarHBondContact N-O 3.32Å
312	T	90	Very high	87	Confident	55 Å²	55	31.1 Å²	31.1	34%	0.337	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-28	176.4	54.8	0	0	0	0	113.2	L271 A294 S314	L271-T312 HydrophobicContact CD1-CG2 4.49Å; A294-T312 HydrophobicContact CB-CG2 3.93Å; A294-T312 PolarHBondContact O-N 3.08Å; T312-S314 PolarHBondContact O-N 3.33Å
313	N	88.6	Confident	86.1	Confident	103 Å²	103	32 Å²	32	55%	0.551	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	21.6	-176	-64.7	8.5	0	0	0	113.1	A293 M311 I315	A293-N313 HydrophobicContact CB-CB 4.38Å; M311-N313 PolarHBondContact O-N 3.04Å; N313-I315 HydrophobicContact CB-CD1 4.44Å; N313-I315 PolarHBondContact O-N 2.98Å
314	S	87.4	Confident	84.8	Confident	28 Å²	28	31.6 Å²	31.6	20%	0.196	16%	0.161	C	C	.	.	S	Bend	trans	60.1	24.1	-176.4	-39	0	0	0	0	113.3	E37 G39 M311 T312	E37-S314 WeakPolarHBondContact CA-O 3.49Å; E37-S314 WeakPolarHBondContact CB-O 3.39Å; E37-S314 PolarHBondContact N-O 3.21Å; E37-S314 WeakPolarHBondContact O-CB 3.47Å; G39-S314 VanDerWaalsContact C-CB 3.47Å; G39-S314 WeakPolarHBondContact CA-OG 3.42Å; G39-S314 WeakPolarHBondContact O-CA 3.3Å; G39-S314 VanDerWaalsContact O-CB 3.25Å; G39-S314 WeakPolarHBondContact O-CB 3.38Å; G39-S314 PolarHBondContact O-OG 3.28Å; M311-S314 PolarHBondContact O-N 2.78Å; T312-S314 PolarHBondContact O-N 3.33Å
315	I	91.6	Very high	83.3	Confident	46 Å²	46	38.2 Å²	38.2	24%	0.236	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.1	178.2	-63.2	165.6	0	0	0	107.8	Q34 I35 M311 N313	Q34-I315 HydrophobicContact CB-CG2 3.94Å; Q34-I315 HydrophobicContact CG-CG2 4.26Å; I35-I315 CarbonylContact O-C 3.57Å; I35-I315 WeakPolarHBondContact O-CA 3.42Å; M311-I315 WeakPolarHBondContact CB-O 3.4Å; M311-I315 HydrophobicContact CE-CB 3.64Å; M311-I315 HydrophobicContact CE-CG2 3.34Å; M311-I315 WeakPolarHBondContact CE-O 3.41Å; M311-I315 PolarHBondContact N-O 3.32Å; N313-I315 HydrophobicContact CB-CD1 4.44Å; N313-I315 PolarHBondContact O-N 2.98Å
316	L	91.3	Very high	81.5	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.3	171.4	-171.1	75.2	0	0	0	108.8	Q34 I35 E37 V41 I44 F54 V56 Y65 V308 I318	Q34-L316 CarbonylContact C-O 3.52Å; Q34-L316 WeakPolarHBondContact CA-O 3.29Å; I35-L316 HydrophobicContact CB-CB 4.35Å; I35-L316 PolarHBondContact N-O 3.24Å; I35-L316 PolarHBondContact O-N 3.35Å; E37-L316 HydrophobicContact CG-CB 4.41Å; V41-L316 HydrophobicContact CG1-CD1 4.4Å; V41-L316 HydrophobicContact CG2-CD1 4.47Å; I44-L316 HydrophobicContact CD1-CD1 3.75Å; I44-L316 HydrophobicContact CG1-CD1 4.34Å; F54-L316 HydrophobicContact CE2-CD2 3.94Å; V56-L316 HydrophobicContact CG1-CD1 4.06Å; V56-L316 HydrophobicContact CG1-CD2 4.42Å; V56-L316 HydrophobicContact CG2-CD1 4.19Å; V56-L316 HydrophobicContact CG2-CD2 3.83Å; Y65-L316 HydrophobicContact CD2-CD2 4.47Å; Y65-L316 HydrophobicContact CE2-CD2 4.28Å; V308-L316 HydrophobicContact CG1-CD1 3.42Å; V308-L316 VanDerWaalsContact CG1-CD1 3.42Å; V308-L316 HydrophobicContact CG1-CD2 4.08Å; V308-L316 HydrophobicContact CG1-CG 3.81Å; L316-I318 HydrophobicContact CD2-CD1 4.13Å; L316-I318 HydrophobicContact CD2-CG1 4.18Å; L316-I318 HydrophobicContact CG-CG1 4.32Å
317	S	91.3	Very high	79.6	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.007	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.2	178	-173.9	0	0	0	0	109.8	P32 V33 V308 V309	P32-S317 WeakPolarHBondContact CB-OG 3.2Å; V33-S317 WeakPolarHBondContact O-CA 3.35Å; V308-S317 WeakPolarHBondContact CA-O 3.47Å; V309-S317 PolarHBondContact N-O 2.82Å; V309-S317 PolarHBondContact O-N 3.03Å
318	I	90.4	Very high	77.4	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.9	-179.5	-51.9	171.8	0	0	0	108.6	P32 V33 I35 F54 I307 V308 L316 H320	P32-I318 CarbonylContact C-O 3.53Å; P32-I318 WeakPolarHBondContact CA-O 3.32Å; V33-I318 HydrophobicContact CB-CB 4.47Å; V33-I318 PolarHBondContact N-O 3.31Å; V33-I318 PolarHBondContact O-N 2.99Å; I35-I318 HydrophobicContact CD1-CD1 3.59Å; F54-I318 HydrophobicContact CE1-CD1 4.41Å; F54-I318 HydrophobicContact CE2-CD1 4.37Å; F54-I318 HydrophobicContact CZ-CD1 3.59Å; F54-I318 HydrophobicContact CZ-CG1 4.36Å; I307-I318 WeakPolarHBondContact O-CA 3.49Å; V308-I318 HydrophobicContact CG1-CG1 4.23Å; V308-I318 HydrophobicContact CG2-CG1 4.18Å; V308-I318 HydrophobicContact CG2-CG2 4.1Å; L316-I318 HydrophobicContact CD2-CD1 4.13Å; L316-I318 HydrophobicContact CD2-CG1 4.18Å; L316-I318 HydrophobicContact CG-CG1 4.32Å; I318-H320 VanDerWaalsContact CG2-NE2 3.33Å; I318-H320 WeakPolarHBondContact CG2-NE2 3.44Å
319	K	89.1	Confident	75	Confident	22 Å²	22	55.8 Å²	55.8	10%	0.096	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.4	174.4	-71.3	-179.6	178.8	167.1	0	109.5	Y29 P32 Y291 S306 I307	Y29-K319 HydrophobicContact CD1-CB 3.92Å; P32-K319 HydrophobicContact CB-CG 3.87Å; Y291-K319 VanDerWaalsContact CZ-NZ 3.31Å; Y291-K319 WeakPolarHBondContact OH-CD 3.5Å; Y291-K319 WeakPolarHBondContact OH-CE 3.16Å; Y291-K319 PolarHBondContact OH-NZ 3.08Å; S306-K319 CarbonylContact C-O 3.6Å; S306-K319 VanDerWaalsContact CA-O 3.29Å; S306-K319 WeakPolarHBondContact CA-O 3.42Å; I307-K319 HydrophobicContact CB-CB 4.39Å; I307-K319 PolarHBondContact N-O 2.72Å; I307-K319 PolarHBondContact O-N 3.47Å
320	H	86.2	Confident	72.5	Confident	23 Å²	23	62.4 Å²	62.4	11%	0.106	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	138.7	173.1	-67.3	-62.9	0	0	0	111.5	Y29 K30 P67 E305 S306 I318	Y29-H320 CarbonylContact C-O 3.57Å; Y29-H320 WeakPolarHBondContact CA-O 3.36Å; K30-H320 WeakPolarHBondContact CB-O 3.36Å; K30-H320 HydrophobicContact CD-CB 4.29Å; K30-H320 PolarHBondContact N-O 3.44Å; P67-H320 PolarHBondContact O-CE1 2.96Å; P67-H320 PolarHBondContact O-NE2 3.46Å; E305-H320 CarbonylContact O-C 3.49Å; E305-H320 WeakPolarHBondContact O-CA 3.34Å; S306-H320 WeakPolarHBondContact CB-ND1 3.41Å; I318-H320 VanDerWaalsContact CG2-NE2 3.33Å; I318-H320 WeakPolarHBondContact CG2-NE2 3.44Å
321	R	82.9	Confident	70	Confident	49 Å²	49	69.2 Å²	69.2	19%	0.185	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-70.1	139	172.1	-163.9	177.5	65.1	-172.1	-6.3	110	Y25 Y29 E305 H323	Y25-R321 VanDerWaalsContact CE2-NH1 3.33Å; Y25-R321 PolarHBondContact OH-NH1 2.98Å; Y29-R321 HydrophobicContact CD1-CB 4.17Å; Y29-R321 HydrophobicContact CE1-CB 3.83Å; Y29-R321 HydrophobicContact CE1-CG 4.49Å; Y29-R321 HydrophobicContact CE2-CB 4.47Å; Y29-R321 HydrophobicContact CE2-CG 4.26Å; E305-R321 PolarHBondContact O-N 2.82Å; R321-H323 PolarHBondContact NH2-CE1 2.87Å; R321-H323 PolarHBondContact NH2-NE2 3.46Å; R321-H323 PolarHBondContact O-N 3.19Å
322	K	71.9	Confident	67.7	Low	113 Å²	113	71.9 Å²	71.9	49%	0.491	36%	0.363	S	S	.	.			trans	-77.2	112.7	166.7	-67.1	-177.6	179.4	175.7	0	108.3	N28 K30 T324	N28-K322 WeakPolarHBondContact O-CB 3.28Å; N28-K322 PolarHBondContact O-N 2.7Å; K30-K322 HydrophobicContact CD-CG 4.15Å; K30-K322 HydrophobicContact CG-CD 4.15Å; K30-K322 HydrophobicContact CG-CG 3.35Å; K322-T324 PolarHBondContact O-N 2.83Å
323	H	60.6	Low	65.7	Low	73 Å²	73	76 Å²	76	34%	0.338	38%	0.378	S	S	.	.			trans	-62.4	126.3	164.4	-93.2	-95.2	0	0	0	108.8	R321 E325 E326	R321-H323 PolarHBondContact NH2-CE1 2.87Å; R321-H323 PolarHBondContact NH2-NE2 3.46Å; R321-H323 PolarHBondContact O-N 3.19Å; H323-E325 PolarHBondContact O-N 3.02Å; H323-E326 HydrophobicContact CB-CG 4.22Å; H323-E326 PolarHBondContact O-N 3.02Å
324	T	50.6	Low	63.6	Low	86 Å²	86	79.1 Å²	79.1	53%	0.528	39%	0.39	S	S	.	.	H	α-helix	trans	-66.8	-13.7	179.3	-33.1	0	0	0	0	111.8	K322 S327 K328	K322-T324 PolarHBondContact O-N 2.83Å; T324-S327 WeakPolarHBondContact CA-OG 3.43Å; T324-S327 PolarHBondContact O-OG 2.84Å; T324-K328 WeakPolarHBondContact O-CG 3.48Å; T324-K328 PolarHBondContact O-N 2.88Å
325	E	49.3	Very low	61.6	Low	142 Å²	142	87.1 Å²	87.1	66%	0.664	42%	0.415	S	S	*	.	H	α-helix	trans	-77	-40.4	173	-61.4	-164.4	149.2	0	0	111.9	H323 S327 K328 E329	H323-E325 PolarHBondContact O-N 3.02Å; E325-S327 VanDerWaalsContact C-N 3.27Å; E325-S327 PolarHBondContact O-N 2.52Å; E325-K328 CarbonylContact O-C 3.57Å; E325-K328 PolarHBondContact O-N 2.87Å; E325-K328 VanDerWaalsContact O-N 3.16Å; E325-E329 WeakPolarHBondContact O-CB 3.5Å; E325-E329 WeakPolarHBondContact O-CG 3.27Å; E325-E329 PolarHBondContact O-N 2.86Å
326	E	47.5	Very low	59.4	Low	100 Å²	100	96.5 Å²	96.5	47%	0.467	45%	0.448	S	S	.	.	H	α-helix	trans	-62.7	-34.2	174.2	-67.4	-172.3	151.3	0	0	112.1	K30 H323 E329 M330	K30-E326 IonicContact NZ-OE2 3.88Å; K30-E326 PolarHBondContact NZ-OE2 2.75Å; H323-E326 HydrophobicContact CB-CG 4.22Å; H323-E326 PolarHBondContact O-N 3.02Å; E326-E329 PolarHBondContact O-N 2.89Å; E326-M330 VanDerWaalsContact O-CB 3.27Å; E326-M330 WeakPolarHBondContact O-CB 3.45Å; E326-M330 VanDerWaalsContact O-CG 3.29Å; E326-M330 WeakPolarHBondContact O-CG 3.45Å; E326-M330 PolarHBondContact O-N 2.76Å
327	S	45.6	Very low	57.1	Low	53 Å²	53	107.2 Å²	107.2	37%	0.371	49%	0.488	S	S	.	.	H	α-helix	trans	-73.7	-34.9	176.3	57.8	0	0	0	0	112.3	T324 E325 M331	T324-S327 WeakPolarHBondContact CA-OG 3.43Å; T324-S327 PolarHBondContact O-OG 2.84Å; E325-S327 VanDerWaalsContact C-N 3.27Å; E325-S327 PolarHBondContact O-N 2.52Å; S327-M331 VanDerWaalsContact O-CB 3.28Å; S327-M331 WeakPolarHBondContact O-CB 3.39Å; S327-M331 WeakPolarHBondContact O-CG 3.46Å; S327-M331 PolarHBondContact O-N 3.46Å
328	K	44.4	Very low	55.1	Low	151 Å²	151	112.3 Å²	112.3	66%	0.657	52%	0.521	S	S	*	.	H	α-helix	trans	-67.3	-39.5	169.2	-76.8	177.6	-178.8	174.5	0	111.6	T324 E325 S332	T324-K328 WeakPolarHBondContact O-CG 3.48Å; T324-K328 PolarHBondContact O-N 2.88Å; E325-K328 CarbonylContact O-C 3.57Å; E325-K328 PolarHBondContact O-N 2.87Å; E325-K328 VanDerWaalsContact O-N 3.16Å; K328-S332 WeakPolarHBondContact O-CB 3.38Å; K328-S332 PolarHBondContact O-N 2.93Å; K328-S332 PolarHBondContact O-OG 2.75Å
329	E	40.3	Very low	52.9	Low	116 Å²	116	116.2 Å²	116.2	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-68.7	-45.9	177.5	-76.5	-167.1	160.5	0	0	111.8	E325 E326 M331 S332 Q333	E325-E329 WeakPolarHBondContact O-CB 3.5Å; E325-E329 WeakPolarHBondContact O-CG 3.27Å; E325-E329 PolarHBondContact O-N 2.86Å; E326-E329 PolarHBondContact O-N 2.89Å; E329-M331 PolarHBondContact O-N 2.95Å; E329-S332 WeakPolarHBondContact CA-OG 3.43Å; E329-S332 CarbonylContact O-C 3.53Å; E329-S332 WeakPolarHBondContact O-CA 3.23Å; E329-S332 PolarHBondContact O-N 3.34Å; E329-S332 PolarHBondContact O-OG 3.4Å; E329-Q333 WeakPolarHBondContact O-CB 3.29Å; E329-Q333 VanDerWaalsContact O-CG 3.32Å; E329-Q333 WeakPolarHBondContact O-CG 3.24Å; E329-Q333 PolarHBondContact O-N 2.77Å
330	M	39	Very low	51.3	Low	138 Å²	138	126.5 Å²	126.5	68%	0.68	59%	0.589	S	S	*	*	H	α-helix	trans	-61	-41.8	173.8	-78.9	-174.1	151.6	0	0	112.2	E326 S332 Q333 Q334	E326-M330 VanDerWaalsContact O-CB 3.27Å; E326-M330 WeakPolarHBondContact O-CB 3.45Å; E326-M330 VanDerWaalsContact O-CG 3.29Å; E326-M330 WeakPolarHBondContact O-CG 3.45Å; E326-M330 PolarHBondContact O-N 2.76Å; M330-S332 VanDerWaalsContact C-N 3.32Å; M330-Q333 PolarHBondContact O-N 2.93Å; M330-Q334 PolarHBondContact O-N 3.35Å
331	M	40.6	Very low	49.6	Very low	144 Å²	144	136.3 Å²	136.3	71%	0.709	63%	0.625	S	S	*	*	H	α-helix	trans	-68.3	-30.6	173.2	-74.1	-178	65.8	0	0	112.5	S327 E329	S327-M331 VanDerWaalsContact O-CB 3.28Å; S327-M331 WeakPolarHBondContact O-CB 3.39Å; S327-M331 WeakPolarHBondContact O-CG 3.46Å; S327-M331 PolarHBondContact O-N 3.46Å; E329-M331 PolarHBondContact O-N 2.95Å
332	S	43.1	Very low	48.1	Very low	62 Å²	62	139.4 Å²	139.4	43%	0.434	65%	0.649	S	S	.	*	H	α-helix	trans	-75.3	-32	174.7	82	0	0	0	0	112.5	K328 E329 M330 Q334 R335	K328-S332 WeakPolarHBondContact O-CB 3.38Å; K328-S332 PolarHBondContact O-N 2.93Å; K328-S332 PolarHBondContact O-OG 2.75Å; E329-S332 WeakPolarHBondContact CA-OG 3.43Å; E329-S332 CarbonylContact O-C 3.53Å; E329-S332 WeakPolarHBondContact O-CA 3.23Å; E329-S332 PolarHBondContact O-N 3.34Å; E329-S332 PolarHBondContact O-OG 3.4Å; M330-S332 VanDerWaalsContact C-N 3.32Å; S332-Q334 VanDerWaalsContact C-N 3.3Å; S332-R335 VanDerWaalsContact O-CB 3.28Å; S332-R335 WeakPolarHBondContact O-CB 3.3Å; S332-R335 PolarHBondContact O-N 2.99Å; S332-R335 VanDerWaalsContact O-N 3.08Å
333	Q	48.3	Very low	46.9	Very low	140 Å²	140	143 Å²	143	65%	0.654	67%	0.665	S	S	*	*	H	α-helix	trans	-72.1	-25.7	176.2	-75.5	-176.1	8.6	0	0	111.9	E329 M330 R335	E329-Q333 WeakPolarHBondContact O-CB 3.29Å; E329-Q333 VanDerWaalsContact O-CG 3.32Å; E329-Q333 WeakPolarHBondContact O-CG 3.24Å; E329-Q333 PolarHBondContact O-N 2.77Å; M330-Q333 PolarHBondContact O-N 2.93Å; Q333-R335 VanDerWaalsContact C-N 3.27Å; Q333-R335 PolarHBondContact O-N 3.32Å
334	Q	43.7	Very low	46.4	Very low	170 Å²	170	144.4 Å²	144.4	79%	0.794	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-6.2	168.6	-75.6	-169.3	-14.1	0	0	114.1	M330 S332 R336	M330-Q334 PolarHBondContact O-N 3.35Å; S332-Q334 VanDerWaalsContact C-N 3.3Å; Q334-R336 PolarHBondContact O-N 2.9Å; Q334-R336 VanDerWaalsContact O-N 3.1Å
335	R	46.8	Very low	46.3	Very low	195 Å²	195	149.7 Å²	149.7	74%	0.736	69%	0.694	S	S	*	*	S	Bend	trans	-69.8	111.1	163.3	-68.1	-176.3	164.9	179.5	-3.4	107.1	S332 Q333 R337	S332-R335 VanDerWaalsContact O-CB 3.28Å; S332-R335 WeakPolarHBondContact O-CB 3.3Å; S332-R335 PolarHBondContact O-N 2.99Å; S332-R335 VanDerWaalsContact O-N 3.08Å; Q333-R335 VanDerWaalsContact C-N 3.27Å; Q333-R335 PolarHBondContact O-N 3.32Å; R335-R337 PolarHBondContact O-N 3.25Å
336	R	45.4	Very low	46.7	Very low	244 Å²	244	145.6 Å²	145.6	92%	0.921	69%	0.69	S	S	*	*			trans	-35.2	109.3	166.8	-77.9	-177.5	167.3	-178.5	-4.2	108.3	Q334 P338	Q334-R336 PolarHBondContact O-N 2.9Å; Q334-R336 VanDerWaalsContact O-N 3.1Å; R336-P338 WeakPolarHBondContact O-CD 3.42Å; R336-P338 VanDerWaalsContact O-N 3.12Å
337	R	42.7	Very low	47.3	Very low	225 Å²	225	149.2 Å²	149.2	85%	0.849	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-53.2	123.2	175.4	-70	-176.8	177.5	-176	-0.2	106.2	R335 S339	R335-R337 PolarHBondContact O-N 3.25Å; R337-S339 PolarHBondContact O-N 2.78Å
338	P	49.3	Very low	48	Very low	107 Å²	107	154.3 Å²	154.3	70%	0.695	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-56.7	137.8	171.9	22.4	-29.5	0	0	0	107.4	R336 Y340	R336-P338 WeakPolarHBondContact O-CD 3.42Å; R336-P338 VanDerWaalsContact O-N 3.12Å; P338-Y340 PolarHBondContact O-N 3.34Å
339	S	43.7	Very low	49.1	Very low	88 Å²	88	153.8 Å²	153.8	62%	0.615	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-47.4	137.1	173	63.9	0	0	0	0	108.6	R337 R341	R337-S339 PolarHBondContact O-N 2.78Å; S339-R341 PolarHBondContact O-N 3.3Å
340	Y	55.9	Low	50.6	Low	237 Å²	237	153.9 Å²	153.9	93%	0.929	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.7	-4.8	-175.1	-170.1	-98.3	0	0	0	116.7	P338 V342	P338-Y340 PolarHBondContact O-N 3.34Å; Y340-V342 VanDerWaalsContact C-N 3.35Å; Y340-V342 PolarHBondContact O-N 3.3Å
341	R	50.3	Low	52.1	Low	230 Å²	230	151.8 Å²	151.8	87%	0.868	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-7.5	-179.1	-89.5	-177.2	155.9	163	-4.6	116.9	S339	S339-R341 PolarHBondContact O-N 3.3Å
342	V	52.2	Low	53.9	Low	114 Å²	114	152.3 Å²	152.3	69%	0.691	73%	0.728	S	S	*	*	S	Bend	trans	-98.7	99.8	175.1	-167.2	0	0	0	0	109.3	Y340 V344	Y340-V342 VanDerWaalsContact C-N 3.35Å; Y340-V342 PolarHBondContact O-N 3.3Å; V342-V344 PolarHBondContact O-N 3.31Å
343	F	45.6	Very low	55.2	Low	189 Å²	189	155.8 Å²	155.8	83%	0.829	75%	0.75	S	S	*	*			trans	-35.9	120.1	177	-111.6	-102.7	0	0	0	113.6	K345	F343-K345 PolarHBondContact O-N 2.89Å; F343-K345 VanDerWaalsContact O-N 3.14Å
344	V	50.3	Low	56.6	Low	101 Å²	101	156.1 Å²	156.1	61%	0.612	76%	0.756	S	S	*	*			trans	-81.3	85.9	168.6	-177.7	0	0	0	0	108.5	V342 K347	V342-V344 PolarHBondContact O-N 3.31Å; V344-K347 HydrophobicContact CG1-CB 4.31Å; V344-K347 HydrophobicContact CG1-CD 3.77Å; V344-K347 HydrophobicContact CG1-CG 3.62Å
345	K	49	Very low	58.1	Low	197 Å²	197	151.7 Å²	151.7	86%	0.857	74%	0.738	S	S	*	*			trans	-80.6	127.4	159.6	-87.2	-174.1	172.8	-177.6	0	108.3	F343	F343-K345 PolarHBondContact O-N 2.89Å; F343-K345 VanDerWaalsContact O-N 3.14Å
346	G	57.7	Low	59.4	Low	56 Å²	56	153 Å²	153	58%	0.577	74%	0.744	S	S	*	*			trans	114.3	8	168.6	0	0	0	0	0	117.6	N348 F349	G346-N348 PolarHBondContact O-N 3.41Å; G346-N348 VanDerWaalsContact O-N 3.1Å; G346-F349 PolarHBondContact O-N 3.23Å
347	K	59.2	Low	60.6	Low	177 Å²	177	149.1 Å²	149.1	77%	0.77	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-18.7	177.5	-102.8	176.5	177.5	-172.1	0	115.1	V344	V344-K347 HydrophobicContact CG1-CB 4.31Å; V344-K347 HydrophobicContact CG1-CD 3.77Å; V344-K347 HydrophobicContact CG1-CG 3.62Å
348	N	60.2	Low	61.6	Low	159 Å²	159	144.6 Å²	144.6	85%	0.85	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	11.1	-177.9	-59.9	-2	0	0	0	112.9	G346 V350	G346-N348 PolarHBondContact O-N 3.41Å; G346-N348 VanDerWaalsContact O-N 3.1Å; N348-V350 PolarHBondContact O-N 3.37Å
349	F	67.6	Low	62.5	Low	140 Å²	140	143.9 Å²	143.9	61%	0.614	74%	0.736	S	S	*	*			trans	-85.3	103.2	179.2	-172.3	-100.5	0	0	0	110	G346 P351 D355	G346-F349 PolarHBondContact O-N 3.23Å; F349-P351 HydrophobicContact CE1-CB 4.4Å; F349-D355 WeakPolarHBondContact CZ-OD2 3.14Å
350	V	71.9	Confident	63.8	Low	119 Å²	119	148.6 Å²	148.6	72%	0.721	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-84.7	117.8	168.4	-178.3	0	0	0	0	107	N348 K352	N348-V350 PolarHBondContact O-N 3.37Å; V350-K352 PolarHBondContact O-N 3.28Å
351	P	71	Confident	64.2	Low	94 Å²	94	143.1 Å²	143.1	61%	0.61	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-64.2	133.9	-178.1	25.9	-32.7	0	0	0	110.4	F349	F349-P351 HydrophobicContact CE1-CB 4.4Å
352	K	77.5	Confident	64.9	Low	154 Å²	154	138.4 Å²	138.4	67%	0.67	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-81.3	156.3	169.8	-69.4	-179.5	-178.9	179.7	0	109.4	V350 D354 D355	V350-K352 PolarHBondContact O-N 3.28Å; K352-D354 PolarHBondContact O-N 3.02Å; K352-D355 PolarHBondContact N-OD2 3.2Å; K352-D355 WeakPolarHBondContact O-CB 3.3Å; K352-D355 PolarHBondContact O-N 3.19Å
353	P	70.9	Confident	65.5	Low	136 Å²	136	141.6 Å²	141.6	88%	0.883	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-20.1	-178.4	22.6	-33.4	0	0	0	114.4
354	D	77.3	Confident	66.6	Low	147 Å²	147	140.8 Å²	140.8	79%	0.786	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	0.8	177.2	-70.1	-28.5	0	0	0	114.4	K352 Y356	K352-D354 PolarHBondContact O-N 3.02Å; D354-Y356 PolarHBondContact O-N 2.89Å
355	D	75.8	Confident	67.8	Low	77 Å²	77	143.7 Å²	143.7	41%	0.412	75%	0.745	S	S	.	*			trans	-81.1	115.1	-178	-71.7	-31.6	0	0	0	111.6	F349 K352	F349-D355 WeakPolarHBondContact CZ-OD2 3.14Å; K352-D355 PolarHBondContact N-OD2 3.2Å; K352-D355 WeakPolarHBondContact O-CB 3.3Å; K352-D355 PolarHBondContact O-N 3.19Å
356	Y	74.7	Confident	69.3	Low	221 Å²	221	136.6 Å²	136.6	87%	0.867	72%	0.716	S	S	*	*			trans	-81.6	121.7	173.1	-93.5	-97.7	0	0	0	111.9	D354 V358	D354-Y356 PolarHBondContact O-N 2.89Å; Y356-V358 PolarHBondContact O-N 3.04Å
357	L	70.2	Confident	70.4	Confident	164 Å²	164	135.5 Å²	135.5	86%	0.859	70%	0.702	S	S	*	*			trans	-73	97.9	172.2	-174	111.3	0	0	0	110.6	S359	L357-S359 PolarHBondContact O-N 3.48Å; L357-S359 VanDerWaalsContact O-N 3.12Å
358	V	64.1	Low	71.7	Confident	129 Å²	129	133 Å²	133	78%	0.782	69%	0.691	S	S	*	*			trans	-73	103.2	168.8	-176.7	0	0	0	0	108.7	Y356 K360	Y356-V358 PolarHBondContact O-N 3.04Å; V358-K360 PolarHBondContact O-N 2.75Å
359	S	66.9	Low	72.9	Confident	93 Å²	93	126.4 Å²	126.4	65%	0.65	65%	0.654	S	S	*	*			trans	-62.2	130	172.2	61.9	0	0	0	0	109.4	L357	L357-S359 PolarHBondContact O-N 3.48Å; L357-S359 VanDerWaalsContact O-N 3.12Å
360	K	71.9	Confident	73.8	Confident	186 Å²	186	120 Å²	120	81%	0.809	63%	0.626	S	S	*	*			trans	-57.1	136	175.1	-70.6	179.2	178.8	175.7	0	108.3	V358 V362	V358-K360 PolarHBondContact O-N 2.75Å; K360-V362 PolarHBondContact O-N 3.09Å
361	P	63.4	Low	74.5	Confident	123 Å²	123	120.2 Å²	120.2	80%	0.799	61%	0.614	S	S	*	*			trans	-58.8	113	176.8	23.9	-32.3	0	0	0	108.5	K363	P361-K363 PolarHBondContact O-N 3.46Å
362	V	64.8	Low	75.3	Confident	131 Å²	131	117.4 Å²	117.4	79%	0.794	59%	0.593	S	S	*	*			trans	-66.5	116	177.1	178.2	0	0	0	0	106.4	K360 E364	K360-V362 PolarHBondContact O-N 3.09Å; V362-E364 PolarHBondContact O-N 3.15Å
363	K	66.3	Low	75.8	Confident	181 Å²	181	110.1 Å²	110.1	79%	0.787	56%	0.562	S	S	*	*			trans	-63.7	108.6	172.8	-72	-175.2	178.3	-178.9	0	108.1	P361 H365	P361-K363 PolarHBondContact O-N 3.46Å; K363-H365 PolarHBondContact O-CD2 2.98Å; K363-H365 PolarHBondContact O-N 2.89Å; K363-H365 VanDerWaalsContact O-N 3.11Å
364	E	67.4	Low	76.5	Confident	171 Å²	171	109.3 Å²	109.3	80%	0.799	54%	0.544	S	S	*	.			trans	-68.6	108.4	173.6	-68.6	-170.9	163.9	0	0	109.1	V362 L366	V362-E364 PolarHBondContact O-N 3.15Å; E364-L366 PolarHBondContact O-N 2.89Å
365	H	76.1	Confident	77.1	Confident	162 Å²	162	108.3 Å²	108.3	75%	0.75	53%	0.533	S	S	*	.			trans	-79.1	115.2	174	-76.3	-77.7	0	0	0	109.4	K363	K363-H365 PolarHBondContact O-CD2 2.98Å; K363-H365 PolarHBondContact O-N 2.89Å; K363-H365 VanDerWaalsContact O-N 3.11Å
366	L	80.3	Confident	77.5	Confident	49 Å²	49	112.9 Å²	112.9	26%	0.257	55%	0.549	S	S	.	.			trans	-59.2	138.5	172.7	-65.2	171	0	0	0	110.6	F4 P6 E364 D370 R371 K374	F4-L366 HydrophobicContact CD1-CD1 4.44Å; F4-L366 HydrophobicContact CD1-CD2 4.34Å; P6-L366 HydrophobicContact CB-CD2 4.27Å; E364-L366 PolarHBondContact O-N 2.89Å; L366-D370 HydrophobicContact CB-CB 4.14Å; L366-D370 HydrophobicContact CD2-CB 4.29Å; L366-R371 HydrophobicContact CB-CG 3.98Å; L366-R371 PolarHBondContact O-NE 2.82Å; L366-R371 PolarHBondContact O-NH2 3.45Å; L366-K374 HydrophobicContact CD1-CD 4.26Å
367	A	82.2	Confident	78.2	Confident	33 Å²	33	105.4 Å²	105.4	27%	0.273	52%	0.524	S	S	.	.			trans	-63	162.1	173.1	0	0	0	0	0	111.2	Y369 D370 R371	A367-Y369 HydrophobicContact CB-CD1 3.96Å; A367-Y369 HydrophobicContact CB-CE1 3.43Å; A367-Y369 VanDerWaalsContact CB-CE1 3.43Å; A367-Y369 HydrophobicContact CB-CE2 4.08Å; A367-Y369 VanDerWaalsContact CB-CZ 3.5Å; A367-Y369 PolarHBondContact O-N 2.73Å; A367-D370 HydrophobicContact CB-CB 4.47Å; A367-D370 PolarHBondContact O-N 2.93Å; A367-R371 WeakPolarHBondContact O-CG 3.5Å; A367-R371 PolarHBondContact O-N 3.47Å
368	K	84.8	Confident	79.1	Confident	123 Å²	123	98.9 Å²	98.9	54%	0.535	49%	0.491	S	S	.	.	H	α-helix	trans	-57.1	-47.5	-178.2	-68	-177.3	-175	171.6	0	112	D370 R371 E372 E387	K368-D370 PolarHBondContact O-N 2.69Å; K368-R371 WeakPolarHBondContact O-CB 3.13Å; K368-R371 PolarHBondContact O-N 2.86Å; K368-E372 PolarHBondContact O-N 3.32Å; K368-E387 IonicContact NZ-OE1 3.36Å; K368-E387 PolarHBondContact NZ-OE1 3Å; K368-E387 IonicContact NZ-OE2 2.9Å; K368-E387 PolarHBondContact NZ-OE2 3.04Å
369	Y	85.8	Confident	80.3	Confident	21 Å²	21	95 Å²	95	8%	0.082	47%	0.47	C	S	.	.	H	α-helix	trans	-64.6	-37.7	179.2	59.1	-98.2	0	0	0	112.1	T7 A367 R371 E372 L373 I397 V401	T7-Y369 VanDerWaalsContact OG1-CE2 3.27Å; T7-Y369 WeakPolarHBondContact OG1-CE2 3.5Å; A367-Y369 HydrophobicContact CB-CD1 3.96Å; A367-Y369 HydrophobicContact CB-CE1 3.43Å; A367-Y369 VanDerWaalsContact CB-CE1 3.43Å; A367-Y369 HydrophobicContact CB-CE2 4.08Å; A367-Y369 VanDerWaalsContact CB-CZ 3.5Å; A367-Y369 PolarHBondContact O-N 2.73Å; Y369-R371 VanDerWaalsContact C-N 3.32Å; Y369-R371 PolarHBondContact O-N 3.37Å; Y369-E372 PolarHBondContact O-N 2.82Å; Y369-L373 WeakPolarHBondContact O-CG 3.44Å; Y369-L373 PolarHBondContact O-N 3.35Å; Y369-I397 HydrophobicContact CD1-CG2 4.3Å; Y369-I397 HydrophobicContact CE1-CG2 3.56Å; Y369-V401 HydrophobicContact CD2-CG2 3.71Å; Y369-V401 HydrophobicContact CE2-CG2 4.18Å; Y369-V401 HydrophobicContact CG-CG2 4.03Å
370	D	85.9	Confident	81.2	Confident	6 Å²	6	96.9 Å²	96.9	3%	0.032	47%	0.466	C	S	.	.	H	α-helix	trans	-64.5	-36.3	175.8	-81.7	-39.5	0	0	0	112.1	F4 T7 L366 A367 K368 E372 K374	F4-D370 HydrophobicContact CE1-CB 3.87Å; F4-D370 WeakPolarHBondContact CE1-O 3.24Å; F4-D370 HydrophobicContact CZ-CB 4.42Å; F4-D370 WeakPolarHBondContact CZ-O 3.34Å; T7-D370 WeakPolarHBondContact CG2-OD1 3.43Å; T7-D370 PolarHBondContact N-OD1 3.28Å; T7-D370 PolarHBondContact OG1-OD1 3.5Å; L366-D370 HydrophobicContact CB-CB 4.14Å; L366-D370 HydrophobicContact CD2-CB 4.29Å; A367-D370 HydrophobicContact CB-CB 4.47Å; A367-D370 PolarHBondContact O-N 2.93Å; K368-D370 PolarHBondContact O-N 2.69Å; D370-E372 VanDerWaalsContact C-N 3.33Å; D370-K374 VanDerWaalsContact O-CB 3.32Å; D370-K374 WeakPolarHBondContact O-CB 3.3Å; D370-K374 PolarHBondContact O-N 2.85Å
371	R	88.3	Confident	82	Confident	123 Å²	123	88 Å²	88	46%	0.464	43%	0.428	S	S	.	.	H	α-helix	trans	-64.7	-39	174.6	-66.8	175.1	-155.7	178.2	5.3	111.5	L366 A367 K368 Y369 K374 K375	L366-R371 HydrophobicContact CB-CG 3.98Å; L366-R371 PolarHBondContact O-NE 2.82Å; L366-R371 PolarHBondContact O-NH2 3.45Å; A367-R371 WeakPolarHBondContact O-CG 3.5Å; A367-R371 PolarHBondContact O-N 3.47Å; K368-R371 WeakPolarHBondContact O-CB 3.13Å; K368-R371 PolarHBondContact O-N 2.86Å; Y369-R371 VanDerWaalsContact C-N 3.32Å; Y369-R371 PolarHBondContact O-N 3.37Å; R371-K374 PolarHBondContact O-N 2.89Å; R371-K375 WeakPolarHBondContact O-CG 3.33Å; R371-K375 PolarHBondContact O-N 3.27Å
372	E	88	Confident	83.1	Confident	35 Å²	35	82.2 Å²	82.2	16%	0.164	39%	0.39	C	S	.	.	H	α-helix	trans	-74.9	-37.2	178.4	-66.3	-53.4	130.2	0	0	112	K368 Y369 D370 K374 K375 F376 N377 K380 A381	K368-E372 PolarHBondContact O-N 3.32Å; Y369-E372 PolarHBondContact O-N 2.82Å; D370-E372 VanDerWaalsContact C-N 3.33Å; E372-K374 VanDerWaalsContact C-N 3.27Å; E372-K374 PolarHBondContact O-N 3.33Å; E372-K375 CarbonylContact O-C 3.52Å; E372-K375 WeakPolarHBondContact O-CA 3.07Å; E372-K375 PolarHBondContact O-N 2.91Å; E372-K375 IonicContact OE1-NZ 3.02Å; E372-K375 PolarHBondContact OE1-NZ 2.81Å; E372-F376 PolarHBondContact O-N 3.01Å; E372-F376 VanDerWaalsContact O-N 3.15Å; E372-N377 HydrophobicContact CB-CB 4.34Å; E372-N377 PolarHBondContact O-N 2.82Å; E372-N377 WeakPolarHBondContact OE2-CB 3.48Å; E372-N377 PolarHBondContact OE2-ND2 3.15Å; E372-K380 HydrophobicContact CG-CB 4.37Å; E372-A381 HydrophobicContact CB-CB 3.97Å
373	L	86.1	Confident	84.2	Confident	2 Å²	2	78.4 Å²	78.4	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-33.3	170.1	-72.4	176	0	0	0	112.5	F4 T7 Y369 K375 F376 A381 L405	F4-L373 HydrophobicContact CE2-CB 3.93Å; F4-L373 HydrophobicContact CZ-CB 3.7Å; T7-L373 HydrophobicContact CG2-CD1 3.44Å; T7-L373 VanDerWaalsContact CG2-CD1 3.44Å; Y369-L373 WeakPolarHBondContact O-CG 3.44Å; Y369-L373 PolarHBondContact O-N 3.35Å; L373-K375 VanDerWaalsContact C-N 3.3Å; L373-F376 PolarHBondContact O-N 2.69Å; L373-A381 HydrophobicContact CD2-CB 3.71Å; L373-A381 HydrophobicContact CG-CB 3.75Å; L373-L405 HydrophobicContact CD2-CD2 3.87Å
374	K	86.8	Confident	85.1	Confident	119 Å²	119	70.6 Å²	70.6	52%	0.517	33%	0.334	S	S	.	.	H	α-helix	trans	-68.1	-30.4	172.8	-177.1	178.4	177.8	-177.9	0	112.3	F4 L366 D370 R371 E372 F376	F4-K374 HydrophobicContact CB-CB 4.46Å; F4-K374 HydrophobicContact CB-CD 4.11Å; F4-K374 HydrophobicContact CB-CG 4.07Å; F4-K374 HydrophobicContact CD1-CB 4.3Å; F4-K374 HydrophobicContact CD2-CB 3.82Å; F4-K374 HydrophobicContact CD2-CG 4.19Å; F4-K374 HydrophobicContact CE2-CB 4.08Å; F4-K374 HydrophobicContact CG-CB 3.94Å; F4-K374 HydrophobicContact CG-CD 4.39Å; F4-K374 HydrophobicContact CG-CG 4.09Å; F4-K374 HydrophobicContact CZ-CB 4.44Å; L366-K374 HydrophobicContact CD1-CD 4.26Å; D370-K374 VanDerWaalsContact O-CB 3.32Å; D370-K374 WeakPolarHBondContact O-CB 3.3Å; D370-K374 PolarHBondContact O-N 2.85Å; R371-K374 PolarHBondContact O-N 2.89Å; E372-K374 VanDerWaalsContact C-N 3.27Å; E372-K374 PolarHBondContact O-N 3.33Å; K374-F376 VanDerWaalsContact C-N 3.32Å
375	K	88.7	Confident	85.9	Confident	126 Å²	126	62.4 Å²	62.4	55%	0.548	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	2.5	175.7	-67.5	173.6	-172.5	168	0	113.5	R371 E372 L373 N377	R371-K375 WeakPolarHBondContact O-CG 3.33Å; R371-K375 PolarHBondContact O-N 3.27Å; E372-K375 CarbonylContact O-C 3.52Å; E372-K375 WeakPolarHBondContact O-CA 3.07Å; E372-K375 PolarHBondContact O-N 2.91Å; E372-K375 IonicContact OE1-NZ 3.02Å; E372-K375 PolarHBondContact OE1-NZ 2.81Å; L373-K375 VanDerWaalsContact C-N 3.3Å; K375-N377 PolarHBondContact O-N 2.93Å
376	F	85.7	Confident	86.3	Confident	173 Å²	173	55 Å²	55	76%	0.759	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	17.6	-173.7	-60	-89.9	0	0	0	114.9	E372 L373 K374 V378	E372-F376 PolarHBondContact O-N 3.01Å; E372-F376 VanDerWaalsContact O-N 3.15Å; L373-F376 PolarHBondContact O-N 2.69Å; K374-F376 VanDerWaalsContact C-N 3.32Å; F376-V378 PolarHBondContact O-N 2.8Å
377	N	89	Confident	86.3	Confident	64 Å²	64	56.6 Å²	56.6	34%	0.342	27%	0.268	S	S	.	.			trans	-85.5	86.4	174.5	-70.9	-23.5	0	0	0	110.2	E372 K375 K380 A381	E372-N377 HydrophobicContact CB-CB 4.34Å; E372-N377 PolarHBondContact O-N 2.82Å; E372-N377 WeakPolarHBondContact OE2-CB 3.48Å; E372-N377 PolarHBondContact OE2-ND2 3.15Å; K375-N377 PolarHBondContact O-N 2.93Å; N377-K380 HydrophobicContact CB-CB 4.3Å; N377-A381 VanDerWaalsContact O-CB 3.29Å; N377-A381 WeakPolarHBondContact O-CB 3.34Å; N377-A381 PolarHBondContact O-N 2.63Å; N377-A381 VanDerWaalsContact O-N 3.1Å
378	V	89.5	Confident	85.9	Confident	26 Å²	26	60.5 Å²	60.5	16%	0.158	28%	0.283	C	S	.	.	H	α-helix	trans	-71.1	-40.3	-173.3	-63.3	0	0	0	0	113.7	F376 A381 L382 L405 A414	F376-V378 PolarHBondContact O-N 2.8Å; V378-A381 PolarHBondContact O-N 3.3Å; V378-L382 PolarHBondContact O-N 3.24Å; V378-L405 HydrophobicContact CB-CD2 3.99Å; V378-L405 HydrophobicContact CG1-CD2 3.93Å; V378-A414 HydrophobicContact CB-CB 4.07Å; V378-A414 HydrophobicContact CG2-CB 4Å
379	S	87.8	Confident	85.4	Confident	49 Å²	49	61.9 Å²	61.9	34%	0.343	29%	0.285	S	S	.	.	H	α-helix	trans	-65.4	-48.5	-179.2	-40.6	0	0	0	0	111.1	A381 L382 D383	S379-A381 VanDerWaalsContact C-N 3.28Å; S379-A381 PolarHBondContact O-N 2.88Å; S379-L382 PolarHBondContact O-N 3.13Å; S379-L382 VanDerWaalsContact O-N 3.15Å; S379-D383 PolarHBondContact O-N 3.44Å
380	K	87.4	Confident	84.9	Confident	132 Å²	132	61.8 Å²	61.8	57%	0.574	29%	0.286	S	S	*	.	H	α-helix	trans	-64	-32.4	176.5	-64.8	-177.9	179.4	175.9	0	112.8	E372 N377 A384	E372-K380 HydrophobicContact CG-CB 4.37Å; N377-K380 HydrophobicContact CB-CB 4.3Å; K380-A384 VanDerWaalsContact O-CB 3.29Å; K380-A384 WeakPolarHBondContact O-CB 3.47Å; K380-A384 PolarHBondContact O-N 3.24Å
381	A	87	Confident	84.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.1	-42.1	174.8	0	0	0	0	0	111.8	E372 L373 N377 V378 S379 S385	E372-A381 HydrophobicContact CB-CB 3.97Å; L373-A381 HydrophobicContact CD2-CB 3.71Å; L373-A381 HydrophobicContact CG-CB 3.75Å; N377-A381 VanDerWaalsContact O-CB 3.29Å; N377-A381 WeakPolarHBondContact O-CB 3.34Å; N377-A381 PolarHBondContact O-N 2.63Å; N377-A381 VanDerWaalsContact O-N 3.1Å; V378-A381 PolarHBondContact O-N 3.3Å; S379-A381 VanDerWaalsContact C-N 3.28Å; S379-A381 PolarHBondContact O-N 2.88Å; A381-S385 PolarHBondContact O-N 2.87Å
382	L	87.2	Confident	83.5	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-43.1	175.8	-176.1	53.2	0	0	0	110.7	V378 S379 A384 S385 L386 I402 L405 A414 L415 R418 L426	V378-L382 PolarHBondContact O-N 3.24Å; S379-L382 PolarHBondContact O-N 3.13Å; S379-L382 VanDerWaalsContact O-N 3.15Å; L382-A384 PolarHBondContact O-N 2.83Å; L382-S385 WeakPolarHBondContact O-CA 3.37Å; L382-S385 WeakPolarHBondContact O-CB 3.3Å; L382-S385 PolarHBondContact O-N 3.38Å; L382-S385 PolarHBondContact O-OG 2.72Å; L382-L386 HydrophobicContact CD1-CD1 4.28Å; L382-L386 HydrophobicContact CG-CD1 4.08Å; L382-L386 WeakPolarHBondContact O-CG 3.4Å; L382-L386 PolarHBondContact O-N 2.84Å; L382-L386 VanDerWaalsContact O-N 3.09Å; L382-I402 HydrophobicContact CD1-CG1 3.94Å; L382-L405 HydrophobicContact CB-CD1 4.2Å; L382-L405 HydrophobicContact CD1-CD1 4.41Å; L382-A414 HydrophobicContact CD2-CB 4.15Å; L382-L415 HydrophobicContact CD2-CD2 3.92Å; L382-R418 VanDerWaalsContact CD2-NH2 3.34Å; L382-L426 HydrophobicContact CD2-CD1 4.1Å
383	D	88.1	Confident	82.9	Confident	51 Å²	51	70.2 Å²	70.2	27%	0.273	32%	0.324	S	S	.	.	H	α-helix	trans	-66.6	-39.3	179.4	-55.3	-22.7	0	0	0	112.2	S379 S385 L386 E387 R418	S379-D383 PolarHBondContact O-N 3.44Å; D383-S385 PolarHBondContact O-N 2.63Å; D383-L386 PolarHBondContact O-N 3.09Å; D383-E387 PolarHBondContact O-N 3.48Å; D383-R418 IonicContact OD1-CZ 3.12Å; D383-R418 IonicContact OD1-NH1 3.99Å; D383-R418 PolarHBondContact OD1-NH1 2.84Å; D383-R418 VanDerWaalsContact OD1-NH1 3.09Å; D383-R418 IonicContact OD1-NH2 2.94Å; D383-R418 PolarHBondContact OD1-NH2 2.88Å
384	A	86	Confident	82.6	Confident	16 Å²	16	75 Å²	75	13%	0.132	35%	0.345	C	S	.	.	H	α-helix	trans	-61.9	-27.2	173.1	0	0	0	0	0	112.7	K380 L382 L390	K380-A384 VanDerWaalsContact O-CB 3.29Å; K380-A384 WeakPolarHBondContact O-CB 3.47Å; K380-A384 PolarHBondContact O-N 3.24Å; L382-A384 PolarHBondContact O-N 2.83Å; A384-L390 WeakPolarHBondContact O-CD1 3.38Å
385	S	83.4	Confident	82.4	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-83.7	-17	174.8	80.6	0	0	0	0	113.3	A381 L382 D383 T398	A381-S385 PolarHBondContact O-N 2.87Å; L382-S385 WeakPolarHBondContact O-CA 3.37Å; L382-S385 WeakPolarHBondContact O-CB 3.3Å; L382-S385 PolarHBondContact O-N 3.38Å; L382-S385 PolarHBondContact O-OG 2.72Å; D383-S385 PolarHBondContact O-N 2.63Å; S385-T398 PolarHBondContact O-OG1 3.01Å
386	L	84.1	Confident	82.2	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.026	31%	0.314	C	S	.	.	S	Bend	trans	-94.3	1.5	178.7	-71.1	168.4	0	0	0	113.5	L382 D383 I388 T398 L426 F429	L382-L386 HydrophobicContact CD1-CD1 4.28Å; L382-L386 HydrophobicContact CG-CD1 4.08Å; L382-L386 WeakPolarHBondContact O-CG 3.4Å; L382-L386 PolarHBondContact O-N 2.84Å; L382-L386 VanDerWaalsContact O-N 3.09Å; D383-L386 PolarHBondContact O-N 3.09Å; L386-I388 PolarHBondContact O-N 2.81Å; L386-T398 HydrophobicContact CD2-CG2 3.78Å; L386-T398 HydrophobicContact CG-CG2 4.34Å; L386-L426 HydrophobicContact CD1-CB 4.37Å; L386-L426 HydrophobicContact CD1-CD1 4.05Å; L386-L426 HydrophobicContact CD1-CG 4.24Å; L386-F429 HydrophobicContact CD2-CB 3.97Å; L386-F429 HydrophobicContact CD2-CD1 4.15Å; L386-F429 HydrophobicContact CD2-CD2 4.47Å; L386-F429 HydrophobicContact CD2-CG 3.92Å
387	E	81.4	Confident	82.2	Confident	83 Å²	83	59.7 Å²	59.7	39%	0.388	28%	0.282	S	S	.	.			trans	-49.9	135.3	172	-75.8	-173.6	-179.5	0	0	110.4	K368 D383 W389 L390 R391	K368-E387 IonicContact NZ-OE1 3.36Å; K368-E387 PolarHBondContact NZ-OE1 3Å; K368-E387 IonicContact NZ-OE2 2.9Å; K368-E387 PolarHBondContact NZ-OE2 3.04Å; D383-E387 PolarHBondContact O-N 3.48Å; E387-W389 PolarHBondContact O-N 2.84Å; E387-L390 HydrophobicContact CB-CD1 4.24Å; E387-L390 WeakPolarHBondContact O-CB 3.31Å; E387-L390 PolarHBondContact O-N 2.93Å; E387-R391 PolarHBondContact O-N 2.83Å
388	I	73.2	Confident	82.1	Confident	116 Å²	116	56.7 Å²	56.7	60%	0.595	27%	0.266	S	S	*	.	H	α-helix	trans	-48.6	-38.9	-169.3	-63.2	162.8	0	0	0	113.1	L386 K392	L386-I388 PolarHBondContact O-N 2.81Å; I388-K392 HydrophobicContact CG2-CD 4.33Å; I388-K392 PolarHBondContact O-N 2.85Å; I388-K392 VanDerWaalsContact O-N 3.07Å
389	W	74	Confident	82.1	Confident	152 Å²	152	55.4 Å²	55.4	58%	0.576	26%	0.258	S	S	*	.	H	α-helix	trans	-68.5	-44.5	-179.5	-175.4	91.7	0	0	0	112.8	E387 K393	E387-W389 PolarHBondContact O-N 2.84Å; W389-K393 HydrophobicContact CZ2-CD 3.78Å; W389-K393 VanDerWaalsContact O-CB 3.24Å; W389-K393 WeakPolarHBondContact O-CB 3.46Å; W389-K393 PolarHBondContact O-N 2.86Å
390	L	74.3	Confident	82	Confident	19 Å²	19	53.1 Å²	53.1	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-46.9	175.3	-84.9	139.9	0	0	0	109.8	A384 E387 K392 K394 I397	A384-L390 WeakPolarHBondContact O-CD1 3.38Å; E387-L390 HydrophobicContact CB-CD1 4.24Å; E387-L390 WeakPolarHBondContact O-CB 3.31Å; E387-L390 PolarHBondContact O-N 2.93Å; L390-K392 VanDerWaalsContact C-N 3.35Å; L390-K392 PolarHBondContact O-N 3.06Å; L390-K394 CarbonylContact O-C 3.55Å; L390-K394 WeakPolarHBondContact O-CA 3.47Å; L390-K394 PolarHBondContact O-N 2.9Å; L390-I397 HydrophobicContact CD2-CB 3.84Å; L390-I397 HydrophobicContact CD2-CD1 3.58Å; L390-I397 HydrophobicContact CD2-CG1 4.28Å; L390-I397 HydrophobicContact CD2-CG2 3.71Å
391	R	72.8	Confident	82.1	Confident	40 Å²	40	46.9 Å²	46.9	15%	0.151	22%	0.215	C	C	.	.	H	α-helix	trans	-53.9	-45.6	179.2	-160.4	-179.6	75.2	-178.8	2.5	113.4	E387 H428 F429	E387-R391 PolarHBondContact O-N 2.83Å; R391-H428 PolarHBondContact NH2-CD2 2.69Å; R391-H428 VanDerWaalsContact NH2-CD2 3.28Å; R391-F429 HydrophobicContact CG-CB 4.3Å; R391-F429 HydrophobicContact CG-CD2 3.53Å; R391-F429 HydrophobicContact CG-CE2 4.34Å; R391-F429 HydrophobicContact CG-CG 4.34Å
392	K	72.7	Confident	82.2	Confident	160 Å²	160	47.3 Å²	47.3	70%	0.696	22%	0.218	S	C	*	.	H	α-helix	trans	-87.5	-34.8	-175.8	-71.6	-172.1	175.7	-174.2	0	114.1	I388 L390	I388-K392 HydrophobicContact CG2-CD 4.33Å; I388-K392 PolarHBondContact O-N 2.85Å; I388-K392 VanDerWaalsContact O-N 3.07Å; L390-K392 VanDerWaalsContact C-N 3.35Å; L390-K392 PolarHBondContact O-N 3.06Å
393	K	75.6	Confident	82.3	Confident	141 Å²	141	51.3 Å²	51.3	61%	0.613	24%	0.235	S	C	*	.	H	α-helix	trans	-100.4	-29.4	-169.7	-159.2	176.9	-177	176.1	0	113.4	W389	W389-K393 HydrophobicContact CZ2-CD 3.78Å; W389-K393 VanDerWaalsContact O-CB 3.24Å; W389-K393 WeakPolarHBondContact O-CB 3.46Å; W389-K393 PolarHBondContact O-N 2.86Å
394	K	79.3	Confident	82.2	Confident	102 Å²	102	50.3 Å²	50.3	44%	0.443	23%	0.229	S	C	.	.			trans	-145.2	67.8	-176.6	-67.3	-167.1	175.5	-172	0	111.6	L390 E396 I397	L390-K394 CarbonylContact O-C 3.55Å; L390-K394 WeakPolarHBondContact O-CA 3.47Å; L390-K394 PolarHBondContact O-N 2.9Å; K394-E396 PolarHBondContact O-N 2.86Å; K394-E396 VanDerWaalsContact O-N 3.15Å; K394-I397 HydrophobicContact CB-CD1 3.85Å; K394-I397 HydrophobicContact CB-CG1 4.16Å; K394-I397 HydrophobicContact CD-CD1 3.69Å; K394-I397 HydrophobicContact CG-CD1 4.44Å; K394-I397 PolarHBondContact O-N 2.93Å; K394-I397 VanDerWaalsContact O-N 3.13Å
395	P	83.3	Confident	82.3	Confident	27 Å²	27	49.6 Å²	49.6	18%	0.175	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-25.4	177.3	26	-35	0	0	0	112.7	I397 T398 V399 F429 N433 F439	P395-I397 PolarHBondContact O-N 3.35Å; P395-I397 VanDerWaalsContact O-N 3.13Å; P395-T398 PolarHBondContact O-N 2.86Å; P395-T398 VanDerWaalsContact O-N 3.09Å; P395-V399 WeakPolarHBondContact O-CG2 3.08Å; P395-V399 PolarHBondContact O-N 2.89Å; P395-F429 HydrophobicContact CB-CE2 4.05Å; P395-N433 VanDerWaalsContact CB-OD1 3.3Å; P395-N433 WeakPolarHBondContact CB-OD1 3.48Å; P395-F439 HydrophobicContact CG-CE2 4.21Å
396	E	84.9	Confident	82.6	Confident	52 Å²	52	53.1 Å²	53.1	24%	0.243	24%	0.241	C	C	.	.	H	α-helix	trans	-48.9	-37.7	173.3	-66.2	170	-169.5	0	0	113.3	I9 K394 G400 F439	I9-E396 HydrophobicContact CG2-CB 4.17Å; K394-E396 PolarHBondContact O-N 2.86Å; K394-E396 VanDerWaalsContact O-N 3.15Å; E396-G400 PolarHBondContact O-N 2.83Å; E396-F439 HydrophobicContact CB-CE1 4.45Å; E396-F439 HydrophobicContact CB-CZ 4.39Å; E396-F439 HydrophobicContact CG-CE1 3.93Å; E396-F439 HydrophobicContact CG-CZ 3.55Å
397	I	86.2	Confident	82.7	Confident	18 Å²	18	61.3 Å²	61.3	9%	0.092	27%	0.272	C	S	.	.	H	α-helix	trans	-71.3	-45.8	-178.2	-61.8	174.8	0	0	0	110	I9 Y369 L390 K394 P395 G400 V401	I9-I397 HydrophobicContact CD1-CD1 4.48Å; I9-I397 HydrophobicContact CD1-CG1 3.93Å; I9-I397 HydrophobicContact CG1-CG1 4.35Å; I9-I397 HydrophobicContact CG2-CG1 4.34Å; Y369-I397 HydrophobicContact CD1-CG2 4.3Å; Y369-I397 HydrophobicContact CE1-CG2 3.56Å; L390-I397 HydrophobicContact CD2-CB 3.84Å; L390-I397 HydrophobicContact CD2-CD1 3.58Å; L390-I397 HydrophobicContact CD2-CG1 4.28Å; L390-I397 HydrophobicContact CD2-CG2 3.71Å; K394-I397 HydrophobicContact CB-CD1 3.85Å; K394-I397 HydrophobicContact CB-CG1 4.16Å; K394-I397 HydrophobicContact CD-CD1 3.69Å; K394-I397 HydrophobicContact CG-CD1 4.44Å; K394-I397 PolarHBondContact O-N 2.93Å; K394-I397 VanDerWaalsContact O-N 3.13Å; P395-I397 PolarHBondContact O-N 3.35Å; P395-I397 VanDerWaalsContact O-N 3.13Å; I397-G400 PolarHBondContact O-N 2.89Å; I397-V401 WeakPolarHBondContact O-CG2 3.48Å; I397-V401 PolarHBondContact O-N 3.15Å
398	T	86.6	Confident	83	Confident	0 Å²	0	62 Å²	62	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-45	178.6	-46.9	0	0	0	0	110.9	S385 L386 P395 G400 V401 I402 F429	S385-T398 PolarHBondContact O-OG1 3.01Å; L386-T398 HydrophobicContact CD2-CG2 3.78Å; L386-T398 HydrophobicContact CG-CG2 4.34Å; P395-T398 PolarHBondContact O-N 2.86Å; P395-T398 VanDerWaalsContact O-N 3.09Å; T398-G400 VanDerWaalsContact C-N 3.3Å; T398-G400 PolarHBondContact O-N 3.41Å; T398-V401 PolarHBondContact O-N 3.38Å; T398-V401 VanDerWaalsContact O-N 3.17Å; T398-I402 HydrophobicContact CG2-CD1 4.32Å; T398-I402 WeakPolarHBondContact O-CG1 3.47Å; T398-I402 PolarHBondContact O-N 3.48Å; T398-F429 HydrophobicContact CG2-CD1 4.17Å; T398-F429 HydrophobicContact CG2-CD2 4.42Å; T398-F429 HydrophobicContact CG2-CE1 3.62Å; T398-F429 HydrophobicContact CG2-CE2 3.86Å; T398-F429 HydrophobicContact CG2-CZ 3.43Å; T398-F429 VanDerWaalsContact CG2-CZ 3.43Å
399	V	88.4	Confident	83.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-38.2	175.3	180	0	0	0	0	111.2	P395 V401 I402 K403 F429 F439 I442 I443	P395-V399 WeakPolarHBondContact O-CG2 3.08Å; P395-V399 PolarHBondContact O-N 2.89Å; V399-V401 VanDerWaalsContact C-N 3.34Å; V399-V401 PolarHBondContact O-N 2.95Å; V399-I402 PolarHBondContact O-N 3.3Å; V399-K403 WeakPolarHBondContact O-CB 3.35Å; V399-K403 PolarHBondContact O-N 3.03Å; V399-F429 HydrophobicContact CG2-CE1 4.47Å; V399-F429 HydrophobicContact CG2-CZ 3.99Å; V399-F439 HydrophobicContact CB-CD1 3.99Å; V399-F439 HydrophobicContact CB-CE1 4.49Å; V399-F439 HydrophobicContact CB-CG 4.48Å; V399-F439 HydrophobicContact CG1-CB 4.26Å; V399-F439 HydrophobicContact CG1-CD1 3.83Å; V399-F439 HydrophobicContact CG1-CG 4.37Å; V399-F439 HydrophobicContact CG2-CB 3.93Å; V399-F439 HydrophobicContact CG2-CD1 3.82Å; V399-F439 HydrophobicContact CG2-CD2 4.45Å; V399-F439 HydrophobicContact CG2-CE1 4.43Å; V399-F439 HydrophobicContact CG2-CG 3.83Å; V399-I442 HydrophobicContact CG1-CB 3.97Å; V399-I442 HydrophobicContact CG1-CD1 3.59Å; V399-I442 HydrophobicContact CG1-CG1 4.4Å; V399-I442 HydrophobicContact CG1-CG2 3.87Å; V399-I443 HydrophobicContact CG2-CD1 4.13Å; V399-I443 HydrophobicContact CG2-CG1 4.3Å
400	G	87.3	Confident	84.4	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-40.9	173	0	0	0	0	0	113.2	E396 I397 T398 E404	E396-G400 PolarHBondContact O-N 2.83Å; I397-G400 PolarHBondContact O-N 2.89Å; T398-G400 VanDerWaalsContact C-N 3.3Å; T398-G400 PolarHBondContact O-N 3.41Å; G400-E404 WeakPolarHBondContact O-CG 3.5Å; G400-E404 PolarHBondContact O-N 3.26Å
401	V	88.4	Confident	85	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.8	-45.2	175.6	173.2	0	0	0	0	111.2	Y369 I397 T398 V399 K403 E404 L405	Y369-V401 HydrophobicContact CD2-CG2 3.71Å; Y369-V401 HydrophobicContact CE2-CG2 4.18Å; Y369-V401 HydrophobicContact CG-CG2 4.03Å; I397-V401 WeakPolarHBondContact O-CG2 3.48Å; I397-V401 PolarHBondContact O-N 3.15Å; T398-V401 PolarHBondContact O-N 3.38Å; T398-V401 VanDerWaalsContact O-N 3.17Å; V399-V401 VanDerWaalsContact C-N 3.34Å; V399-V401 PolarHBondContact O-N 2.95Å; V401-K403 VanDerWaalsContact C-N 3.32Å; V401-K403 PolarHBondContact O-N 3.06Å; V401-E404 PolarHBondContact O-N 2.89Å; V401-L405 HydrophobicContact CG1-CD1 4.06Å; V401-L405 HydrophobicContact CG1-CG 4.38Å; V401-L405 WeakPolarHBondContact O-CG 3.37Å; V401-L405 PolarHBondContact O-N 3.06Å
402	I	88.8	Confident	85.7	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-45.5	177	-67.5	169	0	0	0	110.4	L382 T398 V399 E404 L405 D406 L411 F429 I442 A446	L382-I402 HydrophobicContact CD1-CG1 3.94Å; T398-I402 HydrophobicContact CG2-CD1 4.32Å; T398-I402 WeakPolarHBondContact O-CG1 3.47Å; T398-I402 PolarHBondContact O-N 3.48Å; V399-I402 PolarHBondContact O-N 3.3Å; I402-E404 VanDerWaalsContact C-N 3.35Å; I402-E404 PolarHBondContact O-N 3.48Å; I402-L405 PolarHBondContact O-N 3.13Å; I402-D406 WeakPolarHBondContact O-CB 3.19Å; I402-D406 PolarHBondContact O-N 3.18Å; I402-L411 HydrophobicContact CG2-CD1 4.42Å; I402-L411 HydrophobicContact CG2-CD2 3.82Å; I402-F429 HydrophobicContact CD1-CE1 3.92Å; I402-I442 HydrophobicContact CB-CG2 4.22Å; I402-I442 HydrophobicContact CG2-CG2 3.73Å; I402-A446 HydrophobicContact CG2-CB 4.11Å
403	K	89	Confident	86.4	Confident	84 Å²	84	54.5 Å²	54.5	37%	0.365	26%	0.263	S	S	.	.	H	α-helix	trans	-60.2	-42.6	175.9	-172.1	177.4	-172.8	167.7	0	112.4	V399 V401 L405 D406 R407 I442	V399-K403 WeakPolarHBondContact O-CB 3.35Å; V399-K403 PolarHBondContact O-N 3.03Å; V401-K403 VanDerWaalsContact C-N 3.32Å; V401-K403 PolarHBondContact O-N 3.06Å; K403-L405 VanDerWaalsContact C-N 3.34Å; K403-D406 PolarHBondContact O-N 2.83Å; K403-R407 WeakPolarHBondContact O-CB 3.42Å; K403-R407 VanDerWaalsContact O-CG 3.24Å; K403-R407 WeakPolarHBondContact O-CG 3.5Å; K403-R407 PolarHBondContact O-N 2.91Å; K403-I442 HydrophobicContact CB-CD1 4.24Å; K403-I442 HydrophobicContact CB-CG2 4.26Å; K403-I442 HydrophobicContact CD-CD1 3.9Å; K403-I442 HydrophobicContact CG-CD1 4.3Å
404	E	87	Confident	87	Confident	31 Å²	31	47.8 Å²	47.8	15%	0.145	23%	0.234	C	C	.	.	H	α-helix	trans	-69.8	-31.3	177.5	-77	-69.1	141.8	0	0	112.5	T7 G400 V401 I402 R407 R408	T7-E404 HydrophobicContact CG2-CB 4.15Å; T7-E404 HydrophobicContact CG2-CG 3.96Å; G400-E404 WeakPolarHBondContact O-CG 3.5Å; G400-E404 PolarHBondContact O-N 3.26Å; V401-E404 PolarHBondContact O-N 2.89Å; I402-E404 VanDerWaalsContact C-N 3.35Å; I402-E404 PolarHBondContact O-N 3.48Å; E404-R407 IonicContact OE1-NH1 3.38Å; E404-R407 PolarHBondContact OE1-NH1 2.92Å; E404-R408 VanDerWaalsContact O-CG 3.24Å; E404-R408 WeakPolarHBondContact O-CG 3.19Å; E404-R408 PolarHBondContact O-N 3.4Å
405	L	88.8	Confident	87.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70.3	-38.6	172.3	-72.2	173.4	0	0	0	112.2	L373 V378 L382 V401 I402 K403 R408 G409 T410 L411 A414	L373-L405 HydrophobicContact CD2-CD2 3.87Å; V378-L405 HydrophobicContact CB-CD2 3.99Å; V378-L405 HydrophobicContact CG1-CD2 3.93Å; L382-L405 HydrophobicContact CB-CD1 4.2Å; L382-L405 HydrophobicContact CD1-CD1 4.41Å; V401-L405 HydrophobicContact CG1-CD1 4.06Å; V401-L405 HydrophobicContact CG1-CG 4.38Å; V401-L405 WeakPolarHBondContact O-CG 3.37Å; V401-L405 PolarHBondContact O-N 3.06Å; I402-L405 PolarHBondContact O-N 3.13Å; K403-L405 VanDerWaalsContact C-N 3.34Å; L405-R408 PolarHBondContact O-N 2.92Å; L405-G409 PolarHBondContact O-N 3.02Å; L405-T410 PolarHBondContact O-N 3.49Å; L405-T410 VanDerWaalsContact O-N 3.11Å; L405-L411 HydrophobicContact CB-CB 4.08Å; L405-L411 HydrophobicContact CB-CD1 4.09Å; L405-L411 HydrophobicContact CD1-CD1 4.21Å; L405-L411 PolarHBondContact O-N 3.08Å; L405-A414 HydrophobicContact CD1-CB 4.2Å
406	D	89	Confident	87.6	Confident	74 Å²	74	44.1 Å²	44.1	40%	0.396	22%	0.224	S	C	.	.	H	α-helix	trans	-64.1	-47.1	175.2	-176.7	53.5	0	0	0	111	I402 K403 R408 G409 L411	I402-D406 WeakPolarHBondContact O-CB 3.19Å; I402-D406 PolarHBondContact O-N 3.18Å; K403-D406 PolarHBondContact O-N 2.83Å; D406-R408 PolarHBondContact O-N 3.37Å; D406-R408 VanDerWaalsContact O-N 3.12Å; D406-G409 PolarHBondContact O-N 3.29Å; D406-L411 HydrophobicContact CB-CD2 3.97Å
407	R	86.9	Confident	87.5	Confident	177 Å²	177	45.4 Å²	45.4	67%	0.668	25%	0.252	S	S	*	.	H	α-helix	trans	-58.8	-27	174	-71.5	179.4	78.7	-169.4	7.4	114	K403 E404	K403-R407 WeakPolarHBondContact O-CB 3.42Å; K403-R407 VanDerWaalsContact O-CG 3.24Å; K403-R407 WeakPolarHBondContact O-CG 3.5Å; K403-R407 PolarHBondContact O-N 2.91Å; E404-R407 IonicContact OE1-NH1 3.38Å; E404-R407 PolarHBondContact OE1-NH1 2.92Å
408	R	87.5	Confident	87.5	Confident	98 Å²	98	45.4 Å²	45.4	37%	0.37	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-8.4	176.2	-70.2	173.6	-170.2	-151.9	3.3	113	E404 L405 D406 T410	E404-R408 VanDerWaalsContact O-CG 3.24Å; E404-R408 WeakPolarHBondContact O-CG 3.19Å; E404-R408 PolarHBondContact O-N 3.4Å; L405-R408 PolarHBondContact O-N 2.92Å; D406-R408 PolarHBondContact O-N 3.37Å; D406-R408 VanDerWaalsContact O-N 3.12Å; R408-T410 HydrophobicContact CB-CG2 4.29Å; R408-T410 PolarHBondContact O-N 3.14Å
409	G	86.1	Confident	87.5	Confident	58 Å²	58	50.6 Å²	50.6	60%	0.598	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	8.7	-173	0	0	0	0	0	114	L405 D406	L405-G409 PolarHBondContact O-N 3.02Å; D406-G409 PolarHBondContact O-N 3.29Å
410	T	89.3	Confident	87.3	Confident	36 Å²	36	55.1 Å²	55.1	22%	0.221	30%	0.3	C	S	.	.			trans	-96	2.7	-175.6	54.7	0	0	0	0	113.3	L405 R408 N413 A414	L405-T410 PolarHBondContact O-N 3.49Å; L405-T410 VanDerWaalsContact O-N 3.11Å; R408-T410 HydrophobicContact CB-CG2 4.29Å; R408-T410 PolarHBondContact O-N 3.14Å; T410-N413 PolarHBondContact O-N 3.38Å; T410-A414 PolarHBondContact O-N 3.37Å
411	L	87.8	Confident	87.3	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.016	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-42.1	-177.3	-176.5	51	0	0	0	112.1	I402 L405 D406 N413 A414 L415 M449	I402-L411 HydrophobicContact CG2-CD1 4.42Å; I402-L411 HydrophobicContact CG2-CD2 3.82Å; L405-L411 HydrophobicContact CB-CB 4.08Å; L405-L411 HydrophobicContact CB-CD1 4.09Å; L405-L411 HydrophobicContact CD1-CD1 4.21Å; L405-L411 PolarHBondContact O-N 3.08Å; D406-L411 HydrophobicContact CB-CD2 3.97Å; L411-N413 VanDerWaalsContact C-N 3.27Å; L411-N413 PolarHBondContact O-N 2.78Å; L411-A414 WeakPolarHBondContact O-CB 3.14Å; L411-A414 PolarHBondContact O-N 2.88Å; L411-L415 HydrophobicContact CD1-CD1 3.99Å; L411-L415 HydrophobicContact CD1-CG 4.08Å; L411-L415 HydrophobicContact CG-CD1 3.98Å; L411-L415 WeakPolarHBondContact O-CG 3Å; L411-L415 PolarHBondContact O-N 3.13Å; L411-M449 HydrophobicContact CB-CE 4.43Å; L411-M449 HydrophobicContact CB-SD 4.32Å; L411-M449 HydrophobicContact CD2-CE 3.3Å; L411-M449 HydrophobicContact CD2-SD 4.17Å; L411-M449 HydrophobicContact CG-CE 3.87Å; L411-M449 HydrophobicContact CG-SD 4.09Å
412	K	87.8	Confident	87.2	Confident	122 Å²	122	65.1 Å²	65.1	53%	0.53	35%	0.346	S	S	.	.	H	α-helix	trans	-56.2	-42.6	173.9	-66.9	-173.4	177.8	-171.9	0	112	A414 L415 A416 M449	K412-A414 VanDerWaalsContact C-N 3.32Å; K412-A414 PolarHBondContact O-N 2.84Å; K412-L415 PolarHBondContact O-N 3.47Å; K412-A416 WeakPolarHBondContact O-CB 3.45Å; K412-A416 PolarHBondContact O-N 2.84Å; K412-M449 HydrophobicContact CG-CG 4.31Å; K412-M449 HydrophobicContact CG-SD 3.71Å
413	N	87.3	Confident	87.1	Confident	110 Å²	110	65.1 Å²	65.1	59%	0.588	35%	0.346	S	S	*	.	H	α-helix	trans	-68.8	-30.9	178.1	-62.2	-0.7	0	0	0	112.6	T410 L411 L415	T410-N413 PolarHBondContact O-N 3.38Å; L411-N413 VanDerWaalsContact C-N 3.27Å; L411-N413 PolarHBondContact O-N 2.78Å; N413-L415 VanDerWaalsContact C-N 3.35Å
414	A	87.3	Confident	87.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-74.5	-28	176.8	0	0	0	0	0	112.6	V378 L382 L405 T410 L411 K412 R418	V378-A414 HydrophobicContact CB-CB 4.07Å; V378-A414 HydrophobicContact CG2-CB 4Å; L382-A414 HydrophobicContact CD2-CB 4.15Å; L405-A414 HydrophobicContact CD1-CB 4.2Å; T410-A414 PolarHBondContact O-N 3.37Å; L411-A414 WeakPolarHBondContact O-CB 3.14Å; L411-A414 PolarHBondContact O-N 2.88Å; K412-A414 VanDerWaalsContact C-N 3.32Å; K412-A414 PolarHBondContact O-N 2.84Å; A414-R418 PolarHBondContact O-NE 3.06Å; A414-R418 PolarHBondContact O-NH2 2.78Å
415	L	87.3	Confident	87.1	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-89.1	-28.6	179.9	-66.9	172.3	0	0	0	113	L382 L411 K412 N413 R418 L426 M449 I450 I453 Y454	L382-L415 HydrophobicContact CD2-CD2 3.92Å; L411-L415 HydrophobicContact CD1-CD1 3.99Å; L411-L415 HydrophobicContact CD1-CG 4.08Å; L411-L415 HydrophobicContact CG-CD1 3.98Å; L411-L415 WeakPolarHBondContact O-CG 3Å; L411-L415 PolarHBondContact O-N 3.13Å; K412-L415 PolarHBondContact O-N 3.47Å; N413-L415 VanDerWaalsContact C-N 3.35Å; L415-R418 WeakPolarHBondContact O-CD 2.87Å; L415-R418 WeakPolarHBondContact O-CG 3.19Å; L415-L426 HydrophobicContact CD2-CD1 3.46Å; L415-L426 VanDerWaalsContact CD2-CD1 3.46Å; L415-L426 HydrophobicContact CD2-CD2 4.41Å; L415-M449 HydrophobicContact CD1-CB 3.96Å; L415-I450 HydrophobicContact CD1-CG1 4.07Å; L415-I450 HydrophobicContact CD2-CG1 4.13Å; L415-I453 HydrophobicContact CB-CD1 3.83Å; L415-Y454 PolarHBondContact O-OH 3.45Å
416	A	87.3	Confident	87.1	Confident	48 Å²	48	65.8 Å²	65.8	40%	0.397	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	144	179	0	0	0	0	0	112.5	K412	K412-A416 WeakPolarHBondContact O-CB 3.45Å; K412-A416 PolarHBondContact O-N 2.84Å
417	G	84.6	Confident	87.1	Confident	79 Å²	79	62.5 Å²	62.5	81%	0.814	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	24	171.3	0	0	0	0	0	115.4
418	R	84.7	Confident	87.1	Confident	18 Å²	18	58.2 Å²	58.2	7%	0.068	32%	0.324	C	S	.	.			trans	-85.4	147	175.5	-61.8	175.7	169.4	-110.7	-25.1	112.5	L382 D383 A414 L415 Q422 Y454	L382-R418 VanDerWaalsContact CD2-NH2 3.34Å; D383-R418 IonicContact OD1-CZ 3.12Å; D383-R418 IonicContact OD1-NH1 3.99Å; D383-R418 PolarHBondContact OD1-NH1 2.84Å; D383-R418 VanDerWaalsContact OD1-NH1 3.09Å; D383-R418 IonicContact OD1-NH2 2.94Å; D383-R418 PolarHBondContact OD1-NH2 2.88Å; A414-R418 PolarHBondContact O-NE 3.06Å; A414-R418 PolarHBondContact O-NH2 2.78Å; L415-R418 WeakPolarHBondContact O-CD 2.87Å; L415-R418 WeakPolarHBondContact O-CG 3.19Å; R418-Q422 HydrophobicContact CB-CB 4.19Å; R418-Y454 WeakPolarHBondContact CA-OH 3.01Å; R418-Y454 VanDerWaalsContact CB-OH 3.3Å; R418-Y454 WeakPolarHBondContact CB-OH 3.21Å; R418-Y454 PolarHBondContact N-OH 3.11Å; R418-Y454 PolarHBondContact O-OH 2.76Å
419	D	86.2	Confident	87.2	Confident	110 Å²	110	53.7 Å²	53.7	59%	0.588	31%	0.307	S	S	*	.			trans	-73.2	163.3	172.7	-55.2	-40.9	0	0	0	111.9	E421 Q422 L423	D419-E421 VanDerWaalsContact C-N 3.32Å; D419-E421 PolarHBondContact O-N 2.71Å; D419-Q422 PolarHBondContact O-N 2.75Å; D419-L423 PolarHBondContact O-N 2.88Å
420	E	85.4	Confident	87.4	Confident	95 Å²	95	51 Å²	51	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-54.8	-43.7	178.9	179.7	175.6	-179.1	0	0	112.9	Q422 L423 S424 S461 I464	E420-Q422 PolarHBondContact O-N 2.8Å; E420-L423 PolarHBondContact O-N 2.82Å; E420-S424 WeakPolarHBondContact O-CB 3.05Å; E420-S424 PolarHBondContact O-N 3.01Å; E420-S461 VanDerWaalsContact OE1-CB 3.31Å; E420-S461 WeakPolarHBondContact OE1-CB 3.5Å; E420-S461 PolarHBondContact OE1-OG 3.32Å; E420-I464 HydrophobicContact CG-CD1 3.9Å; E420-I464 HydrophobicContact CG-CG1 4.39Å
421	E	86.4	Confident	87.4	Confident	148 Å²	148	49.9 Å²	49.9	69%	0.692	27%	0.272	S	S	*	.	H	α-helix	trans	-62.8	-43.5	179.4	-65.6	-171.1	171.7	0	0	112	D419 S424 Q425	D419-E421 VanDerWaalsContact C-N 3.32Å; D419-E421 PolarHBondContact O-N 2.71Å; E421-S424 PolarHBondContact O-N 2.79Å; E421-S424 PolarHBondContact O-OG 3.46Å; E421-Q425 WeakPolarHBondContact O-CG 3.25Å; E421-Q425 PolarHBondContact O-N 3.24Å; E421-Q425 VanDerWaalsContact O-N 3.1Å
422	Q	86.8	Confident	87.3	Confident	63 Å²	63	52.3 Å²	52.3	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-69	-38.5	-179.7	-65.4	177.5	0.3	0	0	111.3	R418 D419 E420 S424 Q425 L426	R418-Q422 HydrophobicContact CB-CB 4.19Å; D419-Q422 PolarHBondContact O-N 2.75Å; E420-Q422 PolarHBondContact O-N 2.8Å; Q422-S424 VanDerWaalsContact C-N 3.35Å; Q422-Q425 PolarHBondContact O-N 3.33Å; Q422-L426 WeakPolarHBondContact O-CB 3.44Å; Q422-L426 PolarHBondContact O-N 2.82Å
423	L	87.6	Confident	87.3	Confident	9 Å²	9	47.6 Å²	47.6	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-41.6	174.4	-176.2	57.2	0	0	0	110.8	D419 E420 Q425 L426 L427 I450 Y454 I464	D419-L423 PolarHBondContact O-N 2.88Å; E420-L423 PolarHBondContact O-N 2.82Å; L423-Q425 VanDerWaalsContact C-N 3.32Å; L423-Q425 PolarHBondContact O-N 2.86Å; L423-L426 PolarHBondContact O-N 2.83Å; L423-L427 HydrophobicContact CD1-CD1 4.44Å; L423-L427 HydrophobicContact CD1-CG 4.33Å; L423-L427 HydrophobicContact CG-CD1 4.17Å; L423-L427 HydrophobicContact CG-CG 4.49Å; L423-L427 PolarHBondContact O-N 2.78Å; L423-I450 HydrophobicContact CD1-CG2 3.75Å; L423-Y454 HydrophobicContact CD1-CD2 4.27Å; L423-Y454 HydrophobicContact CD1-CE2 4.2Å; L423-Y454 HydrophobicContact CD2-CD1 4.01Å; L423-Y454 HydrophobicContact CD2-CD2 4.3Å; L423-Y454 HydrophobicContact CD2-CE1 4.16Å; L423-Y454 HydrophobicContact CD2-CE2 4.45Å; L423-Y454 HydrophobicContact CD2-CG 4.07Å; L423-I464 HydrophobicContact CD2-CD1 3.72Å; L423-I464 HydrophobicContact CD2-CG1 4.44Å; L423-I464 HydrophobicContact CG-CD1 4.39Å
424	S	88.1	Confident	87.2	Confident	33 Å²	33	43.1 Å²	43.1	23%	0.231	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-38.3	177	83.6	0	0	0	0	112.7	E420 E421 Q422 L426 H428 Q467	E420-S424 WeakPolarHBondContact O-CB 3.05Å; E420-S424 PolarHBondContact O-N 3.01Å; E421-S424 PolarHBondContact O-N 2.79Å; E421-S424 PolarHBondContact O-OG 3.46Å; Q422-S424 VanDerWaalsContact C-N 3.35Å; S424-L426 VanDerWaalsContact C-N 3.3Å; S424-L426 PolarHBondContact O-N 2.85Å; S424-H428 VanDerWaalsContact O-CB 3.24Å; S424-H428 WeakPolarHBondContact O-CB 3.37Å; S424-H428 PolarHBondContact O-N 3.22Å; S424-Q467 PolarHBondContact O-OE1 2.9Å
425	Q	87.5	Confident	87.1	Confident	89 Å²	89	47 Å²	47	42%	0.416	28%	0.277	S	S	.	.	H	α-helix	trans	-67.1	-36.1	177.6	-71.7	177.5	14	0	0	111.8	E421 Q422 L423 F429	E421-Q425 WeakPolarHBondContact O-CG 3.25Å; E421-Q425 PolarHBondContact O-N 3.24Å; E421-Q425 VanDerWaalsContact O-N 3.1Å; Q422-Q425 PolarHBondContact O-N 3.33Å; L423-Q425 VanDerWaalsContact C-N 3.32Å; L423-Q425 PolarHBondContact O-N 2.86Å; Q425-F429 PolarHBondContact O-N 2.92Å; Q425-F429 VanDerWaalsContact O-N 3.12Å
426	L	88.1	Confident	86.9	Confident	8 Å²	8	49.2 Å²	49.2	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-75.3	-45.6	-179.9	-162.2	152.9	0	0	0	110.9	L382 L386 L415 Q422 L423 S424 H428 F429 V430 I450	L382-L426 HydrophobicContact CD2-CD1 4.1Å; L386-L426 HydrophobicContact CD1-CB 4.37Å; L386-L426 HydrophobicContact CD1-CD1 4.05Å; L386-L426 HydrophobicContact CD1-CG 4.24Å; L415-L426 HydrophobicContact CD2-CD1 3.46Å; L415-L426 VanDerWaalsContact CD2-CD1 3.46Å; L415-L426 HydrophobicContact CD2-CD2 4.41Å; Q422-L426 WeakPolarHBondContact O-CB 3.44Å; Q422-L426 PolarHBondContact O-N 2.82Å; L423-L426 PolarHBondContact O-N 2.83Å; S424-L426 VanDerWaalsContact C-N 3.3Å; S424-L426 PolarHBondContact O-N 2.85Å; L426-H428 VanDerWaalsContact C-N 3.31Å; L426-H428 PolarHBondContact O-N 3.39Å; L426-F429 WeakPolarHBondContact O-CA 3.39Å; L426-F429 WeakPolarHBondContact O-CB 3.23Å; L426-F429 PolarHBondContact O-N 2.96Å; L426-V430 HydrophobicContact CD2-CG2 4Å; L426-V430 WeakPolarHBondContact O-CG2 3.34Å; L426-V430 PolarHBondContact O-N 2.94Å; L426-I450 HydrophobicContact CD2-CD1 3.08Å; L426-I450 HydrophobicContact CD2-CG1 4.04Å
427	L	88.3	Confident	86.6	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-59.8	-41.5	172.6	-75.8	174.4	0	0	0	111.5	L423 F429 V430 I431 I450 I464 Q467 L468	L423-L427 HydrophobicContact CD1-CD1 4.44Å; L423-L427 HydrophobicContact CD1-CG 4.33Å; L423-L427 HydrophobicContact CG-CD1 4.17Å; L423-L427 HydrophobicContact CG-CG 4.49Å; L423-L427 PolarHBondContact O-N 2.78Å; L427-F429 VanDerWaalsContact C-N 3.26Å; L427-F429 PolarHBondContact O-N 2.96Å; L427-V430 PolarHBondContact O-N 2.83Å; L427-I431 WeakPolarHBondContact O-CB 3.13Å; L427-I431 WeakPolarHBondContact O-CD1 3.26Å; L427-I431 WeakPolarHBondContact O-CG1 3.41Å; L427-I431 PolarHBondContact O-N 2.83Å; L427-I450 HydrophobicContact CD2-CG2 4.4Å; L427-I464 HydrophobicContact CD1-CG2 3.93Å; L427-Q467 HydrophobicContact CB-CB 4.42Å; L427-Q467 VanDerWaalsContact CB-OE1 3.31Å; L427-Q467 HydrophobicContact CD1-CB 4.3Å; L427-L468 HydrophobicContact CD1-CD2 4.46Å; L427-L468 HydrophobicContact CD2-CD2 4.08Å
428	H	88.9	Confident	86.5	Confident	86 Å²	86	50.2 Å²	50.2	40%	0.398	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-34.3	174	-167.3	90.1	0	0	0	112.6	R391 S424 L426 G432	R391-H428 PolarHBondContact NH2-CD2 2.69Å; R391-H428 VanDerWaalsContact NH2-CD2 3.28Å; S424-H428 VanDerWaalsContact O-CB 3.24Å; S424-H428 WeakPolarHBondContact O-CB 3.37Å; S424-H428 PolarHBondContact O-N 3.22Å; L426-H428 VanDerWaalsContact C-N 3.31Å; L426-H428 PolarHBondContact O-N 3.39Å; H428-G432 PolarHBondContact O-N 2.95Å; H428-G432 VanDerWaalsContact O-N 3.13Å
429	F	88.8	Confident	86.5	Confident	3 Å²	3	49.5 Å²	49.5	1%	0.013	27%	0.266	C	S	.	.	H	α-helix	trans	-68.8	-43.9	173.3	176.2	-103.6	0	0	0	112	L386 R391 P395 T398 V399 I402 Q425 L426 L427 G432 N433	L386-F429 HydrophobicContact CD2-CB 3.97Å; L386-F429 HydrophobicContact CD2-CD1 4.15Å; L386-F429 HydrophobicContact CD2-CD2 4.47Å; L386-F429 HydrophobicContact CD2-CG 3.92Å; R391-F429 HydrophobicContact CG-CB 4.3Å; R391-F429 HydrophobicContact CG-CD2 3.53Å; R391-F429 HydrophobicContact CG-CE2 4.34Å; R391-F429 HydrophobicContact CG-CG 4.34Å; P395-F429 HydrophobicContact CB-CE2 4.05Å; T398-F429 HydrophobicContact CG2-CD1 4.17Å; T398-F429 HydrophobicContact CG2-CD2 4.42Å; T398-F429 HydrophobicContact CG2-CE1 3.62Å; T398-F429 HydrophobicContact CG2-CE2 3.86Å; T398-F429 HydrophobicContact CG2-CZ 3.43Å; T398-F429 VanDerWaalsContact CG2-CZ 3.43Å; V399-F429 HydrophobicContact CG2-CE1 4.47Å; V399-F429 HydrophobicContact CG2-CZ 3.99Å; I402-F429 HydrophobicContact CD1-CE1 3.92Å; Q425-F429 PolarHBondContact O-N 2.92Å; Q425-F429 VanDerWaalsContact O-N 3.12Å; L426-F429 WeakPolarHBondContact O-CA 3.39Å; L426-F429 WeakPolarHBondContact O-CB 3.23Å; L426-F429 PolarHBondContact O-N 2.96Å; L427-F429 VanDerWaalsContact C-N 3.26Å; L427-F429 PolarHBondContact O-N 2.96Å; F429-G432 PolarHBondContact O-N 2.83Å; F429-N433 WeakPolarHBondContact CD2-ND2 3.26Å; F429-N433 WeakPolarHBondContact CE2-ND2 3.31Å; F429-N433 PolarHBondContact O-N 2.8Å; F429-N433 PolarHBondContact O-ND2 3.34Å
430	V	89.4	Confident	86.4	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-53.7	176.6	170.9	0	0	0	0	110	L426 L427 G432 N433 I434 I443 A447 I450 L471	L426-V430 HydrophobicContact CD2-CG2 4Å; L426-V430 WeakPolarHBondContact O-CG2 3.34Å; L426-V430 PolarHBondContact O-N 2.94Å; L427-V430 PolarHBondContact O-N 2.83Å; V430-G432 VanDerWaalsContact C-N 3.26Å; V430-G432 PolarHBondContact O-N 2.84Å; V430-N433 PolarHBondContact O-N 2.94Å; V430-N433 VanDerWaalsContact O-N 3.12Å; V430-I434 WeakPolarHBondContact O-CB 3.43Å; V430-I434 PolarHBondContact O-N 2.83Å; V430-I443 HydrophobicContact CB-CG2 4.16Å; V430-I443 HydrophobicContact CG1-CG2 3.76Å; V430-I443 HydrophobicContact CG2-CG2 4.18Å; V430-A447 HydrophobicContact CG1-CB 4.01Å; V430-I450 HydrophobicContact CG2-CD1 4.31Å; V430-L471 HydrophobicContact CG1-CD1 3.99Å; V430-L471 HydrophobicContact CG1-CD2 4.46Å
431	I	88.9	Confident	86.6	Confident	12 Å²	12	45 Å²	45	6%	0.062	25%	0.253	C	S	.	.	H	α-helix	trans	-55.1	-41.1	178.7	-71.1	166.7	0	0	0	111.7	L427 N433 Q467 R470 L471 I474	L427-I431 WeakPolarHBondContact O-CB 3.13Å; L427-I431 WeakPolarHBondContact O-CD1 3.26Å; L427-I431 WeakPolarHBondContact O-CG1 3.41Å; L427-I431 PolarHBondContact O-N 2.83Å; I431-N433 PolarHBondContact O-N 2.9Å; I431-Q467 HydrophobicContact CD1-CB 3.93Å; I431-Q467 HydrophobicContact CD1-CG 4.4Å; I431-Q467 VanDerWaalsContact CD1-O 3.25Å; I431-Q467 WeakPolarHBondContact CD1-O 3.31Å; I431-R470 HydrophobicContact CG2-CG 4.34Å; I431-L471 HydrophobicContact CD1-CB 4.47Å; I431-L471 HydrophobicContact CG1-CB 4.01Å; I431-L471 HydrophobicContact CG1-CD1 4.04Å; I431-I474 HydrophobicContact CG2-CD1 3.63Å
432	G	85.9	Confident	86.7	Confident	54 Å²	54	39.1 Å²	39.1	56%	0.557	23%	0.226	S	C	*	.	H	α-helix	trans	-75.1	-19.6	-177.3	0	0	0	0	0	115	H428 F429 V430	H428-G432 PolarHBondContact O-N 2.95Å; H428-G432 VanDerWaalsContact O-N 3.13Å; F429-G432 PolarHBondContact O-N 2.83Å; V430-G432 VanDerWaalsContact C-N 3.26Å; V430-G432 PolarHBondContact O-N 2.84Å
433	N	87.5	Confident	86.8	Confident	23 Å²	23	36.1 Å²	36.1	12%	0.123	21%	0.212	C	C	.	.	H	α-helix	trans	-121.9	-2.8	-171	-65.8	-76.8	0	0	0	114.1	P395 F429 V430 I431 V435 D436 I443	P395-N433 VanDerWaalsContact CB-OD1 3.3Å; P395-N433 WeakPolarHBondContact CB-OD1 3.48Å; F429-N433 WeakPolarHBondContact CD2-ND2 3.26Å; F429-N433 WeakPolarHBondContact CE2-ND2 3.31Å; F429-N433 PolarHBondContact O-N 2.8Å; F429-N433 PolarHBondContact O-ND2 3.34Å; V430-N433 PolarHBondContact O-N 2.94Å; V430-N433 VanDerWaalsContact O-N 3.12Å; I431-N433 PolarHBondContact O-N 2.9Å; N433-V435 PolarHBondContact O-N 3Å; N433-D436 PolarHBondContact O-N 2.88Å; N433-I443 HydrophobicContact CB-CD1 3.36Å
434	I	86.8	Confident	87	Confident	15 Å²	15	39.1 Å²	39.1	8%	0.077	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-27.1	178	-153.5	159.5	0	0	0	112.7	V430 D436 L471 I474 L475	V430-I434 WeakPolarHBondContact O-CB 3.43Å; V430-I434 PolarHBondContact O-N 2.83Å; I434-D436 VanDerWaalsContact C-N 3.29Å; I434-D436 PolarHBondContact O-N 2.94Å; I434-L471 HydrophobicContact CD1-CD1 3.85Å; I434-I474 HydrophobicContact CG2-CG2 3.7Å; I434-L475 HydrophobicContact CD1-CD2 3.69Å; I434-L475 HydrophobicContact CD1-CG 4.18Å; I434-L475 HydrophobicContact CG1-CD2 4.41Å
435	V	84.8	Confident	87.1	Confident	82 Å²	82	39.9 Å²	39.9	50%	0.497	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-19.5	178.2	-176	0	0	0	0	112.5	N433 T437 I474	N433-V435 PolarHBondContact O-N 3Å; V435-T437 PolarHBondContact O-N 2.74Å; V435-I474 HydrophobicContact CG2-CG2 3.98Å
436	D	83.8	Confident	87.2	Confident	50 Å²	50	35.9 Å²	35.9	27%	0.267	21%	0.213	S	C	.	.			trans	-83.8	106.8	175.8	-165.8	-19.9	0	0	0	109.6	N433 I434 R438 F439 A440	N433-D436 PolarHBondContact O-N 2.88Å; I434-D436 VanDerWaalsContact C-N 3.29Å; I434-D436 PolarHBondContact O-N 2.94Å; D436-R438 PolarHBondContact O-N 2.93Å; D436-R438 WeakPolarHBondContact OD1-CB 3.49Å; D436-R438 WeakPolarHBondContact OD1-CD 3.49Å; D436-R438 WeakPolarHBondContact OD1-CG 3.49Å; D436-R438 PolarHBondContact OD1-N 2.89Å; D436-R438 IonicContact OD1-NE 3.09Å; D436-F439 HydrophobicContact CB-CD2 3.75Å; D436-F439 HydrophobicContact CB-CE2 4.26Å; D436-F439 PolarHBondContact O-N 3.48Å; D436-F439 WeakPolarHBondContact OD2-CE2 3.11Å; D436-A440 PolarHBondContact O-N 2.97Å
437	T	79.9	Confident	87.3	Confident	94 Å²	94	35.9 Å²	35.9	58%	0.577	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-25.3	-179.3	59.1	0	0	0	0	113.9	V435	V435-T437 PolarHBondContact O-N 2.74Å
438	R	82	Confident	87.5	Confident	55 Å²	55	40.6 Å²	40.6	21%	0.208	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-35	179.7	-62.5	165.1	-171.4	165.5	25.5	113.3	Y12 P13 D436	Y12-R438 HydrophobicContact CD1-CB 3.72Å; Y12-R438 HydrophobicContact CD1-CG 4.25Å; Y12-R438 HydrophobicContact CE1-CB 4.12Å; Y12-R438 VanDerWaalsContact CE1-O 3.24Å; Y12-R438 WeakPolarHBondContact CE1-O 3.4Å; Y12-R438 HydrophobicContact CG-CB 4.01Å; Y12-R438 HydrophobicContact CG-CG 4.46Å; P13-R438 PolarHBondContact O-NE 3.06Å; D436-R438 PolarHBondContact O-N 2.93Å; D436-R438 WeakPolarHBondContact OD1-CB 3.49Å; D436-R438 WeakPolarHBondContact OD1-CD 3.49Å; D436-R438 WeakPolarHBondContact OD1-CG 3.49Å; D436-R438 PolarHBondContact OD1-N 2.89Å; D436-R438 IonicContact OD1-NE 3.09Å
439	F	84.4	Confident	87.5	Confident	3 Å²	3	37.6 Å²	37.6	1%	0.013	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-20	-175	-52.2	-50.7	0	0	0	112	Y12 P395 E396 V399 D436 P441 I442 I443	Y12-F439 AromaticContact CD2-CD1 3.98Å; Y12-F439 HydrophobicContact CD2-CD1 3.98Å; Y12-F439 AromaticContact CD2-CE1 3.31Å; Y12-F439 HydrophobicContact CD2-CE1 3.31Å; Y12-F439 HydrophobicContact CD2-CZ 4.17Å; Y12-F439 AromaticContact CE2-CD1 3.51Å; Y12-F439 HydrophobicContact CE2-CD1 3.51Å; Y12-F439 AromaticContact CE2-CE1 3.23Å; Y12-F439 HydrophobicContact CE2-CE1 3.23Å; Y12-F439 HydrophobicContact CE2-CZ 4.43Å; Y12-F439 HydrophobicContact CG-CE1 4.17Å; Y12-F439 AromaticContact CZ-CD1 3.87Å; P395-F439 HydrophobicContact CG-CE2 4.21Å; E396-F439 HydrophobicContact CB-CE1 4.45Å; E396-F439 HydrophobicContact CB-CZ 4.39Å; E396-F439 HydrophobicContact CG-CE1 3.93Å; E396-F439 HydrophobicContact CG-CZ 3.55Å; V399-F439 HydrophobicContact CB-CD1 3.99Å; V399-F439 HydrophobicContact CB-CE1 4.49Å; V399-F439 HydrophobicContact CB-CG 4.48Å; V399-F439 HydrophobicContact CG1-CB 4.26Å; V399-F439 HydrophobicContact CG1-CD1 3.83Å; V399-F439 HydrophobicContact CG1-CG 4.37Å; V399-F439 HydrophobicContact CG2-CB 3.93Å; V399-F439 HydrophobicContact CG2-CD1 3.82Å; V399-F439 HydrophobicContact CG2-CD2 4.45Å; V399-F439 HydrophobicContact CG2-CE1 4.43Å; V399-F439 HydrophobicContact CG2-CG 3.83Å; D436-F439 HydrophobicContact CB-CD2 3.75Å; D436-F439 HydrophobicContact CB-CE2 4.26Å; D436-F439 PolarHBondContact O-N 3.48Å; D436-F439 WeakPolarHBondContact OD2-CE2 3.11Å; F439-P441 VanDerWaalsContact C-CD 3.47Å; F439-I442 PolarHBondContact O-N 3.49Å; F439-I443 HydrophobicContact CB-CD1 3.53Å; F439-I443 HydrophobicContact CB-CG1 4.19Å; F439-I443 WeakPolarHBondContact O-CG1 3.36Å; F439-I443 PolarHBondContact O-N 3.47Å
440	A	85.8	Confident	87.6	Confident	25 Å²	25	37.7 Å²	37.7	21%	0.207	22%	0.223	C	C	.	.	H	α-helix	trans	-45.6	-47.1	-174.5	0	0	0	0	0	114.2	D436 I442 I443 L444	D436-A440 PolarHBondContact O-N 2.97Å; A440-I442 PolarHBondContact O-N 2.88Å; A440-I443 PolarHBondContact O-N 3.15Å; A440-L444 WeakPolarHBondContact O-CB 3.27Å; A440-L444 PolarHBondContact O-N 2.83Å
441	P	88.3	Confident	87.5	Confident	85 Å²	85	41.1 Å²	41.1	55%	0.552	24%	0.241	S	C	*	.	H	α-helix	trans	-63.8	-38.2	-178.4	-22.7	33.8	0	0	0	114	F439 T445	F439-P441 VanDerWaalsContact C-CD 3.47Å; P441-T445 WeakPolarHBondContact O-CG2 3.34Å; P441-T445 PolarHBondContact O-N 3.47Å; P441-T445 PolarHBondContact O-OG1 2.9Å
442	I	88.5	Confident	87.6	Confident	24 Å²	24	46.1 Å²	46.1	12%	0.123	27%	0.268	C	S	.	.	H	α-helix	trans	-76.1	-33.9	-179.1	-60.4	160.6	0	0	0	110.2	Y12 V399 I402 K403 F439 A440 T445 A446	Y12-I442 VanDerWaalsContact OH-CD1 3.31Å; Y12-I442 WeakPolarHBondContact OH-CD1 3.32Å; V399-I442 HydrophobicContact CG1-CB 3.97Å; V399-I442 HydrophobicContact CG1-CD1 3.59Å; V399-I442 HydrophobicContact CG1-CG1 4.4Å; V399-I442 HydrophobicContact CG1-CG2 3.87Å; I402-I442 HydrophobicContact CB-CG2 4.22Å; I402-I442 HydrophobicContact CG2-CG2 3.73Å; K403-I442 HydrophobicContact CB-CD1 4.24Å; K403-I442 HydrophobicContact CB-CG2 4.26Å; K403-I442 HydrophobicContact CD-CD1 3.9Å; K403-I442 HydrophobicContact CG-CD1 4.3Å; F439-I442 PolarHBondContact O-N 3.49Å; A440-I442 PolarHBondContact O-N 2.88Å; I442-T445 WeakPolarHBondContact CA-OG1 3.41Å; I442-T445 PolarHBondContact O-OG1 3.41Å; I442-A446 PolarHBondContact O-N 2.95Å
443	I	90.2	Very high	87.8	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-75.7	-37.7	178.5	-67	175.8	0	0	0	110.6	V399 V430 N433 F439 A440 A446 A447	V399-I443 HydrophobicContact CG2-CD1 4.13Å; V399-I443 HydrophobicContact CG2-CG1 4.3Å; V430-I443 HydrophobicContact CB-CG2 4.16Å; V430-I443 HydrophobicContact CG1-CG2 3.76Å; V430-I443 HydrophobicContact CG2-CG2 4.18Å; N433-I443 HydrophobicContact CB-CD1 3.36Å; F439-I443 HydrophobicContact CB-CD1 3.53Å; F439-I443 HydrophobicContact CB-CG1 4.19Å; F439-I443 WeakPolarHBondContact O-CG1 3.36Å; F439-I443 PolarHBondContact O-N 3.47Å; A440-I443 PolarHBondContact O-N 3.15Å; I443-A446 CarbonylContact O-C 3.58Å; I443-A446 WeakPolarHBondContact O-CB 3.38Å; I443-A446 PolarHBondContact O-N 3.46Å; I443-A447 WeakPolarHBondContact O-CB 3.06Å; I443-A447 PolarHBondContact O-N 3.49Å
444	L	90.7	Very high	87.8	Confident	72 Å²	72	46.7 Å²	46.7	38%	0.377	26%	0.256	S	S	.	.	H	α-helix	trans	-64.5	-46.5	177.6	-172.5	69.4	0	0	0	111	A440 A446 A447 E448	A440-L444 WeakPolarHBondContact O-CB 3.27Å; A440-L444 PolarHBondContact O-N 2.83Å; L444-A446 VanDerWaalsContact C-N 3.28Å; L444-A446 PolarHBondContact O-N 2.89Å; L444-A447 CarbonylContact O-C 3.48Å; L444-A447 WeakPolarHBondContact O-CA 3.39Å; L444-A447 WeakPolarHBondContact O-CB 3.29Å; L444-A447 PolarHBondContact O-N 2.68Å; L444-E448 WeakPolarHBondContact O-CG 3.46Å; L444-E448 PolarHBondContact O-N 2.8Å
445	T	90.1	Very high	87.8	Confident	49 Å²	49	53.6 Å²	53.6	30%	0.301	29%	0.285	S	S	.	.	H	α-helix	trans	-58.4	-40.1	173.2	46.4	0	0	0	0	112.1	P441 I442 M449	P441-T445 WeakPolarHBondContact O-CG2 3.34Å; P441-T445 PolarHBondContact O-N 3.47Å; P441-T445 PolarHBondContact O-OG1 2.9Å; I442-T445 WeakPolarHBondContact CA-OG1 3.41Å; I442-T445 PolarHBondContact O-OG1 3.41Å; T445-M449 WeakPolarHBondContact O-CE 3.23Å; T445-M449 PolarHBondContact O-N 2.71Å; T445-M449 VanDerWaalsContact O-N 3.11Å
446	A	89.6	Confident	87.8	Confident	5 Å²	5	54.5 Å²	54.5	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-41.6	172.6	0	0	0	0	0	112.4	I402 I442 I443 L444 M449 I450	I402-A446 HydrophobicContact CG2-CB 4.11Å; I442-A446 PolarHBondContact O-N 2.95Å; I443-A446 CarbonylContact O-C 3.58Å; I443-A446 WeakPolarHBondContact O-CB 3.38Å; I443-A446 PolarHBondContact O-N 3.46Å; L444-A446 VanDerWaalsContact C-N 3.28Å; L444-A446 PolarHBondContact O-N 2.89Å; A446-M449 PolarHBondContact O-N 2.98Å; A446-I450 WeakPolarHBondContact O-CD1 3.4Å; A446-I450 WeakPolarHBondContact O-CG1 3.32Å; A446-I450 PolarHBondContact O-N 2.62Å
447	A	90.8	Very high	87.7	Confident	7 Å²	7	54.8 Å²	54.8	6%	0.058	30%	0.298	C	S	.	.	H	α-helix	trans	-61.4	-45.8	176.8	0	0	0	0	0	112.1	V430 I443 L444 M449 I450 L451	V430-A447 HydrophobicContact CG1-CB 4.01Å; I443-A447 WeakPolarHBondContact O-CB 3.06Å; I443-A447 PolarHBondContact O-N 3.49Å; L444-A447 CarbonylContact O-C 3.48Å; L444-A447 WeakPolarHBondContact O-CA 3.39Å; L444-A447 WeakPolarHBondContact O-CB 3.29Å; L444-A447 PolarHBondContact O-N 2.68Å; A447-M449 PolarHBondContact O-N 3.37Å; A447-I450 PolarHBondContact O-N 3.39Å; A447-L451 WeakPolarHBondContact O-CG 3.46Å; A447-L451 PolarHBondContact O-N 3.48Å
448	E	91.8	Very high	87.7	Confident	105 Å²	105	54.3 Å²	54.3	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-57.3	-48.2	173.7	-72.5	173.3	176.8	0	0	111.1	L444 I450 L451 D452	L444-E448 WeakPolarHBondContact O-CG 3.46Å; L444-E448 PolarHBondContact O-N 2.8Å; E448-I450 VanDerWaalsContact C-N 3.3Å; E448-I450 PolarHBondContact O-N 2.84Å; E448-L451 PolarHBondContact O-N 2.67Å; E448-D452 PolarHBondContact O-N 3.28Å
449	M	90	Very high	87.5	Confident	22 Å²	22	54.4 Å²	54.4	11%	0.108	31%	0.31	C	S	.	.	H	α-helix	trans	-62.2	-35.4	177.2	-79.2	-175.6	-87.7	0	0	113.4	L411 K412 L415 T445 A446 A447 I453	L411-M449 HydrophobicContact CB-CE 4.43Å; L411-M449 HydrophobicContact CB-SD 4.32Å; L411-M449 HydrophobicContact CD2-CE 3.3Å; L411-M449 HydrophobicContact CD2-SD 4.17Å; L411-M449 HydrophobicContact CG-CE 3.87Å; L411-M449 HydrophobicContact CG-SD 4.09Å; K412-M449 HydrophobicContact CG-CG 4.31Å; K412-M449 HydrophobicContact CG-SD 3.71Å; L415-M449 HydrophobicContact CD1-CB 3.96Å; T445-M449 WeakPolarHBondContact O-CE 3.23Å; T445-M449 PolarHBondContact O-N 2.71Å; T445-M449 VanDerWaalsContact O-N 3.11Å; A446-M449 PolarHBondContact O-N 2.98Å; A447-M449 PolarHBondContact O-N 3.37Å; M449-I453 WeakPolarHBondContact O-CD1 3.3Å; M449-I453 VanDerWaalsContact O-CG1 3.23Å; M449-I453 WeakPolarHBondContact O-CG1 3.33Å; M449-I453 PolarHBondContact O-N 2.83Å; M449-I453 VanDerWaalsContact O-N 3.12Å
450	I	89.8	Confident	87.5	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-67.4	-46.1	176.3	-67.2	151.3	0	0	0	110.2	L415 L423 L426 L427 V430 A446 A447 E448 D452 I453 Y454	L415-I450 HydrophobicContact CD1-CG1 4.07Å; L415-I450 HydrophobicContact CD2-CG1 4.13Å; L423-I450 HydrophobicContact CD1-CG2 3.75Å; L426-I450 HydrophobicContact CD2-CD1 3.08Å; L426-I450 HydrophobicContact CD2-CG1 4.04Å; L427-I450 HydrophobicContact CD2-CG2 4.4Å; V430-I450 HydrophobicContact CG2-CD1 4.31Å; A446-I450 WeakPolarHBondContact O-CD1 3.4Å; A446-I450 WeakPolarHBondContact O-CG1 3.32Å; A446-I450 PolarHBondContact O-N 2.62Å; A447-I450 PolarHBondContact O-N 3.39Å; E448-I450 VanDerWaalsContact C-N 3.3Å; E448-I450 PolarHBondContact O-N 2.84Å; I450-D452 VanDerWaalsContact C-N 3.32Å; I450-D452 PolarHBondContact O-N 3.27Å; I450-I453 PolarHBondContact O-N 2.65Å; I450-Y454 HydrophobicContact CG2-CD2 4.21Å; I450-Y454 WeakPolarHBondContact O-CB 3.28Å; I450-Y454 WeakPolarHBondContact O-CD2 3.42Å; I450-Y454 PolarHBondContact O-N 2.76Å
451	L	89	Confident	87.6	Confident	75 Å²	75	61.2 Å²	61.2	39%	0.393	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-40.6	178.4	-70.9	172.2	0	0	0	111.6	A447 E448 K455 L468	A447-L451 WeakPolarHBondContact O-CG 3.46Å; A447-L451 PolarHBondContact O-N 3.48Å; E448-L451 PolarHBondContact O-N 2.67Å; L451-K455 WeakPolarHBondContact O-CA 3.44Å; L451-K455 WeakPolarHBondContact O-CB 3.3Å; L451-K455 PolarHBondContact O-N 2.82Å; L451-L468 HydrophobicContact CD2-CD2 3.83Å
452	D	90.8	Very high	87.5	Confident	118 Å²	118	60.4 Å²	60.4	63%	0.631	34%	0.34	S	S	*	.	H	α-helix	trans	-62.8	-46.4	176.7	-82.9	-10.7	0	0	0	112.5	E448 I450	E448-D452 PolarHBondContact O-N 3.28Å; I450-D452 VanDerWaalsContact C-N 3.32Å; I450-D452 PolarHBondContact O-N 3.27Å
453	I	88.9	Confident	87.4	Confident	59 Å²	59	64.4 Å²	64.4	30%	0.303	36%	0.361	S	S	.	.	H	α-helix	trans	-69.2	-41.9	-177.7	-68.1	167.1	0	0	0	111	L415 M449 I450	L415-I453 HydrophobicContact CB-CD1 3.83Å; M449-I453 WeakPolarHBondContact O-CD1 3.3Å; M449-I453 VanDerWaalsContact O-CG1 3.23Å; M449-I453 WeakPolarHBondContact O-CG1 3.33Å; M449-I453 PolarHBondContact O-N 2.83Å; M449-I453 VanDerWaalsContact O-N 3.12Å; I450-I453 PolarHBondContact O-N 2.65Å
454	Y	87.7	Confident	87.3	Confident	29 Å²	29	65.3 Å²	65.3	11%	0.114	37%	0.365	C	S	.	.	H	α-helix	trans	-98.4	9.3	-171.3	-71.6	-81.3	0	0	0	114	L415 R418 L423 I450 S456 V457 I458	L415-Y454 PolarHBondContact O-OH 3.45Å; R418-Y454 WeakPolarHBondContact CA-OH 3.01Å; R418-Y454 VanDerWaalsContact CB-OH 3.3Å; R418-Y454 WeakPolarHBondContact CB-OH 3.21Å; R418-Y454 PolarHBondContact N-OH 3.11Å; R418-Y454 PolarHBondContact O-OH 2.76Å; L423-Y454 HydrophobicContact CD1-CD2 4.27Å; L423-Y454 HydrophobicContact CD1-CE2 4.2Å; L423-Y454 HydrophobicContact CD2-CD1 4.01Å; L423-Y454 HydrophobicContact CD2-CD2 4.3Å; L423-Y454 HydrophobicContact CD2-CE1 4.16Å; L423-Y454 HydrophobicContact CD2-CE2 4.45Å; L423-Y454 HydrophobicContact CD2-CG 4.07Å; I450-Y454 HydrophobicContact CG2-CD2 4.21Å; I450-Y454 WeakPolarHBondContact O-CB 3.28Å; I450-Y454 WeakPolarHBondContact O-CD2 3.42Å; I450-Y454 PolarHBondContact O-N 2.76Å; Y454-S456 PolarHBondContact O-N 2.84Å; Y454-S456 VanDerWaalsContact O-N 3.1Å; Y454-V457 HydrophobicContact CD1-CB 4.31Å; Y454-V457 HydrophobicContact CD1-CG2 4.17Å; Y454-V457 PolarHBondContact O-N 2.49Å; Y454-I458 PolarHBondContact O-N 3.04Å
455	K	86.5	Confident	87.1	Confident	160 Å²	160	63.9 Å²	63.9	70%	0.696	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-38.3	-179.4	-172.5	173.9	-179.9	175.5	0	114	L451 V457	L451-K455 WeakPolarHBondContact O-CA 3.44Å; L451-K455 WeakPolarHBondContact O-CB 3.3Å; L451-K455 PolarHBondContact O-N 2.82Å; K455-V457 VanDerWaalsContact C-N 3.29Å; K455-V457 PolarHBondContact O-N 3.37Å
456	S	85.7	Confident	87.1	Confident	102 Å²	102	67.7 Å²	67.7	71%	0.713	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-11.2	-179.9	60.8	0	0	0	0	114.3	Y454	Y454-S456 PolarHBondContact O-N 2.84Å; Y454-S456 VanDerWaalsContact O-N 3.1Å
457	V	80.4	Confident	87.1	Confident	55 Å²	55	69.3 Å²	69.3	33%	0.333	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-11.9	-174	-171	0	0	0	0	111.4	Y454 K455 G459 Q460	Y454-V457 HydrophobicContact CD1-CB 4.31Å; Y454-V457 HydrophobicContact CD1-CG2 4.17Å; Y454-V457 PolarHBondContact O-N 2.49Å; K455-V457 VanDerWaalsContact C-N 3.29Å; K455-V457 PolarHBondContact O-N 3.37Å; V457-G459 PolarHBondContact O-N 3.35Å; V457-Q460 WeakPolarHBondContact O-CB 3.22Å; V457-Q460 PolarHBondContact O-N 2.99Å
458	I	80.2	Confident	87	Confident	84 Å²	84	70.5 Å²	70.5	43%	0.431	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	131.7	176	-59.9	171.9	0	0	0	109.3	Y454 L468	Y454-I458 PolarHBondContact O-N 3.04Å; I458-L468 HydrophobicContact CG1-CD1 4.29Å; I458-L468 HydrophobicContact CG2-CD1 4.48Å
459	G	78.4	Confident	87	Confident	58 Å²	58	70.2 Å²	70.2	60%	0.598	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.9	-5.2	-176.8	0	0	0	0	0	115.8	V457 D465	V457-G459 PolarHBondContact O-N 3.35Å; G459-D465 VanDerWaalsContact CA-OD2 3.31Å; G459-D465 WeakPolarHBondContact CA-OD2 3.22Å; G459-D465 PolarHBondContact N-OD1 3.32Å; G459-D465 VanDerWaalsContact N-OD1 3.15Å
460	Q	85.1	Confident	87.1	Confident	155 Å²	155	76.3 Å²	76.3	72%	0.724	41%	0.408	S	S	*	.	S	Bend	trans	-86.8	-31.6	176.4	-64.5	-176.6	3.1	0	0	113.2	V457	V457-Q460 WeakPolarHBondContact O-CB 3.22Å; V457-Q460 PolarHBondContact O-N 2.99Å
461	S	87.2	Confident	87.1	Confident	16 Å²	16	76.6 Å²	76.6	11%	0.112	41%	0.409	C	S	.	.			trans	-121.3	123	179.6	166	0	0	0	0	111.3	E420 L463 I464 D465	E420-S461 VanDerWaalsContact OE1-CB 3.31Å; E420-S461 WeakPolarHBondContact OE1-CB 3.5Å; E420-S461 PolarHBondContact OE1-OG 3.32Å; S461-L463 PolarHBondContact O-N 3.14Å; S461-L463 PolarHBondContact OG-N 2.85Å; S461-I464 PolarHBondContact O-N 2.75Å; S461-I464 PolarHBondContact OG-N 2.87Å; S461-D465 PolarHBondContact O-N 2.93Å; S461-D465 VanDerWaalsContact O-N 3.15Å
462	A	86.9	Confident	87.3	Confident	68 Å²	68	77.6 Å²	77.6	56%	0.562	41%	0.412	S	S	*	.	H	α-helix	trans	-63.3	-28.1	175.6	0	0	0	0	0	113.2	Q466	A462-Q466 WeakPolarHBondContact O-CB 3.3Å; A462-Q466 VanDerWaalsContact O-CG 3.27Å; A462-Q466 WeakPolarHBondContact O-CG 3.49Å; A462-Q466 PolarHBondContact O-N 2.88Å; A462-Q466 VanDerWaalsContact O-N 3.09Å
463	L	85.5	Confident	87.4	Confident	108 Å²	108	76.6 Å²	76.6	57%	0.565	41%	0.406	S	S	*	.	H	α-helix	trans	-72.4	-42.4	-179.1	-67.2	179	0	0	0	111.7	S461 Q467	S461-L463 PolarHBondContact O-N 3.14Å; S461-L463 PolarHBondContact OG-N 2.85Å; L463-Q467 WeakPolarHBondContact O-CG 3.29Å; L463-Q467 PolarHBondContact O-N 2.9Å
464	I	87.6	Confident	87.5	Confident	19 Å²	19	75.3 Å²	75.3	10%	0.097	40%	0.4	C	S	.	.	H	α-helix	trans	-67.5	-43.5	176.9	-68.8	166.9	0	0	0	109.7	E420 L423 L427 S461 Q466 Q467 L468	E420-I464 HydrophobicContact CG-CD1 3.9Å; E420-I464 HydrophobicContact CG-CG1 4.39Å; L423-I464 HydrophobicContact CD2-CD1 3.72Å; L423-I464 HydrophobicContact CD2-CG1 4.44Å; L423-I464 HydrophobicContact CG-CD1 4.39Å; L427-I464 HydrophobicContact CD1-CG2 3.93Å; S461-I464 PolarHBondContact O-N 2.75Å; S461-I464 PolarHBondContact OG-N 2.87Å; I464-Q466 VanDerWaalsContact C-N 3.33Å; I464-Q466 PolarHBondContact O-N 3.15Å; I464-Q467 CarbonylContact O-C 3.6Å; I464-Q467 WeakPolarHBondContact O-CA 3Å; I464-Q467 WeakPolarHBondContact O-CB 3.36Å; I464-Q467 PolarHBondContact O-N 3.2Å; I464-L468 HydrophobicContact CG2-CD1 3.92Å; I464-L468 HydrophobicContact CG2-CG 4.21Å; I464-L468 WeakPolarHBondContact O-CG 3.23Å; I464-L468 PolarHBondContact O-N 3.29Å
465	D	87.4	Confident	87.7	Confident	43 Å²	43	76.7 Å²	76.7	23%	0.23	41%	0.409	C	S	.	.	H	α-helix	trans	-61.5	-41.4	179.8	-64.9	-20.5	0	0	0	111.6	G459 S461 Q467 L468 L469	G459-D465 VanDerWaalsContact CA-OD2 3.31Å; G459-D465 WeakPolarHBondContact CA-OD2 3.22Å; G459-D465 PolarHBondContact N-OD1 3.32Å; G459-D465 VanDerWaalsContact N-OD1 3.15Å; S461-D465 PolarHBondContact O-N 2.93Å; S461-D465 VanDerWaalsContact O-N 3.15Å; D465-Q467 VanDerWaalsContact C-N 3.31Å; D465-Q467 PolarHBondContact O-N 3.21Å; D465-L468 PolarHBondContact O-N 3.42Å; D465-L469 WeakPolarHBondContact O-CG 3.45Å; D465-L469 PolarHBondContact O-N 3.13Å
466	Q	89.7	Confident	88.1	Confident	129 Å²	129	73.4 Å²	73.4	60%	0.603	40%	0.396	S	S	*	.	H	α-helix	trans	-61.3	-38.1	172.8	-77.1	179.2	7.2	0	0	112.8	A462 I464 R470	A462-Q466 WeakPolarHBondContact O-CB 3.3Å; A462-Q466 VanDerWaalsContact O-CG 3.27Å; A462-Q466 WeakPolarHBondContact O-CG 3.49Å; A462-Q466 PolarHBondContact O-N 2.88Å; A462-Q466 VanDerWaalsContact O-N 3.09Å; I464-Q466 VanDerWaalsContact C-N 3.33Å; I464-Q466 PolarHBondContact O-N 3.15Å; Q466-R470 WeakPolarHBondContact O-CB 3.45Å; Q466-R470 PolarHBondContact O-N 3.46Å
467	Q	88.9	Confident	88.4	Confident	39 Å²	39	71.6 Å²	71.6	18%	0.182	38%	0.384	C	S	.	.	H	α-helix	trans	-70	-38.5	176.9	-73.1	-176.2	-14.1	0	0	112	S424 L427 I431 L463 I464 D465 R470 L471	S424-Q467 PolarHBondContact O-OE1 2.9Å; L427-Q467 HydrophobicContact CB-CB 4.42Å; L427-Q467 VanDerWaalsContact CB-OE1 3.31Å; L427-Q467 HydrophobicContact CD1-CB 4.3Å; I431-Q467 HydrophobicContact CD1-CB 3.93Å; I431-Q467 HydrophobicContact CD1-CG 4.4Å; I431-Q467 VanDerWaalsContact CD1-O 3.25Å; I431-Q467 WeakPolarHBondContact CD1-O 3.31Å; L463-Q467 WeakPolarHBondContact O-CG 3.29Å; L463-Q467 PolarHBondContact O-N 2.9Å; I464-Q467 CarbonylContact O-C 3.6Å; I464-Q467 WeakPolarHBondContact O-CA 3Å; I464-Q467 WeakPolarHBondContact O-CB 3.36Å; I464-Q467 PolarHBondContact O-N 3.2Å; D465-Q467 VanDerWaalsContact C-N 3.31Å; D465-Q467 PolarHBondContact O-N 3.21Å; Q467-R470 WeakPolarHBondContact O-CB 3.2Å; Q467-R470 PolarHBondContact O-N 2.95Å; Q467-L471 PolarHBondContact O-N 2.99Å
468	L	90.1	Very high	88.8	Confident	32 Å²	32	71 Å²	71	17%	0.168	38%	0.377	C	S	.	.	H	α-helix	trans	-66.8	-43.1	175.8	-70.5	175.7	0	0	0	111.8	L427 L451 I458 I464 D465 R470 L471 Q472	L427-L468 HydrophobicContact CD1-CD2 4.46Å; L427-L468 HydrophobicContact CD2-CD2 4.08Å; L451-L468 HydrophobicContact CD2-CD2 3.83Å; I458-L468 HydrophobicContact CG1-CD1 4.29Å; I458-L468 HydrophobicContact CG2-CD1 4.48Å; I464-L468 HydrophobicContact CG2-CD1 3.92Å; I464-L468 HydrophobicContact CG2-CG 4.21Å; I464-L468 WeakPolarHBondContact O-CG 3.23Å; I464-L468 PolarHBondContact O-N 3.29Å; D465-L468 PolarHBondContact O-N 3.42Å; L468-R470 VanDerWaalsContact C-N 3.27Å; L468-R470 PolarHBondContact O-N 3.24Å; L468-L471 WeakPolarHBondContact O-CB 3.35Å; L468-L471 PolarHBondContact O-N 3.4Å; L468-L471 VanDerWaalsContact O-N 3.14Å; L468-Q472 PolarHBondContact O-N 3.48Å
469	L	91.3	Very high	89.4	Confident	99 Å²	99	71 Å²	71	52%	0.518	38%	0.377	S	S	.	.	H	α-helix	trans	-59.4	-40.5	172.3	-74.6	169.9	0	0	0	111.5	D465 Q472 N473	D465-L469 WeakPolarHBondContact O-CG 3.45Å; D465-L469 PolarHBondContact O-N 3.13Å; L469-Q472 PolarHBondContact O-N 2.51Å; L469-N473 VanDerWaalsContact O-CG 3.26Å; L469-N473 PolarHBondContact O-N 2.83Å; L469-N473 PolarHBondContact O-ND2 3.47Å
470	R	91.8	Very high	90.3	Very high	150 Å²	150	72.5 Å²	72.5	57%	0.566	37%	0.371	S	S	*	.	H	α-helix	trans	-64.8	-40.6	175	-175.2	175.4	-178.4	165.6	3.7	112.2	I431 Q466 Q467 L468 Q472 N473 I474	I431-R470 HydrophobicContact CG2-CG 4.34Å; Q466-R470 WeakPolarHBondContact O-CB 3.45Å; Q466-R470 PolarHBondContact O-N 3.46Å; Q467-R470 WeakPolarHBondContact O-CB 3.2Å; Q467-R470 PolarHBondContact O-N 2.95Å; L468-R470 VanDerWaalsContact C-N 3.27Å; L468-R470 PolarHBondContact O-N 3.24Å; R470-Q472 VanDerWaalsContact C-N 3.34Å; R470-N473 PolarHBondContact O-N 3.22Å; R470-I474 HydrophobicContact CG-CD1 4.07Å; R470-I474 WeakPolarHBondContact O-CD1 3.36Å; R470-I474 WeakPolarHBondContact O-CG1 3.29Å; R470-I474 PolarHBondContact O-N 3.34Å; R470-I474 VanDerWaalsContact O-N 3.15Å
471	L	90.7	Very high	90.6	Very high	10 Å²	10	69.1 Å²	69.1	5%	0.052	36%	0.358	C	S	.	.	H	α-helix	trans	-61.4	-44.3	175.3	-179.4	65	0	0	0	110.8	V430 I431 I434 Q467 L468 I474 L475	V430-L471 HydrophobicContact CG1-CD1 3.99Å; V430-L471 HydrophobicContact CG1-CD2 4.46Å; I431-L471 HydrophobicContact CD1-CB 4.47Å; I431-L471 HydrophobicContact CG1-CB 4.01Å; I431-L471 HydrophobicContact CG1-CD1 4.04Å; I434-L471 HydrophobicContact CD1-CD1 3.85Å; Q467-L471 PolarHBondContact O-N 2.99Å; L468-L471 WeakPolarHBondContact O-CB 3.35Å; L468-L471 PolarHBondContact O-N 3.4Å; L468-L471 VanDerWaalsContact O-N 3.14Å; L471-I474 PolarHBondContact O-N 3.05Å; L471-L475 HydrophobicContact CD1-CD1 4.46Å; L471-L475 HydrophobicContact CG-CD1 4.14Å; L471-L475 WeakPolarHBondContact O-CG 3.4Å; L471-L475 PolarHBondContact O-N 2.81Å
472	Q	91.6	Very high	90.8	Very high	96 Å²	96	73.7 Å²	73.7	45%	0.449	38%	0.378	S	S	.	.	H	α-helix	trans	-58.7	-51.5	176.2	-178.9	-177	-6.5	0	0	111.6	L468 L469 R470 I474 L475 E476	L468-Q472 PolarHBondContact O-N 3.48Å; L469-Q472 PolarHBondContact O-N 2.51Å; R470-Q472 VanDerWaalsContact C-N 3.34Å; Q472-I474 VanDerWaalsContact C-N 3.25Å; Q472-I474 PolarHBondContact O-N 2.71Å; Q472-L475 WeakPolarHBondContact O-CB 3.41Å; Q472-L475 PolarHBondContact O-N 2.88Å; Q472-L475 VanDerWaalsContact O-N 3.1Å; Q472-E476 HydrophobicContact CG-CG 4.48Å; Q472-E476 WeakPolarHBondContact CG-OE1 3.37Å; Q472-E476 PolarHBondContact NE2-OE1 3.43Å; Q472-E476 PolarHBondContact O-N 2.81Å
473	N	93.8	Very high	91.2	Very high	97 Å²	97	75.6 Å²	75.6	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-59.1	-37.4	-179.6	-67.4	-15.3	0	0	0	112.5	L469 R470 S477	L469-N473 VanDerWaalsContact O-CG 3.26Å; L469-N473 PolarHBondContact O-N 2.83Å; L469-N473 PolarHBondContact O-ND2 3.47Å; R470-N473 PolarHBondContact O-N 3.22Å; N473-S477 PolarHBondContact O-N 3.37Å; N473-S477 PolarHBondContact O-OG 3.31Å
474	I	91.6	Very high	91.8	Very high	33 Å²	33	76.5 Å²	76.5	17%	0.169	38%	0.376	C	S	.	.	H	α-helix	trans	-68.8	-43.8	176.9	-68.9	164.3	0	0	0	110.6	I431 I434 V435 R470 L471 Q472 E476 S477 E478	I431-I474 HydrophobicContact CG2-CD1 3.63Å; I434-I474 HydrophobicContact CG2-CG2 3.7Å; V435-I474 HydrophobicContact CG2-CG2 3.98Å; R470-I474 HydrophobicContact CG-CD1 4.07Å; R470-I474 WeakPolarHBondContact O-CD1 3.36Å; R470-I474 WeakPolarHBondContact O-CG1 3.29Å; R470-I474 PolarHBondContact O-N 3.34Å; R470-I474 VanDerWaalsContact O-N 3.15Å; L471-I474 PolarHBondContact O-N 3.05Å; Q472-I474 VanDerWaalsContact C-N 3.25Å; Q472-I474 PolarHBondContact O-N 2.71Å; I474-E476 PolarHBondContact O-N 3.01Å; I474-S477 WeakPolarHBondContact CA-OG 3.48Å; I474-S477 PolarHBondContact O-N 3.2Å; I474-S477 PolarHBondContact O-OG 3.32Å; I474-E478 PolarHBondContact O-N 3.46Å
475	L	91.1	Very high	92.1	Very high	58 Å²	58	80.7 Å²	80.7	30%	0.304	40%	0.398	S	S	.	.	H	α-helix	trans	-61.2	-43.6	176.2	-78.4	167.9	0	0	0	111.9	I434 L471 Q472 S477 E478 I479	I434-L475 HydrophobicContact CD1-CD2 3.69Å; I434-L475 HydrophobicContact CD1-CG 4.18Å; I434-L475 HydrophobicContact CG1-CD2 4.41Å; L471-L475 HydrophobicContact CD1-CD1 4.46Å; L471-L475 HydrophobicContact CG-CD1 4.14Å; L471-L475 WeakPolarHBondContact O-CG 3.4Å; L471-L475 PolarHBondContact O-N 2.81Å; Q472-L475 WeakPolarHBondContact O-CB 3.41Å; Q472-L475 PolarHBondContact O-N 2.88Å; Q472-L475 VanDerWaalsContact O-N 3.1Å; L475-S477 VanDerWaalsContact C-N 3.32Å; L475-S477 PolarHBondContact O-N 3.17Å; L475-E478 PolarHBondContact O-N 3.14Å; L475-I479 WeakPolarHBondContact O-CD1 3.35Å; L475-I479 VanDerWaalsContact O-CG1 3.25Å; L475-I479 WeakPolarHBondContact O-CG1 3.25Å; L475-I479 PolarHBondContact O-N 2.88Å
476	E	94.5	Very high	92.5	Very high	91 Å²	91	84.1 Å²	84.1	43%	0.425	42%	0.416	S	S	.	.	H	α-helix	trans	-60.1	-42.5	174.9	-74.1	175.9	-168.8	0	0	111.5	Q472 I474 E478 I479 N480	Q472-E476 HydrophobicContact CG-CG 4.48Å; Q472-E476 WeakPolarHBondContact CG-OE1 3.37Å; Q472-E476 PolarHBondContact NE2-OE1 3.43Å; Q472-E476 PolarHBondContact O-N 2.81Å; I474-E476 PolarHBondContact O-N 3.01Å; E476-E478 PolarHBondContact O-N 3.2Å; E476-I479 PolarHBondContact O-N 3.5Å; E476-N480 PolarHBondContact O-N 3.33Å; E476-N480 VanDerWaalsContact O-N 3.15Å; E476-N480 PolarHBondContact O-ND2 2.59Å
477	S	92.6	Very high	92.9	Very high	64 Å²	64	84.5 Å²	84.5	45%	0.448	42%	0.418	S	S	.	.	H	α-helix	trans	-65.7	-36.6	176.3	68.6	0	0	0	0	113.3	N473 I474 L475 N480 L481	N473-S477 PolarHBondContact O-N 3.37Å; N473-S477 PolarHBondContact O-OG 3.31Å; I474-S477 WeakPolarHBondContact CA-OG 3.48Å; I474-S477 PolarHBondContact O-N 3.2Å; I474-S477 PolarHBondContact O-OG 3.32Å; L475-S477 VanDerWaalsContact C-N 3.32Å; L475-S477 PolarHBondContact O-N 3.17Å; S477-N480 PolarHBondContact O-N 3.21Å; S477-L481 PolarHBondContact O-N 3.31Å; S477-L481 VanDerWaalsContact O-N 3.07Å
478	E	89.6	Confident	93.3	Very high	42 Å²	42	86.8 Å²	86.8	20%	0.196	43%	0.434	C	S	.	.	H	α-helix	trans	-70.1	-41.2	178.6	-168.1	66.6	-164.2	0	0	111	I474 L475 E476 N480 L481 E482	I474-E478 PolarHBondContact O-N 3.46Å; L475-E478 PolarHBondContact O-N 3.14Å; E476-E478 PolarHBondContact O-N 3.2Å; E478-N480 VanDerWaalsContact C-N 3.29Å; E478-N480 PolarHBondContact O-N 2.65Å; E478-L481 WeakPolarHBondContact O-CB 3.3Å; E478-L481 PolarHBondContact O-N 3.42Å; E478-L481 VanDerWaalsContact O-N 3.13Å; E478-E482 WeakPolarHBondContact O-CG 3.25Å; E478-E482 PolarHBondContact O-N 2.77Å
479	I	92.8	Very high	93.6	Very high	85 Å²	85	89.2 Å²	89.2	44%	0.436	45%	0.447	S	S	.	.	H	α-helix	trans	-59.7	-42.2	175.7	-68.8	163.5	0	0	0	110.6	L475 E476 E482 Q483	L475-I479 WeakPolarHBondContact O-CD1 3.35Å; L475-I479 VanDerWaalsContact O-CG1 3.25Å; L475-I479 WeakPolarHBondContact O-CG1 3.25Å; L475-I479 PolarHBondContact O-N 2.88Å; E476-I479 PolarHBondContact O-N 3.5Å; I479-E482 PolarHBondContact O-N 3.11Å; I479-Q483 WeakPolarHBondContact O-CG 3.41Å; I479-Q483 PolarHBondContact O-N 3.18Å; I479-Q483 VanDerWaalsContact O-N 3.08Å
480	N	95.8	Very high	93.8	Very high	88 Å²	88	86.2 Å²	86.2	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-41.3	175.9	-68.1	-19.5	0	0	0	111.6	E476 S477 E478 Q483 E484	E476-N480 PolarHBondContact O-N 3.33Å; E476-N480 VanDerWaalsContact O-N 3.15Å; E476-N480 PolarHBondContact O-ND2 2.59Å; S477-N480 PolarHBondContact O-N 3.21Å; E478-N480 VanDerWaalsContact C-N 3.29Å; E478-N480 PolarHBondContact O-N 2.65Å; N480-Q483 WeakPolarHBondContact O-CB 3.15Å; N480-Q483 PolarHBondContact O-N 2.64Å; N480-E484 PolarHBondContact O-N 3.27Å
481	L	92.8	Very high	94.1	Very high	85 Å²	85	85.3 Å²	85.3	45%	0.445	44%	0.443	S	S	.	.	H	α-helix	trans	-64.2	-41.6	177.1	-166	159.5	0	0	0	111.5	S477 E478 Q483 E484 L485	S477-L481 PolarHBondContact O-N 3.31Å; S477-L481 VanDerWaalsContact O-N 3.07Å; E478-L481 WeakPolarHBondContact O-CB 3.3Å; E478-L481 PolarHBondContact O-N 3.42Å; E478-L481 VanDerWaalsContact O-N 3.13Å; L481-Q483 VanDerWaalsContact C-N 3.29Å; L481-Q483 PolarHBondContact O-N 3.27Å; L481-E484 PolarHBondContact O-N 2.89Å; L481-L485 WeakPolarHBondContact O-CB 3.49Å; L481-L485 PolarHBondContact O-N 3.49Å
482	E	91.3	Very high	94.3	Very high	112 Å²	112	88.5 Å²	88.5	52%	0.523	46%	0.46	S	S	.	.	H	α-helix	trans	-60.8	-38.6	174.7	-73.7	-174.4	163.5	0	0	112	E478 I479 L485 L486	E478-E482 WeakPolarHBondContact O-CG 3.25Å; E478-E482 PolarHBondContact O-N 2.77Å; I479-E482 PolarHBondContact O-N 3.11Å; E482-L485 PolarHBondContact O-N 3.46Å; E482-L486 WeakPolarHBondContact O-CG 3.39Å; E482-L486 PolarHBondContact O-N 2.94Å
483	Q	95.8	Very high	94.5	Very high	107 Å²	107	88.2 Å²	88.2	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-49.6	174.2	-71.4	174.2	5.7	0	0	111.7	I479 N480 L481 L485 L486 E487	I479-Q483 WeakPolarHBondContact O-CG 3.41Å; I479-Q483 PolarHBondContact O-N 3.18Å; I479-Q483 VanDerWaalsContact O-N 3.08Å; N480-Q483 WeakPolarHBondContact O-CB 3.15Å; N480-Q483 PolarHBondContact O-N 2.64Å; L481-Q483 VanDerWaalsContact C-N 3.29Å; L481-Q483 PolarHBondContact O-N 3.27Å; Q483-L485 VanDerWaalsContact C-N 3.26Å; Q483-L485 PolarHBondContact O-N 3.1Å; Q483-L486 WeakPolarHBondContact O-CB 3.43Å; Q483-L486 PolarHBondContact O-N 2.96Å; Q483-E487 PolarHBondContact O-N 3.45Å
484	E	96.9	Very high	94.5	Very high	128 Å²	128	87.8 Å²	87.8	60%	0.598	46%	0.463	S	S	*	.	H	α-helix	trans	-59.1	-38.7	176.2	-70.3	-179	-179.1	0	0	111.8	N480 L481 E487 V488	N480-E484 PolarHBondContact O-N 3.27Å; L481-E484 PolarHBondContact O-N 2.89Å; E484-E487 WeakPolarHBondContact O-CB 3Å; E484-E487 PolarHBondContact O-N 3.21Å; E484-V488 WeakPolarHBondContact O-CG2 3.26Å; E484-V488 PolarHBondContact O-N 2.98Å
485	L	94.8	Very high	94.6	Very high	106 Å²	106	92.3 Å²	92.3	56%	0.555	49%	0.485	S	S	*	.	H	α-helix	trans	-68.3	-36.4	179	-168.7	138	0	0	0	112.1	L481 E482 Q483 V488 L489	L481-L485 WeakPolarHBondContact O-CB 3.49Å; L481-L485 PolarHBondContact O-N 3.49Å; E482-L485 PolarHBondContact O-N 3.46Å; Q483-L485 VanDerWaalsContact C-N 3.26Å; Q483-L485 PolarHBondContact O-N 3.1Å; L485-V488 PolarHBondContact O-N 2.84Å; L485-L489 WeakPolarHBondContact O-CB 3.38Å; L485-L489 PolarHBondContact O-N 2.74Å
486	L	95.9	Very high	94.7	Very high	116 Å²	116	95.2 Å²	95.2	61%	0.607	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-38.7	172.6	-76	168.9	0	0	0	111.8	E482 Q483 L489 G490	E482-L486 WeakPolarHBondContact O-CG 3.39Å; E482-L486 PolarHBondContact O-N 2.94Å; Q483-L486 WeakPolarHBondContact O-CB 3.43Å; Q483-L486 PolarHBondContact O-N 2.96Å; L486-L489 PolarHBondContact O-N 2.9Å; L486-G490 PolarHBondContact O-N 2.97Å
487	E	96.9	Very high	94.5	Very high	137 Å²	137	93.7 Å²	93.7	64%	0.64	50%	0.498	S	S	*	.	H	α-helix	trans	-62.2	-48.1	174	-68.5	-179.1	178	0	0	111.4	Q483 E484 L489 G490 M491	Q483-E487 PolarHBondContact O-N 3.45Å; E484-E487 WeakPolarHBondContact O-CB 3Å; E484-E487 PolarHBondContact O-N 3.21Å; E487-L489 VanDerWaalsContact C-N 3.33Å; E487-L489 PolarHBondContact O-N 3.44Å; E487-G490 PolarHBondContact O-N 2.99Å; E487-M491 WeakPolarHBondContact O-CG 3.22Å; E487-M491 PolarHBondContact O-N 3.43Å
488	V	97.1	Very high	94.3	Very high	87 Å²	87	95 Å²	95	53%	0.527	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-40.2	177.3	173.3	0	0	0	0	111.6	E484 L485 G490 M491 L492	E484-V488 WeakPolarHBondContact O-CG2 3.26Å; E484-V488 PolarHBondContact O-N 2.98Å; L485-V488 PolarHBondContact O-N 2.84Å; V488-G490 VanDerWaalsContact C-N 3.34Å; V488-M491 PolarHBondContact O-N 2.89Å; V488-L492 VanDerWaalsContact O-CB 3.32Å; V488-L492 WeakPolarHBondContact O-CB 3.49Å; V488-L492 PolarHBondContact O-N 3.37Å
489	L	96.7	Very high	94.1	Very high	82 Å²	82	96.8 Å²	96.8	43%	0.429	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-44.8	175.4	-177.8	63.7	0	0	0	110.8	L485 L486 E487 M491 L492 D493	L485-L489 WeakPolarHBondContact O-CB 3.38Å; L485-L489 PolarHBondContact O-N 2.74Å; L486-L489 PolarHBondContact O-N 2.9Å; E487-L489 VanDerWaalsContact C-N 3.33Å; E487-L489 PolarHBondContact O-N 3.44Å; L489-M491 PolarHBondContact O-N 2.71Å; L489-L492 PolarHBondContact O-N 3.41Å; L489-D493 PolarHBondContact O-N 3.29Å
490	G	96.8	Very high	93.4	Very high	36 Å²	36	98.1 Å²	98.1	37%	0.371	53%	0.533	S	S	.	.	H	α-helix	trans	-58.1	-45.1	174.1	0	0	0	0	0	112.4	L486 E487 V488 L492 D493 T494	L486-G490 PolarHBondContact O-N 2.97Å; E487-G490 PolarHBondContact O-N 2.99Å; V488-G490 VanDerWaalsContact C-N 3.34Å; G490-L492 VanDerWaalsContact C-N 3.35Å; G490-L492 PolarHBondContact O-N 2.52Å; G490-D493 PolarHBondContact O-N 2.6Å; G490-T494 WeakPolarHBondContact O-CG2 3.44Å; G490-T494 PolarHBondContact O-N 3.49Å; G490-T494 VanDerWaalsContact O-N 3.12Å
491	M	96.2	Very high	91.6	Very high	131 Å²	131	99.1 Å²	99.1	65%	0.645	54%	0.542	S	S	*	.	H	α-helix	trans	-60.3	-44	175.2	-67.9	176.5	66.8	0	0	112	E487 V488 L489 T494 M495	E487-M491 WeakPolarHBondContact O-CG 3.22Å; E487-M491 PolarHBondContact O-N 3.43Å; V488-M491 PolarHBondContact O-N 2.89Å; L489-M491 PolarHBondContact O-N 2.71Å; M491-T494 PolarHBondContact O-N 3.47Å; M491-T494 PolarHBondContact O-OG1 3.19Å; M491-M495 WeakPolarHBondContact O-CG 3.22Å; M491-M495 PolarHBondContact O-N 3.07Å; M491-M495 VanDerWaalsContact O-N 3.09Å
492	L	96.1	Very high	89.6	Confident	77 Å²	77	106 Å²	106	40%	0.403	56%	0.562	S	S	.	*	H	α-helix	trans	-69.2	-36.8	-177.9	-173.6	138.5	0	0	0	112.2	V488 L489 G490 M495 F496	V488-L492 VanDerWaalsContact O-CB 3.32Å; V488-L492 WeakPolarHBondContact O-CB 3.49Å; V488-L492 PolarHBondContact O-N 3.37Å; L489-L492 PolarHBondContact O-N 3.41Å; G490-L492 VanDerWaalsContact C-N 3.35Å; G490-L492 PolarHBondContact O-N 2.52Å; L492-M495 WeakPolarHBondContact O-CB 3.34Å; L492-M495 PolarHBondContact O-N 3.27Å; L492-F496 HydrophobicContact CD2-CD2 3.51Å; L492-F496 HydrophobicContact CD2-CE2 3.1Å; L492-F496 HydrophobicContact CD2-CZ 3.9Å; L492-F496 HydrophobicContact CG-CD2 4.24Å; L492-F496 HydrophobicContact CG-CE2 3.9Å; L492-F496 HydrophobicContact CG-CZ 4.31Å; L492-F496 PolarHBondContact O-N 3.25Å
493	D	95	Very high	87.6	Confident	91 Å²	91	110 Å²	110	49%	0.487	58%	0.577	S	S	.	*	H	α-helix	trans	-64.1	-39.4	173	-78.9	-14.9	0	0	0	111.8	L489 G490 M495 F496 A497	L489-D493 PolarHBondContact O-N 3.29Å; G490-D493 PolarHBondContact O-N 2.6Å; D493-M495 VanDerWaalsContact C-N 3.34Å; D493-M495 PolarHBondContact O-N 3.25Å; D493-F496 PolarHBondContact O-N 2.94Å; D493-A497 VanDerWaalsContact O-CB 3.3Å; D493-A497 WeakPolarHBondContact O-CB 3.37Å; D493-A497 PolarHBondContact O-N 3.28Å
494	T	94.4	Very high	85.1	Confident	87 Å²	87	113.5 Å²	113.5	53%	0.534	59%	0.594	S	S	.	*	H	α-helix	trans	-64.6	-38.5	173.8	65.6	0	0	0	0	112.2	G490 M491 A497 T498	G490-T494 WeakPolarHBondContact O-CG2 3.44Å; G490-T494 PolarHBondContact O-N 3.49Å; G490-T494 VanDerWaalsContact O-N 3.12Å; M491-T494 PolarHBondContact O-N 3.47Å; M491-T494 PolarHBondContact O-OG1 3.19Å; T494-A497 PolarHBondContact O-N 2.95Å; T494-T498 VanDerWaalsContact O-CG2 3.29Å; T494-T498 WeakPolarHBondContact O-CG2 3.33Å; T494-T498 PolarHBondContact O-N 3.49Å; T494-T498 PolarHBondContact O-OG1 3.07Å
495	M	94.1	Very high	82.7	Confident	128 Å²	128	113.5 Å²	113.5	63%	0.631	60%	0.602	S	S	*	*	H	α-helix	trans	-65.7	-40.3	174.5	-74.7	-67.7	-63.4	0	0	112.1	M491 L492 D493 T498 S499	M491-M495 WeakPolarHBondContact O-CG 3.22Å; M491-M495 PolarHBondContact O-N 3.07Å; M491-M495 VanDerWaalsContact O-N 3.09Å; L492-M495 WeakPolarHBondContact O-CB 3.34Å; L492-M495 PolarHBondContact O-N 3.27Å; D493-M495 VanDerWaalsContact C-N 3.34Å; D493-M495 PolarHBondContact O-N 3.25Å; M495-T498 WeakPolarHBondContact CA-OG1 3.43Å; M495-T498 PolarHBondContact O-OG1 3.16Å; M495-S499 WeakPolarHBondContact O-CB 3.44Å; M495-S499 PolarHBondContact O-N 2.99Å; M495-S499 PolarHBondContact O-OG 3.4Å
496	F	93.1	Very high	80.1	Confident	120 Å²	120	114 Å²	114	53%	0.526	61%	0.612	S	S	.	*	H	α-helix	trans	-69.5	-43.3	175.5	-73.7	-36.3	0	0	0	112.3	L492 D493 T498 S499 V500	L492-F496 HydrophobicContact CD2-CD2 3.51Å; L492-F496 HydrophobicContact CD2-CE2 3.1Å; L492-F496 HydrophobicContact CD2-CZ 3.9Å; L492-F496 HydrophobicContact CG-CD2 4.24Å; L492-F496 HydrophobicContact CG-CE2 3.9Å; L492-F496 HydrophobicContact CG-CZ 4.31Å; L492-F496 PolarHBondContact O-N 3.25Å; D493-F496 PolarHBondContact O-N 2.94Å; F496-T498 VanDerWaalsContact C-N 3.29Å; F496-T498 PolarHBondContact O-N 3.15Å; F496-S499 WeakPolarHBondContact CA-OG 3.39Å; F496-S499 PolarHBondContact O-N 2.95Å; F496-S499 VanDerWaalsContact O-N 3.12Å; F496-S499 PolarHBondContact O-OG 3.4Å; F496-V500 VanDerWaalsContact O-CG2 3.32Å; F496-V500 WeakPolarHBondContact O-CG2 3.49Å; F496-V500 PolarHBondContact O-N 3.17Å
497	A	90.5	Very high	77.2	Confident	59 Å²	59	118.8 Å²	118.8	49%	0.488	62%	0.624	S	S	.	*	H	α-helix	trans	-57.8	-42.5	176.2	0	0	0	0	0	111.8	D493 T494 V500 T501	D493-A497 VanDerWaalsContact O-CB 3.3Å; D493-A497 WeakPolarHBondContact O-CB 3.37Å; D493-A497 PolarHBondContact O-N 3.28Å; T494-A497 PolarHBondContact O-N 2.95Å; A497-V500 PolarHBondContact O-N 3.05Å; A497-T501 PolarHBondContact O-N 3.19Å; A497-T501 PolarHBondContact O-OG1 2.82Å
498	T	88.3	Confident	74.2	Confident	90 Å²	90	117.1 Å²	117.1	55%	0.552	63%	0.627	S	S	*	*	H	α-helix	trans	-69.6	-34.5	175.8	52.4	0	0	0	0	113.2	T494 M495 F496 V500 T501	T494-T498 VanDerWaalsContact O-CG2 3.29Å; T494-T498 WeakPolarHBondContact O-CG2 3.33Å; T494-T498 PolarHBondContact O-N 3.49Å; T494-T498 PolarHBondContact O-OG1 3.07Å; M495-T498 WeakPolarHBondContact CA-OG1 3.43Å; M495-T498 PolarHBondContact O-OG1 3.16Å; F496-T498 VanDerWaalsContact C-N 3.29Å; F496-T498 PolarHBondContact O-N 3.15Å; T498-V500 VanDerWaalsContact C-N 3.32Å; T498-V500 PolarHBondContact O-N 2.95Å; T498-T501 PolarHBondContact O-OG1 3.26Å
499	S	84.4	Confident	71.3	Confident	81 Å²	81	120.6 Å²	120.6	57%	0.566	64%	0.642	S	S	*	*	H	α-helix	trans	-69.4	-29.1	176.1	75.3	0	0	0	0	113.4	M495 F496	M495-S499 WeakPolarHBondContact O-CB 3.44Å; M495-S499 PolarHBondContact O-N 2.99Å; M495-S499 PolarHBondContact O-OG 3.4Å; F496-S499 WeakPolarHBondContact CA-OG 3.39Å; F496-S499 PolarHBondContact O-N 2.95Å; F496-S499 VanDerWaalsContact O-N 3.12Å; F496-S499 PolarHBondContact O-OG 3.4Å
500	V	77.9	Confident	68.5	Low	113 Å²	113	123.1 Å²	123.1	69%	0.685	66%	0.661	S	S	*	*	H	α-helix	trans	-81.9	-26.8	-179.5	174.5	0	0	0	0	111.6	F496 A497 T498 R502	F496-V500 VanDerWaalsContact O-CG2 3.32Å; F496-V500 WeakPolarHBondContact O-CG2 3.49Å; F496-V500 PolarHBondContact O-N 3.17Å; A497-V500 PolarHBondContact O-N 3.05Å; T498-V500 VanDerWaalsContact C-N 3.32Å; T498-V500 PolarHBondContact O-N 2.95Å; V500-R502 VanDerWaalsContact C-N 3.25Å; V500-R502 PolarHBondContact O-N 3.46Å
501	T	58.3	Low	65.4	Low	109 Å²	109	124.4 Å²	124.4	67%	0.669	68%	0.675	S	S	*	*			trans	-83.5	57.3	178.2	53.3	0	0	0	0	113.4	A497 T498	A497-T501 PolarHBondContact O-N 3.19Å; A497-T501 PolarHBondContact O-OG1 2.82Å; T498-T501 PolarHBondContact O-OG1 3.26Å
502	R	52.1	Low	62.4	Low	228 Å²	228	130.1 Å²	130.1	86%	0.86	69%	0.689	S	S	*	*			trans	-140.9	63.7	156.2	-83.3	-169.3	178.2	174.9	-1.2	110.5	V500	V500-R502 VanDerWaalsContact C-N 3.25Å; V500-R502 PolarHBondContact O-N 3.46Å
503	K	47.9	Very low	59.6	Low	196 Å²	196	131.3 Å²	131.3	85%	0.852	70%	0.704	S	S	*	*			trans	-103.7	98	146.6	-82.1	-177.3	176.5	178.1	0	105.7	V505	K503-V505 PolarHBondContact O-N 3.36Å; K503-V505 VanDerWaalsContact O-N 3.1Å
504	E	43.8	Very low	56.6	Low	182 Å²	182	134.7 Å²	134.7	85%	0.85	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-53.2	118.2	168.3	-66.9	-175.2	171.4	0	0	107.6	P506	E504-P506 WeakPolarHBondContact O-CD 3.12Å
505	V	46	Very low	53.8	Low	127 Å²	127	134 Å²	134	77%	0.77	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-70.2	117.5	164.2	-179.1	0	0	0	0	104.7	K503 Y507	K503-V505 PolarHBondContact O-N 3.36Å; K503-V505 VanDerWaalsContact O-N 3.1Å; V505-Y507 PolarHBondContact O-N 3.02Å
506	P	39.7	Very low	50.8	Low	116 Å²	116	136.6 Å²	136.6	75%	0.753	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.2	117.6	176.4	13.7	-12.5	0	0	0	108	E504 S508	E504-P506 WeakPolarHBondContact O-CD 3.12Å; P506-S508 PolarHBondContact O-N 2.8Å
507	Y	35.2	Very low	47.8	Very low	218 Å²	218	135.4 Å²	135.4	86%	0.855	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-58.4	116.9	168.8	-125.3	-97.7	0	0	0	107.4	V505 D509	V505-Y507 PolarHBondContact O-N 3.02Å; Y507-D509 PolarHBondContact O-N 3.41Å
508	S	34.4	Very low	45	Very low	102 Å²	102	142.3 Å²	142.3	71%	0.713	78%	0.782	S	S	*	*			trans	-76.3	102.2	172.3	56	0	0	0	0	108.8	P506 V510	P506-S508 PolarHBondContact O-N 2.8Å; S508-V510 PolarHBondContact O-N 2.79Å
509	D	37.2	Very low	42.2	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	79%	0.794	S	S	*	*			trans	-63	102.4	165.9	-91.2	-27	0	0	0	109.4	Y507	Y507-D509 PolarHBondContact O-N 3.41Å
510	V	36.5	Very low	39.6	Very low	135 Å²	135	147.4 Å²	147.4	82%	0.818	81%	0.811	S	S	*	*			trans	-119.1	97.4	162.7	-178.8	0	0	0	0	108.3	S508	S508-V510 PolarHBondContact O-N 2.79Å
511	G	32.5	Very low	37.3	Very low	64 Å²	64	146.6 Å²	146.6	66%	0.66	82%	0.816	S	S	*	*			trans	73.4	101.8	136.1	0	0	0	0	0	117.4
512	R	32.5	Very low	36.1	Very low	251 Å²	251	147.2 Å²	147.2	95%	0.947	83%	0.825	S	S	*	*				-156	104.8	124.9	-105.3	164.2	-164	-160.3	4.4	110.3
513	S	36.8	Very low	35.2	Very low	102 Å²	102	142.1 Å²	142.1	71%	0.713	82%	0.824	S	S	*	*			trans	-46.7	130.5	154.1	50.1	0	0	0	0	110.4
514	N	32.3	Very low	34.4	Very low	161 Å²	161	138.2 Å²	138.2	86%	0.861	82%	0.822	S	S	*	*				-165.2	137.1	127.4	-89.9	-17.1	0	0	0	109.5
515	G	35.2	Very low	33.8	Very low	72 Å²	72	140.9 Å²	140.9	74%	0.742	82%	0.824	S	S	*	*			trans	-65.7	156.3	-154.9	0	0	0	0	0	115.2
516	L	31.3	Very low	33.4	Very low	183 Å²	183	140.9 Å²	140.9	96%	0.958	83%	0.827	S	S	*	*			trans	-156.5	145.2	142.3	-99.6	158.8	0	0	0	108.7
517	A	31.1	Very low	33	Very low	96 Å²	96	144.4 Å²	144.4	79%	0.793	83%	0.833	S	S	*	*			trans	-66	161.8	-163.4	0	0	0	0	0	114.9
518	Q	31.8	Very low	33	Very low	204 Å²	204	142.6 Å²	142.6	95%	0.953	84%	0.837	S	S	*	*			trans	-46.4	140.4	170	-70.5	168.2	-26.8	0	0	113.1
519	G	28.8	Very low	32.8	Very low	77 Å²	77	147.7 Å²	147.7	79%	0.794	85%	0.847	S	S	*	*			trans	-173.3	105.4	166.9	0	0	0	0	0	110.1
520	E	30.7	Very low	32.5	Very low	200 Å²	200	151.1 Å²	151.1	94%	0.935	85%	0.848	S	S	*	*			trans	-54.5	142.8	178	-59.6	169.1	139.4	0	0	113
521	A	29.3	Very low	32.8	Very low	96 Å²	96	150.4 Å²	150.4	79%	0.793	85%	0.846	S	S	*	*			trans	-168.6	110.6	140.6	0	0	0	0	0	110.6
522	S	32.9	Very low	33.5	Very low	122 Å²	122	153.2 Å²	153.2	85%	0.853	85%	0.853	S	S	*	*			trans	-54.4	133.3	159.7	50.5	0	0	0	0	111.8
523	S	33.2	Very low	33.8	Very low	121 Å²	121	150.6 Å²	150.6	85%	0.846	85%	0.852	S	S	*	*			trans	-141.5	125.7	157.2	63.7	0	0	0	0	112.5
524	S	31.6	Very low	34.4	Very low	115 Å²	115	153.9 Å²	153.9	80%	0.804	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-65.5	150.4	-179.6	42.1	0	0	0	0	114.3
525	R	31.5	Very low	35.2	Very low	237 Å²	237	159.4 Å²	159.4	89%	0.894	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-52.9	143.6	164.8	-71.2	175.2	169.6	174.1	-3.8	111.8
526	P	36.1	Very low	35.2	Very low	128 Å²	128	163.8 Å²	163.8	83%	0.831	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-87.9	123.8	170	30.3	-25.7	0	0	0	111.5
527	E	31.5	Very low	35.4	Very low	189 Å²	189	162.8 Å²	162.8	88%	0.883	88%	0.878	S	S	*	*	P	Polyproline II helix	trans	-84.1	145.3	166.2	-79.8	-169.1	152.1	0	0	111.5
528	L	35.5	Very low	35.7	Very low	180 Å²	180	166.5 Å²	166.5	94%	0.942	88%	0.883	S	S	*	*	P	Polyproline II helix	trans	-75.2	130.3	-179.1	-80.5	139.5	0	0	0	112.3
529	F	29.9	Very low	35.9	Very low	210 Å²	210	164.3 Å²	164.3	92%	0.921	88%	0.879	S	S	*	*	P	Polyproline II helix	trans	-60.7	134.2	174.5	-96.5	-100.9	0	0	0	113.7
530	R	31	Very low	36.4	Very low	231 Å²	231	169.8 Å²	169.8	87%	0.872	88%	0.884	S	S	*	*	P	Polyproline II helix	trans	-98.4	145	155.1	-82.8	-175.3	-177.3	178.3	1.7	109.6
531	P	42.7	Very low	36.7	Very low	119 Å²	119	167.7 Å²	167.7	77%	0.773	88%	0.881	S	S	*	*	P	Polyproline II helix	trans	-84.3	153.8	172.7	33.3	-31.6	0	0	0	112.2
532	P	47.8	Very low	37.3	Very low	124 Å²	124	172.9 Å²	172.9	81%	0.805	89%	0.887	S	S	*	*	P	Polyproline II helix	trans	-88.6	149.2	-177.4	34.6	-32.7	0	0	0	113.5
533	E	39.3	Very low	37.6	Very low	196 Å²	196	176.8 Å²	176.8	92%	0.916	89%	0.89	S	S	*	*	P	Polyproline II helix	trans	-73.1	140.6	169.5	-68.1	175.5	157.7	0	0	111.2
534	I	48.8	Very low	38	Very low	171 Å²	171	181.4 Å²	181.4	88%	0.877	89%	0.894	S	S	*	*	P	Polyproline II helix	trans	-93.8	135.6	170.1	-63	172.3	0	0	0	107.2
535	K	50.1	Low	38.6	Very low	277 Å²	277	187.5 Å²	187.5	100%	1.204	90%	0.902	S	S	*	*			trans	-50.2	0	177.7	-74.8	179.2	174.9	178.1	0	115.1

Retrieved 535 of 535 residues in 295.3 ms (Link to these results)

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