A0A077ZIW8_TRITR Loading...

aspartyl aminopeptidase

AlphaFold DB , UniProt , Accession A0A077ZIW8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 323 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.6	Very low	68.4	Low	243 Å²	243	122.5 Å²	122.5	100%	1.197	70%	0.7	S	S	*	*				0	118	0	-67	177.9	-166.4	0	0	107.1	N3	M1-N3 PolarHBondContact O-N 3.47Å
2	A	40.9	Very low	70.4	Confident	93 Å²	93	118.9 Å²	118.9	77%	0.769	67%	0.667	S	S	*	*			trans	-61.5	135.2	174.1	0	0	0	0	0	108.5	K4	A2-K4 PolarHBondContact O-N 3.13Å
3	N	50	Low	72.3	Confident	165 Å²	165	113.7 Å²	113.7	88%	0.882	64%	0.643	S	S	*	*			trans	-69.8	61.9	-173.8	-148.1	14.7	0	0	0	111	M1 M5	M1-N3 PolarHBondContact O-N 3.47Å; N3-M5 PolarHBondContact O-N 2.73Å; N3-M5 VanDerWaalsContact O-N 3.13Å
4	K	60.7	Low	74	Confident	193 Å²	193	111.1 Å²	111.1	84%	0.839	62%	0.619	S	S	*	*			trans	-72.5	102	168.7	-84.9	-173.5	175.3	-177.6	0	106.3	A2 L6	A2-K4 PolarHBondContact O-N 3.13Å; K4-L6 PolarHBondContact O-N 2.74Å
5	M	69.5	Low	75.5	Confident	171 Å²	171	105.4 Å²	105.4	84%	0.842	59%	0.592	S	S	*	*			trans	-50.6	134	162.1	-74.9	177.2	67.3	0	0	107.9	N3	N3-M5 PolarHBondContact O-N 2.73Å; N3-M5 VanDerWaalsContact O-N 3.13Å
6	L	77.2	Confident	76.8	Confident	95 Å²	95	102.4 Å²	102.4	50%	0.497	57%	0.574	S	S	.	*			trans	-55.1	141	169.8	-73.2	169.8	0	0	0	108.7	K4 A8 D10 V11 Y14	K4-L6 PolarHBondContact O-N 2.74Å; L6-A8 PolarHBondContact O-N 2.65Å; L6-D10 HydrophobicContact CB-CB 4.25Å; L6-V11 HydrophobicContact CB-CG2 3.88Å; L6-Y14 HydrophobicContact CD1-CD2 4.46Å; L6-Y14 HydrophobicContact CD1-CE2 4.1Å
7	P	81	Confident	78	Confident	78 Å²	78	102.2 Å²	102.2	51%	0.506	57%	0.567	S	S	.	*			trans	-45.9	142.4	167.4	-26.6	32.3	0	0	0	111.1	A9 D10 V11	P7-A9 PolarHBondContact O-N 3.39Å; P7-A9 VanDerWaalsContact O-N 3.12Å; P7-D10 VanDerWaalsContact CD-OD2 3.24Å; P7-D10 WeakPolarHBondContact CD-OD2 3.29Å; P7-D10 WeakPolarHBondContact CG-OD2 3Å; P7-D10 WeakPolarHBondContact O-CB 3.19Å; P7-D10 PolarHBondContact O-N 3.21Å; P7-V11 PolarHBondContact O-N 3.36Å; P7-V11 VanDerWaalsContact O-N 3.16Å
8	A	77.6	Confident	79.1	Confident	86 Å²	86	97.1 Å²	97.1	71%	0.711	54%	0.538	S	S	*	.	H	α-helix	trans	-56.3	-33	-178.5	0	0	0	0	0	112.9	L6 D10 V11 R12	L6-A8 PolarHBondContact O-N 2.65Å; A8-D10 VanDerWaalsContact C-N 3.34Å; A8-D10 PolarHBondContact O-N 3.12Å; A8-V11 PolarHBondContact O-N 3Å; A8-R12 WeakPolarHBondContact O-CB 3.24Å; A8-R12 PolarHBondContact O-N 2.97Å
9	A	77.8	Confident	80.1	Confident	72 Å²	72	92.7 Å²	92.7	60%	0.595	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-39.1	174.7	0	0	0	0	0	112.7	P7 R12 S13	P7-A9 PolarHBondContact O-N 3.39Å; P7-A9 VanDerWaalsContact O-N 3.12Å; A9-R12 PolarHBondContact O-N 3.06Å; A9-S13 PolarHBondContact O-N 3.27Å
10	D	87	Confident	81	Confident	71 Å²	71	92.3 Å²	92.3	38%	0.38	51%	0.511	S	S	.	.	H	α-helix	trans	-70.8	-43.3	179.1	-62.7	-11.6	0	0	0	110.2	L6 P7 A8 R12 S13 Y14	L6-D10 HydrophobicContact CB-CB 4.25Å; P7-D10 VanDerWaalsContact CD-OD2 3.24Å; P7-D10 WeakPolarHBondContact CD-OD2 3.29Å; P7-D10 WeakPolarHBondContact CG-OD2 3Å; P7-D10 WeakPolarHBondContact O-CB 3.19Å; P7-D10 PolarHBondContact O-N 3.21Å; A8-D10 VanDerWaalsContact C-N 3.34Å; A8-D10 PolarHBondContact O-N 3.12Å; D10-R12 VanDerWaalsContact C-N 3.3Å; D10-R12 PolarHBondContact O-N 3.24Å; D10-S13 PolarHBondContact O-N 3.42Å; D10-Y14 WeakPolarHBondContact O-CD2 3.32Å; D10-Y14 PolarHBondContact O-N 2.83Å; D10-Y14 VanDerWaalsContact O-N 3.1Å
11	V	90	Very high	81.8	Confident	80 Å²	80	88.4 Å²	88.4	49%	0.485	49%	0.489	S	S	.	.	H	α-helix	trans	-56.9	-45.8	174.4	178.6	0	0	0	0	110.7	L6 P7 A8 Y14 A15	L6-V11 HydrophobicContact CB-CG2 3.88Å; P7-V11 PolarHBondContact O-N 3.36Å; P7-V11 VanDerWaalsContact O-N 3.16Å; A8-V11 PolarHBondContact O-N 3Å; V11-Y14 PolarHBondContact O-N 3.49Å; V11-A15 PolarHBondContact O-N 3.05Å; V11-A15 VanDerWaalsContact O-N 3.16Å
12	R	93	Very high	84.5	Confident	80 Å²	80	76.9 Å²	76.9	30%	0.302	43%	0.432	S	S	.	.	H	α-helix	trans	-64.5	-41.4	178.8	-178.5	58	-167.6	-117.3	2.6	112.1	A8 A9 D10 Y14 A15 D16 E243	A8-R12 WeakPolarHBondContact O-CB 3.24Å; A8-R12 PolarHBondContact O-N 2.97Å; A9-R12 PolarHBondContact O-N 3.06Å; D10-R12 VanDerWaalsContact C-N 3.3Å; D10-R12 PolarHBondContact O-N 3.24Å; R12-Y14 PolarHBondContact O-N 2.9Å; R12-A15 WeakPolarHBondContact O-CB 3.24Å; R12-A15 PolarHBondContact O-N 3.22Å; R12-A15 VanDerWaalsContact O-N 3.11Å; R12-D16 WeakPolarHBondContact CG-OD2 3.48Å; R12-D16 IonicContact CZ-OD1 3.9Å; R12-D16 IonicContact CZ-OD2 2.83Å; R12-D16 VanDerWaalsContact NE-CG 3.28Å; R12-D16 IonicContact NE-OD1 2.63Å; R12-D16 PolarHBondContact NE-OD1 3.24Å; R12-D16 IonicContact NE-OD2 3.87Å; R12-D16 PolarHBondContact NE-OD2 3.31Å; R12-D16 VanDerWaalsContact NE-OD2 3.08Å; R12-D16 IonicContact NH2-OD1 3.24Å; R12-D16 PolarHBondContact NH2-OD1 2.69Å; R12-D16 PolarHBondContact O-N 3.34Å; R12-E243 IonicContact CZ-OE2 3.35Å; R12-E243 IonicContact NH1-OE2 3.77Å; R12-E243 PolarHBondContact NH1-OE2 3.23Å
13	S	94.9	Very high	87.1	Confident	51 Å²	51	73.6 Å²	73.6	36%	0.357	40%	0.401	S	S	.	.	H	α-helix	trans	-60	-42.9	177.6	-178.2	0	0	0	0	112.7	A9 D10 A15 D16 H17	A9-S13 PolarHBondContact O-N 3.27Å; D10-S13 PolarHBondContact O-N 3.42Å; S13-A15 VanDerWaalsContact C-N 3.33Å; S13-A15 PolarHBondContact O-N 3.19Å; S13-D16 PolarHBondContact O-N 3.04Å; S13-H17 WeakPolarHBondContact O-CB 3.29Å; S13-H17 VanDerWaalsContact O-CG 3.3Å; S13-H17 PolarHBondContact O-N 3.12Å; S13-H17 PolarHBondContact O-ND1 2.75Å; S13-H17 PolarHBondContact OG-CE1 2.91Å
14	Y	95.6	Very high	89.4	Confident	78 Å²	78	71.6 Å²	71.6	31%	0.306	39%	0.385	S	S	.	.	H	α-helix	trans	-62.5	-39.8	173.8	-75.7	-67.1	0	0	0	112.4	L6 D10 V11 R12 F18 Y258 T262 E266	L6-Y14 HydrophobicContact CD1-CD2 4.46Å; L6-Y14 HydrophobicContact CD1-CE2 4.1Å; D10-Y14 WeakPolarHBondContact O-CD2 3.32Å; D10-Y14 PolarHBondContact O-N 2.83Å; D10-Y14 VanDerWaalsContact O-N 3.1Å; V11-Y14 PolarHBondContact O-N 3.49Å; R12-Y14 PolarHBondContact O-N 2.9Å; Y14-F18 WeakPolarHBondContact O-CB 3.05Å; Y14-F18 PolarHBondContact O-N 3.11Å; Y14-Y258 PolarHBondContact O-OH 2.8Å; Y14-T262 HydrophobicContact CD1-CG2 4.18Å; Y14-T262 HydrophobicContact CE1-CG2 3.73Å; Y14-E266 VanDerWaalsContact CE1-OE1 3.23Å; Y14-E266 WeakPolarHBondContact CE1-OE1 3.18Å; Y14-E266 VanDerWaalsContact OH-CD 3.27Å; Y14-E266 PolarHBondContact OH-OE1 3.08Å; Y14-E266 PolarHBondContact OH-OE2 3.45Å
15	A	96.3	Very high	91	Very high	25 Å²	25	62.4 Å²	62.4	21%	0.207	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-43.8	178.4	0	0	0	0	0	112	V11 R12 S13 F18 V19 I238 V246	V11-A15 PolarHBondContact O-N 3.05Å; V11-A15 VanDerWaalsContact O-N 3.16Å; R12-A15 WeakPolarHBondContact O-CB 3.24Å; R12-A15 PolarHBondContact O-N 3.22Å; R12-A15 VanDerWaalsContact O-N 3.11Å; S13-A15 VanDerWaalsContact C-N 3.33Å; S13-A15 PolarHBondContact O-N 3.19Å; A15-F18 WeakPolarHBondContact O-CB 3.25Å; A15-F18 PolarHBondContact O-N 3.12Å; A15-V19 WeakPolarHBondContact O-CG2 3.4Å; A15-V19 PolarHBondContact O-N 2.93Å; A15-I238 HydrophobicContact CB-CD1 3.82Å; A15-V246 HydrophobicContact CB-CG2 4.46Å
16	D	96.9	Very high	92.2	Very high	57 Å²	57	54.9 Å²	54.9	31%	0.305	31%	0.309	S	S	.	.	H	α-helix	trans	-63.9	-44.7	177.5	-70.2	-34.7	0	0	0	111.3	R12 S13 F18 V19 D20	R12-D16 WeakPolarHBondContact CG-OD2 3.48Å; R12-D16 IonicContact CZ-OD1 3.9Å; R12-D16 IonicContact CZ-OD2 2.83Å; R12-D16 VanDerWaalsContact NE-CG 3.28Å; R12-D16 IonicContact NE-OD1 2.63Å; R12-D16 PolarHBondContact NE-OD1 3.24Å; R12-D16 IonicContact NE-OD2 3.87Å; R12-D16 PolarHBondContact NE-OD2 3.31Å; R12-D16 VanDerWaalsContact NE-OD2 3.08Å; R12-D16 IonicContact NH2-OD1 3.24Å; R12-D16 PolarHBondContact NH2-OD1 2.69Å; R12-D16 PolarHBondContact O-N 3.34Å; S13-D16 PolarHBondContact O-N 3.04Å; D16-F18 VanDerWaalsContact C-N 3.29Å; D16-F18 PolarHBondContact O-N 3.5Å; D16-V19 WeakPolarHBondContact O-CB 3.45Å; D16-V19 PolarHBondContact O-N 2.81Å; D16-V19 VanDerWaalsContact O-N 3.16Å; D16-D20 PolarHBondContact O-N 3.26Å
17	H	97.1	Very high	93	Very high	100 Å²	100	50.7 Å²	50.7	46%	0.463	29%	0.287	S	S	.	.	H	α-helix	trans	-64.4	-33.5	174.9	-70.2	155	0	0	0	112.8	S13 D20 F21 Y258	S13-H17 WeakPolarHBondContact O-CB 3.29Å; S13-H17 VanDerWaalsContact O-CG 3.3Å; S13-H17 PolarHBondContact O-N 3.12Å; S13-H17 PolarHBondContact O-ND1 2.75Å; S13-H17 PolarHBondContact OG-CE1 2.91Å; H17-D20 PolarHBondContact O-N 3.1Å; H17-F21 WeakPolarHBondContact O-CB 3.4Å; H17-F21 PolarHBondContact O-N 3.16Å; H17-Y258 HydrophobicContact CB-CE2 4.33Å; H17-Y258 WeakPolarHBondContact CB-OH 3.34Å
18	F	97.8	Very high	93.5	Very high	9 Å²	9	47.2 Å²	47.2	4%	0.039	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-40.8	172.8	177.1	-129.2	0	0	0	111.8	Y14 A15 D16 D20 F21 L22 V246 L251 L255 Y258	Y14-F18 WeakPolarHBondContact O-CB 3.05Å; Y14-F18 PolarHBondContact O-N 3.11Å; A15-F18 WeakPolarHBondContact O-CB 3.25Å; A15-F18 PolarHBondContact O-N 3.12Å; D16-F18 VanDerWaalsContact C-N 3.29Å; D16-F18 PolarHBondContact O-N 3.5Å; F18-D20 VanDerWaalsContact C-N 3.33Å; F18-D20 PolarHBondContact O-N 3.21Å; F18-F21 HydrophobicContact CD2-CD1 4.43Å; F18-F21 HydrophobicContact CE2-CD1 4.46Å; F18-F21 WeakPolarHBondContact O-CB 3.5Å; F18-F21 PolarHBondContact O-N 2.97Å; F18-L22 HydrophobicContact CD1-CD1 4.19Å; F18-L22 HydrophobicContact CD2-CG 4.16Å; F18-L22 HydrophobicContact CE1-CD1 3.66Å; F18-L22 HydrophobicContact CE1-CG 4.18Å; F18-L22 HydrophobicContact CE2-CD1 4.08Å; F18-L22 HydrophobicContact CE2-CD2 3.75Å; F18-L22 HydrophobicContact CE2-CG 3.65Å; F18-L22 HydrophobicContact CZ-CD1 3.6Å; F18-L22 HydrophobicContact CZ-CD2 3.72Å; F18-L22 HydrophobicContact CZ-CG 3.67Å; F18-L22 WeakPolarHBondContact O-CG 3.45Å; F18-L22 PolarHBondContact O-N 3.41Å; F18-V246 HydrophobicContact CD1-CG1 4.05Å; F18-V246 HydrophobicContact CD1-CG2 4.3Å; F18-V246 HydrophobicContact CE1-CG1 3.99Å; F18-L251 HydrophobicContact CE1-CD2 3.65Å; F18-L251 HydrophobicContact CZ-CD2 3.76Å; F18-L255 HydrophobicContact CD1-CD1 4.07Å; F18-L255 HydrophobicContact CE1-CB 4.29Å; F18-L255 HydrophobicContact CE1-CD1 3.67Å; F18-L255 VanDerWaalsContact CE2-CA 3.49Å; F18-L255 HydrophobicContact CE2-CB 4.21Å; F18-L255 HydrophobicContact CE2-CD1 4.22Å; F18-L255 HydrophobicContact CG-CD1 4.49Å; F18-L255 VanDerWaalsContact CZ-CA 3.46Å; F18-L255 HydrophobicContact CZ-CB 3.65Å; F18-L255 HydrophobicContact CZ-CD1 3.75Å; F18-L255 HydrophobicContact CZ-CG 4.3Å; F18-Y258 HydrophobicContact CB-CD1 3.73Å; F18-Y258 HydrophobicContact CB-CE1 3.65Å; F18-Y258 HydrophobicContact CB-CG 4.24Å; F18-Y258 AromaticContact CD2-CD1 3.61Å; F18-Y258 HydrophobicContact CD2-CD1 3.61Å; F18-Y258 HydrophobicContact CD2-CD2 4.26Å; F18-Y258 HydrophobicContact CD2-CE1 4.4Å; F18-Y258 AromaticContact CD2-CG 3.54Å; F18-Y258 HydrophobicContact CD2-CG 3.54Å; F18-Y258 HydrophobicContact CE2-CG 4.38Å; F18-Y258 AromaticContact CG-CD1 3.93Å; F18-Y258 HydrophobicContact CG-CD1 3.93Å; F18-Y258 HydrophobicContact CG-CE1 4.36Å; F18-Y258 HydrophobicContact CG-CG 4.28Å
19	V	98	Very high	94.3	Very high	14 Å²	14	43.3 Å²	43.3	9%	0.085	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-43.8	173.2	165.2	0	0	0	0	111.1	A15 D16 F21 L22 N23 A236 I238 V246	A15-V19 WeakPolarHBondContact O-CG2 3.4Å; A15-V19 PolarHBondContact O-N 2.93Å; D16-V19 WeakPolarHBondContact O-CB 3.45Å; D16-V19 PolarHBondContact O-N 2.81Å; D16-V19 VanDerWaalsContact O-N 3.16Å; V19-F21 VanDerWaalsContact C-N 3.32Å; V19-F21 PolarHBondContact O-N 3.01Å; V19-L22 PolarHBondContact O-N 2.82Å; V19-N23 WeakPolarHBondContact O-CB 3.32Å; V19-N23 PolarHBondContact O-N 3.05Å; V19-N23 PolarHBondContact O-ND2 2.83Å; V19-N23 VanDerWaalsContact O-ND2 3.11Å; V19-A236 HydrophobicContact CG1-CB 4.24Å; V19-A236 WeakPolarHBondContact CG1-O 3.24Å; V19-I238 HydrophobicContact CG2-CD1 3.63Å; V19-I238 HydrophobicContact CG2-CG1 4.2Å; V19-V246 HydrophobicContact CG2-CG1 3.92Å
20	D	97.7	Very high	95.2	Very high	84 Å²	84	40.9 Å²	40.9	45%	0.449	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-41.4	174.1	-77.1	-20.5	0	0	0	112.1	D16 H17 F18 N23 K24	D16-D20 PolarHBondContact O-N 3.26Å; H17-D20 PolarHBondContact O-N 3.1Å; F18-D20 VanDerWaalsContact C-N 3.33Å; F18-D20 PolarHBondContact O-N 3.21Å; D20-N23 PolarHBondContact O-N 2.9Å; D20-K24 WeakPolarHBondContact O-CG 3.18Å; D20-K24 PolarHBondContact O-N 2.91Å; D20-K24 VanDerWaalsContact O-N 3.17Å
21	F	97.9	Very high	95.7	Very high	12 Å²	12	37.5 Å²	37.5	5%	0.053	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-48	175.3	180	-96.8	0	0	0	111.7	H17 F18 V19 N23 K24 A25 A34 L254 T257 Y258	H17-F21 WeakPolarHBondContact O-CB 3.4Å; H17-F21 PolarHBondContact O-N 3.16Å; F18-F21 HydrophobicContact CD2-CD1 4.43Å; F18-F21 HydrophobicContact CE2-CD1 4.46Å; F18-F21 WeakPolarHBondContact O-CB 3.5Å; F18-F21 PolarHBondContact O-N 2.97Å; V19-F21 VanDerWaalsContact C-N 3.32Å; V19-F21 PolarHBondContact O-N 3.01Å; F21-N23 VanDerWaalsContact C-N 3.29Å; F21-N23 PolarHBondContact O-N 3.48Å; F21-K24 PolarHBondContact O-N 2.9Å; F21-K24 VanDerWaalsContact O-N 3.14Å; F21-A25 HydrophobicContact CD1-CB 4.31Å; F21-A25 HydrophobicContact CE1-CB 4.04Å; F21-A25 HydrophobicContact CZ-CB 4.23Å; F21-A25 WeakPolarHBondContact O-CB 3.5Å; F21-A25 PolarHBondContact O-N 2.78Å; F21-A34 HydrophobicContact CD2-CB 4.03Å; F21-A34 HydrophobicContact CE2-CB 3.83Å; F21-L254 HydrophobicContact CE1-CB 4.05Å; F21-L254 HydrophobicContact CE1-CD2 4.15Å; F21-T257 HydrophobicContact CZ-CG2 4.22Å; F21-Y258 HydrophobicContact CB-CD2 3.74Å; F21-Y258 HydrophobicContact CB-CE2 4.25Å; F21-Y258 HydrophobicContact CD1-CD2 4.23Å; F21-Y258 HydrophobicContact CD1-CG 4.44Å; F21-Y258 HydrophobicContact CD2-CD2 4.23Å; F21-Y258 AromaticContact CG-CD2 3.82Å; F21-Y258 HydrophobicContact CG-CD2 3.82Å; F21-Y258 HydrophobicContact CG-CG 4.46Å
22	L	96.8	Very high	96	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-40	178.4	-75.2	176	0	0	0	112.7	F18 V19 K24 A25 A236 V246 R250 L251 L254	F18-L22 HydrophobicContact CD1-CD1 4.19Å; F18-L22 HydrophobicContact CD2-CG 4.16Å; F18-L22 HydrophobicContact CE1-CD1 3.66Å; F18-L22 HydrophobicContact CE1-CG 4.18Å; F18-L22 HydrophobicContact CE2-CD1 4.08Å; F18-L22 HydrophobicContact CE2-CD2 3.75Å; F18-L22 HydrophobicContact CE2-CG 3.65Å; F18-L22 HydrophobicContact CZ-CD1 3.6Å; F18-L22 HydrophobicContact CZ-CD2 3.72Å; F18-L22 HydrophobicContact CZ-CG 3.67Å; F18-L22 WeakPolarHBondContact O-CG 3.45Å; F18-L22 PolarHBondContact O-N 3.41Å; V19-L22 PolarHBondContact O-N 2.82Å; L22-K24 VanDerWaalsContact C-N 3.31Å; L22-A25 PolarHBondContact O-N 2.99Å; L22-A236 HydrophobicContact CB-CB 3.78Å; L22-A236 HydrophobicContact CD1-CB 3.8Å; L22-A236 HydrophobicContact CG-CB 4.49Å; L22-V246 HydrophobicContact CD1-CG1 4.07Å; L22-R250 PolarHBondContact O-NH2 3.42Å; L22-L251 HydrophobicContact CD1-CD2 3.7Å; L22-L254 HydrophobicContact CD2-CB 3.75Å; L22-L254 HydrophobicContact CD2-CD1 3.93Å; L22-L254 HydrophobicContact CD2-CG 4.5Å
23	N	97.1	Very high	96.2	Very high	24 Å²	24	34.7 Å²	34.7	13%	0.128	17%	0.174	C	C	.	.	H	α-helix	trans	-71.7	-24.6	179.9	-76.1	-38.7	0	0	0	112.9	V19 D20 F21 R235 A236	V19-N23 WeakPolarHBondContact O-CB 3.32Å; V19-N23 PolarHBondContact O-N 3.05Å; V19-N23 PolarHBondContact O-ND2 2.83Å; V19-N23 VanDerWaalsContact O-ND2 3.11Å; D20-N23 PolarHBondContact O-N 2.9Å; F21-N23 VanDerWaalsContact C-N 3.29Å; F21-N23 PolarHBondContact O-N 3.48Å; N23-R235 WeakPolarHBondContact OD1-CA 3.13Å; N23-R235 WeakPolarHBondContact OD1-CB 3.22Å; N23-A236 PolarHBondContact ND2-O 3.04Å; N23-A236 VanDerWaalsContact ND2-O 3.14Å; N23-A236 PolarHBondContact OD1-N 2.84Å
24	K	96.5	Very high	96.3	Very high	124 Å²	124	32.5 Å²	32.5	54%	0.539	16%	0.159	S	C	.	.	H	α-helix	trans	-84.2	-41.2	170.9	-68.4	171.2	-175.8	174.6	0	111.7	D20 F21 L22 V26 H30 A34	D20-K24 WeakPolarHBondContact O-CG 3.18Å; D20-K24 PolarHBondContact O-N 2.91Å; D20-K24 VanDerWaalsContact O-N 3.17Å; F21-K24 PolarHBondContact O-N 2.9Å; F21-K24 VanDerWaalsContact O-N 3.14Å; L22-K24 VanDerWaalsContact C-N 3.31Å; K24-V26 PolarHBondContact O-N 3.38Å; K24-H30 VanDerWaalsContact O-CB 3.23Å; K24-H30 WeakPolarHBondContact O-CB 3.41Å; K24-A34 HydrophobicContact CB-CB 4.35Å
25	A	96.1	Very high	96.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.			trans	-80.2	57.1	-174.1	0	0	0	0	0	112.9	F21 L22 S27 A31 R250 L254	F21-A25 HydrophobicContact CD1-CB 4.31Å; F21-A25 HydrophobicContact CE1-CB 4.04Å; F21-A25 HydrophobicContact CZ-CB 4.23Å; F21-A25 WeakPolarHBondContact O-CB 3.5Å; F21-A25 PolarHBondContact O-N 2.78Å; L22-A25 PolarHBondContact O-N 2.99Å; A25-S27 VanDerWaalsContact C-N 3.35Å; A25-A31 HydrophobicContact CB-CB 3.75Å; A25-R250 WeakPolarHBondContact O-CD 3.49Å; A25-R250 PolarHBondContact O-NE 2.92Å; A25-L254 HydrophobicContact CB-CD1 3.65Å; A25-L254 HydrophobicContact CB-CD2 4.42Å; A25-L254 WeakPolarHBondContact O-CD1 3.36Å
26	V	94.4	Very high	96.5	Very high	13 Å²	13	32 Å²	32	8%	0.079	15%	0.152	C	C	.	.	S	Bend	trans	-73.7	-23.7	-177.3	-65.4	0	0	0	0	113.9	K24 H30 C127 H144	K24-V26 PolarHBondContact O-N 3.38Å; V26-H30 HydrophobicContact CG2-CB 4.01Å; V26-C127 HydrophobicContact CB-CB 4.24Å; V26-C127 HydrophobicContact CG2-CB 3.54Å; V26-C127 PolarHBondContact O-SG 3.28Å; V26-H144 HydrophobicContact CG2-CB 4.46Å
27	S	92.6	Very high	96.5	Very high	7 Å²	7	33.2 Å²	33.2	5%	0.049	16%	0.155	C	C	.	.	S	Bend	trans	-139.6	170.2	170.9	81.8	0	0	0	0	110.6	A25 M29 H30 A31 Y229	A25-S27 VanDerWaalsContact C-N 3.35Å; S27-M29 PolarHBondContact O-N 3.21Å; S27-M29 PolarHBondContact OG-N 3.21Å; S27-H30 CarbonylContact O-C 3.33Å; S27-H30 PolarHBondContact O-N 3.23Å; S27-H30 PolarHBondContact OG-N 3.22Å; S27-H30 PolarHBondContact OG-ND1 3.39Å; S27-A31 PolarHBondContact O-N 2.93Å; S27-Y229 VanDerWaalsContact CB-CD2 3.42Å
28	P	92.2	Very high	96.6	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.032	15%	0.149	C	C	.	.	H	α-helix	trans	-54.6	-40.7	176.3	-31.8	41.6	0	0	0	113.3	H30 A31 V32 T68 L92 K93 P94	P28-H30 VanDerWaalsContact C-N 3.31Å; P28-H30 PolarHBondContact O-N 3.42Å; P28-A31 WeakPolarHBondContact O-CB 3.45Å; P28-A31 PolarHBondContact O-N 3.42Å; P28-V32 WeakPolarHBondContact O-CG2 3.33Å; P28-V32 PolarHBondContact O-N 3.23Å; P28-T68 HydrophobicContact CB-CG2 4.17Å; P28-L92 HydrophobicContact CB-CB 3.86Å; P28-L92 HydrophobicContact CB-CD1 4.42Å; P28-L92 HydrophobicContact CG-CB 4.19Å; P28-K93 WeakPolarHBondContact CD-O 3.07Å; P28-K93 WeakPolarHBondContact CG-O 3.49Å; P28-P94 HydrophobicContact CG-CB 3.89Å; P28-P94 HydrophobicContact CG-CG 3.91Å
29	M	94.1	Very high	96.6	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.015	15%	0.147	C	C	.	.	H	α-helix	trans	-65.3	-38.4	178.5	-54.9	77.8	147.3	0	0	112	S27 K33 G67 T68 R129 L142 E227 Y229	S27-M29 PolarHBondContact O-N 3.21Å; S27-M29 PolarHBondContact OG-N 3.21Å; M29-K33 WeakPolarHBondContact O-CB 3.19Å; M29-K33 PolarHBondContact O-N 3.39Å; M29-G67 WeakPolarHBondContact CA-O 3.34Å; M29-T68 HydrophobicContact CE-CG2 4.23Å; M29-T68 HydrophobicContact CG-CG2 3.72Å; M29-T68 HydrophobicContact SD-CG2 3.82Å; M29-R129 HydrophobicContact CE-CB 4.4Å; M29-R129 HydrophobicContact CE-CG 3.72Å; M29-L142 HydrophobicContact CB-CD1 4.16Å; M29-L142 HydrophobicContact CB-CD2 3.49Å; M29-L142 VanDerWaalsContact CB-CD2 3.49Å; M29-L142 HydrophobicContact CB-CG 4.49Å; M29-L142 HydrophobicContact CG-CD2 4.05Å; M29-E227 HydrophobicContact CE-CB 4.02Å; M29-E227 HydrophobicContact CE-CG 3.69Å; M29-E227 WeakPolarHBondContact CE-OE2 3.38Å; M29-Y229 HydrophobicContact CE-CE2 3.65Å; M29-Y229 VanDerWaalsContact CE-OH 3.29Å; M29-Y229 WeakPolarHBondContact CE-OH 3.26Å; M29-Y229 HydrophobicContact SD-CE2 3.57Å; M29-Y229 VanDerWaalsContact SD-CE2 3.57Å
30	H	96.9	Very high	96.6	Very high	21 Å²	21	33.2 Å²	33.2	10%	0.097	16%	0.162	C	C	.	.	H	α-helix	trans	-72.7	-33	176.1	-65.8	84.3	0	0	0	111.8	K24 V26 S27 P28 K33 A34 G128 V143	K24-H30 VanDerWaalsContact O-CB 3.23Å; K24-H30 WeakPolarHBondContact O-CB 3.41Å; V26-H30 HydrophobicContact CG2-CB 4.01Å; S27-H30 CarbonylContact O-C 3.33Å; S27-H30 PolarHBondContact O-N 3.23Å; S27-H30 PolarHBondContact OG-N 3.22Å; S27-H30 PolarHBondContact OG-ND1 3.39Å; P28-H30 VanDerWaalsContact C-N 3.31Å; P28-H30 PolarHBondContact O-N 3.42Å; H30-K33 PolarHBondContact O-N 2.61Å; H30-A34 WeakPolarHBondContact O-CB 3.23Å; H30-A34 PolarHBondContact O-N 3.28Å; H30-G128 PolarHBondContact CE1-O 3.12Å; H30-V143 PolarHBondContact CE1-O 3.47Å
31	A	97	Very high	96.6	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-47.3	172.4	0	0	0	0	0	111.3	A25 S27 P28 A34 C35 L92 L254	A25-A31 HydrophobicContact CB-CB 3.75Å; S27-A31 PolarHBondContact O-N 2.93Å; P28-A31 WeakPolarHBondContact O-CB 3.45Å; P28-A31 PolarHBondContact O-N 3.42Å; A31-A34 PolarHBondContact O-N 3.2Å; A31-C35 PolarHBondContact O-N 3.21Å; A31-C35 PolarHBondContact O-SG 3.43Å; A31-L92 HydrophobicContact CB-CD1 4.38Å; A31-L92 HydrophobicContact CB-CD2 3.55Å; A31-L254 HydrophobicContact CB-CD2 3.93Å
32	V	96.5	Very high	96.5	Very high	6 Å²	6	35.7 Å²	35.7	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-42.8	173.9	170.3	0	0	0	0	111	P28 A34 C35 R36 T64 G67 L70 L92	P28-V32 WeakPolarHBondContact O-CG2 3.33Å; P28-V32 PolarHBondContact O-N 3.23Å; V32-A34 PolarHBondContact O-N 2.98Å; V32-C35 PolarHBondContact O-N 2.98Å; V32-R36 VanDerWaalsContact O-CB 3.25Å; V32-R36 WeakPolarHBondContact O-CB 3.49Å; V32-R36 PolarHBondContact O-N 3.1Å; V32-T64 HydrophobicContact CG1-CG2 3.85Å; V32-G67 WeakPolarHBondContact CB-O 3.48Å; V32-L70 HydrophobicContact CG1-CB 4.36Å; V32-L70 HydrophobicContact CG1-CD1 4.29Å; V32-L70 HydrophobicContact CG2-CB 4.45Å; V32-L92 HydrophobicContact CG2-CD1 3.59Å
33	K	97.3	Very high	96.6	Very high	95 Å²	95	38.3 Å²	38.3	41%	0.413	22%	0.216	S	C	.	.	H	α-helix	trans	-57.7	-48	174.7	176.7	176	167.1	-174.3	0	111.5	M29 H30 C35 R36 E37 L142	M29-K33 WeakPolarHBondContact O-CB 3.19Å; M29-K33 PolarHBondContact O-N 3.39Å; H30-K33 PolarHBondContact O-N 2.61Å; K33-C35 PolarHBondContact O-N 3.16Å; K33-R36 WeakPolarHBondContact O-CB 3.26Å; K33-R36 PolarHBondContact O-N 3.18Å; K33-E37 WeakPolarHBondContact CE-OE1 3.32Å; K33-E37 IonicContact NZ-OE1 2.89Å; K33-E37 WeakPolarHBondContact O-CG 3.15Å; K33-E37 PolarHBondContact O-N 3.4Å; K33-L142 HydrophobicContact CB-CD1 3.99Å; K33-L142 HydrophobicContact CD-CD1 3.78Å; K33-L142 HydrophobicContact CG-CD1 4.45Å
34	A	97.6	Very high	96.6	Very high	5 Å²	5	37.6 Å²	37.6	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-43.6	177.7	0	0	0	0	0	111.8	F21 K24 H30 A31 V32 E37 S38	F21-A34 HydrophobicContact CD2-CB 4.03Å; F21-A34 HydrophobicContact CE2-CB 3.83Å; K24-A34 HydrophobicContact CB-CB 4.35Å; H30-A34 WeakPolarHBondContact O-CB 3.23Å; H30-A34 PolarHBondContact O-N 3.28Å; A31-A34 PolarHBondContact O-N 3.2Å; V32-A34 PolarHBondContact O-N 2.98Å; A34-E37 PolarHBondContact O-N 2.83Å; A34-S38 PolarHBondContact O-N 3.45Å; A34-S38 PolarHBondContact O-OG 3.38Å
35	C	98.1	Very high	96.6	Very high	2 Å²	2	37 Å²	37	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-61.8	-44.7	175.6	-64.2	0	0	0	0	111.8	A31 V32 K33 S38 L39 L70 L261	A31-C35 PolarHBondContact O-N 3.21Å; A31-C35 PolarHBondContact O-SG 3.43Å; V32-C35 PolarHBondContact O-N 2.98Å; K33-C35 PolarHBondContact O-N 3.16Å; C35-S38 PolarHBondContact O-N 3.43Å; C35-L39 WeakPolarHBondContact O-CB 3.32Å; C35-L39 WeakPolarHBondContact O-CD1 3.28Å; C35-L39 VanDerWaalsContact O-CG 3.3Å; C35-L39 WeakPolarHBondContact O-CG 3.42Å; C35-L39 PolarHBondContact O-N 3.48Å; C35-L70 HydrophobicContact CB-CD1 3.99Å; C35-L261 HydrophobicContact CB-CD2 3.81Å
36	R	97.8	Very high	96.7	Very high	91 Å²	91	39.9 Å²	39.9	34%	0.343	23%	0.225	S	C	.	.	H	α-helix	trans	-58.7	-47.5	176.5	170.5	173.1	-175.8	-80.3	-1.1	111.3	V32 K33 S38 L39 I40 E46 F62 L70	V32-R36 VanDerWaalsContact O-CB 3.25Å; V32-R36 WeakPolarHBondContact O-CB 3.49Å; V32-R36 PolarHBondContact O-N 3.1Å; K33-R36 WeakPolarHBondContact O-CB 3.26Å; K33-R36 PolarHBondContact O-N 3.18Å; R36-S38 PolarHBondContact O-N 3.49Å; R36-L39 PolarHBondContact O-N 2.94Å; R36-I40 HydrophobicContact CG-CD1 3.75Å; R36-I40 HydrophobicContact CG-CG1 4.44Å; R36-I40 WeakPolarHBondContact O-CB 3.47Å; R36-I40 VanDerWaalsContact O-CG1 3.28Å; R36-I40 WeakPolarHBondContact O-CG1 3.48Å; R36-I40 PolarHBondContact O-N 2.82Å; R36-E46 WeakPolarHBondContact CD-OE1 3.05Å; R36-E46 IonicContact CZ-OE1 3.96Å; R36-E46 IonicContact CZ-OE2 2.86Å; R36-E46 IonicContact NE-OE1 3.18Å; R36-E46 PolarHBondContact NE-OE1 3.33Å; R36-E46 IonicContact NE-OE2 2.72Å; R36-E46 PolarHBondContact NE-OE2 2.79Å; R36-E46 IonicContact NH2-OE1 3.97Å; R36-E46 IonicContact NH2-OE2 3.95Å; R36-E46 PolarHBondContact NH2-OE2 3.31Å; R36-F62 HydrophobicContact CB-CE2 4.1Å; R36-F62 HydrophobicContact CB-CZ 4.46Å; R36-F62 HydrophobicContact CG-CE2 3.68Å; R36-F62 HydrophobicContact CG-CZ 3.72Å; R36-L70 HydrophobicContact CB-CD1 4.45Å
37	E	97.8	Very high	96.7	Very high	81 Å²	81	39.9 Å²	39.9	38%	0.379	22%	0.224	S	C	.	.	H	α-helix	trans	-58.3	-46.8	176.5	-73.6	170	179	0	0	111.2	K33 A34 L39 I40 S41	K33-E37 WeakPolarHBondContact CE-OE1 3.32Å; K33-E37 IonicContact NZ-OE1 2.89Å; K33-E37 WeakPolarHBondContact O-CG 3.15Å; K33-E37 PolarHBondContact O-N 3.4Å; A34-E37 PolarHBondContact O-N 2.83Å; E37-L39 PolarHBondContact O-N 3.26Å; E37-I40 PolarHBondContact O-N 2.87Å; E37-S41 WeakPolarHBondContact O-CB 3.49Å; E37-S41 PolarHBondContact O-N 2.87Å; E37-S41 PolarHBondContact O-OG 3.02Å
38	S	97.6	Very high	96.7	Very high	48 Å²	48	45 Å²	45	34%	0.336	25%	0.248	S	C	.	.	H	α-helix	trans	-60.7	-43.6	176	-62.9	0	0	0	0	113.2	A34 C35 R36 S41 A42	A34-S38 PolarHBondContact O-N 3.45Å; A34-S38 PolarHBondContact O-OG 3.38Å; C35-S38 PolarHBondContact O-N 3.43Å; R36-S38 PolarHBondContact O-N 3.49Å; S38-S41 PolarHBondContact O-N 3.03Å; S38-A42 WeakPolarHBondContact O-CB 3.34Å; S38-A42 PolarHBondContact O-N 3.45Å
39	L	98.3	Very high	96.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66	-44	179.5	-74.6	163.3	0	0	0	112.1	C35 R36 E37 S41 A42 G43 F44 F62 L70 A72 L261 F264 M265	C35-L39 WeakPolarHBondContact O-CB 3.32Å; C35-L39 WeakPolarHBondContact O-CD1 3.28Å; C35-L39 VanDerWaalsContact O-CG 3.3Å; C35-L39 WeakPolarHBondContact O-CG 3.42Å; C35-L39 PolarHBondContact O-N 3.48Å; R36-L39 PolarHBondContact O-N 2.94Å; E37-L39 PolarHBondContact O-N 3.26Å; L39-S41 VanDerWaalsContact C-N 3.33Å; L39-S41 PolarHBondContact O-N 3.07Å; L39-A42 CarbonylContact O-C 3.57Å; L39-A42 WeakPolarHBondContact O-CA 3.37Å; L39-A42 PolarHBondContact O-N 3.45Å; L39-G43 PolarHBondContact O-N 2.98Å; L39-F44 HydrophobicContact CB-CB 4.06Å; L39-F44 HydrophobicContact CB-CD2 4.42Å; L39-F44 HydrophobicContact CB-CG 4.24Å; L39-F44 HydrophobicContact CD2-CB 4.49Å; L39-F44 HydrophobicContact CD2-CD1 3.89Å; L39-F44 HydrophobicContact CD2-CD2 3.81Å; L39-F44 HydrophobicContact CD2-CE1 4.05Å; L39-F44 HydrophobicContact CD2-CE2 3.94Å; L39-F44 HydrophobicContact CD2-CG 3.8Å; L39-F44 HydrophobicContact CD2-CZ 4.08Å; L39-F44 WeakPolarHBondContact O-CB 3.41Å; L39-F44 WeakPolarHBondContact O-CD2 3.13Å; L39-F44 PolarHBondContact O-N 3.17Å; L39-F62 HydrophobicContact CB-CD1 4.14Å; L39-F62 HydrophobicContact CB-CE1 4.34Å; L39-F62 HydrophobicContact CB-CG 4.48Å; L39-F62 HydrophobicContact CD1-CB 4Å; L39-F62 HydrophobicContact CD1-CD1 4.46Å; L39-F62 HydrophobicContact CD1-CD2 4.29Å; L39-F62 HydrophobicContact CD1-CG 3.99Å; L39-L70 HydrophobicContact CD1-CD1 3.83Å; L39-L70 HydrophobicContact CD1-CD2 3.65Å; L39-L70 HydrophobicContact CD1-CG 4.33Å; L39-A72 HydrophobicContact CD1-CB 3.82Å; L39-A72 HydrophobicContact CD2-CB 3.75Å; L39-A72 HydrophobicContact CG-CB 4.47Å; L39-L261 HydrophobicContact CD1-CD1 4.21Å; L39-L261 HydrophobicContact CD2-CD1 3.82Å; L39-L261 HydrophobicContact CG-CD1 3.95Å; L39-F264 HydrophobicContact CD2-CE1 4.29Å; L39-M265 HydrophobicContact CD2-CG 4.25Å; L39-M265 HydrophobicContact CD2-SD 4.27Å
40	I	98.2	Very high	96.1	Very high	75 Å²	75	51.8 Å²	51.8	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-60.2	-45.6	175.3	-69.7	170.3	0	0	0	109.9	R36 E37 A42 G43 F62	R36-I40 HydrophobicContact CG-CD1 3.75Å; R36-I40 HydrophobicContact CG-CG1 4.44Å; R36-I40 WeakPolarHBondContact O-CB 3.47Å; R36-I40 VanDerWaalsContact O-CG1 3.28Å; R36-I40 WeakPolarHBondContact O-CG1 3.48Å; R36-I40 PolarHBondContact O-N 2.82Å; E37-I40 PolarHBondContact O-N 2.87Å; I40-A42 PolarHBondContact O-N 3.34Å; I40-G43 PolarHBondContact O-N 2.81Å; I40-F62 HydrophobicContact CD1-CZ 4.16Å; I40-F62 HydrophobicContact CG1-CE1 3.88Å; I40-F62 HydrophobicContact CG1-CZ 3.85Å
41	S	97.4	Very high	95.7	Very high	111 Å²	111	54.8 Å²	54.8	78%	0.776	31%	0.306	S	S	*	.	H	α-helix	trans	-61.8	-28.4	175.2	-65.7	0	0	0	0	113.2	E37 S38 L39 G43	E37-S41 WeakPolarHBondContact O-CB 3.49Å; E37-S41 PolarHBondContact O-N 2.87Å; E37-S41 PolarHBondContact O-OG 3.02Å; S38-S41 PolarHBondContact O-N 3.03Å; L39-S41 VanDerWaalsContact C-N 3.33Å; L39-S41 PolarHBondContact O-N 3.07Å; S41-G43 VanDerWaalsContact C-N 3.28Å; S41-G43 PolarHBondContact O-N 2.6Å
42	A	97	Very high	95.2	Very high	37 Å²	37	60.6 Å²	60.6	31%	0.306	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	5.5	174.8	0	0	0	0	0	114.1	S38 L39 I40 F44 M265	S38-A42 WeakPolarHBondContact O-CB 3.34Å; S38-A42 PolarHBondContact O-N 3.45Å; L39-A42 CarbonylContact O-C 3.57Å; L39-A42 WeakPolarHBondContact O-CA 3.37Å; L39-A42 PolarHBondContact O-N 3.45Å; I40-A42 PolarHBondContact O-N 3.34Å; A42-F44 HydrophobicContact CB-CD2 3.96Å; A42-F44 HydrophobicContact CB-CE2 4.11Å; A42-M265 HydrophobicContact CB-SD 4.04Å
43	G	97.2	Very high	95	Very high	55 Å²	55	60.8 Å²	60.8	57%	0.567	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	23	176.2	0	0	0	0	0	114.6	L39 I40 S41	L39-G43 PolarHBondContact O-N 2.98Å; I40-G43 PolarHBondContact O-N 2.81Å; S41-G43 VanDerWaalsContact C-N 3.28Å; S41-G43 PolarHBondContact O-N 2.6Å
44	F	97.9	Very high	94.6	Very high	10 Å²	10	65.1 Å²	65.1	4%	0.044	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-80.8	139	171.6	-72.7	-112.5	0	0	0	111.1	L39 A42 K60 Y61 F62 A72 V74 F264	L39-F44 HydrophobicContact CB-CB 4.06Å; L39-F44 HydrophobicContact CB-CD2 4.42Å; L39-F44 HydrophobicContact CB-CG 4.24Å; L39-F44 HydrophobicContact CD2-CB 4.49Å; L39-F44 HydrophobicContact CD2-CD1 3.89Å; L39-F44 HydrophobicContact CD2-CD2 3.81Å; L39-F44 HydrophobicContact CD2-CE1 4.05Å; L39-F44 HydrophobicContact CD2-CE2 3.94Å; L39-F44 HydrophobicContact CD2-CG 3.8Å; L39-F44 HydrophobicContact CD2-CZ 4.08Å; L39-F44 WeakPolarHBondContact O-CB 3.41Å; L39-F44 WeakPolarHBondContact O-CD2 3.13Å; L39-F44 PolarHBondContact O-N 3.17Å; A42-F44 HydrophobicContact CB-CD2 3.96Å; A42-F44 HydrophobicContact CB-CE2 4.11Å; F44-K60 WeakPolarHBondContact CA-O 3.43Å; F44-K60 HydrophobicContact CB-CB 4.33Å; F44-K60 HydrophobicContact CD1-CB 3.68Å; F44-K60 HydrophobicContact CD2-CB 4.11Å; F44-K60 HydrophobicContact CD2-CD 4.11Å; F44-K60 HydrophobicContact CE1-CB 3.87Å; F44-K60 HydrophobicContact CE1-CG 4.46Å; F44-K60 HydrophobicContact CE2-CB 4.31Å; F44-K60 HydrophobicContact CE2-CD 3.87Å; F44-K60 HydrophobicContact CG-CB 3.78Å; F44-K60 HydrophobicContact CZ-CB 4.18Å; F44-K60 HydrophobicContact CZ-CD 4.15Å; F44-K60 HydrophobicContact CZ-CG 4.37Å; F44-Y61 WeakPolarHBondContact CD1-O 3.46Å; F44-F62 HydrophobicContact CB-CD1 3.78Å; F44-F62 HydrophobicContact CB-CE1 4.3Å; F44-A72 HydrophobicContact CE1-CB 4.38Å; F44-V74 HydrophobicContact CE1-CG2 3.6Å; F44-V74 HydrophobicContact CZ-CG2 3.68Å; F44-F264 AromaticContact CE1-CE1 3.48Å; F44-F264 HydrophobicContact CE1-CE1 3.48Å; F44-F264 VanDerWaalsContact CE1-CE1 3.48Å; F44-F264 AromaticContact CE1-CZ 3.7Å; F44-F264 HydrophobicContact CE1-CZ 3.7Å; F44-F264 HydrophobicContact CE2-CE1 4.47Å; F44-F264 HydrophobicContact CZ-CD1 4.31Å; F44-F264 AromaticContact CZ-CE1 3.39Å; F44-F264 HydrophobicContact CZ-CE1 3.39Å; F44-F264 AromaticContact CZ-CZ 3.85Å; F44-F264 HydrophobicContact CZ-CZ 3.85Å
45	E	97.5	Very high	94.3	Very high	112 Å²	112	65.4 Å²	65.4	52%	0.523	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	130.8	172.4	-178.1	-179.6	164.6	0	0	110.4	K60 Y61 F62	E45-K60 PolarHBondContact N-O 2.87Å; E45-Y61 HydrophobicContact CB-CD1 3.98Å; E45-Y61 HydrophobicContact CB-CE1 4.35Å; E45-Y61 HydrophobicContact CG-CD1 4.45Å; E45-Y61 CarbonylContact O-C 3.43Å; E45-Y61 VanDerWaalsContact O-CA 3.31Å; E45-Y61 WeakPolarHBondContact O-CA 3.17Å; E45-Y61 WeakPolarHBondContact OE2-CE1 3.25Å; E45-F62 WeakPolarHBondContact O-CD1 3.44Å; E45-F62 PolarHBondContact O-N 3.22Å
46	E	97.1	Very high	93.9	Very high	60 Å²	60	68.1 Å²	68.1	28%	0.28	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.5	171.7	-169.4	164.9	-152	0	0	110.1	R36 F62	R36-E46 WeakPolarHBondContact CD-OE1 3.05Å; R36-E46 IonicContact CZ-OE1 3.96Å; R36-E46 IonicContact CZ-OE2 2.86Å; R36-E46 IonicContact NE-OE1 3.18Å; R36-E46 PolarHBondContact NE-OE1 3.33Å; R36-E46 IonicContact NE-OE2 2.72Å; R36-E46 PolarHBondContact NE-OE2 2.79Å; R36-E46 IonicContact NH2-OE1 3.97Å; R36-E46 IonicContact NH2-OE2 3.95Å; R36-E46 PolarHBondContact NH2-OE2 3.31Å; E46-F62 WeakPolarHBondContact CA-O 3.41Å; E46-F62 HydrophobicContact CB-CD1 4.38Å; E46-F62 HydrophobicContact CB-CE1 3.6Å; E46-F62 HydrophobicContact CB-CE2 3.98Å; E46-F62 HydrophobicContact CB-CZ 3.35Å; E46-F62 HydrophobicContact CG-CD2 4.36Å; E46-F62 HydrophobicContact CG-CE1 4.18Å; E46-F62 HydrophobicContact CG-CE2 3.6Å; E46-F62 HydrophobicContact CG-CZ 3.51Å
47	L	95.1	Very high	93.7	Very high	12 Å²	12	66.2 Å²	66.2	6%	0.063	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.8	175.4	-60.6	178.9	0	0	0	110.1	W53 L55 Y61 F62 V63 F73	L47-W53 HydrophobicContact CB-CD2 4.42Å; L47-W53 HydrophobicContact CB-CZ2 4.44Å; L47-W53 HydrophobicContact CD1-CB 4.38Å; L47-W53 HydrophobicContact CD1-CD2 3.62Å; L47-W53 HydrophobicContact CD1-CE3 3.82Å; L47-W53 HydrophobicContact CD1-CG 3.87Å; L47-W53 HydrophobicContact CD1-CZ3 4.37Å; L47-L55 HydrophobicContact CD1-CD2 3.91Å; L47-Y61 HydrophobicContact CD1-CD1 4.04Å; L47-Y61 HydrophobicContact CD1-CG 4.02Å; L47-Y61 HydrophobicContact CD2-CD1 3.84Å; L47-Y61 HydrophobicContact CD2-CE1 4.44Å; L47-Y61 HydrophobicContact CG-CD1 4.07Å; L47-Y61 HydrophobicContact CG-CG 4.43Å; L47-F62 PolarHBondContact N-O 2.87Å; L47-V63 HydrophobicContact CB-CB 4.47Å; L47-F73 HydrophobicContact CD1-CE1 4.15Å; L47-F73 HydrophobicContact CD1-CZ 3.72Å
48	E	91.8	Very high	93.5	Very high	116 Å²	116	68 Å²	68	54%	0.542	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-75.7	131.1	170.1	-73.8	-62.3	161.8	0	0	110.3	S50 D51 W53	E48-S50 PolarHBondContact O-N 3Å; E48-D51 HydrophobicContact CB-CB 4.22Å; E48-D51 PolarHBondContact O-N 3.4Å; E48-W53 PolarHBondContact O-NE1 2.81Å
49	E	86.9	Confident	93.4	Very high	52 Å²	52	66.2 Å²	66.2	24%	0.243	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-34	-176.2	-158.1	-148.2	144.6	0	0	111.2	D51 V63 K65 K303	E49-D51 VanDerWaalsContact C-N 3.25Å; E49-D51 PolarHBondContact O-N 2.99Å; E49-V63 HydrophobicContact CB-CG2 4.1Å; E49-V63 HydrophobicContact CG-CG2 4.23Å; E49-K65 IonicContact OE1-NZ 2.69Å; E49-K65 PolarHBondContact OE1-NZ 2.97Å; E49-K65 WeakPolarHBondContact OE2-CD 3.45Å; E49-K65 WeakPolarHBondContact OE2-CE 3.33Å; E49-K65 IonicContact OE2-NZ 3.11Å; E49-K65 PolarHBondContact OE2-NZ 2.87Å; E49-K303 HydrophobicContact CG-CD 3.92Å; E49-K303 WeakPolarHBondContact O-CE 3.3Å; E49-K303 PolarHBondContact O-NZ 3.37Å; E49-K303 IonicContact OE1-NZ 3.96Å; E49-K303 PolarHBondContact OE1-NZ 3.34Å; E49-K303 VanDerWaalsContact OE1-NZ 3.11Å
50	S	87.1	Confident	93.3	Very high	98 Å²	98	68.8 Å²	68.8	69%	0.685	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.3	-178.2	49.3	0	0	0	0	114.6	E48	E48-S50 PolarHBondContact O-N 3Å
51	D	88.6	Confident	93.2	Very high	84 Å²	84	65.7 Å²	65.7	45%	0.449	37%	0.366	S	S	.	.	S	Bend	trans	-90.4	161.9	-165.4	-67.9	6.7	0	0	0	111.6	E48 E49	E48-D51 HydrophobicContact CB-CB 4.22Å; E48-D51 PolarHBondContact O-N 3.4Å; E49-D51 VanDerWaalsContact C-N 3.25Å; E49-D51 PolarHBondContact O-N 2.99Å
52	V	87.4	Confident	93.2	Very high	123 Å²	123	60.4 Å²	60.4	75%	0.745	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-83.7	119.9	167	179.6	0	0	0	0	107.7
53	W	91	Very high	93.1	Very high	9 Å²	9	59 Å²	59	3%	0.034	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-80.5	136	-173.3	-57.7	-17.5	0	0	0	111.4	L47 E48 L55 V63 F73 F304 Q307 S312	L47-W53 HydrophobicContact CB-CD2 4.42Å; L47-W53 HydrophobicContact CB-CZ2 4.44Å; L47-W53 HydrophobicContact CD1-CB 4.38Å; L47-W53 HydrophobicContact CD1-CD2 3.62Å; L47-W53 HydrophobicContact CD1-CE3 3.82Å; L47-W53 HydrophobicContact CD1-CG 3.87Å; L47-W53 HydrophobicContact CD1-CZ3 4.37Å; E48-W53 PolarHBondContact O-NE1 2.81Å; W53-L55 HydrophobicContact CB-CD1 4.45Å; W53-L55 HydrophobicContact CB-CD2 3.88Å; W53-L55 HydrophobicContact CB-CG 3.99Å; W53-L55 HydrophobicContact CE3-CD1 4.46Å; W53-V63 HydrophobicContact CH2-CB 4.3Å; W53-V63 HydrophobicContact CH2-CG1 3.96Å; W53-V63 HydrophobicContact CZ2-CB 4.15Å; W53-V63 HydrophobicContact CZ2-CG1 4.29Å; W53-V63 HydrophobicContact CZ2-CG2 4.04Å; W53-F73 HydrophobicContact CE3-CZ 4.25Å; W53-F73 HydrophobicContact CZ3-CE1 4.24Å; W53-F73 HydrophobicContact CZ3-CZ 4.17Å; W53-F304 HydrophobicContact CZ3-CD2 4.41Å; W53-Q307 HydrophobicContact CD2-CB 3.87Å; W53-Q307 HydrophobicContact CD2-CG 3.9Å; W53-Q307 HydrophobicContact CE3-CB 3.3Å; W53-Q307 HydrophobicContact CE3-CG 3.78Å; W53-Q307 HydrophobicContact CG-CB 4.47Å; W53-Q307 HydrophobicContact CG-CG 4.45Å; W53-Q307 HydrophobicContact CH2-CG 4.44Å; W53-Q307 HydrophobicContact CZ3-CB 3.67Å; W53-Q307 HydrophobicContact CZ3-CG 4.06Å; W53-Q307 VanDerWaalsContact N-OE1 3.11Å; W53-S312 WeakPolarHBondContact O-CB 3.42Å
54	K	88.8	Confident	92.9	Very high	186 Å²	186	58.1 Å²	58.1	81%	0.809	30%	0.301	S	S	*	.			trans	-106.1	98.4	172.2	-67.6	-178.1	-176.8	176.3	0	108.3
55	L	91.2	Very high	92.5	Very high	11 Å²	11	60.6 Å²	60.6	6%	0.058	31%	0.311	C	S	.	.			trans	-103.6	143	-171.6	-53.3	177.1	0	0	0	110.5	L47 W53 Y61 F73 L75 V308 V313	L47-L55 HydrophobicContact CD1-CD2 3.91Å; W53-L55 HydrophobicContact CB-CD1 4.45Å; W53-L55 HydrophobicContact CB-CD2 3.88Å; W53-L55 HydrophobicContact CB-CG 3.99Å; W53-L55 HydrophobicContact CE3-CD1 4.46Å; L55-Y61 HydrophobicContact CB-CE2 4.23Å; L55-Y61 HydrophobicContact CD2-CD1 4.06Å; L55-Y61 HydrophobicContact CD2-CD2 3.77Å; L55-Y61 HydrophobicContact CD2-CE1 4.01Å; L55-Y61 HydrophobicContact CD2-CE2 3.69Å; L55-Y61 HydrophobicContact CD2-CG 3.94Å; L55-F73 HydrophobicContact CD1-CE2 4.13Å; L55-F73 HydrophobicContact CD1-CZ 4.37Å; L55-F73 HydrophobicContact CD2-CE2 4.2Å; L55-F73 HydrophobicContact CD2-CZ 4.19Å; L55-L75 HydrophobicContact CB-CD1 3.72Å; L55-L75 HydrophobicContact CD1-CD1 4.43Å; L55-V308 HydrophobicContact CD1-CG2 3.69Å; L55-V313 HydrophobicContact CB-CG2 4.32Å
56	S	91.4	Very high	92.1	Very high	59 Å²	59	59.1 Å²	59.1	41%	0.413	31%	0.307	S	S	.	.			trans	-124.3	149.2	175.6	61	0	0	0	0	111.3	G59 Y61	S56-G59 WeakPolarHBondContact O-CA 3.39Å; S56-G59 PolarHBondContact O-N 3.09Å; S56-Y61 PolarHBondContact N-OH 3.19Å; S56-Y61 PolarHBondContact OG-OH 2.93Å
57	P	92.3	Very high	91.8	Very high	52 Å²	52	57.6 Å²	57.6	34%	0.338	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	142.5	166.6	-26	35.2	0	0	0	110.7	G59 G76	P57-G59 PolarHBondContact O-N 2.94Å; P57-G76 WeakPolarHBondContact CB-O 3.46Å
58	R	94.5	Very high	91.6	Very high	119 Å²	119	57 Å²	57	45%	0.449	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	-4.8	-170.8	-48.6	170.6	167.3	66.4	12.7	115.2	L75 G77 V274 D275	R58-L75 WeakPolarHBondContact CA-O 3.48Å; R58-L75 PolarHBondContact N-O 2.97Å; R58-G77 PolarHBondContact NH1-O 2.83Å; R58-V274 HydrophobicContact CB-CG1 4.36Å; R58-V274 HydrophobicContact CG-CG1 4.34Å; R58-D275 IonicContact CZ-OD1 3.35Å; R58-D275 IonicContact NE-OD1 2.79Å; R58-D275 PolarHBondContact NE-OD1 2.96Å; R58-D275 IonicContact NH2-OD1 3.12Å; R58-D275 PolarHBondContact NH2-OD1 3.26Å; R58-D275 VanDerWaalsContact NH2-OD1 3.11Å
59	G	94.6	Very high	91.6	Very high	9 Å²	9	51.6 Å²	51.6	9%	0.093	28%	0.28	C	S	.	.			trans	-65.5	141.4	177.8	0	0	0	0	0	112	S56 P57 Y61 V74 L75	S56-G59 WeakPolarHBondContact O-CA 3.39Å; S56-G59 PolarHBondContact O-N 3.09Å; P57-G59 PolarHBondContact O-N 2.94Å; G59-Y61 VanDerWaalsContact C-CE2 3.41Å; G59-Y61 VanDerWaalsContact CA-CE2 3.44Å; G59-V74 WeakPolarHBondContact O-CA 3.46Å; G59-L75 PolarHBondContact O-N 2.75Å
60	K	96.9	Very high	91.9	Very high	55 Å²	55	49.2 Å²	49.2	24%	0.239	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.4	179.2	-62	-171.7	176.9	-170	0	108.7	F44 E45 V74 T268	F44-K60 WeakPolarHBondContact CA-O 3.43Å; F44-K60 HydrophobicContact CB-CB 4.33Å; F44-K60 HydrophobicContact CD1-CB 3.68Å; F44-K60 HydrophobicContact CD2-CB 4.11Å; F44-K60 HydrophobicContact CD2-CD 4.11Å; F44-K60 HydrophobicContact CE1-CB 3.87Å; F44-K60 HydrophobicContact CE1-CG 4.46Å; F44-K60 HydrophobicContact CE2-CB 4.31Å; F44-K60 HydrophobicContact CE2-CD 3.87Å; F44-K60 HydrophobicContact CG-CB 3.78Å; F44-K60 HydrophobicContact CZ-CB 4.18Å; F44-K60 HydrophobicContact CZ-CD 4.15Å; F44-K60 HydrophobicContact CZ-CG 4.37Å; E45-K60 PolarHBondContact N-O 2.87Å; K60-V74 HydrophobicContact CB-CG2 4.27Å; K60-V74 HydrophobicContact CG-CG1 4.39Å; K60-V74 HydrophobicContact CG-CG2 3.87Å; K60-T268 WeakPolarHBondContact CE-O 3.11Å; K60-T268 PolarHBondContact NZ-O 2.88Å
61	Y	96.9	Very high	92.2	Very high	9 Å²	9	44.7 Å²	44.7	4%	0.035	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	152.3	-170	-55.3	-75.2	0	0	0	111.7	F44 E45 L47 L55 S56 G59 A72 F73 L75	F44-Y61 WeakPolarHBondContact CD1-O 3.46Å; E45-Y61 HydrophobicContact CB-CD1 3.98Å; E45-Y61 HydrophobicContact CB-CE1 4.35Å; E45-Y61 HydrophobicContact CG-CD1 4.45Å; E45-Y61 CarbonylContact O-C 3.43Å; E45-Y61 VanDerWaalsContact O-CA 3.31Å; E45-Y61 WeakPolarHBondContact O-CA 3.17Å; E45-Y61 WeakPolarHBondContact OE2-CE1 3.25Å; L47-Y61 HydrophobicContact CD1-CD1 4.04Å; L47-Y61 HydrophobicContact CD1-CG 4.02Å; L47-Y61 HydrophobicContact CD2-CD1 3.84Å; L47-Y61 HydrophobicContact CD2-CE1 4.44Å; L47-Y61 HydrophobicContact CG-CD1 4.07Å; L47-Y61 HydrophobicContact CG-CG 4.43Å; L55-Y61 HydrophobicContact CB-CE2 4.23Å; L55-Y61 HydrophobicContact CD2-CD1 4.06Å; L55-Y61 HydrophobicContact CD2-CD2 3.77Å; L55-Y61 HydrophobicContact CD2-CE1 4.01Å; L55-Y61 HydrophobicContact CD2-CE2 3.69Å; L55-Y61 HydrophobicContact CD2-CG 3.94Å; S56-Y61 PolarHBondContact N-OH 3.19Å; S56-Y61 PolarHBondContact OG-OH 2.93Å; G59-Y61 VanDerWaalsContact C-CE2 3.41Å; G59-Y61 VanDerWaalsContact CA-CE2 3.44Å; Y61-A72 CarbonylContact O-C 3.42Å; Y61-A72 WeakPolarHBondContact O-CA 3.26Å; Y61-F73 VanDerWaalsContact CB-CZ 3.48Å; Y61-F73 HydrophobicContact CD2-CD2 4.14Å; Y61-F73 AromaticContact CD2-CE2 3.56Å; Y61-F73 HydrophobicContact CD2-CE2 3.56Å; Y61-F73 HydrophobicContact CD2-CZ 4.13Å; Y61-F73 AromaticContact CG-CE2 3.97Å; Y61-F73 HydrophobicContact CG-CE2 3.97Å; Y61-F73 HydrophobicContact CG-CZ 4.07Å; Y61-F73 PolarHBondContact N-O 3.04Å; Y61-F73 PolarHBondContact O-N 3.44Å; Y61-F73 VanDerWaalsContact O-O 3.14Å; Y61-L75 HydrophobicContact CE2-CD1 4.46Å
62	F	96.7	Very high	92.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.6	165.3	74.9	-79.1	0	0	0	111.5	R36 L39 I40 F44 E45 E46 L47 T64 L70 I71 A72	R36-F62 HydrophobicContact CB-CE2 4.1Å; R36-F62 HydrophobicContact CB-CZ 4.46Å; R36-F62 HydrophobicContact CG-CE2 3.68Å; R36-F62 HydrophobicContact CG-CZ 3.72Å; L39-F62 HydrophobicContact CB-CD1 4.14Å; L39-F62 HydrophobicContact CB-CE1 4.34Å; L39-F62 HydrophobicContact CB-CG 4.48Å; L39-F62 HydrophobicContact CD1-CB 4Å; L39-F62 HydrophobicContact CD1-CD1 4.46Å; L39-F62 HydrophobicContact CD1-CD2 4.29Å; L39-F62 HydrophobicContact CD1-CG 3.99Å; I40-F62 HydrophobicContact CD1-CZ 4.16Å; I40-F62 HydrophobicContact CG1-CE1 3.88Å; I40-F62 HydrophobicContact CG1-CZ 3.85Å; F44-F62 HydrophobicContact CB-CD1 3.78Å; F44-F62 HydrophobicContact CB-CE1 4.3Å; E45-F62 WeakPolarHBondContact O-CD1 3.44Å; E45-F62 PolarHBondContact O-N 3.22Å; E46-F62 WeakPolarHBondContact CA-O 3.41Å; E46-F62 HydrophobicContact CB-CD1 4.38Å; E46-F62 HydrophobicContact CB-CE1 3.6Å; E46-F62 HydrophobicContact CB-CE2 3.98Å; E46-F62 HydrophobicContact CB-CZ 3.35Å; E46-F62 HydrophobicContact CG-CD2 4.36Å; E46-F62 HydrophobicContact CG-CE1 4.18Å; E46-F62 HydrophobicContact CG-CE2 3.6Å; E46-F62 HydrophobicContact CG-CZ 3.51Å; L47-F62 PolarHBondContact N-O 2.87Å; F62-T64 HydrophobicContact CD2-CG2 4.27Å; F62-T64 HydrophobicContact CE2-CG2 4.2Å; F62-L70 HydrophobicContact CD2-CD1 3.98Å; F62-L70 HydrophobicContact CD2-CG 4.41Å; F62-I71 CarbonylContact C-O 3.55Å; F62-I71 WeakPolarHBondContact CA-O 3.3Å; F62-I71 WeakPolarHBondContact CB-O 3.37Å; F62-A72 HydrophobicContact CB-CB 3.85Å
63	V	94.8	Very high	93	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.048	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143	175.7	59.3	0	0	0	0	108.7	L47 E49 W53 L70 I71	L47-V63 HydrophobicContact CB-CB 4.47Å; E49-V63 HydrophobicContact CB-CG2 4.1Å; E49-V63 HydrophobicContact CG-CG2 4.23Å; W53-V63 HydrophobicContact CH2-CB 4.3Å; W53-V63 HydrophobicContact CH2-CG1 3.96Å; W53-V63 HydrophobicContact CZ2-CB 4.15Å; W53-V63 HydrophobicContact CZ2-CG1 4.29Å; W53-V63 HydrophobicContact CZ2-CG2 4.04Å; V63-L70 WeakPolarHBondContact O-CA 3.13Å; V63-I71 HydrophobicContact CG1-CB 4.15Å; V63-I71 PolarHBondContact N-O 3.31Å; V63-I71 PolarHBondContact O-N 3.02Å
64	T	92.9	Very high	93.3	Very high	37 Å²	37	34.4 Å²	34.4	23%	0.227	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	148	171.5	71.8	0	0	0	0	110.7	V32 F62 A69 L70	V32-T64 HydrophobicContact CG1-CG2 3.85Å; F62-T64 HydrophobicContact CD2-CG2 4.27Å; F62-T64 HydrophobicContact CE2-CG2 4.2Å; T64-A69 CarbonylContact C-O 3.47Å; T64-A69 WeakPolarHBondContact CA-O 3.48Å; T64-L70 HydrophobicContact CG2-CD1 4.06Å; T64-L70 HydrophobicContact CG2-CG 4.4Å
65	K	89.6	Confident	93.5	Very high	61 Å²	61	25.6 Å²	25.6	27%	0.265	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.7	173.8	-176.4	70.3	177.8	-178.9	0	108.8	E49 G67 T68 A69 L296 V300	E49-K65 IonicContact OE1-NZ 2.69Å; E49-K65 PolarHBondContact OE1-NZ 2.97Å; E49-K65 WeakPolarHBondContact OE2-CD 3.45Å; E49-K65 WeakPolarHBondContact OE2-CE 3.33Å; E49-K65 IonicContact OE2-NZ 3.11Å; E49-K65 PolarHBondContact OE2-NZ 2.87Å; K65-G67 PolarHBondContact O-N 3.45Å; K65-T68 PolarHBondContact O-N 2.88Å; K65-A69 HydrophobicContact CB-CB 4.34Å; K65-A69 PolarHBondContact N-O 3.42Å; K65-A69 PolarHBondContact O-N 3.11Å; K65-L296 HydrophobicContact CG-CD1 3.85Å; K65-V300 HydrophobicContact CB-CG2 3.91Å; K65-V300 HydrophobicContact CD-CG2 4.28Å; K65-V300 HydrophobicContact CG-CG2 3.74Å
66	N	88.2	Confident	93.7	Very high	82 Å²	82	25 Å²	25	44%	0.439	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	6	-178.5	-176.8	50.8	0	0	0	114.2	T68 R129	N66-T68 PolarHBondContact ND2-OG1 2.94Å; N66-T68 PolarHBondContact O-N 3.47Å; N66-R129 PolarHBondContact ND2-NH2 3.44Å; N66-R129 PolarHBondContact O-NH1 3.3Å; N66-R129 PolarHBondContact OD1-NH1 3.01Å; N66-R129 PolarHBondContact OD1-NH2 2.85Å
67	G	90.9	Very high	93.8	Very high	27 Å²	27	22.6 Å²	22.6	28%	0.278	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	9.2	-167.6	0	0	0	0	0	114.4	M29 V32 K65	M29-G67 WeakPolarHBondContact CA-O 3.34Å; V32-G67 WeakPolarHBondContact CB-O 3.48Å; K65-G67 PolarHBondContact O-N 3.45Å
68	T	90.7	Very high	93.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-5	179.3	64.1	0	0	0	0	113.7	P28 M29 K65 N66 L92 D287	P28-T68 HydrophobicContact CB-CG2 4.17Å; M29-T68 HydrophobicContact CE-CG2 4.23Å; M29-T68 HydrophobicContact CG-CG2 3.72Å; M29-T68 HydrophobicContact SD-CG2 3.82Å; K65-T68 PolarHBondContact O-N 2.88Å; N66-T68 PolarHBondContact ND2-OG1 2.94Å; N66-T68 PolarHBondContact O-N 3.47Å; T68-L92 WeakPolarHBondContact O-CD1 3.33Å; T68-D287 WeakPolarHBondContact CB-OD2 3.45Å; T68-D287 WeakPolarHBondContact O-CB 3.46Å; T68-D287 PolarHBondContact OG1-OD2 3.13Å
69	A	91.6	Very high	93.6	Very high	3 Å²	3	19.3 Å²	19.3	3%	0.025	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	153.6	168.5	0	0	0	0	0	110.3	T64 K65 A285 L296	T64-A69 CarbonylContact C-O 3.47Å; T64-A69 WeakPolarHBondContact CA-O 3.48Å; K65-A69 HydrophobicContact CB-CB 4.34Å; K65-A69 PolarHBondContact N-O 3.42Å; K65-A69 PolarHBondContact O-N 3.11Å; A69-A285 CarbonylContact C-O 3.56Å; A69-A285 VanDerWaalsContact CA-O 3.28Å; A69-A285 WeakPolarHBondContact CA-O 3.34Å; A69-A285 WeakPolarHBondContact CB-O 3.3Å; A69-L296 HydrophobicContact CB-CD2 4.47Å
70	L	93.2	Very high	93.2	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	136.7	-178.3	-177.5	147.8	0	0	0	110.1	V32 C35 R36 L39 F62 V63 T64 A72 F283 A284 A285	V32-L70 HydrophobicContact CG1-CB 4.36Å; V32-L70 HydrophobicContact CG1-CD1 4.29Å; V32-L70 HydrophobicContact CG2-CB 4.45Å; C35-L70 HydrophobicContact CB-CD1 3.99Å; R36-L70 HydrophobicContact CB-CD1 4.45Å; L39-L70 HydrophobicContact CD1-CD1 3.83Å; L39-L70 HydrophobicContact CD1-CD2 3.65Å; L39-L70 HydrophobicContact CD1-CG 4.33Å; F62-L70 HydrophobicContact CD2-CD1 3.98Å; F62-L70 HydrophobicContact CD2-CG 4.41Å; V63-L70 WeakPolarHBondContact O-CA 3.13Å; T64-L70 HydrophobicContact CG2-CD1 4.06Å; T64-L70 HydrophobicContact CG2-CG 4.4Å; L70-A72 HydrophobicContact CD2-CB 4.08Å; L70-F283 HydrophobicContact CD2-CD1 4.14Å; L70-F283 HydrophobicContact CD2-CE1 4.23Å; L70-A284 WeakPolarHBondContact O-CA 3.46Å; L70-A285 PolarHBondContact N-O 3.18Å; L70-A285 PolarHBondContact O-N 2.8Å
71	I	94.3	Very high	92.7	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.015	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.2	165.9	-60.1	-167.2	0	0	0	107.9	F62 V63 F73 M282 F283 A284 F286 V300	F62-I71 CarbonylContact C-O 3.55Å; F62-I71 WeakPolarHBondContact CA-O 3.3Å; F62-I71 WeakPolarHBondContact CB-O 3.37Å; V63-I71 HydrophobicContact CG1-CB 4.15Å; V63-I71 PolarHBondContact N-O 3.31Å; V63-I71 PolarHBondContact O-N 3.02Å; I71-F73 HydrophobicContact CG2-CD1 4.34Å; I71-M282 HydrophobicContact CG2-CE 3.92Å; I71-M282 HydrophobicContact CG2-CG 3.79Å; I71-M282 HydrophobicContact CG2-SD 3.73Å; I71-F283 CarbonylContact C-O 3.49Å; I71-F283 WeakPolarHBondContact CA-O 3.43Å; I71-A284 HydrophobicContact CD1-CB 4.39Å; I71-A284 HydrophobicContact CG1-CB 4.05Å; I71-F286 HydrophobicContact CD1-CE1 4.27Å; I71-F286 HydrophobicContact CD1-CZ 4.32Å; I71-V300 HydrophobicContact CD1-CB 4.26Å; I71-V300 HydrophobicContact CD1-CG1 3.34Å; I71-V300 HydrophobicContact CG1-CG1 3.9Å
72	A	96.6	Very high	92.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142.9	169	0	0	0	0	0	109.5	L39 F44 Y61 F62 L70 F264 M282 F283	L39-A72 HydrophobicContact CD1-CB 3.82Å; L39-A72 HydrophobicContact CD2-CB 3.75Å; L39-A72 HydrophobicContact CG-CB 4.47Å; F44-A72 HydrophobicContact CE1-CB 4.38Å; Y61-A72 CarbonylContact O-C 3.42Å; Y61-A72 WeakPolarHBondContact O-CA 3.26Å; F62-A72 HydrophobicContact CB-CB 3.85Å; L70-A72 HydrophobicContact CD2-CB 4.08Å; A72-F264 HydrophobicContact CB-CD1 4.46Å; A72-F264 HydrophobicContact CB-CE1 3.64Å; A72-F264 HydrophobicContact CB-CZ 4.11Å; A72-M282 CarbonylContact O-C 3.54Å; A72-M282 WeakPolarHBondContact O-CA 3.18Å; A72-M282 WeakPolarHBondContact O-CG 3.2Å; A72-F283 HydrophobicContact CB-CB 4.49Å; A72-F283 PolarHBondContact N-O 2.96Å; A72-F283 PolarHBondContact O-N 2.97Å; A72-F283 VanDerWaalsContact O-O 3.1Å
73	F	96.4	Very high	91.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154.2	-179.8	61.6	-87.1	0	0	0	112.4	L47 W53 L55 Y61 I71 L75 V280 M281 M282 F304 V308	L47-F73 HydrophobicContact CD1-CE1 4.15Å; L47-F73 HydrophobicContact CD1-CZ 3.72Å; W53-F73 HydrophobicContact CE3-CZ 4.25Å; W53-F73 HydrophobicContact CZ3-CE1 4.24Å; W53-F73 HydrophobicContact CZ3-CZ 4.17Å; L55-F73 HydrophobicContact CD1-CE2 4.13Å; L55-F73 HydrophobicContact CD1-CZ 4.37Å; L55-F73 HydrophobicContact CD2-CE2 4.2Å; L55-F73 HydrophobicContact CD2-CZ 4.19Å; Y61-F73 VanDerWaalsContact CB-CZ 3.48Å; Y61-F73 HydrophobicContact CD2-CD2 4.14Å; Y61-F73 AromaticContact CD2-CE2 3.56Å; Y61-F73 HydrophobicContact CD2-CE2 3.56Å; Y61-F73 HydrophobicContact CD2-CZ 4.13Å; Y61-F73 AromaticContact CG-CE2 3.97Å; Y61-F73 HydrophobicContact CG-CE2 3.97Å; Y61-F73 HydrophobicContact CG-CZ 4.07Å; Y61-F73 PolarHBondContact N-O 3.04Å; Y61-F73 PolarHBondContact O-N 3.44Å; Y61-F73 VanDerWaalsContact O-O 3.14Å; I71-F73 HydrophobicContact CG2-CD1 4.34Å; F73-L75 HydrophobicContact CD2-CD2 4.22Å; F73-L75 HydrophobicContact CE2-CD2 4.49Å; F73-V280 HydrophobicContact CB-CG1 4.18Å; F73-M281 CarbonylContact C-O 3.59Å; F73-M281 WeakPolarHBondContact CA-O 3.15Å; F73-M281 WeakPolarHBondContact CB-O 3.34Å; F73-M282 HydrophobicContact CB-CB 4.38Å; F73-M282 HydrophobicContact CB-CE 4.42Å; F73-M282 HydrophobicContact CB-CG 4.45Å; F73-F304 HydrophobicContact CB-CE2 4.1Å; F73-F304 AromaticContact CD1-CD2 3.98Å; F73-F304 HydrophobicContact CD1-CD2 3.98Å; F73-F304 AromaticContact CD1-CE2 3.63Å; F73-F304 HydrophobicContact CD1-CE2 3.63Å; F73-F304 AromaticContact CD2-CE2 3.73Å; F73-F304 HydrophobicContact CD2-CE2 3.73Å; F73-F304 HydrophobicContact CD2-CZ 4.45Å; F73-F304 AromaticContact CE1-CD2 3.99Å; F73-F304 HydrophobicContact CE1-CD2 3.99Å; F73-F304 AromaticContact CE1-CE2 3.87Å; F73-F304 HydrophobicContact CE1-CE2 3.87Å; F73-F304 AromaticContact CE2-CE2 3.95Å; F73-F304 HydrophobicContact CE2-CE2 3.95Å; F73-F304 HydrophobicContact CG-CD2 4.35Å; F73-F304 AromaticContact CG-CE2 3.55Å; F73-F304 HydrophobicContact CG-CE2 3.55Å; F73-F304 HydrophobicContact CG-CZ 4.41Å; F73-F304 HydrophobicContact CZ-CD2 4.36Å; F73-F304 HydrophobicContact CZ-CE2 4.01Å; F73-V308 HydrophobicContact CE2-CG2 4.45Å
74	V	96.1	Very high	91.4	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.7	174.6	178.7	0	0	0	0	108.9	F44 G59 K60 F264 T268 V274 M281	F44-V74 HydrophobicContact CE1-CG2 3.6Å; F44-V74 HydrophobicContact CZ-CG2 3.68Å; G59-V74 WeakPolarHBondContact O-CA 3.46Å; K60-V74 HydrophobicContact CB-CG2 4.27Å; K60-V74 HydrophobicContact CG-CG1 4.39Å; K60-V74 HydrophobicContact CG-CG2 3.87Å; V74-F264 HydrophobicContact CG2-CE2 4.41Å; V74-F264 HydrophobicContact CG2-CZ 3.91Å; V74-T268 HydrophobicContact CB-CG2 3.83Å; V74-T268 HydrophobicContact CG1-CG2 4.37Å; V74-T268 HydrophobicContact CG2-CG2 3.49Å; V74-T268 VanDerWaalsContact CG2-CG2 3.49Å; V74-V274 HydrophobicContact CG1-CG1 4.12Å; V74-V274 HydrophobicContact CG1-CG2 4.35Å; V74-M281 HydrophobicContact CB-CE 4.42Å; V74-M281 HydrophobicContact CG1-CE 4.3Å; V74-M281 PolarHBondContact N-O 2.84Å; V74-M281 PolarHBondContact O-N 3.19Å
75	L	94.8	Very high	91.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.5	173.5	-57.1	-174.3	0	0	0	109.2	L55 R58 G59 Y61 F73 F79 V280 V308	L55-L75 HydrophobicContact CB-CD1 3.72Å; L55-L75 HydrophobicContact CD1-CD1 4.43Å; R58-L75 WeakPolarHBondContact CA-O 3.48Å; R58-L75 PolarHBondContact N-O 2.97Å; G59-L75 PolarHBondContact O-N 2.75Å; Y61-L75 HydrophobicContact CE2-CD1 4.46Å; F73-L75 HydrophobicContact CD2-CD2 4.22Å; F73-L75 HydrophobicContact CE2-CD2 4.49Å; L75-F79 HydrophobicContact CB-CB 4.1Å; L75-F79 HydrophobicContact CB-CD1 4.19Å; L75-F79 HydrophobicContact CB-CG 4.04Å; L75-F79 HydrophobicContact CD1-CD1 3.87Å; L75-F79 HydrophobicContact CD1-CE1 3.98Å; L75-F79 HydrophobicContact CD2-CD1 4.22Å; L75-F79 HydrophobicContact CD2-CD2 4.23Å; L75-F79 HydrophobicContact CD2-CE1 4.14Å; L75-F79 HydrophobicContact CD2-CE2 4.15Å; L75-F79 HydrophobicContact CD2-CG 4.27Å; L75-F79 HydrophobicContact CD2-CZ 4.11Å; L75-F79 HydrophobicContact CG-CD1 4.32Å; L75-V280 HydrophobicContact CD2-CG1 4.3Å; L75-V280 HydrophobicContact CD2-CG2 3.81Å; L75-V308 HydrophobicContact CD2-CG1 4.3Å
76	G	93.8	Very high	91.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.19	C	C	.	.			trans	-55.7	159.2	175	0	0	0	0	0	113.3	P57 N78 F79 S277 D279	P57-G76 WeakPolarHBondContact CB-O 3.46Å; G76-N78 PolarHBondContact O-N 3.08Å; G76-F79 WeakPolarHBondContact O-CB 3.49Å; G76-F79 PolarHBondContact O-N 3.5Å; G76-S277 CarbonylContact C-O 3.28Å; G76-S277 VanDerWaalsContact C-O 3.28Å; G76-S277 VanDerWaalsContact CA-O 3.32Å; G76-S277 WeakPolarHBondContact CA-O 3.26Å; G76-D279 PolarHBondContact N-O 3.4Å
77	G	93.2	Very high	91.5	Very high	7 Å²	7	32.8 Å²	32.8	7%	0.072	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-25	-178.1	0	0	0	0	0	114.3	R58 V274 S277	R58-G77 PolarHBondContact NH1-O 2.83Å; G77-V274 PolarHBondContact N-O 2.92Å; G77-S277 PolarHBondContact N-O 2.75Å
78	N	92.6	Very high	91.4	Very high	94 Å²	94	34.9 Å²	34.9	50%	0.503	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	20.5	176.6	-56.1	-48.1	0	0	0	111.8	G76 T80 D275 S276 S277 A278	G76-N78 PolarHBondContact O-N 3.08Å; N78-T80 PolarHBondContact O-N 2.92Å; N78-D275 PolarHBondContact ND2-O 3.16Å; N78-S276 PolarHBondContact ND2-O 2.93Å; N78-S277 PolarHBondContact N-O 3.15Å; N78-A278 HydrophobicContact CB-CB 4.1Å
79	F	91.2	Very high	91.1	Very high	8 Å²	8	37.3 Å²	37.3	4%	0.035	22%	0.221	C	C	.	.			trans	-58.8	134.3	-176.5	174.1	-99.4	0	0	0	111.7	L75 G76 R83 A278 V280 V308 V313	L75-F79 HydrophobicContact CB-CB 4.1Å; L75-F79 HydrophobicContact CB-CD1 4.19Å; L75-F79 HydrophobicContact CB-CG 4.04Å; L75-F79 HydrophobicContact CD1-CD1 3.87Å; L75-F79 HydrophobicContact CD1-CE1 3.98Å; L75-F79 HydrophobicContact CD2-CD1 4.22Å; L75-F79 HydrophobicContact CD2-CD2 4.23Å; L75-F79 HydrophobicContact CD2-CE1 4.14Å; L75-F79 HydrophobicContact CD2-CE2 4.15Å; L75-F79 HydrophobicContact CD2-CG 4.27Å; L75-F79 HydrophobicContact CD2-CZ 4.11Å; L75-F79 HydrophobicContact CG-CD1 4.32Å; G76-F79 WeakPolarHBondContact O-CB 3.49Å; G76-F79 PolarHBondContact O-N 3.5Å; F79-R83 HydrophobicContact CD2-CB 4.25Å; F79-R83 HydrophobicContact CE2-CB 4.2Å; F79-A278 WeakPolarHBondContact CA-O 3.45Å; F79-V280 HydrophobicContact CD2-CG2 3.88Å; F79-V280 HydrophobicContact CE2-CG2 3.42Å; F79-V280 VanDerWaalsContact CE2-CG2 3.42Å; F79-V280 HydrophobicContact CZ-CG2 4.29Å; F79-V308 HydrophobicContact CE1-CG1 4.37Å; F79-V308 HydrophobicContact CE2-CG1 4.28Å; F79-V308 HydrophobicContact CZ-CG1 3.58Å; F79-V313 HydrophobicContact CD1-CG2 4.43Å; F79-V313 HydrophobicContact CE1-CB 4.47Å; F79-V313 HydrophobicContact CE1-CG1 4.39Å; F79-V313 HydrophobicContact CE1-CG2 3.8Å
80	T	86.7	Confident	90.6	Very high	78 Å²	78	37.6 Å²	37.6	48%	0.479	22%	0.223	S	C	.	.			trans	-132.6	157.6	166.7	45.5	0	0	0	0	108.7	N78 R83	N78-T80 PolarHBondContact O-N 2.92Å; T80-R83 WeakPolarHBondContact O-CG 3.22Å
81	P	86.1	Confident	89.7	Confident	34 Å²	34	38.6 Å²	38.6	22%	0.221	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	143.4	175.9	-26	36	0	0	0	112.7	V313 A316	P81-V313 HydrophobicContact CG-CB 4.07Å; P81-V313 HydrophobicContact CG-CG1 4.2Å; P81-A316 HydrophobicContact CB-CB 3.42Å; P81-A316 VanDerWaalsContact CB-CB 3.42Å; P81-A316 VanDerWaalsContact CG-CA 3.43Å; P81-A316 HydrophobicContact CG-CB 3.17Å
82	G	83.8	Confident	87.6	Confident	36 Å²	36	38.7 Å²	38.7	37%	0.371	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	2.1	-179.3	0	0	0	0	0	115.3
83	R	88.3	Confident	85	Confident	97 Å²	97	42 Å²	42	37%	0.366	24%	0.242	S	C	.	.			trans	-74.8	150.6	176.4	-63.5	-66.3	-53.8	177.1	2.5	112.2	F79 T80 A278 D279 W320	F79-R83 HydrophobicContact CD2-CB 4.25Å; F79-R83 HydrophobicContact CE2-CB 4.2Å; T80-R83 WeakPolarHBondContact O-CG 3.22Å; R83-A278 VanDerWaalsContact CB-O 3.24Å; R83-A278 WeakPolarHBondContact CB-O 3.4Å; R83-A278 WeakPolarHBondContact CG-O 3.39Å; R83-D279 IonicContact CZ-OD1 3.98Å; R83-D279 IonicContact NE-OD1 3.08Å; R83-D279 PolarHBondContact NE-OD1 2.8Å; R83-D279 VanDerWaalsContact NE-OD1 3.12Å; R83-D279 IonicContact NH2-OD1 2.74Å; R83-D279 PolarHBondContact NH2-OD1 3.49Å; R83-W320 WeakPolarHBondContact O-CZ2 3.48Å
84	P	89	Confident	82.7	Confident	60 Å²	60	42.3 Å²	42.3	39%	0.39	24%	0.244	S	C	.	.			trans	-57.8	155.7	178.8	-24.9	33.9	0	0	0	114.1	V280	P84-V280 PolarHBondContact O-N 3.45Å
85	V	90.5	Very high	79.8	Confident	49 Å²	49	45.4 Å²	45.4	30%	0.297	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.2	172	-176.1	0	0	0	0	109.1	M87 V280 M282 F304	V85-M87 HydrophobicContact CG1-CB 4.48Å; V85-V280 WeakPolarHBondContact CA-O 3.37Å; V85-V280 HydrophobicContact CB-CB 4.42Å; V85-V280 HydrophobicContact CG1-CB 4.34Å; V85-V280 HydrophobicContact CG1-CG1 4.25Å; V85-V280 HydrophobicContact CG2-CB 4.06Å; V85-V280 HydrophobicContact CG2-CG1 4.48Å; V85-V280 HydrophobicContact CG2-CG2 4.4Å; V85-M282 HydrophobicContact CG1-CB 3.79Å; V85-M282 HydrophobicContact CG1-CE 4.07Å; V85-M282 HydrophobicContact CG1-SD 4.24Å; V85-F304 HydrophobicContact CG2-CE1 4.12Å
86	H	91.3	Very high	76.9	Confident	105 Å²	105	47.1 Å²	47.1	49%	0.486	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	111.1	170.3	-60.4	-84.6	0	0	0	108.4	D279 V280 M282	H86-D279 IonicContact CD2-OD2 3.61Å; H86-D279 IonicContact CE1-OD2 3.91Å; H86-D279 IonicContact NE2-OD2 3.4Å; H86-D279 PolarHBondContact NE2-OD2 2.88Å; H86-V280 PolarHBondContact N-O 2.81Å; H86-M282 PolarHBondContact O-N 3.29Å
87	M	90.5	Very high	73.7	Confident	86 Å²	86	54.8 Å²	54.8	42%	0.424	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.2	-169.2	-173.9	-169	-74.1	0	0	112.5	V85 M282 A284 I301	V85-M87 HydrophobicContact CG1-CB 4.48Å; M87-M282 CarbonylContact C-O 3.6Å; M87-M282 WeakPolarHBondContact CA-O 3.32Å; M87-M282 HydrophobicContact CB-CB 4.44Å; M87-M282 HydrophobicContact CE-SD 3.32Å; M87-M282 WeakPolarHBondContact CE-SD 3.34Å; M87-M282 HydrophobicContact CG-CB 4.42Å; M87-M282 HydrophobicContact CG-CG 4.28Å; M87-M282 HydrophobicContact CG-SD 4.2Å; M87-M282 HydrophobicContact SD-SD 4.44Å; M87-A284 HydrophobicContact CG-CB 4.49Å; M87-A284 HydrophobicContact SD-CB 4.4Å; M87-I301 HydrophobicContact CE-CD1 4.29Å
88	V	89.3	Confident	70.8	Confident	71 Å²	71	57.4 Å²	57.4	43%	0.43	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117.8	160.8	179.7	0	0	0	0	108.5	T90 M282 F283 A284	V88-T90 HydrophobicContact CG1-CG2 4.47Å; V88-M282 PolarHBondContact N-O 2.9Å; V88-F283 HydrophobicContact CB-CD2 4.45Å; V88-F283 HydrophobicContact CG1-CD2 4.42Å; V88-F283 WeakPolarHBondContact O-CA 3.43Å; V88-A284 PolarHBondContact O-N 3.5Å
89	G	83.3	Confident	68	Low	51 Å²	51	56.3 Å²	56.3	53%	0.526	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	136.2	-178.3	0	0	0	0	0	113.1	A284	G89-A284 CarbonylContact C-O 3.54Å; G89-A284 VanDerWaalsContact CA-O 3.28Å; G89-A284 WeakPolarHBondContact CA-O 3.35Å
90	T	80.6	Confident	65.1	Low	8 Å²	8	59 Å²	59	5%	0.049	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	-179.6	-179.2	79.7	0	0	0	0	111.7	V88 S256 T257 F283 A284 F286	V88-T90 HydrophobicContact CG1-CG2 4.47Å; T90-S256 WeakPolarHBondContact CG2-O 3.1Å; T90-T257 WeakPolarHBondContact CB-OG1 3.19Å; T90-T257 PolarHBondContact OG1-OG1 3.13Å; T90-F283 HydrophobicContact CG2-CE2 3.85Å; T90-F283 HydrophobicContact CG2-CZ 4.5Å; T90-A284 PolarHBondContact N-O 3.36Å; T90-F286 PolarHBondContact O-N 2.97Å
91	H	76.2	Confident	62.6	Low	24 Å²	24	63.1 Å²	63.1	11%	0.111	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	160	-176.1	64.8	-91.7	0	0	0	118.5	D252 N253 F286 E289 E290	H91-D252 IonicContact CE1-OD1 3.84Å; H91-D252 IonicContact NE2-OD1 2.83Å; H91-D252 PolarHBondContact NE2-OD1 3.41Å; H91-N253 WeakPolarHBondContact CE1-CB 3.41Å; H91-N253 PolarHBondContact CE1-ND2 3.12Å; H91-N253 PolarHBondContact ND1-ND2 3.38Å; H91-N253 VanDerWaalsContact NE2-CB 3.32Å; H91-N253 WeakPolarHBondContact NE2-CB 3.33Å; H91-F286 CarbonylContact C-O 3.5Å; H91-F286 WeakPolarHBondContact CA-O 3.32Å; H91-F286 WeakPolarHBondContact CB-O 3.22Å; H91-E289 HydrophobicContact CB-CB 3.4Å; H91-E289 VanDerWaalsContact CB-CB 3.4Å; H91-E289 HydrophobicContact CB-CG 3.86Å; H91-E289 IonicContact CD2-OE2 3.12Å; H91-E289 IonicContact CE1-OE2 3.11Å; H91-E289 IonicContact NE2-OE2 2.74Å; H91-E289 PolarHBondContact NE2-OE2 3.34Å; H91-E290 IonicContact NE2-OE1 3.7Å
92	L	49.9	Very low	61.1	Low	4 Å²	4	67.7 Å²	67.7	2%	0.021	38%	0.379	C	S	.	.			trans	-129.3	159.4	-177.1	-57.1	173.5	0	0	0	112.4	P28 A31 V32 T68 L254 F286 N288	P28-L92 HydrophobicContact CB-CB 3.86Å; P28-L92 HydrophobicContact CB-CD1 4.42Å; P28-L92 HydrophobicContact CG-CB 4.19Å; A31-L92 HydrophobicContact CB-CD1 4.38Å; A31-L92 HydrophobicContact CB-CD2 3.55Å; V32-L92 HydrophobicContact CG2-CD1 3.59Å; T68-L92 WeakPolarHBondContact O-CD1 3.33Å; L92-L254 HydrophobicContact CD2-CD2 3.54Å; L92-F286 PolarHBondContact N-O 3.46Å; L92-N288 PolarHBondContact O-N 2.85Å
93	K	42.4	Very low	60.7	Low	71 Å²	71	72.8 Å²	72.8	31%	0.309	39%	0.387	S	S	.	.			trans	-122	117.6	-166.3	-65.1	-174.8	158.6	163.2	0	117	P28 Y111 D252 E290	P28-K93 WeakPolarHBondContact CD-O 3.07Å; P28-K93 WeakPolarHBondContact CG-O 3.49Å; K93-Y111 HydrophobicContact CB-CD1 4.37Å; K93-Y111 HydrophobicContact CB-CE1 3.86Å; K93-Y111 HydrophobicContact CG-CE1 4.41Å; K93-D252 WeakPolarHBondContact CE-O 3.4Å; K93-D252 PolarHBondContact NZ-O 3.31Å; K93-D252 IonicContact NZ-OD2 2.64Å; K93-D252 PolarHBondContact NZ-OD2 2.89Å; K93-E290 HydrophobicContact CD-CG 4.28Å; K93-E290 VanDerWaalsContact CE-CD 3.47Å; K93-E290 WeakPolarHBondContact CE-OE1 3.46Å; K93-E290 HydrophobicContact CG-CG 3.87Å; K93-E290 IonicContact NZ-OE1 3.32Å; K93-E290 PolarHBondContact NZ-OE1 3Å
94	P	48	Very low	60.3	Low	5 Å²	5	68.8 Å²	68.8	3%	0.032	37%	0.372	C	S	.	.			trans	-148.4	134.3	168.1	31.3	-10.4	0	0	0	123.9	P28 Y111 Y229 D287	P28-P94 HydrophobicContact CG-CB 3.89Å; P28-P94 HydrophobicContact CG-CG 3.91Å; P94-Y111 WeakPolarHBondContact CD-OH 3.45Å; P94-Y111 WeakPolarHBondContact O-CD2 3.31Å; P94-Y111 WeakPolarHBondContact O-CE2 3.47Å; P94-Y229 HydrophobicContact CB-CD1 4.31Å; P94-Y229 HydrophobicContact CB-CE1 3.16Å; P94-Y229 WeakPolarHBondContact CB-OH 3.49Å; P94-D287 WeakPolarHBondContact CD-OD1 3.28Å; P94-D287 WeakPolarHBondContact CG-OD1 3.4Å; P94-D287 WeakPolarHBondContact CG-OD2 3.14Å
95	N	33.2	Very low	60.1	Low	66 Å²	66	68.1 Å²	68.1	35%	0.353	36%	0.364	S	S	.	.				127.1	123.4	120	-160	15.6	0	0	0	118.9	Y229	N95-Y229 HydrophobicContact CB-CE1 3.91Å; N95-Y229 VanDerWaalsContact N-CE1 3.34Å
96	P	35.3	Very low	59.6	Low	36 Å²	36	66.6 Å²	66.6	23%	0.234	35%	0.354	C	S	.	.			trans	-149.8	158.9	162	21	4.7	0	0	0	121.5	S109	P96-S109 WeakPolarHBondContact CB-O 3.36Å; P96-S109 WeakPolarHBondContact CG-O 3.49Å
97	K	27.1	Very low	59.1	Low	161 Å²	161	61.8 Å²	61.8	70%	0.7	33%	0.332	S	S	*	.			trans	-109.5	166.9	-170.9	-86.4	-177.4	175.1	179.6	0	118	S107 V108 S109	K97-S107 CarbonylContact O-C 3.52Å; K97-V108 CarbonylContact O-C 3.46Å; K97-V108 WeakPolarHBondContact O-CA 3.38Å; K97-V108 PolarHBondContact O-N 3.5Å; K97-S109 PolarHBondContact N-OG 3.04Å; K97-S109 PolarHBondContact O-N 3.4Å; K97-S109 PolarHBondContact O-OG 2.84Å
98	A	32.4	Very low	58.9	Low	61 Å²	61	58.8 Å²	58.8	50%	0.504	32%	0.319	S	S	.	.			trans	-140.9	139.6	-155.5	0	0	0	0	0	124.1	L106 S107	A98-L106 HydrophobicContact CB-CB 3.96Å; A98-L106 HydrophobicContact CB-CD2 4.47Å; A98-S107 VanDerWaalsContact CA-CA 3.47Å; A98-S107 VanDerWaalsContact CA-CB 3.46Å; A98-S107 WeakPolarHBondContact CA-O 3.35Å; A98-S107 WeakPolarHBondContact CB-O 3.23Å
99	S	32.1	Very low	58.6	Low	72 Å²	72	58 Å²	58	50%	0.503	32%	0.316	S	S	.	.			trans	-169.4	129.4	155.7	67.5	0	0	0	0	121.5	S107	S99-S107 WeakPolarHBondContact CA-OG 3.5Å; S99-S107 PolarHBondContact N-OG 2.66Å; S99-S107 PolarHBondContact O-OG 3.27Å
100	C	31.6	Very low	58.9	Low	65 Å²	65	58.6 Å²	58.6	44%	0.439	31%	0.31	S	S	.	.			trans	69.5	147.3	144.2	83.3	0	0	0	0	124.2	Q105 K176	C100-Q105 PolarHBondContact N-O 2.59Å; C100-K176 PolarHBondContact O-NZ 2.86Å
101	K	34.7	Very low	59.1	Low	164 Å²	164	59.7 Å²	59.7	71%	0.713	31%	0.313	S	S	*	.			cis	-163	160.6	32.7	-117.9	178.3	-170.4	178.2	0	114.5	W103 Q105	K101-W103 CarbonylContact C-O 3.49Å; K101-Q105 VanDerWaalsContact N-OE1 3.16Å; K101-Q105 PolarHBondContact O-OE1 3.21Å
102	N	52.6	Low	59.5	Low	130 Å²	130	59.7 Å²	59.7	70%	0.695	32%	0.32	S	S	*	.	S	Bend	trans	89.4	-58.3	179.4	-72.1	-12.7	0	0	0	116.6	T182	N102-T182 WeakPolarHBondContact O-CB 3.37Å; N102-T182 PolarHBondContact O-OG1 3.18Å
103	W	75.7	Confident	61.3	Low	142 Å²	142	63 Å²	63	54%	0.538	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	156.4	154.1	-66.3	83.7	0	0	0	106.7	K101 Q105 I178 A181	K101-W103 CarbonylContact C-O 3.49Å; W103-Q105 HydrophobicContact CB-CG 4.08Å; W103-Q105 PolarHBondContact O-N 3.32Å; W103-I178 HydrophobicContact CB-CB 4.28Å; W103-I178 HydrophobicContact CB-CG2 3.62Å; W103-I178 HydrophobicContact CD2-CG2 4.46Å; W103-I178 HydrophobicContact CE3-CD1 4.43Å; W103-I178 HydrophobicContact CG-CG2 3.94Å; W103-A181 HydrophobicContact CE3-CB 4.26Å; W103-A181 HydrophobicContact CZ3-CB 3.99Å
104	Q	80.5	Confident	63.5	Low	14 Å²	14	61 Å²	61	7%	0.065	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	109.9	164.2	-50.9	-157.6	31.2	0	0	107.1	F179 A180 S203 K204 M206	Q104-F179 VanDerWaalsContact C-CE1 3.41Å; Q104-F179 HydrophobicContact CB-CD1 4.23Å; Q104-F179 HydrophobicContact CB-CD2 4.03Å; Q104-F179 HydrophobicContact CB-CE1 3.71Å; Q104-F179 HydrophobicContact CB-CE2 3.47Å; Q104-F179 VanDerWaalsContact CB-CE2 3.47Å; Q104-F179 HydrophobicContact CB-CG 4.39Å; Q104-F179 HydrophobicContact CB-CZ 3.31Å; Q104-F179 HydrophobicContact CG-CE2 4.35Å; Q104-F179 HydrophobicContact CG-CZ 4.41Å; Q104-F179 WeakPolarHBondContact O-CD1 3.14Å; Q104-F179 WeakPolarHBondContact O-CE1 3.24Å; Q104-F179 PolarHBondContact O-N 3.19Å; Q104-A180 HydrophobicContact CB-CB 4.06Å; Q104-A180 HydrophobicContact CG-CB 4.09Å; Q104-A180 PolarHBondContact N-O 2.86Å; Q104-S203 PolarHBondContact NE2-OG 2.91Å; Q104-K204 PolarHBondContact NE2-O 3.29Å; Q104-K204 VanDerWaalsContact NE2-O 3.16Å; Q104-M206 VanDerWaalsContact OE1-CB 3.26Å
105	Q	83.9	Confident	65.6	Low	46 Å²	46	66.9 Å²	66.9	22%	0.215	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	144.9	-174.9	-75.1	-179.9	-56.1	0	0	110.6	C100 K101 W103 K176 P177 I178	C100-Q105 PolarHBondContact N-O 2.59Å; K101-Q105 VanDerWaalsContact N-OE1 3.16Å; K101-Q105 PolarHBondContact O-OE1 3.21Å; W103-Q105 HydrophobicContact CB-CG 4.08Å; W103-Q105 PolarHBondContact O-N 3.32Å; Q105-K176 HydrophobicContact CB-CB 4.36Å; Q105-K176 HydrophobicContact CG-CB 4.44Å; Q105-K176 PolarHBondContact NE2-O 2.89Å; Q105-P177 VanDerWaalsContact CA-O 3.28Å; Q105-P177 WeakPolarHBondContact CA-O 3.05Å; Q105-I178 HydrophobicContact CG-CG2 3.78Å
106	L	81.8	Confident	68.5	Low	16 Å²	16	66.3 Å²	66.3	8%	0.084	38%	0.376	C	S	.	.			trans	-90.7	131.9	162.1	-55.6	-178.7	0	0	0	107.3	A98 L150 K176 P177 F179 F208	A98-L106 HydrophobicContact CB-CB 3.96Å; A98-L106 HydrophobicContact CB-CD2 4.47Å; L106-L150 HydrophobicContact CD1-CD1 3.88Å; L106-L150 HydrophobicContact CD1-CD2 3.44Å; L106-L150 VanDerWaalsContact CD1-CD2 3.44Å; L106-L150 HydrophobicContact CD1-CG 4.32Å; L106-L150 HydrophobicContact CG-CD2 4.04Å; L106-K176 CarbonylContact O-C 3.6Å; L106-K176 WeakPolarHBondContact O-CA 2.83Å; L106-P177 PolarHBondContact N-O 2.78Å; L106-P177 VanDerWaalsContact O-CD 3.3Å; L106-P177 WeakPolarHBondContact O-CD 3.38Å; L106-F179 HydrophobicContact CD2-CD1 3.93Å; L106-F179 HydrophobicContact CD2-CE1 3.66Å; L106-F179 HydrophobicContact CG-CD1 3.87Å; L106-F179 HydrophobicContact CG-CE1 4.08Å; L106-F208 HydrophobicContact CD1-CD1 4.03Å; L106-F208 HydrophobicContact CD1-CD2 4.43Å; L106-F208 HydrophobicContact CD1-CE1 3.59Å; L106-F208 HydrophobicContact CD1-CE2 4.03Å; L106-F208 HydrophobicContact CD1-CG 4.43Å; L106-F208 HydrophobicContact CD1-CZ 3.6Å; L106-F208 HydrophobicContact CD2-CB 3.92Å; L106-F208 HydrophobicContact CD2-CD1 3.58Å; L106-F208 HydrophobicContact CD2-CD2 4.01Å; L106-F208 HydrophobicContact CD2-CE1 4.05Å; L106-F208 HydrophobicContact CD2-CE2 4.44Å; L106-F208 HydrophobicContact CD2-CG 3.56Å; L106-F208 HydrophobicContact CD2-CZ 4.46Å; L106-F208 HydrophobicContact CG-CD1 4.44Å; L106-F208 HydrophobicContact CG-CE1 4.45Å; L106-F208 HydrophobicContact CG-CG 4.5Å
107	S	80.9	Confident	71.2	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.028	39%	0.391	C	S	.	.			trans	-68.1	162.4	151.1	-44.5	0	0	0	0	107.9	K97 A98 S99	K97-S107 CarbonylContact O-C 3.52Å; A98-S107 VanDerWaalsContact CA-CA 3.47Å; A98-S107 VanDerWaalsContact CA-CB 3.46Å; A98-S107 WeakPolarHBondContact CA-O 3.35Å; A98-S107 WeakPolarHBondContact CB-O 3.23Å; S99-S107 WeakPolarHBondContact CA-OG 3.5Å; S99-S107 PolarHBondContact N-OG 2.66Å; S99-S107 PolarHBondContact O-OG 3.27Å
108	V	85.2	Confident	74.4	Confident	23 Å²	23	66.4 Å²	66.4	14%	0.139	37%	0.374	C	S	.	.			trans	-135.8	143.8	162.2	-65.4	0	0	0	0	105.3	K97 L175 P177 L230	K97-V108 CarbonylContact O-C 3.46Å; K97-V108 WeakPolarHBondContact O-CA 3.38Å; K97-V108 PolarHBondContact O-N 3.5Å; V108-L175 HydrophobicContact CG2-CB 3.84Å; V108-L175 VanDerWaalsContact CG2-O 3.28Å; V108-L175 WeakPolarHBondContact CG2-O 3.08Å; V108-L175 PolarHBondContact N-O 3.05Å; V108-P177 HydrophobicContact CG1-CG 4.36Å; V108-L230 HydrophobicContact CG1-CD1 3.98Å; V108-L230 HydrophobicContact CG1-CD2 4.19Å
109	S	83.3	Confident	77.4	Confident	55 Å²	55	67.2 Å²	67.2	39%	0.385	36%	0.364	S	S	.	.			trans	-72.9	170.6	157.1	-20.2	0	0	0	0	109.9	P96 K97	P96-S109 WeakPolarHBondContact CB-O 3.36Å; P96-S109 WeakPolarHBondContact CG-O 3.49Å; K97-S109 PolarHBondContact N-OG 3.04Å; K97-S109 PolarHBondContact O-N 3.4Å; K97-S109 PolarHBondContact O-OG 2.84Å
110	T	88.9	Confident	80.4	Confident	64 Å²	64	64.7 Å²	64.7	39%	0.393	34%	0.344	S	S	.	.			trans	-100.9	148.3	171.2	45.9	0	0	0	0	109.1	W116 A171 L175	T110-W116 VanDerWaalsContact CB-CZ2 3.41Å; T110-W116 HydrophobicContact CG2-CD2 3.83Å; T110-W116 VanDerWaalsContact CG2-CE2 3.45Å; T110-W116 HydrophobicContact CG2-CE3 4.37Å; T110-W116 HydrophobicContact CG2-CG 4.29Å; T110-W116 HydrophobicContact CG2-CH2 4.31Å; T110-W116 HydrophobicContact CG2-CZ2 3.75Å; T110-A171 HydrophobicContact CG2-CB 4.29Å; T110-L175 HydrophobicContact CG2-CD1 3.49Å; T110-L175 VanDerWaalsContact CG2-CD1 3.49Å
111	Y	84.4	Confident	83.5	Confident	30 Å²	30	65 Å²	65	12%	0.118	34%	0.341	C	S	.	.			trans	-127.6	121	175	175.1	-92.9	0	0	0	110.7	K93 P94 W116 N288 E290 V291	K93-Y111 HydrophobicContact CB-CD1 4.37Å; K93-Y111 HydrophobicContact CB-CE1 3.86Å; K93-Y111 HydrophobicContact CG-CE1 4.41Å; P94-Y111 WeakPolarHBondContact CD-OH 3.45Å; P94-Y111 WeakPolarHBondContact O-CD2 3.31Å; P94-Y111 WeakPolarHBondContact O-CE2 3.47Å; Y111-W116 VanDerWaalsContact O-CH2 3.25Å; Y111-W116 WeakPolarHBondContact O-CH2 3.3Å; Y111-N288 VanDerWaalsContact OH-CA 3.32Å; Y111-N288 WeakPolarHBondContact OH-CA 3.33Å; Y111-E290 HydrophobicContact CD1-CB 4.47Å; Y111-E290 HydrophobicContact CE1-CB 3.62Å; Y111-E290 HydrophobicContact CE1-CG 3.97Å; Y111-V291 HydrophobicContact CD2-CG1 3.62Å; Y111-V291 HydrophobicContact CE2-CB 4.11Å; Y111-V291 HydrophobicContact CE2-CG1 3.23Å; Y111-V291 HydrophobicContact CE2-CG2 3.76Å
112	G	86	Confident	86.4	Confident	25 Å²	25	62.3 Å²	62.3	26%	0.258	33%	0.327	S	S	.	.	S	Bend	trans	73.2	-171.1	-177.3	0	0	0	0	0	114.1	G114 W116	G112-G114 VanDerWaalsContact C-N 3.26Å; G112-G114 PolarHBondContact O-N 2.5Å; G112-G114 VanDerWaalsContact O-N 3.16Å; G112-W116 WeakPolarHBondContact O-CZ2 3.45Å
113	G	86.6	Confident	88.5	Confident	74 Å²	74	60.4 Å²	60.4	76%	0.763	32%	0.316	S	S	*	.	S	Bend	trans	-85.9	47.4	-179.7	0	0	0	0	0	113.9
114	G	89	Confident	89.5	Confident	28 Å²	28	53.7 Å²	53.7	29%	0.289	29%	0.291	S	S	.	.			trans	-62.4	144.9	-173.7	0	0	0	0	0	114.1	G112 W116	G112-G114 VanDerWaalsContact C-N 3.26Å; G112-G114 PolarHBondContact O-N 2.5Å; G112-G114 VanDerWaalsContact O-N 3.16Å; G114-W116 PolarHBondContact O-N 2.79Å; G114-W116 PolarHBondContact O-NE1 2.89Å
115	M	92.4	Very high	90.2	Very high	128 Å²	128	53 Å²	53	63%	0.631	29%	0.288	S	S	*	.			trans	-76.9	70.6	165	-69.8	-169.9	-70.4	0	0	110.1	R117 T118	M115-R117 PolarHBondContact O-N 2.82Å; M115-T118 HydrophobicContact CB-CG2 4.08Å; M115-T118 PolarHBondContact O-N 3.35Å; M115-T118 PolarHBondContact O-OG1 2.9Å
116	W	93.5	Very high	90.6	Very high	55 Å²	55	51 Å²	51	21%	0.208	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-53.3	-28.7	-170.3	-60.1	125.5	0	0	0	115.2	T110 Y111 G112 G114 T118 W119 F169 L175	T110-W116 VanDerWaalsContact CB-CZ2 3.41Å; T110-W116 HydrophobicContact CG2-CD2 3.83Å; T110-W116 VanDerWaalsContact CG2-CE2 3.45Å; T110-W116 HydrophobicContact CG2-CE3 4.37Å; T110-W116 HydrophobicContact CG2-CG 4.29Å; T110-W116 HydrophobicContact CG2-CH2 4.31Å; T110-W116 HydrophobicContact CG2-CZ2 3.75Å; Y111-W116 VanDerWaalsContact O-CH2 3.25Å; Y111-W116 WeakPolarHBondContact O-CH2 3.3Å; G112-W116 WeakPolarHBondContact O-CZ2 3.45Å; G114-W116 PolarHBondContact O-N 2.79Å; G114-W116 PolarHBondContact O-NE1 2.89Å; W116-T118 PolarHBondContact O-N 3.04Å; W116-T118 VanDerWaalsContact O-N 3.15Å; W116-W119 AromaticContact CE3-CD1 3.87Å; W116-W119 HydrophobicContact CE3-CG 4.42Å; W116-W119 AromaticContact CE3-NE1 3.72Å; W116-W119 AromaticContact CZ3-CE2 4Å; W116-W119 HydrophobicContact CZ3-CZ2 4.28Å; W116-W119 AromaticContact CZ3-NE1 3.79Å; W116-W119 WeakPolarHBondContact O-CB 3.26Å; W116-W119 PolarHBondContact O-N 2.83Å; W116-W119 VanDerWaalsContact O-N 3.09Å; W116-F169 HydrophobicContact CB-CE2 4.13Å; W116-F169 HydrophobicContact CB-CZ 3.6Å; W116-L175 HydrophobicContact CB-CD1 4.22Å; W116-L175 HydrophobicContact CB-CD2 4.43Å; W116-L175 HydrophobicContact CD2-CD1 4.33Å; W116-L175 HydrophobicContact CG-CD1 4.13Å
117	R	93	Very high	91.2	Very high	142 Å²	142	50.2 Å²	50.2	54%	0.536	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-56.2	-29.5	173.4	79.1	-179	-151.7	-70.7	-4.2	113.7	M115 W119 F120 F167 F169	M115-R117 PolarHBondContact O-N 2.82Å; R117-W119 PolarHBondContact O-N 2.94Å; R117-F120 PolarHBondContact O-N 2.84Å; R117-F167 HydrophobicContact CB-CD1 3.8Å; R117-F167 HydrophobicContact CB-CE1 3.82Å; R117-F169 HydrophobicContact CB-CE1 4.39Å
118	T	94.7	Very high	91.7	Very high	57 Å²	57	50 Å²	50	35%	0.35	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-78.2	-7.9	-178	70	0	0	0	0	113.4	M115 W116 R122	M115-T118 HydrophobicContact CB-CG2 4.08Å; M115-T118 PolarHBondContact O-N 3.35Å; M115-T118 PolarHBondContact O-OG1 2.9Å; W116-T118 PolarHBondContact O-N 3.04Å; W116-T118 VanDerWaalsContact O-N 3.15Å; T118-R122 WeakPolarHBondContact O-CG 3.5Å
119	W	95.3	Very high	92.2	Very high	78 Å²	78	49.7 Å²	49.7	30%	0.295	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-85.6	-18.5	176.2	-70.4	72.2	0	0	0	112.5	W116 R117 L124 L152 L230	W116-W119 AromaticContact CE3-CD1 3.87Å; W116-W119 HydrophobicContact CE3-CG 4.42Å; W116-W119 AromaticContact CE3-NE1 3.72Å; W116-W119 AromaticContact CZ3-CE2 4Å; W116-W119 HydrophobicContact CZ3-CZ2 4.28Å; W116-W119 AromaticContact CZ3-NE1 3.79Å; W116-W119 WeakPolarHBondContact O-CB 3.26Å; W116-W119 PolarHBondContact O-N 2.83Å; W116-W119 VanDerWaalsContact O-N 3.09Å; R117-W119 PolarHBondContact O-N 2.94Å; W119-L124 HydrophobicContact CE3-CD1 4.43Å; W119-L124 HydrophobicContact CE3-CD2 4.07Å; W119-L124 HydrophobicContact CZ3-CD2 4.34Å; W119-L152 HydrophobicContact CB-CD2 4.11Å; W119-L230 WeakPolarHBondContact CH2-O 3.41Å; W119-L230 HydrophobicContact CZ3-CB 3.85Å; W119-L230 WeakPolarHBondContact CZ3-O 3.31Å
120	F	95.4	Very high	92.6	Very high	18 Å²	18	47 Å²	47	8%	0.079	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	148.7	173.4	-70.7	-100	0	0	0	110.6	R117 R122 L152 P153 N154 F167 F169 A174 L175	R117-F120 PolarHBondContact O-N 2.84Å; F120-R122 PolarHBondContact O-N 3.19Å; F120-L152 CarbonylContact C-O 3.32Å; F120-L152 VanDerWaalsContact CA-O 3.27Å; F120-L152 WeakPolarHBondContact CA-O 3.37Å; F120-L152 HydrophobicContact CD1-CD2 4.09Å; F120-L152 HydrophobicContact CD1-CG 3.78Å; F120-L152 HydrophobicContact CD2-CD2 3.94Å; F120-L152 HydrophobicContact CE1-CD1 4.29Å; F120-L152 HydrophobicContact CE1-CD2 4.19Å; F120-L152 HydrophobicContact CE1-CG 3.98Å; F120-L152 HydrophobicContact CE2-CD2 4.07Å; F120-L152 HydrophobicContact CG-CD2 3.97Å; F120-L152 HydrophobicContact CG-CG 4.08Å; F120-L152 HydrophobicContact CZ-CD2 4.19Å; F120-L152 HydrophobicContact CZ-CG 4.45Å; F120-P153 WeakPolarHBondContact CD1-O 3.46Å; F120-N154 WeakPolarHBondContact CB-ND2 3.49Å; F120-N154 WeakPolarHBondContact CD1-OD1 3.25Å; F120-F167 HydrophobicContact CD2-CE1 4.35Å; F120-F167 HydrophobicContact CD2-CZ 4.27Å; F120-F167 HydrophobicContact CE2-CE1 4.17Å; F120-F167 HydrophobicContact CE2-CZ 4.31Å; F120-F167 HydrophobicContact CG-CZ 4.43Å; F120-F169 HydrophobicContact CE2-CD1 4.38Å; F120-F169 HydrophobicContact CE2-CD2 4.41Å; F120-F169 HydrophobicContact CE2-CE1 4.17Å; F120-F169 HydrophobicContact CE2-CE2 4.18Å; F120-F169 HydrophobicContact CE2-CZ 4.05Å; F120-F169 HydrophobicContact CZ-CD2 4.29Å; F120-F169 HydrophobicContact CZ-CE2 4.47Å; F120-F169 HydrophobicContact CZ-CG 4.35Å; F120-A174 HydrophobicContact CZ-CB 4.12Å; F120-L175 HydrophobicContact CE2-CD2 3.65Å; F120-L175 HydrophobicContact CZ-CD2 3.86Å
121	D	96.7	Very high	92.9	Very high	73 Å²	73	46.7 Å²	46.7	39%	0.39	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	39.3	-178.6	-60.2	-30.7	0	0	0	114.1	Y151 L152 N154	D121-Y151 VanDerWaalsContact CA-OH 3.24Å; D121-Y151 WeakPolarHBondContact CA-OH 3.47Å; D121-Y151 VanDerWaalsContact CB-OH 3.23Å; D121-Y151 WeakPolarHBondContact CB-OH 3.16Å; D121-Y151 VanDerWaalsContact CG-OH 3.29Å; D121-Y151 PolarHBondContact OD1-OH 3.28Å; D121-L152 PolarHBondContact N-O 3.49Å; D121-N154 PolarHBondContact OD1-N 3.38Å; D121-N154 WeakPolarHBondContact OD2-CB 3.4Å; D121-N154 PolarHBondContact OD2-ND2 3.01Å
122	R	95.4	Very high	93.4	Very high	107 Å²	107	45.3 Å²	45.3	40%	0.404	24%	0.239	S	C	.	.			trans	-111.6	143.7	173.3	-65.6	-61.2	-169.3	157	-1.8	110.7	T118 F120 L124 Y151 E234	T118-R122 WeakPolarHBondContact O-CG 3.5Å; F120-R122 PolarHBondContact O-N 3.19Å; R122-L124 HydrophobicContact CB-CD2 3.86Å; R122-L124 HydrophobicContact CB-CG 4.13Å; R122-L124 WeakPolarHBondContact O-CG 3.43Å; R122-L124 PolarHBondContact O-N 3.35Å; R122-Y151 VanDerWaalsContact O-CD2 3.31Å; R122-Y151 WeakPolarHBondContact O-CD2 3.41Å; R122-E234 IonicContact CZ-OE2 3.87Å; R122-E234 IonicContact NH1-OE2 2.71Å; R122-E234 PolarHBondContact NH1-OE2 3.47Å
123	D	96.9	Very high	94	Very high	89 Å²	89	49.6 Å²	49.6	48%	0.476	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	108.3	164	-74.8	3.6	0	0	0	108.4	P148 P232 T233	D123-P148 HydrophobicContact CB-CB 4.02Å; D123-P232 WeakPolarHBondContact O-CA 3.21Å; D123-T233 VanDerWaalsContact CB-OG1 3.27Å; D123-T233 WeakPolarHBondContact CB-OG1 3.43Å; D123-T233 PolarHBondContact O-N 2.92Å; D123-T233 PolarHBondContact O-OG1 2.91Å
124	L	95.9	Very high	94.3	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	153.1	-175.5	-59.5	173.6	0	0	0	110.7	W119 R122 I149 L150 L152 L230 C231	W119-L124 HydrophobicContact CE3-CD1 4.43Å; W119-L124 HydrophobicContact CE3-CD2 4.07Å; W119-L124 HydrophobicContact CZ3-CD2 4.34Å; R122-L124 HydrophobicContact CB-CD2 3.86Å; R122-L124 HydrophobicContact CB-CG 4.13Å; R122-L124 WeakPolarHBondContact O-CG 3.43Å; R122-L124 PolarHBondContact O-N 3.35Å; L124-I149 PolarHBondContact O-N 2.85Å; L124-L150 WeakPolarHBondContact CA-O 3.5Å; L124-L150 HydrophobicContact CB-CB 3.74Å; L124-L150 WeakPolarHBondContact CB-O 3.19Å; L124-L150 PolarHBondContact N-O 2.89Å; L124-L150 PolarHBondContact O-N 3.28Å; L124-L152 HydrophobicContact CD1-CB 4.17Å; L124-L230 HydrophobicContact CD1-CD2 4.02Å; L124-C231 CarbonylContact C-O 3.52Å; L124-C231 WeakPolarHBondContact CA-O 3.29Å
125	S	94.8	Very high	94.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	-174.5	172.2	-166.9	0	0	0	0	111	I145 R147 L230 C231 T233	S125-I145 WeakPolarHBondContact CB-O 3.38Å; S125-I145 WeakPolarHBondContact OG-CB 3.5Å; S125-I145 PolarHBondContact OG-O 3.39Å; S125-R147 WeakPolarHBondContact CB-O 3.32Å; S125-R147 PolarHBondContact OG-O 2.96Å; S125-R147 VanDerWaalsContact OG-O 3.06Å; S125-L230 CarbonylContact O-C 3.52Å; S125-L230 VanDerWaalsContact O-CA 3.27Å; S125-L230 WeakPolarHBondContact O-CA 2.77Å; S125-C231 PolarHBondContact N-O 2.84Å; S125-C231 PolarHBondContact O-N 3.09Å; S125-T233 VanDerWaalsContact CB-CG2 3.49Å
126	V	92.2	Very high	94.6	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.012	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.2	179.2	176.4	0	0	0	0	111.2	I145 I149 L150 F208 I212 L228 Y229	V126-I145 PolarHBondContact O-N 3.24Å; V126-I149 HydrophobicContact CB-CD1 4.26Å; V126-I149 HydrophobicContact CG2-CD1 4.03Å; V126-L150 HydrophobicContact CG2-CD1 3.48Å; V126-L150 VanDerWaalsContact CG2-CD1 3.48Å; V126-F208 HydrophobicContact CG2-CE1 3.98Å; V126-F208 HydrophobicContact CG2-CZ 3.64Å; V126-I212 HydrophobicContact CG1-CG2 4.36Å; V126-L228 HydrophobicContact CG1-CB 3.89Å; V126-L228 HydrophobicContact CG1-CD1 4.08Å; V126-L228 HydrophobicContact CG1-CD2 3.91Å; V126-L228 HydrophobicContact CG1-CG 4.16Å; V126-Y229 VanDerWaalsContact CA-O 3.3Å; V126-Y229 WeakPolarHBondContact CA-O 2.88Å
127	C	94.4	Very high	94.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	165.4	166.7	60.8	0	0	0	0	110.6	V26 V143 H144 L228 Y229	V26-C127 HydrophobicContact CB-CB 4.24Å; V26-C127 HydrophobicContact CG2-CB 3.54Å; V26-C127 PolarHBondContact O-SG 3.28Å; C127-V143 CarbonylContact C-O 3.51Å; C127-V143 WeakPolarHBondContact CA-O 3.39Å; C127-H144 HydrophobicContact CB-CB 4.12Å; C127-L228 CarbonylContact O-C 3.53Å; C127-L228 WeakPolarHBondContact O-CA 3.43Å; C127-Y229 PolarHBondContact N-O 3.44Å; C127-Y229 WeakPolarHBondContact O-CD2 3.39Å; C127-Y229 PolarHBondContact O-N 3.15Å
128	G	92.7	Very high	94.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.1	-135.8	177.1	0	0	0	0	0	112.4	H30 L142 V143 E227	H30-G128 PolarHBondContact CE1-O 3.12Å; G128-L142 WeakPolarHBondContact O-CA 3.43Å; G128-V143 PolarHBondContact N-O 2.83Å; G128-V143 PolarHBondContact O-N 2.92Å; G128-E227 CarbonylContact C-O 3.51Å; G128-E227 WeakPolarHBondContact CA-O 3.32Å
129	R	94.1	Very high	94.8	Very high	16 Å²	16	56.7 Å²	56.7	6%	0.06	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	150.5	176.6	72.3	-172.1	164.6	172.8	-0.7	113.6	M29 N66 F131 K141 L142 F226 E227	M29-R129 HydrophobicContact CE-CB 4.4Å; M29-R129 HydrophobicContact CE-CG 3.72Å; N66-R129 PolarHBondContact ND2-NH2 3.44Å; N66-R129 PolarHBondContact O-NH1 3.3Å; N66-R129 PolarHBondContact OD1-NH1 3.01Å; N66-R129 PolarHBondContact OD1-NH2 2.85Å; R129-F131 HydrophobicContact CG-CE2 4.27Å; R129-K141 CarbonylContact C-O 3.58Å; R129-K141 WeakPolarHBondContact CA-O 3.44Å; R129-K141 WeakPolarHBondContact CB-O 3.45Å; R129-L142 HydrophobicContact CB-CD2 3.8Å; R129-F226 WeakPolarHBondContact O-CA 3.23Å; R129-E227 HydrophobicContact CG-CB 4.09Å; R129-E227 IonicContact CZ-OE2 3.73Å; R129-E227 PolarHBondContact N-O 3.06Å; R129-E227 IonicContact NE-OE2 2.74Å; R129-E227 PolarHBondContact NE-OE2 2.89Å; R129-E227 IonicContact NH2-OE2 2.7Å; R129-E227 PolarHBondContact NH2-OE2 3.11Å; R129-E227 PolarHBondContact O-N 3.26Å
130	F	92.8	Very high	94.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	144.3	160.7	-72.3	-79.8	0	0	0	110.2	V132 A140 K141 V143 V209 I212 A213 I218 I223 F226 L228	F130-V132 HydrophobicContact CB-CG2 3.68Å; F130-A140 CarbonylContact O-C 3.59Å; F130-A140 WeakPolarHBondContact O-CA 3.03Å; F130-K141 PolarHBondContact N-O 2.87Å; F130-K141 PolarHBondContact O-N 3.48Å; F130-V143 HydrophobicContact CD2-CB 4.31Å; F130-V143 HydrophobicContact CD2-CG1 3.61Å; F130-V143 HydrophobicContact CD2-CG2 3.8Å; F130-V143 HydrophobicContact CE2-CB 4.38Å; F130-V143 HydrophobicContact CE2-CG1 4Å; F130-V143 HydrophobicContact CE2-CG2 3.82Å; F130-V209 HydrophobicContact CE1-CG1 3.72Å; F130-V209 HydrophobicContact CZ-CG1 4.36Å; F130-I212 HydrophobicContact CE2-CG2 4.02Å; F130-I212 HydrophobicContact CZ-CB 4.37Å; F130-I212 HydrophobicContact CZ-CG2 4.03Å; F130-A213 HydrophobicContact CE1-CB 4.34Å; F130-A213 HydrophobicContact CE2-CB 4.25Å; F130-A213 HydrophobicContact CZ-CB 4Å; F130-I218 HydrophobicContact CB-CD1 4.07Å; F130-I218 HydrophobicContact CD2-CD1 3.7Å; F130-I218 HydrophobicContact CG-CD1 4.17Å; F130-I223 HydrophobicContact CD1-CD1 3.94Å; F130-I223 HydrophobicContact CD1-CG1 4.12Å; F130-I223 HydrophobicContact CD1-CG2 3.86Å; F130-I223 HydrophobicContact CE1-CD1 3.87Å; F130-I223 HydrophobicContact CE1-CG2 4.42Å; F130-F226 HydrophobicContact CD1-CB 3.55Å; F130-F226 HydrophobicContact CD1-CG 4.49Å; F130-F226 HydrophobicContact CE1-CB 3.73Å; F130-F226 HydrophobicContact CE1-CD1 4.46Å; F130-F226 HydrophobicContact CE1-CG 4.28Å; F130-F226 HydrophobicContact CG-CB 4.41Å; F130-L228 HydrophobicContact CE1-CD1 4.36Å; F130-L228 HydrophobicContact CE2-CD2 4.31Å; F130-L228 HydrophobicContact CZ-CD1 4.03Å; F130-L228 HydrophobicContact CZ-CD2 4.37Å
131	F	94.7	Very high	94.8	Very high	56 Å²	56	58.2 Å²	58.2	25%	0.246	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	111.8	163.7	-65.8	-84.4	0	0	0	107.6	R129 V138 K139 A140 V224 S225	R129-F131 HydrophobicContact CG-CE2 4.27Å; F131-V138 HydrophobicContact CB-CG1 3.91Å; F131-K139 WeakPolarHBondContact CA-O 2.76Å; F131-A140 HydrophobicContact CD1-CB 4.22Å; F131-A140 HydrophobicContact CE1-CB 4.13Å; F131-V224 HydrophobicContact CB-CB 4.48Å; F131-V224 PolarHBondContact O-N 3.07Å; F131-S225 PolarHBondContact N-O 2.65Å; F131-S225 PolarHBondContact O-N 2.92Å
132	V	95.6	Very high	94.7	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.2	-169.6	-174.2	0	0	0	0	109.2	F130 V138 K139 K141 I218 D222	F130-V132 HydrophobicContact CB-CG2 3.68Å; V132-V138 WeakPolarHBondContact O-CA 3.17Å; V132-K139 PolarHBondContact N-O 3.16Å; V132-K139 PolarHBondContact O-N 2.9Å; V132-K141 HydrophobicContact CB-CD 4.44Å; V132-K141 HydrophobicContact CG2-CD 4.13Å; V132-K141 HydrophobicContact CG2-CG 4.37Å; V132-I218 HydrophobicContact CG1-CG2 4.18Å; V132-I218 HydrophobicContact CG2-CD1 4.26Å; V132-I218 HydrophobicContact CG2-CG2 3.7Å; V132-D222 CarbonylContact C-O 3.29Å; V132-D222 WeakPolarHBondContact CA-O 3.37Å; V132-D222 HydrophobicContact CG1-CB 3.52Å
133	K	96.9	Very high	94.7	Very high	114 Å²	114	53 Å²	53	50%	0.496	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	124.6	171.2	-172.2	179	178.1	-175.7	0	109.1	G135 D222 V224	K133-G135 WeakPolarHBondContact CE-O 3.28Å; K133-G135 WeakPolarHBondContact CG-O 3.46Å; K133-D222 PolarHBondContact N-O 3.47Å; K133-V224 HydrophobicContact CB-CG2 4.22Å
134	E	94.4	Very high	94.6	Very high	65 Å²	65	51.6 Å²	51.6	30%	0.304	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	97.2	171.7	-69.5	-168.1	172.2	0	0	108.4	D136 K137 K139 K141	E134-D136 PolarHBondContact O-N 3.21Å; E134-K137 PolarHBondContact N-O 2.92Å; E134-K137 PolarHBondContact O-N 2.97Å; E134-K139 WeakPolarHBondContact OE2-CD 3.45Å; E134-K139 WeakPolarHBondContact OE2-CE 3.33Å; E134-K139 IonicContact OE2-NZ 2.97Å; E134-K139 PolarHBondContact OE2-NZ 2.92Å; E134-K141 WeakPolarHBondContact OE1-CE 3.45Å; E134-K141 IonicContact OE1-NZ 2.83Å; E134-K141 PolarHBondContact OE1-NZ 3.17Å
135	G	92.6	Very high	94.6	Very high	59 Å²	59	52.1 Å²	52.1	61%	0.608	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	-122.7	-169.7	0	0	0	0	0	111.1	K133	K133-G135 WeakPolarHBondContact CE-O 3.28Å; K133-G135 WeakPolarHBondContact CG-O 3.46Å
136	D	93.9	Very high	94.6	Very high	171 Å²	171	57.1 Å²	57.1	91%	0.914	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	3.3	178.8	-61.8	-35.4	0	0	0	113.7	E134	E134-D136 PolarHBondContact O-N 3.21Å
137	K	95.1	Very high	94.8	Very high	150 Å²	150	63 Å²	63	65%	0.652	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	155.2	-178.8	-63.6	-175	-179.2	-177.2	0	111	E134	E134-K137 PolarHBondContact N-O 2.92Å; E134-K137 PolarHBondContact O-N 2.97Å
138	V	95.5	Very high	94.9	Very high	82 Å²	82	66.2 Å²	66.2	50%	0.497	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.9	168.4	-178.6	0	0	0	0	108.1	F131 V132 V224	F131-V138 HydrophobicContact CB-CG1 3.91Å; V132-V138 WeakPolarHBondContact O-CA 3.17Å; V138-V224 HydrophobicContact CG1-CB 4.46Å; V138-V224 HydrophobicContact CG1-CG2 4.26Å; V138-V224 HydrophobicContact CG2-CG2 4.11Å
139	K	94.9	Very high	94.9	Very high	106 Å²	106	67.6 Å²	67.6	46%	0.461	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	145.3	177.6	-63.9	-165.7	-164.8	154.8	0	111.3	F131 V132 E134	F131-K139 WeakPolarHBondContact CA-O 2.76Å; V132-K139 PolarHBondContact N-O 3.16Å; V132-K139 PolarHBondContact O-N 2.9Å; E134-K139 WeakPolarHBondContact OE2-CD 3.45Å; E134-K139 WeakPolarHBondContact OE2-CE 3.33Å; E134-K139 IonicContact OE2-NZ 2.97Å; E134-K139 PolarHBondContact OE2-NZ 2.92Å
140	A	94.6	Very high	94.9	Very high	56 Å²	56	67.1 Å²	67.1	46%	0.463	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.4	170.1	0	0	0	0	0	110.1	F130 F131	F130-A140 CarbonylContact O-C 3.59Å; F130-A140 WeakPolarHBondContact O-CA 3.03Å; F131-A140 HydrophobicContact CD1-CB 4.22Å; F131-A140 HydrophobicContact CE1-CB 4.13Å
141	K	95.7	Very high	95	Very high	72 Å²	72	70.9 Å²	70.9	31%	0.313	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120	172.4	-70.6	-171.4	176.5	173.6	0	109.6	R129 F130 V132 E134 I218	R129-K141 CarbonylContact C-O 3.58Å; R129-K141 WeakPolarHBondContact CA-O 3.44Å; R129-K141 WeakPolarHBondContact CB-O 3.45Å; F130-K141 PolarHBondContact N-O 2.87Å; F130-K141 PolarHBondContact O-N 3.48Å; V132-K141 HydrophobicContact CB-CD 4.44Å; V132-K141 HydrophobicContact CG2-CD 4.13Å; V132-K141 HydrophobicContact CG2-CG 4.37Å; E134-K141 WeakPolarHBondContact OE1-CE 3.45Å; E134-K141 IonicContact OE1-NZ 2.83Å; E134-K141 PolarHBondContact OE1-NZ 3.17Å; K141-I218 HydrophobicContact CB-CD1 3.99Å; K141-I218 HydrophobicContact CD-CD1 4.01Å; K141-I218 HydrophobicContact CD-CG1 4.02Å
142	L	96.1	Very high	95	Very high	63 Å²	63	68.5 Å²	68.5	33%	0.33	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	140.2	174.8	-58.3	-168.1	0	0	0	110.3	M29 K33 G128 R129	M29-L142 HydrophobicContact CB-CD1 4.16Å; M29-L142 HydrophobicContact CB-CD2 3.49Å; M29-L142 VanDerWaalsContact CB-CD2 3.49Å; M29-L142 HydrophobicContact CB-CG 4.49Å; M29-L142 HydrophobicContact CG-CD2 4.05Å; K33-L142 HydrophobicContact CB-CD1 3.99Å; K33-L142 HydrophobicContact CD-CD1 3.78Å; K33-L142 HydrophobicContact CG-CD1 4.45Å; G128-L142 WeakPolarHBondContact O-CA 3.43Å; R129-L142 HydrophobicContact CB-CD2 3.8Å
143	V	95.1	Very high	94.9	Very high	8 Å²	8	71 Å²	71	5%	0.048	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	144.2	-177.9	-67.8	0	0	0	0	111	H30 C127 G128 F130 C216 I218 L228	H30-V143 PolarHBondContact CE1-O 3.47Å; C127-V143 CarbonylContact C-O 3.51Å; C127-V143 WeakPolarHBondContact CA-O 3.39Å; G128-V143 PolarHBondContact N-O 2.83Å; G128-V143 PolarHBondContact O-N 2.92Å; F130-V143 HydrophobicContact CD2-CB 4.31Å; F130-V143 HydrophobicContact CD2-CG1 3.61Å; F130-V143 HydrophobicContact CD2-CG2 3.8Å; F130-V143 HydrophobicContact CE2-CB 4.38Å; F130-V143 HydrophobicContact CE2-CG1 4Å; F130-V143 HydrophobicContact CE2-CG2 3.82Å; V143-C216 HydrophobicContact CB-CB 4.29Å; V143-C216 VanDerWaalsContact CB-SG 3.58Å; V143-C216 HydrophobicContact CG1-CB 3.57Å; V143-C216 VanDerWaalsContact CG1-SG 3.56Å; V143-I218 HydrophobicContact CG1-CD1 3.84Å; V143-L228 HydrophobicContact CG2-CD2 3.7Å
144	H	95.2	Very high	94.7	Very high	59 Å²	59	68.2 Å²	68.2	27%	0.273	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	123.1	172.5	176.6	-144.9	0	0	0	108.7	V26 C127 D146	V26-H144 HydrophobicContact CG2-CB 4.46Å; C127-H144 HydrophobicContact CB-CB 4.12Å; H144-D146 IonicContact CE1-OD1 3.33Å
145	I	95.2	Very high	94.6	Very high	13 Å²	13	69.7 Å²	69.7	7%	0.067	37%	0.37	C	S	.	.			trans	-91.3	104	173.2	-57.3	-57.4	0	0	0	108	S125 V126 R147 I149 I212 L215 C216	S125-I145 WeakPolarHBondContact CB-O 3.38Å; S125-I145 WeakPolarHBondContact OG-CB 3.5Å; S125-I145 PolarHBondContact OG-O 3.39Å; V126-I145 PolarHBondContact O-N 3.24Å; I145-R147 HydrophobicContact CG2-CG 3.74Å; I145-R147 PolarHBondContact O-N 3.24Å; I145-I149 HydrophobicContact CB-CD1 4.26Å; I145-I149 HydrophobicContact CG1-CD1 4.4Å; I145-I149 HydrophobicContact CG2-CD1 4.15Å; I145-I149 HydrophobicContact CG2-CG1 4.48Å; I145-I149 HydrophobicContact CG2-CG2 4.02Å; I145-I212 HydrophobicContact CG1-CD1 4.2Å; I145-I212 HydrophobicContact CG1-CG2 4.32Å; I145-L215 HydrophobicContact CD1-CB 3.62Å; I145-L215 HydrophobicContact CD1-CD1 4.24Å; I145-C216 WeakPolarHBondContact CD1-SG 3.41Å
146	D	94.3	Very high	94.6	Very high	106 Å²	106	69.4 Å²	69.4	57%	0.567	36%	0.362	S	S	*	.			trans	-84.2	54	-175.4	-162.5	20.2	0	0	0	112.5	H144 R235	H144-D146 IonicContact CE1-OD1 3.33Å; D146-R235 IonicContact OD2-NH1 2.75Å
147	R	96.3	Very high	94.6	Very high	126 Å²	126	64.7 Å²	64.7	48%	0.475	34%	0.336	S	S	.	.	S	Bend	trans	-161.3	154.4	173.9	64.6	178.6	-176.8	89.3	-0.1	110.8	S125 I145 I149	S125-R147 WeakPolarHBondContact CB-O 3.32Å; S125-R147 PolarHBondContact OG-O 2.96Å; S125-R147 VanDerWaalsContact OG-O 3.06Å; I145-R147 HydrophobicContact CG2-CG 3.74Å; I145-R147 PolarHBondContact O-N 3.24Å; R147-I149 HydrophobicContact CG-CG2 4.15Å; R147-I149 VanDerWaalsContact NH1-CG2 3.32Å; R147-I149 PolarHBondContact O-N 3.45Å
148	P	96.7	Very high	94.6	Very high	67 Å²	67	64.9 Å²	64.9	44%	0.435	34%	0.339	S	S	.	.			trans	-67.4	126.7	178.6	25.9	-33.8	0	0	0	111	D123 T233	D123-P148 HydrophobicContact CB-CB 4.02Å; P148-T233 HydrophobicContact CB-CG2 4.36Å
149	I	94	Very high	94.4	Very high	29 Å²	29	67.4 Å²	67.4	15%	0.149	35%	0.349	C	S	.	.			trans	-134.5	-9	178.6	54	161.4	0	0	0	112.8	L124 V126 I145 R147 F179 F208 I212	L124-I149 PolarHBondContact O-N 2.85Å; V126-I149 HydrophobicContact CB-CD1 4.26Å; V126-I149 HydrophobicContact CG2-CD1 4.03Å; I145-I149 HydrophobicContact CB-CD1 4.26Å; I145-I149 HydrophobicContact CG1-CD1 4.4Å; I145-I149 HydrophobicContact CG2-CD1 4.15Å; I145-I149 HydrophobicContact CG2-CG1 4.48Å; I145-I149 HydrophobicContact CG2-CG2 4.02Å; R147-I149 HydrophobicContact CG-CG2 4.15Å; R147-I149 VanDerWaalsContact NH1-CG2 3.32Å; R147-I149 PolarHBondContact O-N 3.45Å; I149-F179 WeakPolarHBondContact O-CB 3.06Å; I149-F208 HydrophobicContact CD1-CZ 4.3Å; I149-I212 HydrophobicContact CD1-CD1 3.41Å; I149-I212 VanDerWaalsContact CD1-CD1 3.41Å
150	L	93.3	Very high	94.1	Very high	5 Å²	5	65.1 Å²	65.1	3%	0.026	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.1	-177.4	-71.5	164.8	0	0	0	108.9	L106 L124 V126 P177 I178 F179 F208 L230	L106-L150 HydrophobicContact CD1-CD1 3.88Å; L106-L150 HydrophobicContact CD1-CD2 3.44Å; L106-L150 VanDerWaalsContact CD1-CD2 3.44Å; L106-L150 HydrophobicContact CD1-CG 4.32Å; L106-L150 HydrophobicContact CG-CD2 4.04Å; L124-L150 WeakPolarHBondContact CA-O 3.5Å; L124-L150 HydrophobicContact CB-CB 3.74Å; L124-L150 WeakPolarHBondContact CB-O 3.19Å; L124-L150 PolarHBondContact N-O 2.89Å; L124-L150 PolarHBondContact O-N 3.28Å; V126-L150 HydrophobicContact CG2-CD1 3.48Å; V126-L150 VanDerWaalsContact CG2-CD1 3.48Å; L150-P177 HydrophobicContact CB-CB 4.36Å; L150-P177 HydrophobicContact CD2-CB 4Å; L150-I178 WeakPolarHBondContact CA-O 3.47Å; L150-F179 HydrophobicContact CD2-CB 3.68Å; L150-F179 HydrophobicContact CD2-CD1 4.47Å; L150-F208 HydrophobicContact CD1-CZ 4.15Å; L150-F208 HydrophobicContact CD2-CE2 4.18Å; L150-F208 HydrophobicContact CD2-CZ 4.32Å; L150-F208 HydrophobicContact CG-CZ 4.45Å; L150-L230 HydrophobicContact CD1-CD1 4Å; L150-L230 HydrophobicContact CD1-CD2 3.98Å; L150-L230 HydrophobicContact CD1-CG 3.72Å
151	Y	95	Very high	93.8	Very high	80 Å²	80	72.3 Å²	72.3	31%	0.314	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	138.3	173.9	-168.4	-99	0	0	0	109.4	D121 R122 P153 P177 I178	D121-Y151 VanDerWaalsContact CA-OH 3.24Å; D121-Y151 WeakPolarHBondContact CA-OH 3.47Å; D121-Y151 VanDerWaalsContact CB-OH 3.23Å; D121-Y151 WeakPolarHBondContact CB-OH 3.16Å; D121-Y151 VanDerWaalsContact CG-OH 3.29Å; D121-Y151 PolarHBondContact OD1-OH 3.28Å; R122-Y151 VanDerWaalsContact O-CD2 3.31Å; R122-Y151 WeakPolarHBondContact O-CD2 3.41Å; Y151-P153 HydrophobicContact CD1-CB 3.96Å; Y151-P153 HydrophobicContact CD1-CG 4.5Å; Y151-P153 HydrophobicContact CE1-CB 3.84Å; Y151-P153 WeakPolarHBondContact O-CD 3.19Å; Y151-P177 CarbonylContact O-C 3.53Å; Y151-P177 VanDerWaalsContact O-CA 3.26Å; Y151-P177 WeakPolarHBondContact O-CA 3.39Å; Y151-I178 PolarHBondContact N-O 2.98Å; Y151-I178 VanDerWaalsContact N-O 3.08Å; Y151-I178 WeakPolarHBondContact O-CG1 3.4Å; Y151-I178 PolarHBondContact O-N 2.83Å
152	L	93.7	Very high	93.5	Very high	6 Å²	6	74.6 Å²	74.6	3%	0.031	37%	0.367	C	S	.	.			trans	-111	93.3	176.2	-179.1	64.5	0	0	0	108.8	W119 F120 D121 L124 A174 L175 P177	W119-L152 HydrophobicContact CB-CD2 4.11Å; F120-L152 CarbonylContact C-O 3.32Å; F120-L152 VanDerWaalsContact CA-O 3.27Å; F120-L152 WeakPolarHBondContact CA-O 3.37Å; F120-L152 HydrophobicContact CD1-CD2 4.09Å; F120-L152 HydrophobicContact CD1-CG 3.78Å; F120-L152 HydrophobicContact CD2-CD2 3.94Å; F120-L152 HydrophobicContact CE1-CD1 4.29Å; F120-L152 HydrophobicContact CE1-CD2 4.19Å; F120-L152 HydrophobicContact CE1-CG 3.98Å; F120-L152 HydrophobicContact CE2-CD2 4.07Å; F120-L152 HydrophobicContact CG-CD2 3.97Å; F120-L152 HydrophobicContact CG-CG 4.08Å; F120-L152 HydrophobicContact CZ-CD2 4.19Å; F120-L152 HydrophobicContact CZ-CG 4.45Å; D121-L152 PolarHBondContact N-O 3.49Å; L124-L152 HydrophobicContact CD1-CB 4.17Å; L152-A174 WeakPolarHBondContact CD1-O 3.25Å; L152-L175 HydrophobicContact CD2-CD2 3.7Å; L152-P177 HydrophobicContact CD1-CG 4.27Å
153	P	94	Very high	93	Very high	55 Å²	55	72.7 Å²	72.7	36%	0.357	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-75.4	141	-171.7	29.4	-34.5	0	0	0	112.6	F120 Y151 I178	F120-P153 WeakPolarHBondContact CD1-O 3.46Å; Y151-P153 HydrophobicContact CD1-CB 3.96Å; Y151-P153 HydrophobicContact CD1-CG 4.5Å; Y151-P153 HydrophobicContact CE1-CB 3.84Å; Y151-P153 WeakPolarHBondContact O-CD 3.19Å; P153-I178 HydrophobicContact CG-CD1 4.47Å
154	N	93.3	Very high	92.7	Very high	55 Å²	55	79 Å²	79	29%	0.294	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-71.1	155.2	162.7	-88	-57.3	0	0	0	112.4	F120 D121 F167	F120-N154 WeakPolarHBondContact CB-ND2 3.49Å; F120-N154 WeakPolarHBondContact CD1-OD1 3.25Å; D121-N154 PolarHBondContact OD1-N 3.38Å; D121-N154 WeakPolarHBondContact OD2-CB 3.4Å; D121-N154 PolarHBondContact OD2-ND2 3.01Å; N154-F167 VanDerWaalsContact OD1-CE2 3.23Å; N154-F167 WeakPolarHBondContact OD1-CE2 3.48Å; N154-F167 WeakPolarHBondContact OD1-CZ 3.4Å
155	L	92.1	Very high	92.6	Very high	96 Å²	96	81.4 Å²	81.4	50%	0.503	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-72.9	137.2	164	-175.4	61.1	0	0	0	109.3	I157 L159 E160	L155-I157 PolarHBondContact O-N 3.01Å; L155-L159 HydrophobicContact CD1-CB 4.11Å; L155-L159 HydrophobicContact CD1-CD1 3.72Å; L155-L159 HydrophobicContact CD2-CB 4.16Å; L155-L159 HydrophobicContact CG-CB 4.06Å; L155-E160 HydrophobicContact CD2-CB 4.07Å
156	A	93.3	Very high	92.3	Very high	53 Å²	53	84.2 Å²	84.2	44%	0.438	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-60.6	133.6	178.2	0	0	0	0	0	111.2	H158 L159 E160	A156-H158 PolarHBondContact O-N 3.26Å; A156-L159 WeakPolarHBondContact O-CB 3.35Å; A156-L159 PolarHBondContact O-N 2.81Å; A156-E160 PolarHBondContact O-N 3.35Å
157	I	93.6	Very high	92	Very high	71 Å²	71	82.4 Å²	82.4	36%	0.364	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-25.9	179.3	-167.9	170.3	0	0	0	113.9	L155 L159 E160 R161 N164	L155-I157 PolarHBondContact O-N 3.01Å; I157-L159 PolarHBondContact O-N 2.95Å; I157-E160 CarbonylContact O-C 3.52Å; I157-E160 PolarHBondContact O-N 3.21Å; I157-R161 VanDerWaalsContact O-CA 3.29Å; I157-R161 WeakPolarHBondContact O-CA 3.28Å; I157-R161 PolarHBondContact O-N 3.16Å; I157-R161 VanDerWaalsContact O-N 3.15Å; I157-N164 VanDerWaalsContact CD1-ND2 3.32Å; I157-N164 WeakPolarHBondContact CD1-ND2 3.47Å
158	H	94.1	Very high	91.6	Very high	154 Å²	154	81.2 Å²	81.2	71%	0.713	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.8	175.3	-54.6	92.8	0	0	0	113	A156	A156-H158 PolarHBondContact O-N 3.26Å
159	L	92.5	Very high	91.3	Very high	136 Å²	136	81 Å²	81	71%	0.712	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-18.3	177.5	-58.5	176	0	0	0	112.2	L155 A156 I157	L155-L159 HydrophobicContact CD1-CB 4.11Å; L155-L159 HydrophobicContact CD1-CD1 3.72Å; L155-L159 HydrophobicContact CD2-CB 4.16Å; L155-L159 HydrophobicContact CG-CB 4.06Å; A156-L159 WeakPolarHBondContact O-CB 3.35Å; A156-L159 PolarHBondContact O-N 2.81Å; I157-L159 PolarHBondContact O-N 2.95Å
160	E	87.7	Confident	91	Very high	58 Å²	58	83.8 Å²	83.8	27%	0.271	44%	0.438	S	S	.	.			trans	-134.7	77	177	-170.4	-179	-138.2	0	0	110.2	L155 A156 I157 E162 S163	L155-E160 HydrophobicContact CD2-CB 4.07Å; A156-E160 PolarHBondContact O-N 3.35Å; I157-E160 CarbonylContact O-C 3.52Å; I157-E160 PolarHBondContact O-N 3.21Å; E160-E162 PolarHBondContact O-N 3.43Å; E160-E162 VanDerWaalsContact O-N 3.16Å; E160-S163 VanDerWaalsContact O-CB 3.28Å; E160-S163 WeakPolarHBondContact O-CB 3.49Å; E160-S163 PolarHBondContact O-N 3.28Å; E160-S163 VanDerWaalsContact O-N 3.11Å; E160-S163 PolarHBondContact OE2-OG 3.23Å; E160-S163 VanDerWaalsContact OE2-OG 3.12Å
161	R	88.8	Confident	90.8	Very high	206 Å²	206	85.2 Å²	85.2	78%	0.777	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.6	-169.9	-64.6	-175.9	-179.1	-171.3	-0.5	114.1	I157 S163	I157-R161 VanDerWaalsContact O-CA 3.29Å; I157-R161 WeakPolarHBondContact O-CA 3.28Å; I157-R161 PolarHBondContact O-N 3.16Å; I157-R161 VanDerWaalsContact O-N 3.15Å; R161-S163 VanDerWaalsContact C-N 3.34Å
162	E	89.5	Confident	90.3	Very high	121 Å²	121	86.6 Å²	86.6	57%	0.565	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	4.6	-179.9	-59.5	-56.8	142.1	0	0	113.3	E160 N164 T165 S166	E160-E162 PolarHBondContact O-N 3.43Å; E160-E162 VanDerWaalsContact O-N 3.16Å; E162-N164 PolarHBondContact O-N 3.28Å; E162-N164 VanDerWaalsContact O-N 3.07Å; E162-T165 PolarHBondContact O-N 3.11Å; E162-T165 PolarHBondContact O-OG1 3.28Å; E162-T165 PolarHBondContact OE2-OG1 3.38Å; E162-S166 PolarHBondContact O-N 2.99Å; E162-S166 VanDerWaalsContact O-O 3.05Å
163	S	86.2	Confident	89.9	Confident	23 Å²	23	91.5 Å²	91.5	16%	0.161	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.5	-175.5	-158.6	0	0	0	0	113.3	E160 R161 F167	E160-S163 VanDerWaalsContact O-CB 3.28Å; E160-S163 WeakPolarHBondContact O-CB 3.49Å; E160-S163 PolarHBondContact O-N 3.28Å; E160-S163 VanDerWaalsContact O-N 3.11Å; E160-S163 PolarHBondContact OE2-OG 3.23Å; E160-S163 VanDerWaalsContact OE2-OG 3.12Å; R161-S163 VanDerWaalsContact C-N 3.34Å; S163-F167 WeakPolarHBondContact OG-CD2 3.38Å
164	N	88.9	Confident	89.7	Confident	141 Å²	141	90.5 Å²	90.5	75%	0.754	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-24.1	176.1	-75.2	-22.6	0	0	0	114.3	I157 E162	I157-N164 VanDerWaalsContact CD1-ND2 3.32Å; I157-N164 WeakPolarHBondContact CD1-ND2 3.47Å; E162-N164 PolarHBondContact O-N 3.28Å; E162-N164 VanDerWaalsContact O-N 3.07Å
165	T	91.5	Very high	89.5	Confident	109 Å²	109	88.2 Å²	88.2	67%	0.669	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-34.6	-177.6	51.5	0	0	0	0	111.5	E162	E162-T165 PolarHBondContact O-N 3.11Å; E162-T165 PolarHBondContact O-OG1 3.28Å; E162-T165 PolarHBondContact OE2-OG1 3.38Å
166	S	88.8	Confident	89.3	Confident	71 Å²	71	85.4 Å²	85.4	50%	0.497	45%	0.454	S	S	.	.			trans	-144.3	125	175.2	62.1	0	0	0	0	110.6	E162	E162-S166 PolarHBondContact O-N 2.99Å; E162-S166 VanDerWaalsContact O-O 3.05Å
167	F	88	Confident	89.2	Confident	69 Å²	69	83 Å²	83	30%	0.303	43%	0.433	S	S	.	.			trans	-112.8	101.6	174.2	-167.5	-85.7	0	0	0	109.1	R117 F120 N154 S163 F169	R117-F167 HydrophobicContact CB-CD1 3.8Å; R117-F167 HydrophobicContact CB-CE1 3.82Å; F120-F167 HydrophobicContact CD2-CE1 4.35Å; F120-F167 HydrophobicContact CD2-CZ 4.27Å; F120-F167 HydrophobicContact CE2-CE1 4.17Å; F120-F167 HydrophobicContact CE2-CZ 4.31Å; F120-F167 HydrophobicContact CG-CZ 4.43Å; N154-F167 VanDerWaalsContact OD1-CE2 3.23Å; N154-F167 WeakPolarHBondContact OD1-CE2 3.48Å; N154-F167 WeakPolarHBondContact OD1-CZ 3.4Å; S163-F167 WeakPolarHBondContact OG-CD2 3.38Å; F167-F169 AromaticContact CD1-CD1 3.64Å; F167-F169 HydrophobicContact CD1-CD1 3.64Å; F167-F169 AromaticContact CD1-CE1 3.81Å; F167-F169 HydrophobicContact CD1-CE1 3.81Å; F167-F169 AromaticContact CE1-CD1 3.29Å; F167-F169 HydrophobicContact CE1-CD1 3.29Å; F167-F169 AromaticContact CE1-CE1 3.51Å; F167-F169 HydrophobicContact CE1-CE1 3.51Å; F167-F169 HydrophobicContact CE1-CG 4.35Å; F167-F169 HydrophobicContact CZ-CD1 4.36Å
168	S	88.6	Confident	89.1	Confident	100 Å²	100	81.3 Å²	81.3	70%	0.699	43%	0.425	S	S	*	.			trans	-128.8	129.8	-177.9	177	0	0	0	0	109.8
169	F	89.7	Confident	88.9	Confident	62 Å²	62	76.3 Å²	76.3	27%	0.272	40%	0.401	S	S	.	.			trans	-144	153.5	178.9	60.4	-82.8	0	0	0	110.3	W116 R117 F120 F167 A174 L175	W116-F169 HydrophobicContact CB-CE2 4.13Å; W116-F169 HydrophobicContact CB-CZ 3.6Å; R117-F169 HydrophobicContact CB-CE1 4.39Å; F120-F169 HydrophobicContact CE2-CD1 4.38Å; F120-F169 HydrophobicContact CE2-CD2 4.41Å; F120-F169 HydrophobicContact CE2-CE1 4.17Å; F120-F169 HydrophobicContact CE2-CE2 4.18Å; F120-F169 HydrophobicContact CE2-CZ 4.05Å; F120-F169 HydrophobicContact CZ-CD2 4.29Å; F120-F169 HydrophobicContact CZ-CE2 4.47Å; F120-F169 HydrophobicContact CZ-CG 4.35Å; F167-F169 AromaticContact CD1-CD1 3.64Å; F167-F169 HydrophobicContact CD1-CD1 3.64Å; F167-F169 AromaticContact CD1-CE1 3.81Å; F167-F169 HydrophobicContact CD1-CE1 3.81Å; F167-F169 AromaticContact CE1-CD1 3.29Å; F167-F169 HydrophobicContact CE1-CD1 3.29Å; F167-F169 AromaticContact CE1-CE1 3.51Å; F167-F169 HydrophobicContact CE1-CE1 3.51Å; F167-F169 HydrophobicContact CE1-CG 4.35Å; F167-F169 HydrophobicContact CZ-CD1 4.36Å; F169-A174 HydrophobicContact CB-CB 3.8Å; F169-A174 HydrophobicContact CD2-CB 3.87Å; F169-A174 HydrophobicContact CG-CB 4.17Å; F169-L175 HydrophobicContact CD2-CD2 4.49Å; F169-L175 HydrophobicContact CE2-CD1 4.28Å; F169-L175 HydrophobicContact CE2-CD2 3.84Å; F169-L175 HydrophobicContact CE2-CG 4Å; F169-L175 HydrophobicContact CZ-CD2 4.49Å
170	N	89.7	Confident	88.5	Confident	88 Å²	88	70.8 Å²	70.8	47%	0.471	38%	0.375	S	S	.	.			trans	-79.8	124.3	166.8	-178.7	-48.9	0	0	0	108.6	E172 D173 A174	N170-E172 VanDerWaalsContact C-N 3.34Å; N170-E172 PolarHBondContact O-N 2.91Å; N170-E172 WeakPolarHBondContact OD1-CB 2.83Å; N170-E172 PolarHBondContact OD1-N 3.24Å; N170-D173 HydrophobicContact CB-CB 4.11Å; N170-D173 WeakPolarHBondContact CB-OD2 3.49Å; N170-D173 VanDerWaalsContact CG-OD2 3.23Å; N170-D173 PolarHBondContact ND2-OD2 2.94Å; N170-D173 PolarHBondContact O-N 2.95Å; N170-D173 PolarHBondContact OD1-N 2.81Å; N170-A174 VanDerWaalsContact O-CB 3.26Å; N170-A174 WeakPolarHBondContact O-CB 3.11Å; N170-A174 PolarHBondContact O-N 2.89Å
171	A	87.5	Confident	88.3	Confident	35 Å²	35	69.8 Å²	69.8	29%	0.289	38%	0.377	S	S	.	.	H	α-helix	trans	-61.5	-39	-177.4	0	0	0	0	0	113.1	T110 L175	T110-A171 HydrophobicContact CG2-CB 4.29Å; A171-L175 HydrophobicContact CB-CD1 3.93Å; A171-L175 HydrophobicContact CB-CG 4.43Å; A171-L175 WeakPolarHBondContact O-CB 2.79Å; A171-L175 WeakPolarHBondContact O-CG 3.37Å; A171-L175 PolarHBondContact O-N 2.8Å; A171-L175 VanDerWaalsContact O-N 3.08Å
172	E	85	Confident	87.6	Confident	109 Å²	109	62 Å²	62	51%	0.509	35%	0.353	S	S	.	.	H	α-helix	trans	-68.3	-37.6	179.7	-177.9	59.6	-146.7	0	0	111.7	N170 K176	N170-E172 VanDerWaalsContact C-N 3.34Å; N170-E172 PolarHBondContact O-N 2.91Å; N170-E172 WeakPolarHBondContact OD1-CB 2.83Å; N170-E172 PolarHBondContact OD1-N 3.24Å; E172-K176 WeakPolarHBondContact O-CE 2.97Å
173	D	85.8	Confident	86.2	Confident	110 Å²	110	58.3 Å²	58.3	59%	0.588	34%	0.34	S	S	*	.	H	α-helix	trans	-81.7	-42	-177.5	-61.8	-41.1	0	0	0	112.3	N170	N170-D173 HydrophobicContact CB-CB 4.11Å; N170-D173 WeakPolarHBondContact CB-OD2 3.49Å; N170-D173 VanDerWaalsContact CG-OD2 3.23Å; N170-D173 PolarHBondContact ND2-OD2 2.94Å; N170-D173 PolarHBondContact O-N 2.95Å; N170-D173 PolarHBondContact OD1-N 2.81Å
174	A	88.6	Confident	84.7	Confident	34 Å²	34	65 Å²	65	28%	0.281	37%	0.368	S	S	.	.	H	α-helix	trans	-95	-29.7	-168.7	0	0	0	0	0	114	F120 L152 F169 N170 K176	F120-A174 HydrophobicContact CZ-CB 4.12Å; L152-A174 WeakPolarHBondContact CD1-O 3.25Å; F169-A174 HydrophobicContact CB-CB 3.8Å; F169-A174 HydrophobicContact CD2-CB 3.87Å; F169-A174 HydrophobicContact CG-CB 4.17Å; N170-A174 VanDerWaalsContact O-CB 3.26Å; N170-A174 WeakPolarHBondContact O-CB 3.11Å; N170-A174 PolarHBondContact O-N 2.89Å; A174-K176 PolarHBondContact O-N 2.92Å
175	L	89.9	Confident	82.7	Confident	6 Å²	6	66.1 Å²	66.1	3%	0.031	37%	0.366	C	S	.	.			trans	-81.4	67.7	178.2	-55.9	179.3	0	0	0	110	V108 T110 W116 F120 L152 F169 A171	V108-L175 HydrophobicContact CG2-CB 3.84Å; V108-L175 VanDerWaalsContact CG2-O 3.28Å; V108-L175 WeakPolarHBondContact CG2-O 3.08Å; V108-L175 PolarHBondContact N-O 3.05Å; T110-L175 HydrophobicContact CG2-CD1 3.49Å; T110-L175 VanDerWaalsContact CG2-CD1 3.49Å; W116-L175 HydrophobicContact CB-CD1 4.22Å; W116-L175 HydrophobicContact CB-CD2 4.43Å; W116-L175 HydrophobicContact CD2-CD1 4.33Å; W116-L175 HydrophobicContact CG-CD1 4.13Å; F120-L175 HydrophobicContact CE2-CD2 3.65Å; F120-L175 HydrophobicContact CZ-CD2 3.86Å; L152-L175 HydrophobicContact CD2-CD2 3.7Å; F169-L175 HydrophobicContact CD2-CD2 4.49Å; F169-L175 HydrophobicContact CE2-CD1 4.28Å; F169-L175 HydrophobicContact CE2-CD2 3.84Å; F169-L175 HydrophobicContact CE2-CG 4Å; F169-L175 HydrophobicContact CZ-CD2 4.49Å; A171-L175 HydrophobicContact CB-CD1 3.93Å; A171-L175 HydrophobicContact CB-CG 4.43Å; A171-L175 WeakPolarHBondContact O-CB 2.79Å; A171-L175 WeakPolarHBondContact O-CG 3.37Å; A171-L175 PolarHBondContact O-N 2.8Å; A171-L175 VanDerWaalsContact O-N 3.08Å
176	K	88.4	Confident	80.3	Confident	37 Å²	37	66.1 Å²	66.1	16%	0.161	37%	0.371	C	S	.	.			trans	-127.3	80	179.4	-65.9	-169.3	177.7	-171.4	0	112.2	C100 Q105 L106 E172 A174 I178	C100-K176 PolarHBondContact O-NZ 2.86Å; Q105-K176 HydrophobicContact CB-CB 4.36Å; Q105-K176 HydrophobicContact CG-CB 4.44Å; Q105-K176 PolarHBondContact NE2-O 2.89Å; L106-K176 CarbonylContact O-C 3.6Å; L106-K176 WeakPolarHBondContact O-CA 2.83Å; E172-K176 WeakPolarHBondContact O-CE 2.97Å; A174-K176 PolarHBondContact O-N 2.92Å; K176-I178 PolarHBondContact O-N 2.89Å
177	P	91.1	Very high	77.7	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.013	38%	0.382	C	S	.	.			trans	-55.9	134.7	179.4	-25.5	35.3	0	0	0	112.1	Q105 L106 V108 L150 Y151 L152 L230	Q105-P177 VanDerWaalsContact CA-O 3.28Å; Q105-P177 WeakPolarHBondContact CA-O 3.05Å; L106-P177 PolarHBondContact N-O 2.78Å; L106-P177 VanDerWaalsContact O-CD 3.3Å; L106-P177 WeakPolarHBondContact O-CD 3.38Å; V108-P177 HydrophobicContact CG1-CG 4.36Å; L150-P177 HydrophobicContact CB-CB 4.36Å; L150-P177 HydrophobicContact CD2-CB 4Å; Y151-P177 CarbonylContact O-C 3.53Å; Y151-P177 VanDerWaalsContact O-CA 3.26Å; Y151-P177 WeakPolarHBondContact O-CA 3.39Å; L152-P177 HydrophobicContact CD1-CG 4.27Å; P177-L230 HydrophobicContact CB-CD2 4.06Å; P177-L230 HydrophobicContact CG-CD2 3.46Å; P177-L230 VanDerWaalsContact CG-CD2 3.46Å
178	I	91.3	Very high	75.1	Confident	37 Å²	37	72.3 Å²	72.3	19%	0.19	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	144.1	173.2	60.2	171.9	0	0	0	109.8	W103 Q105 L150 Y151 P153 K176	W103-I178 HydrophobicContact CB-CB 4.28Å; W103-I178 HydrophobicContact CB-CG2 3.62Å; W103-I178 HydrophobicContact CD2-CG2 4.46Å; W103-I178 HydrophobicContact CE3-CD1 4.43Å; W103-I178 HydrophobicContact CG-CG2 3.94Å; Q105-I178 HydrophobicContact CG-CG2 3.78Å; L150-I178 WeakPolarHBondContact CA-O 3.47Å; Y151-I178 PolarHBondContact N-O 2.98Å; Y151-I178 VanDerWaalsContact N-O 3.08Å; Y151-I178 WeakPolarHBondContact O-CG1 3.4Å; Y151-I178 PolarHBondContact O-N 2.83Å; P153-I178 HydrophobicContact CG-CD1 4.47Å; K176-I178 PolarHBondContact O-N 2.89Å
179	F	89.2	Confident	72.7	Confident	49 Å²	49	75.7 Å²	75.7	22%	0.215	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	-23	174.9	63.6	-94.1	0	0	0	114.6	Q104 L106 I149 L150 M206 F208	Q104-F179 VanDerWaalsContact C-CE1 3.41Å; Q104-F179 HydrophobicContact CB-CD1 4.23Å; Q104-F179 HydrophobicContact CB-CD2 4.03Å; Q104-F179 HydrophobicContact CB-CE1 3.71Å; Q104-F179 HydrophobicContact CB-CE2 3.47Å; Q104-F179 VanDerWaalsContact CB-CE2 3.47Å; Q104-F179 HydrophobicContact CB-CG 4.39Å; Q104-F179 HydrophobicContact CB-CZ 3.31Å; Q104-F179 HydrophobicContact CG-CE2 4.35Å; Q104-F179 HydrophobicContact CG-CZ 4.41Å; Q104-F179 WeakPolarHBondContact O-CD1 3.14Å; Q104-F179 WeakPolarHBondContact O-CE1 3.24Å; Q104-F179 PolarHBondContact O-N 3.19Å; L106-F179 HydrophobicContact CD2-CD1 3.93Å; L106-F179 HydrophobicContact CD2-CE1 3.66Å; L106-F179 HydrophobicContact CG-CD1 3.87Å; L106-F179 HydrophobicContact CG-CE1 4.08Å; I149-F179 WeakPolarHBondContact O-CB 3.06Å; L150-F179 HydrophobicContact CD2-CB 3.68Å; L150-F179 HydrophobicContact CD2-CD1 4.47Å; F179-M206 HydrophobicContact CE2-CB 4.26Å; F179-F208 HydrophobicContact CB-CD2 4.26Å; F179-F208 HydrophobicContact CB-CE2 4.1Å; F179-F208 AromaticContact CD1-CD2 3.9Å; F179-F208 HydrophobicContact CD1-CD2 3.9Å; F179-F208 HydrophobicContact CD1-CE2 4.36Å; F179-F208 AromaticContact CD2-CD2 3.79Å; F179-F208 HydrophobicContact CD2-CD2 3.79Å; F179-F208 HydrophobicContact CD2-CE2 4.42Å; F179-F208 HydrophobicContact CE1-CB 4.24Å; F179-F208 HydrophobicContact CE1-CD2 4.08Å; F179-F208 HydrophobicContact CE1-CG 4.42Å; F179-F208 HydrophobicContact CE2-CB 4.25Å; F179-F208 AromaticContact CE2-CD2 3.98Å; F179-F208 HydrophobicContact CE2-CD2 3.98Å; F179-F208 AromaticContact CG-CD2 3.73Å; F179-F208 HydrophobicContact CG-CD2 3.73Å; F179-F208 HydrophobicContact CG-CE2 4.07Å; F179-F208 HydrophobicContact CZ-CB 3.88Å; F179-F208 HydrophobicContact CZ-CD2 4.1Å; F179-F208 HydrophobicContact CZ-CG 4.4Å
180	A	85.3	Confident	70	Confident	19 Å²	19	81.5 Å²	81.5	16%	0.157	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	157.4	176.4	0	0	0	0	0	111.5	Q104 M206	Q104-A180 HydrophobicContact CB-CB 4.06Å; Q104-A180 HydrophobicContact CG-CB 4.09Å; Q104-A180 PolarHBondContact N-O 2.86Å; A180-M206 HydrophobicContact CB-SD 3.99Å
181	A	83.3	Confident	67.4	Low	38 Å²	38	85.5 Å²	85.5	31%	0.314	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	143.6	167.1	0	0	0	0	0	110.1	W103	W103-A181 HydrophobicContact CE3-CB 4.26Å; W103-A181 HydrophobicContact CZ3-CB 3.99Å
182	T	72.6	Confident	64.7	Low	43 Å²	43	93.2 Å²	93.2	26%	0.264	48%	0.484	S	S	.	.	B	Isolated β-bridge	trans	-84.8	136.1	171.7	-58.8	0	0	0	0	110	N102 H184	N102-T182 WeakPolarHBondContact O-CB 3.37Å; N102-T182 PolarHBondContact O-OG1 3.18Å; T182-H184 PolarHBondContact O-N 2.89Å
183	S	61.5	Low	62.3	Low	42 Å²	42	94 Å²	94	29%	0.294	50%	0.5	S	S	.	.			trans	-70.5	110.8	171.3	-170.4	0	0	0	0	111.1	K185 S203	S183-K185 PolarHBondContact O-N 3.48Å; S183-K185 VanDerWaalsContact O-N 3.12Å; S183-S203 WeakPolarHBondContact CB-O 3.04Å; S183-S203 PolarHBondContact N-O 3.39Å
184	H	54.7	Low	59.7	Low	164 Å²	164	95.7 Å²	95.7	76%	0.759	51%	0.509	S	S	*	.			trans	-76.2	92.9	164.6	-83.7	-70.4	0	0	0	109.3	T182 S186	T182-H184 PolarHBondContact O-N 2.89Å; H184-S186 PolarHBondContact O-N 2.82Å
185	K	46.9	Very low	57.2	Low	164 Å²	164	103.3 Å²	103.3	71%	0.713	54%	0.539	S	S	*	.			trans	-70.2	87.2	157.4	-73	-166.1	176.5	-168.5	0	108.3	S183	S183-K185 PolarHBondContact O-N 3.48Å; S183-K185 VanDerWaalsContact O-N 3.12Å
186	S	41.5	Very low	54.5	Low	110 Å²	110	110.6 Å²	110.6	77%	0.769	58%	0.578	S	S	*	*			trans	-55.4	135.8	163.4	44.3	0	0	0	0	109.3	H184	H184-S186 PolarHBondContact O-N 2.82Å
187	G	34.2	Very low	51.9	Low	70 Å²	70	113.1 Å²	113.1	72%	0.722	60%	0.601	S	S	*	*	S	Bend	trans	-59	159.3	-163.5	0	0	0	0	0	117.3
188	K	32.2	Very low	49.3	Very low	200 Å²	200	119.1 Å²	119.1	87%	0.87	64%	0.642	S	S	*	*	S	Bend	trans	55.4	68.4	161.2	-61	-175.6	-179.7	179.9	0	116.5
189	H	38.4	Very low	46.6	Very low	170 Å²	170	124.5 Å²	124.5	79%	0.787	67%	0.671	S	S	*	*			trans	-171.8	88.9	137.9	-100.2	-66.7	0	0	0	108.5	K191	H189-K191 VanDerWaalsContact C-N 3.29Å; H189-K191 PolarHBondContact O-N 2.91Å
190	E	33.6	Very low	44.1	Very low	185 Å²	185	126.5 Å²	126.5	86%	0.864	69%	0.692	S	S	*	*			trans	-72.5	93	161.3	-69.9	-174.1	155.3	0	0	107.1
191	K	34.6	Very low	42.2	Very low	171 Å²	171	130.8 Å²	130.8	74%	0.743	72%	0.719	S	S	*	*			trans	-106.5	129.1	154.6	-78.8	-169.5	175.7	-175.9	0	106.8	H189 C193	H189-K191 VanDerWaalsContact C-N 3.29Å; H189-K191 PolarHBondContact O-N 2.91Å; K191-C193 PolarHBondContact O-N 3.5Å
192	E	31.5	Very low	40.1	Very low	197 Å²	197	131.8 Å²	131.8	92%	0.921	72%	0.723	S	S	*	*			trans	-40.4	119.1	174	-66.6	165.9	148.6	0	0	110
193	C	33.3	Very low	39.1	Very low	125 Å²	125	131 Å²	131	85%	0.845	72%	0.719	S	S	*	*			trans	-93.6	125	168.5	-76.2	0	0	0	0	108.5	K191	K191-C193 PolarHBondContact O-N 3.5Å
194	D	31.6	Very low	38.9	Very low	146 Å²	146	137.6 Å²	137.6	78%	0.781	74%	0.743	S	S	*	*			trans	-47.1	144.7	174.2	-66.6	-51.6	0	0	0	113.5	D196	D194-D196 PolarHBondContact O-N 3.3Å
195	Q	35.7	Very low	39.4	Very low	195 Å²	195	136.5 Å²	136.5	91%	0.911	74%	0.743	S	S	*	*	S	Bend	trans	-71.9	9.4	-171.4	-71.7	-177.7	-13.7	0	0	115.8
196	D	33.6	Very low	40.6	Very low	159 Å²	159	132.1 Å²	132.1	85%	0.85	73%	0.726	S	S	*	*			trans	-120.7	27.4	-163.3	-82.1	-23.3	0	0	0	116.4	D194	D194-D196 PolarHBondContact O-N 3.3Å
197	S	33.7	Very low	42.5	Very low	90 Å²	90	131.8 Å²	131.8	63%	0.629	72%	0.715	S	S	*	*			trans	-112.3	98.1	172.5	60.8	0	0	0	0	112.6	N199	S197-N199 PolarHBondContact O-N 3.3Å
198	S	36.1	Very low	44.9	Very low	127 Å²	127	129.6 Å²	129.6	89%	0.888	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	20.1	-178	57.3	0	0	0	0	115.5
199	N	35.2	Very low	47.5	Very low	150 Å²	150	121.6 Å²	121.6	80%	0.802	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.3	35	-172.5	-124.6	13.6	0	0	0	115.1	S197 C201	S197-N199 PolarHBondContact O-N 3.3Å; N199-C201 PolarHBondContact O-N 2.88Å; N199-C201 VanDerWaalsContact O-N 3.08Å
200	S	36.3	Very low	49.8	Very low	92 Å²	92	114.6 Å²	114.6	64%	0.643	63%	0.625	S	S	*	*			trans	-74.6	94.7	169.6	-178.2	0	0	0	0	110.3	C202	S200-C202 PolarHBondContact O-N 3.48Å
201	C	45.1	Very low	52.5	Low	109 Å²	109	109.4 Å²	109.4	74%	0.736	60%	0.601	S	S	*	*			trans	-71.7	14.6	177.1	49.8	0	0	0	0	114.6	N199	N199-C201 PolarHBondContact O-N 2.88Å; N199-C201 VanDerWaalsContact O-N 3.08Å
202	C	40.5	Very low	55.1	Low	58 Å²	58	101.5 Å²	101.5	39%	0.392	57%	0.566	S	S	.	*			trans	-124.3	95.1	-170.3	-66.9	0	0	0	0	110.3	S200	S200-C202 PolarHBondContact O-N 3.48Å
203	S	50.4	Low	57.9	Low	26 Å²	26	92.1 Å²	92.1	18%	0.182	52%	0.523	C	S	.	.	B	Isolated β-bridge	trans	-87.4	153.8	179.8	51.7	0	0	0	0	113	Q104 S183 M206	Q104-S203 PolarHBondContact NE2-OG 2.91Å; S183-S203 WeakPolarHBondContact CB-O 3.04Å; S183-S203 PolarHBondContact N-O 3.39Å; S203-M206 WeakPolarHBondContact OG-CE 2.85Å; S203-M206 PolarHBondContact OG-SD 3.3Å
204	K	58	Low	60.7	Low	181 Å²	181	92.5 Å²	92.5	79%	0.787	51%	0.512	S	S	*	.	S	Bend	trans	-56.6	162.6	159.1	-72	176.5	178.7	173.1	0	109	Q104 M206	Q104-K204 PolarHBondContact NE2-O 3.29Å; Q104-K204 VanDerWaalsContact NE2-O 3.16Å; K204-M206 WeakPolarHBondContact O-CG 3.43Å; K204-M206 PolarHBondContact O-N 3.31Å
205	D	65.1	Low	63.6	Low	142 Å²	142	89.8 Å²	89.8	76%	0.759	50%	0.497	S	S	*	.	S	Bend	trans	-46.9	108.8	173	-67.5	-32.7	0	0	0	109.6
206	M	72.5	Confident	66.3	Low	72 Å²	72	82 Å²	82	36%	0.355	46%	0.464	S	S	.	.			trans	-84.8	134.5	-174.8	-69.3	169.9	153.5	0	0	108.4	Q104 F179 A180 S203 K204 F208 E211	Q104-M206 VanDerWaalsContact OE1-CB 3.26Å; F179-M206 HydrophobicContact CE2-CB 4.26Å; A180-M206 HydrophobicContact CB-SD 3.99Å; S203-M206 WeakPolarHBondContact OG-CE 2.85Å; S203-M206 PolarHBondContact OG-SD 3.3Å; K204-M206 WeakPolarHBondContact O-CG 3.43Å; K204-M206 PolarHBondContact O-N 3.31Å; M206-F208 PolarHBondContact O-N 2.81Å; M206-F208 VanDerWaalsContact O-N 3.07Å; M206-E211 HydrophobicContact CB-CG 4.36Å
207	N	81.7	Confident	69.3	Low	103 Å²	103	80 Å²	80	55%	0.551	46%	0.462	S	S	*	.			trans	-79.1	92.3	167.5	-177.8	-18.1	0	0	0	108.4	V209 A210 E211	N207-V209 PolarHBondContact O-N 3.11Å; N207-V209 VanDerWaalsContact O-N 3.13Å; N207-V209 PolarHBondContact OD1-N 3.05Å; N207-A210 HydrophobicContact CB-CB 3.93Å; N207-A210 WeakPolarHBondContact O-CB 3.28Å; N207-A210 PolarHBondContact O-N 3.05Å; N207-A210 PolarHBondContact OD1-N 2.93Å; N207-E211 WeakPolarHBondContact O-CG 3.17Å; N207-E211 PolarHBondContact O-N 3.22Å
208	F	84.8	Confident	72.2	Confident	24 Å²	24	76.2 Å²	76.2	11%	0.105	44%	0.435	C	S	.	.	H	α-helix	trans	-47.7	-44.3	-178.3	-178.3	-98	0	0	0	113.2	L106 V126 I149 L150 F179 M206 A210 E211 I212	L106-F208 HydrophobicContact CD1-CD1 4.03Å; L106-F208 HydrophobicContact CD1-CD2 4.43Å; L106-F208 HydrophobicContact CD1-CE1 3.59Å; L106-F208 HydrophobicContact CD1-CE2 4.03Å; L106-F208 HydrophobicContact CD1-CG 4.43Å; L106-F208 HydrophobicContact CD1-CZ 3.6Å; L106-F208 HydrophobicContact CD2-CB 3.92Å; L106-F208 HydrophobicContact CD2-CD1 3.58Å; L106-F208 HydrophobicContact CD2-CD2 4.01Å; L106-F208 HydrophobicContact CD2-CE1 4.05Å; L106-F208 HydrophobicContact CD2-CE2 4.44Å; L106-F208 HydrophobicContact CD2-CG 3.56Å; L106-F208 HydrophobicContact CD2-CZ 4.46Å; L106-F208 HydrophobicContact CG-CD1 4.44Å; L106-F208 HydrophobicContact CG-CE1 4.45Å; L106-F208 HydrophobicContact CG-CG 4.5Å; V126-F208 HydrophobicContact CG2-CE1 3.98Å; V126-F208 HydrophobicContact CG2-CZ 3.64Å; I149-F208 HydrophobicContact CD1-CZ 4.3Å; L150-F208 HydrophobicContact CD1-CZ 4.15Å; L150-F208 HydrophobicContact CD2-CE2 4.18Å; L150-F208 HydrophobicContact CD2-CZ 4.32Å; L150-F208 HydrophobicContact CG-CZ 4.45Å; F179-F208 HydrophobicContact CB-CD2 4.26Å; F179-F208 HydrophobicContact CB-CE2 4.1Å; F179-F208 AromaticContact CD1-CD2 3.9Å; F179-F208 HydrophobicContact CD1-CD2 3.9Å; F179-F208 HydrophobicContact CD1-CE2 4.36Å; F179-F208 AromaticContact CD2-CD2 3.79Å; F179-F208 HydrophobicContact CD2-CD2 3.79Å; F179-F208 HydrophobicContact CD2-CE2 4.42Å; F179-F208 HydrophobicContact CE1-CB 4.24Å; F179-F208 HydrophobicContact CE1-CD2 4.08Å; F179-F208 HydrophobicContact CE1-CG 4.42Å; F179-F208 HydrophobicContact CE2-CB 4.25Å; F179-F208 AromaticContact CE2-CD2 3.98Å; F179-F208 HydrophobicContact CE2-CD2 3.98Å; F179-F208 AromaticContact CG-CD2 3.73Å; F179-F208 HydrophobicContact CG-CD2 3.73Å; F179-F208 HydrophobicContact CG-CE2 4.07Å; F179-F208 HydrophobicContact CZ-CB 3.88Å; F179-F208 HydrophobicContact CZ-CD2 4.1Å; F179-F208 HydrophobicContact CZ-CG 4.4Å; M206-F208 PolarHBondContact O-N 2.81Å; M206-F208 VanDerWaalsContact O-N 3.07Å; F208-A210 VanDerWaalsContact C-N 3.34Å; F208-A210 PolarHBondContact O-N 3.46Å; F208-E211 PolarHBondContact O-N 3.48Å; F208-I212 HydrophobicContact CD1-CG1 3.93Å; F208-I212 HydrophobicContact CD2-CG1 4.42Å; F208-I212 HydrophobicContact CE1-CD1 4.12Å; F208-I212 HydrophobicContact CE1-CG1 3.5Å; F208-I212 HydrophobicContact CE2-CD1 3.93Å; F208-I212 HydrophobicContact CE2-CG1 4.04Å; F208-I212 HydrophobicContact CG-CG1 4.37Å; F208-I212 HydrophobicContact CZ-CD1 3.62Å; F208-I212 HydrophobicContact CZ-CG1 3.55Å; F208-I212 VanDerWaalsContact O-CG1 3.3Å; F208-I212 WeakPolarHBondContact O-CG1 3.23Å; F208-I212 PolarHBondContact O-N 2.8Å
209	V	86.4	Confident	75	Confident	32 Å²	32	75 Å²	75	19%	0.194	42%	0.418	C	S	.	.	H	α-helix	trans	-63.3	-42.3	-178.5	-179.3	0	0	0	0	111.1	F130 N207 A213 I223 F226	F130-V209 HydrophobicContact CE1-CG1 3.72Å; F130-V209 HydrophobicContact CZ-CG1 4.36Å; N207-V209 PolarHBondContact O-N 3.11Å; N207-V209 VanDerWaalsContact O-N 3.13Å; N207-V209 PolarHBondContact OD1-N 3.05Å; V209-A213 WeakPolarHBondContact O-CB 3.37Å; V209-A213 PolarHBondContact O-N 3.32Å; V209-I223 HydrophobicContact CG1-CD1 4.34Å; V209-F226 HydrophobicContact CB-CE1 4.38Å; V209-F226 HydrophobicContact CG1-CD1 3.65Å; V209-F226 HydrophobicContact CG1-CE1 3.66Å; V209-F226 HydrophobicContact CG1-CG 4.36Å; V209-F226 HydrophobicContact CG1-CZ 4.37Å; V209-F226 HydrophobicContact CG2-CD1 4.48Å; V209-F226 HydrophobicContact CG2-CE1 3.8Å; V209-F226 HydrophobicContact CG2-CE2 4.39Å; V209-F226 HydrophobicContact CG2-CZ 3.74Å
210	A	86.1	Confident	77.6	Confident	22 Å²	22	70 Å²	70	18%	0.182	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-41.2	176.5	0	0	0	0	0	111.8	N207 F208 A213 Q214 A220	N207-A210 HydrophobicContact CB-CB 3.93Å; N207-A210 WeakPolarHBondContact O-CB 3.28Å; N207-A210 PolarHBondContact O-N 3.05Å; N207-A210 PolarHBondContact OD1-N 2.93Å; F208-A210 VanDerWaalsContact C-N 3.34Å; F208-A210 PolarHBondContact O-N 3.46Å; A210-A213 PolarHBondContact O-N 3.34Å; A210-Q214 WeakPolarHBondContact O-CB 3.43Å; A210-Q214 PolarHBondContact O-N 3.29Å; A210-A220 HydrophobicContact CB-CB 3.72Å
211	E	89.3	Confident	80.3	Confident	77 Å²	77	69.8 Å²	69.8	36%	0.36	40%	0.402	S	S	.	.	H	α-helix	trans	-62.8	-45.5	176.7	-64	-64.4	158.4	0	0	111.6	M206 N207 F208 A213 Q214 L215	M206-E211 HydrophobicContact CB-CG 4.36Å; N207-E211 WeakPolarHBondContact O-CG 3.17Å; N207-E211 PolarHBondContact O-N 3.22Å; F208-E211 PolarHBondContact O-N 3.48Å; E211-A213 VanDerWaalsContact C-N 3.35Å; E211-A213 PolarHBondContact O-N 3.46Å; E211-Q214 PolarHBondContact O-N 3Å; E211-L215 VanDerWaalsContact O-CG 3.31Å; E211-L215 WeakPolarHBondContact O-CG 3.34Å; E211-L215 PolarHBondContact O-N 3.45Å
212	I	89.8	Confident	82.7	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-62.9	-42.7	176.2	-63	-57.3	0	0	0	111.1	V126 F130 I145 I149 F208 L215 C216	V126-I212 HydrophobicContact CG1-CG2 4.36Å; F130-I212 HydrophobicContact CE2-CG2 4.02Å; F130-I212 HydrophobicContact CZ-CB 4.37Å; F130-I212 HydrophobicContact CZ-CG2 4.03Å; I145-I212 HydrophobicContact CG1-CD1 4.2Å; I145-I212 HydrophobicContact CG1-CG2 4.32Å; I149-I212 HydrophobicContact CD1-CD1 3.41Å; I149-I212 VanDerWaalsContact CD1-CD1 3.41Å; F208-I212 HydrophobicContact CD1-CG1 3.93Å; F208-I212 HydrophobicContact CD2-CG1 4.42Å; F208-I212 HydrophobicContact CE1-CD1 4.12Å; F208-I212 HydrophobicContact CE1-CG1 3.5Å; F208-I212 HydrophobicContact CE2-CD1 3.93Å; F208-I212 HydrophobicContact CE2-CG1 4.04Å; F208-I212 HydrophobicContact CG-CG1 4.37Å; F208-I212 HydrophobicContact CZ-CD1 3.62Å; F208-I212 HydrophobicContact CZ-CG1 3.55Å; F208-I212 VanDerWaalsContact O-CG1 3.3Å; F208-I212 WeakPolarHBondContact O-CG1 3.23Å; F208-I212 PolarHBondContact O-N 2.8Å; I212-L215 HydrophobicContact CD1-CD1 4.39Å; I212-L215 PolarHBondContact O-N 3.14Å; I212-C216 PolarHBondContact O-N 3.17Å; I212-C216 VanDerWaalsContact O-N 3.09Å; I212-C216 PolarHBondContact O-SG 2.74Å
213	A	89.7	Confident	85.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-61.4	-45.3	176.7	0	0	0	0	0	111.6	F130 V209 A210 E211 L215 C216 S217 I218 I223	F130-A213 HydrophobicContact CE1-CB 4.34Å; F130-A213 HydrophobicContact CE2-CB 4.25Å; F130-A213 HydrophobicContact CZ-CB 4Å; V209-A213 WeakPolarHBondContact O-CB 3.37Å; V209-A213 PolarHBondContact O-N 3.32Å; A210-A213 PolarHBondContact O-N 3.34Å; E211-A213 VanDerWaalsContact C-N 3.35Å; E211-A213 PolarHBondContact O-N 3.46Å; A213-L215 PolarHBondContact O-N 3.16Å; A213-C216 CarbonylContact O-C 3.05Å; A213-C216 VanDerWaalsContact O-C 3.29Å; A213-C216 WeakPolarHBondContact O-CA 3.32Å; A213-C216 WeakPolarHBondContact O-CB 3.32Å; A213-C216 PolarHBondContact O-N 3.14Å; A213-S217 PolarHBondContact O-N 3.39Å; A213-S217 VanDerWaalsContact O-N 3.13Å; A213-I218 CarbonylContact C-O 3.25Å; A213-I218 VanDerWaalsContact C-O 3.25Å; A213-I218 HydrophobicContact CB-CB 4.07Å; A213-I218 HydrophobicContact CB-CG2 4.19Å; A213-I218 WeakPolarHBondContact O-CB 3.45Å; A213-I218 PolarHBondContact O-N 3.16Å; A213-I223 HydrophobicContact CB-CD1 3.43Å; A213-I223 VanDerWaalsContact CB-CD1 3.43Å; A213-I223 HydrophobicContact CB-CG1 4.41Å
214	Q	92.1	Very high	87.1	Confident	134 Å²	134	70 Å²	70	63%	0.626	39%	0.392	S	S	*	.	H	α-helix	trans	-61.5	-43.8	176.9	-173.5	176.3	12.6	0	0	111.8	A210 E211 C216 S217	A210-Q214 WeakPolarHBondContact O-CB 3.43Å; A210-Q214 PolarHBondContact O-N 3.29Å; E211-Q214 PolarHBondContact O-N 3Å; Q214-C216 PolarHBondContact O-N 2.63Å; Q214-S217 PolarHBondContact O-N 3.11Å
215	L	93.4	Very high	88.7	Confident	88 Å²	88	64.3 Å²	64.3	46%	0.461	38%	0.375	S	S	.	.	H	α-helix	trans	-59.2	-26	173.4	-72.6	172.3	0	0	0	112.6	I145 E211 I212 A213	I145-L215 HydrophobicContact CD1-CB 3.62Å; I145-L215 HydrophobicContact CD1-CD1 4.24Å; E211-L215 VanDerWaalsContact O-CG 3.31Å; E211-L215 WeakPolarHBondContact O-CG 3.34Å; E211-L215 PolarHBondContact O-N 3.45Å; I212-L215 HydrophobicContact CD1-CD1 4.39Å; I212-L215 PolarHBondContact O-N 3.14Å; A213-L215 PolarHBondContact O-N 3.16Å
216	C	93.1	Very high	89.9	Confident	32 Å²	32	61.5 Å²	61.5	22%	0.216	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	12.5	175.6	-59.4	0	0	0	0	113.6	V143 I145 I212 A213 Q214 I218	V143-C216 HydrophobicContact CB-CB 4.29Å; V143-C216 VanDerWaalsContact CB-SG 3.58Å; V143-C216 HydrophobicContact CG1-CB 3.57Å; V143-C216 VanDerWaalsContact CG1-SG 3.56Å; I145-C216 WeakPolarHBondContact CD1-SG 3.41Å; I212-C216 PolarHBondContact O-N 3.17Å; I212-C216 VanDerWaalsContact O-N 3.09Å; I212-C216 PolarHBondContact O-SG 2.74Å; A213-C216 CarbonylContact O-C 3.05Å; A213-C216 VanDerWaalsContact O-C 3.29Å; A213-C216 WeakPolarHBondContact O-CA 3.32Å; A213-C216 WeakPolarHBondContact O-CB 3.32Å; A213-C216 PolarHBondContact O-N 3.14Å; Q214-C216 PolarHBondContact O-N 2.63Å; C216-I218 VanDerWaalsContact C-N 3.28Å; C216-I218 HydrophobicContact CB-CD1 4.23Å; C216-I218 HydrophobicContact CB-CG1 4.47Å; C216-I218 PolarHBondContact O-N 2.6Å
217	S	95.6	Very high	90.8	Very high	117 Å²	117	59.2 Å²	59.2	82%	0.818	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	39.2	-177.1	-55	0	0	0	0	113.7	A213 Q214	A213-S217 PolarHBondContact O-N 3.39Å; A213-S217 VanDerWaalsContact O-N 3.13Å; Q214-S217 PolarHBondContact O-N 3.11Å
218	I	95.2	Very high	91.2	Very high	11 Å²	11	55.2 Å²	55.2	6%	0.056	32%	0.324	C	S	.	.			trans	-113.6	128.5	173.8	-64.1	169.2	0	0	0	108	F130 V132 K141 V143 A213 C216 A220 I223	F130-I218 HydrophobicContact CB-CD1 4.07Å; F130-I218 HydrophobicContact CD2-CD1 3.7Å; F130-I218 HydrophobicContact CG-CD1 4.17Å; V132-I218 HydrophobicContact CG1-CG2 4.18Å; V132-I218 HydrophobicContact CG2-CD1 4.26Å; V132-I218 HydrophobicContact CG2-CG2 3.7Å; K141-I218 HydrophobicContact CB-CD1 3.99Å; K141-I218 HydrophobicContact CD-CD1 4.01Å; K141-I218 HydrophobicContact CD-CG1 4.02Å; V143-I218 HydrophobicContact CG1-CD1 3.84Å; A213-I218 CarbonylContact C-O 3.25Å; A213-I218 VanDerWaalsContact C-O 3.25Å; A213-I218 HydrophobicContact CB-CB 4.07Å; A213-I218 HydrophobicContact CB-CG2 4.19Å; A213-I218 WeakPolarHBondContact O-CB 3.45Å; A213-I218 PolarHBondContact O-N 3.16Å; C216-I218 VanDerWaalsContact C-N 3.28Å; C216-I218 HydrophobicContact CB-CD1 4.23Å; C216-I218 HydrophobicContact CB-CG1 4.47Å; C216-I218 PolarHBondContact O-N 2.6Å; I218-A220 PolarHBondContact O-N 3.38Å; I218-I223 HydrophobicContact CG2-CG1 4.07Å
219	D	94.7	Very high	91.5	Very high	101 Å²	101	54.8 Å²	54.8	54%	0.54	32%	0.321	S	S	.	.			trans	-68.9	128.6	172.1	-166.1	-32.7	0	0	0	109.7	A221 D222	D219-A221 PolarHBondContact O-N 3.26Å; D219-A221 WeakPolarHBondContact OD1-CB 3.4Å; D219-A221 PolarHBondContact OD1-N 3.22Å; D219-D222 PolarHBondContact O-N 3.07Å; D219-D222 VanDerWaalsContact O-N 3.12Å
220	A	89.3	Confident	91.8	Very high	45 Å²	45	54.8 Å²	54.8	37%	0.372	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-60.6	-28.8	178.7	0	0	0	0	0	112.7	A210 I218 D222 I223	A210-A220 HydrophobicContact CB-CB 3.72Å; I218-A220 PolarHBondContact O-N 3.38Å; A220-D222 VanDerWaalsContact C-N 3.25Å; A220-D222 PolarHBondContact O-N 3.16Å; A220-I223 HydrophobicContact CB-CD1 4.39Å; A220-I223 PolarHBondContact O-N 3Å
221	A	94.1	Very high	92.1	Very high	87 Å²	87	53.9 Å²	53.9	72%	0.719	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-67.9	-24.1	177.8	0	0	0	0	0	113.2	D219	D219-A221 PolarHBondContact O-N 3.26Å; D219-A221 WeakPolarHBondContact OD1-CB 3.4Å; D219-A221 PolarHBondContact OD1-N 3.22Å
222	D	95.4	Very high	92.4	Very high	68 Å²	68	51.7 Å²	51.7	36%	0.364	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-89.7	-6.5	-179.3	-68.5	-34.4	0	0	0	112.9	V132 K133 D219 A220 V224	V132-D222 CarbonylContact C-O 3.29Å; V132-D222 WeakPolarHBondContact CA-O 3.37Å; V132-D222 HydrophobicContact CG1-CB 3.52Å; K133-D222 PolarHBondContact N-O 3.47Å; D219-D222 PolarHBondContact O-N 3.07Å; D219-D222 VanDerWaalsContact O-N 3.12Å; A220-D222 VanDerWaalsContact C-N 3.25Å; A220-D222 PolarHBondContact O-N 3.16Å; D222-V224 PolarHBondContact O-N 2.93Å
223	I	90.2	Very high	92.6	Very high	37 Å²	37	52.9 Å²	52.9	19%	0.19	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	116.5	-178.8	-58.2	170.7	0	0	0	110.1	F130 V209 A213 I218 A220	F130-I223 HydrophobicContact CD1-CD1 3.94Å; F130-I223 HydrophobicContact CD1-CG1 4.12Å; F130-I223 HydrophobicContact CD1-CG2 3.86Å; F130-I223 HydrophobicContact CE1-CD1 3.87Å; F130-I223 HydrophobicContact CE1-CG2 4.42Å; V209-I223 HydrophobicContact CG1-CD1 4.34Å; A213-I223 HydrophobicContact CB-CD1 3.43Å; A213-I223 VanDerWaalsContact CB-CD1 3.43Å; A213-I223 HydrophobicContact CB-CG1 4.41Å; I218-I223 HydrophobicContact CG2-CG1 4.07Å; A220-I223 HydrophobicContact CB-CD1 4.39Å; A220-I223 PolarHBondContact O-N 3Å
224	V	93.2	Very high	93	Very high	92 Å²	92	59.1 Å²	59.1	56%	0.558	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	-42.7	172.4	-179.4	0	0	0	0	110.8	F131 K133 V138 D222	F131-V224 HydrophobicContact CB-CB 4.48Å; F131-V224 PolarHBondContact O-N 3.07Å; K133-V224 HydrophobicContact CB-CG2 4.22Å; V138-V224 HydrophobicContact CG1-CB 4.46Å; V138-V224 HydrophobicContact CG1-CG2 4.26Å; V138-V224 HydrophobicContact CG2-CG2 4.11Å; D222-V224 PolarHBondContact O-N 2.93Å
225	S	92	Very high	93.2	Very high	62 Å²	62	58.9 Å²	58.9	43%	0.434	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	173.6	-179.7	-171.2	0	0	0	0	110.1	F131	F131-S225 PolarHBondContact N-O 2.65Å; F131-S225 PolarHBondContact O-N 2.92Å
226	F	90.1	Very high	93.4	Very high	83 Å²	83	55 Å²	55	36%	0.364	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	159	177.6	58.3	-95.9	0	0	0	112	R129 F130 V209 L228	R129-F226 WeakPolarHBondContact O-CA 3.23Å; F130-F226 HydrophobicContact CD1-CB 3.55Å; F130-F226 HydrophobicContact CD1-CG 4.49Å; F130-F226 HydrophobicContact CE1-CB 3.73Å; F130-F226 HydrophobicContact CE1-CD1 4.46Å; F130-F226 HydrophobicContact CE1-CG 4.28Å; F130-F226 HydrophobicContact CG-CB 4.41Å; V209-F226 HydrophobicContact CB-CE1 4.38Å; V209-F226 HydrophobicContact CG1-CD1 3.65Å; V209-F226 HydrophobicContact CG1-CE1 3.66Å; V209-F226 HydrophobicContact CG1-CG 4.36Å; V209-F226 HydrophobicContact CG1-CZ 4.37Å; V209-F226 HydrophobicContact CG2-CD1 4.48Å; V209-F226 HydrophobicContact CG2-CE1 3.8Å; V209-F226 HydrophobicContact CG2-CE2 4.39Å; V209-F226 HydrophobicContact CG2-CZ 3.74Å; F226-L228 HydrophobicContact CB-CD1 4.46Å; F226-L228 HydrophobicContact CB-CG 4.27Å; F226-L228 HydrophobicContact CD2-CD1 3.92Å; F226-L228 HydrophobicContact CD2-CG 3.97Å; F226-L228 HydrophobicContact CG-CD1 4.35Å; F226-L228 HydrophobicContact CG-CG 4.48Å
227	E	90.6	Very high	93.7	Very high	25 Å²	25	56.7 Å²	56.7	12%	0.117	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	104.1	172.5	-177.2	176.8	-166.4	0	0	107.8	M29 G128 R129 Y229	M29-E227 HydrophobicContact CE-CB 4.02Å; M29-E227 HydrophobicContact CE-CG 3.69Å; M29-E227 WeakPolarHBondContact CE-OE2 3.38Å; G128-E227 CarbonylContact C-O 3.51Å; G128-E227 WeakPolarHBondContact CA-O 3.32Å; R129-E227 HydrophobicContact CG-CB 4.09Å; R129-E227 IonicContact CZ-OE2 3.73Å; R129-E227 PolarHBondContact N-O 3.06Å; R129-E227 IonicContact NE-OE2 2.74Å; R129-E227 PolarHBondContact NE-OE2 2.89Å; R129-E227 IonicContact NH2-OE2 2.7Å; R129-E227 PolarHBondContact NH2-OE2 3.11Å; R129-E227 PolarHBondContact O-N 3.26Å; E227-Y229 VanDerWaalsContact CD-OH 3.23Å; E227-Y229 HydrophobicContact CG-CE2 4.38Å; E227-Y229 VanDerWaalsContact CG-OH 3.31Å; E227-Y229 WeakPolarHBondContact CG-OH 2.94Å; E227-Y229 PolarHBondContact OE1-OH 3.37Å
228	L	90.3	Very high	93.8	Very high	19 Å²	19	52.5 Å²	52.5	10%	0.099	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.3	-169.2	-61.8	176.8	0	0	0	110.1	V126 C127 F130 V143 F226	V126-L228 HydrophobicContact CG1-CB 3.89Å; V126-L228 HydrophobicContact CG1-CD1 4.08Å; V126-L228 HydrophobicContact CG1-CD2 3.91Å; V126-L228 HydrophobicContact CG1-CG 4.16Å; C127-L228 CarbonylContact O-C 3.53Å; C127-L228 WeakPolarHBondContact O-CA 3.43Å; F130-L228 HydrophobicContact CE1-CD1 4.36Å; F130-L228 HydrophobicContact CE2-CD2 4.31Å; F130-L228 HydrophobicContact CZ-CD1 4.03Å; F130-L228 HydrophobicContact CZ-CD2 4.37Å; V143-L228 HydrophobicContact CG2-CD2 3.7Å; F226-L228 HydrophobicContact CB-CD1 4.46Å; F226-L228 HydrophobicContact CB-CG 4.27Å; F226-L228 HydrophobicContact CD2-CD1 3.92Å; F226-L228 HydrophobicContact CD2-CG 3.97Å; F226-L228 HydrophobicContact CG-CD1 4.35Å; F226-L228 HydrophobicContact CG-CG 4.48Å
229	Y	91.1	Very high	93.8	Very high	15 Å²	15	52.6 Å²	52.6	6%	0.059	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.1	179.2	-50.4	-80.9	0	0	0	109.3	S27 M29 P94 N95 V126 C127 E227	S27-Y229 VanDerWaalsContact CB-CD2 3.42Å; M29-Y229 HydrophobicContact CE-CE2 3.65Å; M29-Y229 VanDerWaalsContact CE-OH 3.29Å; M29-Y229 WeakPolarHBondContact CE-OH 3.26Å; M29-Y229 HydrophobicContact SD-CE2 3.57Å; M29-Y229 VanDerWaalsContact SD-CE2 3.57Å; P94-Y229 HydrophobicContact CB-CD1 4.31Å; P94-Y229 HydrophobicContact CB-CE1 3.16Å; P94-Y229 WeakPolarHBondContact CB-OH 3.49Å; N95-Y229 HydrophobicContact CB-CE1 3.91Å; N95-Y229 VanDerWaalsContact N-CE1 3.34Å; V126-Y229 VanDerWaalsContact CA-O 3.3Å; V126-Y229 WeakPolarHBondContact CA-O 2.88Å; C127-Y229 PolarHBondContact N-O 3.44Å; C127-Y229 WeakPolarHBondContact O-CD2 3.39Å; C127-Y229 PolarHBondContact O-N 3.15Å; E227-Y229 VanDerWaalsContact CD-OH 3.23Å; E227-Y229 HydrophobicContact CG-CE2 4.38Å; E227-Y229 VanDerWaalsContact CG-OH 3.31Å; E227-Y229 WeakPolarHBondContact CG-OH 2.94Å; E227-Y229 PolarHBondContact OE1-OH 3.37Å
230	L	92.4	Very high	93.9	Very high	31 Å²	31	49.3 Å²	49.3	16%	0.162	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	137.3	160.8	-85.6	66	0	0	0	109.5	V108 W119 L124 S125 L150 P177	V108-L230 HydrophobicContact CG1-CD1 3.98Å; V108-L230 HydrophobicContact CG1-CD2 4.19Å; W119-L230 WeakPolarHBondContact CH2-O 3.41Å; W119-L230 HydrophobicContact CZ3-CB 3.85Å; W119-L230 WeakPolarHBondContact CZ3-O 3.31Å; L124-L230 HydrophobicContact CD1-CD2 4.02Å; S125-L230 CarbonylContact O-C 3.52Å; S125-L230 VanDerWaalsContact O-CA 3.27Å; S125-L230 WeakPolarHBondContact O-CA 2.77Å; L150-L230 HydrophobicContact CD1-CD1 4Å; L150-L230 HydrophobicContact CD1-CD2 3.98Å; L150-L230 HydrophobicContact CD1-CG 3.72Å; P177-L230 HydrophobicContact CB-CD2 4.06Å; P177-L230 HydrophobicContact CG-CD2 3.46Å; P177-L230 VanDerWaalsContact CG-CD2 3.46Å
231	C	93.1	Very high	94.2	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.02	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.1	174.7	58.2	0	0	0	0	110.2	L124 S125	L124-C231 CarbonylContact C-O 3.52Å; L124-C231 WeakPolarHBondContact CA-O 3.29Å; S125-C231 PolarHBondContact N-O 2.84Å; S125-C231 PolarHBondContact O-N 3.09Å
232	P	94.3	Very high	94.2	Very high	32 Å²	32	58.2 Å²	58.2	21%	0.208	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	144.8	169.2	28.7	-33.4	0	0	0	109.8	D123 A249	D123-P232 WeakPolarHBondContact O-CA 3.21Å; P232-A249 HydrophobicContact CG-CB 3.75Å
233	T	95.7	Very high	94.1	Very high	29 Å²	29	60.7 Å²	60.7	18%	0.178	32%	0.321	C	S	.	.			trans	-86.5	-15.2	173.3	55.5	0	0	0	0	112.8	D123 S125 P148 R235	D123-T233 VanDerWaalsContact CB-OG1 3.27Å; D123-T233 WeakPolarHBondContact CB-OG1 3.43Å; D123-T233 PolarHBondContact O-N 2.92Å; D123-T233 PolarHBondContact O-OG1 2.91Å; S125-T233 VanDerWaalsContact CB-CG2 3.49Å; P148-T233 HydrophobicContact CB-CG2 4.36Å; T233-R235 PolarHBondContact O-N 3.44Å
234	E	96.5	Very high	94.3	Very high	131 Å²	131	63.5 Å²	63.5	61%	0.612	34%	0.336	S	S	*	.	S	Bend	trans	-59.1	120.8	171.5	-172.3	178.8	-170.6	0	0	109.8	R122	R122-E234 IonicContact CZ-OE2 3.87Å; R122-E234 IonicContact NH1-OE2 2.71Å; R122-E234 PolarHBondContact NH1-OE2 3.47Å
235	R	97	Very high	94.4	Very high	129 Å²	129	64.3 Å²	64.3	49%	0.487	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-74.6	148.5	-177.7	-61.9	-172.6	72.5	90	-3.6	110.6	N23 D146 T233	N23-R235 WeakPolarHBondContact OD1-CA 3.13Å; N23-R235 WeakPolarHBondContact OD1-CB 3.22Å; D146-R235 IonicContact OD2-NH1 2.75Å; T233-R235 PolarHBondContact O-N 3.44Å
236	A	97.9	Very high	94.7	Very high	6 Å²	6	63.2 Å²	63.2	5%	0.05	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-63.5	142.5	164.7	0	0	0	0	0	109.9	V19 L22 N23 F247	V19-A236 HydrophobicContact CG1-CB 4.24Å; V19-A236 WeakPolarHBondContact CG1-O 3.24Å; L22-A236 HydrophobicContact CB-CB 3.78Å; L22-A236 HydrophobicContact CD1-CB 3.8Å; L22-A236 HydrophobicContact CG-CB 4.49Å; N23-A236 PolarHBondContact ND2-O 3.04Å; N23-A236 VanDerWaalsContact ND2-O 3.14Å; N23-A236 PolarHBondContact OD1-N 2.84Å; A236-F247 CarbonylContact C-O 3.38Å; A236-F247 WeakPolarHBondContact CA-O 3.39Å
237	V	98.2	Very high	95.1	Very high	68 Å²	68	64.4 Å²	64.4	41%	0.412	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	159.8	-177.3	-63.6	0	0	0	0	111.2	F247	V237-F247 HydrophobicContact CG2-CB 4.15Å; V237-F247 HydrophobicContact CG2-CD2 4.48Å; V237-F247 PolarHBondContact N-O 3.45Å; V237-F247 PolarHBondContact O-N 3.27Å
238	I	97.9	Very high	95.3	Very high	29 Å²	29	64.8 Å²	64.8	15%	0.149	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	135.4	159.3	-53.9	-57.1	0	0	0	108.3	A15 V19 E243 F245 V246	A15-I238 HydrophobicContact CB-CD1 3.82Å; V19-I238 HydrophobicContact CG2-CD1 3.63Å; V19-I238 HydrophobicContact CG2-CG1 4.2Å; I238-E243 HydrophobicContact CG2-CB 3.78Å; I238-E243 VanDerWaalsContact CG2-O 3.26Å; I238-E243 WeakPolarHBondContact CG2-O 3.5Å; I238-F245 CarbonylContact C-O 3.56Å; I238-F245 WeakPolarHBondContact CA-O 3.36Å; I238-V246 HydrophobicContact CD1-CG2 3.76Å
239	G	96.3	Very high	95.4	Very high	12 Å²	12	65.7 Å²	65.7	12%	0.124	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	-174.9	-177	0	0	0	0	0	112.9	E243 D244 F245	G239-E243 CarbonylContact O-C 3.49Å; G239-E243 VanDerWaalsContact O-CA 3.3Å; G239-E243 WeakPolarHBondContact O-CA 3.29Å; G239-D244 PolarHBondContact O-N 2.64Å; G239-F245 PolarHBondContact N-O 2.86Å; G239-F245 PolarHBondContact O-N 3.25Å
240	G	95.6	Very high	95.6	Very high	32 Å²	32	67.7 Å²	67.7	33%	0.33	36%	0.357	S	S	.	.	S	Bend	trans	93.6	154.9	-168.7	0	0	0	0	0	111.9	M242 E243	G240-M242 PolarHBondContact O-N 3.45Å; G240-E243 PolarHBondContact O-N 2.88Å
241	L	95.7	Very high	95.7	Very high	172 Å²	172	69.2 Å²	69.2	90%	0.901	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30	179.4	-179.7	62	0	0	0	111.9
242	M	94.4	Very high	95.7	Very high	148 Å²	148	72.8 Å²	72.8	73%	0.729	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	10.4	180	-58.2	-57.3	-62	0	0	112.7	G240 D244	G240-M242 PolarHBondContact O-N 3.45Å; M242-D244 HydrophobicContact CB-CB 4.33Å; M242-D244 PolarHBondContact O-N 2.83Å
243	E	94.3	Very high	95.6	Very high	119 Å²	119	72.7 Å²	72.7	56%	0.556	38%	0.381	S	S	*	.	S	Bend	trans	54.1	36.7	-174.4	-58.6	-165.2	141.5	0	0	113.5	R12 I238 G239 G240	R12-E243 IonicContact CZ-OE2 3.35Å; R12-E243 IonicContact NH1-OE2 3.77Å; R12-E243 PolarHBondContact NH1-OE2 3.23Å; I238-E243 HydrophobicContact CG2-CB 3.78Å; I238-E243 VanDerWaalsContact CG2-O 3.26Å; I238-E243 WeakPolarHBondContact CG2-O 3.5Å; G239-E243 CarbonylContact O-C 3.49Å; G239-E243 VanDerWaalsContact O-CA 3.3Å; G239-E243 WeakPolarHBondContact O-CA 3.29Å; G240-E243 PolarHBondContact O-N 2.88Å
244	D	93.3	Very high	95.6	Very high	97 Å²	97	71.8 Å²	71.8	52%	0.519	38%	0.375	S	S	.	.			trans	-99.2	1.2	-172.1	56	-25.1	0	0	0	113.8	G239 M242	G239-D244 PolarHBondContact O-N 2.64Å; M242-D244 HydrophobicContact CB-CB 4.33Å; M242-D244 PolarHBondContact O-N 2.83Å
245	F	96.8	Very high	95.6	Very high	108 Å²	108	69.3 Å²	69.3	47%	0.474	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	148.9	178.8	-55.2	-59.2	0	0	0	112.9	I238 G239 F247	I238-F245 CarbonylContact C-O 3.56Å; I238-F245 WeakPolarHBondContact CA-O 3.36Å; G239-F245 PolarHBondContact N-O 2.86Å; G239-F245 PolarHBondContact O-N 3.25Å; F245-F247 HydrophobicContact CB-CD1 3.96Å; F245-F247 HydrophobicContact CB-CE1 3.34Å; F245-F247 HydrophobicContact CB-CZ 3.82Å; F245-F247 HydrophobicContact CD2-CE1 4.1Å; F245-F247 AromaticContact CD2-CZ 3.98Å; F245-F247 HydrophobicContact CD2-CZ 3.98Å; F245-F247 AromaticContact CG-CE1 3.91Å; F245-F247 HydrophobicContact CG-CE1 3.91Å; F245-F247 HydrophobicContact CG-CZ 4.24Å
246	V	97.7	Very high	95.6	Very high	40 Å²	40	65.3 Å²	65.3	24%	0.242	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.5	163.3	-179.8	0	0	0	0	108	A15 F18 V19 L22 I238 L251	A15-V246 HydrophobicContact CB-CG2 4.46Å; F18-V246 HydrophobicContact CD1-CG1 4.05Å; F18-V246 HydrophobicContact CD1-CG2 4.3Å; F18-V246 HydrophobicContact CE1-CG1 3.99Å; V19-V246 HydrophobicContact CG2-CG1 3.92Å; L22-V246 HydrophobicContact CD1-CG1 4.07Å; I238-V246 HydrophobicContact CD1-CG2 3.76Å; V246-L251 HydrophobicContact CG1-CD2 4.21Å
247	F	97.7	Very high	95.5	Very high	107 Å²	107	65 Å²	65	47%	0.469	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.2	172.4	-58.6	-27.6	0	0	0	109.4	A236 V237 F245	A236-F247 CarbonylContact C-O 3.38Å; A236-F247 WeakPolarHBondContact CA-O 3.39Å; V237-F247 HydrophobicContact CG2-CB 4.15Å; V237-F247 HydrophobicContact CG2-CD2 4.48Å; V237-F247 PolarHBondContact N-O 3.45Å; V237-F247 PolarHBondContact O-N 3.27Å; F245-F247 HydrophobicContact CB-CD1 3.96Å; F245-F247 HydrophobicContact CB-CE1 3.34Å; F245-F247 HydrophobicContact CB-CZ 3.82Å; F245-F247 HydrophobicContact CD2-CE1 4.1Å; F245-F247 AromaticContact CD2-CZ 3.98Å; F245-F247 HydrophobicContact CD2-CZ 3.98Å; F245-F247 AromaticContact CG-CE1 3.91Å; F245-F247 HydrophobicContact CG-CE1 3.91Å; F245-F247 HydrophobicContact CG-CZ 4.24Å
248	G	95.4	Very high	95.4	Very high	34 Å²	34	62.9 Å²	62.9	35%	0.351	34%	0.34	S	S	.	.			trans	173.1	163.6	178.6	0	0	0	0	0	113.1
249	A	93	Very high	95.4	Very high	37 Å²	37	65 Å²	65	31%	0.306	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	159.6	172.2	0	0	0	0	0	111.2	P232 L251	P232-A249 HydrophobicContact CG-CB 3.75Å; A249-L251 VanDerWaalsContact C-N 3.25Å; A249-L251 PolarHBondContact O-N 2.72Å
250	R	94.3	Very high	95.4	Very high	57 Å²	57	64.9 Å²	64.9	22%	0.215	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	17.4	170.7	-49.9	169.3	-66.1	-77.7	-2.6	115.3	L22 A25 D252 L254	L22-R250 PolarHBondContact O-NH2 3.42Å; A25-R250 WeakPolarHBondContact O-CD 3.49Å; A25-R250 PolarHBondContact O-NE 2.92Å; R250-D252 CarbonylContact C-O 3.37Å; R250-D252 CarbonylContact O-C 3.14Å; R250-D252 PolarHBondContact O-N 3.33Å; R250-L254 HydrophobicContact CB-CD1 3.58Å; R250-L254 HydrophobicContact CB-CG 4.08Å; R250-L254 HydrophobicContact CG-CD1 4.48Å; R250-L254 VanDerWaalsContact O-CB 3.23Å; R250-L254 WeakPolarHBondContact O-CB 3.48Å; R250-L254 WeakPolarHBondContact O-CG 3.27Å; R250-L254 PolarHBondContact O-N 2.71Å
251	L	94.6	Very high	95.5	Very high	63 Å²	63	63.5 Å²	63.5	33%	0.33	34%	0.338	S	S	.	.	H	α-helix	trans	-49.2	-48.9	173.5	-66.7	178.7	0	0	0	111.2	F18 L22 V246 A249 N253 L254 L255	F18-L251 HydrophobicContact CE1-CD2 3.65Å; F18-L251 HydrophobicContact CZ-CD2 3.76Å; L22-L251 HydrophobicContact CD1-CD2 3.7Å; V246-L251 HydrophobicContact CG1-CD2 4.21Å; A249-L251 VanDerWaalsContact C-N 3.25Å; A249-L251 PolarHBondContact O-N 2.72Å; L251-N253 CarbonylContact O-C 3.56Å; L251-N253 VanDerWaalsContact O-CA 3.24Å; L251-N253 WeakPolarHBondContact O-CA 3.3Å; L251-L254 PolarHBondContact O-N 2.89Å; L251-L255 WeakPolarHBondContact O-CB 3.27Å; L251-L255 PolarHBondContact O-N 3.23Å
252	D	93.1	Very high	95.5	Very high	79 Å²	79	56.1 Å²	56.1	42%	0.422	30%	0.3	S	S	.	.	H	α-helix	trans	-75.9	110.6	161.8	167	41.1	0	0	0	109.9	H91 K93 R250	H91-D252 IonicContact CE1-OD1 3.84Å; H91-D252 IonicContact NE2-OD1 2.83Å; H91-D252 PolarHBondContact NE2-OD1 3.41Å; K93-D252 WeakPolarHBondContact CE-O 3.4Å; K93-D252 PolarHBondContact NZ-O 3.31Å; K93-D252 IonicContact NZ-OD2 2.64Å; K93-D252 PolarHBondContact NZ-OD2 2.89Å; R250-D252 CarbonylContact C-O 3.37Å; R250-D252 CarbonylContact O-C 3.14Å; R250-D252 PolarHBondContact O-N 3.33Å
253	N	93	Very high	95.6	Very high	29 Å²	29	50.8 Å²	50.8	16%	0.155	28%	0.283	C	S	.	.	H	α-helix	cis	-121.1	31.2	-4.5	-160.5	23.5	0	0	0	112.7	H91 L251 L255 S256 T257	H91-N253 WeakPolarHBondContact CE1-CB 3.41Å; H91-N253 PolarHBondContact CE1-ND2 3.12Å; H91-N253 PolarHBondContact ND1-ND2 3.38Å; H91-N253 VanDerWaalsContact NE2-CB 3.32Å; H91-N253 WeakPolarHBondContact NE2-CB 3.33Å; L251-N253 CarbonylContact O-C 3.56Å; L251-N253 VanDerWaalsContact O-CA 3.24Å; L251-N253 WeakPolarHBondContact O-CA 3.3Å; N253-L255 PolarHBondContact O-N 2.9Å; N253-S256 PolarHBondContact O-N 3.15Å; N253-S256 WeakPolarHBondContact OD1-CB 3.41Å; N253-S256 PolarHBondContact OD1-OG 2.9Å; N253-T257 PolarHBondContact O-N 2.97Å; N253-T257 PolarHBondContact O-OG1 2.72Å
254	L	95.5	Very high	95.7	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-24.2	175.4	-65.7	-174.8	0	0	0	112.3	F21 L22 A25 A31 L92 R250 L251 T257 Y258	F21-L254 HydrophobicContact CE1-CB 4.05Å; F21-L254 HydrophobicContact CE1-CD2 4.15Å; L22-L254 HydrophobicContact CD2-CB 3.75Å; L22-L254 HydrophobicContact CD2-CD1 3.93Å; L22-L254 HydrophobicContact CD2-CG 4.5Å; A25-L254 HydrophobicContact CB-CD1 3.65Å; A25-L254 HydrophobicContact CB-CD2 4.42Å; A25-L254 WeakPolarHBondContact O-CD1 3.36Å; A31-L254 HydrophobicContact CB-CD2 3.93Å; L92-L254 HydrophobicContact CD2-CD2 3.54Å; R250-L254 HydrophobicContact CB-CD1 3.58Å; R250-L254 HydrophobicContact CB-CG 4.08Å; R250-L254 HydrophobicContact CG-CD1 4.48Å; R250-L254 VanDerWaalsContact O-CB 3.23Å; R250-L254 WeakPolarHBondContact O-CB 3.48Å; R250-L254 WeakPolarHBondContact O-CG 3.27Å; R250-L254 PolarHBondContact O-N 2.71Å; L251-L254 PolarHBondContact O-N 2.89Å; L254-T257 PolarHBondContact O-N 3.27Å; L254-Y258 VanDerWaalsContact O-CB 3.26Å; L254-Y258 WeakPolarHBondContact O-CB 3.41Å; L254-Y258 PolarHBondContact O-N 3.04Å
255	L	96.3	Very high	95.9	Very high	79 Å²	79	42.9 Å²	42.9	41%	0.414	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-56.8	170.4	177.4	60.4	0	0	0	110.6	F18 L251 N253 T257 Y258 T259	F18-L255 HydrophobicContact CD1-CD1 4.07Å; F18-L255 HydrophobicContact CE1-CB 4.29Å; F18-L255 HydrophobicContact CE1-CD1 3.67Å; F18-L255 VanDerWaalsContact CE2-CA 3.49Å; F18-L255 HydrophobicContact CE2-CB 4.21Å; F18-L255 HydrophobicContact CE2-CD1 4.22Å; F18-L255 HydrophobicContact CG-CD1 4.49Å; F18-L255 VanDerWaalsContact CZ-CA 3.46Å; F18-L255 HydrophobicContact CZ-CB 3.65Å; F18-L255 HydrophobicContact CZ-CD1 3.75Å; F18-L255 HydrophobicContact CZ-CG 4.3Å; L251-L255 WeakPolarHBondContact O-CB 3.27Å; L251-L255 PolarHBondContact O-N 3.23Å; N253-L255 PolarHBondContact O-N 2.9Å; L255-T257 VanDerWaalsContact C-N 3.27Å; L255-T257 PolarHBondContact O-N 3.38Å; L255-Y258 PolarHBondContact O-N 2.71Å; L255-T259 HydrophobicContact CD1-CG2 3.95Å; L255-T259 WeakPolarHBondContact O-CG2 3.34Å; L255-T259 PolarHBondContact O-N 2.74Å; L255-T259 PolarHBondContact O-OG1 2.84Å; L255-T259 VanDerWaalsContact O-OG1 3.09Å
256	S	96	Very high	95.9	Very high	45 Å²	45	42 Å²	42	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-63.8	-36	179.4	-54.6	0	0	0	0	111.9	T90 N253 T259 G260	T90-S256 WeakPolarHBondContact CG2-O 3.1Å; N253-S256 PolarHBondContact O-N 3.15Å; N253-S256 WeakPolarHBondContact OD1-CB 3.41Å; N253-S256 PolarHBondContact OD1-OG 2.9Å; S256-T259 WeakPolarHBondContact CA-OG1 3.23Å; S256-T259 PolarHBondContact O-OG1 3.2Å; S256-G260 WeakPolarHBondContact O-CA 3.24Å; S256-G260 PolarHBondContact O-N 3.3Å
257	T	96.2	Very high	95.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.8	-49.2	175.2	-57.7	0	0	0	0	111.1	F21 T90 N253 L254 L255 L261 F283 A285	F21-T257 HydrophobicContact CZ-CG2 4.22Å; T90-T257 WeakPolarHBondContact CB-OG1 3.19Å; T90-T257 PolarHBondContact OG1-OG1 3.13Å; N253-T257 PolarHBondContact O-N 2.97Å; N253-T257 PolarHBondContact O-OG1 2.72Å; L254-T257 PolarHBondContact O-N 3.27Å; L255-T257 VanDerWaalsContact C-N 3.27Å; L255-T257 PolarHBondContact O-N 3.38Å; T257-L261 VanDerWaalsContact O-CB 3.25Å; T257-L261 WeakPolarHBondContact O-CB 3.49Å; T257-L261 PolarHBondContact O-N 2.87Å; T257-F283 HydrophobicContact CG2-CZ 4.05Å; T257-F283 WeakPolarHBondContact O-CZ 3.31Å; T257-A285 HydrophobicContact CG2-CB 4.22Å
258	Y	97.1	Very high	95.6	Very high	24 Å²	24	36.6 Å²	36.6	9%	0.094	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-52.9	177	172.9	-98	0	0	0	111.6	Y14 H17 F18 F21 L254 L255 G260 L261 T262	Y14-Y258 PolarHBondContact O-OH 2.8Å; H17-Y258 HydrophobicContact CB-CE2 4.33Å; H17-Y258 WeakPolarHBondContact CB-OH 3.34Å; F18-Y258 HydrophobicContact CB-CD1 3.73Å; F18-Y258 HydrophobicContact CB-CE1 3.65Å; F18-Y258 HydrophobicContact CB-CG 4.24Å; F18-Y258 AromaticContact CD2-CD1 3.61Å; F18-Y258 HydrophobicContact CD2-CD1 3.61Å; F18-Y258 HydrophobicContact CD2-CD2 4.26Å; F18-Y258 HydrophobicContact CD2-CE1 4.4Å; F18-Y258 AromaticContact CD2-CG 3.54Å; F18-Y258 HydrophobicContact CD2-CG 3.54Å; F18-Y258 HydrophobicContact CE2-CG 4.38Å; F18-Y258 AromaticContact CG-CD1 3.93Å; F18-Y258 HydrophobicContact CG-CD1 3.93Å; F18-Y258 HydrophobicContact CG-CE1 4.36Å; F18-Y258 HydrophobicContact CG-CG 4.28Å; F21-Y258 HydrophobicContact CB-CD2 3.74Å; F21-Y258 HydrophobicContact CB-CE2 4.25Å; F21-Y258 HydrophobicContact CD1-CD2 4.23Å; F21-Y258 HydrophobicContact CD1-CG 4.44Å; F21-Y258 HydrophobicContact CD2-CD2 4.23Å; F21-Y258 AromaticContact CG-CD2 3.82Å; F21-Y258 HydrophobicContact CG-CD2 3.82Å; F21-Y258 HydrophobicContact CG-CG 4.46Å; L254-Y258 VanDerWaalsContact O-CB 3.26Å; L254-Y258 WeakPolarHBondContact O-CB 3.41Å; L254-Y258 PolarHBondContact O-N 3.04Å; L255-Y258 PolarHBondContact O-N 2.71Å; Y258-G260 VanDerWaalsContact C-N 3.33Å; Y258-G260 PolarHBondContact O-N 2.93Å; Y258-L261 PolarHBondContact O-N 2.77Å; Y258-T262 WeakPolarHBondContact O-CB 3.45Å; Y258-T262 PolarHBondContact O-N 3.24Å; Y258-T262 PolarHBondContact O-OG1 2.99Å
259	T	96.7	Very high	95.6	Very high	73 Å²	73	38.3 Å²	38.3	45%	0.448	23%	0.23	S	C	.	.	H	α-helix	trans	-66.1	-37	-176.9	57.1	0	0	0	0	112.1	L255 S256 G263	L255-T259 HydrophobicContact CD1-CG2 3.95Å; L255-T259 WeakPolarHBondContact O-CG2 3.34Å; L255-T259 PolarHBondContact O-N 2.74Å; L255-T259 PolarHBondContact O-OG1 2.84Å; L255-T259 VanDerWaalsContact O-OG1 3.09Å; S256-T259 WeakPolarHBondContact CA-OG1 3.23Å; S256-T259 PolarHBondContact O-OG1 3.2Å; T259-G263 PolarHBondContact O-N 2.79Å
260	G	96.6	Very high	95.7	Very high	9 Å²	9	41.4 Å²	41.4	9%	0.093	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-44	176.7	0	0	0	0	0	112.2	S256 Y258 F264	S256-G260 WeakPolarHBondContact O-CA 3.24Å; S256-G260 PolarHBondContact O-N 3.3Å; Y258-G260 VanDerWaalsContact C-N 3.33Å; Y258-G260 PolarHBondContact O-N 2.93Å; G260-F264 WeakPolarHBondContact O-CB 3.44Å; G260-F264 PolarHBondContact O-N 3.49Å
261	L	97.7	Very high	95.6	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-65.4	-48.5	175.4	178.8	64	0	0	0	111.3	C35 L39 T257 Y258 F264 M265 F283	C35-L261 HydrophobicContact CB-CD2 3.81Å; L39-L261 HydrophobicContact CD1-CD1 4.21Å; L39-L261 HydrophobicContact CD2-CD1 3.82Å; L39-L261 HydrophobicContact CG-CD1 3.95Å; T257-L261 VanDerWaalsContact O-CB 3.25Å; T257-L261 WeakPolarHBondContact O-CB 3.49Å; T257-L261 PolarHBondContact O-N 2.87Å; Y258-L261 PolarHBondContact O-N 2.77Å; L261-F264 PolarHBondContact O-N 2.96Å; L261-M265 HydrophobicContact CD1-CG 4.19Å; L261-M265 HydrophobicContact CD1-SD 4.18Å; L261-M265 HydrophobicContact CD2-CE 4.42Å; L261-M265 HydrophobicContact CG-CE 3.94Å; L261-M265 HydrophobicContact CG-CG 4.48Å; L261-M265 HydrophobicContact CG-SD 4.19Å; L261-M265 WeakPolarHBondContact O-CG 3.39Å; L261-M265 PolarHBondContact O-N 3.48Å; L261-F283 HydrophobicContact CB-CD1 4.39Å; L261-F283 HydrophobicContact CB-CE1 3.97Å; L261-F283 HydrophobicContact CB-CE2 4.11Å; L261-F283 HydrophobicContact CB-CZ 3.81Å; L261-F283 HydrophobicContact CD1-CD1 3.84Å; L261-F283 HydrophobicContact CD1-CE1 3.95Å; L261-F283 HydrophobicContact CD1-CG 4.43Å; L261-F283 HydrophobicContact CG-CE1 4.46Å; L261-F283 VanDerWaalsContact N-CE2 3.33Å
262	T	96.8	Very high	95.5	Very high	18 Å²	18	49.1 Å²	49.1	11%	0.11	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-50.2	-179.8	-62.3	0	0	0	0	111.1	Y14 Y258 F264 M265 E266	Y14-T262 HydrophobicContact CD1-CG2 4.18Å; Y14-T262 HydrophobicContact CE1-CG2 3.73Å; Y258-T262 WeakPolarHBondContact O-CB 3.45Å; Y258-T262 PolarHBondContact O-N 3.24Å; Y258-T262 PolarHBondContact O-OG1 2.99Å; T262-F264 VanDerWaalsContact C-N 3.32Å; T262-F264 PolarHBondContact O-N 3.16Å; T262-M265 PolarHBondContact O-N 2.92Å; T262-E266 WeakPolarHBondContact O-CG 3.21Å; T262-E266 PolarHBondContact O-N 3.28Å
263	G	95.8	Very high	95.5	Very high	36 Å²	36	48 Å²	48	37%	0.371	28%	0.275	S	S	.	.	H	α-helix	trans	-61.4	-38.6	176.6	0	0	0	0	0	113	T259 A267	T259-G263 PolarHBondContact O-N 2.79Å; G263-A267 WeakPolarHBondContact O-CB 3.36Å; G263-A267 PolarHBondContact O-N 2.87Å
264	F	97	Very high	95.5	Very high	14 Å²	14	47.1 Å²	47.1	6%	0.061	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-45.5	173.8	168.5	-102	0	0	0	112.4	L39 F44 A72 V74 G260 L261 T262 A267 T268 M281 F283	L39-F264 HydrophobicContact CD2-CE1 4.29Å; F44-F264 AromaticContact CE1-CE1 3.48Å; F44-F264 HydrophobicContact CE1-CE1 3.48Å; F44-F264 VanDerWaalsContact CE1-CE1 3.48Å; F44-F264 AromaticContact CE1-CZ 3.7Å; F44-F264 HydrophobicContact CE1-CZ 3.7Å; F44-F264 HydrophobicContact CE2-CE1 4.47Å; F44-F264 HydrophobicContact CZ-CD1 4.31Å; F44-F264 AromaticContact CZ-CE1 3.39Å; F44-F264 HydrophobicContact CZ-CE1 3.39Å; F44-F264 AromaticContact CZ-CZ 3.85Å; F44-F264 HydrophobicContact CZ-CZ 3.85Å; A72-F264 HydrophobicContact CB-CD1 4.46Å; A72-F264 HydrophobicContact CB-CE1 3.64Å; A72-F264 HydrophobicContact CB-CZ 4.11Å; V74-F264 HydrophobicContact CG2-CE2 4.41Å; V74-F264 HydrophobicContact CG2-CZ 3.91Å; G260-F264 WeakPolarHBondContact O-CB 3.44Å; G260-F264 PolarHBondContact O-N 3.49Å; L261-F264 PolarHBondContact O-N 2.96Å; T262-F264 VanDerWaalsContact C-N 3.32Å; T262-F264 PolarHBondContact O-N 3.16Å; F264-A267 PolarHBondContact O-N 2.96Å; F264-T268 HydrophobicContact CD2-CG2 4.05Å; F264-T268 HydrophobicContact CE2-CG2 3.78Å; F264-T268 HydrophobicContact CZ-CG2 4.15Å; F264-T268 WeakPolarHBondContact O-CB 3.27Å; F264-T268 VanDerWaalsContact O-CG2 3.22Å; F264-T268 WeakPolarHBondContact O-CG2 3.21Å; F264-T268 PolarHBondContact O-N 3.27Å; F264-T268 PolarHBondContact O-OG1 2.99Å; F264-M281 HydrophobicContact CD2-CB 4.47Å; F264-M281 HydrophobicContact CE2-CB 4.02Å; F264-F283 HydrophobicContact CB-CB 3.99Å; F264-F283 HydrophobicContact CD1-CB 3.81Å; F264-F283 HydrophobicContact CD2-CB 4.06Å; F264-F283 HydrophobicContact CE1-CB 4.27Å; F264-F283 HydrophobicContact CG-CB 3.68Å
265	M	97.2	Very high	95.5	Very high	36 Å²	36	48.7 Å²	48.7	18%	0.177	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-42.4	178.7	-71.1	-173	-52.9	0	0	111.8	L39 A42 L261 T262 T268 A269	L39-M265 HydrophobicContact CD2-CG 4.25Å; L39-M265 HydrophobicContact CD2-SD 4.27Å; A42-M265 HydrophobicContact CB-SD 4.04Å; L261-M265 HydrophobicContact CD1-CG 4.19Å; L261-M265 HydrophobicContact CD1-SD 4.18Å; L261-M265 HydrophobicContact CD2-CE 4.42Å; L261-M265 HydrophobicContact CG-CE 3.94Å; L261-M265 HydrophobicContact CG-CG 4.48Å; L261-M265 HydrophobicContact CG-SD 4.19Å; L261-M265 WeakPolarHBondContact O-CG 3.39Å; L261-M265 PolarHBondContact O-N 3.48Å; T262-M265 PolarHBondContact O-N 2.92Å; M265-T268 PolarHBondContact O-N 2.87Å; M265-T268 PolarHBondContact O-OG1 2.84Å; M265-A269 WeakPolarHBondContact O-CB 3.05Å; M265-A269 PolarHBondContact O-N 3.05Å
266	E	95.4	Very high	95.3	Very high	89 Å²	89	49.1 Å²	49.1	42%	0.416	29%	0.288	S	S	.	.	H	α-helix	trans	-64.7	-44.5	176	-72.1	179.3	-176.1	0	0	111.8	Y14 T262 T268 A269 M270	Y14-E266 VanDerWaalsContact CE1-OE1 3.23Å; Y14-E266 WeakPolarHBondContact CE1-OE1 3.18Å; Y14-E266 VanDerWaalsContact OH-CD 3.27Å; Y14-E266 PolarHBondContact OH-OE1 3.08Å; Y14-E266 PolarHBondContact OH-OE2 3.45Å; T262-E266 WeakPolarHBondContact O-CG 3.21Å; T262-E266 PolarHBondContact O-N 3.28Å; E266-T268 VanDerWaalsContact C-N 3.31Å; E266-T268 PolarHBondContact O-N 3.46Å; E266-A269 PolarHBondContact O-N 3.44Å; E266-M270 PolarHBondContact O-N 2.85Å
267	A	94.3	Very high	95.2	Very high	31 Å²	31	48.1 Å²	48.1	26%	0.256	28%	0.281	S	S	.	.	H	α-helix	trans	-58.9	-43.1	176.2	0	0	0	0	0	112.1	G263 F264 A269 M270	G263-A267 WeakPolarHBondContact O-CB 3.36Å; G263-A267 PolarHBondContact O-N 2.87Å; F264-A267 PolarHBondContact O-N 2.96Å; A267-A269 VanDerWaalsContact C-N 3.33Å; A267-M270 HydrophobicContact CB-CE 4.44Å; A267-M270 PolarHBondContact O-N 3.42Å
268	T	94.8	Very high	95.1	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-84.2	-6.3	-178.3	59.7	0	0	0	0	114	K60 V74 F264 M265 E266 V274 M281	K60-T268 WeakPolarHBondContact CE-O 3.11Å; K60-T268 PolarHBondContact NZ-O 2.88Å; V74-T268 HydrophobicContact CB-CG2 3.83Å; V74-T268 HydrophobicContact CG1-CG2 4.37Å; V74-T268 HydrophobicContact CG2-CG2 3.49Å; V74-T268 VanDerWaalsContact CG2-CG2 3.49Å; F264-T268 HydrophobicContact CD2-CG2 4.05Å; F264-T268 HydrophobicContact CE2-CG2 3.78Å; F264-T268 HydrophobicContact CZ-CG2 4.15Å; F264-T268 WeakPolarHBondContact O-CB 3.27Å; F264-T268 VanDerWaalsContact O-CG2 3.22Å; F264-T268 WeakPolarHBondContact O-CG2 3.21Å; F264-T268 PolarHBondContact O-N 3.27Å; F264-T268 PolarHBondContact O-OG1 2.99Å; M265-T268 PolarHBondContact O-N 2.87Å; M265-T268 PolarHBondContact O-OG1 2.84Å; E266-T268 VanDerWaalsContact C-N 3.31Å; E266-T268 PolarHBondContact O-N 3.46Å; T268-V274 WeakPolarHBondContact O-CG2 3.38Å; T268-M281 HydrophobicContact CG2-CB 4.28Å; T268-M281 HydrophobicContact CG2-CE 3.88Å; T268-M281 HydrophobicContact CG2-SD 3.97Å
269	A	95.6	Very high	94.9	Very high	69 Å²	69	49.4 Å²	49.4	57%	0.57	29%	0.293	S	S	*	.	H	α-helix	trans	-81.6	-23.8	167.6	0	0	0	0	0	112.1	M265 E266 A267 K271	M265-A269 WeakPolarHBondContact O-CB 3.05Å; M265-A269 PolarHBondContact O-N 3.05Å; E266-A269 PolarHBondContact O-N 3.44Å; A267-A269 VanDerWaalsContact C-N 3.33Å; A269-K271 PolarHBondContact O-N 2.83Å; A269-K271 VanDerWaalsContact O-N 3.1Å
270	M	94.7	Very high	94.8	Very high	103 Å²	103	46 Å²	46	51%	0.507	27%	0.272	S	S	.	.			trans	-72.5	102.3	176.2	-68.3	-174.2	-81.7	0	0	110.9	E266 A267 D272 V273 V274	E266-M270 PolarHBondContact O-N 2.85Å; A267-M270 HydrophobicContact CB-CE 4.44Å; A267-M270 PolarHBondContact O-N 3.42Å; M270-D272 VanDerWaalsContact C-N 3.29Å; M270-D272 PolarHBondContact O-N 2.89Å; M270-V273 HydrophobicContact CB-CB 4.04Å; M270-V273 HydrophobicContact CB-CG2 3.7Å; M270-V273 HydrophobicContact CE-CG2 4.13Å; M270-V273 WeakPolarHBondContact O-CB 2.67Å; M270-V273 PolarHBondContact O-N 2.79Å; M270-V273 HydrophobicContact SD-CG2 4.24Å; M270-V274 PolarHBondContact O-N 2.7Å
271	K	92.4	Very high	94.7	Very high	149 Å²	149	46.7 Å²	46.7	65%	0.648	27%	0.273	S	S	*	.	H	α-helix	trans	-53.2	-43.8	-176.5	-175.1	176.5	178.1	-174.4	0	113	A269 V273 V274 D275	A269-K271 PolarHBondContact O-N 2.83Å; A269-K271 VanDerWaalsContact O-N 3.1Å; K271-V273 VanDerWaalsContact C-N 3.28Å; K271-V273 PolarHBondContact O-N 2.85Å; K271-V274 PolarHBondContact O-N 3.08Å; K271-D275 WeakPolarHBondContact CE-OD2 3.44Å; K271-D275 VanDerWaalsContact CG-OD2 3.25Å; K271-D275 WeakPolarHBondContact CG-OD2 2.91Å; K271-D275 VanDerWaalsContact O-CB 3.29Å; K271-D275 WeakPolarHBondContact O-CB 3.28Å; K271-D275 PolarHBondContact O-N 2.95Å
272	D	93.8	Very high	94.6	Very high	132 Å²	132	46.8 Å²	46.8	71%	0.706	27%	0.274	S	S	*	.	H	α-helix	trans	-63.4	-34.6	-179.4	-62.9	-21.4	0	0	0	112.6	M270 S276	M270-D272 VanDerWaalsContact C-N 3.29Å; M270-D272 PolarHBondContact O-N 2.89Å; D272-S276 VanDerWaalsContact O-CB 3.29Å; D272-S276 WeakPolarHBondContact O-CB 3.48Å; D272-S276 PolarHBondContact O-N 3.35Å; D272-S276 VanDerWaalsContact O-N 3.12Å; D272-S276 PolarHBondContact O-OG 2.52Å
273	V	91.9	Very high	94.6	Very high	56 Å²	56	45.9 Å²	45.9	34%	0.339	27%	0.268	S	S	.	.	H	α-helix	trans	-66.7	-46.8	176.2	175.7	0	0	0	0	110.1	M270 K271 S277 M281	M270-V273 HydrophobicContact CB-CB 4.04Å; M270-V273 HydrophobicContact CB-CG2 3.7Å; M270-V273 HydrophobicContact CE-CG2 4.13Å; M270-V273 WeakPolarHBondContact O-CB 2.67Å; M270-V273 PolarHBondContact O-N 2.79Å; M270-V273 HydrophobicContact SD-CG2 4.24Å; K271-V273 VanDerWaalsContact C-N 3.28Å; K271-V273 PolarHBondContact O-N 2.85Å; V273-S277 VanDerWaalsContact O-CB 3.24Å; V273-S277 WeakPolarHBondContact O-CB 3.4Å; V273-S277 PolarHBondContact O-N 3.03Å; V273-M281 HydrophobicContact CG1-CE 4.49Å; V273-M281 HydrophobicContact CG1-SD 4.27Å
274	V	94	Very high	94.5	Very high	10 Å²	10	44.2 Å²	44.2	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-67.5	-48	179.2	-179.5	0	0	0	0	110.6	R58 V74 G77 T268 M270 K271 S276 S277 M281	R58-V274 HydrophobicContact CB-CG1 4.36Å; R58-V274 HydrophobicContact CG-CG1 4.34Å; V74-V274 HydrophobicContact CG1-CG1 4.12Å; V74-V274 HydrophobicContact CG1-CG2 4.35Å; G77-V274 PolarHBondContact N-O 2.92Å; T268-V274 WeakPolarHBondContact O-CG2 3.38Å; M270-V274 PolarHBondContact O-N 2.7Å; K271-V274 PolarHBondContact O-N 3.08Å; V274-S276 PolarHBondContact O-N 3.06Å; V274-S277 PolarHBondContact O-N 2.75Å; V274-M281 HydrophobicContact CG2-CE 4.04Å
275	D	94	Very high	94.3	Very high	43 Å²	43	43.6 Å²	43.6	23%	0.23	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-35.9	-174	-81.5	-19.3	0	0	0	113.2	R58 N78 K271	R58-D275 IonicContact CZ-OD1 3.35Å; R58-D275 IonicContact NE-OD1 2.79Å; R58-D275 PolarHBondContact NE-OD1 2.96Å; R58-D275 IonicContact NH2-OD1 3.12Å; R58-D275 PolarHBondContact NH2-OD1 3.26Å; R58-D275 VanDerWaalsContact NH2-OD1 3.11Å; N78-D275 PolarHBondContact ND2-O 3.16Å; K271-D275 WeakPolarHBondContact CE-OD2 3.44Å; K271-D275 VanDerWaalsContact CG-OD2 3.25Å; K271-D275 WeakPolarHBondContact CG-OD2 2.91Å; K271-D275 VanDerWaalsContact O-CB 3.29Å; K271-D275 WeakPolarHBondContact O-CB 3.28Å; K271-D275 PolarHBondContact O-N 2.95Å
276	S	93.6	Very high	93.9	Very high	88 Å²	88	42.5 Å²	42.5	62%	0.615	24%	0.243	S	C	*	.	H	α-helix	trans	-82.3	-22.4	178.8	62.5	0	0	0	0	113.5	N78 D272 V274	N78-S276 PolarHBondContact ND2-O 2.93Å; D272-S276 VanDerWaalsContact O-CB 3.29Å; D272-S276 WeakPolarHBondContact O-CB 3.48Å; D272-S276 PolarHBondContact O-N 3.35Å; D272-S276 VanDerWaalsContact O-N 3.12Å; D272-S276 PolarHBondContact O-OG 2.52Å; V274-S276 PolarHBondContact O-N 3.06Å
277	S	93.2	Very high	93.4	Very high	24 Å²	24	38.4 Å²	38.4	17%	0.168	22%	0.223	C	C	.	.			trans	-73.6	141.5	-177.9	-177.1	0	0	0	0	112.7	G76 G77 N78 V273 V274 D279	G76-S277 CarbonylContact C-O 3.28Å; G76-S277 VanDerWaalsContact C-O 3.28Å; G76-S277 VanDerWaalsContact CA-O 3.32Å; G76-S277 WeakPolarHBondContact CA-O 3.26Å; G77-S277 PolarHBondContact N-O 2.75Å; N78-S277 PolarHBondContact N-O 3.15Å; V273-S277 VanDerWaalsContact O-CB 3.24Å; V273-S277 WeakPolarHBondContact O-CB 3.4Å; V273-S277 PolarHBondContact O-N 3.03Å; V274-S277 PolarHBondContact O-N 2.75Å; S277-D279 PolarHBondContact OG-N 2.8Å; S277-D279 PolarHBondContact OG-O 3.48Å
278	A	93.6	Very high	92.8	Very high	23 Å²	23	38.7 Å²	38.7	19%	0.19	22%	0.221	C	C	.	.			trans	-103	-3.5	165	0	0	0	0	0	112.3	N78 F79 R83	N78-A278 HydrophobicContact CB-CB 4.1Å; F79-A278 WeakPolarHBondContact CA-O 3.45Å; R83-A278 VanDerWaalsContact CB-O 3.24Å; R83-A278 WeakPolarHBondContact CB-O 3.4Å; R83-A278 WeakPolarHBondContact CG-O 3.39Å
279	D	93.6	Very high	92.1	Very high	28 Å²	28	41.6 Å²	41.6	15%	0.15	23%	0.234	C	C	.	.	S	Bend	trans	-100.3	168.8	-169.1	-61.5	-9	0	0	0	111.2	G76 R83 H86 S277	G76-D279 PolarHBondContact N-O 3.4Å; R83-D279 IonicContact CZ-OD1 3.98Å; R83-D279 IonicContact NE-OD1 3.08Å; R83-D279 PolarHBondContact NE-OD1 2.8Å; R83-D279 VanDerWaalsContact NE-OD1 3.12Å; R83-D279 IonicContact NH2-OD1 2.74Å; R83-D279 PolarHBondContact NH2-OD1 3.49Å; H86-D279 IonicContact CD2-OD2 3.61Å; H86-D279 IonicContact CE1-OD2 3.91Å; H86-D279 IonicContact NE2-OD2 3.4Å; H86-D279 PolarHBondContact NE2-OD2 2.88Å; S277-D279 PolarHBondContact OG-N 2.8Å; S277-D279 PolarHBondContact OG-O 3.48Å
280	V	93.9	Very high	90.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.6	172.3	-177.7	0	0	0	0	108.9	F73 L75 F79 P84 V85 H86 F304 V308	F73-V280 HydrophobicContact CB-CG1 4.18Å; L75-V280 HydrophobicContact CD2-CG1 4.3Å; L75-V280 HydrophobicContact CD2-CG2 3.81Å; F79-V280 HydrophobicContact CD2-CG2 3.88Å; F79-V280 HydrophobicContact CE2-CG2 3.42Å; F79-V280 VanDerWaalsContact CE2-CG2 3.42Å; F79-V280 HydrophobicContact CZ-CG2 4.29Å; P84-V280 PolarHBondContact O-N 3.45Å; V85-V280 WeakPolarHBondContact CA-O 3.37Å; V85-V280 HydrophobicContact CB-CB 4.42Å; V85-V280 HydrophobicContact CG1-CB 4.34Å; V85-V280 HydrophobicContact CG1-CG1 4.25Å; V85-V280 HydrophobicContact CG2-CB 4.06Å; V85-V280 HydrophobicContact CG2-CG1 4.48Å; V85-V280 HydrophobicContact CG2-CG2 4.4Å; H86-V280 PolarHBondContact N-O 2.81Å; V280-F304 HydrophobicContact CG1-CZ 3.86Å; V280-V308 HydrophobicContact CG2-CG1 4.43Å
281	M	95.2	Very high	90.1	Very high	25 Å²	25	39 Å²	39	12%	0.123	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	135.2	165.1	-67.8	174.9	-79.7	0	0	108.8	F73 V74 F264 T268 V273 V274	F73-M281 CarbonylContact C-O 3.59Å; F73-M281 WeakPolarHBondContact CA-O 3.15Å; F73-M281 WeakPolarHBondContact CB-O 3.34Å; V74-M281 HydrophobicContact CB-CE 4.42Å; V74-M281 HydrophobicContact CG1-CE 4.3Å; V74-M281 PolarHBondContact N-O 2.84Å; V74-M281 PolarHBondContact O-N 3.19Å; F264-M281 HydrophobicContact CD2-CB 4.47Å; F264-M281 HydrophobicContact CE2-CB 4.02Å; T268-M281 HydrophobicContact CG2-CB 4.28Å; T268-M281 HydrophobicContact CG2-CE 3.88Å; T268-M281 HydrophobicContact CG2-SD 3.97Å; V273-M281 HydrophobicContact CG1-CE 4.49Å; V273-M281 HydrophobicContact CG1-SD 4.27Å; V274-M281 HydrophobicContact CG2-CE 4.04Å
282	M	95.8	Very high	89.1	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.02	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	138.2	-176	-177.7	-179.2	-71.7	0	0	112.4	I71 A72 F73 V85 H86 M87 V88 F304	I71-M282 HydrophobicContact CG2-CE 3.92Å; I71-M282 HydrophobicContact CG2-CG 3.79Å; I71-M282 HydrophobicContact CG2-SD 3.73Å; A72-M282 CarbonylContact O-C 3.54Å; A72-M282 WeakPolarHBondContact O-CA 3.18Å; A72-M282 WeakPolarHBondContact O-CG 3.2Å; F73-M282 HydrophobicContact CB-CB 4.38Å; F73-M282 HydrophobicContact CB-CE 4.42Å; F73-M282 HydrophobicContact CB-CG 4.45Å; V85-M282 HydrophobicContact CG1-CB 3.79Å; V85-M282 HydrophobicContact CG1-CE 4.07Å; V85-M282 HydrophobicContact CG1-SD 4.24Å; H86-M282 PolarHBondContact O-N 3.29Å; M87-M282 CarbonylContact C-O 3.6Å; M87-M282 WeakPolarHBondContact CA-O 3.32Å; M87-M282 HydrophobicContact CB-CB 4.44Å; M87-M282 HydrophobicContact CE-SD 3.32Å; M87-M282 WeakPolarHBondContact CE-SD 3.34Å; M87-M282 HydrophobicContact CG-CB 4.42Å; M87-M282 HydrophobicContact CG-CG 4.28Å; M87-M282 HydrophobicContact CG-SD 4.2Å; M87-M282 HydrophobicContact SD-SD 4.44Å; V88-M282 PolarHBondContact N-O 2.9Å; M282-F304 HydrophobicContact CE-CD1 3.44Å; M282-F304 VanDerWaalsContact CE-CD1 3.44Å; M282-F304 HydrophobicContact CE-CD2 3.51Å; M282-F304 HydrophobicContact CE-CE1 3.29Å; M282-F304 HydrophobicContact CE-CE2 3.36Å; M282-F304 HydrophobicContact CE-CG 3.57Å; M282-F304 HydrophobicContact CE-CZ 3.27Å
283	F	96.5	Very high	87.6	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.2	163	170.5	-102	0	0	0	109.2	L70 I71 A72 V88 T90 T257 L261 F264 A285	L70-F283 HydrophobicContact CD2-CD1 4.14Å; L70-F283 HydrophobicContact CD2-CE1 4.23Å; I71-F283 CarbonylContact C-O 3.49Å; I71-F283 WeakPolarHBondContact CA-O 3.43Å; A72-F283 HydrophobicContact CB-CB 4.49Å; A72-F283 PolarHBondContact N-O 2.96Å; A72-F283 PolarHBondContact O-N 2.97Å; A72-F283 VanDerWaalsContact O-O 3.1Å; V88-F283 HydrophobicContact CB-CD2 4.45Å; V88-F283 HydrophobicContact CG1-CD2 4.42Å; V88-F283 WeakPolarHBondContact O-CA 3.43Å; T90-F283 HydrophobicContact CG2-CE2 3.85Å; T90-F283 HydrophobicContact CG2-CZ 4.5Å; T257-F283 HydrophobicContact CG2-CZ 4.05Å; T257-F283 WeakPolarHBondContact O-CZ 3.31Å; L261-F283 HydrophobicContact CB-CD1 4.39Å; L261-F283 HydrophobicContact CB-CE1 3.97Å; L261-F283 HydrophobicContact CB-CE2 4.11Å; L261-F283 HydrophobicContact CB-CZ 3.81Å; L261-F283 HydrophobicContact CD1-CD1 3.84Å; L261-F283 HydrophobicContact CD1-CE1 3.95Å; L261-F283 HydrophobicContact CD1-CG 4.43Å; L261-F283 HydrophobicContact CG-CE1 4.46Å; L261-F283 VanDerWaalsContact N-CE2 3.33Å; F264-F283 HydrophobicContact CB-CB 3.99Å; F264-F283 HydrophobicContact CD1-CB 3.81Å; F264-F283 HydrophobicContact CD2-CB 4.06Å; F264-F283 HydrophobicContact CE1-CB 4.27Å; F264-F283 HydrophobicContact CG-CB 3.68Å; F283-A285 HydrophobicContact CE1-CB 3.96Å; F283-A285 HydrophobicContact CZ-CB 3.95Å
284	A	94	Very high	86.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	115.8	-179.7	0	0	0	0	0	111.3	L70 I71 M87 V88 G89 T90 F286	L70-A284 WeakPolarHBondContact O-CA 3.46Å; I71-A284 HydrophobicContact CD1-CB 4.39Å; I71-A284 HydrophobicContact CG1-CB 4.05Å; M87-A284 HydrophobicContact CG-CB 4.49Å; M87-A284 HydrophobicContact SD-CB 4.4Å; V88-A284 PolarHBondContact O-N 3.5Å; G89-A284 CarbonylContact C-O 3.54Å; G89-A284 VanDerWaalsContact CA-O 3.28Å; G89-A284 WeakPolarHBondContact CA-O 3.35Å; T90-A284 PolarHBondContact N-O 3.36Å; A284-F286 HydrophobicContact CB-CD2 4.33Å; A284-F286 HydrophobicContact CB-CE2 3.53Å; A284-F286 HydrophobicContact CB-CZ 3.63Å
285	A	92.7	Very high	84.7	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	113.7	174.1	0	0	0	0	0	109.6	A69 L70 T257 F283	A69-A285 CarbonylContact C-O 3.56Å; A69-A285 VanDerWaalsContact CA-O 3.28Å; A69-A285 WeakPolarHBondContact CA-O 3.34Å; A69-A285 WeakPolarHBondContact CB-O 3.3Å; L70-A285 PolarHBondContact N-O 3.18Å; L70-A285 PolarHBondContact O-N 2.8Å; T257-A285 HydrophobicContact CG2-CB 4.22Å; F283-A285 HydrophobicContact CE1-CB 3.96Å; F283-A285 HydrophobicContact CZ-CB 3.95Å
286	F	89.3	Confident	83.1	Confident	14 Å²	14	45.9 Å²	45.9	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	144	-174	-65.3	-71	0	0	0	113.2	I71 T90 H91 L92 A284 R297 I301	I71-F286 HydrophobicContact CD1-CE1 4.27Å; I71-F286 HydrophobicContact CD1-CZ 4.32Å; T90-F286 PolarHBondContact O-N 2.97Å; H91-F286 CarbonylContact C-O 3.5Å; H91-F286 WeakPolarHBondContact CA-O 3.32Å; H91-F286 WeakPolarHBondContact CB-O 3.22Å; L92-F286 PolarHBondContact N-O 3.46Å; A284-F286 HydrophobicContact CB-CD2 4.33Å; A284-F286 HydrophobicContact CB-CE2 3.53Å; A284-F286 HydrophobicContact CB-CZ 3.63Å; F286-R297 HydrophobicContact CB-CG 4.05Å; F286-R297 HydrophobicContact CD1-CB 4.21Å; F286-R297 HydrophobicContact CD1-CG 3.78Å; F286-R297 HydrophobicContact CD2-CG 4.33Å; F286-R297 HydrophobicContact CE1-CB 4.24Å; F286-R297 HydrophobicContact CE1-CG 4.3Å; F286-R297 HydrophobicContact CG-CG 3.79Å; F286-I301 HydrophobicContact CE1-CG1 4.46Å; F286-I301 HydrophobicContact CZ-CD1 3.86Å; F286-I301 HydrophobicContact CZ-CG1 3.99Å
287	D	85	Confident	81.9	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.011	23%	0.23	C	C	.	.	S	Bend	trans	-79	170.3	170.2	-155.4	8.9	0	0	0	112.7	T68 P94 E289 L296	T68-D287 WeakPolarHBondContact CB-OD2 3.45Å; T68-D287 WeakPolarHBondContact O-CB 3.46Å; T68-D287 PolarHBondContact OG1-OD2 3.13Å; P94-D287 WeakPolarHBondContact CD-OD1 3.28Å; P94-D287 WeakPolarHBondContact CG-OD1 3.4Å; P94-D287 WeakPolarHBondContact CG-OD2 3.14Å; D287-E289 VanDerWaalsContact C-N 3.34Å; D287-E289 PolarHBondContact O-N 3.48Å; D287-L296 HydrophobicContact CB-CD2 3.96Å
288	N	81.2	Confident	80.7	Confident	38 Å²	38	50.7 Å²	50.7	20%	0.203	25%	0.249	C	C	.	.			trans	65.2	23.7	163.8	-58.9	-55.7	0	0	0	117.1	L92 Y111 V291 K292 A293	L92-N288 PolarHBondContact O-N 2.85Å; Y111-N288 VanDerWaalsContact OH-CA 3.32Å; Y111-N288 WeakPolarHBondContact OH-CA 3.33Å; N288-V291 HydrophobicContact CB-CG2 3.87Å; N288-V291 WeakPolarHBondContact O-CG2 3.49Å; N288-K292 PolarHBondContact O-N 3.37Å; N288-A293 HydrophobicContact CB-CB 3.65Å; N288-A293 PolarHBondContact O-N 3.17Å; N288-A293 VanDerWaalsContact O-N 3.16Å
289	E	80.1	Confident	79.6	Confident	63 Å²	63	54.5 Å²	54.5	29%	0.294	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-45.6	176.9	-168.6	-80.9	158.8	0	0	112.6	H91 D287 V291 K292 R297	H91-E289 HydrophobicContact CB-CB 3.4Å; H91-E289 VanDerWaalsContact CB-CB 3.4Å; H91-E289 HydrophobicContact CB-CG 3.86Å; H91-E289 IonicContact CD2-OE2 3.12Å; H91-E289 IonicContact CE1-OE2 3.11Å; H91-E289 IonicContact NE2-OE2 2.74Å; H91-E289 PolarHBondContact NE2-OE2 3.34Å; D287-E289 VanDerWaalsContact C-N 3.34Å; D287-E289 PolarHBondContact O-N 3.48Å; E289-V291 PolarHBondContact O-N 3.09Å; E289-V291 VanDerWaalsContact O-N 3.11Å; E289-K292 WeakPolarHBondContact O-CA 3.49Å; E289-K292 PolarHBondContact O-N 2.74Å; E289-R297 VanDerWaalsContact CA-NH2 3.28Å
290	E	71.2	Confident	78.6	Confident	46 Å²	46	54 Å²	54	22%	0.215	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.1	-175.1	-64.3	-67.1	171.6	0	0	113.9	H91 K93 Y111	H91-E290 IonicContact NE2-OE1 3.7Å; K93-E290 HydrophobicContact CD-CG 4.28Å; K93-E290 VanDerWaalsContact CE-CD 3.47Å; K93-E290 WeakPolarHBondContact CE-OE1 3.46Å; K93-E290 HydrophobicContact CG-CG 3.87Å; K93-E290 IonicContact NZ-OE1 3.32Å; K93-E290 PolarHBondContact NZ-OE1 3Å; Y111-E290 HydrophobicContact CD1-CB 4.47Å; Y111-E290 HydrophobicContact CE1-CB 3.62Å; Y111-E290 HydrophobicContact CE1-CG 3.97Å
291	V	76.9	Confident	77.7	Confident	73 Å²	73	56.5 Å²	56.5	44%	0.442	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	8.2	175.2	-65.8	0	0	0	0	112.5	Y111 N288 E289 A293	Y111-V291 HydrophobicContact CD2-CG1 3.62Å; Y111-V291 HydrophobicContact CE2-CB 4.11Å; Y111-V291 HydrophobicContact CE2-CG1 3.23Å; Y111-V291 HydrophobicContact CE2-CG2 3.76Å; N288-V291 HydrophobicContact CB-CG2 3.87Å; N288-V291 WeakPolarHBondContact O-CG2 3.49Å; E289-V291 PolarHBondContact O-N 3.09Å; E289-V291 VanDerWaalsContact O-N 3.11Å; V291-A293 HydrophobicContact CG2-CB 4.32Å; V291-A293 PolarHBondContact O-N 3.37Å
292	K	71.2	Confident	76.8	Confident	180 Å²	180	62.1 Å²	62.1	78%	0.783	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	30.7	176.2	-56.6	176.2	-178.9	174.6	0	113.7	N288 E289 K294	N288-K292 PolarHBondContact O-N 3.37Å; E289-K292 WeakPolarHBondContact O-CA 3.49Å; E289-K292 PolarHBondContact O-N 2.74Å; K292-K294 PolarHBondContact O-N 2.93Å
293	A	62.2	Low	75.9	Confident	38 Å²	38	64.9 Å²	64.9	31%	0.314	31%	0.312	S	S	.	.			trans	-71.3	115.7	179.5	0	0	0	0	0	110.5	N288 V291	N288-A293 HydrophobicContact CB-CB 3.65Å; N288-A293 PolarHBondContact O-N 3.17Å; N288-A293 VanDerWaalsContact O-N 3.16Å; V291-A293 HydrophobicContact CG2-CB 4.32Å; V291-A293 PolarHBondContact O-N 3.37Å
294	K	62.5	Low	75.2	Confident	156 Å²	156	65.2 Å²	65.2	68%	0.678	31%	0.314	S	S	*	.			trans	-86.3	-26.7	-174.8	-68.9	178.8	-179.5	177.7	0	113.7	K292	K292-K294 PolarHBondContact O-N 2.93Å
295	D	62.1	Low	74.5	Confident	122 Å²	122	66.5 Å²	66.5	65%	0.652	32%	0.323	S	S	*	.	H	α-helix	trans	-74.1	-36.3	-162.6	-61	-28.6	0	0	0	113.5	R297 N299	D295-R297 PolarHBondContact O-N 3.34Å; D295-N299 PolarHBondContact O-N 3.26Å; D295-N299 PolarHBondContact O-ND2 3.26Å
296	L	62.3	Low	73.8	Confident	38 Å²	38	70 Å²	70	20%	0.199	34%	0.344	C	S	.	.	H	α-helix	trans	-64	-41.9	-178.4	-169.2	65.8	0	0	0	111.5	K65 A69 D287 V300	K65-L296 HydrophobicContact CG-CD1 3.85Å; A69-L296 HydrophobicContact CB-CD2 4.47Å; D287-L296 HydrophobicContact CB-CD2 3.96Å; L296-V300 VanDerWaalsContact O-CG2 3.32Å; L296-V300 WeakPolarHBondContact O-CG2 3.36Å; L296-V300 PolarHBondContact O-N 3.13Å
297	R	67.1	Low	73.4	Confident	81 Å²	81	70.6 Å²	70.6	31%	0.306	35%	0.347	S	S	.	.	H	α-helix	trans	-63.8	-47.9	-177.4	-58.7	-174.3	-175.4	178.8	-2.3	112	F286 E289 D295 N299 V300 I301	F286-R297 HydrophobicContact CB-CG 4.05Å; F286-R297 HydrophobicContact CD1-CB 4.21Å; F286-R297 HydrophobicContact CD1-CG 3.78Å; F286-R297 HydrophobicContact CD2-CG 4.33Å; F286-R297 HydrophobicContact CE1-CB 4.24Å; F286-R297 HydrophobicContact CE1-CG 4.3Å; F286-R297 HydrophobicContact CG-CG 3.79Å; E289-R297 VanDerWaalsContact CA-NH2 3.28Å; D295-R297 PolarHBondContact O-N 3.34Å; R297-N299 PolarHBondContact O-N 3.2Å; R297-V300 PolarHBondContact O-N 3.05Å; R297-I301 WeakPolarHBondContact O-CG1 3.5Å; R297-I301 PolarHBondContact O-N 3.26Å; R297-I301 VanDerWaalsContact O-N 3.16Å
298	K	68.4	Low	73	Confident	131 Å²	131	70.9 Å²	70.9	57%	0.57	35%	0.348	S	S	*	.	H	α-helix	trans	-61.2	-44.7	-178.6	-70.7	-170.3	174.2	-163.9	0	111.7	V300 K302	K298-V300 PolarHBondContact O-N 2.85Å; K298-K302 WeakPolarHBondContact O-CB 2.79Å; K298-K302 PolarHBondContact O-N 3.07Å
299	N	71.1	Confident	72.1	Confident	104 Å²	104	69.4 Å²	69.4	56%	0.556	34%	0.342	S	S	*	.	H	α-helix	trans	-66.6	-40.5	-175.9	-71.4	-22.2	0	0	0	112.5	D295 R297 K303	D295-N299 PolarHBondContact O-N 3.26Å; D295-N299 PolarHBondContact O-ND2 3.26Å; R297-N299 PolarHBondContact O-N 3.2Å; N299-K303 PolarHBondContact O-N 3Å; N299-K303 VanDerWaalsContact O-N 3.13Å
300	V	71.9	Confident	71	Confident	17 Å²	17	68.6 Å²	68.6	10%	0.103	34%	0.344	C	S	.	.	H	α-helix	trans	-69.6	-45.2	179.6	-175.1	0	0	0	0	110.9	K65 I71 L296 R297 K298 K302 K303 F304	K65-V300 HydrophobicContact CB-CG2 3.91Å; K65-V300 HydrophobicContact CD-CG2 4.28Å; K65-V300 HydrophobicContact CG-CG2 3.74Å; I71-V300 HydrophobicContact CD1-CB 4.26Å; I71-V300 HydrophobicContact CD1-CG1 3.34Å; I71-V300 HydrophobicContact CG1-CG1 3.9Å; L296-V300 VanDerWaalsContact O-CG2 3.32Å; L296-V300 WeakPolarHBondContact O-CG2 3.36Å; L296-V300 PolarHBondContact O-N 3.13Å; R297-V300 PolarHBondContact O-N 3.05Å; K298-V300 PolarHBondContact O-N 2.85Å; V300-K302 PolarHBondContact O-N 3.43Å; V300-K303 PolarHBondContact O-N 2.99Å; V300-F304 PolarHBondContact O-N 3.4Å
301	I	75.9	Confident	70	Confident	54 Å²	54	75.2 Å²	75.2	28%	0.277	38%	0.375	S	S	.	.	H	α-helix	trans	-63.9	-43.1	177.8	-65.4	171.2	0	0	0	111	M87 F286 R297 K303 F304 C305	M87-I301 HydrophobicContact CE-CD1 4.29Å; F286-I301 HydrophobicContact CE1-CG1 4.46Å; F286-I301 HydrophobicContact CZ-CD1 3.86Å; F286-I301 HydrophobicContact CZ-CG1 3.99Å; R297-I301 WeakPolarHBondContact O-CG1 3.5Å; R297-I301 PolarHBondContact O-N 3.26Å; R297-I301 VanDerWaalsContact O-N 3.16Å; I301-K303 VanDerWaalsContact C-N 3.3Å; I301-K303 PolarHBondContact O-N 3Å; I301-F304 WeakPolarHBondContact O-CB 3.05Å; I301-F304 PolarHBondContact O-N 2.93Å; I301-C305 PolarHBondContact O-N 3.12Å; I301-C305 PolarHBondContact O-SG 3.33Å; I301-C305 VanDerWaalsContact O-SG 3.4Å
302	K	76.1	Confident	68.8	Low	142 Å²	142	72.7 Å²	72.7	62%	0.617	36%	0.36	S	S	*	.	H	α-helix	trans	-58.7	-43	177.4	-176.9	174.1	-178.7	173.1	0	111.6	K298 V300 C305 V306	K298-K302 WeakPolarHBondContact O-CB 2.79Å; K298-K302 PolarHBondContact O-N 3.07Å; V300-K302 PolarHBondContact O-N 3.43Å; K302-C305 PolarHBondContact O-N 3.25Å; K302-V306 WeakPolarHBondContact O-CG2 3.45Å; K302-V306 PolarHBondContact O-N 3.29Å
303	K	76	Confident	67.7	Low	62 Å²	62	64.6 Å²	64.6	27%	0.27	33%	0.326	S	S	.	.	H	α-helix	trans	-63.7	-43	177.1	-168.5	172.7	-161.4	166.8	0	111.8	E49 N299 V300 I301 C305 V306 Q307	E49-K303 HydrophobicContact CG-CD 3.92Å; E49-K303 WeakPolarHBondContact O-CE 3.3Å; E49-K303 PolarHBondContact O-NZ 3.37Å; E49-K303 IonicContact OE1-NZ 3.96Å; E49-K303 PolarHBondContact OE1-NZ 3.34Å; E49-K303 VanDerWaalsContact OE1-NZ 3.11Å; N299-K303 PolarHBondContact O-N 3Å; N299-K303 VanDerWaalsContact O-N 3.13Å; V300-K303 PolarHBondContact O-N 2.99Å; I301-K303 VanDerWaalsContact C-N 3.3Å; I301-K303 PolarHBondContact O-N 3Å; K303-C305 PolarHBondContact O-N 3.22Å; K303-V306 PolarHBondContact O-N 2.88Å; K303-Q307 HydrophobicContact CG-CG 4.28Å; K303-Q307 WeakPolarHBondContact O-CB 3.39Å; K303-Q307 VanDerWaalsContact O-CG 3.32Å; K303-Q307 WeakPolarHBondContact O-CG 3.49Å; K303-Q307 PolarHBondContact O-N 2.88Å
304	F	82.3	Confident	66.7	Low	7 Å²	7	68.9 Å²	68.9	3%	0.031	35%	0.35	C	S	.	.	H	α-helix	trans	-55.8	-50.2	172.3	172	-87.8	0	0	0	111.3	W53 F73 V85 V280 M282 V300 I301 V306 Q307 V308	W53-F304 HydrophobicContact CZ3-CD2 4.41Å; F73-F304 HydrophobicContact CB-CE2 4.1Å; F73-F304 AromaticContact CD1-CD2 3.98Å; F73-F304 HydrophobicContact CD1-CD2 3.98Å; F73-F304 AromaticContact CD1-CE2 3.63Å; F73-F304 HydrophobicContact CD1-CE2 3.63Å; F73-F304 AromaticContact CD2-CE2 3.73Å; F73-F304 HydrophobicContact CD2-CE2 3.73Å; F73-F304 HydrophobicContact CD2-CZ 4.45Å; F73-F304 AromaticContact CE1-CD2 3.99Å; F73-F304 HydrophobicContact CE1-CD2 3.99Å; F73-F304 AromaticContact CE1-CE2 3.87Å; F73-F304 HydrophobicContact CE1-CE2 3.87Å; F73-F304 AromaticContact CE2-CE2 3.95Å; F73-F304 HydrophobicContact CE2-CE2 3.95Å; F73-F304 HydrophobicContact CG-CD2 4.35Å; F73-F304 AromaticContact CG-CE2 3.55Å; F73-F304 HydrophobicContact CG-CE2 3.55Å; F73-F304 HydrophobicContact CG-CZ 4.41Å; F73-F304 HydrophobicContact CZ-CD2 4.36Å; F73-F304 HydrophobicContact CZ-CE2 4.01Å; V85-F304 HydrophobicContact CG2-CE1 4.12Å; V280-F304 HydrophobicContact CG1-CZ 3.86Å; M282-F304 HydrophobicContact CE-CD1 3.44Å; M282-F304 VanDerWaalsContact CE-CD1 3.44Å; M282-F304 HydrophobicContact CE-CD2 3.51Å; M282-F304 HydrophobicContact CE-CE1 3.29Å; M282-F304 HydrophobicContact CE-CE2 3.36Å; M282-F304 HydrophobicContact CE-CG 3.57Å; M282-F304 HydrophobicContact CE-CZ 3.27Å; V300-F304 PolarHBondContact O-N 3.4Å; I301-F304 WeakPolarHBondContact O-CB 3.05Å; I301-F304 PolarHBondContact O-N 2.93Å; F304-V306 VanDerWaalsContact C-N 3.3Å; F304-V306 PolarHBondContact O-N 2.92Å; F304-Q307 PolarHBondContact O-N 2.9Å; F304-V308 HydrophobicContact CD1-CG2 4.34Å; F304-V308 HydrophobicContact CD2-CG2 3.74Å; F304-V308 HydrophobicContact CE1-CB 4.17Å; F304-V308 HydrophobicContact CE1-CG1 4.41Å; F304-V308 HydrophobicContact CE1-CG2 3.95Å; F304-V308 HydrophobicContact CE2-CB 4.34Å; F304-V308 HydrophobicContact CE2-CG2 3.29Å; F304-V308 HydrophobicContact CG-CG2 4.22Å; F304-V308 HydrophobicContact CZ-CB 3.96Å; F304-V308 HydrophobicContact CZ-CG1 4.05Å; F304-V308 HydrophobicContact CZ-CG2 3.38Å; F304-V308 WeakPolarHBondContact O-CB 3.36Å; F304-V308 VanDerWaalsContact O-CG2 3.32Å; F304-V308 WeakPolarHBondContact O-CG2 3.31Å; F304-V308 PolarHBondContact O-N 3.24Å
305	C	78.9	Confident	65.8	Low	28 Å²	28	65 Å²	65	19%	0.189	36%	0.355	C	S	.	.	H	α-helix	trans	-59.3	-39.4	179.2	-69.7	0	0	0	0	112.7	I301 K302 K303 G309 W320	I301-C305 PolarHBondContact O-N 3.12Å; I301-C305 PolarHBondContact O-SG 3.33Å; I301-C305 VanDerWaalsContact O-SG 3.4Å; K302-C305 PolarHBondContact O-N 3.25Å; K303-C305 PolarHBondContact O-N 3.22Å; C305-G309 VanDerWaalsContact O-CA 3.26Å; C305-G309 WeakPolarHBondContact O-CA 3.46Å; C305-G309 PolarHBondContact O-N 3.34Å; C305-W320 HydrophobicContact CB-CB 4.07Å; C305-W320 HydrophobicContact CB-CG 4.45Å
306	V	77.8	Confident	64.8	Low	73 Å²	73	59.9 Å²	59.9	44%	0.442	33%	0.329	S	S	.	.	H	α-helix	trans	-65.6	-52.4	174.3	172.9	0	0	0	0	110.1	K302 K303 F304 V308 G309 S310	K302-V306 WeakPolarHBondContact O-CG2 3.45Å; K302-V306 PolarHBondContact O-N 3.29Å; K303-V306 PolarHBondContact O-N 2.88Å; F304-V306 VanDerWaalsContact C-N 3.3Å; F304-V306 PolarHBondContact O-N 2.92Å; V306-V308 VanDerWaalsContact C-N 3.27Å; V306-V308 PolarHBondContact O-N 3.46Å; V306-G309 PolarHBondContact O-N 3.3Å; V306-S310 WeakPolarHBondContact O-CB 3.41Å; V306-S310 PolarHBondContact O-N 3.16Å; V306-S310 PolarHBondContact O-OG 2.92Å
307	Q	80.5	Confident	63.5	Low	28 Å²	28	62.1 Å²	62.1	13%	0.131	35%	0.354	C	S	.	.	H	α-helix	trans	-68	-22.9	-176	-68.4	-73	-16.2	0	0	113.5	W53 K303 F304 S312	W53-Q307 HydrophobicContact CD2-CB 3.87Å; W53-Q307 HydrophobicContact CD2-CG 3.9Å; W53-Q307 HydrophobicContact CE3-CB 3.3Å; W53-Q307 HydrophobicContact CE3-CG 3.78Å; W53-Q307 HydrophobicContact CG-CB 4.47Å; W53-Q307 HydrophobicContact CG-CG 4.45Å; W53-Q307 HydrophobicContact CH2-CG 4.44Å; W53-Q307 HydrophobicContact CZ3-CB 3.67Å; W53-Q307 HydrophobicContact CZ3-CG 4.06Å; W53-Q307 VanDerWaalsContact N-OE1 3.11Å; K303-Q307 HydrophobicContact CG-CG 4.28Å; K303-Q307 WeakPolarHBondContact O-CB 3.39Å; K303-Q307 VanDerWaalsContact O-CG 3.32Å; K303-Q307 WeakPolarHBondContact O-CG 3.49Å; K303-Q307 PolarHBondContact O-N 2.88Å; F304-Q307 PolarHBondContact O-N 2.9Å; Q307-S312 WeakPolarHBondContact O-CB 3.14Å; Q307-S312 PolarHBondContact O-OG 3.12Å
308	V	77.4	Confident	61.9	Low	7 Å²	7	63.1 Å²	63.1	4%	0.042	37%	0.373	C	S	.	.	H	α-helix	trans	-100.5	-28.7	179	176.8	0	0	0	0	112.1	L55 F73 L75 F79 V280 F304 V306	L55-V308 HydrophobicContact CD1-CG2 3.69Å; F73-V308 HydrophobicContact CE2-CG2 4.45Å; L75-V308 HydrophobicContact CD2-CG1 4.3Å; F79-V308 HydrophobicContact CE1-CG1 4.37Å; F79-V308 HydrophobicContact CE2-CG1 4.28Å; F79-V308 HydrophobicContact CZ-CG1 3.58Å; V280-V308 HydrophobicContact CG2-CG1 4.43Å; F304-V308 HydrophobicContact CD1-CG2 4.34Å; F304-V308 HydrophobicContact CD2-CG2 3.74Å; F304-V308 HydrophobicContact CE1-CB 4.17Å; F304-V308 HydrophobicContact CE1-CG1 4.41Å; F304-V308 HydrophobicContact CE1-CG2 3.95Å; F304-V308 HydrophobicContact CE2-CB 4.34Å; F304-V308 HydrophobicContact CE2-CG2 3.29Å; F304-V308 HydrophobicContact CG-CG2 4.22Å; F304-V308 HydrophobicContact CZ-CB 3.96Å; F304-V308 HydrophobicContact CZ-CG1 4.05Å; F304-V308 HydrophobicContact CZ-CG2 3.38Å; F304-V308 WeakPolarHBondContact O-CB 3.36Å; F304-V308 VanDerWaalsContact O-CG2 3.32Å; F304-V308 WeakPolarHBondContact O-CG2 3.31Å; F304-V308 PolarHBondContact O-N 3.24Å; V306-V308 VanDerWaalsContact C-N 3.27Å; V306-V308 PolarHBondContact O-N 3.46Å
309	G	62.5	Low	60.4	Low	7 Å²	7	59.6 Å²	59.6	7%	0.072	37%	0.368	C	S	.	.	H	α-helix	trans	-95.3	-10.4	-177.9	0	0	0	0	0	115.4	C305 V306	C305-G309 VanDerWaalsContact O-CA 3.26Å; C305-G309 WeakPolarHBondContact O-CA 3.46Å; C305-G309 PolarHBondContact O-N 3.34Å; V306-G309 PolarHBondContact O-N 3.3Å
310	S	56.8	Low	58.8	Low	47 Å²	47	59.4 Å²	59.4	33%	0.329	36%	0.36	S	S	.	.	S	Bend	trans	-126.2	139.8	176.8	71.9	0	0	0	0	110.9	V306 S312	V306-S310 WeakPolarHBondContact O-CB 3.41Å; V306-S310 PolarHBondContact O-N 3.16Å; V306-S310 PolarHBondContact O-OG 2.92Å; S310-S312 PolarHBondContact O-N 3.04Å; S310-S312 PolarHBondContact O-OG 3.08Å
311	E	50	Low	56.8	Low	185 Å²	185	65 Å²	65	86%	0.864	39%	0.394	S	S	*	.	S	Bend	trans	40.4	-19.2	166	-63.3	-174.1	174.2	0	0	122	V313	E311-V313 VanDerWaalsContact C-N 3.3Å; E311-V313 PolarHBondContact O-N 2.94Å
312	S	52	Low	54.5	Low	20 Å²	20	70.6 Å²	70.6	14%	0.14	42%	0.419	C	S	.	.	S	Bend	trans	-73.7	-20.4	-179.5	60	0	0	0	0	113.6	W53 Q307 S310	W53-S312 WeakPolarHBondContact O-CB 3.42Å; Q307-S312 WeakPolarHBondContact O-CB 3.14Å; Q307-S312 PolarHBondContact O-OG 3.12Å; S310-S312 PolarHBondContact O-N 3.04Å; S310-S312 PolarHBondContact O-OG 3.08Å
313	V	47.7	Very low	52.3	Low	9 Å²	9	78 Å²	78	6%	0.055	44%	0.443	C	S	.	.	S	Bend	trans	-117.8	123.9	171.9	-177.2	0	0	0	0	107.4	L55 F79 P81 E311 G315 A316	L55-V313 HydrophobicContact CB-CG2 4.32Å; F79-V313 HydrophobicContact CD1-CG2 4.43Å; F79-V313 HydrophobicContact CE1-CB 4.47Å; F79-V313 HydrophobicContact CE1-CG1 4.39Å; F79-V313 HydrophobicContact CE1-CG2 3.8Å; P81-V313 HydrophobicContact CG-CB 4.07Å; P81-V313 HydrophobicContact CG-CG1 4.2Å; E311-V313 VanDerWaalsContact C-N 3.3Å; E311-V313 PolarHBondContact O-N 2.94Å; V313-G315 PolarHBondContact O-N 3.06Å; V313-A316 WeakPolarHBondContact O-CB 3.45Å; V313-A316 PolarHBondContact O-N 3.04Å
314	P	41.6	Very low	51.1	Low	128 Å²	128	78.8 Å²	78.8	83%	0.831	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	118.2	-179.9	-25	32.4	0	0	0	111.4
315	G	42.9	Very low	49.5	Very low	76 Å²	76	82.6 Å²	82.6	78%	0.784	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	108	4.8	179.4	0	0	0	0	0	116.9	V313 A317	V313-G315 PolarHBondContact O-N 3.06Å; G315-A317 PolarHBondContact O-N 3.23Å
316	A	41.6	Very low	47.9	Very low	13 Å²	13	85.6 Å²	85.6	11%	0.107	49%	0.49	C	S	.	.			trans	-83.9	84.2	-176.6	0	0	0	0	0	114.4	P81 V313	P81-A316 HydrophobicContact CB-CB 3.42Å; P81-A316 VanDerWaalsContact CB-CB 3.42Å; P81-A316 VanDerWaalsContact CG-CA 3.43Å; P81-A316 HydrophobicContact CG-CB 3.17Å; V313-A316 WeakPolarHBondContact O-CB 3.45Å; V313-A316 PolarHBondContact O-N 3.04Å
317	A	34.8	Very low	46.1	Very low	86 Å²	86	86.4 Å²	86.4	71%	0.711	49%	0.493	S	S	*	.			trans	-96.6	109.4	164.5	0	0	0	0	0	110.3	G315	G315-A317 PolarHBondContact O-N 3.23Å
318	S	34.4	Very low	44	Very low	102 Å²	102	90 Å²	90	71%	0.713	52%	0.515	S	S	*	.			trans	39.6	95.2	157.8	63	0	0	0	0	118.2
319	A	35.2	Very low	41.7	Very low	56 Å²	56	95.5 Å²	95.5	46%	0.463	55%	0.547	S	S	.	.			trans	-129.9	5.4	168.9	0	0	0	0	0	115.1
320	W	38.3	Very low	40.2	Very low	100 Å²	100	101.9 Å²	101.9	38%	0.379	58%	0.581	S	S	.	*			trans	-140.8	75.5	-174.5	-60.6	100.1	0	0	0	112.1	R83 C305	R83-W320 WeakPolarHBondContact O-CZ2 3.48Å; C305-W320 HydrophobicContact CB-CB 4.07Å; C305-W320 HydrophobicContact CB-CG 4.45Å
321	T	30.9	Very low	39	Very low	134 Å²	134	106.1 Å²	106.1	82%	0.822	60%	0.6	S	S	*	*			trans	-119.7	9.3	177.4	26.9	0	0	0	0	115.7
322	E	26.6	Very low	38	Very low	172 Å²	172	99.5 Å²	99.5	80%	0.804	58%	0.578	S	S	*	*			trans	-135.2	89.3	179.3	-66.8	-172.4	169.2	0	0	112.9
323	W	30.6	Very low	36.8	Very low	298 Å²	298	106.7 Å²	106.7	100%	1.129	62%	0.618	S	S	*	*			trans	-157.5	0	154.4	-72.7	102.9	0	0	0	111.4

Retrieved 323 of 323 residues in 177.6 ms (Link to these results)

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