A0A5K4FDA9_SCHMA Loading...

WD repeat domain phosphoinositide-interacting protein 3

AlphaFold DB (A0A5K4FB24), UniProt , Accession A0A5K4FDA9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 403 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	88.5	Confident	81.1	Confident	26 Å²	26	50.5 Å²	50.5	13%	0.128	31%	0.309	C	S	.	.				0	127.5	0	169.1	-170.5	-70.8	0	0	106.3	G19 F20 Y24 S290 L291 I385 C386 A387	M1-G19 CarbonylContact O-C 3.27Å; M1-G19 WeakPolarHBondContact O-CA 3.46Å; M1-F20 HydrophobicContact CB-CD2 4.41Å; M1-F20 HydrophobicContact CG-CD2 4.4Å; M1-F20 PolarHBondContact O-N 2.81Å; M1-F20 HydrophobicContact SD-CD2 4Å; M1-F20 HydrophobicContact SD-CE2 4.24Å; M1-Y24 HydrophobicContact CB-CE1 4.29Å; M1-S290 VanDerWaalsContact SD-CB 3.56Å; M1-L291 WeakPolarHBondContact CE-O 3.48Å; M1-I385 HydrophobicContact CG-CB 4.38Å; M1-I385 HydrophobicContact CG-CD1 4.4Å; M1-I385 HydrophobicContact SD-CB 4.16Å; M1-C386 WeakPolarHBondContact CE-O 3.33Å; M1-A387 HydrophobicContact CE-CB 4.37Å; M1-A387 HydrophobicContact SD-CB 4.25Å
2	C	92.9	Very high	80.5	Confident	38 Å²	38	61.1 Å²	61.1	26%	0.257	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	165.9	-169.1	62.3	0	0	0	0	113.3	F17 V18	C2-F17 HydrophobicContact CB-CE1 4.43Å; C2-F17 HydrophobicContact CB-CE2 3.5Å; C2-F17 VanDerWaalsContact CB-CE2 3.5Å; C2-F17 HydrophobicContact CB-CZ 3.36Å; C2-V18 CarbonylContact C-O 3.5Å; C2-V18 VanDerWaalsContact CA-O 3.3Å; C2-V18 WeakPolarHBondContact CA-O 3.27Å; C2-V18 WeakPolarHBondContact CB-O 3.29Å
3	M	90.8	Very high	80.4	Confident	26 Å²	26	57.8 Å²	57.8	13%	0.128	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	134.4	177.1	-179.6	172.2	67.9	0	0	110	V5 F17 V18 K383 I385	M3-V5 HydrophobicContact CE-CG2 4.37Å; M3-F17 WeakPolarHBondContact O-CA 3.36Å; M3-F17 WeakPolarHBondContact O-CD2 3.45Å; M3-V18 PolarHBondContact N-O 2.93Å; M3-V18 PolarHBondContact O-N 3.29Å; M3-K383 HydrophobicContact CE-CB 3.8Å; M3-K383 WeakPolarHBondContact CE-O 3.31Å; M3-K383 HydrophobicContact SD-CB 3.32Å; M3-K383 WeakPolarHBondContact SD-CB 3.47Å; M3-K383 HydrophobicContact SD-CD 3.87Å; M3-K383 HydrophobicContact SD-CG 4.22Å; M3-I385 HydrophobicContact CB-CG2 4.08Å
4	R	91.1	Very high	81.1	Confident	93 Å²	93	55.4 Å²	55.4	35%	0.351	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.5	163.6	-74.7	-171.9	175.4	94	-6.5	109.2	F17 G60 R108	R4-F17 HydrophobicContact CG-CD2 4.03Å; R4-G60 PolarHBondContact NE-O 3.39Å; R4-R108 VanDerWaalsContact CZ-O 3.25Å; R4-R108 PolarHBondContact NH1-O 2.66Å; R4-R108 PolarHBondContact NH2-O 3.29Å
5	V	87.9	Confident	81.9	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.067	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-98.3	124.6	179	-176.1	0	0	0	0	107.3	M3 D9 I15 L16 V18 N401	M3-V5 HydrophobicContact CE-CG2 4.37Å; V5-D9 HydrophobicContact CG1-CB 3.89Å; V5-I15 HydrophobicContact CB-CG2 4.36Å; V5-I15 HydrophobicContact CG2-CG2 3.96Å; V5-L16 PolarHBondContact N-O 3.2Å; V5-V18 HydrophobicContact CG2-CG2 4.47Å; V5-N401 WeakPolarHBondContact CG1-ND2 3.13Å
6	S	80.5	Confident	82.7	Confident	38 Å²	38	50.1 Å²	50.1	27%	0.266	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-73	153.9	176.3	67.7	0	0	0	0	110	T8 D9 S10	S6-T8 PolarHBondContact O-N 2.73Å; S6-T8 VanDerWaalsContact O-N 3.17Å; S6-T8 PolarHBondContact OG-OG1 2.86Å; S6-D9 CarbonylContact O-C 3.42Å; S6-D9 PolarHBondContact O-N 3.1Å; S6-D9 WeakPolarHBondContact OG-CB 3.44Å; S6-D9 PolarHBondContact OG-N 2.74Å; S6-D9 VanDerWaalsContact OG-N 3.16Å; S6-D9 PolarHBondContact OG-OD2 2.92Å; S6-S10 WeakPolarHBondContact O-CB 3.25Å; S6-S10 PolarHBondContact O-N 3.39Å
7	P	74.1	Confident	83.4	Confident	88 Å²	88	47.2 Å²	47.2	57%	0.571	29%	0.285	S	S	*	.	H	α-helix	trans	-54.1	-37.3	176	-28	35.7	0	0	0	113.1	S10 G11	P7-S10 WeakPolarHBondContact CA-OG 3.32Å; P7-S10 PolarHBondContact O-N 3.08Å; P7-S10 PolarHBondContact O-OG 2.95Å; P7-G11 PolarHBondContact O-N 3.47Å
8	T	72.1	Confident	84	Confident	126 Å²	126	44.8 Å²	44.8	77%	0.773	27%	0.271	S	S	*	.	H	α-helix	trans	-66.4	-36.4	176	50.8	0	0	0	0	112.9	S6	S6-T8 PolarHBondContact O-N 2.73Å; S6-T8 VanDerWaalsContact O-N 3.17Å; S6-T8 PolarHBondContact OG-OG1 2.86Å
9	D	72.2	Confident	84.6	Confident	48 Å²	48	42.6 Å²	42.6	26%	0.257	26%	0.258	S	S	.	.	H	α-helix	trans	-76.7	-27.2	175.9	-63.6	-27.8	0	0	0	111.3	V5 S6 K383 N401	V5-D9 HydrophobicContact CG1-CB 3.89Å; S6-D9 CarbonylContact O-C 3.42Å; S6-D9 PolarHBondContact O-N 3.1Å; S6-D9 WeakPolarHBondContact OG-CB 3.44Å; S6-D9 PolarHBondContact OG-N 2.74Å; S6-D9 VanDerWaalsContact OG-N 3.16Å; S6-D9 PolarHBondContact OG-OD2 2.92Å; D9-K383 IonicContact OD2-NZ 2.86Å; D9-K383 PolarHBondContact OD2-NZ 3.17Å; D9-N401 PolarHBondContact O-ND2 2.78Å
10	S	69.4	Low	85.1	Confident	12 Å²	12	40.8 Å²	40.8	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-72	-26.1	-176.8	76.2	0	0	0	0	114.1	S6 P7 N12 S13 I15 N401	S6-S10 WeakPolarHBondContact O-CB 3.25Å; S6-S10 PolarHBondContact O-N 3.39Å; P7-S10 WeakPolarHBondContact CA-OG 3.32Å; P7-S10 PolarHBondContact O-N 3.08Å; P7-S10 PolarHBondContact O-OG 2.95Å; S10-N12 PolarHBondContact O-N 3.23Å; S10-S13 WeakPolarHBondContact O-CB 3.33Å; S10-S13 PolarHBondContact O-N 3.09Å; S10-S13 PolarHBondContact O-OG 3.21Å; S10-I15 WeakPolarHBondContact CB-O 3.38Å; S10-N401 WeakPolarHBondContact CA-ND2 3.49Å
11	G	72.6	Confident	85.6	Confident	50 Å²	50	39 Å²	39	52%	0.515	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	-127.2	-172.8	0	0	0	0	0	111.2	P7	P7-G11 PolarHBondContact O-N 3.47Å
12	N	74.2	Confident	85.9	Confident	177 Å²	177	39.2 Å²	39.2	95%	0.947	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-2.1	177.2	-71.9	-13.5	0	0	0	114.2	S10 G14	S10-N12 PolarHBondContact O-N 3.23Å; N12-G14 PolarHBondContact O-N 3.01Å
13	S	79.8	Confident	85.8	Confident	19 Å²	19	40.2 Å²	40.2	13%	0.133	24%	0.24	C	C	.	.	S	Bend	trans	-65.4	-22	-175.1	67.3	0	0	0	0	113.5	S10 I15 I402	S10-S13 WeakPolarHBondContact O-CB 3.33Å; S10-S13 PolarHBondContact O-N 3.09Å; S10-S13 PolarHBondContact O-OG 3.21Å; S13-I15 PolarHBondContact O-N 3.45Å; S13-I15 PolarHBondContact OG-N 3.43Å; S13-I402 WeakPolarHBondContact CB-O 3.45Å
14	G	89.9	Confident	85.9	Confident	23 Å²	23	40.3 Å²	40.3	24%	0.237	24%	0.239	C	C	.	.			trans	65.5	12.8	-172.9	0	0	0	0	0	113.7	N12 M31 Q32	N12-G14 PolarHBondContact O-N 3.01Å; G14-M31 CarbonylContact O-C 3.54Å; G14-M31 VanDerWaalsContact O-CA 3.26Å; G14-M31 WeakPolarHBondContact O-CA 3.39Å; G14-Q32 PolarHBondContact O-N 3.41Å
15	I	93	Very high	86	Confident	13 Å²	13	36.1 Å²	36.1	7%	0.067	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	130.7	178.2	-63.7	171.7	0	0	0	109.9	V5 S10 S13 V18 V29 N401 I402	V5-I15 HydrophobicContact CB-CG2 4.36Å; V5-I15 HydrophobicContact CG2-CG2 3.96Å; S10-I15 WeakPolarHBondContact CB-O 3.38Å; S13-I15 PolarHBondContact O-N 3.45Å; S13-I15 PolarHBondContact OG-N 3.43Å; I15-V18 HydrophobicContact CG2-CG2 3.98Å; I15-V29 HydrophobicContact CB-CG1 4.46Å; I15-V29 HydrophobicContact CD1-CG1 4.31Å; I15-V29 HydrophobicContact CG1-CG1 3.97Å; I15-V29 HydrophobicContact CG2-CG1 3.83Å; I15-N401 WeakPolarHBondContact CB-OD1 3.45Å; I15-N401 WeakPolarHBondContact CD1-OD1 2.98Å; I15-N401 WeakPolarHBondContact CG2-OD1 3.3Å; I15-I402 WeakPolarHBondContact CD1-O 3.49Å
16	L	94.2	Very high	86.3	Confident	13 Å²	13	35.7 Å²	35.7	7%	0.068	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-23	179	-58.2	176.4	0	0	0	112.4	V5 G30	V5-L16 PolarHBondContact N-O 3.2Å; L16-G30 PolarHBondContact N-O 3.2Å
17	F	94.7	Very high	87	Confident	1 Å²	1	34.4 Å²	34.4	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	144.6	-173.1	175.7	-94.2	0	0	0	111.9	C2 M3 R4 V29 G30 Y61 M62	C2-F17 HydrophobicContact CB-CE1 4.43Å; C2-F17 HydrophobicContact CB-CE2 3.5Å; C2-F17 VanDerWaalsContact CB-CE2 3.5Å; C2-F17 HydrophobicContact CB-CZ 3.36Å; M3-F17 WeakPolarHBondContact O-CA 3.36Å; M3-F17 WeakPolarHBondContact O-CD2 3.45Å; R4-F17 HydrophobicContact CG-CD2 4.03Å; F17-V29 CarbonylContact O-C 3.57Å; F17-V29 VanDerWaalsContact O-CA 3.26Å; F17-V29 WeakPolarHBondContact O-CA 3.23Å; F17-G30 PolarHBondContact N-O 2.78Å; F17-G30 VanDerWaalsContact N-O 3.16Å; F17-G30 PolarHBondContact O-N 2.81Å; F17-Y61 AromaticContact CD2-CD2 3.82Å; F17-Y61 HydrophobicContact CD2-CD2 3.82Å; F17-Y61 HydrophobicContact CD2-CG 4.22Å; F17-Y61 AromaticContact CE2-CD2 3.3Å; F17-Y61 HydrophobicContact CE2-CD2 3.3Å; F17-Y61 AromaticContact CE2-CE2 3.59Å; F17-Y61 HydrophobicContact CE2-CE2 3.59Å; F17-Y61 AromaticContact CE2-CG 3.85Å; F17-Y61 HydrophobicContact CE2-CG 3.85Å; F17-Y61 HydrophobicContact CZ-CD2 4.04Å; F17-Y61 HydrophobicContact CZ-CE2 4.13Å; F17-Y61 HydrophobicContact CZ-CG 4.3Å; F17-M62 HydrophobicContact CD1-CB 4.02Å; F17-M62 HydrophobicContact CD1-CG 4.32Å; F17-M62 HydrophobicContact CE1-CB 3.78Å; F17-M62 VanDerWaalsContact CE1-N 3.3Å; F17-M62 WeakPolarHBondContact CE1-O 3.26Å; F17-M62 WeakPolarHBondContact CZ-O 3.4Å
18	V	94.5	Very high	88.1	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.024	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.7	167.5	-175.8	0	0	0	0	109.2	C2 M3 V5 I15 F27 A28 V29 I385	C2-V18 CarbonylContact C-O 3.5Å; C2-V18 VanDerWaalsContact CA-O 3.3Å; C2-V18 WeakPolarHBondContact CA-O 3.27Å; C2-V18 WeakPolarHBondContact CB-O 3.29Å; M3-V18 PolarHBondContact N-O 2.93Å; M3-V18 PolarHBondContact O-N 3.29Å; V5-V18 HydrophobicContact CG2-CG2 4.47Å; I15-V18 HydrophobicContact CG2-CG2 3.98Å; V18-F27 HydrophobicContact CG1-CD2 4.27Å; V18-A28 WeakPolarHBondContact CA-O 3.42Å; V18-V29 HydrophobicContact CG2-CG1 4.47Å; V18-V29 HydrophobicContact CG2-CG2 4.42Å; V18-I385 HydrophobicContact CG1-CD1 4.46Å
19	G	94.8	Very high	89.2	Confident	3 Å²	3	24.7 Å²	24.7	3%	0.031	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	137.3	176.6	0	0	0	0	0	114.1	M1 F27 A28	M1-G19 CarbonylContact O-C 3.27Å; M1-G19 WeakPolarHBondContact O-CA 3.46Å; G19-F27 CarbonylContact O-C 3.57Å; G19-F27 VanDerWaalsContact O-CA 3.25Å; G19-F27 WeakPolarHBondContact O-CA 3.08Å; G19-F27 WeakPolarHBondContact O-CB 3.41Å; G19-A28 PolarHBondContact N-O 2.78Å; G19-A28 PolarHBondContact O-N 3.32Å
20	F	95.7	Very high	90.4	Very high	7 Å²	7	22.4 Å²	22.4	3%	0.031	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	148.4	171.7	-68.8	-75.9	0	0	0	111.6	M1 Y24 C26 F27 I385 A387 I397 T399	M1-F20 HydrophobicContact CB-CD2 4.41Å; M1-F20 HydrophobicContact CG-CD2 4.4Å; M1-F20 PolarHBondContact O-N 2.81Å; M1-F20 HydrophobicContact SD-CD2 4Å; M1-F20 HydrophobicContact SD-CE2 4.24Å; F20-Y24 HydrophobicContact CB-CD1 3.81Å; F20-Y24 HydrophobicContact CG-CD1 4.22Å; F20-C26 WeakPolarHBondContact CA-O 3.5Å; F20-F27 HydrophobicContact CD1-CB 3.92Å; F20-F27 HydrophobicContact CE1-CB 4.29Å; F20-F27 HydrophobicContact CG-CB 4.48Å; F20-I385 HydrophobicContact CD2-CD1 3.88Å; F20-I385 HydrophobicContact CD2-CG1 4.29Å; F20-I385 HydrophobicContact CE2-CD1 3.95Å; F20-I385 HydrophobicContact CE2-CG1 3.87Å; F20-A387 HydrophobicContact CD2-CB 4.43Å; F20-A387 HydrophobicContact CE2-CB 4.21Å; F20-I397 HydrophobicContact CE1-CG2 3.88Å; F20-I397 HydrophobicContact CZ-CB 4.48Å; F20-I397 HydrophobicContact CZ-CG2 3.99Å; F20-T399 HydrophobicContact CE1-CG2 3.89Å; F20-T399 HydrophobicContact CE2-CG2 4.4Å; F20-T399 HydrophobicContact CZ-CG2 3.64Å
21	N	95.6	Very high	91.6	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.016	14%	0.141	C	C	.	.			trans	-66.6	178.1	161.3	76.1	-22	0	0	0	111.3	D23 Y24 G25 C26 M64 F66	N21-D23 VanDerWaalsContact C-N 3.3Å; N21-D23 PolarHBondContact ND2-OD1 3.35Å; N21-D23 PolarHBondContact O-N 2.61Å; N21-D23 PolarHBondContact OD1-OD1 3.22Å; N21-Y24 PolarHBondContact O-N 3.28Å; N21-Y24 WeakPolarHBondContact OD1-CA 3.35Å; N21-Y24 PolarHBondContact OD1-N 3.33Å; N21-Y24 VanDerWaalsContact OD1-N 3.11Å; N21-G25 PolarHBondContact OD1-N 3.19Å; N21-C26 HydrophobicContact CB-CB 4.41Å; N21-C26 PolarHBondContact N-O 3.3Å; N21-C26 PolarHBondContact OD1-N 3.2Å; N21-C26 PolarHBondContact OD1-O 2.86Å; N21-M64 HydrophobicContact CB-CB 3.88Å; N21-M64 HydrophobicContact CB-CE 4.31Å; N21-M64 HydrophobicContact CB-CG 4.42Å; N21-M64 HydrophobicContact CB-SD 3.86Å; N21-F66 WeakPolarHBondContact CB-O 3.48Å; N21-F66 PolarHBondContact ND2-O 3.36Å
22	Q	94.4	Very high	92.7	Very high	30 Å²	30	22.9 Å²	22.9	14%	0.14	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-28.6	-169.4	-68.9	80.2	-11.5	0	0	113.8	M64 F66 Q154	Q22-M64 VanDerWaalsContact CD-O 3.29Å; Q22-M64 PolarHBondContact NE2-O 2.99Å; Q22-M64 PolarHBondContact OE1-O 3.27Å; Q22-F66 HydrophobicContact CB-CD1 3.78Å; Q22-F66 HydrophobicContact CB-CE1 3.63Å; Q22-F66 HydrophobicContact CB-CG 4.35Å; Q22-F66 HydrophobicContact CB-CZ 4.08Å; Q22-F66 HydrophobicContact CG-CD1 4.41Å; Q22-F66 HydrophobicContact CG-CD2 4.48Å; Q22-F66 HydrophobicContact CG-CE1 4.28Å; Q22-F66 HydrophobicContact CG-CE2 4.35Å; Q22-F66 HydrophobicContact CG-CZ 4.28Å; Q22-Q154 HydrophobicContact CB-CG 4.07Å; Q22-Q154 HydrophobicContact CG-CG 3.79Å
23	D	91.4	Very high	93.7	Very high	60 Å²	60	17.2 Å²	17.2	32%	0.321	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	8.4	-178.9	68.6	1.3	0	0	0	113.5	N21 G25 S390	N21-D23 VanDerWaalsContact C-N 3.3Å; N21-D23 PolarHBondContact ND2-OD1 3.35Å; N21-D23 PolarHBondContact O-N 2.61Å; N21-D23 PolarHBondContact OD1-OD1 3.22Å; D23-G25 PolarHBondContact O-N 3.45Å; D23-G25 PolarHBondContact OD1-N 3.07Å; D23-S390 VanDerWaalsContact O-CB 3.29Å; D23-S390 WeakPolarHBondContact O-CB 3.27Å; D23-S390 PolarHBondContact O-OG 3.33Å
24	Y	93	Very high	94.5	Very high	28 Å²	28	16.3 Å²	16.3	11%	0.11	9%	0.09	C	C	.	.	S	Bend	trans	59.4	13.3	-179.9	-43.1	-47.3	0	0	0	115	M1 F20 N21 C40 Y151 A387	M1-Y24 HydrophobicContact CB-CE1 4.29Å; F20-Y24 HydrophobicContact CB-CD1 3.81Å; F20-Y24 HydrophobicContact CG-CD1 4.22Å; N21-Y24 PolarHBondContact O-N 3.28Å; N21-Y24 WeakPolarHBondContact OD1-CA 3.35Å; N21-Y24 PolarHBondContact OD1-N 3.33Å; N21-Y24 VanDerWaalsContact OD1-N 3.11Å; Y24-C40 PolarHBondContact O-SG 3.02Å; Y24-Y151 PolarHBondContact OH-OH 3.45Å; Y24-A387 HydrophobicContact CD1-CB 3.95Å; Y24-A387 HydrophobicContact CD2-CB 3.8Å; Y24-A387 HydrophobicContact CE1-CB 4.4Å; Y24-A387 HydrophobicContact CE2-CB 4.26Å; Y24-A387 HydrophobicContact CG-CB 3.63Å
25	G	92.4	Very high	94.9	Very high	5 Å²	5	15.5 Å²	15.5	5%	0.052	8%	0.079	C	C	.	.	S	Bend	trans	-81.6	-21.9	178.2	0	0	0	0	0	114	N21 D23 N39 C40 R67	N21-G25 PolarHBondContact OD1-N 3.19Å; D23-G25 PolarHBondContact O-N 3.45Å; D23-G25 PolarHBondContact OD1-N 3.07Å; G25-N39 PolarHBondContact O-OD1 3.49Å; G25-C40 WeakPolarHBondContact O-CB 3.34Å; G25-C40 PolarHBondContact O-N 3.43Å; G25-C40 PolarHBondContact O-SG 3.06Å; G25-C40 VanDerWaalsContact O-SG 3.39Å; G25-R67 VanDerWaalsContact CA-NH2 3.25Å; G25-R67 PolarHBondContact O-NH2 3.17Å
26	C	94.7	Very high	95.1	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.014	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	161	174.2	-71.2	0	0	0	0	111.1	F20 N21 F38 M64 R67	F20-C26 WeakPolarHBondContact CA-O 3.5Å; N21-C26 HydrophobicContact CB-CB 4.41Å; N21-C26 PolarHBondContact N-O 3.3Å; N21-C26 PolarHBondContact OD1-N 3.2Å; N21-C26 PolarHBondContact OD1-O 2.86Å; C26-F38 CarbonylContact C-O 3.55Å; C26-F38 WeakPolarHBondContact CA-O 3.45Å; C26-F38 WeakPolarHBondContact CB-O 3.41Å; C26-M64 HydrophobicContact CB-CE 3.64Å; C26-M64 HydrophobicContact CB-SD 3.95Å; C26-R67 PolarHBondContact SG-NH1 2.62Å
27	F	95.4	Very high	95.2	Very high	10 Å²	10	15.6 Å²	15.6	4%	0.044	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	149.2	165.2	66.2	-85.3	0	0	0	111.6	V18 G19 F20 V29 I37 F38 L43 T399	V18-F27 HydrophobicContact CG1-CD2 4.27Å; G19-F27 CarbonylContact O-C 3.57Å; G19-F27 VanDerWaalsContact O-CA 3.25Å; G19-F27 WeakPolarHBondContact O-CA 3.08Å; G19-F27 WeakPolarHBondContact O-CB 3.41Å; F20-F27 HydrophobicContact CD1-CB 3.92Å; F20-F27 HydrophobicContact CE1-CB 4.29Å; F20-F27 HydrophobicContact CG-CB 4.48Å; F27-V29 HydrophobicContact CD2-CG2 3.86Å; F27-V29 HydrophobicContact CE2-CG2 3.83Å; F27-I37 WeakPolarHBondContact O-CA 3.25Å; F27-F38 HydrophobicContact CD1-CB 3.93Å; F27-F38 HydrophobicContact CD2-CB 4.26Å; F27-F38 HydrophobicContact CD2-CD2 4.02Å; F27-F38 HydrophobicContact CE1-CB 3.41Å; F27-F38 VanDerWaalsContact CE1-CB 3.41Å; F27-F38 HydrophobicContact CE1-CG 4.19Å; F27-F38 HydrophobicContact CE2-CB 3.78Å; F27-F38 AromaticContact CE2-CD2 3.39Å; F27-F38 HydrophobicContact CE2-CD2 3.39Å; F27-F38 HydrophobicContact CE2-CE2 4.15Å; F27-F38 AromaticContact CE2-CG 3.76Å; F27-F38 HydrophobicContact CE2-CG 3.76Å; F27-F38 HydrophobicContact CG-CB 4.33Å; F27-F38 HydrophobicContact CZ-CB 3.33Å; F27-F38 HydrophobicContact CZ-CD1 4.35Å; F27-F38 AromaticContact CZ-CD2 3.75Å; F27-F38 HydrophobicContact CZ-CD2 3.75Å; F27-F38 AromaticContact CZ-CG 3.58Å; F27-F38 HydrophobicContact CZ-CG 3.58Å; F27-F38 PolarHBondContact N-O 3.39Å; F27-F38 PolarHBondContact O-N 2.91Å; F27-L43 HydrophobicContact CE1-CD1 3.73Å; F27-L43 HydrophobicContact CZ-CD1 3.84Å; F27-T399 HydrophobicContact CB-CG2 4.35Å; F27-T399 HydrophobicContact CD1-CG2 3.81Å; F27-T399 HydrophobicContact CD2-CG2 4.03Å; F27-T399 HydrophobicContact CE1-CG2 4.02Å; F27-T399 HydrophobicContact CE2-CG2 4.23Å; F27-T399 HydrophobicContact CG-CG2 3.81Å; F27-T399 HydrophobicContact CZ-CG2 4.21Å
28	A	96.5	Very high	95.2	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.008	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	145.5	175.2	0	0	0	0	0	110.1	V18 G19 R36 I37 M62 M64	V18-A28 WeakPolarHBondContact CA-O 3.42Å; G19-A28 PolarHBondContact N-O 2.78Å; G19-A28 PolarHBondContact O-N 3.32Å; A28-R36 WeakPolarHBondContact CA-O 3.28Å; A28-I37 HydrophobicContact CB-CG1 4.43Å; A28-M62 HydrophobicContact CB-CB 4.08Å; A28-M62 HydrophobicContact CB-CE 4.09Å; A28-M62 HydrophobicContact CB-SD 3.92Å; A28-M64 HydrophobicContact CB-CG 4Å; A28-M64 HydrophobicContact CB-SD 3.99Å
29	V	95.9	Very high	95.2	Very high	9 Å²	9	18 Å²	18	6%	0.055	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.8	176.3	-176.2	0	0	0	0	108.4	I15 F17 V18 F27 M31 F35 R36 F38	I15-V29 HydrophobicContact CB-CG1 4.46Å; I15-V29 HydrophobicContact CD1-CG1 4.31Å; I15-V29 HydrophobicContact CG1-CG1 3.97Å; I15-V29 HydrophobicContact CG2-CG1 3.83Å; F17-V29 CarbonylContact O-C 3.57Å; F17-V29 VanDerWaalsContact O-CA 3.26Å; F17-V29 WeakPolarHBondContact O-CA 3.23Å; V18-V29 HydrophobicContact CG2-CG1 4.47Å; V18-V29 HydrophobicContact CG2-CG2 4.42Å; F27-V29 HydrophobicContact CD2-CG2 3.86Å; F27-V29 HydrophobicContact CE2-CG2 3.83Å; V29-M31 HydrophobicContact CG1-CG 4.04Å; V29-F35 CarbonylContact O-C 3.52Å; V29-F35 VanDerWaalsContact O-CA 3.23Å; V29-F35 WeakPolarHBondContact O-CA 3.36Å; V29-F35 WeakPolarHBondContact O-CB 3.36Å; V29-R36 HydrophobicContact CB-CB 4.37Å; V29-R36 PolarHBondContact N-O 2.79Å; V29-R36 PolarHBondContact O-N 2.83Å; V29-F38 HydrophobicContact CB-CE2 4.36Å; V29-F38 HydrophobicContact CG2-CD2 4.02Å; V29-F38 HydrophobicContact CG2-CE2 3.77Å
30	G	96.6	Very high	95	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	135.1	170.9	0	0	0	0	0	109.7	L16 F17 V59	L16-G30 PolarHBondContact N-O 3.2Å; F17-G30 PolarHBondContact N-O 2.78Å; F17-G30 VanDerWaalsContact N-O 3.16Å; F17-G30 PolarHBondContact O-N 2.81Å; G30-V59 CarbonylContact C-O 3.56Å; G30-V59 VanDerWaalsContact C-O 3.27Å; G30-V59 VanDerWaalsContact CA-O 3.28Å; G30-V59 WeakPolarHBondContact CA-O 3.41Å
31	M	95.5	Very high	94.6	Very high	31 Å²	31	22.6 Å²	22.6	15%	0.153	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	165.6	-172.2	-56.1	-175.2	75.9	0	0	111.5	G14 V29 N33 G34 R36 G58 V59	G14-M31 CarbonylContact O-C 3.54Å; G14-M31 VanDerWaalsContact O-CA 3.26Å; G14-M31 WeakPolarHBondContact O-CA 3.39Å; V29-M31 HydrophobicContact CG1-CG 4.04Å; M31-N33 PolarHBondContact O-N 2.91Å; M31-G34 WeakPolarHBondContact CA-O 3.44Å; M31-G34 WeakPolarHBondContact CB-O 3.49Å; M31-G34 PolarHBondContact N-O 2.81Å; M31-G34 PolarHBondContact O-N 3.1Å; M31-R36 HydrophobicContact SD-CG 3.59Å; M31-R36 VanDerWaalsContact SD-CG 3.59Å; M31-G58 WeakPolarHBondContact O-CA 3.4Å; M31-V59 PolarHBondContact N-O 3.41Å; M31-V59 PolarHBondContact O-N 3.18Å
32	Q	95.1	Very high	94.4	Very high	42 Å²	42	26.8 Å²	26.8	20%	0.196	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.1	175.9	-174.7	59.2	41.4	0	0	113.3	G14 T57 G58 N78 H79	G14-Q32 PolarHBondContact O-N 3.41Å; Q32-T57 CarbonylContact O-C 3.28Å; Q32-T57 PolarHBondContact O-OG1 3.01Å; Q32-G58 WeakPolarHBondContact O-CA 3.46Å; Q32-G58 PolarHBondContact O-N 2.83Å; Q32-N78 VanDerWaalsContact NE2-N 3.19Å; Q32-H79 VanDerWaalsContact NE2-N 3.16Å
33	N	95.3	Very high	94.1	Very high	58 Å²	58	31.2 Å²	31.2	31%	0.31	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	6	-178.1	75	-17.8	0	0	0	114.9	M31 E50 F51 T57	M31-N33 PolarHBondContact O-N 2.91Å; N33-E50 VanDerWaalsContact ND2-CD 3.28Å; N33-E50 PolarHBondContact ND2-OE1 2.92Å; N33-E50 VanDerWaalsContact O-CA 3.32Å; N33-E50 WeakPolarHBondContact O-CA 3.45Å; N33-F51 PolarHBondContact O-N 2.79Å; N33-F51 VanDerWaalsContact O-N 3.09Å; N33-T57 CarbonylContact C-O 3.57Å; N33-T57 VanDerWaalsContact C-O 3.28Å
34	G	96.8	Very high	94.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.3	-137	-176.7	0	0	0	0	0	112.1	M31 Y49 T57 V59	M31-G34 WeakPolarHBondContact CA-O 3.44Å; M31-G34 WeakPolarHBondContact CB-O 3.49Å; M31-G34 PolarHBondContact N-O 2.81Å; M31-G34 PolarHBondContact O-N 3.1Å; G34-Y49 WeakPolarHBondContact CA-O 3.37Å; G34-T57 PolarHBondContact N-O 3.16Å; G34-V59 WeakPolarHBondContact O-CB 3.28Å; G34-V59 WeakPolarHBondContact O-CG2 3.46Å
35	F	97.5	Very high	94.4	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	166.1	-178.4	63.8	-96.2	0	0	0	113.9	V29 I37 Y49 F51 V59 M62 L71 I73 W90	V29-F35 CarbonylContact O-C 3.52Å; V29-F35 VanDerWaalsContact O-CA 3.23Å; V29-F35 WeakPolarHBondContact O-CA 3.36Å; V29-F35 WeakPolarHBondContact O-CB 3.36Å; F35-I37 HydrophobicContact CD2-CG1 4.47Å; F35-Y49 HydrophobicContact CE1-CD1 4.06Å; F35-Y49 HydrophobicContact CE1-CG 4.07Å; F35-Y49 HydrophobicContact CZ-CD1 4.49Å; F35-Y49 HydrophobicContact CZ-CG 4.06Å; F35-Y49 PolarHBondContact N-O 3.07Å; F35-Y49 PolarHBondContact O-N 3.08Å; F35-Y49 VanDerWaalsContact O-N 3.08Å; F35-F51 HydrophobicContact CD1-CE2 4.06Å; F35-F51 HydrophobicContact CD1-CZ 4.35Å; F35-F51 HydrophobicContact CE1-CE2 4.21Å; F35-F51 HydrophobicContact CE1-CZ 4.05Å; F35-V59 HydrophobicContact CD1-CG2 4.42Å; F35-M62 HydrophobicContact CB-CE 3.55Å; F35-M62 HydrophobicContact CB-SD 3.36Å; F35-M62 WeakPolarHBondContact CB-SD 3.26Å; F35-M62 HydrophobicContact CD1-CE 4.15Å; F35-M62 HydrophobicContact CD2-CE 3.56Å; F35-M62 HydrophobicContact CD2-SD 4.48Å; F35-M62 HydrophobicContact CE2-CE 4.27Å; F35-M62 HydrophobicContact CG-CE 3.49Å; F35-M62 VanDerWaalsContact CG-CE 3.49Å; F35-M62 HydrophobicContact CG-SD 4.03Å; F35-L71 HydrophobicContact CD2-CD1 4.45Å; F35-L71 HydrophobicContact CE2-CD1 3.81Å; F35-L71 HydrophobicContact CZ-CD1 3.96Å; F35-I73 HydrophobicContact CD1-CD1 4.28Å; F35-I73 HydrophobicContact CE1-CD1 4.07Å; F35-W90 AromaticContact CZ-NE1 3.66Å
36	R	96.7	Very high	94.5	Very high	15 Å²	15	41.3 Å²	41.3	6%	0.057	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151.2	173.4	-52.1	-66.2	178.8	-91.3	-3.4	110.3	A28 V29 M31 F38 E47 R48 Y49 E50	A28-R36 WeakPolarHBondContact CA-O 3.28Å; V29-R36 HydrophobicContact CB-CB 4.37Å; V29-R36 PolarHBondContact N-O 2.79Å; V29-R36 PolarHBondContact O-N 2.83Å; M31-R36 HydrophobicContact SD-CG 3.59Å; M31-R36 VanDerWaalsContact SD-CG 3.59Å; R36-F38 HydrophobicContact CB-CD2 4.22Å; R36-F38 HydrophobicContact CB-CE2 3.41Å; R36-F38 VanDerWaalsContact CB-CE2 3.41Å; R36-F38 HydrophobicContact CB-CZ 3.88Å; R36-F38 HydrophobicContact CG-CE2 4.27Å; R36-F38 HydrophobicContact CG-CZ 4.37Å; R36-E47 WeakPolarHBondContact CA-O 3.36Å; R36-R48 VanDerWaalsContact NH2-NE 3.1Å; R36-Y49 PolarHBondContact NH1-O 3.35Å; R36-E50 IonicContact CZ-OE1 2.84Å; R36-E50 IonicContact NH1-OE1 3.72Å; R36-E50 IonicContact NH2-OE1 3.56Å; R36-E50 PolarHBondContact NH2-OE1 3.34Å
37	I	97	Very high	94.6	Very high	13 Å²	13	46.1 Å²	46.1	7%	0.067	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.4	170.2	-57.5	176.4	0	0	0	108.4	F27 A28 F35 L46 E47 M64 L71	F27-I37 WeakPolarHBondContact O-CA 3.25Å; A28-I37 HydrophobicContact CB-CG1 4.43Å; F35-I37 HydrophobicContact CD2-CG1 4.47Å; I37-L46 HydrophobicContact CG2-CD1 4.4Å; I37-L46 PolarHBondContact O-N 2.73Å; I37-E47 HydrophobicContact CB-CB 4.03Å; I37-E47 HydrophobicContact CD1-CB 4.27Å; I37-E47 HydrophobicContact CD1-CG 4.41Å; I37-E47 HydrophobicContact CG1-CB 4.25Å; I37-E47 PolarHBondContact N-O 2.81Å; I37-E47 PolarHBondContact O-N 2.93Å; I37-M64 HydrophobicContact CD1-CE 4.32Å; I37-M64 HydrophobicContact CG2-CE 3.55Å; I37-M64 HydrophobicContact CG2-SD 4Å; I37-L71 HydrophobicContact CD1-CD1 3.91Å; I37-L71 HydrophobicContact CD1-CD2 3.88Å
38	F	95.2	Very high	94.6	Very high	34 Å²	34	52.3 Å²	52.3	15%	0.149	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143	179.8	-60.5	-95.2	0	0	0	110.4	C26 F27 V29 R36 L43 K44 Q45	C26-F38 CarbonylContact C-O 3.55Å; C26-F38 WeakPolarHBondContact CA-O 3.45Å; C26-F38 WeakPolarHBondContact CB-O 3.41Å; F27-F38 HydrophobicContact CD1-CB 3.93Å; F27-F38 HydrophobicContact CD2-CB 4.26Å; F27-F38 HydrophobicContact CD2-CD2 4.02Å; F27-F38 HydrophobicContact CE1-CB 3.41Å; F27-F38 VanDerWaalsContact CE1-CB 3.41Å; F27-F38 HydrophobicContact CE1-CG 4.19Å; F27-F38 HydrophobicContact CE2-CB 3.78Å; F27-F38 AromaticContact CE2-CD2 3.39Å; F27-F38 HydrophobicContact CE2-CD2 3.39Å; F27-F38 HydrophobicContact CE2-CE2 4.15Å; F27-F38 AromaticContact CE2-CG 3.76Å; F27-F38 HydrophobicContact CE2-CG 3.76Å; F27-F38 HydrophobicContact CG-CB 4.33Å; F27-F38 HydrophobicContact CZ-CB 3.33Å; F27-F38 HydrophobicContact CZ-CD1 4.35Å; F27-F38 AromaticContact CZ-CD2 3.75Å; F27-F38 HydrophobicContact CZ-CD2 3.75Å; F27-F38 AromaticContact CZ-CG 3.58Å; F27-F38 HydrophobicContact CZ-CG 3.58Å; F27-F38 PolarHBondContact N-O 3.39Å; F27-F38 PolarHBondContact O-N 2.91Å; V29-F38 HydrophobicContact CB-CE2 4.36Å; V29-F38 HydrophobicContact CG2-CD2 4.02Å; V29-F38 HydrophobicContact CG2-CE2 3.77Å; R36-F38 HydrophobicContact CB-CD2 4.22Å; R36-F38 HydrophobicContact CB-CE2 3.41Å; R36-F38 VanDerWaalsContact CB-CE2 3.41Å; R36-F38 HydrophobicContact CB-CZ 3.88Å; R36-F38 HydrophobicContact CG-CE2 4.27Å; R36-F38 HydrophobicContact CG-CZ 4.37Å; F38-L43 HydrophobicContact CB-CD1 4.44Å; F38-K44 CarbonylContact C-O 3.42Å; F38-K44 VanDerWaalsContact CA-O 3.27Å; F38-K44 WeakPolarHBondContact CA-O 3.48Å; F38-Q45 HydrophobicContact CD1-CB 3.77Å; F38-Q45 HydrophobicContact CD1-CG 4.12Å; F38-Q45 HydrophobicContact CE1-CB 3.62Å; F38-Q45 HydrophobicContact CE1-CG 3.76Å; F38-Q45 HydrophobicContact CZ-CB 4.49Å; F38-Q45 HydrophobicContact CZ-CG 4.16Å
39	N	93.7	Very high	94.6	Very high	21 Å²	21	55 Å²	55	11%	0.112	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	139.9	160.9	-171.2	64.3	0	0	0	108.7	G25 D41 P42 L43 K44 L46 R67	G25-N39 PolarHBondContact O-OD1 3.49Å; N39-D41 PolarHBondContact ND2-N 2.82Å; N39-D41 PolarHBondContact ND2-O 3.45Å; N39-P42 PolarHBondContact ND2-O 2.8Å; N39-L43 WeakPolarHBondContact O-CA 3.14Å; N39-K44 HydrophobicContact CB-CB 4.47Å; N39-K44 PolarHBondContact N-O 2.96Å; N39-K44 PolarHBondContact O-N 2.85Å; N39-L46 HydrophobicContact CB-CD1 4.01Å; N39-L46 HydrophobicContact CB-CD2 4.09Å; N39-L46 HydrophobicContact CB-CG 4.06Å; N39-R67 PolarHBondContact OD1-NH1 3.12Å; N39-R67 PolarHBondContact OD1-NH2 3.34Å; N39-R67 VanDerWaalsContact OD1-NH2 3.07Å
40	C	91.1	Very high	94.7	Very high	15 Å²	15	58.4 Å²	58.4	10%	0.101	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-44	-179.4	-62	0	0	0	0	112.9	Y24 G25 L43 I397	Y24-C40 PolarHBondContact O-SG 3.02Å; G25-C40 WeakPolarHBondContact O-CB 3.34Å; G25-C40 PolarHBondContact O-N 3.43Å; G25-C40 PolarHBondContact O-SG 3.06Å; G25-C40 VanDerWaalsContact O-SG 3.39Å; C40-L43 PolarHBondContact O-N 3.27Å; C40-I397 HydrophobicContact CB-CD1 3.74Å; C40-I397 HydrophobicContact CB-CG2 4.01Å
41	D	87.7	Confident	94.7	Very high	92 Å²	92	59.1 Å²	59.1	49%	0.492	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.7	113.9	-175	-175.1	28.9	0	0	0	111.6	N39	N39-D41 PolarHBondContact ND2-N 2.82Å; N39-D41 PolarHBondContact ND2-O 3.45Å
42	P	90.1	Very high	94.6	Very high	91 Å²	91	60.6 Å²	60.6	59%	0.591	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	cis	-64.1	151.2	-9.9	29.9	-35.6	0	0	0	110.9	N39 K44	N39-P42 PolarHBondContact ND2-O 2.8Å; P42-K44 PolarHBondContact O-N 3.16Å
43	L	89.6	Confident	94.5	Very high	122 Å²	122	64.1 Å²	64.1	64%	0.639	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	111.2	175.9	-179.8	62.4	0	0	0	110	F27 F38 N39 C40	F27-L43 HydrophobicContact CE1-CD1 3.73Å; F27-L43 HydrophobicContact CZ-CD1 3.84Å; F38-L43 HydrophobicContact CB-CD1 4.44Å; N39-L43 WeakPolarHBondContact O-CA 3.14Å; C40-L43 PolarHBondContact O-N 3.27Å
44	K	93.6	Very high	94.4	Very high	135 Å²	135	71.1 Å²	71.1	59%	0.587	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.3	131.4	-176.6	-177.8	177.3	178	-178.8	0	111.3	F38 N39 P42 L46	F38-K44 CarbonylContact C-O 3.42Å; F38-K44 VanDerWaalsContact CA-O 3.27Å; F38-K44 WeakPolarHBondContact CA-O 3.48Å; N39-K44 HydrophobicContact CB-CB 4.47Å; N39-K44 PolarHBondContact N-O 2.96Å; N39-K44 PolarHBondContact O-N 2.85Å; P42-K44 PolarHBondContact O-N 3.16Å; K44-L46 PolarHBondContact O-N 3.17Å
45	Q	95.7	Very high	94.2	Very high	90 Å²	90	76 Å²	76	42%	0.421	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	122.5	169.7	-166	-174.9	-85	0	0	109.6	F38	F38-Q45 HydrophobicContact CD1-CB 3.77Å; F38-Q45 HydrophobicContact CD1-CG 4.12Å; F38-Q45 HydrophobicContact CE1-CB 3.62Å; F38-Q45 HydrophobicContact CE1-CG 3.76Å; F38-Q45 HydrophobicContact CZ-CB 4.49Å; F38-Q45 HydrophobicContact CZ-CG 4.16Å
46	L	95.2	Very high	94.1	Very high	81 Å²	81	76.3 Å²	76.3	42%	0.424	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-45.9	177.6	-61.4	-179.3	0	0	0	111.1	I37 N39 K44	I37-L46 HydrophobicContact CG2-CD1 4.4Å; I37-L46 PolarHBondContact O-N 2.73Å; N39-L46 HydrophobicContact CB-CD1 4.01Å; N39-L46 HydrophobicContact CB-CD2 4.09Å; N39-L46 HydrophobicContact CB-CG 4.06Å; K44-L46 PolarHBondContact O-N 3.17Å
47	E	95.8	Very high	94.1	Very high	102 Å²	102	75.9 Å²	75.9	48%	0.477	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	147.4	-174.6	-66.6	-65.5	166.1	0	0	111.6	R36 I37	R36-E47 WeakPolarHBondContact CA-O 3.36Å; I37-E47 HydrophobicContact CB-CB 4.03Å; I37-E47 HydrophobicContact CD1-CB 4.27Å; I37-E47 HydrophobicContact CD1-CG 4.41Å; I37-E47 HydrophobicContact CG1-CB 4.25Å; I37-E47 PolarHBondContact N-O 2.81Å; I37-E47 PolarHBondContact O-N 2.93Å
48	R	96.2	Very high	94.1	Very high	140 Å²	140	75.3 Å²	75.3	53%	0.528	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	122.6	170.5	164.9	165.4	-173.9	163.8	-1.1	108.7	R36 E50	R36-R48 VanDerWaalsContact NH2-NE 3.1Å; R48-E50 IonicContact CZ-OE1 3.32Å; R48-E50 IonicContact NE-OE1 3.29Å; R48-E50 PolarHBondContact NE-OE1 3.45Å; R48-E50 IonicContact NH2-OE1 2.66Å; R48-E50 PolarHBondContact NH2-OE1 2.91Å; R48-E50 IonicContact NH2-OE2 3.74Å
49	Y	97.3	Very high	94.2	Very high	58 Å²	58	73.7 Å²	73.7	23%	0.227	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.4	172.5	-161.3	-90.8	0	0	0	110.3	G34 F35 R36 F51 W90 Q95	G34-Y49 WeakPolarHBondContact CA-O 3.37Å; F35-Y49 HydrophobicContact CE1-CD1 4.06Å; F35-Y49 HydrophobicContact CE1-CG 4.07Å; F35-Y49 HydrophobicContact CZ-CD1 4.49Å; F35-Y49 HydrophobicContact CZ-CG 4.06Å; F35-Y49 PolarHBondContact N-O 3.07Å; F35-Y49 PolarHBondContact O-N 3.08Å; F35-Y49 VanDerWaalsContact O-N 3.08Å; R36-Y49 PolarHBondContact NH1-O 3.35Å; Y49-F51 HydrophobicContact CD1-CD1 4.02Å; Y49-F51 AromaticContact CD1-CE1 3.82Å; Y49-F51 HydrophobicContact CD1-CE1 3.82Å; Y49-F51 HydrophobicContact CD1-CE2 4.3Å; Y49-F51 HydrophobicContact CD1-CG 4.36Å; Y49-F51 AromaticContact CD1-CZ 3.96Å; Y49-F51 HydrophobicContact CD1-CZ 3.96Å; Y49-F51 AromaticContact CE1-CD1 3.53Å; Y49-F51 HydrophobicContact CE1-CD1 3.53Å; Y49-F51 AromaticContact CE1-CE1 3.49Å; Y49-F51 HydrophobicContact CE1-CE1 3.49Å; Y49-F51 VanDerWaalsContact CE1-CE1 3.49Å; Y49-F51 HydrophobicContact CE1-CG 4.2Å; Y49-F51 HydrophobicContact CE1-CZ 4.12Å; Y49-W90 HydrophobicContact CD1-CH2 4.02Å; Y49-W90 AromaticContact CD1-CZ2 3.91Å; Y49-W90 HydrophobicContact CD1-CZ2 3.91Å; Y49-W90 AromaticContact CD2-CZ2 3.91Å; Y49-W90 HydrophobicContact CD2-CZ2 3.91Å; Y49-W90 AromaticContact CE1-CH2 3.45Å; Y49-W90 HydrophobicContact CE1-CH2 3.45Å; Y49-W90 VanDerWaalsContact CE1-CH2 3.45Å; Y49-W90 AromaticContact CE1-CZ2 3.76Å; Y49-W90 HydrophobicContact CE1-CZ2 3.76Å; Y49-W90 HydrophobicContact CE1-CZ3 4.44Å; Y49-W90 HydrophobicContact CE2-CH2 4Å; Y49-W90 AromaticContact CE2-CZ2 3.75Å; Y49-W90 HydrophobicContact CE2-CZ2 3.75Å; Y49-W90 AromaticContact CG-CZ2 3.99Å; Y49-W90 HydrophobicContact CG-CZ2 3.99Å; Y49-W90 AromaticContact CZ-CH2 3.44Å; Y49-W90 VanDerWaalsContact CZ-CH2 3.44Å; Y49-W90 AromaticContact CZ-CZ2 3.67Å; Y49-Q95 HydrophobicContact CD2-CG 4.39Å; Y49-Q95 HydrophobicContact CE2-CB 3.83Å; Y49-Q95 HydrophobicContact CE2-CG 4.01Å
50	E	96.6	Very high	94.3	Very high	81 Å²	81	73 Å²	73	38%	0.379	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.6	175.8	-62.3	-169.3	157.4	0	0	108.9	N33 R36 R48	N33-E50 VanDerWaalsContact ND2-CD 3.28Å; N33-E50 PolarHBondContact ND2-OE1 2.92Å; N33-E50 VanDerWaalsContact O-CA 3.32Å; N33-E50 WeakPolarHBondContact O-CA 3.45Å; R36-E50 IonicContact CZ-OE1 2.84Å; R36-E50 IonicContact NH1-OE1 3.72Å; R36-E50 IonicContact NH2-OE1 3.56Å; R36-E50 PolarHBondContact NH2-OE1 3.34Å; R48-E50 IonicContact CZ-OE1 3.32Å; R48-E50 IonicContact NE-OE1 3.29Å; R48-E50 PolarHBondContact NE-OE1 3.45Å; R48-E50 IonicContact NH2-OE1 2.66Å; R48-E50 PolarHBondContact NH2-OE1 2.91Å; R48-E50 IonicContact NH2-OE2 3.74Å
51	F	96.5	Very high	94.6	Very high	15 Å²	15	72.4 Å²	72.4	7%	0.066	35%	0.349	C	S	.	.			trans	-87.6	155	-178.8	-70.9	-69.4	0	0	0	111.2	N33 F35 Y49 I53 T57 V59 R81 W90 F97	N33-F51 PolarHBondContact O-N 2.79Å; N33-F51 VanDerWaalsContact O-N 3.09Å; F35-F51 HydrophobicContact CD1-CE2 4.06Å; F35-F51 HydrophobicContact CD1-CZ 4.35Å; F35-F51 HydrophobicContact CE1-CE2 4.21Å; F35-F51 HydrophobicContact CE1-CZ 4.05Å; Y49-F51 HydrophobicContact CD1-CD1 4.02Å; Y49-F51 AromaticContact CD1-CE1 3.82Å; Y49-F51 HydrophobicContact CD1-CE1 3.82Å; Y49-F51 HydrophobicContact CD1-CE2 4.3Å; Y49-F51 HydrophobicContact CD1-CG 4.36Å; Y49-F51 AromaticContact CD1-CZ 3.96Å; Y49-F51 HydrophobicContact CD1-CZ 3.96Å; Y49-F51 AromaticContact CE1-CD1 3.53Å; Y49-F51 HydrophobicContact CE1-CD1 3.53Å; Y49-F51 AromaticContact CE1-CE1 3.49Å; Y49-F51 HydrophobicContact CE1-CE1 3.49Å; Y49-F51 VanDerWaalsContact CE1-CE1 3.49Å; Y49-F51 HydrophobicContact CE1-CG 4.2Å; Y49-F51 HydrophobicContact CE1-CZ 4.12Å; F51-I53 PolarHBondContact O-N 2.78Å; F51-T57 HydrophobicContact CB-CG2 3.88Å; F51-T57 VanDerWaalsContact O-CG2 3.25Å; F51-T57 WeakPolarHBondContact O-CG2 3.42Å; F51-V59 HydrophobicContact CD2-CG2 4.17Å; F51-V59 HydrophobicContact CE2-CG2 3.61Å; F51-R81 HydrophobicContact CD1-CG 4.41Å; F51-R81 VanDerWaalsContact CD1-CZ 3.47Å; F51-R81 HydrophobicContact CD2-CG 4.18Å; F51-R81 HydrophobicContact CE1-CG 4.46Å; F51-R81 HydrophobicContact CE2-CG 4.26Å; F51-R81 HydrophobicContact CG-CG 4.28Å; F51-R81 HydrophobicContact CZ-CG 4.4Å; F51-W90 HydrophobicContact CE1-CE3 4.22Å; F51-W90 AromaticContact CE1-CH2 3.8Å; F51-W90 HydrophobicContact CE1-CH2 3.8Å; F51-W90 AromaticContact CE1-CZ3 3.56Å; F51-W90 HydrophobicContact CE1-CZ3 3.56Å; F51-W90 HydrophobicContact CZ-CE3 4.28Å; F51-W90 HydrophobicContact CZ-CH2 4.34Å; F51-W90 HydrophobicContact CZ-CZ3 4.05Å; F51-F97 AromaticContact CE1-CE2 3.88Å; F51-F97 HydrophobicContact CE1-CE2 3.88Å; F51-F97 AromaticContact CE1-CZ 3.95Å; F51-F97 HydrophobicContact CE1-CZ 3.95Å; F51-F97 HydrophobicContact CZ-CE2 4.26Å; F51-F97 AromaticContact CZ-CZ 3.84Å; F51-F97 HydrophobicContact CZ-CZ 3.84Å
52	D	93.7	Very high	95.1	Very high	62 Å²	62	68.2 Å²	68.2	33%	0.332	33%	0.326	S	S	.	.			trans	-64.6	131.1	170.5	-171.6	-29.8	0	0	0	110	R54 D55 T57	D52-R54 PolarHBondContact O-N 2.94Å; D52-R54 WeakPolarHBondContact OD1-CB 3.32Å; D52-R54 WeakPolarHBondContact OD1-CG 3.32Å; D52-R54 PolarHBondContact OD1-N 2.96Å; D52-R54 IonicContact OD1-NE 3.95Å; D52-R54 PolarHBondContact OD1-NE 3.41Å; D52-R54 IonicContact OD2-CZ 3.97Å; D52-R54 IonicContact OD2-NE 2.78Å; D52-R54 PolarHBondContact OD2-NE 2.94Å; D52-R54 VanDerWaalsContact OD2-NE 3.1Å; D52-R54 IonicContact OD2-NH2 3.88Å; D52-R54 PolarHBondContact OD2-NH2 2.86Å; D52-D55 PolarHBondContact O-N 2.82Å; D52-T57 VanDerWaalsContact O-CG2 3.3Å; D52-T57 WeakPolarHBondContact O-CG2 3.25Å
53	I	92.7	Very high	95.5	Very high	116 Å²	116	64.4 Å²	64.4	60%	0.595	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-56.3	-30.1	179.7	-165.6	67.4	0	0	0	113.1	F51 D55 G56 T57	F51-I53 PolarHBondContact O-N 2.78Å; I53-D55 VanDerWaalsContact C-N 3.27Å; I53-D55 PolarHBondContact O-N 2.87Å; I53-G56 PolarHBondContact O-N 3.06Å; I53-T57 HydrophobicContact CB-CG2 4.48Å; I53-T57 HydrophobicContact CD1-CG2 4.21Å
54	R	93.6	Very high	95.9	Very high	205 Å²	205	59.1 Å²	59.1	77%	0.774	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-66.7	-26.6	-176.3	-66.6	-179.2	-68.1	-171.3	3.1	113.6	D52	D52-R54 PolarHBondContact O-N 2.94Å; D52-R54 WeakPolarHBondContact OD1-CB 3.32Å; D52-R54 WeakPolarHBondContact OD1-CG 3.32Å; D52-R54 PolarHBondContact OD1-N 2.96Å; D52-R54 IonicContact OD1-NE 3.95Å; D52-R54 PolarHBondContact OD1-NE 3.41Å; D52-R54 IonicContact OD2-CZ 3.97Å; D52-R54 IonicContact OD2-NE 2.78Å; D52-R54 PolarHBondContact OD2-NE 2.94Å; D52-R54 VanDerWaalsContact OD2-NE 3.1Å; D52-R54 IonicContact OD2-NH2 3.88Å; D52-R54 PolarHBondContact OD2-NH2 2.86Å
55	D	92.3	Very high	96	Very high	102 Å²	102	52.7 Å²	52.7	55%	0.545	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-100.8	1.9	-176.9	-56.2	-34.6	0	0	0	112.9	D52 I53 R81	D52-D55 PolarHBondContact O-N 2.82Å; I53-D55 VanDerWaalsContact C-N 3.27Å; I53-D55 PolarHBondContact O-N 2.87Å; D55-R81 IonicContact OD2-NH1 3.93Å
56	G	95.4	Very high	95.9	Very high	12 Å²	12	50.6 Å²	50.6	12%	0.124	23%	0.234	C	C	.	.			trans	79.4	152	-163.8	0	0	0	0	0	112.1	I53 R81	I53-G56 PolarHBondContact O-N 3.06Å; G56-R81 WeakPolarHBondContact O-CD 3.19Å
57	T	96.9	Very high	95.9	Very high	7 Å²	7	51.4 Å²	51.4	4%	0.043	23%	0.232	C	C	.	.			trans	-136.6	-18.7	-165.4	55.5	0	0	0	0	115	Q32 N33 G34 F51 D52 I53 V59 H79	Q32-T57 CarbonylContact O-C 3.28Å; Q32-T57 PolarHBondContact O-OG1 3.01Å; N33-T57 CarbonylContact C-O 3.57Å; N33-T57 VanDerWaalsContact C-O 3.28Å; G34-T57 PolarHBondContact N-O 3.16Å; F51-T57 HydrophobicContact CB-CG2 3.88Å; F51-T57 VanDerWaalsContact O-CG2 3.25Å; F51-T57 WeakPolarHBondContact O-CG2 3.42Å; D52-T57 VanDerWaalsContact O-CG2 3.3Å; D52-T57 WeakPolarHBondContact O-CG2 3.25Å; I53-T57 HydrophobicContact CB-CG2 4.48Å; I53-T57 HydrophobicContact CD1-CG2 4.21Å; T57-V59 PolarHBondContact O-N 2.95Å; T57-H79 PolarHBondContact N-O 2.97Å
58	G	96.7	Very high	95.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-73.1	127.3	-175.4	0	0	0	0	0	113.3	M31 Q32 G76 H79 R81	M31-G58 WeakPolarHBondContact O-CA 3.4Å; Q32-G58 WeakPolarHBondContact O-CA 3.46Å; Q32-G58 PolarHBondContact O-N 2.83Å; G58-G76 CarbonylContact C-O 3.58Å; G58-G76 VanDerWaalsContact CA-O 3.25Å; G58-G76 WeakPolarHBondContact CA-O 3.4Å; G58-G76 PolarHBondContact O-N 3.32Å; G58-H79 PolarHBondContact N-O 2.81Å; G58-R81 PolarHBondContact O-N 2.89Å
59	V	97.7	Very high	95.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	106.6	174.9	176.4	0	0	0	0	109.2	G30 M31 G34 F35 F51 T57 M62 I73	G30-V59 CarbonylContact C-O 3.56Å; G30-V59 VanDerWaalsContact C-O 3.27Å; G30-V59 VanDerWaalsContact CA-O 3.28Å; G30-V59 WeakPolarHBondContact CA-O 3.41Å; M31-V59 PolarHBondContact N-O 3.41Å; M31-V59 PolarHBondContact O-N 3.18Å; G34-V59 WeakPolarHBondContact O-CB 3.28Å; G34-V59 WeakPolarHBondContact O-CG2 3.46Å; F35-V59 HydrophobicContact CD1-CG2 4.42Å; F51-V59 HydrophobicContact CD2-CG2 4.17Å; F51-V59 HydrophobicContact CE2-CG2 3.61Å; T57-V59 PolarHBondContact O-N 2.95Å; V59-M62 HydrophobicContact CG1-CG 3.52Å; V59-M62 HydrophobicContact CG1-SD 4Å; V59-I73 HydrophobicContact CG1-CG2 3.99Å; V59-I73 HydrophobicContact CG2-CG2 4.36Å
60	G	96.3	Very high	95.7	Very high	6 Å²	6	38.8 Å²	38.8	6%	0.062	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-8.2	-173.2	0	0	0	0	0	115.4	R4 L74	R4-G60 PolarHBondContact NE-O 3.39Å; G60-L74 PolarHBondContact N-O 3.05Å
61	Y	97.9	Very high	95.8	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.016	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	142.7	176.7	-173.7	-82.5	0	0	0	110.3	F17 E63 L74 I110 R111	F17-Y61 AromaticContact CD2-CD2 3.82Å; F17-Y61 HydrophobicContact CD2-CD2 3.82Å; F17-Y61 HydrophobicContact CD2-CG 4.22Å; F17-Y61 AromaticContact CE2-CD2 3.3Å; F17-Y61 HydrophobicContact CE2-CD2 3.3Å; F17-Y61 AromaticContact CE2-CE2 3.59Å; F17-Y61 HydrophobicContact CE2-CE2 3.59Å; F17-Y61 AromaticContact CE2-CG 3.85Å; F17-Y61 HydrophobicContact CE2-CG 3.85Å; F17-Y61 HydrophobicContact CZ-CD2 4.04Å; F17-Y61 HydrophobicContact CZ-CE2 4.13Å; F17-Y61 HydrophobicContact CZ-CG 4.3Å; Y61-E63 HydrophobicContact CE1-CB 4.23Å; Y61-L74 HydrophobicContact CD1-CD1 3.9Å; Y61-L74 HydrophobicContact CD1-CG 4.07Å; Y61-L74 HydrophobicContact CG-CD1 3.9Å; Y61-L74 HydrophobicContact CG-CG 4.31Å; Y61-L74 PolarHBondContact N-O 3.03Å; Y61-L74 PolarHBondContact O-N 3.48Å; Y61-I110 HydrophobicContact CD1-CG2 3.86Å; Y61-I110 HydrophobicContact CE1-CG2 3.72Å; Y61-I110 WeakPolarHBondContact CE1-O 3.49Å; Y61-I110 PolarHBondContact OH-O 3.16Å; Y61-R111 PolarHBondContact OH-NH1 3.24Å
62	M	97.9	Very high	95.9	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145.8	175.4	-59.8	-179.2	74.1	0	0	111.8	F17 A28 F35 V59 L71 G72	F17-M62 HydrophobicContact CD1-CB 4.02Å; F17-M62 HydrophobicContact CD1-CG 4.32Å; F17-M62 HydrophobicContact CE1-CB 3.78Å; F17-M62 VanDerWaalsContact CE1-N 3.3Å; F17-M62 WeakPolarHBondContact CE1-O 3.26Å; F17-M62 WeakPolarHBondContact CZ-O 3.4Å; A28-M62 HydrophobicContact CB-CB 4.08Å; A28-M62 HydrophobicContact CB-CE 4.09Å; A28-M62 HydrophobicContact CB-SD 3.92Å; F35-M62 HydrophobicContact CB-CE 3.55Å; F35-M62 HydrophobicContact CB-SD 3.36Å; F35-M62 WeakPolarHBondContact CB-SD 3.26Å; F35-M62 HydrophobicContact CD1-CE 4.15Å; F35-M62 HydrophobicContact CD2-CE 3.56Å; F35-M62 HydrophobicContact CD2-SD 4.48Å; F35-M62 HydrophobicContact CE2-CE 4.27Å; F35-M62 HydrophobicContact CG-CE 3.49Å; F35-M62 VanDerWaalsContact CG-CE 3.49Å; F35-M62 HydrophobicContact CG-SD 4.03Å; V59-M62 HydrophobicContact CG1-CG 3.52Å; V59-M62 HydrophobicContact CG1-SD 4Å; M62-L71 HydrophobicContact CE-CD1 3.92Å; M62-G72 CarbonylContact C-O 3.48Å; M62-G72 VanDerWaalsContact CA-O 3.29Å; M62-G72 WeakPolarHBondContact CA-O 3.49Å
63	E	97.8	Very high	96.1	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.056	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	111.9	167.7	179.6	76.8	176.1	0	0	108.1	Y61 L71 G72 I110 R111 L112	Y61-E63 HydrophobicContact CE1-CB 4.23Å; E63-L71 CarbonylContact O-C 3.52Å; E63-L71 WeakPolarHBondContact O-CA 3.08Å; E63-G72 PolarHBondContact N-O 3.48Å; E63-G72 PolarHBondContact O-N 2.78Å; E63-I110 HydrophobicContact CB-CG2 4.09Å; E63-I110 WeakPolarHBondContact CB-O 3.41Å; E63-R111 WeakPolarHBondContact OE1-CD 3.38Å; E63-R111 IonicContact OE1-NE 2.74Å; E63-R111 WeakPolarHBondContact OE2-CD 3.34Å; E63-R111 IonicContact OE2-NE 3.34Å; E63-L112 HydrophobicContact CB-CG 4.49Å; E63-L112 HydrophobicContact CG-CB 4.16Å; E63-L112 HydrophobicContact CG-CD1 4.17Å; E63-L112 HydrophobicContact CG-CG 3.85Å
64	M	97.5	Very high	96.4	Very high	10 Å²	10	26.2 Å²	26.2	5%	0.049	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	141.4	169.4	-60.3	175.8	67.1	0	0	108.9	N21 Q22 C26 A28 I37 F66 L71	N21-M64 HydrophobicContact CB-CB 3.88Å; N21-M64 HydrophobicContact CB-CE 4.31Å; N21-M64 HydrophobicContact CB-CG 4.42Å; N21-M64 HydrophobicContact CB-SD 3.86Å; Q22-M64 VanDerWaalsContact CD-O 3.29Å; Q22-M64 PolarHBondContact NE2-O 2.99Å; Q22-M64 PolarHBondContact OE1-O 3.27Å; C26-M64 HydrophobicContact CB-CE 3.64Å; C26-M64 HydrophobicContact CB-SD 3.95Å; A28-M64 HydrophobicContact CB-CG 4Å; A28-M64 HydrophobicContact CB-SD 3.99Å; I37-M64 HydrophobicContact CD1-CE 4.32Å; I37-M64 HydrophobicContact CG2-CE 3.55Å; I37-M64 HydrophobicContact CG2-SD 4Å; M64-F66 PolarHBondContact O-N 2.85Å; M64-L71 HydrophobicContact CB-CD2 4.22Å; M64-L71 HydrophobicContact CG-CD2 3.88Å
65	L	96.6	Very high	96.6	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.091	C	C	.	.			trans	-89.5	92.9	161.2	178.2	60.4	0	0	0	108.4	R67 T68 L70 L112 F130 I216	L65-R67 PolarHBondContact O-N 2.92Å; L65-T68 HydrophobicContact CG-CG2 4.44Å; L65-T68 WeakPolarHBondContact O-CB 3.49Å; L65-T68 WeakPolarHBondContact O-CG2 3.4Å; L65-T68 PolarHBondContact O-N 2.84Å; L65-T68 PolarHBondContact O-OG1 2.96Å; L65-L70 HydrophobicContact CB-CB 4.4Å; L65-L70 WeakPolarHBondContact CB-O 3.35Å; L65-L70 HydrophobicContact CD2-CB 4.42Å; L65-L70 HydrophobicContact CD2-CD1 4.47Å; L65-L70 PolarHBondContact N-O 3Å; L65-L112 HydrophobicContact CB-CB 4.33Å; L65-L112 HydrophobicContact CB-CD1 3.97Å; L65-L112 HydrophobicContact CD1-CB 3.99Å; L65-F130 HydrophobicContact CD2-CE2 4.02Å; L65-F130 HydrophobicContact CD2-CZ 3.95Å; L65-I216 HydrophobicContact CD2-CD1 4.07Å
66	F	94.1	Very high	96.7	Very high	47 Å²	47	13.3 Å²	13.3	21%	0.206	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	-117.7	-173.1	-69.9	-88	0	0	0	112.1	N21 Q22 M64 H114 Q154	N21-F66 WeakPolarHBondContact CB-O 3.48Å; N21-F66 PolarHBondContact ND2-O 3.36Å; Q22-F66 HydrophobicContact CB-CD1 3.78Å; Q22-F66 HydrophobicContact CB-CE1 3.63Å; Q22-F66 HydrophobicContact CB-CG 4.35Å; Q22-F66 HydrophobicContact CB-CZ 4.08Å; Q22-F66 HydrophobicContact CG-CD1 4.41Å; Q22-F66 HydrophobicContact CG-CD2 4.48Å; Q22-F66 HydrophobicContact CG-CE1 4.28Å; Q22-F66 HydrophobicContact CG-CE2 4.35Å; Q22-F66 HydrophobicContact CG-CZ 4.28Å; M64-F66 PolarHBondContact O-N 2.85Å; F66-H114 AromaticContact CD2-CE1 3.81Å; F66-H114 AromaticContact CD2-NE2 3.29Å; F66-H114 VanDerWaalsContact CD2-NE2 3.29Å; F66-H114 WeakPolarHBondContact CD2-NE2 3.1Å; F66-H114 AromaticContact CE2-CD2 3.67Å; F66-H114 AromaticContact CE2-NE2 3.33Å; F66-H114 VanDerWaalsContact CE2-NE2 3.33Å; F66-H114 WeakPolarHBondContact CE2-NE2 3.3Å; F66-Q154 HydrophobicContact CE2-CG 4.44Å; F66-Q154 HydrophobicContact CZ-CB 3.77Å; F66-Q154 HydrophobicContact CZ-CG 3.89Å
67	R	93.5	Very high	96.6	Very high	98 Å²	98	14.6 Å²	14.6	37%	0.37	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	27.8	173.2	-64.9	-176.5	175.2	-113.1	6.6	111.1	G25 C26 N39 L65	G25-R67 VanDerWaalsContact CA-NH2 3.25Å; G25-R67 PolarHBondContact O-NH2 3.17Å; C26-R67 PolarHBondContact SG-NH1 2.62Å; N39-R67 PolarHBondContact OD1-NH1 3.12Å; N39-R67 PolarHBondContact OD1-NH2 3.34Å; N39-R67 VanDerWaalsContact OD1-NH2 3.07Å; L65-R67 PolarHBondContact O-N 2.92Å
68	T	94.9	Very high	96.4	Very high	14 Å²	14	20.3 Å²	20.3	9%	0.086	12%	0.118	C	C	.	.	S	Bend	trans	-81.3	173.2	174.2	74.5	0	0	0	0	110.4	L65 L70 N214 I216	L65-T68 HydrophobicContact CG-CG2 4.44Å; L65-T68 WeakPolarHBondContact O-CB 3.49Å; L65-T68 WeakPolarHBondContact O-CG2 3.4Å; L65-T68 PolarHBondContact O-N 2.84Å; L65-T68 PolarHBondContact O-OG1 2.96Å; T68-L70 PolarHBondContact O-N 2.8Å; T68-L70 PolarHBondContact OG1-N 3.4Å; T68-N214 WeakPolarHBondContact CB-O 3.07Å; T68-N214 HydrophobicContact CG2-CB 4.4Å; T68-N214 WeakPolarHBondContact CG2-O 3.37Å; T68-I216 HydrophobicContact CG2-CD1 3.75Å; T68-I216 HydrophobicContact CG2-CG1 4.15Å
69	N	94.7	Very high	96.2	Very high	20 Å²	20	25.7 Å²	25.7	11%	0.107	14%	0.143	C	C	.	.	S	Bend	trans	-72.4	-10.1	174	58.9	-59.5	0	0	0	113.7	D91 G92 I93 I216	N69-D91 VanDerWaalsContact ND2-CG 3.27Å; N69-D91 PolarHBondContact ND2-OD1 3Å; N69-G92 PolarHBondContact O-N 2.92Å; N69-I93 HydrophobicContact CB-CB 4.45Å; N69-I93 HydrophobicContact CB-CD1 3.67Å; N69-I93 HydrophobicContact CB-CG1 3.67Å; N69-I216 PolarHBondContact OD1-N 2.82Å
70	L	96.9	Very high	96.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.5	-174	-61.6	-179	0	0	0	111.8	L65 T68 W90 D91 V98 F130 I216 I218	L65-L70 HydrophobicContact CB-CB 4.4Å; L65-L70 WeakPolarHBondContact CB-O 3.35Å; L65-L70 HydrophobicContact CD2-CB 4.42Å; L65-L70 HydrophobicContact CD2-CD1 4.47Å; L65-L70 PolarHBondContact N-O 3Å; T68-L70 PolarHBondContact O-N 2.8Å; T68-L70 PolarHBondContact OG1-N 3.4Å; L70-W90 WeakPolarHBondContact CA-O 3.35Å; L70-D91 HydrophobicContact CD2-CB 4.15Å; L70-V98 HydrophobicContact CD2-CG2 4.45Å; L70-F130 HydrophobicContact CD1-CE1 3.7Å; L70-F130 HydrophobicContact CD1-CZ 3.58Å; L70-I216 HydrophobicContact CD1-CB 4Å; L70-I216 HydrophobicContact CD1-CG2 3.83Å; L70-I218 HydrophobicContact CD1-CD1 4.26Å; L70-I218 HydrophobicContact CD1-CG1 3.82Å; L70-I218 HydrophobicContact CD2-CD1 3.95Å; L70-I218 HydrophobicContact CD2-CG1 4.23Å
71	L	98	Very high	96.2	Very high	5 Å²	5	30 Å²	30	3%	0.026	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.5	179	-49.9	173.7	0	0	0	109.8	F35 I37 M62 E63 M64 I73 L89 W90	F35-L71 HydrophobicContact CD2-CD1 4.45Å; F35-L71 HydrophobicContact CE2-CD1 3.81Å; F35-L71 HydrophobicContact CZ-CD1 3.96Å; I37-L71 HydrophobicContact CD1-CD1 3.91Å; I37-L71 HydrophobicContact CD1-CD2 3.88Å; M62-L71 HydrophobicContact CE-CD1 3.92Å; E63-L71 CarbonylContact O-C 3.52Å; E63-L71 WeakPolarHBondContact O-CA 3.08Å; M64-L71 HydrophobicContact CB-CD2 4.22Å; M64-L71 HydrophobicContact CG-CD2 3.88Å; L71-I73 HydrophobicContact CB-CG1 4.24Å; L71-L89 CarbonylContact O-C 3.46Å; L71-L89 WeakPolarHBondContact O-CA 3.39Å; L71-W90 HydrophobicContact CB-CB 4.29Å; L71-W90 PolarHBondContact N-O 3.38Å; L71-W90 PolarHBondContact O-N 3.28Å
72	G	98.4	Very high	96.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	126.4	163.3	0	0	0	0	0	109.7	M62 E63 C88	M62-G72 CarbonylContact C-O 3.48Å; M62-G72 VanDerWaalsContact CA-O 3.29Å; M62-G72 WeakPolarHBondContact CA-O 3.49Å; E63-G72 PolarHBondContact N-O 3.48Å; E63-G72 PolarHBondContact O-N 2.78Å; G72-C88 WeakPolarHBondContact CA-O 3.5Å
73	I	98.5	Very high	96.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.5	-176	-63.1	-171.5	0	0	0	109.9	F35 V59 L71 L82 C88 W90 F97	F35-I73 HydrophobicContact CD1-CD1 4.28Å; F35-I73 HydrophobicContact CE1-CD1 4.07Å; V59-I73 HydrophobicContact CG1-CG2 3.99Å; V59-I73 HydrophobicContact CG2-CG2 4.36Å; L71-I73 HydrophobicContact CB-CG1 4.24Å; I73-L82 HydrophobicContact CB-CD1 4.45Å; I73-L82 HydrophobicContact CG2-CD1 3.89Å; I73-C88 PolarHBondContact N-O 2.75Å; I73-C88 PolarHBondContact O-N 2.71Å; I73-W90 HydrophobicContact CD1-CB 3.54Å; I73-W90 HydrophobicContact CD1-CD2 4.44Å; I73-W90 HydrophobicContact CD1-CG 3.91Å; I73-W90 HydrophobicContact CG1-CB 4.13Å; I73-F97 HydrophobicContact CB-CE1 4.35Å; I73-F97 HydrophobicContact CD1-CE1 4.3Å; I73-F97 HydrophobicContact CG2-CE1 4.36Å
74	L	98.6	Very high	96.1	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	149.4	164.8	-43.1	175.1	0	0	0	109.7	G60 Y61 A87 V107 I110	G60-L74 PolarHBondContact N-O 3.05Å; Y61-L74 HydrophobicContact CD1-CD1 3.9Å; Y61-L74 HydrophobicContact CD1-CG 4.07Å; Y61-L74 HydrophobicContact CG-CD1 3.9Å; Y61-L74 HydrophobicContact CG-CG 4.31Å; Y61-L74 PolarHBondContact N-O 3.03Å; Y61-L74 PolarHBondContact O-N 3.48Å; L74-A87 HydrophobicContact CD2-CB 3.43Å; L74-A87 VanDerWaalsContact CD2-CB 3.43Å; L74-V107 HydrophobicContact CD1-CB 4.37Å; L74-V107 HydrophobicContact CD1-CG1 3.82Å; L74-V107 HydrophobicContact CD2-CB 4.11Å; L74-V107 HydrophobicContact CD2-CG1 3.64Å; L74-V107 HydrophobicContact CG-CG1 4.42Å; L74-I110 HydrophobicContact CD2-CB 4.44Å; L74-I110 HydrophobicContact CD2-CG2 4.18Å; L74-I110 HydrophobicContact CG-CG2 4.2Å
75	G	97.6	Very high	96.1	Very high	18 Å²	18	38.8 Å²	38.8	19%	0.186	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	162.2	174.7	0	0	0	0	0	113.5	S80	G75-S80 VanDerWaalsContact C-OG 3.24Å; G75-S80 WeakPolarHBondContact CA-OG 3.42Å
76	G	94.8	Very high	96.2	Very high	19 Å²	19	39 Å²	39	20%	0.196	22%	0.223	C	C	.	.			trans	178.2	-175.3	170.1	0	0	0	0	0	112.7	G58 S80	G58-G76 CarbonylContact C-O 3.58Å; G58-G76 VanDerWaalsContact CA-O 3.25Å; G58-G76 WeakPolarHBondContact CA-O 3.4Å; G58-G76 PolarHBondContact O-N 3.32Å; G76-S80 PolarHBondContact N-OG 3.49Å; G76-S80 WeakPolarHBondContact O-CA 3.48Å
77	G	93.1	Very high	96.4	Very high	38 Å²	38	36.9 Å²	36.9	39%	0.392	21%	0.214	S	C	.	.	S	Bend	trans	74.6	-168.8	-177.7	0	0	0	0	0	113.5	H79	G77-H79 VanDerWaalsContact C-N 3.34Å; G77-H79 PolarHBondContact O-N 3.11Å
78	N	92	Very high	96.6	Very high	127 Å²	127	32.3 Å²	32.3	68%	0.679	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-25.1	-171.3	-57.5	-22.3	0	0	0	113.6	Q32	Q32-N78 VanDerWaalsContact NE2-N 3.19Å
79	H	93.4	Very high	96.8	Very high	114 Å²	114	31.8 Å²	31.8	53%	0.528	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.3	68.2	-177.3	-63.3	141.5	0	0	0	108.1	Q32 T57 G58 G77 R81	Q32-H79 VanDerWaalsContact NE2-N 3.16Å; T57-H79 PolarHBondContact N-O 2.97Å; G58-H79 PolarHBondContact N-O 2.81Å; G77-H79 VanDerWaalsContact C-N 3.34Å; G77-H79 PolarHBondContact O-N 3.11Å; H79-R81 PolarHBondContact O-N 2.95Å
80	S	96.2	Very high	96.9	Very high	45 Å²	45	31 Å²	31	32%	0.315	19%	0.189	S	C	.	.	B	Isolated β-bridge	trans	-58.2	133.4	-172.8	-172.2	0	0	0	0	112.6	G75 G76 L82	G75-S80 VanDerWaalsContact C-OG 3.24Å; G75-S80 WeakPolarHBondContact CA-OG 3.42Å; G76-S80 PolarHBondContact N-OG 3.49Å; G76-S80 WeakPolarHBondContact O-CA 3.48Å; S80-L82 VanDerWaalsContact C-N 3.29Å; S80-L82 PolarHBondContact O-N 3.08Å; S80-L82 PolarHBondContact OG-N 2.8Å; S80-L82 PolarHBondContact OG-O 3.17Å
81	R	96.9	Very high	96.9	Very high	52 Å²	52	31.3 Å²	31.3	20%	0.196	19%	0.191	C	C	.	.	S	Bend	trans	-68.3	-27.6	174.6	175.4	60.5	-171.5	-143.9	1.4	113.2	F51 D55 G56 G58 H79 F97	F51-R81 HydrophobicContact CD1-CG 4.41Å; F51-R81 VanDerWaalsContact CD1-CZ 3.47Å; F51-R81 HydrophobicContact CD2-CG 4.18Å; F51-R81 HydrophobicContact CE1-CG 4.46Å; F51-R81 HydrophobicContact CE2-CG 4.26Å; F51-R81 HydrophobicContact CG-CG 4.28Å; F51-R81 HydrophobicContact CZ-CG 4.4Å; D55-R81 IonicContact OD2-NH1 3.93Å; G56-R81 WeakPolarHBondContact O-CD 3.19Å; G58-R81 PolarHBondContact O-N 2.89Å; H79-R81 PolarHBondContact O-N 2.95Å; R81-F97 HydrophobicContact CG-CE2 4.29Å; R81-F97 HydrophobicContact CG-CZ 4.04Å
82	L	97.3	Very high	96.8	Very high	15 Å²	15	32.3 Å²	32.3	8%	0.079	20%	0.202	C	C	.	.	S	Bend	trans	-131.8	147.4	-176.4	-60.6	170.9	0	0	0	110.1	I73 S80 C88 F97	I73-L82 HydrophobicContact CB-CD1 4.45Å; I73-L82 HydrophobicContact CG2-CD1 3.89Å; S80-L82 VanDerWaalsContact C-N 3.29Å; S80-L82 PolarHBondContact O-N 3.08Å; S80-L82 PolarHBondContact OG-N 2.8Å; S80-L82 PolarHBondContact OG-O 3.17Å; L82-C88 HydrophobicContact CD1-CB 3.96Å; L82-F97 HydrophobicContact CD1-CE1 4.19Å; L82-F97 HydrophobicContact CD2-CE1 4.44Å; L82-F97 HydrophobicContact CD2-CZ 4.32Å
83	P	97.5	Very high	96.6	Very high	77 Å²	77	37.5 Å²	37.5	50%	0.5	23%	0.229	S	C	.	.			trans	-58.4	152.4	169	-23	33.9	0	0	0	112.3	N85 V86	P83-N85 WeakPolarHBondContact CB-OD1 3.46Å; P83-N85 PolarHBondContact O-N 3.06Å; P83-N85 VanDerWaalsContact O-N 3.17Å; P83-V86 HydrophobicContact CB-CB 4.36Å; P83-V86 HydrophobicContact CB-CG2 3.95Å; P83-V86 HydrophobicContact CG-CG2 4.05Å; P83-V86 PolarHBondContact O-N 3.15Å; P83-V86 VanDerWaalsContact O-N 3.12Å
84	S	97.4	Very high	96.5	Very high	70 Å²	70	42.5 Å²	42.5	49%	0.49	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.5	-175.8	59.7	0	0	0	0	114.1	D106 V107	S84-D106 VanDerWaalsContact CB-OD1 3.27Å; S84-D106 WeakPolarHBondContact CB-OD1 3.29Å; S84-D106 CarbonylContact O-C 3.58Å; S84-D106 WeakPolarHBondContact O-CA 3.32Å; S84-D106 PolarHBondContact OG-OD1 2.86Å; S84-V107 PolarHBondContact O-N 2.87Å
85	N	98.3	Very high	96.3	Very high	50 Å²	50	47.3 Å²	47.3	27%	0.267	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	9	179.3	70.9	-47.3	0	0	0	113.4	P83 C103 T105	P83-N85 WeakPolarHBondContact CB-OD1 3.46Å; P83-N85 PolarHBondContact O-N 3.06Å; P83-N85 VanDerWaalsContact O-N 3.17Å; N85-C103 WeakPolarHBondContact CB-O 3.35Å; N85-C103 PolarHBondContact ND2-O 2.94Å; N85-C103 WeakPolarHBondContact O-CB 3.36Å; N85-C103 PolarHBondContact O-N 3.39Å; N85-T105 WeakPolarHBondContact CB-O 3.39Å
86	V	98.5	Very high	96.2	Very high	6 Å²	6	51.2 Å²	51.2	4%	0.036	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.2	-177.5	174.7	0	0	0	0	110.4	P83 E100 T102	P83-V86 HydrophobicContact CB-CB 4.36Å; P83-V86 HydrophobicContact CB-CG2 3.95Å; P83-V86 HydrophobicContact CG-CG2 4.05Å; P83-V86 PolarHBondContact O-N 3.15Å; P83-V86 VanDerWaalsContact O-N 3.12Å; V86-E100 HydrophobicContact CG1-CG 3.49Å; V86-E100 VanDerWaalsContact CG1-CG 3.49Å; V86-T102 HydrophobicContact CG2-CG2 4.13Å
87	A	98.5	Very high	96.3	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.017	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.6	169.2	0	0	0	0	0	110.2	L74 I101 V107 I110 I119	L74-A87 HydrophobicContact CD2-CB 3.43Å; L74-A87 VanDerWaalsContact CD2-CB 3.43Å; A87-I101 PolarHBondContact N-O 3.21Å; A87-I101 PolarHBondContact O-N 3.25Å; A87-V107 HydrophobicContact CB-CG1 4.23Å; A87-V107 HydrophobicContact CB-CG2 4.38Å; A87-I110 HydrophobicContact CB-CD1 4.29Å; A87-I119 HydrophobicContact CB-CD1 3.64Å
88	C	97.9	Very high	96.4	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.014	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	153	-179	-62.3	0	0	0	0	112.3	G72 I73 L82 F97 L99	G72-C88 WeakPolarHBondContact CA-O 3.5Å; I73-C88 PolarHBondContact N-O 2.75Å; I73-C88 PolarHBondContact O-N 2.71Å; L82-C88 HydrophobicContact CD1-CB 3.96Å; C88-F97 HydrophobicContact CB-CD1 3.44Å; C88-F97 VanDerWaalsContact CB-CD1 3.44Å; C88-F97 HydrophobicContact CB-CE1 3.87Å; C88-F97 HydrophobicContact CB-CG 4.36Å; C88-L99 CarbonylContact C-O 3.34Å; C88-L99 WeakPolarHBondContact CA-O 3.14Å; C88-L99 WeakPolarHBondContact CB-O 3.44Å
89	L	98.2	Very high	96.7	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.9	158.6	-60.6	-174.9	0	0	0	109.8	L71 F97 V98 L99 I110 L112 I117 F130 I218	L71-L89 CarbonylContact O-C 3.46Å; L71-L89 WeakPolarHBondContact O-CA 3.39Å; L89-F97 WeakPolarHBondContact O-CA 3.04Å; L89-V98 HydrophobicContact CB-CG2 4Å; L89-V98 VanDerWaalsContact O-CG2 3.28Å; L89-V98 WeakPolarHBondContact O-CG2 3.44Å; L89-V98 PolarHBondContact O-N 2.81Å; L89-L99 HydrophobicContact CB-CB 4.01Å; L89-L99 HydrophobicContact CD1-CB 4.3Å; L89-L99 HydrophobicContact CD1-CD2 3.78Å; L89-L99 HydrophobicContact CG-CB 4.19Å; L89-L99 HydrophobicContact CG-CD2 4.05Å; L89-L99 PolarHBondContact N-O 3.01Å; L89-I110 HydrophobicContact CD2-CD1 4.16Å; L89-L112 HydrophobicContact CD2-CD1 4.07Å; L89-L112 HydrophobicContact CD2-CD2 3.88Å; L89-I117 HydrophobicContact CD1-CD1 3.84Å; L89-I117 HydrophobicContact CG-CD1 4.47Å; L89-F130 HydrophobicContact CD1-CE1 4.2Å; L89-F130 HydrophobicContact CD1-CE2 4.09Å; L89-F130 HydrophobicContact CD1-CZ 3.72Å; L89-I218 HydrophobicContact CB-CD1 4.21Å; L89-I218 HydrophobicContact CD1-CD1 3.81Å
90	W	98	Very high	96.9	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.6	173.6	173.7	-88	0	0	0	109.6	F35 Y49 F51 L70 L71 I73 Q95 Q96 F97	F35-W90 AromaticContact CZ-NE1 3.66Å; Y49-W90 HydrophobicContact CD1-CH2 4.02Å; Y49-W90 AromaticContact CD1-CZ2 3.91Å; Y49-W90 HydrophobicContact CD1-CZ2 3.91Å; Y49-W90 AromaticContact CD2-CZ2 3.91Å; Y49-W90 HydrophobicContact CD2-CZ2 3.91Å; Y49-W90 AromaticContact CE1-CH2 3.45Å; Y49-W90 HydrophobicContact CE1-CH2 3.45Å; Y49-W90 VanDerWaalsContact CE1-CH2 3.45Å; Y49-W90 AromaticContact CE1-CZ2 3.76Å; Y49-W90 HydrophobicContact CE1-CZ2 3.76Å; Y49-W90 HydrophobicContact CE1-CZ3 4.44Å; Y49-W90 HydrophobicContact CE2-CH2 4Å; Y49-W90 AromaticContact CE2-CZ2 3.75Å; Y49-W90 HydrophobicContact CE2-CZ2 3.75Å; Y49-W90 AromaticContact CG-CZ2 3.99Å; Y49-W90 HydrophobicContact CG-CZ2 3.99Å; Y49-W90 AromaticContact CZ-CH2 3.44Å; Y49-W90 VanDerWaalsContact CZ-CH2 3.44Å; Y49-W90 AromaticContact CZ-CZ2 3.67Å; F51-W90 HydrophobicContact CE1-CE3 4.22Å; F51-W90 AromaticContact CE1-CH2 3.8Å; F51-W90 HydrophobicContact CE1-CH2 3.8Å; F51-W90 AromaticContact CE1-CZ3 3.56Å; F51-W90 HydrophobicContact CE1-CZ3 3.56Å; F51-W90 HydrophobicContact CZ-CE3 4.28Å; F51-W90 HydrophobicContact CZ-CH2 4.34Å; F51-W90 HydrophobicContact CZ-CZ3 4.05Å; L70-W90 WeakPolarHBondContact CA-O 3.35Å; L71-W90 HydrophobicContact CB-CB 4.29Å; L71-W90 PolarHBondContact N-O 3.38Å; L71-W90 PolarHBondContact O-N 3.28Å; I73-W90 HydrophobicContact CD1-CB 3.54Å; I73-W90 HydrophobicContact CD1-CD2 4.44Å; I73-W90 HydrophobicContact CD1-CG 3.91Å; I73-W90 HydrophobicContact CG1-CB 4.13Å; W90-Q95 HydrophobicContact CH2-CB 4.31Å; W90-Q95 WeakPolarHBondContact CH2-O 3.34Å; W90-Q95 HydrophobicContact CZ2-CB 3.9Å; W90-Q96 VanDerWaalsContact CZ3-CA 3.5Å; W90-F97 HydrophobicContact CB-CD1 4.37Å; W90-F97 HydrophobicContact CB-CE1 4.43Å; W90-F97 AromaticContact CE3-CD1 3.89Å; W90-F97 HydrophobicContact CE3-CD1 3.89Å; W90-F97 AromaticContact CE3-CD2 3.98Å; W90-F97 HydrophobicContact CE3-CD2 3.98Å; W90-F97 AromaticContact CE3-CE1 3.85Å; W90-F97 HydrophobicContact CE3-CE1 3.85Å; W90-F97 AromaticContact CE3-CE2 3.9Å; W90-F97 HydrophobicContact CE3-CE2 3.9Å; W90-F97 AromaticContact CE3-CG 3.98Å; W90-F97 HydrophobicContact CE3-CG 3.98Å; W90-F97 AromaticContact CE3-CZ 3.85Å; W90-F97 HydrophobicContact CE3-CZ 3.85Å; W90-F97 AromaticContact CZ3-CD2 4Å; W90-F97 HydrophobicContact CZ3-CD2 4Å; W90-F97 AromaticContact CZ3-CE2 3.85Å; W90-F97 HydrophobicContact CZ3-CE2 3.85Å; W90-F97 HydrophobicContact CZ3-CG 4.42Å; W90-F97 HydrophobicContact CZ3-CZ 4.2Å
91	D	96.9	Very high	97	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	110.2	171.8	-176.6	-22.7	0	0	0	109	N69 L70 I93 K94 Q95 Q96 V98	N69-D91 VanDerWaalsContact ND2-CG 3.27Å; N69-D91 PolarHBondContact ND2-OD1 3Å; L70-D91 HydrophobicContact CD2-CB 4.15Å; D91-I93 VanDerWaalsContact C-N 3.26Å; D91-I93 PolarHBondContact O-N 3.02Å; D91-I93 WeakPolarHBondContact OD1-CB 3.45Å; D91-I93 PolarHBondContact OD1-N 3.07Å; D91-K94 HydrophobicContact CB-CB 4.13Å; D91-K94 PolarHBondContact O-N 3.05Å; D91-K94 PolarHBondContact OD1-N 3.11Å; D91-K94 WeakPolarHBondContact OD2-CD 3.33Å; D91-K94 WeakPolarHBondContact OD2-CG 3.3Å; D91-Q95 VanDerWaalsContact O-CA 3.29Å; D91-Q95 WeakPolarHBondContact O-CA 3.47Å; D91-Q95 PolarHBondContact O-N 2.77Å; D91-Q96 PolarHBondContact N-O 2.94Å; D91-Q96 PolarHBondContact O-N 3.2Å; D91-V98 HydrophobicContact CB-CB 4.44Å; D91-V98 HydrophobicContact CB-CG1 3.58Å; D91-V98 HydrophobicContact CB-CG2 3.94Å
92	G	95	Very high	97	Very high	25 Å²	25	48 Å²	48	26%	0.258	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-24.2	-179.6	0	0	0	0	0	114.6	N69	N69-G92 PolarHBondContact O-N 2.92Å
93	I	94.6	Very high	97	Very high	109 Å²	109	47.8 Å²	47.8	56%	0.559	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-45.8	177.3	-67.6	166.7	0	0	0	109.8	N69 D91 Q95 T215	N69-I93 HydrophobicContact CB-CB 4.45Å; N69-I93 HydrophobicContact CB-CD1 3.67Å; N69-I93 HydrophobicContact CB-CG1 3.67Å; D91-I93 VanDerWaalsContact C-N 3.26Å; D91-I93 PolarHBondContact O-N 3.02Å; D91-I93 WeakPolarHBondContact OD1-CB 3.45Å; D91-I93 PolarHBondContact OD1-N 3.07Å; I93-Q95 VanDerWaalsContact C-N 3.31Å; I93-T215 HydrophobicContact CD1-CG2 3.69Å
94	K	95	Very high	97	Very high	105 Å²	105	49.1 Å²	49.1	46%	0.457	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-14.7	178.7	-63.8	-178.8	-174.6	174.1	0	113.6	D91 Q96 V98	D91-K94 HydrophobicContact CB-CB 4.13Å; D91-K94 PolarHBondContact O-N 3.05Å; D91-K94 PolarHBondContact OD1-N 3.11Å; D91-K94 WeakPolarHBondContact OD2-CD 3.33Å; D91-K94 WeakPolarHBondContact OD2-CG 3.3Å; K94-Q96 VanDerWaalsContact C-N 3.32Å; K94-Q96 HydrophobicContact CB-CG 3.81Å; K94-Q96 PolarHBondContact O-N 3.03Å; K94-V98 HydrophobicContact CD-CG1 4.5Å
95	Q	95.4	Very high	97	Very high	107 Å²	107	49.1 Å²	49.1	50%	0.5	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	47.8	-174.4	-61.6	-174.9	-9.2	0	0	113	Y49 W90 D91 I93	Y49-Q95 HydrophobicContact CD2-CG 4.39Å; Y49-Q95 HydrophobicContact CE2-CB 3.83Å; Y49-Q95 HydrophobicContact CE2-CG 4.01Å; W90-Q95 HydrophobicContact CH2-CB 4.31Å; W90-Q95 WeakPolarHBondContact CH2-O 3.34Å; W90-Q95 HydrophobicContact CZ2-CB 3.9Å; D91-Q95 VanDerWaalsContact O-CA 3.29Å; D91-Q95 WeakPolarHBondContact O-CA 3.47Å; D91-Q95 PolarHBondContact O-N 2.77Å; I93-Q95 VanDerWaalsContact C-N 3.31Å
96	Q	95.5	Very high	97	Very high	99 Å²	99	49.3 Å²	49.3	46%	0.463	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	159.8	179.3	70.3	-178.5	36.6	0	0	112.1	W90 D91 K94 V98	W90-Q96 VanDerWaalsContact CZ3-CA 3.5Å; D91-Q96 PolarHBondContact N-O 2.94Å; D91-Q96 PolarHBondContact O-N 3.2Å; K94-Q96 VanDerWaalsContact C-N 3.32Å; K94-Q96 HydrophobicContact CB-CG 3.81Å; K94-Q96 PolarHBondContact O-N 3.03Å; Q96-V98 HydrophobicContact CG-CG1 3.95Å
97	F	96.6	Very high	97	Very high	53 Å²	53	49.4 Å²	49.4	23%	0.232	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	130.1	165.3	-63.8	-74.4	0	0	0	109.5	F51 I73 R81 L82 C88 L89 W90	F51-F97 AromaticContact CE1-CE2 3.88Å; F51-F97 HydrophobicContact CE1-CE2 3.88Å; F51-F97 AromaticContact CE1-CZ 3.95Å; F51-F97 HydrophobicContact CE1-CZ 3.95Å; F51-F97 HydrophobicContact CZ-CE2 4.26Å; F51-F97 AromaticContact CZ-CZ 3.84Å; F51-F97 HydrophobicContact CZ-CZ 3.84Å; I73-F97 HydrophobicContact CB-CE1 4.35Å; I73-F97 HydrophobicContact CD1-CE1 4.3Å; I73-F97 HydrophobicContact CG2-CE1 4.36Å; R81-F97 HydrophobicContact CG-CE2 4.29Å; R81-F97 HydrophobicContact CG-CZ 4.04Å; L82-F97 HydrophobicContact CD1-CE1 4.19Å; L82-F97 HydrophobicContact CD2-CE1 4.44Å; L82-F97 HydrophobicContact CD2-CZ 4.32Å; C88-F97 HydrophobicContact CB-CD1 3.44Å; C88-F97 VanDerWaalsContact CB-CD1 3.44Å; C88-F97 HydrophobicContact CB-CE1 3.87Å; C88-F97 HydrophobicContact CB-CG 4.36Å; L89-F97 WeakPolarHBondContact O-CA 3.04Å; W90-F97 HydrophobicContact CB-CD1 4.37Å; W90-F97 HydrophobicContact CB-CE1 4.43Å; W90-F97 AromaticContact CE3-CD1 3.89Å; W90-F97 HydrophobicContact CE3-CD1 3.89Å; W90-F97 AromaticContact CE3-CD2 3.98Å; W90-F97 HydrophobicContact CE3-CD2 3.98Å; W90-F97 AromaticContact CE3-CE1 3.85Å; W90-F97 HydrophobicContact CE3-CE1 3.85Å; W90-F97 AromaticContact CE3-CE2 3.9Å; W90-F97 HydrophobicContact CE3-CE2 3.9Å; W90-F97 AromaticContact CE3-CG 3.98Å; W90-F97 HydrophobicContact CE3-CG 3.98Å; W90-F97 AromaticContact CE3-CZ 3.85Å; W90-F97 HydrophobicContact CE3-CZ 3.85Å; W90-F97 AromaticContact CZ3-CD2 4Å; W90-F97 HydrophobicContact CZ3-CD2 4Å; W90-F97 AromaticContact CZ3-CE2 3.85Å; W90-F97 HydrophobicContact CZ3-CE2 3.85Å; W90-F97 HydrophobicContact CZ3-CG 4.42Å; W90-F97 HydrophobicContact CZ3-CZ 4.2Å
98	V	96.4	Very high	97	Very high	38 Å²	38	53.2 Å²	53.2	23%	0.23	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	-12.3	-173.2	-76.4	0	0	0	0	112.6	L70 L89 D91 K94 Q96 I218	L70-V98 HydrophobicContact CD2-CG2 4.45Å; L89-V98 HydrophobicContact CB-CG2 4Å; L89-V98 VanDerWaalsContact O-CG2 3.28Å; L89-V98 WeakPolarHBondContact O-CG2 3.44Å; L89-V98 PolarHBondContact O-N 2.81Å; D91-V98 HydrophobicContact CB-CB 4.44Å; D91-V98 HydrophobicContact CB-CG1 3.58Å; D91-V98 HydrophobicContact CB-CG2 3.94Å; K94-V98 HydrophobicContact CD-CG1 4.5Å; Q96-V98 HydrophobicContact CG-CG1 3.95Å; V98-I218 HydrophobicContact CB-CD1 3.84Å; V98-I218 HydrophobicContact CG2-CD1 3.24Å
99	L	97.3	Very high	97	Very high	16 Å²	16	53.1 Å²	53.1	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	141.5	174.3	177.4	66	0	0	0	109.9	C88 L89 I101 I117 P134	C88-L99 CarbonylContact C-O 3.34Å; C88-L99 WeakPolarHBondContact CA-O 3.14Å; C88-L99 WeakPolarHBondContact CB-O 3.44Å; L89-L99 HydrophobicContact CB-CB 4.01Å; L89-L99 HydrophobicContact CD1-CB 4.3Å; L89-L99 HydrophobicContact CD1-CD2 3.78Å; L89-L99 HydrophobicContact CG-CB 4.19Å; L89-L99 HydrophobicContact CG-CD2 4.05Å; L89-L99 PolarHBondContact N-O 3.01Å; L99-I101 HydrophobicContact CD2-CD1 4.31Å; L99-I101 HydrophobicContact CD2-CG1 4.37Å; L99-I101 HydrophobicContact CG-CG1 4.35Å; L99-I117 HydrophobicContact CD2-CD1 3.47Å; L99-I117 VanDerWaalsContact CD2-CD1 3.47Å; L99-P134 VanDerWaalsContact CD1-CD 3.44Å; L99-P134 HydrophobicContact CD1-CG 3.48Å; L99-P134 VanDerWaalsContact CD1-CG 3.48Å; L99-P134 HydrophobicContact CD2-CG 3.45Å; L99-P134 VanDerWaalsContact CD2-CG 3.45Å; L99-P134 HydrophobicContact CG-CG 4.01Å
100	E	97	Very high	97	Very high	121 Å²	121	53.1 Å²	53.1	57%	0.565	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.3	173.5	-173.7	174.8	128.9	0	0	109.9	V86 T102	V86-E100 HydrophobicContact CG1-CG 3.49Å; V86-E100 VanDerWaalsContact CG1-CG 3.49Å; E100-T102 PolarHBondContact OE1-OG1 2.88Å
101	I	98.1	Very high	97	Very high	15 Å²	15	53.9 Å²	53.9	8%	0.077	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	105.5	173.7	-57.5	178.8	0	0	0	108.3	A87 L99 I117 I119 Y128 P134	A87-I101 PolarHBondContact N-O 3.21Å; A87-I101 PolarHBondContact O-N 3.25Å; L99-I101 HydrophobicContact CD2-CD1 4.31Å; L99-I101 HydrophobicContact CD2-CG1 4.37Å; L99-I101 HydrophobicContact CG-CG1 4.35Å; I101-I117 HydrophobicContact CD1-CD1 4.27Å; I101-I117 HydrophobicContact CD1-CG2 4.02Å; I101-I119 HydrophobicContact CD1-CG1 4.49Å; I101-I119 HydrophobicContact CG2-CG1 4.48Å; I101-Y128 HydrophobicContact CD1-CD2 4.41Å; I101-Y128 HydrophobicContact CD1-CG 4.43Å; I101-Y128 HydrophobicContact CG2-CE2 4.36Å; I101-P134 HydrophobicContact CD1-CB 4.3Å; I101-P134 HydrophobicContact CD1-CG 4.15Å; I101-P134 HydrophobicContact CG1-CG 4.33Å
102	T	98	Very high	97	Very high	84 Å²	84	53.6 Å²	53.6	52%	0.515	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	127.2	177.6	-56.1	0	0	0	0	110.5	V86 E100	V86-T102 HydrophobicContact CG2-CG2 4.13Å; E100-T102 PolarHBondContact OE1-OG1 2.88Å
103	C	98.1	Very high	96.9	Very high	11 Å²	11	52.5 Å²	52.5	7%	0.074	28%	0.276	C	S	.	.			trans	-110	161.2	-177.7	-64.2	0	0	0	0	111.5	N85 T105 V107 L121	N85-C103 WeakPolarHBondContact CB-O 3.35Å; N85-C103 PolarHBondContact ND2-O 2.94Å; N85-C103 WeakPolarHBondContact O-CB 3.36Å; N85-C103 PolarHBondContact O-N 3.39Å; C103-T105 VanDerWaalsContact C-N 3.26Å; C103-T105 PolarHBondContact O-N 2.84Å; C103-V107 HydrophobicContact CB-CG2 4.09Å; C103-L121 HydrophobicContact CB-CD2 3.82Å
104	A	95.9	Very high	96.7	Very high	105 Å²	105	50.1 Å²	50.1	87%	0.868	26%	0.263	S	S	*	.	S	Bend	trans	-73.5	-16.6	176.9	0	0	0	0	0	113.7
105	T	97.8	Very high	96.5	Very high	71 Å²	71	45.2 Å²	45.2	44%	0.436	24%	0.242	S	C	.	.	S	Bend	trans	-140.9	169.1	-179.6	61.5	0	0	0	0	110	N85 C103 V107	N85-T105 WeakPolarHBondContact CB-O 3.39Å; C103-T105 VanDerWaalsContact C-N 3.26Å; C103-T105 PolarHBondContact O-N 2.84Å; T105-V107 PolarHBondContact O-N 2.88Å
106	D	97.8	Very high	96.4	Very high	54 Å²	54	41.2 Å²	41.2	29%	0.289	22%	0.222	S	C	.	.			trans	-51.5	131.7	176.9	-72.4	-4.8	0	0	0	112.9	S84 R108 V122	S84-D106 VanDerWaalsContact CB-OD1 3.27Å; S84-D106 WeakPolarHBondContact CB-OD1 3.29Å; S84-D106 CarbonylContact O-C 3.58Å; S84-D106 WeakPolarHBondContact O-CA 3.32Å; S84-D106 PolarHBondContact OG-OD1 2.86Å; D106-R108 IonicContact OD2-CZ 3.7Å; D106-R108 IonicContact OD2-NH1 3.1Å; D106-R108 IonicContact OD2-NH2 2.73Å; D106-R108 PolarHBondContact OD2-NH2 3.06Å; D106-V122 HydrophobicContact CB-CG2 4.44Å
107	V	98.6	Very high	96.5	Very high	8 Å²	8	36.5 Å²	36.5	5%	0.048	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	116.9	172.3	-175.7	0	0	0	0	109	L74 S84 A87 C103 T105 G109 I119 L121	L74-V107 HydrophobicContact CD1-CB 4.37Å; L74-V107 HydrophobicContact CD1-CG1 3.82Å; L74-V107 HydrophobicContact CD2-CB 4.11Å; L74-V107 HydrophobicContact CD2-CG1 3.64Å; L74-V107 HydrophobicContact CG-CG1 4.42Å; S84-V107 PolarHBondContact O-N 2.87Å; A87-V107 HydrophobicContact CB-CG1 4.23Å; A87-V107 HydrophobicContact CB-CG2 4.38Å; C103-V107 HydrophobicContact CB-CG2 4.09Å; T105-V107 PolarHBondContact O-N 2.88Å; V107-G109 WeakPolarHBondContact CG1-O 3.45Å; V107-I119 HydrophobicContact CG1-CG2 3.88Å; V107-I119 HydrophobicContact CG2-CG2 4.16Å; V107-L121 HydrophobicContact CG2-CD2 3.95Å
108	R	98.2	Very high	96.6	Very high	81 Å²	81	34 Å²	34	31%	0.306	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-17	178.8	-61	-58.4	176.9	-170.5	-10.2	113.2	R4 D106 I120 V122 P146	R4-R108 VanDerWaalsContact CZ-O 3.25Å; R4-R108 PolarHBondContact NH1-O 2.66Å; R4-R108 PolarHBondContact NH2-O 3.29Å; D106-R108 IonicContact OD2-CZ 3.7Å; D106-R108 IonicContact OD2-NH1 3.1Å; D106-R108 IonicContact OD2-NH2 2.73Å; D106-R108 PolarHBondContact OD2-NH2 3.06Å; R108-I120 WeakPolarHBondContact CA-O 3.48Å; R108-I120 PolarHBondContact N-O 2.83Å; R108-V122 HydrophobicContact CG-CG2 3.72Å; R108-P146 WeakPolarHBondContact CD-O 3.42Å
109	G	98.3	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168	157.7	173.2	0	0	0	0	0	112.2	V107 I120	V107-G109 WeakPolarHBondContact CG1-O 3.45Å; G109-I120 PolarHBondContact N-O 2.84Å; G109-I120 VanDerWaalsContact N-O 3.15Å; G109-I120 WeakPolarHBondContact O-CD1 3.17Å; G109-I120 PolarHBondContact O-N 2.8Å
110	I	98.5	Very high	96.7	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.8	166.1	-179.6	164	0	0	0	107.3	Y61 E63 L74 A87 L89 L112 I117 I118 I119	Y61-I110 HydrophobicContact CD1-CG2 3.86Å; Y61-I110 HydrophobicContact CE1-CG2 3.72Å; Y61-I110 WeakPolarHBondContact CE1-O 3.49Å; Y61-I110 PolarHBondContact OH-O 3.16Å; E63-I110 HydrophobicContact CB-CG2 4.09Å; E63-I110 WeakPolarHBondContact CB-O 3.41Å; L74-I110 HydrophobicContact CD2-CB 4.44Å; L74-I110 HydrophobicContact CD2-CG2 4.18Å; L74-I110 HydrophobicContact CG-CG2 4.2Å; A87-I110 HydrophobicContact CB-CD1 4.29Å; L89-I110 HydrophobicContact CD2-CD1 4.16Å; I110-L112 HydrophobicContact CD1-CD2 4.07Å; I110-L112 HydrophobicContact CG1-CD2 3.98Å; I110-L112 HydrophobicContact CG1-CG 4.49Å; I110-I117 HydrophobicContact CD1-CG2 3.96Å; I110-I117 HydrophobicContact CG1-CG2 4.24Å; I110-I118 CarbonylContact C-O 3.58Å; I110-I118 WeakPolarHBondContact CA-O 3.36Å; I110-I119 HydrophobicContact CB-CD1 4.22Å; I110-I119 HydrophobicContact CD1-CD1 3.91Å; I110-I119 HydrophobicContact CG1-CD1 3.94Å
111	R	98	Very high	96.8	Very high	21 Å²	21	26 Å²	26	8%	0.079	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.6	173.1	-66.6	-61.1	-123.1	-79.3	-4.4	109.2	Y61 E63 I118 I120 C150 V152	Y61-R111 PolarHBondContact OH-NH1 3.24Å; E63-R111 WeakPolarHBondContact OE1-CD 3.38Å; E63-R111 IonicContact OE1-NE 2.74Å; E63-R111 WeakPolarHBondContact OE2-CD 3.34Å; E63-R111 IonicContact OE2-NE 3.34Å; R111-I118 HydrophobicContact CB-CB 4.14Å; R111-I118 PolarHBondContact N-O 2.81Å; R111-I118 WeakPolarHBondContact O-CD1 3.3Å; R111-I118 PolarHBondContact O-N 3.01Å; R111-I120 HydrophobicContact CB-CD1 4.41Å; R111-I120 HydrophobicContact CG-CD1 3.9Å; R111-C150 PolarHBondContact NH1-O 2.84Å; R111-C150 VanDerWaalsContact NH1-O 3.11Å; R111-C150 PolarHBondContact NH2-O 2.87Å; R111-V152 HydrophobicContact CB-CG2 3.62Å; R111-V152 HydrophobicContact CG-CG2 4.24Å
112	L	96.8	Very high	96.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.4	-173.5	-58.2	178.3	0	0	0	111.2	E63 L65 L89 I110 I117 F130 Q154	E63-L112 HydrophobicContact CB-CG 4.49Å; E63-L112 HydrophobicContact CG-CB 4.16Å; E63-L112 HydrophobicContact CG-CD1 4.17Å; E63-L112 HydrophobicContact CG-CG 3.85Å; L65-L112 HydrophobicContact CB-CB 4.33Å; L65-L112 HydrophobicContact CB-CD1 3.97Å; L65-L112 HydrophobicContact CD1-CB 3.99Å; L89-L112 HydrophobicContact CD2-CD1 4.07Å; L89-L112 HydrophobicContact CD2-CD2 3.88Å; I110-L112 HydrophobicContact CD1-CD2 4.07Å; I110-L112 HydrophobicContact CG1-CD2 3.98Å; I110-L112 HydrophobicContact CG1-CG 4.49Å; L112-I117 HydrophobicContact CD2-CB 4.38Å; L112-I117 HydrophobicContact CD2-CG1 4.13Å; L112-I117 HydrophobicContact CD2-CG2 4.07Å; L112-F130 HydrophobicContact CD2-CE2 4.22Å; L112-Q154 PolarHBondContact O-NE2 2.73Å
113	R	93.6	Very high	96.8	Very high	2 Å²	2	27 Å²	27	1%	0.008	15%	0.152	C	C	.	.			trans	-118.4	172.5	155.3	-62.3	-176.9	71.3	-147.8	0.8	107.8	D115 R116 I118 F130 V152 C153 S155 I176 S225	R113-D115 WeakPolarHBondContact CB-OD1 3.23Å; R113-D115 IonicContact CZ-OD1 3.69Å; R113-D115 IonicContact NE-OD1 3.87Å; R113-D115 IonicContact NH1-OD1 3.45Å; R113-D115 PolarHBondContact NH1-OD1 2.93Å; R113-D115 IonicContact NH1-OD2 3.75Å; R113-D115 PolarHBondContact O-N 3.22Å; R113-R116 HydrophobicContact CB-CB 4.26Å; R113-R116 PolarHBondContact N-O 2.96Å; R113-I118 HydrophobicContact CG-CD1 4.48Å; R113-F130 WeakPolarHBondContact O-CD2 3.33Å; R113-V152 VanDerWaalsContact CD-CG1 3.42Å; R113-V152 HydrophobicContact CG-CG1 3.32Å; R113-C153 PolarHBondContact NE-O 3.46Å; R113-S155 PolarHBondContact NH2-O 3.4Å; R113-I176 PolarHBondContact NH1-O 3.32Å; R113-S225 PolarHBondContact NH2-OG 2.91Å; R113-S225 VanDerWaalsContact NH2-OG 3.12Å
114	H	89.7	Confident	96.8	Very high	59 Å²	59	26.9 Å²	26.9	27%	0.273	15%	0.152	S	C	.	.	S	Bend	trans	-59.6	-25.3	172.4	-73.3	-67.1	0	0	0	113.5	F66 I216 C222	F66-H114 AromaticContact CD2-CE1 3.81Å; F66-H114 AromaticContact CD2-NE2 3.29Å; F66-H114 VanDerWaalsContact CD2-NE2 3.29Å; F66-H114 WeakPolarHBondContact CD2-NE2 3.1Å; F66-H114 AromaticContact CE2-CD2 3.67Å; F66-H114 AromaticContact CE2-NE2 3.33Å; F66-H114 VanDerWaalsContact CE2-NE2 3.33Å; F66-H114 WeakPolarHBondContact CE2-NE2 3.3Å; H114-I216 WeakPolarHBondContact ND1-CD1 3.41Å; H114-C222 WeakPolarHBondContact O-CB 3.44Å
115	D	90.2	Very high	96.9	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.016	11%	0.111	C	C	.	.	S	Bend	trans	-122.7	-2.1	-173	60.3	-6.8	0	0	0	114.3	R113 F130 S225	R113-D115 WeakPolarHBondContact CB-OD1 3.23Å; R113-D115 IonicContact CZ-OD1 3.69Å; R113-D115 IonicContact NE-OD1 3.87Å; R113-D115 IonicContact NH1-OD1 3.45Å; R113-D115 PolarHBondContact NH1-OD1 2.93Å; R113-D115 IonicContact NH1-OD2 3.75Å; R113-D115 PolarHBondContact O-N 3.22Å; D115-F130 PolarHBondContact O-N 3.2Å; D115-S225 PolarHBondContact OD1-OG 2.8Å; D115-S225 VanDerWaalsContact OD1-OG 3.05Å; D115-S225 WeakPolarHBondContact OD2-CB 3.48Å; D115-S225 PolarHBondContact OD2-N 3.13Å; D115-S225 PolarHBondContact OD2-OG 3.36Å
116	R	94.2	Very high	97	Very high	22 Å²	22	20.3 Å²	20.3	8%	0.083	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	142.8	-174.9	-60.3	-66.2	176.8	-110.2	2.8	112.4	R113 I118 V127 Y128 I137 I176 G177	R113-R116 HydrophobicContact CB-CB 4.26Å; R113-R116 PolarHBondContact N-O 2.96Å; R116-I118 HydrophobicContact CB-CD1 3.82Å; R116-V127 HydrophobicContact CB-CG1 4.36Å; R116-V127 HydrophobicContact CG-CG1 4.43Å; R116-Y128 WeakPolarHBondContact CA-O 3.32Å; R116-I137 VanDerWaalsContact NE-CD1 3.32Å; R116-I176 HydrophobicContact CG-CG2 3.84Å; R116-G177 PolarHBondContact NH2-O 2.81Å
117	I	97.3	Very high	96.9	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.7	167.7	-55.8	168.6	0	0	0	107.1	L89 L99 I101 I110 L112 I119 Y128 F130	L89-I117 HydrophobicContact CD1-CD1 3.84Å; L89-I117 HydrophobicContact CG-CD1 4.47Å; L99-I117 HydrophobicContact CD2-CD1 3.47Å; L99-I117 VanDerWaalsContact CD2-CD1 3.47Å; I101-I117 HydrophobicContact CD1-CD1 4.27Å; I101-I117 HydrophobicContact CD1-CG2 4.02Å; I110-I117 HydrophobicContact CD1-CG2 3.96Å; I110-I117 HydrophobicContact CG1-CG2 4.24Å; L112-I117 HydrophobicContact CD2-CB 4.38Å; L112-I117 HydrophobicContact CD2-CG1 4.13Å; L112-I117 HydrophobicContact CD2-CG2 4.07Å; I117-I119 HydrophobicContact CG2-CD1 3.99Å; I117-I119 HydrophobicContact CG2-CG1 4.36Å; I117-Y128 PolarHBondContact N-O 2.8Å; I117-Y128 PolarHBondContact O-N 2.9Å; I117-F130 HydrophobicContact CD1-CD2 4.21Å; I117-F130 HydrophobicContact CD1-CG 4.45Å; I117-F130 HydrophobicContact CG1-CB 4.41Å; I117-F130 HydrophobicContact CG1-CD2 3.54Å; I117-F130 HydrophobicContact CG1-CE2 4.04Å; I117-F130 HydrophobicContact CG1-CG 4.13Å
118	I	98.1	Very high	96.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.2	179.9	-57.5	80.9	0	0	0	107.6	I110 R111 R113 R116 I120 V125 K126 V127 V152	I110-I118 CarbonylContact C-O 3.58Å; I110-I118 WeakPolarHBondContact CA-O 3.36Å; R111-I118 HydrophobicContact CB-CB 4.14Å; R111-I118 PolarHBondContact N-O 2.81Å; R111-I118 WeakPolarHBondContact O-CD1 3.3Å; R111-I118 PolarHBondContact O-N 3.01Å; R113-I118 HydrophobicContact CG-CD1 4.48Å; R116-I118 HydrophobicContact CB-CD1 3.82Å; I118-I120 HydrophobicContact CG2-CD1 4.24Å; I118-V125 HydrophobicContact CG2-CG1 3.75Å; I118-K126 CarbonylContact C-O 3.59Å; I118-K126 WeakPolarHBondContact CA-O 3.45Å; I118-V127 HydrophobicContact CG1-CG1 4.33Å; I118-V127 HydrophobicContact CG1-CG2 4.16Å; I118-V127 HydrophobicContact CG2-CG2 4.36Å; I118-V152 HydrophobicContact CB-CG2 4.41Å; I118-V152 HydrophobicContact CD1-CG1 4.2Å; I118-V152 HydrophobicContact CD1-CG2 3.95Å; I118-V152 HydrophobicContact CG1-CG2 4.04Å
119	I	98.6	Very high	96.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.4	177.6	-59.8	-58.3	0	0	0	108.9	A87 I101 V107 I110 I117 L121 V125 K126 Y128	A87-I119 HydrophobicContact CB-CD1 3.64Å; I101-I119 HydrophobicContact CD1-CG1 4.49Å; I101-I119 HydrophobicContact CG2-CG1 4.48Å; V107-I119 HydrophobicContact CG1-CG2 3.88Å; V107-I119 HydrophobicContact CG2-CG2 4.16Å; I110-I119 HydrophobicContact CB-CD1 4.22Å; I110-I119 HydrophobicContact CD1-CD1 3.91Å; I110-I119 HydrophobicContact CG1-CD1 3.94Å; I117-I119 HydrophobicContact CG2-CD1 3.99Å; I117-I119 HydrophobicContact CG2-CG1 4.36Å; I119-L121 HydrophobicContact CG2-CD2 3.84Å; I119-L121 HydrophobicContact CG2-CG 4.36Å; I119-V125 WeakPolarHBondContact O-CA 3.48Å; I119-K126 HydrophobicContact CB-CB 4.48Å; I119-K126 PolarHBondContact N-O 2.78Å; I119-K126 PolarHBondContact O-N 2.79Å; I119-Y128 HydrophobicContact CB-CE2 4.17Å; I119-Y128 HydrophobicContact CG1-CD2 4.05Å; I119-Y128 HydrophobicContact CG1-CE2 3.81Å
120	I	98.7	Very high	96.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	115.9	178.3	-56.1	84.1	0	0	0	107.8	R108 G109 R111 I118 V125 N145 C150	R108-I120 WeakPolarHBondContact CA-O 3.48Å; R108-I120 PolarHBondContact N-O 2.83Å; G109-I120 PolarHBondContact N-O 2.84Å; G109-I120 VanDerWaalsContact N-O 3.15Å; G109-I120 WeakPolarHBondContact O-CD1 3.17Å; G109-I120 PolarHBondContact O-N 2.8Å; R111-I120 HydrophobicContact CB-CD1 4.41Å; R111-I120 HydrophobicContact CG-CD1 3.9Å; I118-I120 HydrophobicContact CG2-CD1 4.24Å; I120-V125 HydrophobicContact CG1-CG2 4.38Å; I120-V125 HydrophobicContact CG2-CG2 4.27Å; I120-N145 VanDerWaalsContact CG2-ND2 3.34Å; I120-N145 WeakPolarHBondContact CG2-ND2 3.34Å; I120-C150 HydrophobicContact CD1-CB 3.81Å; I120-C150 HydrophobicContact CG1-CB 3.43Å; I120-C150 VanDerWaalsContact CG1-CB 3.43Å
121	L	98.6	Very high	95.9	Very high	8 Å²	8	17.3 Å²	17.3	4%	0.042	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	174.5	173.1	-54.6	-179.2	0	0	0	109.8	C103 V107 I119 N123 A124 K126	C103-L121 HydrophobicContact CB-CD2 3.82Å; V107-L121 HydrophobicContact CG2-CD2 3.95Å; I119-L121 HydrophobicContact CG2-CD2 3.84Å; I119-L121 HydrophobicContact CG2-CG 4.36Å; L121-N123 VanDerWaalsContact C-N 3.28Å; L121-N123 PolarHBondContact O-N 2.96Å; L121-A124 WeakPolarHBondContact CA-O 3.39Å; L121-A124 HydrophobicContact CB-CB 4.39Å; L121-A124 WeakPolarHBondContact CB-O 3.42Å; L121-A124 HydrophobicContact CD1-CB 4.38Å; L121-A124 PolarHBondContact N-O 3.47Å; L121-K126 HydrophobicContact CD1-CD 4.32Å
122	V	97.5	Very high	95.5	Very high	31 Å²	31	19.2 Å²	19.2	19%	0.188	10%	0.103	C	C	.	.	S	Bend	trans	-59.4	-38.3	178.1	177.5	0	0	0	0	112.4	D106 R108 N145	D106-V122 HydrophobicContact CB-CG2 4.44Å; R108-V122 HydrophobicContact CG-CG2 3.72Å; V122-N145 PolarHBondContact O-N 2.84Å
123	N	98.1	Very high	95.3	Very high	90 Å²	90	23.2 Å²	23.2	48%	0.481	13%	0.131	S	C	.	.	S	Bend	trans	-129	15.9	-174.9	-62.9	-44.3	0	0	0	113.2	L121 N141 T142 S144	L121-N123 VanDerWaalsContact C-N 3.28Å; L121-N123 PolarHBondContact O-N 2.96Å; N123-N141 WeakPolarHBondContact O-CA 3.45Å; N123-T142 WeakPolarHBondContact CA-OG1 3.27Å; N123-T142 PolarHBondContact O-N 3.2Å; N123-T142 PolarHBondContact O-OG1 2.99Å; N123-S144 WeakPolarHBondContact OD1-CA 3.04Å
124	A	98.4	Very high	95.3	Very high	8 Å²	8	24.4 Å²	24.4	7%	0.066	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	157.1	179.7	0	0	0	0	0	112.2	L121 S140 T142	L121-A124 WeakPolarHBondContact CA-O 3.39Å; L121-A124 HydrophobicContact CB-CB 4.39Å; L121-A124 WeakPolarHBondContact CB-O 3.42Å; L121-A124 HydrophobicContact CD1-CB 4.38Å; L121-A124 PolarHBondContact N-O 3.47Å; A124-S140 CarbonylContact C-O 3.52Å; A124-S140 VanDerWaalsContact CA-O 3.26Å; A124-S140 WeakPolarHBondContact CA-O 3.5Å; A124-T142 PolarHBondContact N-OG1 3.38Å
125	V	98.6	Very high	95.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.9	166.1	173.6	0	0	0	0	108.3	I118 I119 I120 E139 S140 T142 F163	I118-V125 HydrophobicContact CG2-CG1 3.75Å; I119-V125 WeakPolarHBondContact O-CA 3.48Å; I120-V125 HydrophobicContact CG1-CG2 4.38Å; I120-V125 HydrophobicContact CG2-CG2 4.27Å; V125-E139 WeakPolarHBondContact O-CA 3.44Å; V125-S140 PolarHBondContact N-O 2.76Å; V125-S140 PolarHBondContact O-N 3.01Å; V125-T142 HydrophobicContact CG2-CG2 4Å; V125-F163 HydrophobicContact CB-CD1 4.49Å; V125-F163 HydrophobicContact CB-CD2 4.2Å; V125-F163 HydrophobicContact CB-CE2 4.28Å; V125-F163 HydrophobicContact CB-CG 4.32Å; V125-F163 HydrophobicContact CB-CZ 4.46Å; V125-F163 HydrophobicContact CG1-CD1 4.33Å; V125-F163 HydrophobicContact CG1-CE1 4.41Å; V125-F163 HydrophobicContact CG2-CB 3.97Å; V125-F163 HydrophobicContact CG2-CD1 4.34Å; V125-F163 HydrophobicContact CG2-CD2 3.75Å; V125-F163 HydrophobicContact CG2-CE2 4.32Å; V125-F163 HydrophobicContact CG2-CG 3.77Å
126	K	98.2	Very high	95.8	Very high	38 Å²	38	30.9 Å²	30.9	17%	0.165	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	142.7	177.8	-63.9	-170	-172.2	-119	0	110.1	I118 I119 L121 Y128 L136 F138 E139	I118-K126 CarbonylContact C-O 3.59Å; I118-K126 WeakPolarHBondContact CA-O 3.45Å; I119-K126 HydrophobicContact CB-CB 4.48Å; I119-K126 PolarHBondContact N-O 2.78Å; I119-K126 PolarHBondContact O-N 2.79Å; L121-K126 HydrophobicContact CD1-CD 4.32Å; K126-Y128 HydrophobicContact CB-CD2 4.38Å; K126-Y128 HydrophobicContact CB-CE2 3.56Å; K126-Y128 HydrophobicContact CD-CE2 4.39Å; K126-Y128 VanDerWaalsContact CD-OH 3.3Å; K126-Y128 WeakPolarHBondContact CD-OH 3.26Å; K126-L136 HydrophobicContact CB-CD1 3.75Å; K126-L136 HydrophobicContact CD-CD1 4.15Å; K126-L136 HydrophobicContact CG-CD1 4.13Å; K126-F138 CarbonylContact C-O 3.54Å; K126-F138 WeakPolarHBondContact CA-O 3.29Å; K126-E139 WeakPolarHBondContact CE-OE1 3.35Å; K126-E139 HydrophobicContact CG-CB 4.34Å; K126-E139 HydrophobicContact CG-CG 4.01Å; K126-E139 IonicContact NZ-OE1 3.39Å; K126-E139 PolarHBondContact NZ-OE1 2.64Å; K126-E139 IonicContact NZ-OE2 2.77Å; K126-E139 PolarHBondContact NZ-OE2 3.3Å
127	V	96.9	Very high	95.7	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.9	179.3	-177.7	0	0	0	0	108.5	R116 I118 I137 F138 I176	R116-V127 HydrophobicContact CB-CG1 4.36Å; R116-V127 HydrophobicContact CG-CG1 4.43Å; I118-V127 HydrophobicContact CG1-CG1 4.33Å; I118-V127 HydrophobicContact CG1-CG2 4.16Å; I118-V127 HydrophobicContact CG2-CG2 4.36Å; V127-I137 HydrophobicContact CB-CG1 4.16Å; V127-I137 HydrophobicContact CG1-CD1 3.88Å; V127-I137 HydrophobicContact CG1-CG1 3.86Å; V127-I137 VanDerWaalsContact O-CG1 3.25Å; V127-I137 WeakPolarHBondContact O-CG1 3.26Å; V127-I137 PolarHBondContact O-N 3.19Å; V127-F138 HydrophobicContact CB-CB 4.06Å; V127-F138 HydrophobicContact CG2-CB 4.27Å; V127-F138 HydrophobicContact CG2-CD1 3.91Å; V127-F138 PolarHBondContact N-O 3Å; V127-F138 PolarHBondContact O-N 3.29Å; V127-I176 HydrophobicContact CG1-CD1 4.46Å; V127-I176 HydrophobicContact CG1-CG1 4.44Å; V127-I176 HydrophobicContact CG1-CG2 3.74Å; V127-I176 HydrophobicContact CG2-CD1 4.08Å; V127-I176 HydrophobicContact CG2-CG1 4.31Å
128	Y	95.8	Very high	95.6	Very high	28 Å²	28	34.6 Å²	34.6	11%	0.11	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	157.2	-179.2	-59.7	-99.1	0	0	0	111.2	I101 R116 I117 I119 K126 P134 Q135 L136	I101-Y128 HydrophobicContact CD1-CD2 4.41Å; I101-Y128 HydrophobicContact CD1-CG 4.43Å; I101-Y128 HydrophobicContact CG2-CE2 4.36Å; R116-Y128 WeakPolarHBondContact CA-O 3.32Å; I117-Y128 PolarHBondContact N-O 2.8Å; I117-Y128 PolarHBondContact O-N 2.9Å; I119-Y128 HydrophobicContact CB-CE2 4.17Å; I119-Y128 HydrophobicContact CG1-CD2 4.05Å; I119-Y128 HydrophobicContact CG1-CE2 3.81Å; K126-Y128 HydrophobicContact CB-CD2 4.38Å; K126-Y128 HydrophobicContact CB-CE2 3.56Å; K126-Y128 HydrophobicContact CD-CE2 4.39Å; K126-Y128 VanDerWaalsContact CD-OH 3.3Å; K126-Y128 WeakPolarHBondContact CD-OH 3.26Å; Y128-P134 HydrophobicContact CD1-CB 4.13Å; Y128-P134 HydrophobicContact CG-CB 4.35Å; Y128-Q135 CarbonylContact C-O 3.56Å; Y128-Q135 WeakPolarHBondContact CA-O 3.29Å; Y128-L136 HydrophobicContact CD1-CB 4.03Å; Y128-L136 HydrophobicContact CD1-CD1 4.32Å; Y128-L136 HydrophobicContact CE1-CB 3.79Å; Y128-L136 HydrophobicContact CE1-CD1 3.91Å; Y128-L136 HydrophobicContact CE1-CG 4.43Å; Y128-L136 HydrophobicContact CE2-CD1 4.11Å
129	T	92.8	Very high	95.5	Very high	30 Å²	30	38.7 Å²	38.7	18%	0.184	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	147.5	164.2	58.9	0	0	0	0	110.9	S131 Q135 I137	T129-S131 PolarHBondContact O-N 2.86Å; T129-S131 PolarHBondContact OG1-OG 3Å; T129-Q135 HydrophobicContact CG2-CB 4.23Å; T129-Q135 PolarHBondContact N-O 3.03Å; T129-Q135 PolarHBondContact OG1-N 3.43Å; T129-I137 HydrophobicContact CG2-CG2 3.81Å
130	F	92.8	Very high	95.5	Very high	6 Å²	6	39.7 Å²	39.7	3%	0.026	22%	0.216	C	C	.	.	S	Bend	trans	-88.6	85.2	171.5	-156.8	-69.4	0	0	0	109.7	L65 L70 L89 L112 R113 D115 I117 I218	L65-F130 HydrophobicContact CD2-CE2 4.02Å; L65-F130 HydrophobicContact CD2-CZ 3.95Å; L70-F130 HydrophobicContact CD1-CE1 3.7Å; L70-F130 HydrophobicContact CD1-CZ 3.58Å; L89-F130 HydrophobicContact CD1-CE1 4.2Å; L89-F130 HydrophobicContact CD1-CE2 4.09Å; L89-F130 HydrophobicContact CD1-CZ 3.72Å; L112-F130 HydrophobicContact CD2-CE2 4.22Å; R113-F130 WeakPolarHBondContact O-CD2 3.33Å; D115-F130 PolarHBondContact O-N 3.2Å; I117-F130 HydrophobicContact CD1-CD2 4.21Å; I117-F130 HydrophobicContact CD1-CG 4.45Å; I117-F130 HydrophobicContact CG1-CB 4.41Å; I117-F130 HydrophobicContact CG1-CD2 3.54Å; I117-F130 HydrophobicContact CG1-CE2 4.04Å; I117-F130 HydrophobicContact CG1-CG 4.13Å; F130-I218 HydrophobicContact CE1-CG1 3.84Å
131	S	91	Very high	95.4	Very high	16 Å²	16	43.3 Å²	43.3	11%	0.112	24%	0.236	C	C	.	.	S	Bend	trans	-146.4	163.7	-175.8	52.9	0	0	0	0	110.9	T129 S133 P134	T129-S131 PolarHBondContact O-N 2.86Å; T129-S131 PolarHBondContact OG1-OG 3Å; S131-S133 PolarHBondContact O-N 3.17Å; S131-S133 PolarHBondContact OG-O 3.06Å; S131-P134 WeakPolarHBondContact O-CD 3.2Å; S131-P134 WeakPolarHBondContact O-CG 3.29Å
132	P	89.3	Confident	95.4	Very high	61 Å²	61	43.5 Å²	43.5	40%	0.396	24%	0.237	S	C	.	.	S	Bend	trans	-60.1	-27.9	176.8	-20.6	31.2	0	0	0	113.2	I218	P132-I218 HydrophobicContact CB-CG2 4.25Å; P132-I218 WeakPolarHBondContact CD-O 3.42Å; P132-I218 HydrophobicContact CG-CG2 3.96Å; P132-I218 VanDerWaalsContact CG-O 3.26Å; P132-I218 WeakPolarHBondContact CG-O 3.17Å
133	S	92	Very high	95.4	Very high	84 Å²	84	43.1 Å²	43.1	59%	0.587	24%	0.235	S	C	*	.	S	Bend	trans	-120	87.4	170.8	-54.3	0	0	0	0	109	S131 Q135	S131-S133 PolarHBondContact O-N 3.17Å; S131-S133 PolarHBondContact OG-O 3.06Å; S133-Q135 PolarHBondContact O-N 3.29Å; S133-Q135 PolarHBondContact O-NE2 2.98Å
134	P	94.8	Very high	95.4	Very high	28 Å²	28	42.5 Å²	42.5	18%	0.182	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-62.8	131.2	-175.7	-20.6	30.8	0	0	0	112	L99 I101 Y128 S131	L99-P134 VanDerWaalsContact CD1-CD 3.44Å; L99-P134 HydrophobicContact CD1-CG 3.48Å; L99-P134 VanDerWaalsContact CD1-CG 3.48Å; L99-P134 HydrophobicContact CD2-CG 3.45Å; L99-P134 VanDerWaalsContact CD2-CG 3.45Å; L99-P134 HydrophobicContact CG-CG 4.01Å; I101-P134 HydrophobicContact CD1-CB 4.3Å; I101-P134 HydrophobicContact CD1-CG 4.15Å; I101-P134 HydrophobicContact CG1-CG 4.33Å; Y128-P134 HydrophobicContact CD1-CB 4.13Å; Y128-P134 HydrophobicContact CG-CB 4.35Å; S131-P134 WeakPolarHBondContact O-CD 3.2Å; S131-P134 WeakPolarHBondContact O-CG 3.29Å
135	Q	94	Very high	95.4	Very high	118 Å²	118	42.3 Å²	42.3	55%	0.551	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-102.3	132.8	174.2	-59	-54.5	-50.7	0	0	109.7	Y128 T129 S133 I137	Y128-Q135 CarbonylContact C-O 3.56Å; Y128-Q135 WeakPolarHBondContact CA-O 3.29Å; T129-Q135 HydrophobicContact CG2-CB 4.23Å; T129-Q135 PolarHBondContact N-O 3.03Å; T129-Q135 PolarHBondContact OG1-N 3.43Å; S133-Q135 PolarHBondContact O-N 3.29Å; S133-Q135 PolarHBondContact O-NE2 2.98Å; Q135-I137 PolarHBondContact O-N 2.83Å
136	L	95.1	Very high	95.2	Very high	79 Å²	79	46 Å²	46	41%	0.414	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	119	173.9	179.9	68	0	0	0	109.1	K126 Y128 F138	K126-L136 HydrophobicContact CB-CD1 3.75Å; K126-L136 HydrophobicContact CD-CD1 4.15Å; K126-L136 HydrophobicContact CG-CD1 4.13Å; Y128-L136 HydrophobicContact CD1-CB 4.03Å; Y128-L136 HydrophobicContact CD1-CD1 4.32Å; Y128-L136 HydrophobicContact CE1-CB 3.79Å; Y128-L136 HydrophobicContact CE1-CD1 3.91Å; Y128-L136 HydrophobicContact CE1-CG 4.43Å; Y128-L136 HydrophobicContact CE2-CD1 4.11Å; L136-F138 WeakPolarHBondContact CD1-O 3.4Å
137	I	92.8	Very high	95	Very high	55 Å²	55	48 Å²	48	28%	0.282	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-22.3	-178.4	61.1	166.8	0	0	0	113.2	R116 V127 T129 Q135 I176 T179	R116-I137 VanDerWaalsContact NE-CD1 3.32Å; V127-I137 HydrophobicContact CB-CG1 4.16Å; V127-I137 HydrophobicContact CG1-CD1 3.88Å; V127-I137 HydrophobicContact CG1-CG1 3.86Å; V127-I137 VanDerWaalsContact O-CG1 3.25Å; V127-I137 WeakPolarHBondContact O-CG1 3.26Å; V127-I137 PolarHBondContact O-N 3.19Å; T129-I137 HydrophobicContact CG2-CG2 3.81Å; Q135-I137 PolarHBondContact O-N 2.83Å; I137-I176 HydrophobicContact CD1-CG2 4.11Å; I137-T179 HydrophobicContact CB-CG2 4.43Å; I137-T179 HydrophobicContact CG2-CG2 4.42Å
138	F	95.1	Very high	95	Very high	46 Å²	46	48.1 Å²	48.1	20%	0.202	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	140.8	179.1	175.7	-91.5	0	0	0	110.7	K126 V127 L136 F163 V174 I176 P233	K126-F138 CarbonylContact C-O 3.54Å; K126-F138 WeakPolarHBondContact CA-O 3.29Å; V127-F138 HydrophobicContact CB-CB 4.06Å; V127-F138 HydrophobicContact CG2-CB 4.27Å; V127-F138 HydrophobicContact CG2-CD1 3.91Å; V127-F138 PolarHBondContact N-O 3Å; V127-F138 PolarHBondContact O-N 3.29Å; L136-F138 WeakPolarHBondContact CD1-O 3.4Å; F138-F163 HydrophobicContact CE1-CZ 4.14Å; F138-V174 HydrophobicContact CD2-CG1 4.28Å; F138-V174 HydrophobicContact CE1-CG1 4.08Å; F138-V174 HydrophobicContact CE1-CG2 4.1Å; F138-V174 HydrophobicContact CE2-CG1 3.82Å; F138-V174 HydrophobicContact CE2-CG2 4.48Å; F138-V174 HydrophobicContact CZ-CB 4.28Å; F138-V174 HydrophobicContact CZ-CG1 3.71Å; F138-V174 HydrophobicContact CZ-CG2 3.69Å; F138-I176 HydrophobicContact CB-CD1 4.1Å; F138-I176 HydrophobicContact CD1-CD1 4.15Å; F138-I176 HydrophobicContact CG-CD1 4.03Å; F138-P233 HydrophobicContact CE2-CG 4.32Å
139	E	96.7	Very high	95.1	Very high	85 Å²	85	48 Å²	48	40%	0.397	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	140.4	172.9	176.3	164.8	-168	0	0	109.9	V125 K126	V125-E139 WeakPolarHBondContact O-CA 3.44Å; K126-E139 WeakPolarHBondContact CE-OE1 3.35Å; K126-E139 HydrophobicContact CG-CB 4.34Å; K126-E139 HydrophobicContact CG-CG 4.01Å; K126-E139 IonicContact NZ-OE1 3.39Å; K126-E139 PolarHBondContact NZ-OE1 2.64Å; K126-E139 IonicContact NZ-OE2 2.77Å; K126-E139 PolarHBondContact NZ-OE2 3.3Å
140	S	97.6	Very high	95.4	Very high	21 Å²	21	46.7 Å²	46.7	15%	0.147	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	131.8	174.4	-160.6	0	0	0	0	111.4	A124 V125	A124-S140 CarbonylContact C-O 3.52Å; A124-S140 VanDerWaalsContact CA-O 3.26Å; A124-S140 WeakPolarHBondContact CA-O 3.5Å; V125-S140 PolarHBondContact N-O 2.76Å; V125-S140 PolarHBondContact O-N 3.01Å
141	N	97.9	Very high	95.6	Very high	77 Å²	77	47.8 Å²	47.8	41%	0.412	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	140	171.5	-64.6	-17	0	0	0	110.6	N123 R166	N123-N141 WeakPolarHBondContact O-CA 3.45Å; N141-R166 VanDerWaalsContact O-CG 3.26Å; N141-R166 WeakPolarHBondContact O-CG 3.37Å
142	T	98.4	Very high	95.9	Very high	12 Å²	12	47.2 Å²	47.2	7%	0.074	27%	0.274	C	S	.	.			trans	-117.3	166.6	175.8	68.2	0	0	0	0	109.9	N123 A124 V125 F163 P164 G165	N123-T142 WeakPolarHBondContact CA-OG1 3.27Å; N123-T142 PolarHBondContact O-N 3.2Å; N123-T142 PolarHBondContact O-OG1 2.99Å; A124-T142 PolarHBondContact N-OG1 3.38Å; V125-T142 HydrophobicContact CG2-CG2 4Å; T142-F163 HydrophobicContact CG2-CD2 3.68Å; T142-F163 HydrophobicContact CG2-CE2 4.05Å; T142-P164 WeakPolarHBondContact CB-O 3.23Å; T142-P164 WeakPolarHBondContact CG2-O 3.48Å; T142-G165 CarbonylContact C-O 3.55Å
143	C	97.7	Very high	96.3	Very high	22 Å²	22	44.4 Å²	44.4	15%	0.149	26%	0.255	C	S	.	.	S	Bend	trans	-64.7	175.4	156	66.6	0	0	0	0	109.6	N145 G165	C143-N145 PolarHBondContact O-N 3.01Å; C143-N145 VanDerWaalsContact O-N 3.1Å; C143-G165 PolarHBondContact N-O 2.83Å; C143-G165 PolarHBondContact SG-O 3.25Å; C143-G165 VanDerWaalsContact SG-O 3.33Å
144	S	97.8	Very high	96.4	Very high	78 Å²	78	42.6 Å²	42.6	55%	0.545	24%	0.238	S	C	.	.			trans	-51.9	121.7	173.3	-170.9	0	0	0	0	110.8	N123 P146	N123-S144 WeakPolarHBondContact OD1-CA 3.04Å; S144-P146 WeakPolarHBondContact O-CD 3.36Å
145	N	97.5	Very high	96.2	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	24%	0.238	C	C	.	.			trans	-125.8	60.9	-177.1	-171.5	13.7	0	0	0	110.5	I120 V122 C143 S147 G148 L149	I120-N145 VanDerWaalsContact CG2-ND2 3.34Å; I120-N145 WeakPolarHBondContact CG2-ND2 3.34Å; V122-N145 PolarHBondContact O-N 2.84Å; C143-N145 PolarHBondContact O-N 3.01Å; C143-N145 VanDerWaalsContact O-N 3.1Å; N145-S147 PolarHBondContact O-N 2.72Å; N145-G148 PolarHBondContact O-N 3.11Å; N145-G148 PolarHBondContact OD1-N 3.47Å; N145-L149 PolarHBondContact ND2-N 2.82Å; N145-L149 PolarHBondContact ND2-O 3.44Å; N145-L149 WeakPolarHBondContact OD1-CB 3.46Å; N145-L149 PolarHBondContact OD1-N 3.41Å
146	P	95.4	Very high	95.9	Very high	76 Å²	76	40.4 Å²	40.4	49%	0.494	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-29.5	-173.1	27.1	-35.4	0	0	0	112.7	R108 S144 G148	R108-P146 WeakPolarHBondContact CD-O 3.42Å; S144-P146 WeakPolarHBondContact O-CD 3.36Å; P146-G148 VanDerWaalsContact C-N 3.26Å; P146-G148 PolarHBondContact O-N 2.84Å
147	S	93.9	Very high	95.6	Very high	80 Å²	80	42.2 Å²	42.2	56%	0.559	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-3.9	177.7	-52.6	0	0	0	0	113.6	N145 L149	N145-S147 PolarHBondContact O-N 2.72Å; S147-L149 VanDerWaalsContact C-N 3.33Å; S147-L149 PolarHBondContact O-N 3.05Å
148	G	97.2	Very high	95.6	Very high	4 Å²	4	39.8 Å²	39.8	4%	0.041	23%	0.23	C	C	.	.			trans	64.9	35	-178.4	0	0	0	0	0	113.3	N145 P146 C150	N145-G148 PolarHBondContact O-N 3.11Å; N145-G148 PolarHBondContact OD1-N 3.47Å; P146-G148 VanDerWaalsContact C-N 3.26Å; P146-G148 PolarHBondContact O-N 2.84Å; G148-C150 PolarHBondContact O-N 2.97Å
149	L	97.8	Very high	95.5	Very high	26 Å²	26	37.6 Å²	37.6	14%	0.136	22%	0.221	C	C	.	.			trans	-62.3	118.6	-180	-60.7	-177	0	0	0	110.1	N145 S147 P164 L243 I246	N145-L149 PolarHBondContact ND2-N 2.82Å; N145-L149 PolarHBondContact ND2-O 3.44Å; N145-L149 WeakPolarHBondContact OD1-CB 3.46Å; N145-L149 PolarHBondContact OD1-N 3.41Å; S147-L149 VanDerWaalsContact C-N 3.33Å; S147-L149 PolarHBondContact O-N 3.05Å; L149-P164 HydrophobicContact CB-CG 3.83Å; L149-P164 HydrophobicContact CD1-CG 4.32Å; L149-P164 WeakPolarHBondContact O-CD 3.32Å; L149-L243 HydrophobicContact CD1-CB 3.89Å; L149-L243 WeakPolarHBondContact CD1-O 3.36Å; L149-I246 HydrophobicContact CB-CD1 4.05Å; L149-I246 HydrophobicContact CB-CG1 4.31Å
150	C	98.4	Very high	95.5	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.014	20%	0.202	C	C	.	.			trans	-159.2	147.2	170.1	177.6	0	0	0	0	105.6	R111 I120 G148 V162 F163	R111-C150 PolarHBondContact NH1-O 2.84Å; R111-C150 VanDerWaalsContact NH1-O 3.11Å; R111-C150 PolarHBondContact NH2-O 2.87Å; I120-C150 HydrophobicContact CD1-CB 3.81Å; I120-C150 HydrophobicContact CG1-CB 3.43Å; I120-C150 VanDerWaalsContact CG1-CB 3.43Å; G148-C150 PolarHBondContact O-N 2.97Å; C150-V162 CarbonylContact C-O 3.59Å; C150-V162 VanDerWaalsContact CA-O 3.24Å; C150-V162 WeakPolarHBondContact CA-O 3.38Å; C150-F163 HydrophobicContact CB-CB 4.28Å
151	Y	98	Very high	95.5	Very high	29 Å²	29	32.6 Å²	32.6	11%	0.114	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	135.7	168.3	-164.9	-74.5	0	0	0	108.5	Y24 V161 V162 T247 L248	Y24-Y151 PolarHBondContact OH-OH 3.45Å; Y151-V161 WeakPolarHBondContact O-CA 3.4Å; Y151-V162 PolarHBondContact N-O 3.38Å; Y151-V162 PolarHBondContact O-N 2.96Å; Y151-T247 WeakPolarHBondContact CE2-OG1 3.36Å; Y151-L248 HydrophobicContact CD1-CB 3.75Å; Y151-L248 HydrophobicContact CD1-CD1 3.96Å; Y151-L248 HydrophobicContact CD1-CG 3.87Å; Y151-L248 HydrophobicContact CE1-CB 3.77Å; Y151-L248 HydrophobicContact CE1-CG 4.39Å
152	V	97.1	Very high	95.5	Very high	5 Å²	5	29 Å²	29	3%	0.03	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.8	-175.9	179.8	0	0	0	0	108	R111 R113 I118 Q154 V161	R111-V152 HydrophobicContact CB-CG2 3.62Å; R111-V152 HydrophobicContact CG-CG2 4.24Å; R113-V152 VanDerWaalsContact CD-CG1 3.42Å; R113-V152 HydrophobicContact CG-CG1 3.32Å; I118-V152 HydrophobicContact CB-CG2 4.41Å; I118-V152 HydrophobicContact CD1-CG1 4.2Å; I118-V152 HydrophobicContact CD1-CG2 3.95Å; I118-V152 HydrophobicContact CG1-CG2 4.04Å; V152-Q154 PolarHBondContact O-NE2 3.05Å; V152-V161 HydrophobicContact CG1-CG2 4.14Å; V152-V161 HydrophobicContact CG2-CG1 4.07Å; V152-V161 HydrophobicContact CG2-CG2 4.21Å
153	C	96.3	Very high	95.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.007	17%	0.172	C	C	.	.			trans	-63.7	134.1	171.4	-169.4	0	0	0	0	109.4	R113 N158 L160 L248	R113-C153 PolarHBondContact NE-O 3.46Å; C153-N158 VanDerWaalsContact CB-O 3.28Å; C153-N158 WeakPolarHBondContact CB-O 3.36Å; C153-N158 PolarHBondContact SG-O 3.15Å; C153-L160 HydrophobicContact CB-CB 4.04Å; C153-L160 WeakPolarHBondContact CB-O 3.19Å; C153-L160 PolarHBondContact N-O 3.42Å; C153-L248 HydrophobicContact CB-CD1 3.68Å
154	Q	94.1	Very high	95.6	Very high	47 Å²	47	27.6 Å²	27.6	22%	0.22	17%	0.167	C	C	.	.			trans	-98	-2.4	-179.2	-58.6	-62.2	-33.1	0	0	112.7	Q22 F66 L112 V152	Q22-Q154 HydrophobicContact CB-CG 4.07Å; Q22-Q154 HydrophobicContact CG-CG 3.79Å; F66-Q154 HydrophobicContact CE2-CG 4.44Å; F66-Q154 HydrophobicContact CZ-CB 3.77Å; F66-Q154 HydrophobicContact CZ-CG 3.89Å; L112-Q154 PolarHBondContact O-NE2 2.73Å; V152-Q154 PolarHBondContact O-NE2 3.05Å
155	S	91.6	Very high	95.6	Very high	26 Å²	26	23.9 Å²	23.9	18%	0.182	14%	0.141	C	C	.	.			trans	-63.5	135.7	176.4	-178.6	0	0	0	0	111.3	R113 D157 N158	R113-S155 PolarHBondContact NH2-O 3.4Å; S155-D157 VanDerWaalsContact C-N 3.29Å; S155-D157 PolarHBondContact OG-N 2.98Å; S155-N158 CarbonylContact O-C 3.52Å; S155-N158 PolarHBondContact O-N 3.42Å
156	V	88.3	Confident	95.6	Very high	73 Å²	73	31.2 Å²	31.2	44%	0.442	17%	0.168	S	C	.	.	S	Bend	trans	-63.1	-38.7	174.7	174.8	0	0	0	0	110.5	S225 T226	V156-S225 WeakPolarHBondContact CA-O 3.3Å; V156-S225 WeakPolarHBondContact CB-O 3.46Å; V156-S225 VanDerWaalsContact CG1-O 3.32Å; V156-S225 WeakPolarHBondContact CG1-O 3.45Å; V156-S225 WeakPolarHBondContact CG2-O 3.5Å; V156-T226 WeakPolarHBondContact O-CA 3.45Å; V156-T226 WeakPolarHBondContact O-CB 3.48Å; V156-T226 PolarHBondContact O-OG1 3.33Å
157	D	89	Confident	95.8	Very high	117 Å²	117	36 Å²	36	63%	0.626	18%	0.176	S	C	*	.	S	Bend	trans	-83.8	-17.7	-174.8	-58	-46.7	0	0	0	112.9	S155	S155-D157 VanDerWaalsContact C-N 3.29Å; S155-D157 PolarHBondContact OG-N 2.98Å
158	N	92.2	Very high	96	Very high	5 Å²	5	35.2 Å²	35.2	3%	0.027	17%	0.169	C	C	.	.			trans	-138.6	74.6	-175	-171.4	20	0	0	0	111.1	C153 S155 L160 H175 D251 G252	C153-N158 VanDerWaalsContact CB-O 3.28Å; C153-N158 WeakPolarHBondContact CB-O 3.36Å; C153-N158 PolarHBondContact SG-O 3.15Å; S155-N158 CarbonylContact O-C 3.52Å; S155-N158 PolarHBondContact O-N 3.42Å; N158-L160 PolarHBondContact O-N 3.32Å; N158-H175 PolarHBondContact OD1-CE1 3.26Å; N158-D251 WeakPolarHBondContact CB-O 3.43Å; N158-D251 PolarHBondContact ND2-O 3.45Å; N158-G252 WeakPolarHBondContact ND2-CA 3.38Å; N158-G252 PolarHBondContact ND2-O 2.89Å
159	P	92.8	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.			trans	-76.5	54.2	-177.4	35.8	-40.5	0	0	0	112	I176 T226 A228	P159-I176 VanDerWaalsContact CB-O 3.31Å; P159-I176 WeakPolarHBondContact CB-O 3.49Å; P159-I176 PolarHBondContact O-N 2.96Å; P159-T226 HydrophobicContact CB-CG2 4.16Å; P159-T226 HydrophobicContact CG-CG2 4.13Å; P159-A228 HydrophobicContact CG-CB 3.89Å
160	L	96.3	Very high	96.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	130.6	-174.2	-177.7	64.7	0	0	0	111.2	C153 N158 V162 L173 L248 T270	C153-L160 HydrophobicContact CB-CB 4.04Å; C153-L160 WeakPolarHBondContact CB-O 3.19Å; C153-L160 PolarHBondContact N-O 3.42Å; N158-L160 PolarHBondContact O-N 3.32Å; L160-V162 HydrophobicContact CD1-CG1 4.37Å; L160-V162 HydrophobicContact CD2-CG1 3.96Å; L160-V162 HydrophobicContact CG-CG1 3.88Å; L160-L173 HydrophobicContact CD1-CB 4.03Å; L160-L173 HydrophobicContact CD2-CD2 4.37Å; L160-L248 HydrophobicContact CB-CD1 4.3Å; L160-L248 HydrophobicContact CD2-CD1 4.01Å; L160-L248 HydrophobicContact CD2-CD2 4.01Å; L160-L248 HydrophobicContact CG-CD1 4.17Å; L160-T270 HydrophobicContact CD2-CG2 3.82Å
161	V	97.9	Very high	96.1	Very high	1 Å²	1	34 Å²	34	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.1	171.3	-176.2	0	0	0	0	108.4	Y151 V152 F163 V174 I176	Y151-V161 WeakPolarHBondContact O-CA 3.4Å; V152-V161 HydrophobicContact CG1-CG2 4.14Å; V152-V161 HydrophobicContact CG2-CG1 4.07Å; V152-V161 HydrophobicContact CG2-CG2 4.21Å; V161-F163 HydrophobicContact CG1-CD1 4.02Å; V161-F163 HydrophobicContact CG1-CE1 4.33Å; V161-V174 PolarHBondContact N-O 3.45Å; V161-V174 PolarHBondContact O-N 2.96Å; V161-I176 HydrophobicContact CB-CG1 4.25Å; V161-I176 HydrophobicContact CG2-CB 4.27Å; V161-I176 HydrophobicContact CG2-CG1 3.62Å
162	V	98.7	Very high	96.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.7	-180	-58.3	0	0	0	0	111.4	C150 Y151 L160 V171 S172 L173 I246 L248 L255	C150-V162 CarbonylContact C-O 3.59Å; C150-V162 VanDerWaalsContact CA-O 3.24Å; C150-V162 WeakPolarHBondContact CA-O 3.38Å; Y151-V162 PolarHBondContact N-O 3.38Å; Y151-V162 PolarHBondContact O-N 2.96Å; L160-V162 HydrophobicContact CD1-CG1 4.37Å; L160-V162 HydrophobicContact CD2-CG1 3.96Å; L160-V162 HydrophobicContact CG-CG1 3.88Å; V162-V171 HydrophobicContact CB-CG1 4.09Å; V162-S172 VanDerWaalsContact CA-O 3.28Å; V162-S172 WeakPolarHBondContact CA-O 3.26Å; V162-L173 HydrophobicContact CG1-CG 3.87Å; V162-I246 HydrophobicContact CG2-CD1 4.4Å; V162-L248 HydrophobicContact CG1-CD1 4.22Å; V162-L248 HydrophobicContact CG1-CD2 4.03Å; V162-L248 HydrophobicContact CG1-CG 4.39Å; V162-L248 HydrophobicContact CG2-CD1 4.19Å; V162-L248 HydrophobicContact CG2-CD2 4.24Å; V162-L248 HydrophobicContact CG2-CG 3.95Å; V162-L255 HydrophobicContact CB-CD1 4.43Å; V162-L255 HydrophobicContact CG1-CD1 4.5Å; V162-L255 HydrophobicContact CG2-CD1 4Å
163	F	98.7	Very high	96.2	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	164.7	-176.4	51.5	-87.7	0	0	0	110.5	V125 F138 T142 C150 V161 G165 V171 S172 V174	V125-F163 HydrophobicContact CB-CD1 4.49Å; V125-F163 HydrophobicContact CB-CD2 4.2Å; V125-F163 HydrophobicContact CB-CE2 4.28Å; V125-F163 HydrophobicContact CB-CG 4.32Å; V125-F163 HydrophobicContact CB-CZ 4.46Å; V125-F163 HydrophobicContact CG1-CD1 4.33Å; V125-F163 HydrophobicContact CG1-CE1 4.41Å; V125-F163 HydrophobicContact CG2-CB 3.97Å; V125-F163 HydrophobicContact CG2-CD1 4.34Å; V125-F163 HydrophobicContact CG2-CD2 3.75Å; V125-F163 HydrophobicContact CG2-CE2 4.32Å; V125-F163 HydrophobicContact CG2-CG 3.77Å; F138-F163 HydrophobicContact CE1-CZ 4.14Å; T142-F163 HydrophobicContact CG2-CD2 3.68Å; T142-F163 HydrophobicContact CG2-CE2 4.05Å; C150-F163 HydrophobicContact CB-CB 4.28Å; V161-F163 HydrophobicContact CG1-CD1 4.02Å; V161-F163 HydrophobicContact CG1-CE1 4.33Å; F163-G165 PolarHBondContact O-N 3.09Å; F163-V171 CarbonylContact O-C 3.6Å; F163-S172 PolarHBondContact N-O 3.06Å; F163-S172 VanDerWaalsContact N-O 3.13Å; F163-S172 PolarHBondContact O-N 3.46Å; F163-V174 HydrophobicContact CE1-CB 4.34Å; F163-V174 HydrophobicContact CE1-CG2 3.69Å; F163-V174 HydrophobicContact CZ-CG2 3.74Å
164	P	98.6	Very high	96.2	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.032	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	133.9	174.4	-26.8	36	0	0	0	112.6	T142 L149 L243	T142-P164 WeakPolarHBondContact CB-O 3.23Å; T142-P164 WeakPolarHBondContact CG2-O 3.48Å; L149-P164 HydrophobicContact CB-CG 3.83Å; L149-P164 HydrophobicContact CD1-CG 4.32Å; L149-P164 WeakPolarHBondContact O-CD 3.32Å; P164-L243 HydrophobicContact CB-CD1 4.19Å; P164-L243 HydrophobicContact CG-CD1 4.17Å
165	G	98.3	Very high	96.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.152	C	C	.	.			trans	-75.6	-170.1	174.9	0	0	0	0	0	112.6	T142 C143 F163 R167 V170 S172	T142-G165 CarbonylContact C-O 3.55Å; C143-G165 PolarHBondContact N-O 2.83Å; C143-G165 PolarHBondContact SG-O 3.25Å; C143-G165 VanDerWaalsContact SG-O 3.33Å; F163-G165 PolarHBondContact O-N 3.09Å; G165-R167 PolarHBondContact O-N 3.12Å; G165-V170 PolarHBondContact N-O 3.31Å; G165-S172 WeakPolarHBondContact CA-OG 3.43Å
166	R	97.8	Very high	96	Very high	158 Å²	158	30.7 Å²	30.7	60%	0.596	15%	0.145	S	C	*	.	S	Bend	trans	-70.8	-14.8	-179.3	-67.5	-179	-178	-137.2	2.2	114.2	N141	N141-R166 VanDerWaalsContact O-CG 3.26Å; N141-R166 WeakPolarHBondContact O-CG 3.37Å
167	R	98.1	Very high	95.8	Very high	177 Å²	177	27.2 Å²	27.2	67%	0.668	12%	0.124	S	C	*	.	S	Bend	trans	-120	146.7	179.5	-75.1	176.5	47.9	80.8	6.5	110.1	G165 G169 V170	G165-R167 PolarHBondContact O-N 3.12Å; R167-G169 PolarHBondContact O-N 3.2Å; R167-V170 HydrophobicContact CB-CG2 3.85Å; R167-V170 WeakPolarHBondContact O-CB 3.04Å; R167-V170 PolarHBondContact O-N 3.05Å
168	P	98.1	Very high	95.2	Very high	62 Å²	62	24 Å²	24	40%	0.403	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	138.4	171.4	-29	36.7	0	0	0	112.5	V170 P242	P168-V170 PolarHBondContact O-N 3.14Å; P168-V170 VanDerWaalsContact O-N 3.15Å; P168-P242 HydrophobicContact CB-CB 4.48Å; P168-P242 HydrophobicContact CB-CG 4.05Å
169	G	98.3	Very high	93.7	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.01	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	-5	176.7	0	0	0	0	0	115.7	R167 A238 H239 N241	R167-G169 PolarHBondContact O-N 3.2Å; G169-A238 WeakPolarHBondContact O-CB 3.44Å; G169-A238 PolarHBondContact O-N 2.86Å; G169-H239 CarbonylContact C-O 3.59Å; G169-H239 VanDerWaalsContact CA-O 3.27Å; G169-H239 WeakPolarHBondContact CA-O 3.43Å; G169-H239 PolarHBondContact O-N 3.05Å; G169-N241 WeakPolarHBondContact CA-O 3.34Å; G169-N241 PolarHBondContact N-O 2.66Å
170	V	98.7	Very high	91.7	Very high	6 Å²	6	30.7 Å²	30.7	4%	0.036	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	139.2	172.3	179.9	0	0	0	0	110	G165 R167 P168 Q235 I236 I237 L243	G165-V170 PolarHBondContact N-O 3.31Å; R167-V170 HydrophobicContact CB-CG2 3.85Å; R167-V170 WeakPolarHBondContact O-CB 3.04Å; R167-V170 PolarHBondContact O-N 3.05Å; P168-V170 PolarHBondContact O-N 3.14Å; P168-V170 VanDerWaalsContact O-N 3.15Å; V170-Q235 HydrophobicContact CG1-CB 4.02Å; V170-Q235 HydrophobicContact CG1-CG 4.26Å; V170-I236 CarbonylContact C-O 3.51Å; V170-I236 VanDerWaalsContact CA-O 3.31Å; V170-I236 WeakPolarHBondContact CA-O 3.34Å; V170-I237 HydrophobicContact CG2-CG1 4.25Å; V170-L243 WeakPolarHBondContact O-CD1 3.1Å
171	V	98.8	Very high	89	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.9	169.8	-173.3	0	0	0	0	108.8	V162 F163 L173 Q235 I236 A238 L243 I246 L255 T257	V162-V171 HydrophobicContact CB-CG1 4.09Å; F163-V171 CarbonylContact O-C 3.6Å; V171-L173 HydrophobicContact CB-CD1 4.34Å; V171-L173 HydrophobicContact CG1-CD1 4.05Å; V171-Q235 CarbonylContact O-C 3.53Å; V171-Q235 VanDerWaalsContact O-CA 3.25Å; V171-Q235 WeakPolarHBondContact O-CA 3.4Å; V171-I236 PolarHBondContact N-O 2.77Å; V171-I236 PolarHBondContact O-N 3.3Å; V171-A238 HydrophobicContact CG2-CB 3.98Å; V171-L243 HydrophobicContact CG2-CD1 3.59Å; V171-L243 HydrophobicContact CG2-CD2 4.16Å; V171-I246 HydrophobicContact CG2-CG2 4.45Å; V171-L255 HydrophobicContact CB-CD2 4.33Å; V171-L255 HydrophobicContact CG1-CD2 3.95Å; V171-L255 HydrophobicContact CG2-CD2 4.46Å; V171-T257 HydrophobicContact CG2-CG2 3.9Å
172	S	98.5	Very high	85.9	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.028	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	138.9	167.3	-70	0	0	0	0	110.2	V162 F163 G165 R234	V162-S172 VanDerWaalsContact CA-O 3.28Å; V162-S172 WeakPolarHBondContact CA-O 3.26Å; F163-S172 PolarHBondContact N-O 3.06Å; F163-S172 VanDerWaalsContact N-O 3.13Å; F163-S172 PolarHBondContact O-N 3.46Å; G165-S172 WeakPolarHBondContact CA-OG 3.43Å; S172-R234 WeakPolarHBondContact CA-O 3.05Å
173	L	98.3	Very high	82.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	118.8	179.6	-74.4	82.3	0	0	0	108.4	L160 V162 V171 P233 R234 I236 L255 T270	L160-L173 HydrophobicContact CD1-CB 4.03Å; L160-L173 HydrophobicContact CD2-CD2 4.37Å; V162-L173 HydrophobicContact CG1-CG 3.87Å; V171-L173 HydrophobicContact CB-CD1 4.34Å; V171-L173 HydrophobicContact CG1-CD1 4.05Å; L173-P233 WeakPolarHBondContact O-CA 3.4Å; L173-R234 HydrophobicContact CB-CB 4.29Å; L173-R234 PolarHBondContact N-O 2.99Å; L173-R234 PolarHBondContact O-N 2.85Å; L173-I236 HydrophobicContact CD1-CB 4.39Å; L173-I236 HydrophobicContact CD1-CD1 3.84Å; L173-I236 HydrophobicContact CD1-CG1 3.91Å; L173-I236 HydrophobicContact CD2-CD1 4.13Å; L173-L255 HydrophobicContact CD1-CD2 4.36Å; L173-T270 HydrophobicContact CD2-CG2 4.21Å
174	V	96.5	Very high	79.1	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.018	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	123.2	-176	-172.8	0	0	0	0	110	F138 V161 F163 I176 P233	F138-V174 HydrophobicContact CD2-CG1 4.28Å; F138-V174 HydrophobicContact CE1-CG1 4.08Å; F138-V174 HydrophobicContact CE1-CG2 4.1Å; F138-V174 HydrophobicContact CE2-CG1 3.82Å; F138-V174 HydrophobicContact CE2-CG2 4.48Å; F138-V174 HydrophobicContact CZ-CB 4.28Å; F138-V174 HydrophobicContact CZ-CG1 3.71Å; F138-V174 HydrophobicContact CZ-CG2 3.69Å; V161-V174 PolarHBondContact N-O 3.45Å; V161-V174 PolarHBondContact O-N 2.96Å; F163-V174 HydrophobicContact CE1-CB 4.34Å; F163-V174 HydrophobicContact CE1-CG2 3.69Å; F163-V174 HydrophobicContact CZ-CG2 3.74Å; V174-I176 HydrophobicContact CB-CD1 4.44Å; V174-I176 HydrophobicContact CG1-CD1 3.56Å; V174-I176 HydrophobicContact CG1-CG1 4.32Å; V174-P233 HydrophobicContact CG2-CB 4.14Å; V174-P233 HydrophobicContact CG2-CG 4.39Å
175	H	93.3	Very high	75.8	Confident	26 Å²	26	58.5 Å²	58.5	12%	0.12	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	118.9	170.5	-71.2	-105.7	0	0	0	109.3	N158 N230 M231 R234	N158-H175 PolarHBondContact OD1-CE1 3.26Å; H175-N230 PolarHBondContact O-OD1 3.09Å; H175-M231 HydrophobicContact CB-CB 3.94Å; H175-M231 HydrophobicContact CB-CG 4.12Å; H175-R234 PolarHBondContact NE2-NH2 3.1Å
176	I	89.2	Confident	72.3	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.026	36%	0.36	C	S	.	.			trans	-103.1	77.7	177.1	-56.8	-60.9	0	0	0	107.9	R113 R116 V127 I137 F138 P159 V161 V174	R113-I176 PolarHBondContact NH1-O 3.32Å; R116-I176 HydrophobicContact CG-CG2 3.84Å; V127-I176 HydrophobicContact CG1-CD1 4.46Å; V127-I176 HydrophobicContact CG1-CG1 4.44Å; V127-I176 HydrophobicContact CG1-CG2 3.74Å; V127-I176 HydrophobicContact CG2-CD1 4.08Å; V127-I176 HydrophobicContact CG2-CG1 4.31Å; I137-I176 HydrophobicContact CD1-CG2 4.11Å; F138-I176 HydrophobicContact CB-CD1 4.1Å; F138-I176 HydrophobicContact CD1-CD1 4.15Å; F138-I176 HydrophobicContact CG-CD1 4.03Å; P159-I176 VanDerWaalsContact CB-O 3.31Å; P159-I176 WeakPolarHBondContact CB-O 3.49Å; P159-I176 PolarHBondContact O-N 2.96Å; V161-I176 HydrophobicContact CB-CG1 4.25Å; V161-I176 HydrophobicContact CG2-CB 4.27Å; V161-I176 HydrophobicContact CG2-CG1 3.62Å; V174-I176 HydrophobicContact CB-CD1 4.44Å; V174-I176 HydrophobicContact CG1-CD1 3.56Å; V174-I176 HydrophobicContact CG1-CG1 4.32Å
177	G	83.7	Confident	69.1	Low	0 Å²	0	64.5 Å²	64.5	0%	0	37%	0.369	C	S	.	.			trans	-84.5	-155.6	178.4	0	0	0	0	0	113.1	R116 A228 N230	R116-G177 PolarHBondContact NH2-O 2.81Å; G177-A228 CarbonylContact C-O 3.56Å; G177-A228 WeakPolarHBondContact CA-O 3.4Å; G177-N230 PolarHBondContact N-OD1 2.88Å
178	N	77.3	Confident	65.6	Low	50 Å²	50	63 Å²	63	27%	0.267	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-73.7	126.9	168.9	-72.4	12.9	0	0	0	109.3	G180 S224 T226 A228	N178-G180 PolarHBondContact O-N 3.04Å; N178-S224 VanDerWaalsContact CG-CB 3.48Å; N178-S224 WeakPolarHBondContact ND2-CB 3.48Å; N178-S224 PolarHBondContact ND2-OG 3.23Å; N178-S224 WeakPolarHBondContact OD1-CB 3.24Å; N178-T226 PolarHBondContact ND2-O 2.8Å; N178-T226 PolarHBondContact OD1-O 3.32Å; N178-T226 VanDerWaalsContact OD1-O 3.04Å; N178-A228 PolarHBondContact N-O 2.7Å
179	T	61.1	Low	62.3	Low	59 Å²	59	63.9 Å²	63.9	36%	0.362	39%	0.387	S	S	.	.			trans	-65	116.2	157.5	49.6	0	0	0	0	105.7	I137 S181	I137-T179 HydrophobicContact CB-CG2 4.43Å; I137-T179 HydrophobicContact CG2-CG2 4.42Å; T179-S181 PolarHBondContact O-N 3.21Å
180	G	48.9	Very low	59	Low	86 Å²	86	71.8 Å²	71.8	89%	0.887	43%	0.429	S	S	*	.			trans	-63.1	24.4	-179.9	0	0	0	0	0	115.4	N178 N182	N178-G180 PolarHBondContact O-N 3.04Å; G180-N182 PolarHBondContact O-N 2.98Å
181	S	40.9	Very low	55.6	Low	98 Å²	98	78.5 Å²	78.5	69%	0.685	46%	0.464	S	S	*	.			trans	-84.6	99.5	176.9	-57.6	0	0	0	0	109.9	T179	T179-S181 PolarHBondContact O-N 3.21Å
182	N	31.8	Very low	52.3	Low	124 Å²	124	85.3 Å²	85.3	66%	0.663	50%	0.501	S	S	*	.			trans	71.5	85	159.1	-66	-19.7	0	0	0	118.4	G180 N184	G180-N182 PolarHBondContact O-N 2.98Å; N182-N184 HydrophobicContact CB-CB 4.19Å; N182-N184 PolarHBondContact O-N 3.45Å
183	V	29.9	Very low	49.1	Very low	130 Å²	130	93.1 Å²	93.1	79%	0.788	54%	0.542	S	S	*	.				-56.5	75	125.3	-175.6	0	0	0	0	108.2	L185	V183-L185 HydrophobicContact CG1-CD1 3.52Å
184	N	24.7	Very low	45.8	Very low	110 Å²	110	99.3 Å²	99.3	59%	0.588	59%	0.585	S	S	*	*			trans	-103.6	83.8	154.9	-87.3	-7.8	0	0	0	105.8	N182 N186	N182-N184 HydrophobicContact CB-CB 4.19Å; N182-N184 PolarHBondContact O-N 3.45Å; N184-N186 PolarHBondContact O-N 2.91Å
185	L	29.7	Very low	42.6	Very low	130 Å²	130	102.2 Å²	102.2	68%	0.681	62%	0.616	S	S	*	*			trans	-64.6	73.4	152.1	-80.4	93.2	0	0	0	107.5	V183 N187	V183-L185 HydrophobicContact CG1-CD1 3.52Å; L185-N187 PolarHBondContact O-N 2.97Å
186	N	25.9	Very low	39.3	Very low	138 Å²	138	108.5 Å²	108.5	74%	0.738	65%	0.651	S	S	*	*			trans	-85.7	83.6	152	-91.9	-1.7	0	0	0	106.2	N184 N188	N184-N186 PolarHBondContact O-N 2.91Å; N186-N188 PolarHBondContact O-N 3.21Å
187	N	28.6	Very low	36.5	Very low	145 Å²	145	115.5 Å²	115.5	78%	0.775	69%	0.687	S	S	*	*			trans	-55.4	88	149.6	-75	-19.8	0	0	0	107	L185	L185-N187 PolarHBondContact O-N 2.97Å
188	N	24.9	Very low	33.9	Very low	147 Å²	147	121.1 Å²	121.1	79%	0.786	72%	0.721	S	S	*	*			trans	-141.9	101.9	162.1	-122.7	-2.7	0	0	0	109	N186	N186-N188 PolarHBondContact O-N 3.21Å
189	A	28.5	Very low	31.5	Very low	80 Å²	80	126.3 Å²	126.3	66%	0.661	75%	0.749	S	S	*	*			trans	43.1	107	148.7	0	0	0	0	0	117.7
190	N	29.1	Very low	29.7	Very low	167 Å²	167	130.5 Å²	130.5	89%	0.893	77%	0.769	S	S	*	*				-158.9	120.4	106.8	-97.4	-21.2	0	0	0	112
191	N	29	Very low	28.6	Very low	146 Å²	146	134.2 Å²	134.2	78%	0.781	77%	0.768	S	S	*	*			trans	-52.3	151.3	163.8	-77.2	-31.4	0	0	0	112.1
192	N	27.9	Very low	28.1	Very low	143 Å²	143	134.9 Å²	134.9	77%	0.765	77%	0.773	S	S	*	*			trans	122.2	78.2	148.6	-63.5	-15.4	0	0	0	112.6
193	N	33.1	Very low	27.9	Very low	168 Å²	168	136.2 Å²	136.2	90%	0.898	78%	0.781	S	S	*	*				-165.4	125.3	117.6	-93.6	-20.8	0	0	0	110.8
194	S	27.1	Very low	27.7	Very low	130 Å²	130	136.3 Å²	136.3	91%	0.909	78%	0.782	S	S	*	*			trans	-58.9	135.8	179	-169.1	0	0	0	0	111.8
195	G	30	Very low	27.7	Very low	65 Å²	65	137.2 Å²	137.2	67%	0.67	79%	0.791	S	S	*	*			trans	173.6	65.1	177.5	0	0	0	0	0	111.9	I197	G195-I197 PolarHBondContact O-N 2.9Å
196	N	24.8	Very low	27.6	Very low	157 Å²	157	137.8 Å²	137.8	84%	0.84	80%	0.8	S	S	*	*			trans	-46.9	115.2	172.2	-78.9	-19.2	0	0	0	111.9
197	I	30.8	Very low	27.7	Very low	153 Å²	153	138.7 Å²	138.7	79%	0.785	81%	0.805	S	S	*	*			trans	-133.4	96.4	154.2	-56.1	176.8	0	0	0	107.2	G195 N199	G195-I197 PolarHBondContact O-N 2.9Å; I197-N199 PolarHBondContact O-N 2.83Å
198	T	28.8	Very low	27.7	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.724	80%	0.804	S	S	*	*			trans	-62.7	121.9	170.8	41	0	0	0	0	110.3	N200	T198-N200 PolarHBondContact O-N 3.49Å; T198-N200 VanDerWaalsContact O-N 3.09Å
199	N	25.6	Very low	27.9	Very low	159 Å²	159	138.4 Å²	138.4	85%	0.85	80%	0.803	S	S	*	*			trans	-65.4	99.4	172.4	-81.2	-20.5	0	0	0	110.7	I197	I197-N199 PolarHBondContact O-N 2.83Å
200	N	24.7	Very low	28.2	Very low	147 Å²	147	142.7 Å²	142.7	79%	0.786	81%	0.814	S	S	*	*			trans	-88.7	106.2	161.4	-84.4	-7.3	0	0	0	109.6	T198	T198-N200 PolarHBondContact O-N 3.49Å; T198-N200 VanDerWaalsContact O-N 3.09Å
201	N	25.7	Very low	28.6	Very low	163 Å²	163	138 Å²	138	87%	0.872	81%	0.805	S	S	*	*			trans	-58.3	123.9	151	-84.7	-23.1	0	0	0	109.3
202	S	29.8	Very low	29.1	Very low	112 Å²	112	134.6 Å²	134.6	78%	0.783	79%	0.792	S	S	*	*			trans	-175.1	131.5	140	27	0	0	0	0	110.8
203	N	26.7	Very low	29.9	Very low	153 Å²	153	132.8 Å²	132.8	82%	0.818	79%	0.786	S	S	*	*			trans	-52.6	137.6	165.4	-62.1	-37.5	0	0	0	111
204	T	26	Very low	31.4	Very low	132 Å²	132	130 Å²	130	81%	0.81	77%	0.772	S	S	*	*				169.1	128.2	129	33.6	0	0	0	0	111.7
205	T	25.9	Very low	32.9	Very low	128 Å²	128	128.6 Å²	128.6	79%	0.785	76%	0.758	S	S	*	*			trans	2.1	113.7	150.9	52.1	0	0	0	0	119.2
206	T	27.2	Very low	34.6	Very low	143 Å²	143	126.9 Å²	126.9	88%	0.877	73%	0.733	S	S	*	*				-169.3	120.9	118.5	40.5	0	0	0	0	110.1
207	N	27.6	Very low	36.5	Very low	157 Å²	157	122.1 Å²	122.1	84%	0.84	71%	0.712	S	S	*	*			trans	-60.5	128.3	169.9	-71	-29.5	0	0	0	110.8
208	N	27.8	Very low	38	Very low	141 Å²	141	115.2 Å²	115.2	75%	0.754	68%	0.676	S	S	*	*			trans	170.1	80.2	142	-86.4	-12.4	0	0	0	109.8
209	N	30.2	Very low	39.3	Very low	144 Å²	144	115.6 Å²	115.6	77%	0.77	67%	0.674	S	S	*	*			trans	-128.4	76.7	160.9	-87.4	-14.1	0	0	0	108.6	G211	N209-G211 PolarHBondContact O-N 2.8Å
210	I	34	Very low	40.8	Very low	171 Å²	171	112.1 Å²	112.1	88%	0.877	66%	0.658	S	S	*	*	S	Bend	trans	-75.1	108.7	162.4	-69.9	164.5	0	0	0	105.9
211	G	38.1	Very low	42.2	Very low	68 Å²	68	111.3 Å²	111.3	70%	0.701	65%	0.653	S	S	*	*			trans	106.3	18.3	163	0	0	0	0	0	118.9	N209 T213	N209-G211 PolarHBondContact O-N 2.8Å; G211-T213 PolarHBondContact O-N 3.38Å
212	S	39.5	Very low	43.6	Very low	75 Å²	75	104.6 Å²	104.6	52%	0.524	62%	0.618	S	S	.	*			trans	-64.2	101.8	169.5	-54.6	0	0	0	0	110.3	N214	S212-N214 PolarHBondContact O-N 2.91Å; S212-N214 VanDerWaalsContact O-N 3.11Å
213	T	44.5	Very low	45	Very low	104 Å²	104	104.4 Å²	104.4	64%	0.638	61%	0.614	S	S	*	*			trans	-68	104.6	168.1	50.8	0	0	0	0	108.1	G211 T215	G211-T213 PolarHBondContact O-N 3.38Å; T213-T215 PolarHBondContact O-N 2.91Å
214	N	63.8	Low	46.7	Very low	111 Å²	111	99.8 Å²	99.8	59%	0.594	59%	0.594	S	S	*	*			trans	-67.2	102.2	170.5	-73.6	-14	0	0	0	108.1	T68 S212 I216	T68-N214 WeakPolarHBondContact CB-O 3.07Å; T68-N214 HydrophobicContact CG2-CB 4.4Å; T68-N214 WeakPolarHBondContact CG2-O 3.37Å; S212-N214 PolarHBondContact O-N 2.91Å; S212-N214 VanDerWaalsContact O-N 3.11Å; N214-I216 PolarHBondContact O-N 2.91Å
215	T	59.6	Low	48.5	Very low	100 Å²	100	94.7 Å²	94.7	61%	0.613	56%	0.564	S	S	*	*			trans	-70.4	124.3	174.1	50	0	0	0	0	109.6	I93 T213	I93-T215 HydrophobicContact CD1-CG2 3.69Å; T213-T215 PolarHBondContact O-N 2.91Å
216	I	66.2	Low	50.5	Low	28 Å²	28	88.7 Å²	88.7	14%	0.144	53%	0.527	C	S	.	.			trans	-116.6	122.6	174.1	-61	-179.2	0	0	0	108.7	L65 T68 N69 L70 H114 N214	L65-I216 HydrophobicContact CD2-CD1 4.07Å; T68-I216 HydrophobicContact CG2-CD1 3.75Å; T68-I216 HydrophobicContact CG2-CG1 4.15Å; N69-I216 PolarHBondContact OD1-N 2.82Å; L70-I216 HydrophobicContact CD1-CB 4Å; L70-I216 HydrophobicContact CD1-CG2 3.83Å; H114-I216 WeakPolarHBondContact ND1-CD1 3.41Å; N214-I216 PolarHBondContact O-N 2.91Å
217	S	63.7	Low	52.5	Low	57 Å²	57	88.6 Å²	88.6	40%	0.399	52%	0.521	S	S	.	.			trans	-93.5	121.1	168	48.8	0	0	0	0	110.3	N219 T220	S217-N219 PolarHBondContact O-N 2.68Å; S217-N219 VanDerWaalsContact O-N 3.08Å; S217-T220 PolarHBondContact O-N 2.94Å; S217-T220 PolarHBondContact OG-OG1 2.78Å
218	I	63.2	Low	54.7	Low	9 Å²	9	82.2 Å²	82.2	5%	0.046	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.5	175.7	-71.3	164.8	0	0	0	112.4	L70 L89 V98 F130 P132 T220	L70-I218 HydrophobicContact CD1-CD1 4.26Å; L70-I218 HydrophobicContact CD1-CG1 3.82Å; L70-I218 HydrophobicContact CD2-CD1 3.95Å; L70-I218 HydrophobicContact CD2-CG1 4.23Å; L89-I218 HydrophobicContact CB-CD1 4.21Å; L89-I218 HydrophobicContact CD1-CD1 3.81Å; V98-I218 HydrophobicContact CB-CD1 3.84Å; V98-I218 HydrophobicContact CG2-CD1 3.24Å; F130-I218 HydrophobicContact CE1-CG1 3.84Å; P132-I218 HydrophobicContact CB-CG2 4.25Å; P132-I218 WeakPolarHBondContact CD-O 3.42Å; P132-I218 HydrophobicContact CG-CG2 3.96Å; P132-I218 VanDerWaalsContact CG-O 3.26Å; P132-I218 WeakPolarHBondContact CG-O 3.17Å; I218-T220 PolarHBondContact O-N 3.18Å
219	N	55.9	Low	57.1	Low	126 Å²	126	80.1 Å²	80.1	67%	0.674	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.5	178.1	-67.5	-1.6	0	0	0	113.7	S217	S217-N219 PolarHBondContact O-N 2.68Å; S217-N219 VanDerWaalsContact O-N 3.08Å
220	T	56.6	Low	59.6	Low	85 Å²	85	76.9 Å²	76.9	52%	0.521	47%	0.465	S	S	.	.	S	Bend	trans	-97.5	119.5	172.2	-37.6	0	0	0	0	106.6	S217 I218 C222	S217-T220 PolarHBondContact O-N 2.94Å; S217-T220 PolarHBondContact OG-OG1 2.78Å; I218-T220 PolarHBondContact O-N 3.18Å; T220-C222 PolarHBondContact O-N 2.81Å
221	I	54.7	Low	62	Low	131 Å²	131	73.5 Å²	73.5	67%	0.672	45%	0.447	S	S	*	.			trans	-52.6	113.1	170.8	-64.5	170.6	0	0	0	106.1	P223	I221-P223 WeakPolarHBondContact O-CD 3.44Å; I221-P223 VanDerWaalsContact O-N 3.12Å
222	C	54.6	Low	64.4	Low	21 Å²	21	74.9 Å²	74.9	14%	0.142	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-63.7	120	177.6	-68.8	0	0	0	0	106.4	H114 T220	H114-C222 WeakPolarHBondContact O-CB 3.44Å; T220-C222 PolarHBondContact O-N 2.81Å
223	P	59.2	Low	67	Low	108 Å²	108	75.3 Å²	75.3	70%	0.701	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-57.1	150.8	179.6	23	-31.7	0	0	0	109.2	I221 S225	I221-P223 WeakPolarHBondContact O-CD 3.44Å; I221-P223 VanDerWaalsContact O-N 3.12Å; P223-S225 PolarHBondContact O-N 2.85Å; P223-S225 VanDerWaalsContact O-N 3.12Å
224	S	62.9	Low	69.5	Low	56 Å²	56	73.4 Å²	73.4	39%	0.392	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-48.9	123.8	178.6	49.2	0	0	0	0	110.6	N178 T226	N178-S224 VanDerWaalsContact CG-CB 3.48Å; N178-S224 WeakPolarHBondContact ND2-CB 3.48Å; N178-S224 PolarHBondContact ND2-OG 3.23Å; N178-S224 WeakPolarHBondContact OD1-CB 3.24Å; S224-T226 PolarHBondContact O-N 2.93Å
225	S	63	Low	71.1	Confident	26 Å²	26	73.5 Å²	73.5	18%	0.182	42%	0.423	C	S	.	.	S	Bend	trans	-82.5	12.7	179.3	73.9	0	0	0	0	112.2	R113 D115 V156 P223	R113-S225 PolarHBondContact NH2-OG 2.91Å; R113-S225 VanDerWaalsContact NH2-OG 3.12Å; D115-S225 PolarHBondContact OD1-OG 2.8Å; D115-S225 VanDerWaalsContact OD1-OG 3.05Å; D115-S225 WeakPolarHBondContact OD2-CB 3.48Å; D115-S225 PolarHBondContact OD2-N 3.13Å; D115-S225 PolarHBondContact OD2-OG 3.36Å; V156-S225 WeakPolarHBondContact CA-O 3.3Å; V156-S225 WeakPolarHBondContact CB-O 3.46Å; V156-S225 VanDerWaalsContact CG1-O 3.32Å; V156-S225 WeakPolarHBondContact CG1-O 3.45Å; V156-S225 WeakPolarHBondContact CG2-O 3.5Å; P223-S225 PolarHBondContact O-N 2.85Å; P223-S225 VanDerWaalsContact O-N 3.12Å
226	T	68.5	Low	72.9	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.006	40%	0.395	C	S	.	.			trans	-149	143.7	-175.6	-177.7	0	0	0	0	110.7	V156 P159 N178 S224 A228	V156-T226 WeakPolarHBondContact O-CA 3.45Å; V156-T226 WeakPolarHBondContact O-CB 3.48Å; V156-T226 PolarHBondContact O-OG1 3.33Å; P159-T226 HydrophobicContact CB-CG2 4.16Å; P159-T226 HydrophobicContact CG-CG2 4.13Å; N178-T226 PolarHBondContact ND2-O 2.8Å; N178-T226 PolarHBondContact OD1-O 3.32Å; N178-T226 VanDerWaalsContact OD1-O 3.04Å; S224-T226 PolarHBondContact O-N 2.93Å; T226-A228 VanDerWaalsContact OG1-CB 3.32Å; T226-A228 WeakPolarHBondContact OG1-CB 3.38Å; T226-A228 PolarHBondContact OG1-N 2.86Å
227	N	68.7	Low	74.5	Confident	141 Å²	141	74.5 Å²	74.5	75%	0.754	42%	0.423	S	S	*	.			trans	-93.4	-2.3	168.1	-68.4	-26.4	0	0	0	111.9
228	A	74.8	Confident	76.1	Confident	23 Å²	23	72 Å²	72	19%	0.19	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-77	146.9	-177	0	0	0	0	0	111.5	P159 G177 N178 T226	P159-A228 HydrophobicContact CG-CB 3.89Å; G177-A228 CarbonylContact C-O 3.56Å; G177-A228 WeakPolarHBondContact CA-O 3.4Å; N178-A228 PolarHBondContact N-O 2.7Å; T226-A228 VanDerWaalsContact OG1-CB 3.32Å; T226-A228 WeakPolarHBondContact OG1-CB 3.38Å; T226-A228 PolarHBondContact OG1-N 2.86Å
229	T	78.1	Confident	77.8	Confident	98 Å²	98	72 Å²	72	60%	0.601	41%	0.405	S	S	*	.	B	Isolated β-bridge	trans	-86.7	162.3	172	55.6	0	0	0	0	111
230	N	82.1	Confident	79.7	Confident	75 Å²	75	74.8 Å²	74.8	40%	0.401	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-62	140.7	169.6	-66.1	-34.9	0	0	0	110.6	H175 G177	H175-N230 PolarHBondContact O-OD1 3.09Å; G177-N230 PolarHBondContact N-OD1 2.88Å
231	M	84.6	Confident	81.7	Confident	101 Å²	101	73.9 Å²	73.9	50%	0.498	41%	0.406	S	S	.	.			trans	-117.3	153.4	175	-65.2	-66	-73.1	0	0	109.5	H175	H175-M231 HydrophobicContact CB-CB 3.94Å; H175-M231 HydrophobicContact CB-CG 4.12Å
232	P	87.9	Confident	83.8	Confident	96 Å²	96	69.8 Å²	69.8	62%	0.623	39%	0.388	S	S	*	.			trans	-57	137.7	174.3	23.4	-33.4	0	0	0	110.6	R234	P232-R234 PolarHBondContact O-N 3.11Å
233	P	93.8	Very high	85.9	Confident	84 Å²	84	69.5 Å²	69.5	55%	0.545	39%	0.385	S	S	.	.			trans	-55.8	138.5	174.5	-27.6	36.1	0	0	0	112	F138 L173 V174	F138-P233 HydrophobicContact CE2-CG 4.32Å; L173-P233 WeakPolarHBondContact O-CA 3.4Å; V174-P233 HydrophobicContact CG2-CB 4.14Å; V174-P233 HydrophobicContact CG2-CG 4.39Å
234	R	96.9	Very high	87.6	Confident	65 Å²	65	65.4 Å²	65.4	25%	0.245	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	162.2	176.1	-65.2	178.6	-68.5	151.4	2.3	110.2	S172 L173 H175 P232 T270 K271	S172-R234 WeakPolarHBondContact CA-O 3.05Å; L173-R234 HydrophobicContact CB-CB 4.29Å; L173-R234 PolarHBondContact N-O 2.99Å; L173-R234 PolarHBondContact O-N 2.85Å; H175-R234 PolarHBondContact NE2-NH2 3.1Å; P232-R234 PolarHBondContact O-N 3.11Å; R234-T270 PolarHBondContact NH1-O 2.89Å; R234-T270 PolarHBondContact NH2-O 3.13Å; R234-K271 PolarHBondContact NH1-O 2.84Å
235	Q	97.5	Very high	89.2	Confident	113 Å²	113	63.4 Å²	63.4	53%	0.528	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	145.8	179	-69.4	-176.3	-9.3	0	0	111.4	V170 V171	V170-Q235 HydrophobicContact CG1-CB 4.02Å; V170-Q235 HydrophobicContact CG1-CG 4.26Å; V171-Q235 CarbonylContact O-C 3.53Å; V171-Q235 VanDerWaalsContact O-CA 3.25Å; V171-Q235 WeakPolarHBondContact O-CA 3.4Å
236	I	98.5	Very high	90.9	Very high	7 Å²	7	62.8 Å²	62.8	4%	0.036	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.6	172.4	-66.7	173.1	0	0	0	107.8	V170 V171 L173 A238 L255 F268 C273	V170-I236 CarbonylContact C-O 3.51Å; V170-I236 VanDerWaalsContact CA-O 3.31Å; V170-I236 WeakPolarHBondContact CA-O 3.34Å; V171-I236 PolarHBondContact N-O 2.77Å; V171-I236 PolarHBondContact O-N 3.3Å; L173-I236 HydrophobicContact CD1-CB 4.39Å; L173-I236 HydrophobicContact CD1-CD1 3.84Å; L173-I236 HydrophobicContact CD1-CG1 3.91Å; L173-I236 HydrophobicContact CD2-CD1 4.13Å; I236-A238 VanDerWaalsContact C-N 3.32Å; I236-A238 HydrophobicContact CG2-CB 4.11Å; I236-A238 PolarHBondContact O-N 3.05Å; I236-A238 VanDerWaalsContact O-N 3.08Å; I236-L255 HydrophobicContact CD1-CD2 3.98Å; I236-F268 HydrophobicContact CD1-CB 3.87Å; I236-F268 HydrophobicContact CD1-CD1 4.25Å; I236-F268 HydrophobicContact CD1-CG 4.07Å; I236-F268 HydrophobicContact CG2-CD1 3.57Å; I236-F268 HydrophobicContact CG2-CD2 4.25Å; I236-F268 HydrophobicContact CG2-CE1 3.43Å; I236-F268 VanDerWaalsContact CG2-CE1 3.43Å; I236-F268 HydrophobicContact CG2-CE2 4.12Å; I236-F268 HydrophobicContact CG2-CG 4Å; I236-F268 HydrophobicContact CG2-CZ 3.74Å; I236-C273 HydrophobicContact CD1-CB 3.99Å; I236-C273 HydrophobicContact CG1-CB 3.71Å
237	I	98.3	Very high	92.3	Very high	142 Å²	142	63 Å²	63	73%	0.728	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	87.5	168.5	-54.6	175.9	0	0	0	106.9	V170	V170-I237 HydrophobicContact CG2-CG1 4.25Å
238	A	98.4	Very high	93.7	Very high	3 Å²	3	56.3 Å²	56.3	3%	0.025	31%	0.306	C	S	.	.			trans	-82.8	-37.4	-170.5	0	0	0	0	0	112.3	G169 V171 I236 T257 R266 F268	G169-A238 WeakPolarHBondContact O-CB 3.44Å; G169-A238 PolarHBondContact O-N 2.86Å; V171-A238 HydrophobicContact CG2-CB 3.98Å; I236-A238 VanDerWaalsContact C-N 3.32Å; I236-A238 HydrophobicContact CG2-CB 4.11Å; I236-A238 PolarHBondContact O-N 3.05Å; I236-A238 VanDerWaalsContact O-N 3.08Å; A238-T257 HydrophobicContact CB-CG2 4.21Å; A238-R266 WeakPolarHBondContact O-CD 3.28Å; A238-R266 PolarHBondContact O-NH1 2.8Å; A238-F268 HydrophobicContact CB-CE2 3.81Å; A238-F268 HydrophobicContact CB-CZ 3.91Å
239	H	98.4	Very high	94.7	Very high	10 Å²	10	55.4 Å²	55.4	5%	0.046	30%	0.298	C	S	.	.			trans	-145.3	163.8	-177.1	-62.9	-92.5	0	0	0	111.3	G169 T257 S259 R266	G169-H239 CarbonylContact C-O 3.59Å; G169-H239 VanDerWaalsContact CA-O 3.27Å; G169-H239 WeakPolarHBondContact CA-O 3.43Å; G169-H239 PolarHBondContact O-N 3.05Å; H239-T257 PolarHBondContact NE2-O 3.14Å; H239-T257 PolarHBondContact NE2-OG1 3.42Å; H239-S259 PolarHBondContact ND1-OG 3.17Å; H239-R266 PolarHBondContact ND1-NH1 3.21Å; H239-R266 VanDerWaalsContact ND1-NH1 3.14Å
240	E	97.1	Very high	95.5	Very high	184 Å²	184	59.1 Å²	59.1	86%	0.86	30%	0.301	S	S	*	.	S	Bend	trans	-82.6	-32.5	170.5	-66	175.2	178.6	0	0	111.8
241	N	98	Very high	96.1	Very high	67 Å²	67	58.4 Å²	58.4	36%	0.358	30%	0.298	S	S	.	.	S	Bend	trans	-91.7	158.5	178.7	-61.5	109.4	0	0	0	111.6	G169	G169-N241 WeakPolarHBondContact CA-O 3.34Å; G169-N241 PolarHBondContact N-O 2.66Å
242	P	98	Very high	96.7	Very high	44 Å²	44	53.6 Å²	53.6	29%	0.286	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-52.6	147	174.8	-21.7	30.1	0	0	0	112.5	P168 S259 Q260	P168-P242 HydrophobicContact CB-CB 4.48Å; P168-P242 HydrophobicContact CB-CG 4.05Å; P242-S259 CarbonylContact O-C 3.59Å; P242-S259 WeakPolarHBondContact O-CA 3.45Å; P242-S259 VanDerWaalsContact O-CB 3.27Å; P242-S259 WeakPolarHBondContact O-CB 3.38Å; P242-Q260 HydrophobicContact CB-CG 4.29Å; P242-Q260 PolarHBondContact O-N 2.92Å
243	L	98.2	Very high	97.1	Very high	16 Å²	16	54.3 Å²	54.3	8%	0.084	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	141.5	178.6	-64	166.5	0	0	0	110.3	L149 P164 V170 V171 I246	L149-L243 HydrophobicContact CD1-CB 3.89Å; L149-L243 WeakPolarHBondContact CD1-O 3.36Å; P164-L243 HydrophobicContact CB-CD1 4.19Å; P164-L243 HydrophobicContact CG-CD1 4.17Å; V170-L243 WeakPolarHBondContact O-CD1 3.1Å; V171-L243 HydrophobicContact CG2-CD1 3.59Å; V171-L243 HydrophobicContact CG2-CD2 4.16Å; L243-I246 HydrophobicContact CD1-CG2 4.11Å; L243-I246 HydrophobicContact CD2-CG2 4.42Å
244	A	96.2	Very high	97.3	Very high	21 Å²	21	51.9 Å²	51.9	17%	0.174	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-30	172.8	0	0	0	0	0	112.1	A258 Q260	A244-A258 PolarHBondContact N-O 3.37Å; A244-Q260 HydrophobicContact CB-CG 4.18Å
245	S	97.1	Very high	97.4	Very high	15 Å²	15	48.8 Å²	48.8	11%	0.105	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	141.6	178.1	-170.4	0	0	0	0	111.3	T257 A258 L291	S245-T257 WeakPolarHBondContact O-CA 3.36Å; S245-A258 PolarHBondContact N-O 3.5Å; S245-A258 VanDerWaalsContact N-O 3.13Å; S245-A258 PolarHBondContact O-N 3.49Å; S245-L291 WeakPolarHBondContact OG-CD1 3.39Å
246	I	97.9	Very high	97.5	Very high	13 Å²	13	43.4 Å²	43.4	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	136.6	176.1	59.9	179.3	0	0	0	108.8	L149 V162 V171 L243 A256 T257	L149-I246 HydrophobicContact CB-CD1 4.05Å; L149-I246 HydrophobicContact CB-CG1 4.31Å; V162-I246 HydrophobicContact CG2-CD1 4.4Å; V171-I246 HydrophobicContact CG2-CG2 4.45Å; L243-I246 HydrophobicContact CD1-CG2 4.11Å; L243-I246 HydrophobicContact CD2-CG2 4.42Å; I246-A256 WeakPolarHBondContact CA-O 3Å; I246-T257 HydrophobicContact CG2-CG2 4.26Å
247	T	97.8	Very high	97.5	Very high	4 Å²	4	43.1 Å²	43.1	3%	0.025	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	149.6	171.9	-166.8	0	0	0	0	110.5	Y151 A256 L291 F293	Y151-T247 WeakPolarHBondContact CE2-OG1 3.36Å; T247-A256 HydrophobicContact CG2-CB 3.9Å; T247-A256 PolarHBondContact N-O 3.18Å; T247-A256 PolarHBondContact O-N 3.06Å; T247-L291 HydrophobicContact CG2-CB 3.47Å; T247-L291 VanDerWaalsContact CG2-CB 3.47Å; T247-L291 HydrophobicContact CG2-CD1 4.5Å; T247-L291 WeakPolarHBondContact CG2-O 3.21Å; T247-F293 HydrophobicContact CG2-CD2 4.05Å; T247-F293 HydrophobicContact CG2-CE2 3.93Å
248	L	98.3	Very high	97.5	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	159.4	164.8	-64.7	173.3	0	0	0	109.7	Y151 C153 L160 V162 L254 L255 T270	Y151-L248 HydrophobicContact CD1-CB 3.75Å; Y151-L248 HydrophobicContact CD1-CD1 3.96Å; Y151-L248 HydrophobicContact CD1-CG 3.87Å; Y151-L248 HydrophobicContact CE1-CB 3.77Å; Y151-L248 HydrophobicContact CE1-CG 4.39Å; C153-L248 HydrophobicContact CB-CD1 3.68Å; L160-L248 HydrophobicContact CB-CD1 4.3Å; L160-L248 HydrophobicContact CD2-CD1 4.01Å; L160-L248 HydrophobicContact CD2-CD2 4.01Å; L160-L248 HydrophobicContact CG-CD1 4.17Å; V162-L248 HydrophobicContact CG1-CD1 4.22Å; V162-L248 HydrophobicContact CG1-CD2 4.03Å; V162-L248 HydrophobicContact CG1-CG 4.39Å; V162-L248 HydrophobicContact CG2-CD1 4.19Å; V162-L248 HydrophobicContact CG2-CD2 4.24Å; V162-L248 HydrophobicContact CG2-CG 3.95Å; L248-L254 VanDerWaalsContact CA-O 3.3Å; L248-L254 WeakPolarHBondContact CA-O 3.43Å; L248-L254 WeakPolarHBondContact CD2-O 3.48Å; L248-L255 HydrophobicContact CD2-CB 3.94Å; L248-L255 HydrophobicContact CD2-CD1 3.94Å; L248-T270 HydrophobicContact CD2-CG2 3.92Å
249	N	96.6	Very high	97.5	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.027	18%	0.175	C	C	.	.			trans	-75.9	174.9	158.4	75.1	-34.2	0	0	0	110.4	D251 G252 Y253 L254 F293 S297	N249-D251 PolarHBondContact ND2-OD1 3.12Å; N249-D251 PolarHBondContact O-N 2.89Å; N249-D251 PolarHBondContact OD1-OD1 3.1Å; N249-G252 PolarHBondContact O-N 3.24Å; N249-G252 WeakPolarHBondContact OD1-CA 3.46Å; N249-G252 PolarHBondContact OD1-N 3.07Å; N249-Y253 PolarHBondContact OD1-N 3Å; N249-L254 HydrophobicContact CB-CB 4.1Å; N249-L254 PolarHBondContact N-O 3.45Å; N249-L254 PolarHBondContact OD1-N 2.73Å; N249-L254 PolarHBondContact OD1-O 3.05Å; N249-F293 HydrophobicContact CB-CB 3.99Å; N249-F293 HydrophobicContact CB-CD1 4.2Å; N249-F293 HydrophobicContact CB-CD2 3.66Å; N249-F293 HydrophobicContact CB-CE2 4.1Å; N249-F293 HydrophobicContact CB-CG 3.7Å; N249-S297 WeakPolarHBondContact CB-OG 3.27Å; N249-S297 PolarHBondContact ND2-OG 3.01Å
250	R	94.1	Very high	97.4	Very high	176 Å²	176	40.6 Å²	40.6	66%	0.664	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-42.2	-169.7	-178.2	178	175.6	156.4	1.2	114.1
251	D	95.1	Very high	97.4	Very high	60 Å²	60	36.9 Å²	36.9	32%	0.321	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.8	-179.9	60.3	22.1	0	0	0	113.2	N158 N249 Y253	N158-D251 WeakPolarHBondContact CB-O 3.43Å; N158-D251 PolarHBondContact ND2-O 3.45Å; N249-D251 PolarHBondContact ND2-OD1 3.12Å; N249-D251 PolarHBondContact O-N 2.89Å; N249-D251 PolarHBondContact OD1-OD1 3.1Å; D251-Y253 VanDerWaalsContact C-N 3.34Å; D251-Y253 HydrophobicContact CB-CD2 3.83Å; D251-Y253 HydrophobicContact CB-CE2 4.05Å; D251-Y253 WeakPolarHBondContact OD1-CB 3.4Å; D251-Y253 WeakPolarHBondContact OD1-CD2 3.32Å; D251-Y253 PolarHBondContact OD1-N 3.32Å; D251-Y253 WeakPolarHBondContact OD2-CD2 3.41Å
252	G	96.8	Very high	97.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	76.3	13	179	0	0	0	0	0	115	N158 N249 T270	N158-G252 WeakPolarHBondContact ND2-CA 3.38Å; N158-G252 PolarHBondContact ND2-O 2.89Å; N249-G252 PolarHBondContact O-N 3.24Å; N249-G252 WeakPolarHBondContact OD1-CA 3.46Å; N249-G252 PolarHBondContact OD1-N 3.07Å; G252-T270 WeakPolarHBondContact O-CB 3.42Å; G252-T270 VanDerWaalsContact O-CG2 3.29Å; G252-T270 WeakPolarHBondContact O-CG2 3.41Å; G252-T270 PolarHBondContact O-OG1 2.93Å
253	Y	97	Very high	97.1	Very high	111 Å²	111	32.1 Å²	32.1	44%	0.435	15%	0.148	S	C	.	.	S	Bend	trans	-83	-16.7	177.4	-66.4	-55.6	0	0	0	114.1	N249 D251 T270	N249-Y253 PolarHBondContact OD1-N 3Å; D251-Y253 VanDerWaalsContact C-N 3.34Å; D251-Y253 HydrophobicContact CB-CD2 3.83Å; D251-Y253 HydrophobicContact CB-CE2 4.05Å; D251-Y253 WeakPolarHBondContact OD1-CB 3.4Å; D251-Y253 WeakPolarHBondContact OD1-CD2 3.32Å; D251-Y253 PolarHBondContact OD1-N 3.32Å; D251-Y253 WeakPolarHBondContact OD2-CD2 3.41Å; Y253-T270 VanDerWaalsContact CA-OG1 3.26Å; Y253-T270 WeakPolarHBondContact CA-OG1 3.38Å; Y253-T270 PolarHBondContact O-N 2.97Å; Y253-T270 PolarHBondContact O-OG1 2.77Å
254	L	98.2	Very high	97.1	Very high	33 Å²	33	32.6 Å²	32.6	17%	0.173	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.8	174.6	-58	179.7	0	0	0	111.2	L248 N249 I267 F268 L276 F293	L248-L254 VanDerWaalsContact CA-O 3.3Å; L248-L254 WeakPolarHBondContact CA-O 3.43Å; L248-L254 WeakPolarHBondContact CD2-O 3.48Å; N249-L254 HydrophobicContact CB-CB 4.1Å; N249-L254 PolarHBondContact N-O 3.45Å; N249-L254 PolarHBondContact OD1-N 2.73Å; N249-L254 PolarHBondContact OD1-O 3.05Å; L254-I267 HydrophobicContact CB-CG2 4.3Å; L254-I267 HydrophobicContact CD2-CG2 4.36Å; L254-F268 WeakPolarHBondContact CA-O 3.48Å; L254-L276 HydrophobicContact CD2-CD1 3.51Å; L254-F293 HydrophobicContact CB-CE1 4.2Å; L254-F293 HydrophobicContact CB-CE2 4.49Å; L254-F293 HydrophobicContact CB-CZ 3.89Å; L254-F293 HydrophobicContact CD1-CE1 4.04Å
255	L	98.7	Very high	97.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	115.9	174.8	169.3	67.2	0	0	0	109.5	V162 V171 L173 I236 L248 T257 I267 F268 T270	V162-L255 HydrophobicContact CB-CD1 4.43Å; V162-L255 HydrophobicContact CG1-CD1 4.5Å; V162-L255 HydrophobicContact CG2-CD1 4Å; V171-L255 HydrophobicContact CB-CD2 4.33Å; V171-L255 HydrophobicContact CG1-CD2 3.95Å; V171-L255 HydrophobicContact CG2-CD2 4.46Å; L173-L255 HydrophobicContact CD1-CD2 4.36Å; I236-L255 HydrophobicContact CD1-CD2 3.98Å; L248-L255 HydrophobicContact CD2-CB 3.94Å; L248-L255 HydrophobicContact CD2-CD1 3.94Å; L255-T257 HydrophobicContact CD1-CG2 4.07Å; L255-T257 HydrophobicContact CD2-CG2 4.06Å; L255-T257 HydrophobicContact CG-CG2 3.79Å; L255-I267 CarbonylContact O-C 3.49Å; L255-I267 VanDerWaalsContact O-CA 3.26Å; L255-I267 WeakPolarHBondContact O-CA 3.19Å; L255-F268 HydrophobicContact CB-CB 4.45Å; L255-F268 PolarHBondContact N-O 3Å; L255-F268 PolarHBondContact O-N 3.36Å; L255-T270 HydrophobicContact CB-CG2 3.75Å
256	A	98.6	Very high	97.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	138.5	169.5	0	0	0	0	0	110.8	I246 T247 R266 I267 L291 F293 L300	I246-A256 WeakPolarHBondContact CA-O 3Å; T247-A256 HydrophobicContact CG2-CB 3.9Å; T247-A256 PolarHBondContact N-O 3.18Å; T247-A256 PolarHBondContact O-N 3.06Å; A256-R266 CarbonylContact C-O 3.55Å; A256-R266 WeakPolarHBondContact CA-O 3.21Å; A256-I267 HydrophobicContact CB-CG1 4.31Å; A256-L291 HydrophobicContact CB-CD1 4.27Å; A256-F293 HydrophobicContact CB-CE2 3.62Å; A256-F293 HydrophobicContact CB-CZ 3.6Å; A256-L300 HydrophobicContact CB-CD1 4.12Å; A256-L300 HydrophobicContact CB-CD2 4.23Å
257	T	98.6	Very high	97.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	147.1	-176.2	64.8	0	0	0	0	111.6	V171 A238 H239 S245 I246 L255 I265 R266 F268	V171-T257 HydrophobicContact CG2-CG2 3.9Å; A238-T257 HydrophobicContact CB-CG2 4.21Å; H239-T257 PolarHBondContact NE2-O 3.14Å; H239-T257 PolarHBondContact NE2-OG1 3.42Å; S245-T257 WeakPolarHBondContact O-CA 3.36Å; I246-T257 HydrophobicContact CG2-CG2 4.26Å; L255-T257 HydrophobicContact CD1-CG2 4.07Å; L255-T257 HydrophobicContact CD2-CG2 4.06Å; L255-T257 HydrophobicContact CG-CG2 3.79Å; T257-I265 WeakPolarHBondContact O-CA 3.42Å; T257-R266 PolarHBondContact N-O 3.3Å; T257-R266 PolarHBondContact O-N 2.79Å; T257-R266 PolarHBondContact OG1-O 2.86Å; T257-F268 HydrophobicContact CG2-CD2 4.44Å; T257-F268 HydrophobicContact CG2-CE2 4.39Å
258	A	98.2	Very high	97.3	Very high	0 Å²	0	33 Å²	33	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142	168.4	0	0	0	0	0	110.3	A244 S245 I265 I288 L291	A244-A258 PolarHBondContact N-O 3.37Å; S245-A258 PolarHBondContact N-O 3.5Å; S245-A258 VanDerWaalsContact N-O 3.13Å; S245-A258 PolarHBondContact O-N 3.49Å; A258-I265 HydrophobicContact CB-CD1 3.61Å; A258-I288 HydrophobicContact CB-CB 4.13Å; A258-I288 HydrophobicContact CB-CG1 3.63Å; A258-I288 HydrophobicContact CB-CG2 4.36Å; A258-L291 HydrophobicContact CB-CD1 4.37Å
259	S	97.9	Very high	97.2	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.042	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	172.4	170.9	61	0	0	0	0	112.1	H239 P242 K261 G262	H239-S259 PolarHBondContact ND1-OG 3.17Å; P242-S259 CarbonylContact O-C 3.59Å; P242-S259 WeakPolarHBondContact O-CA 3.45Å; P242-S259 VanDerWaalsContact O-CB 3.27Å; P242-S259 WeakPolarHBondContact O-CB 3.38Å; S259-K261 PolarHBondContact O-N 2.98Å; S259-K261 VanDerWaalsContact O-N 3.11Å; S259-G262 WeakPolarHBondContact O-CA 3.39Å; S259-G262 PolarHBondContact O-N 2.72Å
260	Q	97	Very high	97.3	Very high	96 Å²	96	33.6 Å²	33.6	45%	0.449	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.3	172.6	-71	177.2	-23.6	0	0	113.8	P242 A244 G262 Q285	P242-Q260 HydrophobicContact CB-CG 4.29Å; P242-Q260 PolarHBondContact O-N 2.92Å; A244-Q260 HydrophobicContact CB-CG 4.18Å; Q260-G262 VanDerWaalsContact C-N 3.33Å; Q260-Q285 PolarHBondContact O-NE2 2.94Å
261	K	96.7	Very high	97.3	Very high	106 Å²	106	33.3 Å²	33.3	46%	0.461	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-33.8	171.8	-169.6	174.6	-178.3	173.2	0	111.7	S259 T263 Q285	S259-K261 PolarHBondContact O-N 2.98Å; S259-K261 VanDerWaalsContact O-N 3.11Å; K261-T263 HydrophobicContact CG-CG2 4.08Å; K261-T263 PolarHBondContact O-N 3.06Å; K261-Q285 WeakPolarHBondContact O-CA 3.38Å; K261-Q285 WeakPolarHBondContact O-CG 3.32Å
262	G	95.7	Very high	97.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.161	C	C	.	.			trans	57.3	16.4	171.8	0	0	0	0	0	116.9	S259 Q260 R281 A286	S259-G262 WeakPolarHBondContact O-CA 3.39Å; S259-G262 PolarHBondContact O-N 2.72Å; Q260-G262 VanDerWaalsContact C-N 3.33Å; G262-R281 PolarHBondContact O-NE 2.88Å; G262-R281 VanDerWaalsContact O-NE 3.09Å; G262-A286 WeakPolarHBondContact CA-O 3.42Å
263	T	95.5	Very high	97.4	Very high	12 Å²	12	36.5 Å²	36.5	7%	0.074	17%	0.172	C	C	.	.	S	Bend	trans	-82.9	-31.3	175	53	0	0	0	0	112.2	K261 R281 G282 S284	K261-T263 HydrophobicContact CG-CG2 4.08Å; K261-T263 PolarHBondContact O-N 3.06Å; T263-R281 PolarHBondContact O-N 3.4Å; T263-R281 VanDerWaalsContact O-N 3.08Å; T263-G282 WeakPolarHBondContact CB-O 3.42Å; T263-S284 WeakPolarHBondContact CG2-O 3.31Å
264	L	96.6	Very high	97.4	Very high	26 Å²	26	34 Å²	34	14%	0.136	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.9	-175.2	-64.1	176.7	0	0	0	110.7	E278 L279 R280	L264-E278 HydrophobicContact CD1-CG 4.2Å; L264-E278 HydrophobicContact CD2-CG 4.12Å; L264-L279 CarbonylContact C-O 3.57Å; L264-L279 WeakPolarHBondContact CA-O 3.43Å; L264-R280 HydrophobicContact CD2-CB 4.19Å; L264-R280 HydrophobicContact CD2-CG 4.47Å
265	I	98.1	Very high	97.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.7	171.7	-44.8	-57.8	0	0	0	106.8	T257 A258 L279 I288 L291 L300 V302	T257-I265 WeakPolarHBondContact O-CA 3.42Å; A258-I265 HydrophobicContact CB-CD1 3.61Å; I265-L279 HydrophobicContact CB-CB 4.3Å; I265-L279 PolarHBondContact N-O 2.78Å; I265-L279 PolarHBondContact O-N 2.91Å; I265-I288 HydrophobicContact CD1-CD1 3.97Å; I265-I288 HydrophobicContact CD1-CG1 3.96Å; I265-L291 HydrophobicContact CD1-CD2 4.25Å; I265-L291 HydrophobicContact CG2-CD2 3.85Å; I265-L300 HydrophobicContact CG2-CD2 3.8Å; I265-V302 HydrophobicContact CD1-CG1 3.92Å; I265-V302 HydrophobicContact CG1-CG1 4.04Å; I265-V302 HydrophobicContact CG1-CG2 4.15Å; I265-V302 HydrophobicContact CG2-CG2 4.5Å
266	R	98.1	Very high	97.2	Very high	50 Å²	50	39.9 Å²	39.9	19%	0.189	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	135.7	-178.5	-72.1	179.1	178.8	125.1	3.1	110.6	A238 H239 A256 T257 F268 L275 H277 E278	A238-R266 WeakPolarHBondContact O-CD 3.28Å; A238-R266 PolarHBondContact O-NH1 2.8Å; H239-R266 PolarHBondContact ND1-NH1 3.21Å; H239-R266 VanDerWaalsContact ND1-NH1 3.14Å; A256-R266 CarbonylContact C-O 3.55Å; A256-R266 WeakPolarHBondContact CA-O 3.21Å; T257-R266 PolarHBondContact N-O 3.3Å; T257-R266 PolarHBondContact O-N 2.79Å; T257-R266 PolarHBondContact OG1-O 2.86Å; R266-F268 HydrophobicContact CB-CD2 4.31Å; R266-F268 HydrophobicContact CB-CE2 3.45Å; R266-F268 VanDerWaalsContact CB-CE2 3.45Å; R266-F268 HydrophobicContact CB-CZ 3.87Å; R266-L275 HydrophobicContact CB-CD1 3.79Å; R266-L275 HydrophobicContact CG-CD1 3.97Å; R266-H277 CarbonylContact C-O 3.5Å; R266-H277 WeakPolarHBondContact CA-O 3.28Å; R266-E278 HydrophobicContact CG-CB 4.46Å; R266-E278 HydrophobicContact CG-CG 4.19Å; R266-E278 IonicContact CZ-OE2 3.22Å; R266-E278 IonicContact NE-OE2 2.77Å; R266-E278 PolarHBondContact NE-OE2 3.41Å; R266-E278 IonicContact NH2-OE2 2.79Å; R266-E278 PolarHBondContact NH2-OE2 2.84Å
267	I	98.3	Very high	97.1	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.2	177.6	-53.7	178.9	0	0	0	108.7	L254 L255 A256 L276 H277 L279 F293 L300 L314	L254-I267 HydrophobicContact CB-CG2 4.3Å; L254-I267 HydrophobicContact CD2-CG2 4.36Å; L255-I267 CarbonylContact O-C 3.49Å; L255-I267 VanDerWaalsContact O-CA 3.26Å; L255-I267 WeakPolarHBondContact O-CA 3.19Å; A256-I267 HydrophobicContact CB-CG1 4.31Å; I267-L276 PolarHBondContact O-N 2.88Å; I267-H277 HydrophobicContact CB-CB 4.06Å; I267-H277 HydrophobicContact CD1-CB 4.18Å; I267-H277 HydrophobicContact CG1-CB 4.27Å; I267-H277 PolarHBondContact N-O 3.36Å; I267-H277 PolarHBondContact O-N 2.82Å; I267-H277 VanDerWaalsContact O-N 3.15Å; I267-L279 HydrophobicContact CD1-CD1 3.78Å; I267-L279 HydrophobicContact CG1-CD1 4.34Å; I267-F293 HydrophobicContact CD1-CE1 4.23Å; I267-F293 HydrophobicContact CG2-CE1 4.45Å; I267-F293 HydrophobicContact CG2-CZ 4.21Å; I267-L300 HydrophobicContact CD1-CD2 3.98Å; I267-L300 HydrophobicContact CG1-CD2 4.36Å; I267-L314 HydrophobicContact CD1-CD1 3.52Å; I267-L314 HydrophobicContact CD1-CD2 3.36Å; I267-L314 HydrophobicContact CD1-CG 4.07Å
268	F	98.6	Very high	97	Very high	11 Å²	11	44.8 Å²	44.8	5%	0.048	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	147.5	-180	-59.5	-97	0	0	0	110.7	I236 A238 L254 L255 T257 R266 T274 L275	I236-F268 HydrophobicContact CD1-CB 3.87Å; I236-F268 HydrophobicContact CD1-CD1 4.25Å; I236-F268 HydrophobicContact CD1-CG 4.07Å; I236-F268 HydrophobicContact CG2-CD1 3.57Å; I236-F268 HydrophobicContact CG2-CD2 4.25Å; I236-F268 HydrophobicContact CG2-CE1 3.43Å; I236-F268 VanDerWaalsContact CG2-CE1 3.43Å; I236-F268 HydrophobicContact CG2-CE2 4.12Å; I236-F268 HydrophobicContact CG2-CG 4Å; I236-F268 HydrophobicContact CG2-CZ 3.74Å; A238-F268 HydrophobicContact CB-CE2 3.81Å; A238-F268 HydrophobicContact CB-CZ 3.91Å; L254-F268 WeakPolarHBondContact CA-O 3.48Å; L255-F268 HydrophobicContact CB-CB 4.45Å; L255-F268 PolarHBondContact N-O 3Å; L255-F268 PolarHBondContact O-N 3.36Å; T257-F268 HydrophobicContact CG2-CD2 4.44Å; T257-F268 HydrophobicContact CG2-CE2 4.39Å; R266-F268 HydrophobicContact CB-CD2 4.31Å; R266-F268 HydrophobicContact CB-CE2 3.45Å; R266-F268 VanDerWaalsContact CB-CE2 3.45Å; R266-F268 HydrophobicContact CB-CZ 3.87Å; F268-T274 CarbonylContact C-O 3.55Å; F268-T274 WeakPolarHBondContact CA-O 3.35Å; F268-T274 WeakPolarHBondContact CB-O 3.43Å; F268-L275 HydrophobicContact CD1-CB 3.97Å; F268-L275 HydrophobicContact CD1-CD1 4.08Å; F268-L275 HydrophobicContact CE1-CB 3.78Å; F268-L275 HydrophobicContact CE1-CD1 3.65Å; F268-L275 HydrophobicContact CE1-CG 4.29Å; F268-L275 HydrophobicContact CE2-CD1 4.15Å; F268-L275 HydrophobicContact CG-CD1 4.49Å; F268-L275 HydrophobicContact CZ-CD1 3.68Å
269	S	97.5	Very high	96.8	Very high	17 Å²	17	44.9 Å²	44.9	12%	0.119	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.8	161.4	153.1	0	0	0	0	108.3	K271 D272 C273 T274	S269-K271 VanDerWaalsContact C-N 3.3Å; S269-K271 PolarHBondContact OG-N 3.01Å; S269-D272 WeakPolarHBondContact CB-OD1 3.3Å; S269-D272 PolarHBondContact OG-N 3.45Å; S269-D272 PolarHBondContact OG-OD1 2.99Å; S269-C273 WeakPolarHBondContact O-CA 3.25Å; S269-C273 PolarHBondContact O-N 2.72Å; S269-T274 PolarHBondContact N-O 2.96Å
270	T	97.3	Very high	96.7	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.012	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-13.9	176.7	67.3	0	0	0	0	112.1	L160 L173 R234 L248 G252 Y253 L255	L160-T270 HydrophobicContact CD2-CG2 3.82Å; L173-T270 HydrophobicContact CD2-CG2 4.21Å; R234-T270 PolarHBondContact NH1-O 2.89Å; R234-T270 PolarHBondContact NH2-O 3.13Å; L248-T270 HydrophobicContact CD2-CG2 3.92Å; G252-T270 WeakPolarHBondContact O-CB 3.42Å; G252-T270 VanDerWaalsContact O-CG2 3.29Å; G252-T270 WeakPolarHBondContact O-CG2 3.41Å; G252-T270 PolarHBondContact O-OG1 2.93Å; Y253-T270 VanDerWaalsContact CA-OG1 3.26Å; Y253-T270 WeakPolarHBondContact CA-OG1 3.38Å; Y253-T270 PolarHBondContact O-N 2.97Å; Y253-T270 PolarHBondContact O-OG1 2.77Å; L255-T270 HydrophobicContact CB-CG2 3.75Å
271	K	94.4	Very high	96.5	Very high	170 Å²	170	45.6 Å²	45.6	74%	0.739	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-48	178.8	-178.2	178.7	177.8	179.2	0	111.6	R234 S269	R234-K271 PolarHBondContact NH1-O 2.84Å; S269-K271 VanDerWaalsContact C-N 3.3Å; S269-K271 PolarHBondContact OG-N 3.01Å
272	D	95.7	Very high	96.1	Very high	93 Å²	93	41.4 Å²	41.4	50%	0.497	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	3.1	-175.5	60.7	5.4	0	0	0	113.4	S269 T274	S269-D272 WeakPolarHBondContact CB-OD1 3.3Å; S269-D272 PolarHBondContact OG-N 3.45Å; S269-D272 PolarHBondContact OG-OD1 2.99Å; D272-T274 HydrophobicContact CB-CG2 4.13Å; D272-T274 VanDerWaalsContact CG-CG2 3.45Å; D272-T274 VanDerWaalsContact CG-OG1 3.27Å; D272-T274 PolarHBondContact O-N 2.82Å; D272-T274 WeakPolarHBondContact OD1-CB 3.3Å; D272-T274 WeakPolarHBondContact OD1-CG2 3.49Å; D272-T274 PolarHBondContact OD1-N 2.67Å; D272-T274 PolarHBondContact OD1-OG1 3.34Å; D272-T274 PolarHBondContact OD2-OG1 3.33Å
273	C	97.7	Very high	95.9	Very high	34 Å²	34	47.6 Å²	47.6	23%	0.23	24%	0.244	C	C	.	.			trans	61.1	23.8	179.6	-64.1	0	0	0	0	113.9	I236 S269	I236-C273 HydrophobicContact CD1-CB 3.99Å; I236-C273 HydrophobicContact CG1-CB 3.71Å; S269-C273 WeakPolarHBondContact O-CA 3.25Å; S269-C273 PolarHBondContact O-N 2.72Å
274	T	97.4	Very high	95.8	Very high	59 Å²	59	49.7 Å²	49.7	36%	0.362	26%	0.26	S	S	.	.			trans	-88.4	147.3	-178.6	61.7	0	0	0	0	112.4	F268 S269 D272	F268-T274 CarbonylContact C-O 3.55Å; F268-T274 WeakPolarHBondContact CA-O 3.35Å; F268-T274 WeakPolarHBondContact CB-O 3.43Å; S269-T274 PolarHBondContact N-O 2.96Å; D272-T274 HydrophobicContact CB-CG2 4.13Å; D272-T274 VanDerWaalsContact CG-CG2 3.45Å; D272-T274 VanDerWaalsContact CG-OG1 3.27Å; D272-T274 PolarHBondContact O-N 2.82Å; D272-T274 WeakPolarHBondContact OD1-CB 3.3Å; D272-T274 WeakPolarHBondContact OD1-CG2 3.49Å; D272-T274 PolarHBondContact OD1-N 2.67Å; D272-T274 PolarHBondContact OD1-OG1 3.34Å; D272-T274 PolarHBondContact OD2-OG1 3.33Å
275	L	97.6	Very high	95.7	Very high	87 Å²	87	54.1 Å²	54.1	46%	0.455	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122.8	172.8	179.1	67.3	0	0	0	109.7	R266 F268 H277	R266-L275 HydrophobicContact CB-CD1 3.79Å; R266-L275 HydrophobicContact CG-CD1 3.97Å; F268-L275 HydrophobicContact CD1-CB 3.97Å; F268-L275 HydrophobicContact CD1-CD1 4.08Å; F268-L275 HydrophobicContact CE1-CB 3.78Å; F268-L275 HydrophobicContact CE1-CD1 3.65Å; F268-L275 HydrophobicContact CE1-CG 4.29Å; F268-L275 HydrophobicContact CE2-CD1 4.15Å; F268-L275 HydrophobicContact CG-CD1 4.49Å; F268-L275 HydrophobicContact CZ-CD1 3.68Å; L275-H277 WeakPolarHBondContact CD1-O 3.37Å
276	L	96	Very high	95.5	Very high	68 Å²	68	54.1 Å²	54.1	36%	0.356	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-46.4	178.8	-58.9	178.9	0	0	0	112.1	L254 I267	L254-L276 HydrophobicContact CD2-CD1 3.51Å; I267-L276 PolarHBondContact O-N 2.88Å
277	H	95.7	Very high	95.2	Very high	23 Å²	23	54.6 Å²	54.6	11%	0.106	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	140.4	-177.8	-55.4	-89.6	0	0	0	111.6	R266 I267 L275 L279	R266-H277 CarbonylContact C-O 3.5Å; R266-H277 WeakPolarHBondContact CA-O 3.28Å; I267-H277 HydrophobicContact CB-CB 4.06Å; I267-H277 HydrophobicContact CD1-CB 4.18Å; I267-H277 HydrophobicContact CG1-CB 4.27Å; I267-H277 PolarHBondContact N-O 3.36Å; I267-H277 PolarHBondContact O-N 2.82Å; I267-H277 VanDerWaalsContact O-N 3.15Å; L275-H277 WeakPolarHBondContact CD1-O 3.37Å; H277-L279 HydrophobicContact CB-CD2 4.13Å; H277-L279 HydrophobicContact CB-CG 4.15Å
278	E	96	Very high	95	Very high	80 Å²	80	55 Å²	55	37%	0.374	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	105.9	164.9	-176.2	171.4	102.6	0	0	108.5	L264 R266	L264-E278 HydrophobicContact CD1-CG 4.2Å; L264-E278 HydrophobicContact CD2-CG 4.12Å; R266-E278 HydrophobicContact CG-CB 4.46Å; R266-E278 HydrophobicContact CG-CG 4.19Å; R266-E278 IonicContact CZ-OE2 3.22Å; R266-E278 IonicContact NE-OE2 2.77Å; R266-E278 PolarHBondContact NE-OE2 3.41Å; R266-E278 IonicContact NH2-OE2 2.79Å; R266-E278 PolarHBondContact NH2-OE2 2.84Å
279	L	96	Very high	94.7	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.016	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136.6	-173.2	-53.1	170.9	0	0	0	109.2	L264 I265 I267 H277 L300 F312 L314	L264-L279 CarbonylContact C-O 3.57Å; L264-L279 WeakPolarHBondContact CA-O 3.43Å; I265-L279 HydrophobicContact CB-CB 4.3Å; I265-L279 PolarHBondContact N-O 2.78Å; I265-L279 PolarHBondContact O-N 2.91Å; I267-L279 HydrophobicContact CD1-CD1 3.78Å; I267-L279 HydrophobicContact CG1-CD1 4.34Å; H277-L279 HydrophobicContact CB-CD2 4.13Å; H277-L279 HydrophobicContact CB-CG 4.15Å; L279-L300 HydrophobicContact CD1-CD2 4.02Å; L279-F312 HydrophobicContact CB-CD1 3.87Å; L279-F312 HydrophobicContact CB-CE1 3.81Å; L279-F312 HydrophobicContact CB-CG 4.27Å; L279-F312 HydrophobicContact CB-CZ 4.17Å; L279-F312 HydrophobicContact CD1-CB 3.78Å; L279-F312 HydrophobicContact CD1-CD1 4.1Å; L279-F312 HydrophobicContact CD1-CD2 4.15Å; L279-F312 HydrophobicContact CD1-CG 3.76Å; L279-F312 HydrophobicContact CD2-CB 4.4Å; L279-F312 HydrophobicContact CD2-CD1 3.95Å; L279-F312 HydrophobicContact CD2-CG 4.37Å; L279-F312 HydrophobicContact CG-CD1 4.18Å; L279-F312 HydrophobicContact CG-CG 4.35Å; L279-L314 HydrophobicContact CD1-CD2 3.87Å
280	R	95	Very high	94.5	Very high	102 Å²	102	54.9 Å²	54.9	39%	0.385	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.5	-179.5	-177.3	171.9	-63	-75.5	-1.6	110.1	L264 T370	L264-R280 HydrophobicContact CD2-CB 4.19Å; L264-R280 HydrophobicContact CD2-CG 4.47Å; R280-T370 WeakPolarHBondContact CA-O 3.29Å; R280-T370 VanDerWaalsContact CB-O 3.31Å; R280-T370 WeakPolarHBondContact CB-O 3.43Å; R280-T370 PolarHBondContact N-O 2.69Å
281	R	92.2	Very high	94.4	Very high	14 Å²	14	54.9 Å²	54.9	5%	0.053	29%	0.29	C	S	.	.			trans	-68.9	-43.3	169	-174.2	-140.1	61.3	79.6	-1.3	111	G262 T263 S284 H310	G262-R281 PolarHBondContact O-NE 2.88Å; G262-R281 VanDerWaalsContact O-NE 3.09Å; T263-R281 PolarHBondContact O-N 3.4Å; T263-R281 VanDerWaalsContact O-N 3.08Å; R281-S284 PolarHBondContact NH2-O 3.08Å; R281-H310 PolarHBondContact O-CE1 2.9Å; R281-H310 VanDerWaalsContact O-CE1 3.23Å
282	G	89.9	Confident	94.5	Very high	18 Å²	18	46.8 Å²	46.8	19%	0.186	26%	0.255	C	S	.	.			trans	179.6	179.3	179.8	0	0	0	0	0	113.1	T263	T263-G282 WeakPolarHBondContact CB-O 3.42Å
283	T	90.1	Very high	94.5	Very high	130 Å²	130	42.8 Å²	42.8	80%	0.798	23%	0.233	S	C	*	.	S	Bend	trans	-83.8	-35.2	178.1	50.4	0	0	0	0	112.6
284	S	93.2	Very high	94.2	Very high	57 Å²	57	41.8 Å²	41.8	40%	0.399	23%	0.225	S	C	.	.	S	Bend	trans	-81.5	152	179.1	55.1	0	0	0	0	112.5	T263 R281	T263-S284 WeakPolarHBondContact CG2-O 3.31Å; R281-S284 PolarHBondContact NH2-O 3.08Å
285	Q	95.1	Very high	93.9	Very high	118 Å²	118	44.6 Å²	44.6	55%	0.551	23%	0.233	S	C	*	.			trans	-66.8	139.6	171.7	177.2	167.9	-0.6	0	0	111.1	Q260 K261 R306	Q260-Q285 PolarHBondContact O-NE2 2.94Å; K261-Q285 WeakPolarHBondContact O-CA 3.38Å; K261-Q285 WeakPolarHBondContact O-CG 3.32Å; Q285-R306 PolarHBondContact O-NE 3.42Å; Q285-R306 PolarHBondContact O-NH2 3.03Å
286	A	93	Very high	93.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.239	C	C	.	.			trans	-154.4	132.3	174.1	0	0	0	0	0	109.9	G262 I288 R306	G262-A286 WeakPolarHBondContact CA-O 3.42Å; A286-I288 PolarHBondContact O-N 3.14Å; A286-R306 HydrophobicContact CB-CG 3.5Å; A286-R306 VanDerWaalsContact CB-CG 3.5Å
287	T	91.7	Very high	93.5	Very high	61 Å²	61	43.3 Å²	43.3	37%	0.374	23%	0.228	S	C	.	.			trans	-66.8	122.7	174.9	-53.2	0	0	0	0	110.1	S304 E305	T287-S304 CarbonylContact O-C 3.54Å; T287-S304 WeakPolarHBondContact O-CA 3.17Å; T287-S304 VanDerWaalsContact O-CB 3.26Å; T287-S304 WeakPolarHBondContact O-CB 3.46Å; T287-E305 VanDerWaalsContact CB-OE2 3.23Å; T287-E305 WeakPolarHBondContact CB-OE2 3.47Å; T287-E305 PolarHBondContact N-OE1 3.46Å; T287-E305 PolarHBondContact O-N 3.04Å; T287-E305 VanDerWaalsContact OG1-CD 3.24Å; T287-E305 PolarHBondContact OG1-OE1 2.77Å; T287-E305 VanDerWaalsContact OG1-OE1 3.06Å; T287-E305 PolarHBondContact OG1-OE2 2.9Å
288	I	94.6	Very high	93.3	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.036	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123.5	175.5	-56.1	-51.3	0	0	0	108.9	A258 I265 A286 L291 V302 T303	A258-I288 HydrophobicContact CB-CB 4.13Å; A258-I288 HydrophobicContact CB-CG1 3.63Å; A258-I288 HydrophobicContact CB-CG2 4.36Å; I265-I288 HydrophobicContact CD1-CD1 3.97Å; I265-I288 HydrophobicContact CD1-CG1 3.96Å; A286-I288 PolarHBondContact O-N 3.14Å; I288-L291 HydrophobicContact CG2-CD2 3.91Å; I288-L291 HydrophobicContact CG2-CG 3.98Å; I288-V302 HydrophobicContact CD1-CG1 4.06Å; I288-V302 HydrophobicContact CG2-CG1 4.23Å; I288-T303 WeakPolarHBondContact CA-O 3.15Å; I288-T303 WeakPolarHBondContact CG2-O 3.38Å
289	T	91.9	Very high	93.2	Very high	24 Å²	24	43.1 Å²	43.1	15%	0.147	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-35.9	-178.4	49.6	0	0	0	0	111.8	T303 S304 K383 A384	T289-T303 PolarHBondContact N-O 2.94Å; T289-T303 VanDerWaalsContact OG1-C 3.31Å; T289-T303 WeakPolarHBondContact OG1-CB 3.32Å; T289-T303 PolarHBondContact OG1-O 3.01Å; T289-T303 PolarHBondContact OG1-OG1 3Å; T289-S304 PolarHBondContact OG1-N 3.29Å; T289-K383 HydrophobicContact CG2-CB 4.23Å; T289-K383 HydrophobicContact CG2-CG 4.36Å; T289-A384 VanDerWaalsContact CB-O 3.23Å; T289-A384 WeakPolarHBondContact CB-O 3.25Å; T289-A384 PolarHBondContact OG1-O 2.99Å
290	S	93.5	Very high	93.2	Very high	2 Å²	2	43 Å²	43	1%	0.014	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	151.7	172.3	84.4	0	0	0	0	114.1	M1 T303 C386	M1-S290 VanDerWaalsContact SD-CB 3.56Å; S290-T303 WeakPolarHBondContact CB-OG1 3.37Å; S290-T303 PolarHBondContact N-OG1 2.85Å; S290-T303 PolarHBondContact O-N 3.33Å; S290-T303 PolarHBondContact OG-OG1 2.77Å; S290-C386 PolarHBondContact OG-N 2.75Å; S290-C386 VanDerWaalsContact OG-N 3.16Å; S290-C386 PolarHBondContact OG-O 2.83Å
291	L	96.2	Very high	93.1	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.2	167.2	-64.6	175	0	0	0	106.8	M1 S245 T247 A256 A258 I265 I288 C301 V302	M1-L291 WeakPolarHBondContact CE-O 3.48Å; S245-L291 WeakPolarHBondContact OG-CD1 3.39Å; T247-L291 HydrophobicContact CG2-CB 3.47Å; T247-L291 VanDerWaalsContact CG2-CB 3.47Å; T247-L291 HydrophobicContact CG2-CD1 4.5Å; T247-L291 WeakPolarHBondContact CG2-O 3.21Å; A256-L291 HydrophobicContact CB-CD1 4.27Å; A258-L291 HydrophobicContact CB-CD1 4.37Å; I265-L291 HydrophobicContact CD1-CD2 4.25Å; I265-L291 HydrophobicContact CG2-CD2 3.85Å; I288-L291 HydrophobicContact CG2-CD2 3.91Å; I288-L291 HydrophobicContact CG2-CG 3.98Å; L291-C301 WeakPolarHBondContact CA-O 3.47Å; L291-V302 HydrophobicContact CD2-CB 4.18Å; L291-V302 HydrophobicContact CD2-CG1 3.86Å; L291-V302 HydrophobicContact CD2-CG2 3.71Å
292	S	95.4	Very high	93.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	121.9	179.6	-171.3	0	0	0	0	110.6	C301 A387 F388	S292-C301 PolarHBondContact N-O 2.68Å; S292-C301 PolarHBondContact O-N 3.49Å; S292-A387 WeakPolarHBondContact OG-CA 3.26Å; S292-F388 WeakPolarHBondContact O-CE2 3.21Å
293	F	95.4	Very high	93.4	Very high	9 Å²	9	36.6 Å²	36.6	4%	0.039	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	145.3	164.8	-69.1	-84.7	0	0	0	109.3	T247 N249 L254 A256 I267 L299 L300 L314	T247-F293 HydrophobicContact CG2-CD2 4.05Å; T247-F293 HydrophobicContact CG2-CE2 3.93Å; N249-F293 HydrophobicContact CB-CB 3.99Å; N249-F293 HydrophobicContact CB-CD1 4.2Å; N249-F293 HydrophobicContact CB-CD2 3.66Å; N249-F293 HydrophobicContact CB-CE2 4.1Å; N249-F293 HydrophobicContact CB-CG 3.7Å; L254-F293 HydrophobicContact CB-CE1 4.2Å; L254-F293 HydrophobicContact CB-CE2 4.49Å; L254-F293 HydrophobicContact CB-CZ 3.89Å; L254-F293 HydrophobicContact CD1-CE1 4.04Å; A256-F293 HydrophobicContact CB-CE2 3.62Å; A256-F293 HydrophobicContact CB-CZ 3.6Å; I267-F293 HydrophobicContact CD1-CE1 4.23Å; I267-F293 HydrophobicContact CG2-CE1 4.45Å; I267-F293 HydrophobicContact CG2-CZ 4.21Å; F293-L299 WeakPolarHBondContact CA-O 3.45Å; F293-L300 HydrophobicContact CD1-CD1 4Å; F293-L300 HydrophobicContact CD2-CD1 4.15Å; F293-L300 HydrophobicContact CE1-CD1 4.05Å; F293-L300 HydrophobicContact CE2-CD1 4.2Å; F293-L300 HydrophobicContact CG-CD1 4.07Å; F293-L300 HydrophobicContact CZ-CD1 4.16Å; F293-L314 HydrophobicContact CD1-CD1 3.9Å; F293-L314 HydrophobicContact CE1-CD1 3.58Å
294	N	92.8	Very high	93.5	Very high	12 Å²	12	30.6 Å²	30.6	6%	0.064	16%	0.163	C	C	.	.			trans	-72.3	175.9	165.2	76.7	-33	0	0	0	110.7	D296 S297 D298 L299 F388	N294-D296 VanDerWaalsContact C-N 3.3Å; N294-D296 PolarHBondContact O-N 3.26Å; N294-S297 PolarHBondContact O-N 2.83Å; N294-S297 VanDerWaalsContact O-N 3.14Å; N294-S297 WeakPolarHBondContact OD1-CA 3.26Å; N294-S297 PolarHBondContact OD1-N 3.32Å; N294-D298 VanDerWaalsContact CG-OD1 3.25Å; N294-D298 PolarHBondContact ND2-OD1 3.41Å; N294-D298 PolarHBondContact OD1-N 2.59Å; N294-D298 VanDerWaalsContact OD1-N 3.07Å; N294-D298 PolarHBondContact OD1-OD1 3.25Å; N294-D298 VanDerWaalsContact OD1-OD1 3.1Å; N294-L299 HydrophobicContact CB-CB 4.16Å; N294-L299 PolarHBondContact N-O 2.87Å; N294-L299 PolarHBondContact OD1-N 3.04Å; N294-L299 PolarHBondContact OD1-O 2.9Å; N294-F388 HydrophobicContact CB-CB 4.21Å; N294-F388 HydrophobicContact CB-CD1 3.88Å; N294-F388 HydrophobicContact CB-CD2 3.55Å; N294-F388 HydrophobicContact CB-CE1 4.06Å; N294-F388 HydrophobicContact CB-CE2 3.73Å; N294-F388 HydrophobicContact CB-CG 3.61Å; N294-F388 HydrophobicContact CB-CZ 3.98Å; N294-F388 VanDerWaalsContact N-CD2 3.29Å
295	K	90.3	Very high	93.2	Very high	119 Å²	119	32 Å²	32	52%	0.517	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-42.8	-176.6	-177.8	-172.8	166.3	79.9	0	112.8	S297	K295-S297 VanDerWaalsContact C-N 3.3Å
296	D	90.9	Very high	92.8	Very high	109 Å²	109	33.3 Å²	33.3	58%	0.583	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-2.2	-175.8	-57.7	-44.7	0	0	0	112.8	N294 D298	N294-D296 VanDerWaalsContact C-N 3.3Å; N294-D296 PolarHBondContact O-N 3.26Å; D296-D298 PolarHBondContact O-N 2.9Å
297	S	93.9	Very high	92.3	Very high	18 Å²	18	34 Å²	34	13%	0.126	17%	0.17	C	C	.	.	S	Bend	trans	60.7	21.6	179.1	-48.9	0	0	0	0	114.6	N249 N294 K295	N249-S297 WeakPolarHBondContact CB-OG 3.27Å; N249-S297 PolarHBondContact ND2-OG 3.01Å; N294-S297 PolarHBondContact O-N 2.83Å; N294-S297 VanDerWaalsContact O-N 3.14Å; N294-S297 WeakPolarHBondContact OD1-CA 3.26Å; N294-S297 PolarHBondContact OD1-N 3.32Å; K295-S297 VanDerWaalsContact C-N 3.3Å
298	D	92.5	Very high	92	Very high	54 Å²	54	31.4 Å²	31.4	29%	0.289	15%	0.154	S	C	.	.	S	Bend	trans	-98.8	-11.1	176.3	68.2	-14.8	0	0	0	112.8	N294 D296 C313 L314 T315	N294-D298 VanDerWaalsContact CG-OD1 3.25Å; N294-D298 PolarHBondContact ND2-OD1 3.41Å; N294-D298 PolarHBondContact OD1-N 2.59Å; N294-D298 VanDerWaalsContact OD1-N 3.07Å; N294-D298 PolarHBondContact OD1-OD1 3.25Å; N294-D298 VanDerWaalsContact OD1-OD1 3.1Å; D296-D298 PolarHBondContact O-N 2.9Å; D298-C313 CarbonylContact O-C 3.54Å; D298-L314 WeakPolarHBondContact O-CB 3.2Å; D298-L314 PolarHBondContact O-N 2.71Å; D298-T315 HydrophobicContact CB-CG2 3.7Å
299	L	93.6	Very high	91.7	Very high	45 Å²	45	31 Å²	31	24%	0.236	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.3	171.3	-59.5	178.2	0	0	0	111.4	F293 N294 I311 F312 C313 F388	F293-L299 WeakPolarHBondContact CA-O 3.45Å; N294-L299 HydrophobicContact CB-CB 4.16Å; N294-L299 PolarHBondContact N-O 2.87Å; N294-L299 PolarHBondContact OD1-N 3.04Å; N294-L299 PolarHBondContact OD1-O 2.9Å; L299-I311 HydrophobicContact CB-CG2 4.3Å; L299-I311 HydrophobicContact CD1-CG2 4.44Å; L299-I311 HydrophobicContact CD2-CG2 4.31Å; L299-F312 CarbonylContact C-O 3.55Å; L299-F312 VanDerWaalsContact CA-O 3.3Å; L299-F312 WeakPolarHBondContact CA-O 3.42Å; L299-C313 HydrophobicContact CD2-CB 4.23Å; L299-F388 HydrophobicContact CB-CE1 4.47Å; L299-F388 HydrophobicContact CB-CE2 4.37Å; L299-F388 HydrophobicContact CB-CZ 3.8Å; L299-F388 HydrophobicContact CD1-CE1 4.28Å; L299-F388 HydrophobicContact CD1-CZ 4.37Å
300	L	95.2	Very high	91.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119	169.6	-177.1	73.9	0	0	0	110.7	A256 I265 I267 L279 F293 V302 I311 F312 L314	A256-L300 HydrophobicContact CB-CD1 4.12Å; A256-L300 HydrophobicContact CB-CD2 4.23Å; I265-L300 HydrophobicContact CG2-CD2 3.8Å; I267-L300 HydrophobicContact CD1-CD2 3.98Å; I267-L300 HydrophobicContact CG1-CD2 4.36Å; L279-L300 HydrophobicContact CD1-CD2 4.02Å; F293-L300 HydrophobicContact CD1-CD1 4Å; F293-L300 HydrophobicContact CD2-CD1 4.15Å; F293-L300 HydrophobicContact CE1-CD1 4.05Å; F293-L300 HydrophobicContact CE2-CD1 4.2Å; F293-L300 HydrophobicContact CG-CD1 4.07Å; F293-L300 HydrophobicContact CZ-CD1 4.16Å; L300-V302 HydrophobicContact CD2-CG2 3.91Å; L300-V302 HydrophobicContact CG-CG2 3.98Å; L300-I311 WeakPolarHBondContact O-CA 3.26Å; L300-F312 PolarHBondContact N-O 2.79Å; L300-F312 PolarHBondContact O-N 2.84Å; L300-L314 HydrophobicContact CB-CD1 4.11Å; L300-L314 HydrophobicContact CB-CD2 4.38Å; L300-L314 HydrophobicContact CB-CG 4.44Å
301	C	94.4	Very high	91.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	131.3	168.9	178.1	0	0	0	0	110.2	L291 S292 H310 F388 L396	L291-C301 WeakPolarHBondContact CA-O 3.47Å; S292-C301 PolarHBondContact N-O 2.68Å; S292-C301 PolarHBondContact O-N 3.49Å; C301-H310 CarbonylContact C-O 3.56Å; C301-H310 WeakPolarHBondContact CA-O 3.5Å; C301-F388 HydrophobicContact CB-CD2 4.37Å; C301-F388 HydrophobicContact CB-CE2 3.62Å; C301-F388 HydrophobicContact CB-CZ 3.95Å; C301-L396 HydrophobicContact CB-CD2 3.98Å
302	V	94.7	Very high	91.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120	-179.8	-177.5	0	0	0	0	108.8	I265 I288 L291 L300 A309 H310 F312	I265-V302 HydrophobicContact CD1-CG1 3.92Å; I265-V302 HydrophobicContact CG1-CG1 4.04Å; I265-V302 HydrophobicContact CG1-CG2 4.15Å; I265-V302 HydrophobicContact CG2-CG2 4.5Å; I288-V302 HydrophobicContact CD1-CG1 4.06Å; I288-V302 HydrophobicContact CG2-CG1 4.23Å; L291-V302 HydrophobicContact CD2-CB 4.18Å; L291-V302 HydrophobicContact CD2-CG1 3.86Å; L291-V302 HydrophobicContact CD2-CG2 3.71Å; L300-V302 HydrophobicContact CD2-CG2 3.91Å; L300-V302 HydrophobicContact CG-CG2 3.98Å; V302-A309 CarbonylContact O-C 3.58Å; V302-A309 WeakPolarHBondContact O-CA 3.4Å; V302-H310 HydrophobicContact CB-CB 4.35Å; V302-H310 PolarHBondContact N-O 2.92Å; V302-H310 PolarHBondContact O-N 2.9Å; V302-F312 HydrophobicContact CB-CE2 4.22Å; V302-F312 HydrophobicContact CG2-CD2 3.89Å; V302-F312 HydrophobicContact CG2-CE2 3.75Å
303	T	92.9	Very high	91.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	153.8	174.9	59.6	0	0	0	0	110.8	I288 T289 S290 A309 L378 C386	I288-T303 WeakPolarHBondContact CA-O 3.15Å; I288-T303 WeakPolarHBondContact CG2-O 3.38Å; T289-T303 PolarHBondContact N-O 2.94Å; T289-T303 VanDerWaalsContact OG1-C 3.31Å; T289-T303 WeakPolarHBondContact OG1-CB 3.32Å; T289-T303 PolarHBondContact OG1-O 3.01Å; T289-T303 PolarHBondContact OG1-OG1 3Å; S290-T303 WeakPolarHBondContact CB-OG1 3.37Å; S290-T303 PolarHBondContact N-OG1 2.85Å; S290-T303 PolarHBondContact O-N 3.33Å; S290-T303 PolarHBondContact OG-OG1 2.77Å; T303-A309 HydrophobicContact CG2-CB 3.87Å; T303-L378 HydrophobicContact CG2-CD1 4.19Å; T303-C386 HydrophobicContact CG2-CB 3.65Å; T303-C386 VanDerWaalsContact CG2-SG 3.57Å
304	S	91.2	Very high	91.2	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	167.2	177.4	67	0	0	0	0	111.6	T287 T289 R306 G307 T308	T287-S304 CarbonylContact O-C 3.54Å; T287-S304 WeakPolarHBondContact O-CA 3.17Å; T287-S304 VanDerWaalsContact O-CB 3.26Å; T287-S304 WeakPolarHBondContact O-CB 3.46Å; T289-S304 PolarHBondContact OG1-N 3.29Å; S304-R306 PolarHBondContact O-N 2.85Å; S304-R306 PolarHBondContact OG-N 2.88Å; S304-G307 PolarHBondContact O-N 3.03Å; S304-T308 PolarHBondContact N-O 2.65Å
305	E	87.2	Confident	90.7	Very high	88 Å²	88	35.5 Å²	35.5	41%	0.411	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-4.8	174	73.9	-168.5	166.3	0	0	114.3	T287 G307	T287-E305 VanDerWaalsContact CB-OE2 3.23Å; T287-E305 WeakPolarHBondContact CB-OE2 3.47Å; T287-E305 PolarHBondContact N-OE1 3.46Å; T287-E305 PolarHBondContact O-N 3.04Å; T287-E305 VanDerWaalsContact OG1-CD 3.24Å; T287-E305 PolarHBondContact OG1-OE1 2.77Å; T287-E305 VanDerWaalsContact OG1-OE1 3.06Å; T287-E305 PolarHBondContact OG1-OE2 2.9Å; E305-G307 PolarHBondContact O-N 3.25Å
306	R	86.4	Confident	89.5	Confident	145 Å²	145	37.6 Å²	37.6	55%	0.547	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	10.5	175	-61.8	-70.8	-171.4	176.5	-1.9	113.2	Q285 A286 S304 T308	Q285-R306 PolarHBondContact O-NE 3.42Å; Q285-R306 PolarHBondContact O-NH2 3.03Å; A286-R306 HydrophobicContact CB-CG 3.5Å; A286-R306 VanDerWaalsContact CB-CG 3.5Å; S304-R306 PolarHBondContact O-N 2.85Å; S304-R306 PolarHBondContact OG-N 2.88Å; R306-T308 VanDerWaalsContact C-N 3.29Å; R306-T308 PolarHBondContact O-N 3.32Å
307	G	83.1	Confident	87.5	Confident	14 Å²	14	37.1 Å²	37.1	14%	0.144	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	33.1	178.3	0	0	0	0	0	113.2	S304 E305 L378	S304-G307 PolarHBondContact O-N 3.03Å; E305-G307 PolarHBondContact O-N 3.25Å; G307-L378 PolarHBondContact O-N 3.26Å
308	T	85	Confident	84.7	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.037	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.3	179.1	48.6	0	0	0	0	111.1	S304 R306 C376	S304-T308 PolarHBondContact N-O 2.65Å; R306-T308 VanDerWaalsContact C-N 3.29Å; R306-T308 PolarHBondContact O-N 3.32Å; T308-C376 WeakPolarHBondContact CA-O 3.41Å
309	A	89.9	Confident	82	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.8	168.5	0	0	0	0	0	109.6	V302 T303 R375 C376 L378	V302-A309 CarbonylContact O-C 3.58Å; V302-A309 WeakPolarHBondContact O-CA 3.4Å; T303-A309 HydrophobicContact CG2-CB 3.87Å; A309-R375 WeakPolarHBondContact O-CA 3.26Å; A309-C376 VanDerWaalsContact CB-SG 3.59Å; A309-C376 PolarHBondContact N-O 2.9Å; A309-C376 PolarHBondContact O-N 3.34Å; A309-L378 HydrophobicContact CB-CD1 4.42Å; A309-L378 HydrophobicContact CB-CD2 4.02Å; A309-L378 HydrophobicContact CB-CG 4.33Å
310	H	91.7	Very high	79	Confident	3 Å²	3	47.6 Å²	47.6	1%	0.014	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.5	177.4	-72.3	-98.8	0	0	0	108.6	R281 C301 V302 F312 S372	R281-H310 PolarHBondContact O-CE1 2.9Å; R281-H310 VanDerWaalsContact O-CE1 3.23Å; C301-H310 CarbonylContact C-O 3.56Å; C301-H310 WeakPolarHBondContact CA-O 3.5Å; V302-H310 HydrophobicContact CB-CB 4.35Å; V302-H310 PolarHBondContact N-O 2.92Å; V302-H310 PolarHBondContact O-N 2.9Å; H310-F312 HydrophobicContact CB-CD2 4.39Å; H310-F312 HydrophobicContact CB-CE2 3.65Å; H310-F312 HydrophobicContact CB-CZ 4.12Å; H310-S372 WeakPolarHBondContact ND1-CB 3.42Å; H310-S372 PolarHBondContact ND1-OG 2.76Å
311	I	92.9	Very high	75.8	Confident	27 Å²	27	54.2 Å²	54.2	14%	0.138	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122	174.8	-49.2	177.1	0	0	0	108.4	L299 L300 H373 V374 F388 L396	L299-I311 HydrophobicContact CB-CG2 4.3Å; L299-I311 HydrophobicContact CD1-CG2 4.44Å; L299-I311 HydrophobicContact CD2-CG2 4.31Å; L300-I311 WeakPolarHBondContact O-CA 3.26Å; I311-H373 PolarHBondContact O-N 3.28Å; I311-V374 HydrophobicContact CB-CB 4.17Å; I311-V374 HydrophobicContact CD1-CB 4.23Å; I311-V374 HydrophobicContact CD1-CG1 4.37Å; I311-V374 HydrophobicContact CG1-CB 4.38Å; I311-V374 PolarHBondContact N-O 2.92Å; I311-V374 PolarHBondContact O-N 3.49Å; I311-F388 HydrophobicContact CG2-CZ 4.35Å; I311-L396 HydrophobicContact CD1-CD1 3.96Å; I311-L396 HydrophobicContact CG1-CD1 4.45Å
312	F	93.9	Very high	72.7	Confident	1 Å²	1	60.3 Å²	60.3	0%	0.004	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.4	177.5	-62.9	-90.4	0	0	0	110.1	L279 L299 L300 V302 H310 L314 S372	L279-F312 HydrophobicContact CB-CD1 3.87Å; L279-F312 HydrophobicContact CB-CE1 3.81Å; L279-F312 HydrophobicContact CB-CG 4.27Å; L279-F312 HydrophobicContact CB-CZ 4.17Å; L279-F312 HydrophobicContact CD1-CB 3.78Å; L279-F312 HydrophobicContact CD1-CD1 4.1Å; L279-F312 HydrophobicContact CD1-CD2 4.15Å; L279-F312 HydrophobicContact CD1-CG 3.76Å; L279-F312 HydrophobicContact CD2-CB 4.4Å; L279-F312 HydrophobicContact CD2-CD1 3.95Å; L279-F312 HydrophobicContact CD2-CG 4.37Å; L279-F312 HydrophobicContact CG-CD1 4.18Å; L279-F312 HydrophobicContact CG-CG 4.35Å; L299-F312 CarbonylContact C-O 3.55Å; L299-F312 VanDerWaalsContact CA-O 3.3Å; L299-F312 WeakPolarHBondContact CA-O 3.42Å; L300-F312 PolarHBondContact N-O 2.79Å; L300-F312 PolarHBondContact O-N 2.84Å; V302-F312 HydrophobicContact CB-CE2 4.22Å; V302-F312 HydrophobicContact CG2-CD2 3.89Å; V302-F312 HydrophobicContact CG2-CE2 3.75Å; H310-F312 HydrophobicContact CB-CD2 4.39Å; H310-F312 HydrophobicContact CB-CE2 3.65Å; H310-F312 HydrophobicContact CB-CZ 4.12Å; F312-L314 HydrophobicContact CB-CD2 4.36Å; F312-S372 VanDerWaalsContact CE1-N 3.25Å
313	C	91.6	Very high	69.6	Low	40 Å²	40	70.2 Å²	70.2	27%	0.27	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.6	168.4	-167.7	0	0	0	0	109.5	D298 L299 T315 H373	D298-C313 CarbonylContact O-C 3.54Å; L299-C313 HydrophobicContact CD2-CB 4.23Å; C313-T315 PolarHBondContact SG-OG1 3.15Å; C313-H373 PolarHBondContact N-CD2 2.81Å
314	L	91.2	Very high	66.5	Low	13 Å²	13	76.6 Å²	76.6	7%	0.068	40%	0.399	C	S	.	.			trans	-113.6	-5.1	-175.9	-50.8	-175.5	0	0	0	112.3	I267 L279 F293 D298 L300 F312 K316	I267-L314 HydrophobicContact CD1-CD1 3.52Å; I267-L314 HydrophobicContact CD1-CD2 3.36Å; I267-L314 HydrophobicContact CD1-CG 4.07Å; L279-L314 HydrophobicContact CD1-CD2 3.87Å; F293-L314 HydrophobicContact CD1-CD1 3.9Å; F293-L314 HydrophobicContact CE1-CD1 3.58Å; D298-L314 WeakPolarHBondContact O-CB 3.2Å; D298-L314 PolarHBondContact O-N 2.71Å; L300-L314 HydrophobicContact CB-CD1 4.11Å; L300-L314 HydrophobicContact CB-CD2 4.38Å; L300-L314 HydrophobicContact CB-CG 4.44Å; F312-L314 HydrophobicContact CB-CD2 4.36Å; L314-K316 PolarHBondContact O-N 2.89Å
315	T	83	Confident	63.5	Low	60 Å²	60	83.7 Å²	83.7	37%	0.368	44%	0.435	S	S	.	.	S	Bend	trans	-55.8	131.7	173.7	56.2	0	0	0	0	108.8	D298 C313 D317	D298-T315 HydrophobicContact CB-CG2 3.7Å; C313-T315 PolarHBondContact SG-OG1 3.15Å; T315-D317 PolarHBondContact O-N 2.81Å
316	K	64	Low	60.6	Low	162 Å²	162	87.2 Å²	87.2	70%	0.704	45%	0.452	S	S	*	.			trans	-60.9	113.9	159.8	-67.3	178	-177.2	175.5	0	105	L314 S318 F368	L314-K316 PolarHBondContact O-N 2.89Å; K316-S318 PolarHBondContact O-N 2.98Å; K316-F368 HydrophobicContact CG-CZ 4.49Å
317	D	50.2	Low	57.9	Low	99 Å²	99	87.1 Å²	87.1	53%	0.529	46%	0.46	S	S	.	.			trans	-50.2	102	169.6	-82.7	-21.4	0	0	0	107.3	T315 L319	T315-D317 PolarHBondContact O-N 2.81Å; D317-L319 HydrophobicContact CB-CB 4.33Å; D317-L319 HydrophobicContact CB-CD1 3.61Å; D317-L319 VanDerWaalsContact CG-CD1 3.43Å; D317-L319 PolarHBondContact O-N 3.29Å; D317-L319 WeakPolarHBondContact OD1-CD1 3.41Å
318	S	33.9	Very low	55.2	Low	103 Å²	103	89.6 Å²	89.6	72%	0.72	49%	0.486	S	S	*	.			trans	-81.2	35.4	159.3	-61.4	0	0	0	0	107.9	K316 T320	K316-S318 PolarHBondContact O-N 2.98Å; S318-T320 WeakPolarHBondContact O-CB 3.34Å; S318-T320 WeakPolarHBondContact O-CG2 3.31Å; S318-T320 PolarHBondContact O-N 2.79Å
319	L	36.1	Very low	52.6	Low	133 Å²	133	94.2 Å²	94.2	70%	0.696	52%	0.518	S	S	*	.			trans	-64.9	73.3	148.5	-75.5	91.4	0	0	0	105.1	D317	D317-L319 HydrophobicContact CB-CB 4.33Å; D317-L319 HydrophobicContact CB-CD1 3.61Å; D317-L319 VanDerWaalsContact CG-CD1 3.43Å; D317-L319 PolarHBondContact O-N 3.29Å; D317-L319 WeakPolarHBondContact OD1-CD1 3.41Å
320	T	30.3	Very low	49.7	Very low	101 Å²	101	99.8 Å²	99.8	62%	0.62	56%	0.557	S	S	*	*				33.2	116.6	97.1	64.1	0	0	0	0	110	S318	S318-T320 WeakPolarHBondContact O-CB 3.34Å; S318-T320 WeakPolarHBondContact O-CG2 3.31Å; S318-T320 PolarHBondContact O-N 2.79Å
321	N	28.3	Very low	46.7	Very low	140 Å²	140	104.7 Å²	104.7	75%	0.749	59%	0.592	S	S	*	*	S	Bend	trans	-13.7	129.2	157.6	-94.3	-21.8	0	0	0	111	R323	N321-R323 PolarHBondContact O-N 2.93Å
322	P	28.9	Very low	43.7	Very low	128 Å²	128	110.2 Å²	110.2	83%	0.831	62%	0.622	S	S	*	*			trans	-59.7	88.2	163.4	26.8	-30.6	0	0	0	106.1	N324	P322-N324 PolarHBondContact O-N 2.84Å
323	R	29.1	Very low	40.4	Very low	209 Å²	209	115.9 Å²	115.9	79%	0.789	66%	0.661	S	S	*	*			trans	-66.2	91.6	160.6	-97.6	-169	-82.1	164.9	-6.7	101.7	N321 I325	N321-R323 PolarHBondContact O-N 2.93Å; R323-I325 VanDerWaalsContact C-N 3.25Å; R323-I325 PolarHBondContact O-N 3.08Å
324	N	27.7	Very low	37.5	Very low	133 Å²	133	121.1 Å²	121.1	71%	0.711	69%	0.685	S	S	*	*			trans	24.1	75.8	132.8	-137.9	-0.9	0	0	0	109.2	P322 Q326	P322-N324 PolarHBondContact O-N 2.84Å; N324-Q326 PolarHBondContact O-N 2.89Å
325	I	28.6	Very low	34.3	Very low	152 Å²	152	125.7 Å²	125.7	78%	0.779	72%	0.718	S	S	*	*			trans	-68.2	86.6	165.7	-64.1	175.3	0	0	0	101.7	R323 I327	R323-I325 VanDerWaalsContact C-N 3.25Å; R323-I325 PolarHBondContact O-N 3.08Å; I325-I327 HydrophobicContact CG2-CG1 4.37Å; I325-I327 PolarHBondContact O-N 2.79Å
326	Q	26.3	Very low	31.7	Very low	163 Å²	163	128.2 Å²	128.2	76%	0.762	74%	0.738	S	S	*	*			trans	-59.2	91.5	164.7	-77.3	179.6	-37.4	0	0	104.3	N324 G328	N324-Q326 PolarHBondContact O-N 2.89Å; Q326-G328 PolarHBondContact O-N 2.79Å
327	I	29.6	Very low	30	Very low	143 Å²	143	126.6 Å²	126.6	73%	0.733	75%	0.748	S	S	*	*			trans	-56.7	102.3	158.7	-65.6	170.5	0	0	0	103.3	I325 S329	I325-I327 HydrophobicContact CG2-CG1 4.37Å; I325-I327 PolarHBondContact O-N 2.79Å; I327-S329 PolarHBondContact O-N 2.77Å
328	G	27.1	Very low	28.9	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	76%	0.759	S	S	*	*			trans	-63.6	85.4	178.1	0	0	0	0	0	108.7	Q326 S330	Q326-G328 PolarHBondContact O-N 2.79Å; G328-S330 VanDerWaalsContact C-N 3.3Å; G328-S330 PolarHBondContact O-N 2.73Å; G328-S330 VanDerWaalsContact O-N 3.14Å
329	S	30.5	Very low	28.5	Very low	102 Å²	102	128 Å²	128	71%	0.713	76%	0.764	S	S	*	*			trans	-74.2	95.7	157.2	-65.3	0	0	0	0	106.3	I327 S331	I327-S329 PolarHBondContact O-N 2.77Å; S329-S331 PolarHBondContact O-N 2.99Å
330	S	28.8	Very low	28.2	Very low	118 Å²	118	129 Å²	129	83%	0.825	77%	0.771	S	S	*	*			trans	-54	101.1	166.3	-44.5	0	0	0	0	108.9	G328	G328-S330 VanDerWaalsContact C-N 3.3Å; G328-S330 PolarHBondContact O-N 2.73Å; G328-S330 VanDerWaalsContact O-N 3.14Å
331	S	28.8	Very low	27.9	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	77%	0.772	S	S	*	*			trans	-156.3	103.3	166	-79	0	0	0	0	110.8	S329	S329-S331 PolarHBondContact O-N 2.99Å
332	N	29.8	Very low	27.8	Very low	143 Å²	143	128.7 Å²	128.7	77%	0.765	77%	0.772	S	S	*	*			trans	61.7	98	146.7	-63.9	-6.3	0	0	0	119.4	I334	N332-I334 PolarHBondContact O-N 2.97Å
333	S	25.2	Very low	27.7	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	77%	0.767	S	S	*	*			trans	-36	113.6	134.7	51.1	0	0	0	0	112.9
334	I	30	Very low	27.4	Very low	150 Å²	150	123.1 Å²	123.1	77%	0.769	76%	0.764	S	S	*	*			trans	-127.3	111.5	150.2	-63.7	177.3	0	0	0	107.2	N332	N332-I334 PolarHBondContact O-N 2.97Å
335	S	24.2	Very low	27.3	Very low	109 Å²	109	121.7 Å²	121.7	76%	0.762	76%	0.764	S	S	*	*			trans	-58.4	133.9	163	49.4	0	0	0	0	111.9
336	S	28.8	Very low	27.3	Very low	113 Å²	113	121 Å²	121	79%	0.79	76%	0.762	S	S	*	*			trans	-163.9	118	138.1	55.2	0	0	0	0	110.6
337	S	27.3	Very low	27.5	Very low	129 Å²	129	121.7 Å²	121.7	90%	0.902	77%	0.765	S	S	*	*			trans	-45.2	147.5	162.7	-49.7	0	0	0	0	113
338	G	28	Very low	27.2	Very low	75 Å²	75	120 Å²	120	77%	0.773	77%	0.766	S	S	*	*			trans	177.5	80	171.8	0	0	0	0	0	112.5
339	N	24.6	Very low	27.2	Very low	155 Å²	155	122.6 Å²	122.6	83%	0.829	77%	0.77	S	S	*	*			trans	-50.4	133.7	156.3	-75.8	-22.8	0	0	0	109.4
340	N	29.8	Very low	27	Very low	155 Å²	155	125.7 Å²	125.7	83%	0.829	77%	0.774	S	S	*	*				-173.3	125.1	121.1	-97.7	-15.8	0	0	0	112.7
341	S	24.3	Very low	26.7	Very low	91 Å²	91	127.5 Å²	127.5	64%	0.636	77%	0.773	S	S	*	*			trans	-53.3	148.2	149.4	47.9	0	0	0	0	112.8
342	N	26.6	Very low	26.6	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	78%	0.776	S	S	*	*			trans	122.3	139.1	141	-72.3	-17.2	0	0	0	118.4
343	T	26.8	Very low	26.4	Very low	119 Å²	119	131.4 Å²	131.4	73%	0.73	78%	0.781	S	S	*	*			trans	81.6	97	150.3	63.4	0	0	0	0	119.4
344	S	23.4	Very low	26.4	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	78%	0.783	S	S	*	*				31.7	124.6	111.7	60.4	0	0	0	0	119.4
345	S	25.8	Very low	26.2	Very low	102 Å²	102	130 Å²	130	71%	0.713	78%	0.784	S	S	*	*				126.8	131.9	129.2	72.2	0	0	0	0	115.8
346	N	27.1	Very low	26.4	Very low	137 Å²	137	128.4 Å²	128.4	73%	0.733	79%	0.785	S	S	*	*			trans	70.9	100.6	149.5	-58.3	-14.6	0	0	0	119.1
347	H	31.6	Very low	26.3	Very low	178 Å²	178	133.6 Å²	133.6	82%	0.824	79%	0.794	S	S	*	*				165.4	130	90.4	-107.3	-67	0	0	0	110.7
348	S	22.4	Very low	26.4	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	78%	0.783	S	S	*	*			trans	-58.9	152.5	157.9	-56.1	0	0	0	0	110.3
349	P	28.3	Very low	26.6	Very low	120 Å²	120	132.4 Å²	132.4	78%	0.779	78%	0.784	S	S	*	*				-144.6	158.4	90	38.8	-23.3	0	0	0	115.9
350	H	25.6	Very low	26.8	Very low	168 Å²	168	128.1 Å²	128.1	78%	0.778	78%	0.776	S	S	*	*			trans	97.3	101	138.7	-143.6	-89.3	0	0	0	120
351	L	21.5	Very low	27	Very low	155 Å²	155	130.3 Å²	130.3	81%	0.812	78%	0.779	S	S	*	*			trans	-47.3	135.8	161.4	-87.1	67.5	0	0	0	113.3
352	T	28	Very low	27.4	Very low	129 Å²	129	133.5 Å²	133.5	79%	0.791	79%	0.788	S	S	*	*			trans	-134.1	106.8	143.2	56.4	0	0	0	0	110.3
353	K	25.7	Very low	27.9	Very low	201 Å²	201	131.4 Å²	131.4	87%	0.874	78%	0.784	S	S	*	*			trans	17.8	99.8	155.6	-67.6	177.5	179.1	175.7	0	117.6
354	S	24.1	Very low	28.3	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	79%	0.79	S	S	*	*			trans	-79.2	106	153.4	55.8	0	0	0	0	110
355	S	27	Very low	29	Very low	113 Å²	113	139.3 Å²	139.3	79%	0.79	80%	0.796	S	S	*	*			trans	-142.1	107.2	163.6	57.7	0	0	0	0	108.8
356	G	27.1	Very low	29.8	Very low	76 Å²	76	137.6 Å²	137.6	78%	0.784	79%	0.785	S	S	*	*			trans	146.6	63.1	172.2	0	0	0	0	0	114.6	G358	G356-G358 PolarHBondContact O-N 3.15Å
357	F	28.2	Very low	30.4	Very low	222 Å²	222	138.8 Å²	138.8	97%	0.974	79%	0.79	S	S	*	*			trans	-69	73.9	154.4	-89.8	-91.9	0	0	0	108.2
358	G	29.1	Very low	31.4	Very low	66 Å²	66	133.6 Å²	133.6	68%	0.68	77%	0.765	S	S	*	*			trans	-87.7	99.9	165.2	0	0	0	0	0	107.1	G356 G360	G356-G358 PolarHBondContact O-N 3.15Å; G358-G360 PolarHBondContact O-N 3.21Å
359	S	32.6	Very low	33	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	75%	0.745	S	S	*	*			trans	-53.1	90.7	170.1	-50.6	0	0	0	0	109.1	K361	S359-K361 PolarHBondContact O-N 3.46Å
360	G	28.8	Very low	35	Very low	64 Å²	64	128.1 Å²	128.1	66%	0.66	73%	0.727	S	S	*	*			trans	-65.3	84.5	172.9	0	0	0	0	0	108.4	G358 L362	G358-G360 PolarHBondContact O-N 3.21Å; G360-L362 PolarHBondContact O-N 3.34Å
361	K	32.4	Very low	37.4	Very low	202 Å²	202	124 Å²	124	88%	0.878	71%	0.714	S	S	*	*			trans	-65.1	77.2	147.5	-81.5	-175.2	176.1	178.2	0	105.8	S359 S363	S359-K361 PolarHBondContact O-N 3.46Å; K361-S363 PolarHBondContact O-N 3.28Å
362	L	33.9	Very low	39.9	Very low	158 Å²	158	118 Å²	118	83%	0.827	69%	0.685	S	S	*	*			trans	-59.8	89	155.3	-73.3	166.9	0	0	0	104.6	G360 L364	G360-L362 PolarHBondContact O-N 3.34Å; L362-L364 VanDerWaalsContact C-N 3.27Å; L362-L364 PolarHBondContact O-N 3.14Å
363	S	36.8	Very low	42.3	Very low	98 Å²	98	117.5 Å²	117.5	69%	0.685	67%	0.673	S	S	*	*			trans	-55.8	105	160.9	179.3	0	0	0	0	104.3	K361 R365	K361-S363 PolarHBondContact O-N 3.28Å; S363-R365 PolarHBondContact O-N 2.78Å
364	L	35.6	Very low	44.9	Very low	165 Å²	165	111.6 Å²	111.6	86%	0.864	65%	0.654	S	S	*	*			trans	-59.9	76.8	167.7	-83.7	156.4	0	0	0	106.7	L362 S366	L362-L364 VanDerWaalsContact C-N 3.27Å; L362-L364 PolarHBondContact O-N 3.14Å; L364-S366 PolarHBondContact O-N 2.88Å
365	R	37.6	Very low	47.6	Very low	222 Å²	222	113 Å²	113	84%	0.838	64%	0.64	S	S	*	*			trans	-66.5	84.8	158.3	-79.9	-165.7	176.4	-152.6	1.2	105.4	S363 L367	S363-R365 PolarHBondContact O-N 2.78Å; R365-L367 PolarHBondContact O-N 2.79Å
366	S	42.7	Very low	50.3	Low	67 Å²	67	109.7 Å²	109.7	47%	0.469	62%	0.616	S	S	.	*			trans	35.8	85	137.3	155.3	0	0	0	0	113.1	L364 F368	L364-S366 PolarHBondContact O-N 2.88Å; S366-F368 PolarHBondContact O-N 3.2Å; S366-F368 WeakPolarHBondContact OG-CD2 3.45Å
367	L	39.7	Very low	52.8	Low	161 Å²	161	111.3 Å²	111.3	84%	0.843	61%	0.61	S	S	*	*			trans	-72.3	41.5	163	-69.2	170.4	0	0	0	110.8	R365	R365-L367 PolarHBondContact O-N 2.79Å
368	F	52.4	Low	55.1	Low	69 Å²	69	101.4 Å²	101.4	30%	0.303	57%	0.568	S	S	.	*			trans	-97.2	142.5	179.8	-59.2	-56.5	0	0	0	110.1	K316 S366 T370	K316-F368 HydrophobicContact CG-CZ 4.49Å; S366-F368 PolarHBondContact O-N 3.2Å; S366-F368 WeakPolarHBondContact OG-CD2 3.45Å; F368-T370 PolarHBondContact O-N 2.83Å
369	S	56.2	Low	56.9	Low	46 Å²	46	107.8 Å²	107.8	32%	0.322	58%	0.58	S	S	.	*			trans	-62.2	106.4	167.3	-178.4	0	0	0	0	108.8	T371	S369-T371 PolarHBondContact O-N 3.33Å; S369-T371 PolarHBondContact OG-N 2.6Å; S369-T371 PolarHBondContact OG-O 3.46Å; S369-T371 PolarHBondContact OG-OG1 2.77Å
370	T	69.8	Low	58.6	Low	67 Å²	67	104.2 Å²	104.2	41%	0.411	55%	0.553	S	S	.	*	S	Bend	trans	-69.9	-12.8	169	60.8	0	0	0	0	111.3	R280 F368	R280-T370 WeakPolarHBondContact CA-O 3.29Å; R280-T370 VanDerWaalsContact CB-O 3.31Å; R280-T370 WeakPolarHBondContact CB-O 3.43Å; R280-T370 PolarHBondContact N-O 2.69Å; F368-T370 PolarHBondContact O-N 2.83Å
371	T	75.9	Confident	60.2	Low	81 Å²	81	110.9 Å²	110.9	50%	0.497	56%	0.564	S	S	.	*	S	Bend	trans	-97.9	151.6	178.2	46.8	0	0	0	0	111.4	S369	S369-T371 PolarHBondContact O-N 3.33Å; S369-T371 PolarHBondContact OG-N 2.6Å; S369-T371 PolarHBondContact OG-O 3.46Å; S369-T371 PolarHBondContact OG-OG1 2.77Å
372	S	74.3	Confident	61.9	Low	29 Å²	29	104.4 Å²	104.4	20%	0.203	54%	0.536	C	S	.	.			trans	-64.1	139.6	175.5	54.6	0	0	0	0	111.3	H310 F312	H310-S372 WeakPolarHBondContact ND1-CB 3.42Å; H310-S372 PolarHBondContact ND1-OG 2.76Å; F312-S372 VanDerWaalsContact CE1-N 3.25Å
373	H	77.9	Confident	64.1	Low	120 Å²	120	100.6 Å²	100.6	56%	0.556	51%	0.513	S	S	*	.	S	Bend	trans	-73.3	-36.3	174.8	-74.7	-100.4	0	0	0	111.6	I311 C313	I311-H373 PolarHBondContact O-N 3.28Å; C313-H373 PolarHBondContact N-CD2 2.81Å
374	V	81.8	Confident	66.4	Low	76 Å²	76	96.1 Å²	96.1	46%	0.461	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.2	175.8	-177.5	0	0	0	0	108.7	I311	I311-V374 HydrophobicContact CB-CB 4.17Å; I311-V374 HydrophobicContact CD1-CB 4.23Å; I311-V374 HydrophobicContact CD1-CG1 4.37Å; I311-V374 HydrophobicContact CG1-CB 4.38Å; I311-V374 PolarHBondContact N-O 2.92Å; I311-V374 PolarHBondContact O-N 3.49Å
375	R	80.6	Confident	68.9	Low	157 Å²	157	88.2 Å²	88.2	59%	0.592	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	117.7	168.8	179.1	-179.9	175.3	150.4	-2.7	107.9	A309	A309-R375 WeakPolarHBondContact O-CA 3.26Å
376	C	82.8	Confident	71.3	Confident	43 Å²	43	77.8 Å²	77.8	29%	0.291	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143	172	42.2	0	0	0	0	110.1	T308 A309	T308-C376 WeakPolarHBondContact CA-O 3.41Å; A309-C376 VanDerWaalsContact CB-SG 3.59Å; A309-C376 PolarHBondContact N-O 2.9Å; A309-C376 PolarHBondContact O-N 3.34Å
377	V	79.9	Confident	73.5	Confident	110 Å²	110	74.6 Å²	74.6	67%	0.667	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.2	169.2	179.8	0	0	0	0	106.8
378	L	76.4	Confident	75.7	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.079	34%	0.341	C	S	.	.			trans	-85.2	118.2	169.2	-55.3	176.7	0	0	0	105.6	T303 G307 A309 T380 A384	T303-L378 HydrophobicContact CG2-CD1 4.19Å; G307-L378 PolarHBondContact O-N 3.26Å; A309-L378 HydrophobicContact CB-CD1 4.42Å; A309-L378 HydrophobicContact CB-CD2 4.02Å; A309-L378 HydrophobicContact CB-CG 4.33Å; L378-T380 HydrophobicContact CB-CG2 3.89Å; L378-T380 PolarHBondContact O-N 2.97Å; L378-A384 HydrophobicContact CD1-CB 3.92Å
379	E	67.8	Low	77.3	Confident	200 Å²	200	64.4 Å²	64.4	94%	0.935	33%	0.328	S	S	*	.			trans	-74	54.9	-178.8	-65	-170.7	170.7	0	0	111.5
380	T	67	Low	78.2	Confident	38 Å²	38	65.4 Å²	65.4	23%	0.233	34%	0.335	C	S	.	.			trans	-136.2	139.6	-177.9	-178.6	0	0	0	0	111.2	L378 F382 A384	L378-T380 HydrophobicContact CB-CG2 3.89Å; L378-T380 PolarHBondContact O-N 2.97Å; T380-F382 VanDerWaalsContact CG2-O 3.3Å; T380-F382 WeakPolarHBondContact CG2-O 3.33Å; T380-F382 PolarHBondContact OG1-N 2.89Å; T380-A384 HydrophobicContact CG2-CB 4.31Å
381	K	63.5	Low	78.6	Confident	205 Å²	205	67.5 Å²	67.5	89%	0.891	35%	0.347	S	S	*	.	S	Bend	trans	-76.5	-12.5	168.3	-65.9	-179	-178.5	174	0	111.8
382	F	68.2	Low	78.8	Confident	66 Å²	66	65.7 Å²	65.7	29%	0.289	34%	0.338	S	S	.	.	S	Bend	trans	-106.6	165.9	-170.2	-55.2	-73.2	0	0	0	111.9	T380 N401 E403	T380-F382 VanDerWaalsContact CG2-O 3.3Å; T380-F382 WeakPolarHBondContact CG2-O 3.33Å; T380-F382 PolarHBondContact OG1-N 2.89Å; F382-N401 HydrophobicContact CB-CB 4.44Å; F382-E403 HydrophobicContact CE2-CG 4.42Å; F382-E403 HydrophobicContact CZ-CG 4.33Å; F382-E403 WeakPolarHBondContact CZ-OE1 3.47Å
383	K	79.4	Confident	78.7	Confident	78 Å²	78	66.6 Å²	66.6	34%	0.339	34%	0.343	S	S	.	.			trans	-65.3	139.1	170.6	-63.3	167.6	-173.8	149.4	0	109.1	M3 D9 T289	M3-K383 HydrophobicContact CE-CB 3.8Å; M3-K383 WeakPolarHBondContact CE-O 3.31Å; M3-K383 HydrophobicContact SD-CB 3.32Å; M3-K383 WeakPolarHBondContact SD-CB 3.47Å; M3-K383 HydrophobicContact SD-CD 3.87Å; M3-K383 HydrophobicContact SD-CG 4.22Å; D9-K383 IonicContact OD2-NZ 2.86Å; D9-K383 PolarHBondContact OD2-NZ 3.17Å; T289-K383 HydrophobicContact CG2-CB 4.23Å; T289-K383 HydrophobicContact CG2-CG 4.36Å
384	A	84.6	Confident	78.3	Confident	3 Å²	3	68.1 Å²	68.1	3%	0.025	36%	0.356	C	S	.	.			trans	-125.1	151.3	176.8	0	0	0	0	0	110.5	T289 L378 T380	T289-A384 VanDerWaalsContact CB-O 3.23Å; T289-A384 WeakPolarHBondContact CB-O 3.25Å; T289-A384 PolarHBondContact OG1-O 2.99Å; L378-A384 HydrophobicContact CD1-CB 3.92Å; T380-A384 HydrophobicContact CG2-CB 4.31Å
385	I	87.7	Confident	78.2	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.5	165	60.4	175.1	0	0	0	108.5	M1 M3 V18 F20 T399	M1-I385 HydrophobicContact CG-CB 4.38Å; M1-I385 HydrophobicContact CG-CD1 4.4Å; M1-I385 HydrophobicContact SD-CB 4.16Å; M3-I385 HydrophobicContact CB-CG2 4.08Å; V18-I385 HydrophobicContact CG1-CD1 4.46Å; F20-I385 HydrophobicContact CD2-CD1 3.88Å; F20-I385 HydrophobicContact CD2-CG1 4.29Å; F20-I385 HydrophobicContact CE2-CD1 3.95Å; F20-I385 HydrophobicContact CE2-CG1 3.87Å; I385-T399 WeakPolarHBondContact CG1-OG1 3.4Å; I385-T399 PolarHBondContact N-O 2.82Å; I385-T399 PolarHBondContact O-N 2.79Å
386	C	89.6	Confident	78.1	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.014	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	144.8	177.9	-59.1	0	0	0	0	111	M1 S290 T303 I397	M1-C386 WeakPolarHBondContact CE-O 3.33Å; S290-C386 PolarHBondContact OG-N 2.75Å; S290-C386 VanDerWaalsContact OG-N 3.16Å; S290-C386 PolarHBondContact OG-O 2.83Å; T303-C386 HydrophobicContact CG2-CB 3.65Å; T303-C386 VanDerWaalsContact CG2-SG 3.57Å; C386-I397 VanDerWaalsContact CA-O 3.3Å; C386-I397 WeakPolarHBondContact CA-O 3.13Å
387	A	87.2	Confident	77.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	157.7	171.6	0	0	0	0	0	110.6	M1 F20 Y24 S292 L396 I397	M1-A387 HydrophobicContact CE-CB 4.37Å; M1-A387 HydrophobicContact SD-CB 4.25Å; F20-A387 HydrophobicContact CD2-CB 4.43Å; F20-A387 HydrophobicContact CE2-CB 4.21Å; Y24-A387 HydrophobicContact CD1-CB 3.95Å; Y24-A387 HydrophobicContact CD2-CB 3.8Å; Y24-A387 HydrophobicContact CE1-CB 4.4Å; Y24-A387 HydrophobicContact CE2-CB 4.26Å; Y24-A387 HydrophobicContact CG-CB 3.63Å; S292-A387 WeakPolarHBondContact OG-CA 3.26Å; A387-L396 CarbonylContact O-C 3.54Å; A387-L396 WeakPolarHBondContact O-CA 3.16Å; A387-I397 PolarHBondContact N-O 2.9Å; A387-I397 PolarHBondContact O-N 3.3Å
388	F	87.6	Confident	77.8	Confident	11 Å²	11	61 Å²	61	5%	0.048	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	138.4	169.5	-68.4	-84.9	0	0	0	110.3	S292 N294 L299 C301 I311 P393 L396	S292-F388 WeakPolarHBondContact O-CE2 3.21Å; N294-F388 HydrophobicContact CB-CB 4.21Å; N294-F388 HydrophobicContact CB-CD1 3.88Å; N294-F388 HydrophobicContact CB-CD2 3.55Å; N294-F388 HydrophobicContact CB-CE1 4.06Å; N294-F388 HydrophobicContact CB-CE2 3.73Å; N294-F388 HydrophobicContact CB-CG 3.61Å; N294-F388 HydrophobicContact CB-CZ 3.98Å; N294-F388 VanDerWaalsContact N-CD2 3.29Å; L299-F388 HydrophobicContact CB-CE1 4.47Å; L299-F388 HydrophobicContact CB-CE2 4.37Å; L299-F388 HydrophobicContact CB-CZ 3.8Å; L299-F388 HydrophobicContact CD1-CE1 4.28Å; L299-F388 HydrophobicContact CD1-CZ 4.37Å; C301-F388 HydrophobicContact CB-CD2 4.37Å; C301-F388 HydrophobicContact CB-CE2 3.62Å; C301-F388 HydrophobicContact CB-CZ 3.95Å; I311-F388 HydrophobicContact CG2-CZ 4.35Å; F388-P393 VanDerWaalsContact CD1-O 3.29Å; F388-P393 WeakPolarHBondContact CD1-O 3.09Å; F388-L396 HydrophobicContact CD1-CD2 3.76Å; F388-L396 HydrophobicContact CD2-CD2 4.34Å; F388-L396 HydrophobicContact CE1-CD2 3.79Å; F388-L396 HydrophobicContact CE2-CD2 4.38Å; F388-L396 HydrophobicContact CG-CD2 4.06Å; F388-L396 HydrophobicContact CZ-CD2 4.12Å
389	S	84.4	Confident	77.6	Confident	6 Å²	6	60.6 Å²	60.6	4%	0.042	32%	0.317	C	S	.	.			trans	-64.2	137.4	174.9	170.5	0	0	0	0	110.7	V391 S392 P393 T395	S389-V391 VanDerWaalsContact C-N 3.27Å; S389-V391 PolarHBondContact OG-N 2.8Å; S389-V391 VanDerWaalsContact OG-N 3.15Å; S389-S392 VanDerWaalsContact CB-O 3.26Å; S389-S392 WeakPolarHBondContact CB-O 3.13Å; S389-S392 PolarHBondContact OG-N 2.59Å; S389-P393 WeakPolarHBondContact O-CA 3.5Å; S389-T395 PolarHBondContact N-O 2.68Å
390	S	76.3	Confident	77.6	Confident	67 Å²	67	55.5 Å²	55.5	47%	0.469	29%	0.292	S	S	.	.	S	Bend	trans	-75.8	-18	174.1	47.1	0	0	0	0	113.1	D23	D23-S390 VanDerWaalsContact O-CB 3.29Å; D23-S390 WeakPolarHBondContact O-CB 3.27Å; D23-S390 PolarHBondContact O-OG 3.33Å
391	V	78.7	Confident	77.1	Confident	110 Å²	110	54.1 Å²	54.1	67%	0.667	28%	0.283	S	S	*	.	S	Bend	trans	-97.5	-38.8	-179.1	-174.4	0	0	0	0	111.3	S389	S389-V391 VanDerWaalsContact C-N 3.27Å; S389-V391 PolarHBondContact OG-N 2.8Å; S389-V391 VanDerWaalsContact OG-N 3.15Å
392	S	78.9	Confident	76.3	Confident	44 Å²	44	47.9 Å²	47.9	31%	0.308	26%	0.259	S	S	.	.	S	Bend	trans	-125.7	88.5	177.5	-179.3	0	0	0	0	109.1	S389 D394 T395	S389-S392 VanDerWaalsContact CB-O 3.26Å; S389-S392 WeakPolarHBondContact CB-O 3.13Å; S389-S392 PolarHBondContact OG-N 2.59Å; S392-D394 PolarHBondContact O-N 3.2Å; S392-T395 WeakPolarHBondContact CB-OG1 3.42Å; S392-T395 WeakPolarHBondContact O-CB 2.97Å; S392-T395 PolarHBondContact O-N 2.72Å; S392-T395 PolarHBondContact OG-OG1 2.82Å
393	P	71.7	Confident	75.1	Confident	47 Å²	47	53.9 Å²	53.9	31%	0.305	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.1	-168.8	24	-34	0	0	0	114.5	F388 S389 T395	F388-P393 VanDerWaalsContact CD1-O 3.29Å; F388-P393 WeakPolarHBondContact CD1-O 3.09Å; S389-P393 WeakPolarHBondContact O-CA 3.5Å; P393-T395 VanDerWaalsContact C-N 3.3Å
394	D	70.7	Confident	74.9	Confident	153 Å²	153	52.7 Å²	52.7	82%	0.818	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.1	175.8	-59.2	-36.4	0	0	0	113.4	S392	S392-D394 PolarHBondContact O-N 3.2Å
395	T	78.8	Confident	74.3	Confident	65 Å²	65	55.3 Å²	55.3	40%	0.399	30%	0.299	S	S	.	.			trans	-104.7	129	-179.2	-54	0	0	0	0	110.5	S389 S392 P393	S389-T395 PolarHBondContact N-O 2.68Å; S392-T395 WeakPolarHBondContact CB-OG1 3.42Å; S392-T395 WeakPolarHBondContact O-CB 2.97Å; S392-T395 PolarHBondContact O-N 2.72Å; S392-T395 PolarHBondContact OG-OG1 2.82Å; P393-T395 VanDerWaalsContact C-N 3.3Å
396	L	79.2	Confident	73.6	Confident	50 Å²	50	58.4 Å²	58.4	26%	0.262	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.7	167	-69.5	176.5	0	0	0	109.5	C301 I311 A387 F388	C301-L396 HydrophobicContact CB-CD2 3.98Å; I311-L396 HydrophobicContact CD1-CD1 3.96Å; I311-L396 HydrophobicContact CG1-CD1 4.45Å; A387-L396 CarbonylContact O-C 3.54Å; A387-L396 WeakPolarHBondContact O-CA 3.16Å; F388-L396 HydrophobicContact CD1-CD2 3.76Å; F388-L396 HydrophobicContact CD2-CD2 4.34Å; F388-L396 HydrophobicContact CE1-CD2 3.79Å; F388-L396 HydrophobicContact CE2-CD2 4.38Å; F388-L396 HydrophobicContact CG-CD2 4.06Å; F388-L396 HydrophobicContact CZ-CD2 4.12Å
397	I	79.3	Confident	72.7	Confident	22 Å²	22	61.7 Å²	61.7	11%	0.113	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	123.1	167.1	-57.8	164.2	0	0	0	106.8	F20 C40 C386 A387	F20-I397 HydrophobicContact CE1-CG2 3.88Å; F20-I397 HydrophobicContact CZ-CB 4.48Å; F20-I397 HydrophobicContact CZ-CG2 3.99Å; C40-I397 HydrophobicContact CB-CD1 3.74Å; C40-I397 HydrophobicContact CB-CG2 4.01Å; C386-I397 VanDerWaalsContact CA-O 3.3Å; C386-I397 WeakPolarHBondContact CA-O 3.13Å; A387-I397 PolarHBondContact N-O 2.9Å; A387-I397 PolarHBondContact O-N 3.3Å
398	E	77.6	Confident	71.8	Confident	98 Å²	98	65.6 Å²	65.6	46%	0.458	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.7	173.4	62.7	-175.8	174.3	0	0	110.6
399	T	70.9	Confident	70.7	Confident	8 Å²	8	69.2 Å²	69.2	5%	0.049	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.6	165.6	54.4	0	0	0	0	108.5	F20 F27 I385	F20-T399 HydrophobicContact CE1-CG2 3.89Å; F20-T399 HydrophobicContact CE2-CG2 4.4Å; F20-T399 HydrophobicContact CZ-CG2 3.64Å; F27-T399 HydrophobicContact CB-CG2 4.35Å; F27-T399 HydrophobicContact CD1-CG2 3.81Å; F27-T399 HydrophobicContact CD2-CG2 4.03Å; F27-T399 HydrophobicContact CE1-CG2 4.02Å; F27-T399 HydrophobicContact CE2-CG2 4.23Å; F27-T399 HydrophobicContact CG-CG2 3.81Å; F27-T399 HydrophobicContact CZ-CG2 4.21Å; I385-T399 WeakPolarHBondContact CG1-OG1 3.4Å; I385-T399 PolarHBondContact N-O 2.82Å; I385-T399 PolarHBondContact O-N 2.79Å
400	F	69.5	Low	69.7	Low	93 Å²	93	73.7 Å²	73.7	41%	0.408	40%	0.399	S	S	.	.			trans	-113	165.5	177.5	44.7	-86.9	0	0	0	109.6	I402	F400-I402 HydrophobicContact CD2-CB 4.32Å; F400-I402 HydrophobicContact CD2-CG1 3.76Å; F400-I402 HydrophobicContact CE2-CB 4.19Å; F400-I402 HydrophobicContact CE2-CD1 4.49Å; F400-I402 HydrophobicContact CE2-CG1 3.63Å; F400-I402 HydrophobicContact CE2-CG2 4.26Å; F400-I402 HydrophobicContact CZ-CG1 4.4Å; F400-I402 PolarHBondContact O-N 2.73Å; F400-I402 VanDerWaalsContact O-N 3.1Å
401	N	55.8	Low	69.2	Low	8 Å²	8	74.2 Å²	74.2	4%	0.043	39%	0.393	C	S	.	.			trans	-68	105.7	161.8	-154.6	25.2	0	0	0	107.1	V5 D9 S10 I15 F382 E403	V5-N401 WeakPolarHBondContact CG1-ND2 3.13Å; D9-N401 PolarHBondContact O-ND2 2.78Å; S10-N401 WeakPolarHBondContact CA-ND2 3.49Å; I15-N401 WeakPolarHBondContact CB-OD1 3.45Å; I15-N401 WeakPolarHBondContact CD1-OD1 2.98Å; I15-N401 WeakPolarHBondContact CG2-OD1 3.3Å; F382-N401 HydrophobicContact CB-CB 4.44Å; N401-E403 PolarHBondContact O-N 2.88Å
402	I	47.1	Very low	68.4	Low	75 Å²	75	71.3 Å²	71.3	39%	0.385	37%	0.37	S	S	.	.			trans	-76.2	118.3	178.3	-48.6	179.2	0	0	0	106.1	S13 I15 F400	S13-I402 WeakPolarHBondContact CB-O 3.45Å; I15-I402 WeakPolarHBondContact CD1-O 3.49Å; F400-I402 HydrophobicContact CD2-CB 4.32Å; F400-I402 HydrophobicContact CD2-CG1 3.76Å; F400-I402 HydrophobicContact CE2-CB 4.19Å; F400-I402 HydrophobicContact CE2-CD1 4.49Å; F400-I402 HydrophobicContact CE2-CG1 3.63Å; F400-I402 HydrophobicContact CE2-CG2 4.26Å; F400-I402 HydrophobicContact CZ-CG1 4.4Å; F400-I402 PolarHBondContact O-N 2.73Å; F400-I402 VanDerWaalsContact O-N 3.1Å
403	E	41.8	Very low	67.5	Low	192 Å²	192	73.7 Å²	73.7	90%	0.897	38%	0.376	S	S	*	.			trans	-67.2	0	169.9	-79.5	-171.6	163	0	0	111.9	F382 N401	F382-E403 HydrophobicContact CE2-CG 4.42Å; F382-E403 HydrophobicContact CZ-CG 4.33Å; F382-E403 WeakPolarHBondContact CZ-OE1 3.47Å; N401-E403 PolarHBondContact O-N 2.88Å

Retrieved 403 of 403 residues in 195.8 ms (Link to these results)

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