A0A5K4FAX4_SCHMA Loading...

Protein kinase domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAX4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 326 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	63.9	Low	85.1	Confident	204 Å²	204	115.3 Å²	115.3	100%	1.005	63%	0.629	S	S	*	*				0	101.7	0	-171.2	-174.9	-85.7	0	0	105.9	V16	M1-V16 CarbonylContact C-O 3.44Å; M1-V16 VanDerWaalsContact C-O 3.23Å; M1-V16 PolarHBondContact N-O 2.94Å
2	K	76.2	Confident	85.7	Confident	137 Å²	137	108.8 Å²	108.8	60%	0.596	61%	0.609	S	S	*	*			trans	-80.1	126	-179.2	-171.1	178	177.4	-177	0	109	Q4 F14 L15 V16	K2-Q4 PolarHBondContact O-N 3.14Å; K2-F14 HydrophobicContact CG-CB 4.33Å; K2-L15 CarbonylContact C-O 3.59Å; K2-L15 WeakPolarHBondContact CA-O 3.38Å; K2-V16 HydrophobicContact CG-CG2 4.34Å
3	T	78	Confident	86.1	Confident	47 Å²	47	104.2 Å²	104.2	29%	0.288	59%	0.594	S	S	.	*			trans	-62.9	137.4	171.9	54.1	0	0	0	0	108.7	T5 F14 L15	T3-T5 VanDerWaalsContact C-N 3.28Å; T3-T5 PolarHBondContact OG1-O 2.9Å; T3-T5 VanDerWaalsContact OG1-O 3.09Å; T3-F14 WeakPolarHBondContact O-CD1 3.31Å; T3-L15 HydrophobicContact CG2-CB 3.78Å; T3-L15 HydrophobicContact CG2-CD1 3.98Å; T3-L15 HydrophobicContact CG2-CG 4.13Å; T3-L15 PolarHBondContact N-O 2.91Å; T3-L15 PolarHBondContact OG1-N 2.93Å
4	Q	83	Confident	86.5	Confident	189 Å²	189	102.9 Å²	102.9	88%	0.883	58%	0.578	S	S	*	*	S	Bend	trans	-79.4	-17.7	179	-65.5	-162.6	5.7	0	0	112.5	K2 F14	K2-Q4 PolarHBondContact O-N 3.14Å; Q4-F14 WeakPolarHBondContact O-CE1 3.47Å
5	T	89.3	Confident	86.8	Confident	103 Å²	103	103.3 Å²	103.3	63%	0.632	58%	0.577	S	S	*	*	S	Bend	trans	-112.1	143.7	176.5	49.2	0	0	0	0	110.7	T3 F14	T3-T5 VanDerWaalsContact C-N 3.28Å; T3-T5 PolarHBondContact OG1-O 2.9Å; T3-T5 VanDerWaalsContact OG1-O 3.09Å; T5-F14 VanDerWaalsContact C-CE1 3.5Å
6	P	88.4	Confident	87	Confident	51 Å²	51	101.9 Å²	101.9	33%	0.331	57%	0.572	S	S	.	*			trans	-69.3	144.7	175.3	27.2	-31.4	0	0	0	110.3	T8 A13 F14	P6-T8 PolarHBondContact O-N 3.19Å; P6-A13 CarbonylContact C-O 3.58Å; P6-A13 WeakPolarHBondContact CA-O 3.33Å; P6-F14 HydrophobicContact CB-CD1 4.48Å; P6-F14 HydrophobicContact CB-CE1 4.13Å; P6-F14 HydrophobicContact CB-CE2 4.37Å; P6-F14 HydrophobicContact CB-CZ 4.06Å; P6-F14 HydrophobicContact CG-CE1 4.4Å; P6-F14 HydrophobicContact CG-CZ 4.31Å
7	V	90.3	Very high	87.1	Confident	90 Å²	90	102.3 Å²	102.3	55%	0.545	58%	0.578	S	S	.	*	S	Bend	trans	-55.9	-39.5	-179.3	178.6	0	0	0	0	110.8	A13 L15	V7-A13 WeakPolarHBondContact CG2-O 3.44Å; V7-A13 PolarHBondContact N-O 2.59Å; V7-L15 HydrophobicContact CG2-CD2 3.91Å; V7-L15 HydrophobicContact CG2-CG 3.88Å
8	T	90.8	Very high	87.1	Confident	73 Å²	73	102.4 Å²	102.4	45%	0.448	58%	0.583	S	S	.	*	S	Bend	trans	-140	144.9	165.2	65.2	0	0	0	0	109.5	P6 K10 S11 G12	P6-T8 PolarHBondContact O-N 3.19Å; T8-K10 PolarHBondContact O-N 3.45Å; T8-S11 PolarHBondContact O-N 3.08Å; T8-S11 VanDerWaalsContact O-N 3.15Å; T8-S11 PolarHBondContact O-OG 2.66Å; T8-S11 VanDerWaalsContact O-OG 3.09Å; T8-S11 VanDerWaalsContact OG1-CB 3.26Å; T8-S11 WeakPolarHBondContact OG1-CB 3.34Å; T8-S11 PolarHBondContact OG1-N 2.94Å; T8-S11 PolarHBondContact OG1-OG 2.84Å; T8-G12 PolarHBondContact O-N 3.22Å; T8-G12 VanDerWaalsContact O-N 3.14Å
9	A	89.3	Confident	87.1	Confident	100 Å²	100	105.6 Å²	105.6	83%	0.826	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-37.8	177.7	0	0	0	0	0	112.4
10	K	93.5	Very high	87	Confident	208 Å²	208	105.7 Å²	105.7	90%	0.904	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-37.4	179.8	-173.5	177.4	179.1	-179.7	0	113.4	T8	T8-K10 PolarHBondContact O-N 3.45Å
11	S	93.1	Very high	86.8	Confident	66 Å²	66	107.8 Å²	107.8	46%	0.462	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.6	-31	-178.2	65.1	0	0	0	0	112.7	T8 A13	T8-S11 PolarHBondContact O-N 3.08Å; T8-S11 VanDerWaalsContact O-N 3.15Å; T8-S11 PolarHBondContact O-OG 2.66Å; T8-S11 VanDerWaalsContact O-OG 3.09Å; T8-S11 VanDerWaalsContact OG1-CB 3.26Å; T8-S11 WeakPolarHBondContact OG1-CB 3.34Å; T8-S11 PolarHBondContact OG1-N 2.94Å; T8-S11 PolarHBondContact OG1-OG 2.84Å; S11-A13 PolarHBondContact O-N 2.75Å; S11-A13 VanDerWaalsContact O-N 3.08Å; S11-A13 PolarHBondContact OG-N 2.92Å
12	G	92.2	Very high	87.9	Confident	38 Å²	38	100.5 Å²	100.5	39%	0.392	57%	0.57	S	S	.	*			trans	61.4	10	-168.9	0	0	0	0	0	113.6	T8 F14	T8-G12 PolarHBondContact O-N 3.22Å; T8-G12 VanDerWaalsContact O-N 3.14Å; G12-F14 WeakPolarHBondContact O-CD2 3.44Å; G12-F14 WeakPolarHBondContact O-CE2 3.32Å
13	A	91.4	Very high	88.5	Confident	49 Å²	49	101.9 Å²	101.9	41%	0.405	58%	0.584	S	S	.	*			trans	-77.8	133.4	-175.5	0	0	0	0	0	110.5	P6 V7 S11	P6-A13 CarbonylContact C-O 3.58Å; P6-A13 WeakPolarHBondContact CA-O 3.33Å; V7-A13 WeakPolarHBondContact CG2-O 3.44Å; V7-A13 PolarHBondContact N-O 2.59Å; S11-A13 PolarHBondContact O-N 2.75Å; S11-A13 VanDerWaalsContact O-N 3.08Å; S11-A13 PolarHBondContact OG-N 2.92Å
14	F	92.3	Very high	89.2	Confident	86 Å²	86	104 Å²	104	38%	0.377	59%	0.587	S	S	.	*			trans	-111.4	141.8	176.4	-63.5	-91.2	0	0	0	109.8	K2 T3 Q4 T5 P6 G12	K2-F14 HydrophobicContact CG-CB 4.33Å; T3-F14 WeakPolarHBondContact O-CD1 3.31Å; Q4-F14 WeakPolarHBondContact O-CE1 3.47Å; T5-F14 VanDerWaalsContact C-CE1 3.5Å; P6-F14 HydrophobicContact CB-CD1 4.48Å; P6-F14 HydrophobicContact CB-CE1 4.13Å; P6-F14 HydrophobicContact CB-CE2 4.37Å; P6-F14 HydrophobicContact CB-CZ 4.06Å; P6-F14 HydrophobicContact CG-CE1 4.4Å; P6-F14 HydrophobicContact CG-CZ 4.31Å; G12-F14 WeakPolarHBondContact O-CD2 3.44Å; G12-F14 WeakPolarHBondContact O-CE2 3.32Å
15	L	90.5	Very high	89.7	Confident	108 Å²	108	97.7 Å²	97.7	57%	0.565	56%	0.557	S	S	*	*			trans	-74.3	136.2	168.1	-55.5	178.4	0	0	0	107.7	K2 T3 V7	K2-L15 CarbonylContact C-O 3.59Å; K2-L15 WeakPolarHBondContact CA-O 3.38Å; T3-L15 HydrophobicContact CG2-CB 3.78Å; T3-L15 HydrophobicContact CG2-CD1 3.98Å; T3-L15 HydrophobicContact CG2-CG 4.13Å; T3-L15 PolarHBondContact N-O 2.91Å; T3-L15 PolarHBondContact OG1-N 2.93Å; V7-L15 HydrophobicContact CG2-CD2 3.91Å; V7-L15 HydrophobicContact CG2-CG 3.88Å
16	V	90.5	Very high	89.9	Confident	81 Å²	81	93.1 Å²	93.1	49%	0.491	53%	0.529	S	S	.	.			trans	-119.9	-57	-175.1	-175.5	0	0	0	0	111.1	M1 K2	M1-V16 CarbonylContact C-O 3.44Å; M1-V16 VanDerWaalsContact C-O 3.23Å; M1-V16 PolarHBondContact N-O 2.94Å; K2-V16 HydrophobicContact CG-CG2 4.34Å
17	T	87.9	Confident	90.1	Very high	109 Å²	109	91.6 Å²	91.6	67%	0.669	52%	0.518	S	S	*	.			trans	-133.5	118.8	-173.9	-56.7	0	0	0	0	108.4	I19	T17-I19 PolarHBondContact O-N 2.8Å
18	P	87.6	Confident	90.2	Very high	105 Å²	105	87.9 Å²	87.9	68%	0.682	50%	0.496	S	S	*	.			trans	-65.4	134.6	170.4	27.8	-31.5	0	0	0	109.1
19	I	85.9	Confident	90.4	Very high	162 Å²	162	94.3 Å²	94.3	83%	0.831	51%	0.511	S	S	*	.			trans	-93	113.2	172.7	-59.1	178.3	0	0	0	106.7	T17	T17-I19 PolarHBondContact O-N 2.8Å
20	S	85.6	Confident	90.7	Very high	108 Å²	108	93.7 Å²	93.7	76%	0.755	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-68.3	146	174	-63.7	0	0	0	0	110.3
21	R	83.6	Confident	90.9	Very high	149 Å²	149	84.2 Å²	84.2	56%	0.562	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-64.8	142.5	170.9	-75.4	178.7	-82.4	-171.4	-3.4	109.5	E25 Q97	R21-E25 VanDerWaalsContact CD-OE1 3.32Å; R21-E25 WeakPolarHBondContact CD-OE1 2.89Å; R21-Q97 VanDerWaalsContact NH1-OE1 3.09Å
22	P	87.5	Confident	91.1	Very high	51 Å²	51	86.7 Å²	86.7	33%	0.331	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-70.9	152.3	174	31.5	-33.6	0	0	0	110.4	W24 E25	P22-W24 HydrophobicContact CB-CD2 4.34Å; P22-W24 HydrophobicContact CB-CG 4.26Å; P22-W24 HydrophobicContact CB-CZ2 4.31Å; P22-W24 VanDerWaalsContact CB-NE1 3.32Å; P22-W24 HydrophobicContact CG-CD2 3.9Å; P22-W24 HydrophobicContact CG-CG 4.33Å; P22-W24 HydrophobicContact CG-CH2 4.14Å; P22-W24 HydrophobicContact CG-CZ2 3.43Å; P22-W24 VanDerWaalsContact CG-CZ2 3.43Å; P22-W24 PolarHBondContact O-N 2.9Å; P22-W24 VanDerWaalsContact O-N 3.08Å; P22-E25 HydrophobicContact CG-CB 3.96Å; P22-E25 WeakPolarHBondContact O-CB 2.99Å; P22-E25 PolarHBondContact O-N 3.36Å
23	D	88.9	Confident	91.3	Very high	166 Å²	166	87.7 Å²	87.7	89%	0.888	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.3	-175	-61.2	-27.7	0	0	0	113.9	E25	D23-E25 VanDerWaalsContact C-N 3.34Å
24	W	91.5	Very high	91.6	Very high	92 Å²	92	89.4 Å²	89.4	35%	0.348	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.5	176.8	61.2	-106.6	0	0	0	113.6	P22 L26 L81 G93 I94	P22-W24 HydrophobicContact CB-CD2 4.34Å; P22-W24 HydrophobicContact CB-CG 4.26Å; P22-W24 HydrophobicContact CB-CZ2 4.31Å; P22-W24 VanDerWaalsContact CB-NE1 3.32Å; P22-W24 HydrophobicContact CG-CD2 3.9Å; P22-W24 HydrophobicContact CG-CG 4.33Å; P22-W24 HydrophobicContact CG-CH2 4.14Å; P22-W24 HydrophobicContact CG-CZ2 3.43Å; P22-W24 VanDerWaalsContact CG-CZ2 3.43Å; P22-W24 PolarHBondContact O-N 2.9Å; P22-W24 VanDerWaalsContact O-N 3.08Å; W24-L26 PolarHBondContact O-N 3.13Å; W24-L81 HydrophobicContact CB-CD1 3.77Å; W24-L81 HydrophobicContact CB-CD2 4.01Å; W24-L81 HydrophobicContact CB-CG 4.45Å; W24-L81 HydrophobicContact CD2-CD1 3.58Å; W24-L81 HydrophobicContact CE3-CD1 3.81Å; W24-L81 HydrophobicContact CG-CD1 3.57Å; W24-G93 CarbonylContact O-C 3.55Å; W24-G93 WeakPolarHBondContact O-CA 3.34Å; W24-I94 HydrophobicContact CE3-CB 4.43Å; W24-I94 PolarHBondContact O-N 2.83Å
25	E	92.7	Very high	91.8	Very high	56 Å²	56	91.4 Å²	91.4	26%	0.262	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	98	179.8	-171.2	-174.1	141.2	0	0	109.7	R21 P22 D23 V96	R21-E25 VanDerWaalsContact CD-OE1 3.32Å; R21-E25 WeakPolarHBondContact CD-OE1 2.89Å; P22-E25 HydrophobicContact CG-CB 3.96Å; P22-E25 WeakPolarHBondContact O-CB 2.99Å; P22-E25 PolarHBondContact O-N 3.36Å; D23-E25 VanDerWaalsContact C-N 3.34Å; E25-V96 HydrophobicContact CG-CG2 4.04Å
26	L	94.3	Very high	92	Very high	7 Å²	7	90.6 Å²	90.6	4%	0.037	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	157.2	-174.4	-50.1	-174.3	0	0	0	111.9	W24 V31 Y50 I94 A95 Q97 V104	W24-L26 PolarHBondContact O-N 3.13Å; L26-V31 HydrophobicContact CD1-CG2 4.43Å; L26-Y50 HydrophobicContact CD1-CD2 4.35Å; L26-Y50 HydrophobicContact CD1-CE1 4.3Å; L26-Y50 HydrophobicContact CD1-CE2 4.08Å; L26-Y50 HydrophobicContact CD2-CE1 4.27Å; L26-Y50 HydrophobicContact CD2-CE2 4.19Å; L26-Y50 WeakPolarHBondContact CD2-OH 3.48Å; L26-I94 PolarHBondContact N-O 3.01Å; L26-A95 HydrophobicContact CB-CB 3.95Å; L26-A95 WeakPolarHBondContact O-CA 3.29Å; L26-Q97 PolarHBondContact O-NE2 3.08Å; L26-V104 HydrophobicContact CD1-CB 3.82Å; L26-V104 HydrophobicContact CD1-CG1 4.38Å; L26-V104 HydrophobicContact CD1-CG2 3.63Å
27	D	92.9	Very high	92.2	Very high	19 Å²	19	90.3 Å²	90.3	10%	0.102	45%	0.454	C	S	.	.			trans	-87.5	131.4	165.8	-160.8	-51.7	0	0	0	109.7	R29 D30 Q97	D27-R29 PolarHBondContact O-N 3.28Å; D27-R29 VanDerWaalsContact O-N 3.13Å; D27-R29 WeakPolarHBondContact OD1-CB 2.99Å; D27-R29 WeakPolarHBondContact OD1-CG 3.5Å; D27-R29 IonicContact OD1-CZ 3.85Å; D27-R29 PolarHBondContact OD1-N 2.95Å; D27-R29 IonicContact OD1-NE 2.94Å; D27-R29 PolarHBondContact OD1-NE 2.83Å; D27-R29 IonicContact OD1-NH2 3.9Å; D27-R29 IonicContact OD2-CZ 3.34Å; D27-R29 IonicContact OD2-NE 3.22Å; D27-R29 PolarHBondContact OD2-NE 3.09Å; D27-R29 IonicContact OD2-NH2 2.66Å; D27-R29 PolarHBondContact OD2-NH2 3.46Å; D27-D30 WeakPolarHBondContact CB-OD2 3.32Å; D27-D30 PolarHBondContact O-N 3.03Å; D27-D30 VanDerWaalsContact O-N 3.08Å; D27-Q97 PolarHBondContact OD2-OE1 2.96Å
28	N	93.3	Very high	92.3	Very high	13 Å²	13	86.4 Å²	86.4	7%	0.07	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-59	-26.4	177.9	-66.4	85.8	0	0	0	112.2	D30 V31 A95 Q97 S98 P100	N28-D30 VanDerWaalsContact C-N 3.27Å; N28-D30 PolarHBondContact O-N 3.32Å; N28-V31 PolarHBondContact O-N 2.79Å; N28-A95 HydrophobicContact CB-CB 4.37Å; N28-Q97 PolarHBondContact OD1-N 3.21Å; N28-S98 WeakPolarHBondContact CB-OG 3.48Å; N28-S98 PolarHBondContact ND2-O 3.34Å; N28-S98 PolarHBondContact OD1-N 2.95Å; N28-S98 PolarHBondContact OD1-O 3.31Å; N28-S98 PolarHBondContact OD1-OG 3.13Å; N28-P100 PolarHBondContact ND2-O 3.46Å
29	R	94.7	Very high	92.2	Very high	207 Å²	207	88.4 Å²	88.4	78%	0.781	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-70.5	-23.4	179.7	-63	173.9	-68.6	169.2	2.2	113.1	D27 V31	D27-R29 PolarHBondContact O-N 3.28Å; D27-R29 VanDerWaalsContact O-N 3.13Å; D27-R29 WeakPolarHBondContact OD1-CB 2.99Å; D27-R29 WeakPolarHBondContact OD1-CG 3.5Å; D27-R29 IonicContact OD1-CZ 3.85Å; D27-R29 PolarHBondContact OD1-N 2.95Å; D27-R29 IonicContact OD1-NE 2.94Å; D27-R29 PolarHBondContact OD1-NE 2.83Å; D27-R29 IonicContact OD1-NH2 3.9Å; D27-R29 IonicContact OD2-CZ 3.34Å; D27-R29 IonicContact OD2-NE 3.22Å; D27-R29 PolarHBondContact OD2-NE 3.09Å; D27-R29 IonicContact OD2-NH2 2.66Å; D27-R29 PolarHBondContact OD2-NH2 3.46Å; R29-V31 VanDerWaalsContact C-N 3.32Å
30	D	95.6	Very high	91.6	Very high	88 Å²	88	81.9 Å²	81.9	47%	0.471	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-86.5	-9.1	179.7	-59.6	-26.6	0	0	0	112.1	D27 N28 Y50	D27-D30 WeakPolarHBondContact CB-OD2 3.32Å; D27-D30 PolarHBondContact O-N 3.03Å; D27-D30 VanDerWaalsContact O-N 3.08Å; N28-D30 VanDerWaalsContact C-N 3.27Å; N28-D30 PolarHBondContact O-N 3.32Å; D30-Y50 HydrophobicContact CB-CD2 4.12Å; D30-Y50 HydrophobicContact CB-CE2 3.86Å; D30-Y50 WeakPolarHBondContact O-CD2 3.09Å
31	V	97.1	Very high	90.8	Very high	9 Å²	9	81.4 Å²	81.4	6%	0.055	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	107	-178.8	-175.6	0	0	0	0	109.6	L26 N28 R29 L33 Y50 V57 A95 M102 V104	L26-V31 HydrophobicContact CD1-CG2 4.43Å; N28-V31 PolarHBondContact O-N 2.79Å; R29-V31 VanDerWaalsContact C-N 3.32Å; V31-L33 HydrophobicContact CG1-CD2 4.49Å; V31-Y50 HydrophobicContact CG2-CD2 3.87Å; V31-V57 HydrophobicContact CG1-CG1 4.08Å; V31-V57 HydrophobicContact CG1-CG2 3.75Å; V31-A95 HydrophobicContact CG2-CB 4.4Å; V31-M102 HydrophobicContact CB-SD 4.1Å; V31-M102 HydrophobicContact CG1-SD 3.94Å; V31-V104 HydrophobicContact CG1-CG2 4.04Å; V31-V104 HydrophobicContact CG2-CG2 3.81Å
32	Q	97.1	Very high	90.1	Very high	117 Å²	117	77.5 Å²	77.5	55%	0.547	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.8	175.7	-171.8	178.8	5.4	0	0	110.3	L34 G48 V49	Q32-L34 HydrophobicContact CG-CD2 4.06Å; Q32-G48 CarbonylContact O-C 3.53Å; Q32-G48 WeakPolarHBondContact O-CA 3.38Å; Q32-V49 HydrophobicContact CB-CB 4.36Å; Q32-V49 PolarHBondContact N-O 2.78Å; Q32-V49 PolarHBondContact O-N 2.85Å
33	L	96.5	Very high	89.8	Confident	60 Å²	60	75.5 Å²	75.5	31%	0.314	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	130.9	169.5	-57.3	-176.9	0	0	0	109.9	V31 Y46 V57 T59 M102	V31-L33 HydrophobicContact CG1-CD2 4.49Å; L33-Y46 HydrophobicContact CB-CG 4.47Å; L33-Y46 HydrophobicContact CD1-CD2 4.3Å; L33-Y46 HydrophobicContact CD1-CE2 4.46Å; L33-Y46 HydrophobicContact CD2-CD2 4.36Å; L33-Y46 HydrophobicContact CD2-CG 4.31Å; L33-V57 HydrophobicContact CD2-CB 3.62Å; L33-V57 HydrophobicContact CD2-CG1 3.51Å; L33-V57 HydrophobicContact CD2-CG2 3.98Å; L33-T59 HydrophobicContact CD1-CG2 4.24Å; L33-M102 HydrophobicContact CD1-CE 4Å; L33-M102 HydrophobicContact CD2-SD 4.18Å; L33-M102 HydrophobicContact CG-CE 4.3Å; L33-M102 HydrophobicContact CG-SD 4.48Å
34	L	96.9	Very high	90	Very high	84 Å²	84	67.9 Å²	67.9	44%	0.44	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-108.2	175	-56.3	176.5	0	0	0	109.8	Q32 R47 V49	Q32-L34 HydrophobicContact CG-CD2 4.06Å; L34-R47 WeakPolarHBondContact CA-O 3.37Å; L34-R47 WeakPolarHBondContact CB-O 3.36Å; L34-R47 PolarHBondContact N-O 3.33Å; L34-V49 HydrophobicContact CD1-CG2 3.82Å
35	Q	96.6	Very high	90.1	Very high	128 Å²	128	65 Å²	65	60%	0.598	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.9	-174.9	-176.1	179.9	12.3	0	0	111.9	I37 Y46 R47	Q35-I37 PolarHBondContact O-N 2.76Å; Q35-Y46 CarbonylContact O-C 3.23Å; Q35-Y46 VanDerWaalsContact O-CA 3.28Å; Q35-Y46 WeakPolarHBondContact O-CA 3.16Å; Q35-R47 PolarHBondContact O-N 3.04Å
36	K	96.1	Very high	90.3	Very high	92 Å²	92	64.8 Å²	64.8	40%	0.4	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	121.8	167.1	-177.4	174.1	167.8	174.8	0	109.8	G38 D44 Y46	K36-G38 VanDerWaalsContact CE-O 3.29Å; K36-G38 WeakPolarHBondContact CE-O 3.5Å; K36-D44 HydrophobicContact CD-CB 4.12Å; K36-D44 WeakPolarHBondContact CE-OD1 3.2Å; K36-D44 HydrophobicContact CG-CB 4.44Å; K36-D44 IonicContact NZ-OD1 4Å; K36-D44 PolarHBondContact NZ-OD1 3.25Å; K36-Y46 HydrophobicContact CB-CD1 3.9Å; K36-Y46 HydrophobicContact CB-CE1 3.7Å; K36-Y46 HydrophobicContact CG-CE1 4.37Å
37	I	94.4	Very high	90.4	Very high	75 Å²	75	68.7 Å²	68.7	39%	0.385	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-14.2	-178.4	58.6	175.9	0	0	0	113.3	Q35 V45 R47 Y107	Q35-I37 PolarHBondContact O-N 2.76Å; I37-V45 HydrophobicContact CD1-CG1 3.96Å; I37-V45 HydrophobicContact CG1-CB 4.22Å; I37-V45 HydrophobicContact CG1-CG1 3.87Å; I37-V45 WeakPolarHBondContact CG1-O 3.01Å; I37-V45 PolarHBondContact N-O 2.84Å; I37-R47 HydrophobicContact CD1-CB 4.49Å; I37-R47 HydrophobicContact CG2-CB 3.81Å; I37-Y107 HydrophobicContact CD1-CD2 4.14Å; I37-Y107 HydrophobicContact CD1-CE2 3.73Å
38	G	88.7	Confident	90.7	Very high	27 Å²	27	67.8 Å²	67.8	28%	0.278	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	175.6	-179.6	0	0	0	0	0	113.2	K36 V45	K36-G38 VanDerWaalsContact CE-O 3.29Å; K36-G38 WeakPolarHBondContact CE-O 3.5Å; G38-V45 PolarHBondContact N-O 3.43Å; G38-V45 PolarHBondContact O-N 2.97Å
39	Q	86.2	Confident	90.9	Very high	146 Å²	146	69.2 Å²	69.2	68%	0.682	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.5	122.3	173.6	-176.1	170.8	-16.5	0	0	108
40	G	73.1	Confident	91.1	Very high	26 Å²	26	61 Å²	61	27%	0.268	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-176.7	173.5	0	0	0	0	0	111.3	F42 G43	G40-F42 PolarHBondContact O-N 3.03Å; G40-G43 PolarHBondContact N-O 2.92Å
41	N	68.2	Low	91	Very high	98 Å²	98	62.4 Å²	62.4	52%	0.524	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26	-179.1	-65.9	-24.2	0	0	0	113.3
42	F	70.7	Confident	91	Very high	67 Å²	67	65.5 Å²	65.5	29%	0.294	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-5.4	-171.3	-53.3	-65	0	0	0	114.4	G40 C60 R61 F73	G40-F42 PolarHBondContact O-N 3.03Å; F42-C60 WeakPolarHBondContact O-CA 3.28Å; F42-R61 PolarHBondContact O-N 3.49Å; F42-R61 VanDerWaalsContact O-N 3.1Å; F42-F73 HydrophobicContact CB-CE2 3.82Å; F42-F73 HydrophobicContact CB-CZ 3.49Å; F42-F73 VanDerWaalsContact CB-CZ 3.49Å; F42-F73 HydrophobicContact CD1-CD2 4.26Å; F42-F73 AromaticContact CD1-CE2 3.26Å; F42-F73 HydrophobicContact CD1-CE2 3.26Å; F42-F73 AromaticContact CD1-CZ 3.91Å; F42-F73 HydrophobicContact CD1-CZ 3.91Å; F42-F73 AromaticContact CD2-CE2 3.77Å; F42-F73 HydrophobicContact CD2-CE2 3.77Å; F42-F73 AromaticContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CE1-CD2 4.36Å; F42-F73 AromaticContact CE1-CE2 3.61Å; F42-F73 HydrophobicContact CE1-CE2 3.61Å; F42-F73 HydrophobicContact CE2-CE2 4.09Å; F42-F73 AromaticContact CG-CE2 3.32Å; F42-F73 HydrophobicContact CG-CE2 3.32Å; F42-F73 AromaticContact CG-CZ 3.48Å; F42-F73 HydrophobicContact CG-CZ 3.48Å; F42-F73 VanDerWaalsContact CG-CZ 3.48Å; F42-F73 HydrophobicContact CZ-CE2 4.01Å
43	G	81.2	Confident	91	Very high	9 Å²	9	63.7 Å²	63.7	9%	0.093	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.7	-164.3	179.5	0	0	0	0	0	113	G40 T59	G40-G43 PolarHBondContact N-O 2.92Å; G43-T59 WeakPolarHBondContact CA-O 3.4Å
44	D	91.7	Very high	91	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.027	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	148.1	-173.9	-58.1	-51.6	0	0	0	110.6	K36 Y46 T59 R61	K36-D44 HydrophobicContact CD-CB 4.12Å; K36-D44 WeakPolarHBondContact CE-OD1 3.2Å; K36-D44 HydrophobicContact CG-CB 4.44Å; K36-D44 IonicContact NZ-OD1 4Å; K36-D44 PolarHBondContact NZ-OD1 3.25Å; D44-Y46 HydrophobicContact CB-CD2 4.21Å; D44-Y46 HydrophobicContact CB-CE2 3.43Å; D44-Y46 VanDerWaalsContact CB-CE2 3.43Å; D44-T59 PolarHBondContact N-OG1 3.43Å; D44-T59 PolarHBondContact O-N 3.06Å; D44-T59 PolarHBondContact O-OG1 3.05Å; D44-R61 IonicContact OD2-CZ 3.7Å; D44-R61 IonicContact OD2-NE 2.65Å; D44-R61 IonicContact OD2-NH2 3.04Å; D44-R61 PolarHBondContact OD2-NH2 2.89Å
45	V	94	Very high	91.1	Very high	31 Å²	31	61 Å²	61	19%	0.188	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.4	171.8	-171.4	0	0	0	0	108.2	I37 G38 V57 K58	I37-V45 HydrophobicContact CD1-CG1 3.96Å; I37-V45 HydrophobicContact CG1-CB 4.22Å; I37-V45 HydrophobicContact CG1-CG1 3.87Å; I37-V45 WeakPolarHBondContact CG1-O 3.01Å; I37-V45 PolarHBondContact N-O 2.84Å; G38-V45 PolarHBondContact N-O 3.43Å; G38-V45 PolarHBondContact O-N 2.97Å; V45-V57 CarbonylContact C-O 3.5Å; V45-V57 WeakPolarHBondContact CA-O 3.48Å; V45-K58 HydrophobicContact CG2-CB 4.36Å; V45-K58 HydrophobicContact CG2-CG 4.36Å
46	Y	97	Very high	91.1	Very high	53 Å²	53	55.4 Å²	55.4	21%	0.208	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	147.7	178.4	-63.2	-97.5	0	0	0	110.4	L33 Q35 K36 D44 A56 V57 T59	L33-Y46 HydrophobicContact CB-CG 4.47Å; L33-Y46 HydrophobicContact CD1-CD2 4.3Å; L33-Y46 HydrophobicContact CD1-CE2 4.46Å; L33-Y46 HydrophobicContact CD2-CD2 4.36Å; L33-Y46 HydrophobicContact CD2-CG 4.31Å; Q35-Y46 CarbonylContact O-C 3.23Å; Q35-Y46 VanDerWaalsContact O-CA 3.28Å; Q35-Y46 WeakPolarHBondContact O-CA 3.16Å; K36-Y46 HydrophobicContact CB-CD1 3.9Å; K36-Y46 HydrophobicContact CB-CE1 3.7Å; K36-Y46 HydrophobicContact CG-CE1 4.37Å; D44-Y46 HydrophobicContact CB-CD2 4.21Å; D44-Y46 HydrophobicContact CB-CE2 3.43Å; D44-Y46 VanDerWaalsContact CB-CE2 3.43Å; Y46-A56 CarbonylContact O-C 3.44Å; Y46-A56 WeakPolarHBondContact O-CA 3.44Å; Y46-V57 PolarHBondContact N-O 2.91Å; Y46-V57 PolarHBondContact O-N 3.48Å; Y46-T59 HydrophobicContact CD2-CG2 3.84Å; Y46-T59 HydrophobicContact CE2-CG2 3.77Å
47	R	97.5	Very high	91.1	Very high	88 Å²	88	51 Å²	51	33%	0.332	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	141.6	153.7	-172.3	-178.1	-176.4	-160.2	2.4	107.4	L34 Q35 I37 E54 V55 Y107	L34-R47 WeakPolarHBondContact CA-O 3.37Å; L34-R47 WeakPolarHBondContact CB-O 3.36Å; L34-R47 PolarHBondContact N-O 3.33Å; Q35-R47 PolarHBondContact O-N 3.04Å; I37-R47 HydrophobicContact CD1-CB 4.49Å; I37-R47 HydrophobicContact CG2-CB 3.81Å; R47-E54 HydrophobicContact CG-CG 4.45Å; R47-E54 IonicContact CZ-OE1 2.96Å; R47-E54 IonicContact CZ-OE2 3.23Å; R47-E54 IonicContact NE-OE1 2.65Å; R47-E54 PolarHBondContact NE-OE1 3.45Å; R47-E54 IonicContact NE-OE2 2.75Å; R47-E54 IonicContact NH2-OE1 3.21Å; R47-E54 PolarHBondContact NH2-OE1 2.9Å; R47-E54 IonicContact NH2-OE2 2.75Å; R47-E54 PolarHBondContact NH2-OE2 3.24Å; R47-V55 CarbonylContact C-O 3.51Å; R47-Y107 HydrophobicContact CB-CE2 4.45Å; R47-Y107 HydrophobicContact CG-CD2 4.39Å; R47-Y107 HydrophobicContact CG-CE2 4.21Å
48	G	97.8	Very high	91	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	-178.2	-177.5	0	0	0	0	0	113.1	Q32 V55	Q32-G48 CarbonylContact O-C 3.53Å; Q32-G48 WeakPolarHBondContact O-CA 3.38Å; G48-V55 VanDerWaalsContact C-CG2 3.47Å; G48-V55 PolarHBondContact N-O 2.9Å; G48-V55 PolarHBondContact O-N 2.85Å
49	V	98.3	Very high	91.1	Very high	43 Å²	43	46.9 Å²	46.9	26%	0.261	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.6	174	-177.8	0	0	0	0	109	Q32 L34 C53	Q32-V49 HydrophobicContact CB-CB 4.36Å; Q32-V49 PolarHBondContact N-O 2.78Å; Q32-V49 PolarHBondContact O-N 2.85Å; L34-V49 HydrophobicContact CD1-CG2 3.82Å; V49-C53 VanDerWaalsContact CA-O 3.31Å; V49-C53 WeakPolarHBondContact CA-O 3.36Å
50	Y	97.6	Very high	90.9	Very high	35 Å²	35	40 Å²	40	14%	0.137	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	127.9	172.6	173	-104.7	0	0	0	108.7	L26 D30 V31 G52 C53 V92	L26-Y50 HydrophobicContact CD1-CD2 4.35Å; L26-Y50 HydrophobicContact CD1-CE1 4.3Å; L26-Y50 HydrophobicContact CD1-CE2 4.08Å; L26-Y50 HydrophobicContact CD2-CE1 4.27Å; L26-Y50 HydrophobicContact CD2-CE2 4.19Å; L26-Y50 WeakPolarHBondContact CD2-OH 3.48Å; D30-Y50 HydrophobicContact CB-CD2 4.12Å; D30-Y50 HydrophobicContact CB-CE2 3.86Å; D30-Y50 WeakPolarHBondContact O-CD2 3.09Å; V31-Y50 HydrophobicContact CG2-CD2 3.87Å; Y50-G52 PolarHBondContact O-N 2.91Å; Y50-C53 PolarHBondContact N-O 3.34Å; Y50-C53 WeakPolarHBondContact O-CB 3.21Å; Y50-C53 PolarHBondContact O-N 2.78Å; Y50-V92 HydrophobicContact CD1-CG1 3.82Å; Y50-V92 HydrophobicContact CE1-CG1 3.85Å
51	N	95.4	Very high	90.9	Very high	117 Å²	117	46.3 Å²	46.3	63%	0.626	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.7	42.5	-175.1	-70.2	-12	0	0	0	113.9	C53	N51-C53 PolarHBondContact O-N 2.96Å; N51-C53 VanDerWaalsContact O-N 3.14Å
52	G	96	Very high	90.8	Very high	74 Å²	74	42.8 Å²	42.8	76%	0.763	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.4	-0.2	-178.7	0	0	0	0	0	115.1	Y50	Y50-G52 PolarHBondContact O-N 2.91Å
53	C	96.7	Very high	90.5	Very high	80 Å²	80	44.5 Å²	44.5	54%	0.541	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	145.3	178.1	-61.8	0	0	0	0	110.9	V49 Y50 N51	V49-C53 VanDerWaalsContact CA-O 3.31Å; V49-C53 WeakPolarHBondContact CA-O 3.36Å; Y50-C53 PolarHBondContact N-O 3.34Å; Y50-C53 WeakPolarHBondContact O-CB 3.21Å; Y50-C53 PolarHBondContact O-N 2.78Å; N51-C53 PolarHBondContact O-N 2.96Å; N51-C53 VanDerWaalsContact O-N 3.14Å
54	E	97.5	Very high	89.5	Confident	83 Å²	83	47.1 Å²	47.1	39%	0.388	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.7	174.3	-170.9	176.1	166.8	0	0	111.3	R47 Y107	R47-E54 HydrophobicContact CG-CG 4.45Å; R47-E54 IonicContact CZ-OE1 2.96Å; R47-E54 IonicContact CZ-OE2 3.23Å; R47-E54 IonicContact NE-OE1 2.65Å; R47-E54 PolarHBondContact NE-OE1 3.45Å; R47-E54 IonicContact NE-OE2 2.75Å; R47-E54 IonicContact NH2-OE1 3.21Å; R47-E54 PolarHBondContact NH2-OE1 2.9Å; R47-E54 IonicContact NH2-OE2 2.75Å; R47-E54 PolarHBondContact NH2-OE2 3.24Å; E54-Y107 HydrophobicContact CG-CD1 4.03Å; E54-Y107 HydrophobicContact CG-CG 4.15Å; E54-Y107 WeakPolarHBondContact OE1-CD1 3.28Å; E54-Y107 WeakPolarHBondContact OE1-CE1 3.42Å
55	V	98.2	Very high	88	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.3	-174.5	-67.5	0	0	0	0	112.3	R47 G48 V57 V104 M105	R47-V55 CarbonylContact C-O 3.51Å; G48-V55 VanDerWaalsContact C-CG2 3.47Å; G48-V55 PolarHBondContact N-O 2.9Å; G48-V55 PolarHBondContact O-N 2.85Å; V55-V57 HydrophobicContact CG2-CG2 3.83Å; V55-V104 HydrophobicContact CB-CG1 3.76Å; V55-V104 HydrophobicContact CG1-CG1 3.78Å; V55-V104 HydrophobicContact CG2-CG1 3.9Å; V55-M105 WeakPolarHBondContact CA-O 3.41Å; V55-M105 WeakPolarHBondContact CB-O 3.45Å
56	A	97.4	Very high	86.7	Confident	11 Å²	11	53.3 Å²	53.3	9%	0.091	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	134.1	162.5	0	0	0	0	0	109.2	Y46 M105 Y107	Y46-A56 CarbonylContact O-C 3.44Å; Y46-A56 WeakPolarHBondContact O-CA 3.44Å; A56-M105 HydrophobicContact CB-CB 4.48Å; A56-M105 HydrophobicContact CB-CE 4.38Å; A56-M105 PolarHBondContact N-O 3.23Å; A56-M105 PolarHBondContact O-N 2.81Å; A56-Y107 HydrophobicContact CB-CD2 4.31Å
57	V	96	Very high	85.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	108.2	-176.8	-169.5	0	0	0	0	109.9	V31 L33 V45 Y46 V55 M102 I103 V104	V31-V57 HydrophobicContact CG1-CG1 4.08Å; V31-V57 HydrophobicContact CG1-CG2 3.75Å; L33-V57 HydrophobicContact CD2-CB 3.62Å; L33-V57 HydrophobicContact CD2-CG1 3.51Å; L33-V57 HydrophobicContact CD2-CG2 3.98Å; V45-V57 CarbonylContact C-O 3.5Å; V45-V57 WeakPolarHBondContact CA-O 3.48Å; Y46-V57 PolarHBondContact N-O 2.91Å; Y46-V57 PolarHBondContact O-N 3.48Å; V55-V57 HydrophobicContact CG2-CG2 3.83Å; V57-M102 HydrophobicContact CG1-CB 3.62Å; V57-M102 HydrophobicContact CG1-CG 3.97Å; V57-M102 HydrophobicContact CG1-SD 4.13Å; V57-I103 WeakPolarHBondContact CA-O 3.36Å; V57-V104 HydrophobicContact CG1-CG2 4.47Å
58	K	92.7	Very high	84.1	Confident	10 Å²	10	54.6 Å²	54.6	4%	0.043	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	114.4	173.9	179.2	178.2	177.1	-173	0	108.7	V45 E77 M102 I103 M105 D170	V45-K58 HydrophobicContact CG2-CB 4.36Å; V45-K58 HydrophobicContact CG2-CG 4.36Å; K58-E77 IonicContact NZ-OE1 2.75Å; K58-E77 PolarHBondContact NZ-OE1 2.48Å; K58-E77 VanDerWaalsContact NZ-OE1 3.15Å; K58-M102 WeakPolarHBondContact O-CA 3.21Å; K58-I103 HydrophobicContact CB-CB 4.31Å; K58-I103 HydrophobicContact CD-CD1 4.19Å; K58-I103 HydrophobicContact CG-CD1 4.44Å; K58-I103 PolarHBondContact N-O 3.48Å; K58-I103 PolarHBondContact O-N 3.42Å; K58-M105 HydrophobicContact CB-CE 3.7Å; K58-D170 IonicContact NZ-OD1 3.55Å; K58-D170 PolarHBondContact NZ-OD1 3.48Å; K58-D170 IonicContact NZ-OD2 3.91Å
59	T	90.9	Very high	82.5	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.031	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	142.7	175.2	59.3	0	0	0	0	109.9	L33 G43 D44 Y46 P100 I101 M102	L33-T59 HydrophobicContact CD1-CG2 4.24Å; G43-T59 WeakPolarHBondContact CA-O 3.4Å; D44-T59 PolarHBondContact N-OG1 3.43Å; D44-T59 PolarHBondContact O-N 3.06Å; D44-T59 PolarHBondContact O-OG1 3.05Å; Y46-T59 HydrophobicContact CD2-CG2 3.84Å; Y46-T59 HydrophobicContact CE2-CG2 3.77Å; T59-P100 HydrophobicContact CG2-CG 4.15Å; T59-I101 WeakPolarHBondContact CA-O 3.47Å; T59-M102 HydrophobicContact CG2-CG 4.46Å
60	C	81.3	Confident	81.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.5	177.9	-63.5	0	0	0	0	110.1	F42 V62 F73 I101	F42-C60 WeakPolarHBondContact O-CA 3.28Å; C60-V62 PolarHBondContact O-N 2.69Å; C60-F73 HydrophobicContact CB-CD1 4.49Å; C60-F73 HydrophobicContact CB-CE1 3.63Å; C60-F73 HydrophobicContact CB-CZ 4.12Å; C60-F73 WeakPolarHBondContact SG-CE1 3.44Å; C60-I101 HydrophobicContact CB-CB 4.38Å; C60-I101 PolarHBondContact N-O 3.38Å
61	R	72.8	Confident	80.1	Confident	159 Å²	159	65.6 Å²	65.6	60%	0.6	36%	0.36	S	S	*	.			trans	-89.1	26.2	-177.1	-59.5	-172	-176.3	-171.3	1.4	113.1	F42 D44 D63 Y99	F42-R61 PolarHBondContact O-N 3.49Å; F42-R61 VanDerWaalsContact O-N 3.1Å; D44-R61 IonicContact OD2-CZ 3.7Å; D44-R61 IonicContact OD2-NE 2.65Å; D44-R61 IonicContact OD2-NH2 3.04Å; D44-R61 PolarHBondContact OD2-NH2 2.89Å; R61-D63 PolarHBondContact O-N 2.86Å; R61-Y99 WeakPolarHBondContact CA-OH 3.43Å
62	V	66.9	Low	78.8	Confident	24 Å²	24	65.8 Å²	65.8	15%	0.145	36%	0.355	C	S	.	.			trans	-69.5	132	-180	-176.6	0	0	0	0	109.1	C60 M64 L69 F73	C60-V62 PolarHBondContact O-N 2.69Å; V62-M64 PolarHBondContact O-N 2.78Å; V62-L69 HydrophobicContact CG1-CD2 3.72Å; V62-L69 HydrophobicContact CG1-CG 3.99Å; V62-F73 HydrophobicContact CG2-CD1 4.09Å; V62-F73 HydrophobicContact CG2-CD2 4.11Å; V62-F73 HydrophobicContact CG2-CE1 4.3Å; V62-F73 HydrophobicContact CG2-CE2 4.34Å; V62-F73 HydrophobicContact CG2-CG 4Å; V62-F73 HydrophobicContact CG2-CZ 4.42Å
63	D	64.4	Low	77.6	Confident	104 Å²	104	63.5 Å²	63.5	56%	0.556	32%	0.324	S	S	*	.			trans	-60.5	117.7	174	-171.3	-23.6	0	0	0	109.6	R61 T65	R61-D63 PolarHBondContact O-N 2.86Å; D63-T65 VanDerWaalsContact CG-OG1 3.23Å; D63-T65 PolarHBondContact O-N 2.8Å; D63-T65 WeakPolarHBondContact OD1-CB 3.35Å; D63-T65 WeakPolarHBondContact OD1-CG2 3.27Å; D63-T65 PolarHBondContact OD1-N 2.85Å; D63-T65 PolarHBondContact OD1-OG1 3.23Å; D63-T65 PolarHBondContact OD2-OG1 3.19Å
64	M	59.1	Low	76.8	Confident	63 Å²	63	60.4 Å²	60.4	31%	0.31	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-10.2	-174.2	-73.8	-91.9	-81.8	0	0	113.3	V62 A66 Y99 I101	V62-M64 PolarHBondContact O-N 2.78Å; M64-A66 VanDerWaalsContact C-N 3.28Å; M64-A66 PolarHBondContact O-N 2.96Å; M64-Y99 HydrophobicContact CG-CD2 4.2Å; M64-I101 HydrophobicContact SD-CD1 3.77Å; M64-I101 HydrophobicContact SD-CG1 3.92Å
65	T	61.8	Low	76.1	Confident	123 Å²	123	60.4 Å²	60.4	76%	0.755	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.5	-177.7	56.1	0	0	0	0	113.4	D63	D63-T65 VanDerWaalsContact CG-OG1 3.23Å; D63-T65 PolarHBondContact O-N 2.8Å; D63-T65 WeakPolarHBondContact OD1-CB 3.35Å; D63-T65 WeakPolarHBondContact OD1-CG2 3.27Å; D63-T65 PolarHBondContact OD1-N 2.85Å; D63-T65 PolarHBondContact OD1-OG1 3.23Å; D63-T65 PolarHBondContact OD2-OG1 3.19Å
66	A	65.7	Low	75.4	Confident	43 Å²	43	60.2 Å²	60.2	36%	0.355	30%	0.301	S	S	.	.			trans	-102.4	88.3	177.8	0	0	0	0	0	111.7	M64 D68 L69 R70	M64-A66 VanDerWaalsContact C-N 3.28Å; M64-A66 PolarHBondContact O-N 2.96Å; A66-D68 PolarHBondContact O-N 2.95Å; A66-D68 VanDerWaalsContact O-N 3.16Å; A66-L69 HydrophobicContact CB-CB 3.9Å; A66-L69 WeakPolarHBondContact O-CB 3.19Å; A66-L69 PolarHBondContact O-N 3.08Å; A66-R70 PolarHBondContact O-N 3.2Å; A66-R70 VanDerWaalsContact O-N 3.15Å
67	S	69.1	Low	74.8	Confident	77 Å²	77	59.8 Å²	59.8	54%	0.538	30%	0.297	S	S	.	.	H	α-helix	trans	-53.7	-36.1	-178.2	63.2	0	0	0	0	113.8	R70 R71	S67-R70 PolarHBondContact O-N 3.25Å; S67-R71 PolarHBondContact O-N 2.72Å
68	D	69.7	Low	74.4	Confident	92 Å²	92	62.2 Å²	62.2	49%	0.492	31%	0.312	S	S	.	.	H	α-helix	trans	-67.1	-36.4	176.9	-71.6	-33	0	0	0	113.1	A66 R71 K72	A66-D68 PolarHBondContact O-N 2.95Å; A66-D68 VanDerWaalsContact O-N 3.16Å; D68-R71 PolarHBondContact O-N 3.25Å; D68-R71 IonicContact OD1-CZ 2.75Å; D68-R71 VanDerWaalsContact OD1-CZ 3.23Å; D68-R71 IonicContact OD1-NH1 3.46Å; D68-R71 PolarHBondContact OD1-NH1 3.5Å; D68-R71 IonicContact OD1-NH2 3.51Å; D68-R71 PolarHBondContact OD1-NH2 2.79Å; D68-K72 WeakPolarHBondContact O-CG 3.47Å; D68-K72 PolarHBondContact O-N 3.06Å; D68-K72 VanDerWaalsContact O-N 3.08Å
69	L	65.5	Low	74.1	Confident	94 Å²	94	62.5 Å²	62.5	49%	0.492	32%	0.315	S	S	.	.	H	α-helix	trans	-68.1	-43.7	176.8	-170.4	64.5	0	0	0	109.9	V62 A66 R71 K72 F73	V62-L69 HydrophobicContact CG1-CD2 3.72Å; V62-L69 HydrophobicContact CG1-CG 3.99Å; A66-L69 HydrophobicContact CB-CB 3.9Å; A66-L69 WeakPolarHBondContact O-CB 3.19Å; A66-L69 PolarHBondContact O-N 3.08Å; L69-R71 VanDerWaalsContact C-N 3.34Å; L69-R71 PolarHBondContact O-N 3.14Å; L69-K72 PolarHBondContact O-N 3.09Å; L69-F73 WeakPolarHBondContact O-CB 3.37Å; L69-F73 PolarHBondContact O-N 3.15Å
70	R	72	Confident	74.1	Confident	69 Å²	69	62.3 Å²	62.3	26%	0.26	31%	0.314	S	S	.	.	H	α-helix	trans	-57	-45.4	174.8	177.6	174.9	166.9	-177.4	-10.2	112	A66 S67 F73 L74 V96 I101	A66-R70 PolarHBondContact O-N 3.2Å; A66-R70 VanDerWaalsContact O-N 3.15Å; S67-R70 PolarHBondContact O-N 3.25Å; R70-F73 PolarHBondContact O-N 2.64Å; R70-L74 HydrophobicContact CG-CD1 4.02Å; R70-L74 WeakPolarHBondContact O-CG 3.37Å; R70-L74 PolarHBondContact O-N 2.92Å; R70-V96 PolarHBondContact NH2-O 3.12Å; R70-I101 HydrophobicContact CG-CD1 3.92Å
71	R	72.8	Confident	74.6	Confident	146 Å²	146	63.7 Å²	63.7	55%	0.551	32%	0.321	S	S	*	.	H	α-helix	trans	-63.7	-49.5	179.1	-165.8	-169.8	-43.1	100.3	8.8	111.9	S67 D68 L69 F73 L74 Q75	S67-R71 PolarHBondContact O-N 2.72Å; D68-R71 PolarHBondContact O-N 3.25Å; D68-R71 IonicContact OD1-CZ 2.75Å; D68-R71 VanDerWaalsContact OD1-CZ 3.23Å; D68-R71 IonicContact OD1-NH1 3.46Å; D68-R71 PolarHBondContact OD1-NH1 3.5Å; D68-R71 IonicContact OD1-NH2 3.51Å; D68-R71 PolarHBondContact OD1-NH2 2.79Å; L69-R71 VanDerWaalsContact C-N 3.34Å; L69-R71 PolarHBondContact O-N 3.14Å; R71-F73 PolarHBondContact O-N 3.18Å; R71-L74 PolarHBondContact O-N 3.18Å; R71-Q75 PolarHBondContact O-N 3.29Å
72	K	68.4	Low	75.5	Confident	121 Å²	121	62.3 Å²	62.3	53%	0.526	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-32.3	177.9	-75	-179.1	-179.9	-179.2	0	112.4	D68 L69 R175	D68-K72 WeakPolarHBondContact O-CG 3.47Å; D68-K72 PolarHBondContact O-N 3.06Å; D68-K72 VanDerWaalsContact O-N 3.08Å; L69-K72 PolarHBondContact O-N 3.09Å; K72-R175 PolarHBondContact O-NH2 2.88Å
73	F	70.5	Confident	76.9	Confident	25 Å²	25	61.7 Å²	61.7	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-73.5	-43.3	-179.6	-175.7	-96.1	0	0	0	112.3	F42 C60 V62 L69 R70 R71	F42-F73 HydrophobicContact CB-CE2 3.82Å; F42-F73 HydrophobicContact CB-CZ 3.49Å; F42-F73 VanDerWaalsContact CB-CZ 3.49Å; F42-F73 HydrophobicContact CD1-CD2 4.26Å; F42-F73 AromaticContact CD1-CE2 3.26Å; F42-F73 HydrophobicContact CD1-CE2 3.26Å; F42-F73 AromaticContact CD1-CZ 3.91Å; F42-F73 HydrophobicContact CD1-CZ 3.91Å; F42-F73 AromaticContact CD2-CE2 3.77Å; F42-F73 HydrophobicContact CD2-CE2 3.77Å; F42-F73 AromaticContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CD2-CZ 3.87Å; F42-F73 HydrophobicContact CE1-CD2 4.36Å; F42-F73 AromaticContact CE1-CE2 3.61Å; F42-F73 HydrophobicContact CE1-CE2 3.61Å; F42-F73 HydrophobicContact CE2-CE2 4.09Å; F42-F73 AromaticContact CG-CE2 3.32Å; F42-F73 HydrophobicContact CG-CE2 3.32Å; F42-F73 AromaticContact CG-CZ 3.48Å; F42-F73 HydrophobicContact CG-CZ 3.48Å; F42-F73 VanDerWaalsContact CG-CZ 3.48Å; F42-F73 HydrophobicContact CZ-CE2 4.01Å; C60-F73 HydrophobicContact CB-CD1 4.49Å; C60-F73 HydrophobicContact CB-CE1 3.63Å; C60-F73 HydrophobicContact CB-CZ 4.12Å; C60-F73 WeakPolarHBondContact SG-CE1 3.44Å; V62-F73 HydrophobicContact CG2-CD1 4.09Å; V62-F73 HydrophobicContact CG2-CD2 4.11Å; V62-F73 HydrophobicContact CG2-CE1 4.3Å; V62-F73 HydrophobicContact CG2-CE2 4.34Å; V62-F73 HydrophobicContact CG2-CG 4Å; V62-F73 HydrophobicContact CG2-CZ 4.42Å; L69-F73 WeakPolarHBondContact O-CB 3.37Å; L69-F73 PolarHBondContact O-N 3.15Å; R70-F73 PolarHBondContact O-N 2.64Å; R71-F73 PolarHBondContact O-N 3.18Å
74	L	80.5	Confident	78.4	Confident	15 Å²	15	62.6 Å²	62.6	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-82.3	-12.9	-179.5	-65.8	177.4	0	0	0	113.8	R70 R71 G76 E77 T78 I94 V96 I101 I103	R70-L74 HydrophobicContact CG-CD1 4.02Å; R70-L74 WeakPolarHBondContact O-CG 3.37Å; R70-L74 PolarHBondContact O-N 2.92Å; R71-L74 PolarHBondContact O-N 3.18Å; L74-G76 VanDerWaalsContact C-N 3.35Å; L74-G76 PolarHBondContact O-N 2.82Å; L74-E77 PolarHBondContact O-N 2.84Å; L74-E77 VanDerWaalsContact O-N 3.08Å; L74-T78 PolarHBondContact O-N 2.83Å; L74-T78 PolarHBondContact O-OG1 2.94Å; L74-T78 VanDerWaalsContact O-OG1 3.05Å; L74-I94 HydrophobicContact CD2-CG2 4.27Å; L74-V96 HydrophobicContact CD1-CG1 4Å; L74-I101 HydrophobicContact CD1-CD1 4.39Å; L74-I101 HydrophobicContact CD1-CG2 4.44Å; L74-I101 HydrophobicContact CD2-CG2 3.99Å; L74-I103 HydrophobicContact CD2-CG1 4.46Å
75	Q	82.9	Confident	80.2	Confident	84 Å²	84	61.6 Å²	61.6	39%	0.393	32%	0.32	S	S	.	.	H	α-helix	trans	-51.1	-49.1	-173.8	-169.9	174.8	7.7	0	0	113.6	R71 E77 T78 T79	R71-Q75 PolarHBondContact O-N 3.29Å; Q75-E77 PolarHBondContact O-N 2.94Å; Q75-T78 PolarHBondContact O-N 2.85Å; Q75-T79 PolarHBondContact O-N 3.29Å; Q75-T79 PolarHBondContact O-OG1 2.85Å
76	G	82.2	Confident	81.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.5	-35.7	-179.1	0	0	0	0	0	113.5	L74 A80 F171 S174	L74-G76 VanDerWaalsContact C-N 3.35Å; L74-G76 PolarHBondContact O-N 2.82Å; G76-A80 WeakPolarHBondContact O-CB 3.22Å; G76-A80 PolarHBondContact O-N 3.07Å; G76-A80 VanDerWaalsContact O-N 3.09Å; G76-F171 CarbonylContact C-O 3.46Å; G76-F171 WeakPolarHBondContact CA-O 3.14Å; G76-S174 WeakPolarHBondContact CA-O 3.39Å; G76-S174 VanDerWaalsContact CA-OG 3.25Å; G76-S174 WeakPolarHBondContact CA-OG 3.3Å; G76-S174 PolarHBondContact O-OG 2.88Å
77	E	86.6	Confident	83.5	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-74.3	-37.1	177.1	-57.4	-76.1	-170.2	0	0	110.7	K58 L74 Q75 T79 A80 L81 L91 I94 I103 G172	K58-E77 IonicContact NZ-OE1 2.75Å; K58-E77 PolarHBondContact NZ-OE1 2.48Å; K58-E77 VanDerWaalsContact NZ-OE1 3.15Å; L74-E77 PolarHBondContact O-N 2.84Å; L74-E77 VanDerWaalsContact O-N 3.08Å; Q75-E77 PolarHBondContact O-N 2.94Å; E77-T79 VanDerWaalsContact C-N 3.35Å; E77-T79 PolarHBondContact O-N 2.89Å; E77-A80 PolarHBondContact O-N 3.25Å; E77-A80 VanDerWaalsContact O-N 3.13Å; E77-L81 PolarHBondContact O-N 3.05Å; E77-L81 VanDerWaalsContact O-N 3.14Å; E77-L91 HydrophobicContact CB-CD2 4.17Å; E77-L91 WeakPolarHBondContact O-CD2 3.22Å; E77-I94 HydrophobicContact CB-CD1 4.24Å; E77-I103 HydrophobicContact CB-CD1 4.31Å; E77-I103 HydrophobicContact CB-CG1 4.46Å; E77-I103 HydrophobicContact CG-CD1 3.63Å; E77-I103 HydrophobicContact CG-CG1 4.31Å; E77-G172 PolarHBondContact OE1-N 3.42Å
78	T	86.3	Confident	84.9	Confident	51 Å²	51	54 Å²	54	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-63.2	-40.7	173.8	-56.1	0	0	0	0	111.3	L74 Q75 A80 L81	L74-T78 PolarHBondContact O-N 2.83Å; L74-T78 PolarHBondContact O-OG1 2.94Å; L74-T78 VanDerWaalsContact O-OG1 3.05Å; Q75-T78 PolarHBondContact O-N 2.85Å; T78-A80 VanDerWaalsContact C-N 3.31Å; T78-A80 PolarHBondContact O-N 2.84Å; T78-L81 HydrophobicContact CG2-CD1 4.34Å; T78-L81 WeakPolarHBondContact O-CB 3.32Å; T78-L81 PolarHBondContact O-N 3.22Å
79	T	86.1	Confident	86.2	Confident	17 Å²	17	49.8 Å²	49.8	10%	0.104	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-43.5	171.8	-67.8	0	0	0	0	110.7	Q75 E77 L81 N82 F83 E176	Q75-T79 PolarHBondContact O-N 3.29Å; Q75-T79 PolarHBondContact O-OG1 2.85Å; E77-T79 VanDerWaalsContact C-N 3.35Å; E77-T79 PolarHBondContact O-N 2.89Å; T79-L81 PolarHBondContact O-N 3.38Å; T79-N82 PolarHBondContact O-N 3.14Å; T79-N82 VanDerWaalsContact O-N 3.12Å; T79-F83 HydrophobicContact CG2-CE1 4Å; T79-F83 HydrophobicContact CG2-CZ 3.65Å; T79-E176 HydrophobicContact CG2-CB 3.96Å; T79-E176 HydrophobicContact CG2-CG 4.4Å
80	A	90.9	Very high	87.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-16	-177.6	0	0	0	0	0	114.5	G76 E77 T78 N82 F83 L91 F171	G76-A80 WeakPolarHBondContact O-CB 3.22Å; G76-A80 PolarHBondContact O-N 3.07Å; G76-A80 VanDerWaalsContact O-N 3.09Å; E77-A80 PolarHBondContact O-N 3.25Å; E77-A80 VanDerWaalsContact O-N 3.13Å; T78-A80 VanDerWaalsContact C-N 3.31Å; T78-A80 PolarHBondContact O-N 2.84Å; A80-N82 PolarHBondContact O-N 3.18Å; A80-F83 HydrophobicContact CB-CD2 3.76Å; A80-F83 HydrophobicContact CB-CE2 3.9Å; A80-F83 WeakPolarHBondContact O-CB 3.47Å; A80-F83 PolarHBondContact O-N 3.1Å; A80-L91 HydrophobicContact CB-CD1 3.98Å; A80-L91 HydrophobicContact CB-CD2 3.8Å; A80-L91 HydrophobicContact CB-CG 4.49Å; A80-F171 HydrophobicContact CB-CB 3.77Å; A80-F171 HydrophobicContact CB-CD1 4.31Å; A80-F171 HydrophobicContact CB-CD2 3.82Å; A80-F171 HydrophobicContact CB-CG 3.69Å
81	L	92.5	Very high	88.8	Confident	29 Å²	29	47.8 Å²	47.8	15%	0.152	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.5	169.9	-70.2	167.2	0	0	0	113	W24 E77 T78 T79 F83 L91 I94	W24-L81 HydrophobicContact CB-CD1 3.77Å; W24-L81 HydrophobicContact CB-CD2 4.01Å; W24-L81 HydrophobicContact CB-CG 4.45Å; W24-L81 HydrophobicContact CD2-CD1 3.58Å; W24-L81 HydrophobicContact CE3-CD1 3.81Å; W24-L81 HydrophobicContact CG-CD1 3.57Å; E77-L81 PolarHBondContact O-N 3.05Å; E77-L81 VanDerWaalsContact O-N 3.14Å; T78-L81 HydrophobicContact CG2-CD1 4.34Å; T78-L81 WeakPolarHBondContact O-CB 3.32Å; T78-L81 PolarHBondContact O-N 3.22Å; T79-L81 PolarHBondContact O-N 3.38Å; L81-F83 VanDerWaalsContact C-N 3.31Å; L81-L91 HydrophobicContact CD2-CB 3.84Å; L81-L91 HydrophobicContact CD2-CD2 4.3Å; L81-L91 HydrophobicContact CG-CD2 4.33Å; L81-I94 HydrophobicContact CD1-CD1 4.02Å; L81-I94 HydrophobicContact CD1-CG1 4.21Å; L81-I94 HydrophobicContact CD2-CG1 4.35Å; L81-I94 HydrophobicContact CG-CD1 4.5Å
82	N	92.1	Very high	89.9	Confident	129 Å²	129	43.5 Å²	43.5	69%	0.69	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	1.5	179.1	-61.8	-48	0	0	0	113	T79 A80	T79-N82 PolarHBondContact O-N 3.14Å; T79-N82 VanDerWaalsContact O-N 3.12Å; A80-N82 PolarHBondContact O-N 3.18Å
83	F	95.2	Very high	91.1	Very high	12 Å²	12	37.8 Å²	37.8	5%	0.053	20%	0.199	C	C	.	.			trans	-87	135.8	-179.3	-60.7	-15.3	0	0	0	111.6	T79 A80 L81 I88 Y142 L143 C148 F171	T79-F83 HydrophobicContact CG2-CE1 4Å; T79-F83 HydrophobicContact CG2-CZ 3.65Å; A80-F83 HydrophobicContact CB-CD2 3.76Å; A80-F83 HydrophobicContact CB-CE2 3.9Å; A80-F83 WeakPolarHBondContact O-CB 3.47Å; A80-F83 PolarHBondContact O-N 3.1Å; L81-F83 VanDerWaalsContact C-N 3.31Å; F83-I88 HydrophobicContact CB-CG2 4.04Å; F83-I88 HydrophobicContact CD2-CG2 4.21Å; F83-Y142 WeakPolarHBondContact CA-OH 3.5Å; F83-Y142 HydrophobicContact CB-CE1 3.96Å; F83-Y142 HydrophobicContact CD1-CE1 4.08Å; F83-Y142 HydrophobicContact CG-CE1 4.04Å; F83-L143 HydrophobicContact CD2-CD2 3.76Å; F83-L143 HydrophobicContact CE2-CD2 3.42Å; F83-L143 VanDerWaalsContact CE2-CD2 3.42Å; F83-L143 HydrophobicContact CG-CD2 4.44Å; F83-L143 HydrophobicContact CZ-CD2 3.84Å; F83-C148 HydrophobicContact CZ-CB 3.84Å; F83-F171 HydrophobicContact CD2-CD1 4.37Å; F83-F171 HydrophobicContact CD2-CE1 4.04Å; F83-F171 HydrophobicContact CD2-CZ 4.23Å; F83-F171 AromaticContact CE2-CD1 3.88Å; F83-F171 HydrophobicContact CE2-CD1 3.88Å; F83-F171 AromaticContact CE2-CE1 3.79Å; F83-F171 HydrophobicContact CE2-CE1 3.79Å; F83-F171 HydrophobicContact CE2-CZ 4.43Å
84	N	96.1	Very high	92.2	Very high	123 Å²	123	36.6 Å²	36.6	66%	0.658	19%	0.194	S	C	*	.			trans	-148.8	96.9	178.7	-174.3	28.7	0	0	0	108.5	Y142	N84-Y142 PolarHBondContact N-OH 3.48Å; N84-Y142 WeakPolarHBondContact O-CE2 3.41Å; N84-Y142 PolarHBondContact O-OH 3.06Å
85	H	98	Very high	92.8	Very high	42 Å²	42	35.9 Å²	35.9	19%	0.194	19%	0.19	C	C	.	.			trans	-156.4	141.7	-179.3	-174.6	-93.7	0	0	0	109.2	N87 I88 Y142	H85-N87 PolarHBondContact CE1-OD1 3.13Å; H85-N87 VanDerWaalsContact CE1-OD1 3.29Å; H85-N87 PolarHBondContact ND1-N 3.5Å; H85-N87 PolarHBondContact O-N 3.22Å; H85-I88 HydrophobicContact CB-CB 4.13Å; H85-I88 HydrophobicContact CB-CG1 3.8Å; H85-I88 PolarHBondContact O-N 3.48Å; H85-I88 VanDerWaalsContact O-O 3.1Å; H85-Y142 HydrophobicContact CB-CD1 3.91Å; H85-Y142 HydrophobicContact CB-CD2 3.67Å; H85-Y142 HydrophobicContact CB-CE1 4.03Å; H85-Y142 HydrophobicContact CB-CE2 3.73Å; H85-Y142 HydrophobicContact CB-CG 3.73Å; H85-Y142 AromaticContact CD2-CD2 3.45Å; H85-Y142 VanDerWaalsContact CD2-CD2 3.45Å; H85-Y142 WeakPolarHBondContact CD2-CD2 3.48Å; H85-Y142 AromaticContact CD2-CG 3.77Å; H85-Y142 AromaticContact CG-CD2 3.73Å; H85-Y142 AromaticContact CG-CG 3.72Å
86	P	97.6	Very high	93	Very high	74 Å²	74	32.4 Å²	32.4	48%	0.481	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-33.3	-177.6	21.2	-34.5	0	0	0	113.8	K167	P86-K167 WeakPolarHBondContact O-CE 3.35Å; P86-K167 WeakPolarHBondContact O-CG 3.47Å
87	N	98.4	Very high	93.1	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.037	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	18.3	179.2	-51.1	110.9	0	0	0	114.5	H85 D135 N138 L166 K167 I168	H85-N87 PolarHBondContact CE1-OD1 3.13Å; H85-N87 VanDerWaalsContact CE1-OD1 3.29Å; H85-N87 PolarHBondContact ND1-N 3.5Å; H85-N87 PolarHBondContact O-N 3.22Å; N87-D135 WeakPolarHBondContact CB-O 3.21Å; N87-D135 VanDerWaalsContact CG-O 3.24Å; N87-D135 WeakPolarHBondContact ND2-CB 3.13Å; N87-D135 VanDerWaalsContact ND2-CG 3.31Å; N87-N138 WeakPolarHBondContact OD1-CB 3.16Å; N87-L166 WeakPolarHBondContact CA-O 3.34Å; N87-L166 WeakPolarHBondContact CB-O 3.26Å; N87-L166 PolarHBondContact ND2-O 3.37Å; N87-K167 WeakPolarHBondContact O-CA 3.45Å; N87-I168 PolarHBondContact O-N 3.25Å
88	I	98.1	Very high	93	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.015	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-124	132.5	173.4	-58.8	-62.5	0	0	0	107.9	F83 H85 K90 Y142 L143 I168 F171	F83-I88 HydrophobicContact CB-CG2 4.04Å; F83-I88 HydrophobicContact CD2-CG2 4.21Å; H85-I88 HydrophobicContact CB-CB 4.13Å; H85-I88 HydrophobicContact CB-CG1 3.8Å; H85-I88 PolarHBondContact O-N 3.48Å; H85-I88 VanDerWaalsContact O-O 3.1Å; I88-K90 PolarHBondContact O-N 3.29Å; I88-Y142 HydrophobicContact CG1-CD1 3.94Å; I88-Y142 HydrophobicContact CG1-CE1 4.4Å; I88-L143 HydrophobicContact CD1-CD1 4.02Å; I88-L143 HydrophobicContact CD1-CD2 4.11Å; I88-L143 HydrophobicContact CD1-CG 3.93Å; I88-I168 HydrophobicContact CD1-CB 3.93Å; I88-I168 HydrophobicContact CD1-CD1 4.1Å; I88-I168 HydrophobicContact CD1-CG1 4.35Å; I88-F171 HydrophobicContact CD1-CZ 4.22Å; I88-F171 HydrophobicContact CG2-CE2 3.85Å; I88-F171 HydrophobicContact CG2-CZ 3.61Å
89	V	97.4	Very high	92.8	Very high	3 Å²	3	42 Å²	42	2%	0.018	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-63.4	122.6	174	172.7	0	0	0	0	109.1	L91 M105 E106 V108 L159 K167 I168 A169	V89-L91 PolarHBondContact O-N 3.21Å; V89-M105 HydrophobicContact CG1-CB 4.03Å; V89-M105 HydrophobicContact CG1-CG 4.43Å; V89-M105 HydrophobicContact CG1-SD 4.47Å; V89-E106 HydrophobicContact CG1-CG 3.89Å; V89-V108 HydrophobicContact CG2-CG2 4.27Å; V89-L159 HydrophobicContact CG2-CD1 3.78Å; V89-L159 HydrophobicContact CG2-CG 4.27Å; V89-K167 HydrophobicContact CG2-CB 3.7Å; V89-I168 WeakPolarHBondContact CG2-O 3.29Å; V89-I168 PolarHBondContact N-O 2.82Å; V89-A169 HydrophobicContact CB-CB 4.19Å; V89-A169 HydrophobicContact CG2-CB 3.65Å
90	K	96.4	Very high	92.9	Very high	112 Å²	112	42.7 Å²	42.7	49%	0.487	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-72.4	120.9	178.5	-174.6	173.5	-178.3	178.1	0	110.7	I88 M105 E106	I88-K90 PolarHBondContact O-N 3.29Å; K90-M105 CarbonylContact O-C 3.51Å; K90-M105 WeakPolarHBondContact O-CA 3.42Å; K90-E106 HydrophobicContact CB-CB 4.37Å; K90-E106 HydrophobicContact CB-CG 4.06Å; K90-E106 WeakPolarHBondContact CB-OE1 3.37Å; K90-E106 PolarHBondContact N-OE1 3.34Å; K90-E106 PolarHBondContact O-N 3.28Å
91	L	95.3	Very high	92.8	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.047	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	135.7	164.5	-82.1	64.9	0	0	0	109.2	E77 A80 L81 V89 I103 M105 F171	E77-L91 HydrophobicContact CB-CD2 4.17Å; E77-L91 WeakPolarHBondContact O-CD2 3.22Å; A80-L91 HydrophobicContact CB-CD1 3.98Å; A80-L91 HydrophobicContact CB-CD2 3.8Å; A80-L91 HydrophobicContact CB-CG 4.49Å; L81-L91 HydrophobicContact CD2-CB 3.84Å; L81-L91 HydrophobicContact CD2-CD2 4.3Å; L81-L91 HydrophobicContact CG-CD2 4.33Å; V89-L91 PolarHBondContact O-N 3.21Å; L91-I103 HydrophobicContact CD2-CG2 4.17Å; L91-I103 HydrophobicContact CG-CG2 4.34Å; L91-M105 HydrophobicContact CD1-CG 4.05Å; L91-M105 HydrophobicContact CG-CG 3.92Å; L91-F171 HydrophobicContact CD1-CD2 4.47Å
92	V	95.6	Very high	92.8	Very high	56 Å²	56	42 Å²	42	34%	0.339	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-42.7	176.3	177.8	0	0	0	0	110	Y50 V104	Y50-V92 HydrophobicContact CD1-CG1 3.82Å; Y50-V92 HydrophobicContact CE1-CG1 3.85Å; V92-V104 HydrophobicContact CB-CB 4.36Å; V92-V104 HydrophobicContact CB-CG1 4.04Å; V92-V104 HydrophobicContact CG1-CG1 4.39Å; V92-V104 PolarHBondContact N-O 3.49Å
93	G	95.2	Very high	92.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173	-179.8	-177.5	0	0	0	0	0	112.2	W24 V104	W24-G93 CarbonylContact O-C 3.55Å; W24-G93 WeakPolarHBondContact O-CA 3.34Å; G93-V104 PolarHBondContact N-O 3.07Å; G93-V104 PolarHBondContact O-N 2.85Å
94	I	93.4	Very high	92.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120.6	180	-43.7	179.7	0	0	0	108.7	W24 L26 L74 E77 L81 V96 I101 M102 I103	W24-I94 HydrophobicContact CE3-CB 4.43Å; W24-I94 PolarHBondContact O-N 2.83Å; L26-I94 PolarHBondContact N-O 3.01Å; L74-I94 HydrophobicContact CD2-CG2 4.27Å; E77-I94 HydrophobicContact CB-CD1 4.24Å; L81-I94 HydrophobicContact CD1-CD1 4.02Å; L81-I94 HydrophobicContact CD1-CG1 4.21Å; L81-I94 HydrophobicContact CD2-CG1 4.35Å; L81-I94 HydrophobicContact CG-CD1 4.5Å; I94-V96 HydrophobicContact CB-CG1 3.99Å; I94-V96 HydrophobicContact CG2-CG1 3.31Å; I94-I101 HydrophobicContact CG2-CG2 4.1Å; I94-M102 CarbonylContact C-O 3.55Å; I94-M102 WeakPolarHBondContact CA-O 3.33Å; I94-M102 WeakPolarHBondContact CG2-O 3.39Å; I94-I103 HydrophobicContact CG2-CG1 4.11Å
95	A	92.6	Very high	92.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	111.7	173.2	0	0	0	0	0	109.8	L26 N28 V31 I101 M102	L26-A95 HydrophobicContact CB-CB 3.95Å; L26-A95 WeakPolarHBondContact O-CA 3.29Å; N28-A95 HydrophobicContact CB-CB 4.37Å; V31-A95 HydrophobicContact CG2-CB 4.4Å; A95-I101 WeakPolarHBondContact O-CA 3.14Å; A95-M102 HydrophobicContact CB-CB 4.06Å; A95-M102 PolarHBondContact N-O 2.94Å; A95-M102 PolarHBondContact O-N 3.13Å
96	V	87.1	Confident	92.9	Very high	12 Å²	12	30.6 Å²	30.6	7%	0.073	16%	0.158	C	C	.	.			trans	-129.7	7.5	-169.5	-53.1	0	0	0	0	113.6	E25 R70 L74 I94 I101	E25-V96 HydrophobicContact CG-CG2 4.04Å; R70-V96 PolarHBondContact NH2-O 3.12Å; L74-V96 HydrophobicContact CD1-CG1 4Å; I94-V96 HydrophobicContact CB-CG1 3.99Å; I94-V96 HydrophobicContact CG2-CG1 3.31Å; V96-I101 HydrophobicContact CG1-CG2 4.09Å
97	Q	83.8	Confident	92.9	Very high	73 Å²	73	30.1 Å²	30.1	34%	0.341	15%	0.146	S	C	.	.	S	Bend	trans	-78.3	-28	-175.6	-62.6	-177.9	35.2	0	0	112.1	R21 L26 D27 N28	R21-Q97 VanDerWaalsContact NH1-OE1 3.09Å; L26-Q97 PolarHBondContact O-NE2 3.08Å; D27-Q97 PolarHBondContact OD2-OE1 2.96Å; N28-Q97 PolarHBondContact OD1-N 3.21Å
98	S	85.2	Confident	92.8	Very high	54 Å²	54	30.1 Å²	30.1	38%	0.378	15%	0.147	S	C	.	.	S	Bend	trans	-141.9	169.3	176.6	61.7	0	0	0	0	111.3	N28 P100	N28-S98 WeakPolarHBondContact CB-OG 3.48Å; N28-S98 PolarHBondContact ND2-O 3.34Å; N28-S98 PolarHBondContact OD1-N 2.95Å; N28-S98 PolarHBondContact OD1-O 3.31Å; N28-S98 PolarHBondContact OD1-OG 3.13Å; S98-P100 CarbonylContact O-C 3.53Å
99	Y	82.7	Confident	92.7	Very high	127 Å²	127	32.8 Å²	32.8	50%	0.498	16%	0.164	S	C	.	.	S	Bend	trans	-85.3	142	175.5	-177.4	-87.2	0	0	0	110.9	R61 M64	R61-Y99 WeakPolarHBondContact CA-OH 3.43Å; M64-Y99 HydrophobicContact CG-CD2 4.2Å
100	P	87.2	Confident	92.6	Very high	31 Å²	31	34.3 Å²	34.3	20%	0.201	18%	0.18	C	C	.	.	S	Bend	cis	-75.4	154.2	-4.1	32.3	-35.4	0	0	0	112.2	N28 T59 S98 M102	N28-P100 PolarHBondContact ND2-O 3.46Å; T59-P100 HydrophobicContact CG2-CG 4.15Å; S98-P100 CarbonylContact O-C 3.53Å; P100-M102 HydrophobicContact CG-CE 3.8Å; P100-M102 HydrophobicContact CG-CG 4.45Å; P100-M102 WeakPolarHBondContact O-CG 3.48Å; P100-M102 PolarHBondContact O-N 2.95Å
101	I	88.9	Confident	92.5	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	134.5	164.8	-67.3	166.2	0	0	0	107.9	T59 C60 M64 R70 L74 I94 A95 V96	T59-I101 WeakPolarHBondContact CA-O 3.47Å; C60-I101 HydrophobicContact CB-CB 4.38Å; C60-I101 PolarHBondContact N-O 3.38Å; M64-I101 HydrophobicContact SD-CD1 3.77Å; M64-I101 HydrophobicContact SD-CG1 3.92Å; R70-I101 HydrophobicContact CG-CD1 3.92Å; L74-I101 HydrophobicContact CD1-CD1 4.39Å; L74-I101 HydrophobicContact CD1-CG2 4.44Å; L74-I101 HydrophobicContact CD2-CG2 3.99Å; I94-I101 HydrophobicContact CG2-CG2 4.1Å; A95-I101 WeakPolarHBondContact O-CA 3.14Å; V96-I101 HydrophobicContact CG1-CG2 4.09Å
102	M	92.7	Very high	92.6	Very high	14 Å²	14	31 Å²	31	7%	0.069	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.8	-179	-59.3	-180	-170.1	0	0	110.1	V31 L33 V57 K58 T59 I94 A95 P100	V31-M102 HydrophobicContact CB-SD 4.1Å; V31-M102 HydrophobicContact CG1-SD 3.94Å; L33-M102 HydrophobicContact CD1-CE 4Å; L33-M102 HydrophobicContact CD2-SD 4.18Å; L33-M102 HydrophobicContact CG-CE 4.3Å; L33-M102 HydrophobicContact CG-SD 4.48Å; V57-M102 HydrophobicContact CG1-CB 3.62Å; V57-M102 HydrophobicContact CG1-CG 3.97Å; V57-M102 HydrophobicContact CG1-SD 4.13Å; K58-M102 WeakPolarHBondContact O-CA 3.21Å; T59-M102 HydrophobicContact CG2-CG 4.46Å; I94-M102 CarbonylContact C-O 3.55Å; I94-M102 WeakPolarHBondContact CA-O 3.33Å; I94-M102 WeakPolarHBondContact CG2-O 3.39Å; A95-M102 HydrophobicContact CB-CB 4.06Å; A95-M102 PolarHBondContact N-O 2.94Å; A95-M102 PolarHBondContact O-N 3.13Å; P100-M102 HydrophobicContact CG-CE 3.8Å; P100-M102 HydrophobicContact CG-CG 4.45Å; P100-M102 WeakPolarHBondContact O-CG 3.48Å; P100-M102 PolarHBondContact O-N 2.95Å
103	I	93.4	Very high	92.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	116.5	168.7	-59.1	149.1	0	0	0	106.6	V57 K58 L74 E77 L91 I94 M105	V57-I103 WeakPolarHBondContact CA-O 3.36Å; K58-I103 HydrophobicContact CB-CB 4.31Å; K58-I103 HydrophobicContact CD-CD1 4.19Å; K58-I103 HydrophobicContact CG-CD1 4.44Å; K58-I103 PolarHBondContact N-O 3.48Å; K58-I103 PolarHBondContact O-N 3.42Å; L74-I103 HydrophobicContact CD2-CG1 4.46Å; E77-I103 HydrophobicContact CB-CD1 4.31Å; E77-I103 HydrophobicContact CB-CG1 4.46Å; E77-I103 HydrophobicContact CG-CD1 3.63Å; E77-I103 HydrophobicContact CG-CG1 4.31Å; L91-I103 HydrophobicContact CD2-CG2 4.17Å; L91-I103 HydrophobicContact CG-CG2 4.34Å; I94-I103 HydrophobicContact CG2-CG1 4.11Å; I103-M105 HydrophobicContact CG2-CG 4.14Å; I103-M105 HydrophobicContact CG2-SD 4.32Å
104	V	96.1	Very high	92.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	125.8	-177	-173.7	0	0	0	0	108.7	L26 V31 V55 V57 V92 G93	L26-V104 HydrophobicContact CD1-CB 3.82Å; L26-V104 HydrophobicContact CD1-CG1 4.38Å; L26-V104 HydrophobicContact CD1-CG2 3.63Å; V31-V104 HydrophobicContact CG1-CG2 4.04Å; V31-V104 HydrophobicContact CG2-CG2 3.81Å; V55-V104 HydrophobicContact CB-CG1 3.76Å; V55-V104 HydrophobicContact CG1-CG1 3.78Å; V55-V104 HydrophobicContact CG2-CG1 3.9Å; V57-V104 HydrophobicContact CG1-CG2 4.47Å; V92-V104 HydrophobicContact CB-CB 4.36Å; V92-V104 HydrophobicContact CB-CG1 4.04Å; V92-V104 HydrophobicContact CG1-CG1 4.39Å; V92-V104 PolarHBondContact N-O 3.49Å; G93-V104 PolarHBondContact N-O 3.07Å; G93-V104 PolarHBondContact O-N 2.85Å
105	M	96.8	Very high	92.9	Very high	18 Å²	18	33.3 Å²	33.3	9%	0.089	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	163.8	-175.2	-61.8	161.9	-72.3	0	0	110.2	V55 A56 K58 V89 K90 L91 I103 Y107	V55-M105 WeakPolarHBondContact CA-O 3.41Å; V55-M105 WeakPolarHBondContact CB-O 3.45Å; A56-M105 HydrophobicContact CB-CB 4.48Å; A56-M105 HydrophobicContact CB-CE 4.38Å; A56-M105 PolarHBondContact N-O 3.23Å; A56-M105 PolarHBondContact O-N 2.81Å; K58-M105 HydrophobicContact CB-CE 3.7Å; V89-M105 HydrophobicContact CG1-CB 4.03Å; V89-M105 HydrophobicContact CG1-CG 4.43Å; V89-M105 HydrophobicContact CG1-SD 4.47Å; K90-M105 CarbonylContact O-C 3.51Å; K90-M105 WeakPolarHBondContact O-CA 3.42Å; L91-M105 HydrophobicContact CD1-CG 4.05Å; L91-M105 HydrophobicContact CG-CG 3.92Å; I103-M105 HydrophobicContact CG2-CG 4.14Å; I103-M105 HydrophobicContact CG2-SD 4.32Å; M105-Y107 PolarHBondContact O-N 2.98Å
106	E	97.1	Very high	93.1	Very high	48 Å²	48	35.9 Å²	35.9	22%	0.224	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	140.7	165.3	67.1	173.2	130.6	0	0	110.6	V89 K90 V108 K167	V89-E106 HydrophobicContact CG1-CG 3.89Å; K90-E106 HydrophobicContact CB-CB 4.37Å; K90-E106 HydrophobicContact CB-CG 4.06Å; K90-E106 WeakPolarHBondContact CB-OE1 3.37Å; K90-E106 PolarHBondContact N-OE1 3.34Å; K90-E106 PolarHBondContact O-N 3.28Å; E106-V108 HydrophobicContact CG-CG2 4.09Å; E106-K167 IonicContact OE1-NZ 2.92Å; E106-K167 PolarHBondContact OE1-NZ 2.79Å; E106-K167 IonicContact OE2-NZ 3.88Å; E106-K167 PolarHBondContact OE2-NZ 3.18Å
107	Y	97.6	Very high	93.6	Very high	63 Å²	63	35.3 Å²	35.3	25%	0.247	20%	0.195	C	C	.	.			trans	-83.1	124	171.8	-179.8	-110.1	0	0	0	110	I37 R47 E54 A56 M105 P109	I37-Y107 HydrophobicContact CD1-CD2 4.14Å; I37-Y107 HydrophobicContact CD1-CE2 3.73Å; R47-Y107 HydrophobicContact CB-CE2 4.45Å; R47-Y107 HydrophobicContact CG-CD2 4.39Å; R47-Y107 HydrophobicContact CG-CE2 4.21Å; E54-Y107 HydrophobicContact CG-CD1 4.03Å; E54-Y107 HydrophobicContact CG-CG 4.15Å; E54-Y107 WeakPolarHBondContact OE1-CD1 3.28Å; E54-Y107 WeakPolarHBondContact OE1-CE1 3.42Å; A56-Y107 HydrophobicContact CB-CD2 4.31Å; M105-Y107 PolarHBondContact O-N 2.98Å; Y107-P109 HydrophobicContact CD1-CB 4.33Å; Y107-P109 HydrophobicContact CE1-CB 3.75Å
108	V	97.3	Very high	94.2	Very high	8 Å²	8	37.2 Å²	37.2	5%	0.048	20%	0.199	C	C	.	.			trans	-109.2	104.9	177.7	-173.8	0	0	0	0	109.1	V89 E106 G110 G111 L159 I160 K167	V89-V108 HydrophobicContact CG2-CG2 4.27Å; E106-V108 HydrophobicContact CG-CG2 4.09Å; V108-G110 PolarHBondContact O-N 3.2Å; V108-G111 PolarHBondContact O-N 3.45Å; V108-L159 HydrophobicContact CB-CB 3.93Å; V108-L159 HydrophobicContact CB-CD1 3.78Å; V108-L159 HydrophobicContact CG1-CB 3.74Å; V108-L159 HydrophobicContact CG2-CB 4.34Å; V108-L159 HydrophobicContact CG2-CD1 3.86Å; V108-I160 VanDerWaalsContact CG1-C 3.44Å; V108-I160 VanDerWaalsContact CG1-O 3.28Å; V108-I160 WeakPolarHBondContact CG1-O 3.39Å; V108-K167 HydrophobicContact CG2-CD 4.22Å
109	P	94.6	Very high	94.7	Very high	59 Å²	59	42.7 Å²	42.7	38%	0.383	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.4	-161.5	25	-34.5	0	0	0	114.9	Y107 G111 D162	Y107-P109 HydrophobicContact CD1-CB 4.33Å; Y107-P109 HydrophobicContact CE1-CB 3.75Å; P109-G111 PolarHBondContact O-N 3.4Å; P109-D162 WeakPolarHBondContact CD-OD1 3.1Å; P109-D162 HydrophobicContact CG-CB 3.94Å; P109-D162 VanDerWaalsContact CG-CG 3.47Å; P109-D162 WeakPolarHBondContact CG-OD1 3.22Å
110	G	95.4	Very high	95.2	Very high	34 Å²	34	37.7 Å²	37.7	35%	0.351	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.4	176.7	0	0	0	0	0	113.6	V108 I160	V108-G110 PolarHBondContact O-N 3.2Å; G110-I160 CarbonylContact C-O 3.44Å; G110-I160 WeakPolarHBondContact CA-O 3.36Å; G110-I160 PolarHBondContact N-O 3.04Å
111	G	95.3	Very high	95.3	Very high	28 Å²	28	44.9 Å²	44.9	29%	0.289	23%	0.228	S	C	.	.			trans	67.3	-157.6	178.3	0	0	0	0	0	112.4	V108 P109 L159 I160	V108-G111 PolarHBondContact O-N 3.45Å; P109-G111 PolarHBondContact O-N 3.4Å; G111-L159 CarbonylContact O-C 3.51Å; G111-L159 WeakPolarHBondContact O-CA 3.41Å; G111-I160 PolarHBondContact O-N 3.3Å
112	S	96.2	Very high	95.2	Very high	23 Å²	23	50 Å²	50	16%	0.161	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-68.4	139.8	-175	67.6	0	0	0	0	113.1	L114 N115 H116 C158	S112-L114 VanDerWaalsContact C-N 3.25Å; S112-L114 PolarHBondContact O-N 3.49Å; S112-N115 PolarHBondContact O-N 3.21Å; S112-N115 VanDerWaalsContact O-N 3.1Å; S112-N115 WeakPolarHBondContact OG-CB 3.11Å; S112-N115 PolarHBondContact OG-ND2 3.16Å; S112-N115 VanDerWaalsContact OG-ND2 3.16Å; S112-H116 PolarHBondContact O-N 3.2Å; S112-C158 CarbonylContact C-O 3.4Å; S112-C158 VanDerWaalsContact CA-O 3.3Å; S112-C158 WeakPolarHBondContact CA-O 3.44Å
113	L	98	Very high	95.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-55.6	-42.1	175.8	172.6	71.6	0	0	0	110.9	N115 H116 L117 M132 A155 C158 I160 L166 L216 I220	L113-N115 VanDerWaalsContact C-N 3.29Å; L113-N115 PolarHBondContact O-N 3.49Å; L113-H116 WeakPolarHBondContact O-CB 3.45Å; L113-H116 PolarHBondContact O-N 2.84Å; L113-H116 VanDerWaalsContact O-N 3.12Å; L113-L117 HydrophobicContact CD1-CD1 4Å; L113-L117 HydrophobicContact CD1-CD2 4.25Å; L113-L117 HydrophobicContact CD1-CG 3.84Å; L113-L117 HydrophobicContact CD2-CD1 4.26Å; L113-L117 HydrophobicContact CG-CD1 3.74Å; L113-L117 HydrophobicContact CG-CG 4.05Å; L113-L117 WeakPolarHBondContact O-CB 3.22Å; L113-L117 VanDerWaalsContact O-CG 3.29Å; L113-L117 WeakPolarHBondContact O-CG 3.13Å; L113-L117 PolarHBondContact O-N 3.14Å; L113-M132 HydrophobicContact CD1-CG 4.45Å; L113-M132 HydrophobicContact CD1-SD 3.66Å; L113-A155 WeakPolarHBondContact CB-O 3.46Å; L113-A155 HydrophobicContact CD2-CB 3.97Å; L113-A155 HydrophobicContact CG-CB 4.28Å; L113-C158 HydrophobicContact CB-CB 3.85Å; L113-C158 HydrophobicContact CD2-CB 3.96Å; L113-C158 PolarHBondContact N-O 2.93Å; L113-I160 HydrophobicContact CB-CG1 4.17Å; L113-I160 HydrophobicContact CD1-CD1 3.69Å; L113-I160 HydrophobicContact CD1-CG1 3.71Å; L113-L166 HydrophobicContact CD1-CD1 4.33Å; L113-L166 HydrophobicContact CD2-CD1 3.53Å; L113-L166 HydrophobicContact CG-CD1 4.41Å; L113-L216 HydrophobicContact CD2-CD1 3.93Å; L113-I220 HydrophobicContact CD2-CD1 4.32Å; L113-I220 HydrophobicContact CD2-CG1 3.97Å
114	L	97.4	Very high	95.2	Very high	24 Å²	24	55 Å²	55	13%	0.126	29%	0.294	C	S	.	.	H	α-helix	trans	-54.7	-45.5	177.4	-177.9	60	0	0	0	112.4	S112 R118 A155 R156	S112-L114 VanDerWaalsContact C-N 3.25Å; S112-L114 PolarHBondContact O-N 3.49Å; L114-R118 WeakPolarHBondContact O-CG 3.4Å; L114-R118 PolarHBondContact O-N 3.43Å; L114-A155 HydrophobicContact CB-CB 4.07Å; L114-A155 HydrophobicContact CD1-CB 4.4Å; L114-A155 PolarHBondContact N-O 3.46Å; L114-R156 HydrophobicContact CB-CB 4.49Å; L114-R156 HydrophobicContact CD2-CB 4.05Å
115	N	96.1	Very high	95.1	Very high	82 Å²	82	58.7 Å²	58.7	44%	0.439	32%	0.318	S	S	.	.	H	α-helix	trans	-71.2	-39.1	178	-74.8	-21.6	0	0	0	111.4	S112 L113 R118 K119	S112-N115 PolarHBondContact O-N 3.21Å; S112-N115 VanDerWaalsContact O-N 3.1Å; S112-N115 WeakPolarHBondContact OG-CB 3.11Å; S112-N115 PolarHBondContact OG-ND2 3.16Å; S112-N115 VanDerWaalsContact OG-ND2 3.16Å; L113-N115 VanDerWaalsContact C-N 3.29Å; L113-N115 PolarHBondContact O-N 3.49Å; N115-R118 PolarHBondContact O-N 2.65Å; N115-K119 VanDerWaalsContact O-CB 3.29Å; N115-K119 WeakPolarHBondContact O-CB 3.39Å; N115-K119 WeakPolarHBondContact O-CG 3.26Å; N115-K119 PolarHBondContact O-N 2.95Å
116	H	96.8	Very high	95	Very high	54 Å²	54	59.4 Å²	59.4	25%	0.25	32%	0.323	C	S	.	.	H	α-helix	trans	-58.6	-50.9	176.1	-178.8	86.4	0	0	0	111.7	S112 L113 R118 K119 S120 I160	S112-H116 PolarHBondContact O-N 3.2Å; L113-H116 WeakPolarHBondContact O-CB 3.45Å; L113-H116 PolarHBondContact O-N 2.84Å; L113-H116 VanDerWaalsContact O-N 3.12Å; H116-R118 PolarHBondContact O-N 2.82Å; H116-K119 PolarHBondContact O-N 3.31Å; H116-S120 PolarHBondContact O-N 3.02Å; H116-I160 HydrophobicContact CB-CG1 4.31Å
117	L	97.2	Very high	94.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-57.5	-49.9	178.3	-71.1	170.4	0	0	0	111.5	L113 K119 S120 L124 L129 M132 I220 F223	L113-L117 HydrophobicContact CD1-CD1 4Å; L113-L117 HydrophobicContact CD1-CD2 4.25Å; L113-L117 HydrophobicContact CD1-CG 3.84Å; L113-L117 HydrophobicContact CD2-CD1 4.26Å; L113-L117 HydrophobicContact CG-CD1 3.74Å; L113-L117 HydrophobicContact CG-CG 4.05Å; L113-L117 WeakPolarHBondContact O-CB 3.22Å; L113-L117 VanDerWaalsContact O-CG 3.29Å; L113-L117 WeakPolarHBondContact O-CG 3.13Å; L113-L117 PolarHBondContact O-N 3.14Å; L117-K119 PolarHBondContact O-N 3.1Å; L117-S120 WeakPolarHBondContact O-CB 3.45Å; L117-S120 PolarHBondContact O-N 2.79Å; L117-S120 PolarHBondContact O-OG 3.49Å; L117-L124 HydrophobicContact CD2-CD1 4.09Å; L117-L129 HydrophobicContact CD2-CD2 4.02Å; L117-M132 HydrophobicContact CD2-SD 4.34Å; L117-I220 HydrophobicContact CD1-CG1 4.39Å; L117-F223 CarbonylContact C-O 3.47Å
118	R	97.3	Very high	94.7	Very high	112 Å²	112	63.4 Å²	63.4	42%	0.423	34%	0.343	S	S	.	.	H	α-helix	trans	-64	-39.9	179.3	-71.5	175	176.5	172.1	1.4	112.9	L114 N115 H116 S120 K121 F223 G224	L114-R118 WeakPolarHBondContact O-CG 3.4Å; L114-R118 PolarHBondContact O-N 3.43Å; N115-R118 PolarHBondContact O-N 2.65Å; H116-R118 PolarHBondContact O-N 2.82Å; R118-S120 VanDerWaalsContact C-N 3.25Å; R118-S120 PolarHBondContact O-N 3.1Å; R118-K121 PolarHBondContact O-N 3.18Å; R118-F223 PolarHBondContact N-O 3.12Å; R118-G224 VanDerWaalsContact CZ-O 3.27Å; R118-G224 PolarHBondContact NE-O 2.77Å; R118-G224 PolarHBondContact NH2-O 2.65Å
119	K	95.7	Very high	94.7	Very high	169 Å²	169	63 Å²	63	74%	0.735	34%	0.341	S	S	*	.	H	α-helix	trans	-65.9	-29.1	177.2	-77.4	176	-179.2	-179.3	0	112.4	N115 H116 L117 K121	N115-K119 VanDerWaalsContact O-CB 3.29Å; N115-K119 WeakPolarHBondContact O-CB 3.39Å; N115-K119 WeakPolarHBondContact O-CG 3.26Å; N115-K119 PolarHBondContact O-N 2.95Å; H116-K119 PolarHBondContact O-N 3.31Å; L117-K119 PolarHBondContact O-N 3.1Å; K119-K121 PolarHBondContact O-N 3.31Å
120	S	92.3	Very high	94.7	Very high	23 Å²	23	61 Å²	61	16%	0.161	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.2	179.3	79.8	0	0	0	0	114.3	H116 L117 R118 N122 A123	H116-S120 PolarHBondContact O-N 3.02Å; L117-S120 WeakPolarHBondContact O-CB 3.45Å; L117-S120 PolarHBondContact O-N 2.79Å; L117-S120 PolarHBondContact O-OG 3.49Å; R118-S120 VanDerWaalsContact C-N 3.25Å; R118-S120 PolarHBondContact O-N 3.1Å; S120-N122 VanDerWaalsContact C-N 3.27Å; S120-N122 PolarHBondContact O-N 2.74Å; S120-A123 WeakPolarHBondContact O-CB 3.1Å; S120-A123 PolarHBondContact O-N 3.21Å
121	K	88.5	Confident	94.8	Very high	182 Å²	182	63.5 Å²	63.5	79%	0.791	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	46.3	178.9	-60.7	-177.3	-178.8	-179.8	0	113.2	R118 K119 A123	R118-K121 PolarHBondContact O-N 3.18Å; K119-K121 PolarHBondContact O-N 3.31Å; K121-A123 PolarHBondContact O-N 3.02Å
122	N	87.9	Confident	94.9	Very high	109 Å²	109	62.5 Å²	62.5	58%	0.583	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	21.6	180	-50.9	-15.1	0	0	0	114.8	S120 F223	S120-N122 VanDerWaalsContact C-N 3.27Å; S120-N122 PolarHBondContact O-N 2.74Å; N122-F223 HydrophobicContact CB-CD1 4.48Å; N122-F223 HydrophobicContact CB-CD2 3.82Å; N122-F223 HydrophobicContact CB-CE1 4.4Å; N122-F223 HydrophobicContact CB-CE2 3.72Å; N122-F223 HydrophobicContact CB-CG 4.19Å; N122-F223 HydrophobicContact CB-CZ 4.03Å; N122-F223 WeakPolarHBondContact OD1-CB 3.44Å; N122-F223 WeakPolarHBondContact OD1-CD2 3.35Å; N122-F223 WeakPolarHBondContact OD1-CG 3.36Å
123	A	91.8	Very high	95	Very high	82 Å²	82	61.4 Å²	61.4	68%	0.678	31%	0.31	S	S	*	.			trans	-93.9	-5.4	-176.6	0	0	0	0	0	114.4	S120 K121	S120-A123 WeakPolarHBondContact O-CB 3.1Å; S120-A123 PolarHBondContact O-N 3.21Å; K121-A123 PolarHBondContact O-N 3.02Å
124	L	94.3	Very high	95	Very high	38 Å²	38	62.4 Å²	62.4	20%	0.199	32%	0.315	C	S	.	.	S	Bend	trans	-72.4	133.6	178.6	-62.5	168.4	0	0	0	110.6	L117 L129 M132 F223	L117-L124 HydrophobicContact CD2-CD1 4.09Å; L124-L129 HydrophobicContact CB-CD2 4.1Å; L124-L129 HydrophobicContact CD1-CD2 4.14Å; L124-M132 HydrophobicContact CD1-CE 4.05Å; L124-F223 HydrophobicContact CB-CE1 4.03Å
125	P	94.4	Very high	95	Very high	76 Å²	76	61.6 Å²	61.6	49%	0.494	31%	0.311	S	S	.	.			trans	-67.3	149.7	175.1	28.6	-34.2	0	0	0	110.6	M127 K128 L129	P125-M127 PolarHBondContact O-N 3.36Å; P125-M127 VanDerWaalsContact O-N 3.08Å; P125-K128 HydrophobicContact CG-CB 4.09Å; P125-K128 HydrophobicContact CG-CG 3.73Å; P125-K128 WeakPolarHBondContact O-CB 3.47Å; P125-K128 PolarHBondContact O-N 3.32Å; P125-L129 PolarHBondContact O-N 2.86Å
126	V	94.2	Very high	95.1	Very high	33 Å²	33	57.7 Å²	57.7	20%	0.2	29%	0.29	C	S	.	.	H	α-helix	trans	-51.6	-37.3	179.2	173.8	0	0	0	0	112.1	K128 L129 L130 F221 P253	V126-K128 VanDerWaalsContact C-N 3.29Å; V126-K128 PolarHBondContact O-N 3.15Å; V126-L129 WeakPolarHBondContact O-CB 3.29Å; V126-L129 PolarHBondContact O-N 3.08Å; V126-L129 VanDerWaalsContact O-N 3.15Å; V126-L130 HydrophobicContact CG1-CD1 4.02Å; V126-L130 HydrophobicContact CG1-CG 4.24Å; V126-L130 WeakPolarHBondContact O-CG 3.49Å; V126-L130 PolarHBondContact O-N 3.5Å; V126-F221 HydrophobicContact CG1-CE1 4.33Å; V126-P253 HydrophobicContact CG1-CG 4.29Å
127	M	93.4	Very high	95.2	Very high	96 Å²	96	55.1 Å²	55.1	47%	0.473	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-34.7	176.9	-69.5	-53.6	-57.5	0	0	113.5	P125 L130 Q131 V286	P125-M127 PolarHBondContact O-N 3.36Å; P125-M127 VanDerWaalsContact O-N 3.08Å; M127-L130 HydrophobicContact SD-CD1 4.09Å; M127-Q131 PolarHBondContact O-N 3.47Å; M127-V286 HydrophobicContact CE-CG2 3.94Å
128	K	94.9	Very high	95.3	Very high	99 Å²	99	56.2 Å²	56.2	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-73	-37.8	175.3	-74.4	-70.3	-175	178.3	0	111.6	P125 V126 L130 Q131 M132	P125-K128 HydrophobicContact CG-CB 4.09Å; P125-K128 HydrophobicContact CG-CG 3.73Å; P125-K128 WeakPolarHBondContact O-CB 3.47Å; P125-K128 PolarHBondContact O-N 3.32Å; V126-K128 VanDerWaalsContact C-N 3.29Å; V126-K128 PolarHBondContact O-N 3.15Å; K128-L130 VanDerWaalsContact C-N 3.33Å; K128-Q131 PolarHBondContact O-N 2.83Å; K128-M132 WeakPolarHBondContact O-CG 3.35Å; K128-M132 PolarHBondContact O-N 3.15Å
129	L	96.1	Very high	95.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-40.8	174	-58.9	-178.1	0	0	0	111.8	L117 L124 P125 V126 M132 S133 I220 F221 F223	L117-L129 HydrophobicContact CD2-CD2 4.02Å; L124-L129 HydrophobicContact CB-CD2 4.1Å; L124-L129 HydrophobicContact CD1-CD2 4.14Å; P125-L129 PolarHBondContact O-N 2.86Å; V126-L129 WeakPolarHBondContact O-CB 3.29Å; V126-L129 PolarHBondContact O-N 3.08Å; V126-L129 VanDerWaalsContact O-N 3.15Å; L129-M132 PolarHBondContact O-N 3.4Å; L129-S133 WeakPolarHBondContact O-CB 3.43Å; L129-S133 PolarHBondContact O-N 2.89Å; L129-S133 PolarHBondContact O-OG 2.76Å; L129-I220 HydrophobicContact CB-CG2 3.83Å; L129-I220 HydrophobicContact CD2-CG2 3.9Å; L129-I220 HydrophobicContact CG-CG2 4.4Å; L129-F221 HydrophobicContact CB-CE1 4.17Å; L129-F221 HydrophobicContact CB-CE2 4.13Å; L129-F221 HydrophobicContact CB-CZ 3.9Å; L129-F221 HydrophobicContact CD1-CD1 4.1Å; L129-F221 HydrophobicContact CD1-CE1 4.24Å; L129-F223 HydrophobicContact CD1-CE1 4.15Å; L129-F223 HydrophobicContact CD1-CZ 3.96Å; L129-F223 HydrophobicContact CD2-CE1 4.12Å
130	L	96.2	Very high	95.5	Very high	17 Å²	17	42.8 Å²	42.8	9%	0.089	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-43.4	173.2	-73.2	172.8	0	0	0	112	V126 M127 K128 M132 S133 L134 F221 W255 L256	V126-L130 HydrophobicContact CG1-CD1 4.02Å; V126-L130 HydrophobicContact CG1-CG 4.24Å; V126-L130 WeakPolarHBondContact O-CG 3.49Å; V126-L130 PolarHBondContact O-N 3.5Å; M127-L130 HydrophobicContact SD-CD1 4.09Å; K128-L130 VanDerWaalsContact C-N 3.33Å; L130-M132 PolarHBondContact O-N 3Å; L130-S133 WeakPolarHBondContact O-CB 3.3Å; L130-S133 PolarHBondContact O-N 3.32Å; L130-S133 VanDerWaalsContact O-N 3.17Å; L130-L134 PolarHBondContact O-N 3.25Å; L130-F221 HydrophobicContact CD2-CZ 3.94Å; L130-F221 HydrophobicContact CG-CZ 4.22Å; L130-W255 HydrophobicContact CD2-CH2 3.87Å; L130-W255 HydrophobicContact CD2-CZ2 3.64Å; L130-L256 HydrophobicContact CD2-CD2 3.74Å
131	Q	96.5	Very high	95.8	Very high	87 Å²	87	44.4 Å²	44.4	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-60	-46.5	176.2	-173.5	62.5	54.8	0	0	111.8	M127 K128 S133 L134 D135	M127-Q131 PolarHBondContact O-N 3.47Å; K128-Q131 PolarHBondContact O-N 2.83Å; Q131-S133 PolarHBondContact O-N 3.32Å; Q131-L134 WeakPolarHBondContact O-CB 3.45Å; Q131-L134 PolarHBondContact O-N 2.66Å; Q131-D135 PolarHBondContact NE2-OD1 3Å; Q131-D135 WeakPolarHBondContact O-CB 3.43Å; Q131-D135 VanDerWaalsContact O-CG 3.25Å; Q131-D135 PolarHBondContact O-N 3.45Å
132	M	97.6	Very high	96.2	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.03	20%	0.201	C	C	.	.	H	α-helix	trans	-59.9	-38.3	176.2	-67.2	170	-175.8	0	0	111.5	L113 L117 L124 K128 L129 L130 A136 I160 L166 I220	L113-M132 HydrophobicContact CD1-CG 4.45Å; L113-M132 HydrophobicContact CD1-SD 3.66Å; L117-M132 HydrophobicContact CD2-SD 4.34Å; L124-M132 HydrophobicContact CD1-CE 4.05Å; K128-M132 WeakPolarHBondContact O-CG 3.35Å; K128-M132 PolarHBondContact O-N 3.15Å; L129-M132 PolarHBondContact O-N 3.4Å; L130-M132 PolarHBondContact O-N 3Å; M132-A136 PolarHBondContact O-N 3.28Å; M132-I160 HydrophobicContact CE-CD1 4.24Å; M132-I160 HydrophobicContact CG-CD1 4.2Å; M132-I160 HydrophobicContact SD-CD1 4.41Å; M132-L166 HydrophobicContact CB-CD1 4.14Å; M132-L166 WeakPolarHBondContact O-CD1 3.23Å; M132-I220 HydrophobicContact CB-CD1 4.35Å
133	S	97.8	Very high	96.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.1	-41.6	177.5	-58.4	0	0	0	0	111.7	L129 L130 Q131 A137 Y213 L217	L129-S133 WeakPolarHBondContact O-CB 3.43Å; L129-S133 PolarHBondContact O-N 2.89Å; L129-S133 PolarHBondContact O-OG 2.76Å; L130-S133 WeakPolarHBondContact O-CB 3.3Å; L130-S133 PolarHBondContact O-N 3.32Å; L130-S133 VanDerWaalsContact O-N 3.17Å; Q131-S133 PolarHBondContact O-N 3.32Å; S133-A137 PolarHBondContact O-N 2.9Å; S133-Y213 PolarHBondContact O-OH 3.07Å; S133-L217 WeakPolarHBondContact OG-CD2 3.34Å
134	L	97.9	Very high	96.9	Very high	22 Å²	22	29.7 Å²	29.7	12%	0.115	15%	0.15	C	C	.	.	H	α-helix	trans	-64.9	-46.8	175.4	-179.6	55.3	0	0	0	111.8	L130 Q131 A136 A137 N138 I281 Q282	L130-L134 PolarHBondContact O-N 3.25Å; Q131-L134 WeakPolarHBondContact O-CB 3.45Å; Q131-L134 PolarHBondContact O-N 2.66Å; L134-A136 VanDerWaalsContact C-N 3.31Å; L134-A136 PolarHBondContact O-N 3.18Å; L134-A137 WeakPolarHBondContact O-CB 3.41Å; L134-A137 PolarHBondContact O-N 3.17Å; L134-A137 VanDerWaalsContact O-N 3.09Å; L134-N138 VanDerWaalsContact O-CG 3.29Å; L134-N138 PolarHBondContact O-N 3.06Å; L134-N138 PolarHBondContact O-ND2 3.05Å; L134-I281 HydrophobicContact CB-CG2 3.67Å; L134-I281 HydrophobicContact CD1-CB 4.09Å; L134-I281 HydrophobicContact CD1-CG2 3.99Å; L134-I281 HydrophobicContact CG-CG2 4.28Å; L134-Q282 HydrophobicContact CD1-CB 3.94Å; L134-Q282 HydrophobicContact CD1-CG 4.32Å; L134-Q282 HydrophobicContact CD2-CG 4.39Å
135	D	98.3	Very high	97	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-56.4	-46.3	177.6	-75.1	-2.7	0	0	0	111.2	N87 Q131 A137 N138 G139 Q165 L166	N87-D135 WeakPolarHBondContact CB-O 3.21Å; N87-D135 VanDerWaalsContact CG-O 3.24Å; N87-D135 WeakPolarHBondContact ND2-CB 3.13Å; N87-D135 VanDerWaalsContact ND2-CG 3.31Å; Q131-D135 PolarHBondContact NE2-OD1 3Å; Q131-D135 WeakPolarHBondContact O-CB 3.43Å; Q131-D135 VanDerWaalsContact O-CG 3.25Å; Q131-D135 PolarHBondContact O-N 3.45Å; D135-A137 PolarHBondContact O-N 3.48Å; D135-N138 PolarHBondContact O-N 2.86Å; D135-G139 PolarHBondContact O-N 3.48Å; D135-Q165 WeakPolarHBondContact OD2-CA 3.23Å; D135-L166 HydrophobicContact CB-CB 3.7Å; D135-L166 PolarHBondContact OD2-N 3.24Å
136	A	98.7	Very high	97	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-40.4	175.1	0	0	0	0	0	112.2	M132 L134 G139 M140 L166 Y213 L216	M132-A136 PolarHBondContact O-N 3.28Å; L134-A136 VanDerWaalsContact C-N 3.31Å; L134-A136 PolarHBondContact O-N 3.18Å; A136-G139 PolarHBondContact O-N 3.41Å; A136-M140 WeakPolarHBondContact O-CG 3.36Å; A136-M140 PolarHBondContact O-N 2.88Å; A136-L166 HydrophobicContact CB-CD1 4.17Å; A136-L166 HydrophobicContact CB-CD2 3.81Å; A136-Y213 HydrophobicContact CB-CD2 4.44Å; A136-Y213 HydrophobicContact CB-CE2 3.88Å; A136-L216 HydrophobicContact CB-CD2 3.71Å
137	A	98.6	Very high	97	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.8	-41.6	176.2	0	0	0	0	0	111.9	S133 L134 D135 M140 M141 Y213 I277 I281	S133-A137 PolarHBondContact O-N 2.9Å; L134-A137 WeakPolarHBondContact O-CB 3.41Å; L134-A137 PolarHBondContact O-N 3.17Å; L134-A137 VanDerWaalsContact O-N 3.09Å; D135-A137 PolarHBondContact O-N 3.48Å; A137-M140 PolarHBondContact O-N 3.05Å; A137-M141 VanDerWaalsContact O-CB 3.29Å; A137-M141 WeakPolarHBondContact O-CB 3.5Å; A137-M141 PolarHBondContact O-N 2.78Å; A137-Y213 HydrophobicContact CB-CE2 4.02Å; A137-I277 HydrophobicContact CB-CG2 3.76Å; A137-I281 HydrophobicContact CB-CD1 4.31Å
138	N	98.4	Very high	97.1	Very high	22 Å²	22	29.8 Å²	29.8	12%	0.118	15%	0.151	C	C	.	.	H	α-helix	trans	-64.5	-43.5	177.6	-69.8	-19.5	0	0	0	111.5	N87 L134 D135 M141 Y142 S278	N87-N138 WeakPolarHBondContact OD1-CB 3.16Å; L134-N138 VanDerWaalsContact O-CG 3.29Å; L134-N138 PolarHBondContact O-N 3.06Å; L134-N138 PolarHBondContact O-ND2 3.05Å; D135-N138 PolarHBondContact O-N 2.86Å; N138-M141 PolarHBondContact O-N 3.12Å; N138-Y142 PolarHBondContact O-N 2.97Å; N138-S278 PolarHBondContact OD1-OG 3.5Å
139	G	98.5	Very high	97.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.7	-48.1	172.9	0	0	0	0	0	111.9	D135 A136 M141 Y142 L143	D135-G139 PolarHBondContact O-N 3.48Å; A136-G139 PolarHBondContact O-N 3.41Å; G139-M141 PolarHBondContact O-N 3.5Å; G139-Y142 WeakPolarHBondContact O-CB 3.44Å; G139-Y142 PolarHBondContact O-N 3.08Å; G139-L143 WeakPolarHBondContact O-CG 3.32Å; G139-L143 PolarHBondContact O-N 3.07Å; G139-L143 VanDerWaalsContact O-N 3.1Å
140	M	98.6	Very high	97	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-69.6	-32.2	179.4	-70.2	-54.6	-51	0	0	113.7	A136 A137 Y142 L143 E144 H150 L153 I168 I206 D209 F274	A136-M140 WeakPolarHBondContact O-CG 3.36Å; A136-M140 PolarHBondContact O-N 2.88Å; A137-M140 PolarHBondContact O-N 3.05Å; M140-Y142 VanDerWaalsContact C-N 3.31Å; M140-L143 HydrophobicContact CE-CD1 4.17Å; M140-L143 PolarHBondContact O-N 2.85Å; M140-L143 HydrophobicContact SD-CD1 3.8Å; M140-E144 WeakPolarHBondContact O-CB 3.38Å; M140-E144 PolarHBondContact O-N 3.23Å; M140-H150 HydrophobicContact CE-CB 4.13Å; M140-H150 HydrophobicContact SD-CB 4.4Å; M140-L153 HydrophobicContact CE-CD2 4.47Å; M140-L153 HydrophobicContact CG-CD1 4.38Å; M140-L153 HydrophobicContact CG-CD2 3.73Å; M140-L153 HydrophobicContact SD-CD1 3.93Å; M140-L153 HydrophobicContact SD-CD2 3.77Å; M140-L153 HydrophobicContact SD-CG 4.33Å; M140-I168 HydrophobicContact CG-CD1 3.65Å; M140-I168 HydrophobicContact SD-CD1 3.6Å; M140-I168 VanDerWaalsContact SD-CD1 3.6Å; M140-I206 HydrophobicContact CE-CD1 4.27Å; M140-D209 HydrophobicContact CE-CB 3.55Å; M140-F274 HydrophobicContact CB-CB 4.36Å; M140-F274 HydrophobicContact CB-CD1 3.33Å; M140-F274 HydrophobicContact CB-CD2 3.75Å; M140-F274 HydrophobicContact CB-CE1 3.3Å; M140-F274 HydrophobicContact CB-CE2 3.72Å; M140-F274 HydrophobicContact CB-CG 3.55Å; M140-F274 HydrophobicContact CB-CZ 3.5Å; M140-F274 VanDerWaalsContact CB-CZ 3.5Å; M140-F274 HydrophobicContact CE-CD2 4.41Å; M140-F274 HydrophobicContact CE-CE2 3.6Å; M140-F274 HydrophobicContact CE-CZ 3.72Å; M140-F274 HydrophobicContact CG-CD1 4.22Å; M140-F274 HydrophobicContact CG-CE1 3.7Å; M140-F274 HydrophobicContact CG-CE2 4.29Å; M140-F274 HydrophobicContact CG-CZ 3.72Å
141	M	98.2	Very high	96.9	Very high	57 Å²	57	24.8 Å²	24.8	28%	0.281	13%	0.128	S	C	.	.	H	α-helix	trans	-62.3	-40.8	171.6	179.3	178.8	62.3	0	0	111	A137 N138 G139 L143 E144 A145 F274	A137-M141 VanDerWaalsContact O-CB 3.29Å; A137-M141 WeakPolarHBondContact O-CB 3.5Å; A137-M141 PolarHBondContact O-N 2.78Å; N138-M141 PolarHBondContact O-N 3.12Å; G139-M141 PolarHBondContact O-N 3.5Å; M141-L143 VanDerWaalsContact C-N 3.34Å; M141-E144 PolarHBondContact O-N 2.79Å; M141-A145 PolarHBondContact O-N 3.38Å; M141-F274 HydrophobicContact CB-CB 3.93Å
142	Y	98.3	Very high	96.8	Very high	23 Å²	23	20.9 Å²	20.9	9%	0.09	11%	0.111	C	C	.	.	H	α-helix	trans	-62.5	-40.1	174.6	173.7	-88.7	0	0	0	112.6	F83 N84 H85 I88 N138 G139 M140 R146	F83-Y142 WeakPolarHBondContact CA-OH 3.5Å; F83-Y142 HydrophobicContact CB-CE1 3.96Å; F83-Y142 HydrophobicContact CD1-CE1 4.08Å; F83-Y142 HydrophobicContact CG-CE1 4.04Å; N84-Y142 PolarHBondContact N-OH 3.48Å; N84-Y142 WeakPolarHBondContact O-CE2 3.41Å; N84-Y142 PolarHBondContact O-OH 3.06Å; H85-Y142 HydrophobicContact CB-CD1 3.91Å; H85-Y142 HydrophobicContact CB-CD2 3.67Å; H85-Y142 HydrophobicContact CB-CE1 4.03Å; H85-Y142 HydrophobicContact CB-CE2 3.73Å; H85-Y142 HydrophobicContact CB-CG 3.73Å; H85-Y142 AromaticContact CD2-CD2 3.45Å; H85-Y142 VanDerWaalsContact CD2-CD2 3.45Å; H85-Y142 WeakPolarHBondContact CD2-CD2 3.48Å; H85-Y142 AromaticContact CD2-CG 3.77Å; H85-Y142 AromaticContact CG-CD2 3.73Å; H85-Y142 AromaticContact CG-CG 3.72Å; I88-Y142 HydrophobicContact CG1-CD1 3.94Å; I88-Y142 HydrophobicContact CG1-CE1 4.4Å; N138-Y142 PolarHBondContact O-N 2.97Å; G139-Y142 WeakPolarHBondContact O-CB 3.44Å; G139-Y142 PolarHBondContact O-N 3.08Å; M140-Y142 VanDerWaalsContact C-N 3.31Å; Y142-R146 VanDerWaalsContact CD2-NH1 3.27Å; Y142-R146 VanDerWaalsContact CZ-NH1 3.3Å; Y142-R146 PolarHBondContact OH-NE 3.36Å; Y142-R146 PolarHBondContact OH-NH2 3.33Å; Y142-R146 VanDerWaalsContact OH-NH2 3.13Å
143	L	97	Very high	96.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-70	-41.3	176.2	-64	177.9	0	0	0	112.1	F83 I88 G139 M140 M141 A145 R146 N147 C148 H150 F171	F83-L143 HydrophobicContact CD2-CD2 3.76Å; F83-L143 HydrophobicContact CE2-CD2 3.42Å; F83-L143 VanDerWaalsContact CE2-CD2 3.42Å; F83-L143 HydrophobicContact CG-CD2 4.44Å; F83-L143 HydrophobicContact CZ-CD2 3.84Å; I88-L143 HydrophobicContact CD1-CD1 4.02Å; I88-L143 HydrophobicContact CD1-CD2 4.11Å; I88-L143 HydrophobicContact CD1-CG 3.93Å; G139-L143 WeakPolarHBondContact O-CG 3.32Å; G139-L143 PolarHBondContact O-N 3.07Å; G139-L143 VanDerWaalsContact O-N 3.1Å; M140-L143 HydrophobicContact CE-CD1 4.17Å; M140-L143 PolarHBondContact O-N 2.85Å; M140-L143 HydrophobicContact SD-CD1 3.8Å; M141-L143 VanDerWaalsContact C-N 3.34Å; L143-A145 VanDerWaalsContact C-N 3.31Å; L143-A145 PolarHBondContact O-N 3.39Å; L143-R146 CarbonylContact O-C 3.52Å; L143-R146 WeakPolarHBondContact O-CA 3.44Å; L143-R146 PolarHBondContact O-N 3.49Å; L143-N147 PolarHBondContact O-N 2.97Å; L143-C148 HydrophobicContact CB-CB 4.15Å; L143-C148 HydrophobicContact CD2-CB 4.17Å; L143-C148 PolarHBondContact O-N 3.09Å; L143-H150 HydrophobicContact CD1-CB 4.48Å; L143-F171 HydrophobicContact CD1-CE1 3.77Å; L143-F171 HydrophobicContact CD1-CZ 4.36Å; L143-F171 HydrophobicContact CD2-CE1 3.82Å; L143-F171 HydrophobicContact CD2-CZ 4.41Å; L143-F171 HydrophobicContact CG-CE1 4.46Å
144	E	97.2	Very high	96.8	Very high	40 Å²	40	20.6 Å²	20.6	19%	0.187	11%	0.109	C	C	.	.	H	α-helix	trans	-55.8	-46.4	174.2	176.8	172.1	-124.5	0	0	110.9	M140 M141 R146 N147 I206 F274 S275	M140-E144 WeakPolarHBondContact O-CB 3.38Å; M140-E144 PolarHBondContact O-N 3.23Å; M141-E144 PolarHBondContact O-N 2.79Å; E144-R146 PolarHBondContact O-N 3.47Å; E144-R146 VanDerWaalsContact O-N 3.11Å; E144-N147 PolarHBondContact O-N 3.47Å; E144-I206 HydrophobicContact CB-CD1 4.03Å; E144-I206 HydrophobicContact CB-CG1 3.85Å; E144-I206 HydrophobicContact CG-CG1 3.92Å; E144-F274 HydrophobicContact CB-CD2 4.27Å; E144-F274 WeakPolarHBondContact OE2-CB 3.48Å; E144-F274 PolarHBondContact OE2-N 3.47Å; E144-S275 PolarHBondContact OE2-N 2.98Å
145	A	96.6	Very high	96.8	Very high	78 Å²	78	19.6 Å²	19.6	65%	0.645	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-16.3	177.7	0	0	0	0	0	114.2	M141 L143	M141-A145 PolarHBondContact O-N 3.38Å; L143-A145 VanDerWaalsContact C-N 3.31Å; L143-A145 PolarHBondContact O-N 3.39Å
146	R	95.1	Very high	96.7	Very high	95 Å²	95	22.8 Å²	22.8	36%	0.358	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	9	176.4	-77.4	169.8	173	64.1	5	113.1	Y142 L143 E144 C148	Y142-R146 VanDerWaalsContact CD2-NH1 3.27Å; Y142-R146 VanDerWaalsContact CZ-NH1 3.3Å; Y142-R146 PolarHBondContact OH-NE 3.36Å; Y142-R146 PolarHBondContact OH-NH2 3.33Å; Y142-R146 VanDerWaalsContact OH-NH2 3.13Å; L143-R146 CarbonylContact O-C 3.52Å; L143-R146 WeakPolarHBondContact O-CA 3.44Å; L143-R146 PolarHBondContact O-N 3.49Å; E144-R146 PolarHBondContact O-N 3.47Å; E144-R146 VanDerWaalsContact O-N 3.11Å; R146-C148 PolarHBondContact O-N 3.1Å; R146-C148 VanDerWaalsContact O-N 3.14Å
147	N	93.6	Very high	96.6	Very high	71 Å²	71	23.5 Å²	23.5	38%	0.38	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	33	-173.4	-56.8	-49	0	0	0	112.6	L143 E144 E176 E177 H178	L143-N147 PolarHBondContact O-N 2.97Å; E144-N147 PolarHBondContact O-N 3.47Å; N147-E176 CarbonylContact O-C 3.44Å; N147-E176 WeakPolarHBondContact O-CA 3.46Å; N147-E177 PolarHBondContact O-N 3.23Å; N147-H178 PolarHBondContact OD1-CE1 3.41Å; N147-H178 PolarHBondContact OD1-ND1 3.21Å
148	C	94.5	Very high	96.6	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.007	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.8	177	-176.6	0	0	0	0	109.7	F83 L143 R146 R175	F83-C148 HydrophobicContact CZ-CB 3.84Å; L143-C148 HydrophobicContact CB-CB 4.15Å; L143-C148 HydrophobicContact CD2-CB 4.17Å; L143-C148 PolarHBondContact O-N 3.09Å; R146-C148 PolarHBondContact O-N 3.1Å; R146-C148 VanDerWaalsContact O-N 3.14Å; C148-R175 WeakPolarHBondContact CA-O 3.5Å
149	I	95.1	Very high	96.6	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.1	170.7	-48.2	168.6	0	0	0	107.7	R151 S174 R175 E177 D209	I149-R151 HydrophobicContact CB-CG 4.24Å; I149-R151 HydrophobicContact CG2-CG 3.54Å; I149-S174 CarbonylContact O-C 3.53Å; I149-S174 WeakPolarHBondContact O-CA 3.45Å; I149-R175 PolarHBondContact N-O 3.43Å; I149-R175 PolarHBondContact O-N 3.3Å; I149-E177 WeakPolarHBondContact CD1-O 3.41Å; I149-E177 VanDerWaalsContact CG1-O 3.32Å; I149-E177 WeakPolarHBondContact CG1-O 3.09Å; I149-D209 WeakPolarHBondContact CA-OD2 3.38Å; I149-D209 WeakPolarHBondContact CG2-OD2 3.29Å
150	H	95.1	Very high	96.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.			trans	-74.1	-45.4	-177.2	-169.2	-79.1	0	0	0	112.5	M140 L143 D152 L153 I168 A169 D170 F171 D209	M140-H150 HydrophobicContact CE-CB 4.13Å; M140-H150 HydrophobicContact SD-CB 4.4Å; L143-H150 HydrophobicContact CD1-CB 4.48Å; H150-D152 PolarHBondContact CE1-O 2.93Å; H150-D152 PolarHBondContact ND1-N 3.41Å; H150-D152 PolarHBondContact O-N 3.03Å; H150-L153 PolarHBondContact ND1-N 3.29Å; H150-I168 WeakPolarHBondContact NE2-CG2 3.07Å; H150-A169 PolarHBondContact CE1-O 3.24Å; H150-A169 PolarHBondContact NE2-O 3.44Å; H150-A169 VanDerWaalsContact NE2-O 3.12Å; H150-D170 PolarHBondContact CE1-O 3.3Å; H150-F171 AromaticContact CD2-CD1 3.89Å; H150-F171 AromaticContact CD2-CE1 3.62Å; H150-D209 PolarHBondContact N-OD2 3.09Å
151	R	93.9	Very high	96.4	Very high	9 Å²	9	25 Å²	25	3%	0.034	13%	0.128	C	C	.	.	S	Bend	trans	68.3	-15	177.8	-54.6	179.3	49.3	-133	-3.6	117.3	I149 M173 L182 Y204 D209	I149-R151 HydrophobicContact CB-CG 4.24Å; I149-R151 HydrophobicContact CG2-CG 3.54Å; R151-M173 HydrophobicContact CB-CB 4.35Å; R151-M173 WeakPolarHBondContact CD-O 3.39Å; R151-M173 PolarHBondContact NH1-O 3.04Å; R151-L182 VanDerWaalsContact NH2-CD2 3.29Å; R151-Y204 HydrophobicContact CB-CD1 4.08Å; R151-Y204 HydrophobicContact CB-CE1 4.22Å; R151-Y204 HydrophobicContact CG-CD1 3.67Å; R151-Y204 HydrophobicContact CG-CE1 4.28Å; R151-Y204 HydrophobicContact CG-CG 4Å; R151-D209 WeakPolarHBondContact CA-OD1 3.49Å; R151-D209 PolarHBondContact N-OD1 2.89Å
152	D	93.5	Very high	96.1	Very high	6 Å²	6	29 Å²	29	3%	0.032	15%	0.15	C	C	.	.			trans	-133	42.7	175.8	-161.7	18	0	0	0	113	H150 A154 R156 N157 M173 P190	H150-D152 PolarHBondContact CE1-O 2.93Å; H150-D152 PolarHBondContact ND1-N 3.41Å; H150-D152 PolarHBondContact O-N 3.03Å; D152-A154 PolarHBondContact O-N 2.9Å; D152-R156 IonicContact OD1-CZ 2.59Å; D152-R156 IonicContact OD1-NH2 2.69Å; D152-R156 PolarHBondContact OD1-NH2 2.92Å; D152-R156 IonicContact OD2-NH2 3.53Å; D152-N157 PolarHBondContact O-ND2 3.08Å; D152-N157 PolarHBondContact OD2-ND2 3.25Å; D152-M173 HydrophobicContact CB-CB 4.49Å; D152-M173 HydrophobicContact CB-SD 3.92Å; D152-P190 WeakPolarHBondContact OD1-CB 3.37Å; D152-P190 WeakPolarHBondContact OD1-CG 3.4Å
153	L	98	Very high	95.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.			trans	-72.8	119.4	177.2	-179	68.9	0	0	0	110.2	M140 H150 I168 Y213 L216	M140-L153 HydrophobicContact CE-CD2 4.47Å; M140-L153 HydrophobicContact CG-CD1 4.38Å; M140-L153 HydrophobicContact CG-CD2 3.73Å; M140-L153 HydrophobicContact SD-CD1 3.93Å; M140-L153 HydrophobicContact SD-CD2 3.77Å; M140-L153 HydrophobicContact SD-CG 4.33Å; H150-L153 PolarHBondContact ND1-N 3.29Å; L153-I168 HydrophobicContact CD1-CD1 4.18Å; L153-I168 HydrophobicContact CD1-CG1 4.37Å; L153-I168 HydrophobicContact CD1-CG2 4.12Å; L153-Y213 HydrophobicContact CD2-CD2 4.29Å; L153-L216 HydrophobicContact CD1-CD2 4.09Å; L153-L216 HydrophobicContact CD2-CD2 4.36Å; L153-L216 HydrophobicContact CG-CD2 4.17Å
154	A	97.9	Very high	95.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-162.6	164.1	179.3	0	0	0	0	0	110.7	D152 R156 N157 C158 W193	D152-A154 PolarHBondContact O-N 2.9Å; A154-R156 HydrophobicContact CB-CG 3.97Å; A154-R156 PolarHBondContact O-N 3.27Å; A154-R156 VanDerWaalsContact O-N 3.15Å; A154-N157 CarbonylContact O-C 3.56Å; A154-N157 PolarHBondContact O-N 3.16Å; A154-C158 PolarHBondContact O-N 3.27Å; A154-C158 PolarHBondContact O-SG 2.65Å; A154-C158 VanDerWaalsContact O-SG 3.38Å; A154-W193 HydrophobicContact CB-CD2 4.22Å; A154-W193 HydrophobicContact CB-CG 4.13Å; A154-W193 HydrophobicContact CB-CZ2 4.5Å
155	A	98.3	Very high	95.5	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-62.1	-26	179.5	0	0	0	0	0	113.2	L113 L114 N157 C158 L216 E219	L113-A155 WeakPolarHBondContact CB-O 3.46Å; L113-A155 HydrophobicContact CD2-CB 3.97Å; L113-A155 HydrophobicContact CG-CB 4.28Å; L114-A155 HydrophobicContact CB-CB 4.07Å; L114-A155 HydrophobicContact CD1-CB 4.4Å; L114-A155 PolarHBondContact N-O 3.46Å; A155-N157 VanDerWaalsContact C-N 3.28Å; A155-N157 PolarHBondContact O-N 3.4Å; A155-C158 PolarHBondContact O-N 2.95Å; A155-L216 HydrophobicContact CB-CD1 3.88Å; A155-E219 HydrophobicContact CB-CB 3.99Å; A155-E219 HydrophobicContact CB-CG 4.41Å; A155-E219 WeakPolarHBondContact CB-OE1 3.36Å; A155-E219 PolarHBondContact N-OE2 3.02Å
156	R	96.2	Very high	95.6	Very high	75 Å²	75	31.3 Å²	31.3	28%	0.283	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-67.7	-27.2	173.8	63.7	173.9	176.7	-75.8	-6.5	113.4	L114 D152 A154 P190 W193	L114-R156 HydrophobicContact CB-CB 4.49Å; L114-R156 HydrophobicContact CD2-CB 4.05Å; D152-R156 IonicContact OD1-CZ 2.59Å; D152-R156 IonicContact OD1-NH2 2.69Å; D152-R156 PolarHBondContact OD1-NH2 2.92Å; D152-R156 IonicContact OD2-NH2 3.53Å; A154-R156 HydrophobicContact CB-CG 3.97Å; A154-R156 PolarHBondContact O-N 3.27Å; A154-R156 VanDerWaalsContact O-N 3.15Å; R156-P190 VanDerWaalsContact NH2-CB 3.32Å; R156-W193 VanDerWaalsContact NH1-CH2 3.35Å
157	N	96.3	Very high	95.8	Very high	15 Å²	15	28.2 Å²	28.2	8%	0.08	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-105.1	13.7	-177.6	-67.1	-12.6	0	0	0	111.7	D152 A154 A155 A169 D170	D152-N157 PolarHBondContact O-ND2 3.08Å; D152-N157 PolarHBondContact OD2-ND2 3.25Å; A154-N157 CarbonylContact O-C 3.56Å; A154-N157 PolarHBondContact O-N 3.16Å; A155-N157 VanDerWaalsContact C-N 3.28Å; A155-N157 PolarHBondContact O-N 3.4Å; N157-A169 CarbonylContact O-C 3.51Å; N157-A169 WeakPolarHBondContact O-CA 3.43Å; N157-A169 WeakPolarHBondContact O-CB 3.11Å; N157-A169 PolarHBondContact O-N 3.49Å; N157-A169 VanDerWaalsContact O-O 3.11Å; N157-D170 HydrophobicContact CB-CB 4.24Å
158	C	98.3	Very high	96	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	143.2	165.4	-61.1	0	0	0	0	108	S112 L113 A154 A155 L166 K167	S112-C158 CarbonylContact C-O 3.4Å; S112-C158 VanDerWaalsContact CA-O 3.3Å; S112-C158 WeakPolarHBondContact CA-O 3.44Å; L113-C158 HydrophobicContact CB-CB 3.85Å; L113-C158 HydrophobicContact CD2-CB 3.96Å; L113-C158 PolarHBondContact N-O 2.93Å; A154-C158 PolarHBondContact O-N 3.27Å; A154-C158 PolarHBondContact O-SG 2.65Å; A154-C158 VanDerWaalsContact O-SG 3.38Å; A155-C158 PolarHBondContact O-N 2.95Å; C158-L166 HydrophobicContact CB-CD1 4Å; C158-L166 HydrophobicContact CB-CD2 4.03Å; C158-L166 HydrophobicContact CB-CG 3.95Å; C158-K167 CarbonylContact C-O 3.56Å; C158-K167 WeakPolarHBondContact CA-O 3.46Å
159	L	98	Very high	96	Very high	38 Å²	38	25.3 Å²	25.3	20%	0.199	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	154.8	174.5	-54.5	-176.7	0	0	0	110	V89 V108 G111 L166 K167 A169	V89-L159 HydrophobicContact CG2-CD1 3.78Å; V89-L159 HydrophobicContact CG2-CG 4.27Å; V108-L159 HydrophobicContact CB-CB 3.93Å; V108-L159 HydrophobicContact CB-CD1 3.78Å; V108-L159 HydrophobicContact CG1-CB 3.74Å; V108-L159 HydrophobicContact CG2-CB 4.34Å; V108-L159 HydrophobicContact CG2-CD1 3.86Å; G111-L159 CarbonylContact O-C 3.51Å; G111-L159 WeakPolarHBondContact O-CA 3.41Å; L159-L166 CarbonylContact O-C 3.57Å; L159-L166 WeakPolarHBondContact O-CA 3.45Å; L159-K167 PolarHBondContact N-O 3.44Å; L159-K167 PolarHBondContact O-N 3.19Å; L159-A169 HydrophobicContact CD1-CB 4.16Å; L159-A169 HydrophobicContact CG-CB 4Å
160	I	97.9	Very high	95.7	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.2	174.9	-69.5	-57.9	0	0	0	109.1	V108 G110 G111 L113 H116 M132 Q165 L166	V108-I160 VanDerWaalsContact CG1-C 3.44Å; V108-I160 VanDerWaalsContact CG1-O 3.28Å; V108-I160 WeakPolarHBondContact CG1-O 3.39Å; G110-I160 CarbonylContact C-O 3.44Å; G110-I160 WeakPolarHBondContact CA-O 3.36Å; G110-I160 PolarHBondContact N-O 3.04Å; G111-I160 PolarHBondContact O-N 3.3Å; L113-I160 HydrophobicContact CB-CG1 4.17Å; L113-I160 HydrophobicContact CD1-CD1 3.69Å; L113-I160 HydrophobicContact CD1-CG1 3.71Å; H116-I160 HydrophobicContact CB-CG1 4.31Å; M132-I160 HydrophobicContact CE-CD1 4.24Å; M132-I160 HydrophobicContact CG-CD1 4.2Å; M132-I160 HydrophobicContact SD-CD1 4.41Å; I160-Q165 WeakPolarHBondContact CA-O 3.34Å; I160-L166 HydrophobicContact CD1-CB 3.74Å; I160-L166 HydrophobicContact CD1-CD1 4.49Å; I160-L166 HydrophobicContact CD1-CG 4.23Å
161	S	96.1	Very high	95.2	Very high	11 Å²	11	26.8 Å²	26.8	8%	0.077	14%	0.14	C	C	.	.			trans	-74.8	166.7	169.4	55.4	0	0	0	0	111.5	D163 G164 Q165	S161-D163 VanDerWaalsContact C-N 3.3Å; S161-D163 VanDerWaalsContact CB-OD1 3.27Å; S161-D163 WeakPolarHBondContact CB-OD1 3.38Å; S161-D163 PolarHBondContact O-N 2.79Å; S161-D163 PolarHBondContact OG-OD1 3.05Å; S161-G164 WeakPolarHBondContact O-CA 3.36Å; S161-G164 PolarHBondContact O-N 3.19Å; S161-Q165 PolarHBondContact N-O 3.22Å; S161-Q165 WeakPolarHBondContact OG-CA 3.44Å; S161-Q165 WeakPolarHBondContact OG-CB 3.47Å; S161-Q165 PolarHBondContact OG-N 3.08Å; S161-Q165 PolarHBondContact OG-O 2.88Å; S161-Q165 VanDerWaalsContact OG-O 3.06Å
162	D	91.1	Very high	94.5	Very high	140 Å²	140	26.7 Å²	26.7	75%	0.749	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.4	179.3	30.1	-33.2	0	0	0	113.4	P109 G164	P109-D162 WeakPolarHBondContact CD-OD1 3.1Å; P109-D162 HydrophobicContact CG-CB 3.94Å; P109-D162 VanDerWaalsContact CG-CG 3.47Å; P109-D162 WeakPolarHBondContact CG-OD1 3.22Å; D162-G164 PolarHBondContact O-N 3.18Å
163	D	91.9	Very high	93.7	Very high	99 Å²	99	27.5 Å²	27.5	53%	0.529	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-1.1	169.1	70	-25.6	0	0	0	113.4	S161 Q165	S161-D163 VanDerWaalsContact C-N 3.3Å; S161-D163 VanDerWaalsContact CB-OD1 3.27Å; S161-D163 WeakPolarHBondContact CB-OD1 3.38Å; S161-D163 PolarHBondContact O-N 2.79Å; S161-D163 PolarHBondContact OG-OD1 3.05Å; D163-Q165 VanDerWaalsContact OD2-CD 3.31Å; D163-Q165 WeakPolarHBondContact OD2-CG 3.16Å; D163-Q165 PolarHBondContact OD2-NE2 3.5Å
164	G	92.2	Very high	92.8	Very high	20 Å²	20	27.5 Å²	27.5	21%	0.206	15%	0.146	C	C	.	.	S	Bend	trans	86.4	13.6	175.1	0	0	0	0	0	115	S161 D162	S161-G164 WeakPolarHBondContact O-CA 3.36Å; S161-G164 PolarHBondContact O-N 3.19Å; D162-G164 PolarHBondContact O-N 3.18Å
165	Q	96.6	Very high	92	Very high	72 Å²	72	28.6 Å²	28.6	34%	0.336	15%	0.15	S	C	.	.			trans	-76.8	141.6	172.6	-60.7	-178.2	19.4	0	0	111	D135 I160 S161 D163	D135-Q165 WeakPolarHBondContact OD2-CA 3.23Å; I160-Q165 WeakPolarHBondContact CA-O 3.34Å; S161-Q165 PolarHBondContact N-O 3.22Å; S161-Q165 WeakPolarHBondContact OG-CA 3.44Å; S161-Q165 WeakPolarHBondContact OG-CB 3.47Å; S161-Q165 PolarHBondContact OG-N 3.08Å; S161-Q165 PolarHBondContact OG-O 2.88Å; S161-Q165 VanDerWaalsContact OG-O 3.06Å; D163-Q165 VanDerWaalsContact OD2-CD 3.31Å; D163-Q165 WeakPolarHBondContact OD2-CG 3.16Å; D163-Q165 PolarHBondContact OD2-NE2 3.5Å
166	L	98.6	Very high	91.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	135.7	172.2	-179.2	160.7	0	0	0	111.1	N87 L113 M132 D135 A136 C158 L159 I160 I168	N87-L166 WeakPolarHBondContact CA-O 3.34Å; N87-L166 WeakPolarHBondContact CB-O 3.26Å; N87-L166 PolarHBondContact ND2-O 3.37Å; L113-L166 HydrophobicContact CD1-CD1 4.33Å; L113-L166 HydrophobicContact CD2-CD1 3.53Å; L113-L166 HydrophobicContact CG-CD1 4.41Å; M132-L166 HydrophobicContact CB-CD1 4.14Å; M132-L166 WeakPolarHBondContact O-CD1 3.23Å; D135-L166 HydrophobicContact CB-CB 3.7Å; D135-L166 PolarHBondContact OD2-N 3.24Å; A136-L166 HydrophobicContact CB-CD1 4.17Å; A136-L166 HydrophobicContact CB-CD2 3.81Å; C158-L166 HydrophobicContact CB-CD1 4Å; C158-L166 HydrophobicContact CB-CD2 4.03Å; C158-L166 HydrophobicContact CB-CG 3.95Å; L159-L166 CarbonylContact O-C 3.57Å; L159-L166 WeakPolarHBondContact O-CA 3.45Å; I160-L166 HydrophobicContact CD1-CB 3.74Å; I160-L166 HydrophobicContact CD1-CD1 4.49Å; I160-L166 HydrophobicContact CD1-CG 4.23Å; L166-I168 HydrophobicContact CD2-CG1 4.2Å
167	K	98.7	Very high	90.4	Very high	30 Å²	30	34.4 Å²	34.4	13%	0.13	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.5	172.1	-56.6	-164.2	173.3	-161.6	0	111.9	P86 N87 V89 E106 V108 C158 L159	P86-K167 WeakPolarHBondContact O-CE 3.35Å; P86-K167 WeakPolarHBondContact O-CG 3.47Å; N87-K167 WeakPolarHBondContact O-CA 3.45Å; V89-K167 HydrophobicContact CG2-CB 3.7Å; E106-K167 IonicContact OE1-NZ 2.92Å; E106-K167 PolarHBondContact OE1-NZ 2.79Å; E106-K167 IonicContact OE2-NZ 3.88Å; E106-K167 PolarHBondContact OE2-NZ 3.18Å; V108-K167 HydrophobicContact CG2-CD 4.22Å; C158-K167 CarbonylContact C-O 3.56Å; C158-K167 WeakPolarHBondContact CA-O 3.46Å; L159-K167 PolarHBondContact N-O 3.44Å; L159-K167 PolarHBondContact O-N 3.19Å
168	I	98.4	Very high	89.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	135.4	175	-55.1	174.8	0	0	0	109.3	N87 I88 V89 M140 H150 L153 L166 F171	N87-I168 PolarHBondContact O-N 3.25Å; I88-I168 HydrophobicContact CD1-CB 3.93Å; I88-I168 HydrophobicContact CD1-CD1 4.1Å; I88-I168 HydrophobicContact CD1-CG1 4.35Å; V89-I168 WeakPolarHBondContact CG2-O 3.29Å; V89-I168 PolarHBondContact N-O 2.82Å; M140-I168 HydrophobicContact CG-CD1 3.65Å; M140-I168 HydrophobicContact SD-CD1 3.6Å; M140-I168 VanDerWaalsContact SD-CD1 3.6Å; H150-I168 WeakPolarHBondContact NE2-CG2 3.07Å; L153-I168 HydrophobicContact CD1-CD1 4.18Å; L153-I168 HydrophobicContact CD1-CG1 4.37Å; L153-I168 HydrophobicContact CD1-CG2 4.12Å; L166-I168 HydrophobicContact CD2-CG1 4.2Å; I168-F171 HydrophobicContact CG2-CZ 4.28Å
169	A	94.8	Very high	89	Confident	11 Å²	11	43.7 Å²	43.7	9%	0.091	22%	0.224	C	C	.	.			trans	-133	176.7	-176.5	0	0	0	0	0	111.3	V89 H150 N157 L159	V89-A169 HydrophobicContact CB-CB 4.19Å; V89-A169 HydrophobicContact CG2-CB 3.65Å; H150-A169 PolarHBondContact CE1-O 3.24Å; H150-A169 PolarHBondContact NE2-O 3.44Å; H150-A169 VanDerWaalsContact NE2-O 3.12Å; N157-A169 CarbonylContact O-C 3.51Å; N157-A169 WeakPolarHBondContact O-CA 3.43Å; N157-A169 WeakPolarHBondContact O-CB 3.11Å; N157-A169 PolarHBondContact O-N 3.49Å; N157-A169 VanDerWaalsContact O-O 3.11Å; L159-A169 HydrophobicContact CD1-CB 4.16Å; L159-A169 HydrophobicContact CG-CB 4Å
170	D	87.6	Confident	88.3	Confident	31 Å²	31	43.4 Å²	43.4	17%	0.166	22%	0.221	C	C	.	.			trans	63	71.8	176.8	-154.2	-12.6	0	0	0	114.8	K58 H150 N157 G172	K58-D170 IonicContact NZ-OD1 3.55Å; K58-D170 PolarHBondContact NZ-OD1 3.48Å; K58-D170 IonicContact NZ-OD2 3.91Å; H150-D170 PolarHBondContact CE1-O 3.3Å; N157-D170 HydrophobicContact CB-CB 4.24Å; D170-G172 PolarHBondContact O-N 3.47Å; D170-G172 PolarHBondContact OD1-N 3.15Å
171	F	85.3	Confident	87.6	Confident	1 Å²	1	49.3 Å²	49.3	0%	0.004	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-84.6	11	177.3	-65.6	-85	0	0	0	113.3	G76 A80 F83 I88 L91 L143 H150 I168 M173 S174	G76-F171 CarbonylContact C-O 3.46Å; G76-F171 WeakPolarHBondContact CA-O 3.14Å; A80-F171 HydrophobicContact CB-CB 3.77Å; A80-F171 HydrophobicContact CB-CD1 4.31Å; A80-F171 HydrophobicContact CB-CD2 3.82Å; A80-F171 HydrophobicContact CB-CG 3.69Å; F83-F171 HydrophobicContact CD2-CD1 4.37Å; F83-F171 HydrophobicContact CD2-CE1 4.04Å; F83-F171 HydrophobicContact CD2-CZ 4.23Å; F83-F171 AromaticContact CE2-CD1 3.88Å; F83-F171 HydrophobicContact CE2-CD1 3.88Å; F83-F171 AromaticContact CE2-CE1 3.79Å; F83-F171 HydrophobicContact CE2-CE1 3.79Å; F83-F171 HydrophobicContact CE2-CZ 4.43Å; I88-F171 HydrophobicContact CD1-CZ 4.22Å; I88-F171 HydrophobicContact CG2-CE2 3.85Å; I88-F171 HydrophobicContact CG2-CZ 3.61Å; L91-F171 HydrophobicContact CD1-CD2 4.47Å; L143-F171 HydrophobicContact CD1-CE1 3.77Å; L143-F171 HydrophobicContact CD1-CZ 4.36Å; L143-F171 HydrophobicContact CD2-CE1 3.82Å; L143-F171 HydrophobicContact CD2-CZ 4.41Å; L143-F171 HydrophobicContact CG-CE1 4.46Å; H150-F171 AromaticContact CD2-CD1 3.89Å; H150-F171 AromaticContact CD2-CE1 3.62Å; I168-F171 HydrophobicContact CG2-CZ 4.28Å; F171-M173 PolarHBondContact O-N 3.41Å; F171-M173 VanDerWaalsContact O-N 3.08Å; F171-S174 VanDerWaalsContact O-CB 3.29Å; F171-S174 WeakPolarHBondContact O-CB 3.33Å; F171-S174 PolarHBondContact O-N 3.47Å; F171-S174 PolarHBondContact O-OG 3.47Å
172	G	78.6	Confident	86.7	Confident	7 Å²	7	50.4 Å²	50.4	7%	0.072	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-59.7	-25.3	-176.7	0	0	0	0	0	114	E77 D170	E77-G172 PolarHBondContact OE1-N 3.42Å; D170-G172 PolarHBondContact O-N 3.47Å; D170-G172 PolarHBondContact OD1-N 3.15Å
173	M	76.6	Confident	86	Confident	24 Å²	24	49 Å²	49	12%	0.118	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-97.6	-5.1	175.9	-63.6	-171.6	66	0	0	114	R151 D152 F171	R151-M173 HydrophobicContact CB-CB 4.35Å; R151-M173 WeakPolarHBondContact CD-O 3.39Å; R151-M173 PolarHBondContact NH1-O 3.04Å; D152-M173 HydrophobicContact CB-CB 4.49Å; D152-M173 HydrophobicContact CB-SD 3.92Å; F171-M173 PolarHBondContact O-N 3.41Å; F171-M173 VanDerWaalsContact O-N 3.08Å
174	S	78.9	Confident	85	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.252	C	S	.	.			trans	-72.2	153.5	-170.1	82.7	0	0	0	0	112.8	G76 I149 F171	G76-S174 WeakPolarHBondContact CA-O 3.39Å; G76-S174 VanDerWaalsContact CA-OG 3.25Å; G76-S174 WeakPolarHBondContact CA-OG 3.3Å; G76-S174 PolarHBondContact O-OG 2.88Å; I149-S174 CarbonylContact O-C 3.53Å; I149-S174 WeakPolarHBondContact O-CA 3.45Å; F171-S174 VanDerWaalsContact O-CB 3.29Å; F171-S174 WeakPolarHBondContact O-CB 3.33Å; F171-S174 PolarHBondContact O-N 3.47Å; F171-S174 PolarHBondContact O-OG 3.47Å
175	R	81.9	Confident	83.7	Confident	23 Å²	23	53.4 Å²	53.4	9%	0.087	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	134.8	178.8	-64.3	-67.7	-177.9	-93.8	10.4	110.6	K72 C148 I149 E177 Y180	K72-R175 PolarHBondContact O-NH2 2.88Å; C148-R175 WeakPolarHBondContact CA-O 3.5Å; I149-R175 PolarHBondContact N-O 3.43Å; I149-R175 PolarHBondContact O-N 3.3Å; R175-E177 VanDerWaalsContact C-N 3.33Å; R175-E177 PolarHBondContact O-N 2.89Å; R175-Y180 HydrophobicContact CB-CD2 4.12Å; R175-Y180 HydrophobicContact CB-CG 4.14Å; R175-Y180 HydrophobicContact CG-CD1 4.09Å; R175-Y180 HydrophobicContact CG-CD2 3.58Å; R175-Y180 HydrophobicContact CG-CE1 4.27Å; R175-Y180 HydrophobicContact CG-CE2 3.77Å; R175-Y180 HydrophobicContact CG-CG 3.74Å
176	E	80.1	Confident	82	Confident	116 Å²	116	61 Å²	61	54%	0.542	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	69.2	175.8	-165.6	179.5	175.6	0	0	110.4	T79 N147	T79-E176 HydrophobicContact CG2-CB 3.96Å; T79-E176 HydrophobicContact CG2-CG 4.4Å; N147-E176 CarbonylContact O-C 3.44Å; N147-E176 WeakPolarHBondContact O-CA 3.46Å
177	E	81.3	Confident	80.4	Confident	80 Å²	80	63 Å²	63	37%	0.374	31%	0.313	S	S	.	.	S	Bend	trans	-147.2	149.7	-176.3	-65.4	177.7	-173.6	0	0	109.1	N147 I149 R175 I179 Y180	N147-E177 PolarHBondContact O-N 3.23Å; I149-E177 WeakPolarHBondContact CD1-O 3.41Å; I149-E177 VanDerWaalsContact CG1-O 3.32Å; I149-E177 WeakPolarHBondContact CG1-O 3.09Å; R175-E177 VanDerWaalsContact C-N 3.33Å; R175-E177 PolarHBondContact O-N 2.89Å; E177-I179 VanDerWaalsContact C-N 3.34Å; E177-Y180 WeakPolarHBondContact OE2-CD2 3.29Å
178	H	78.5	Confident	79.1	Confident	135 Å²	135	68.6 Å²	68.6	63%	0.625	34%	0.34	S	S	*	.	S	Bend	trans	-69.2	-35.8	173.6	-71.8	-72.5	0	0	0	112.7	N147	N147-H178 PolarHBondContact OD1-CE1 3.41Å; N147-H178 PolarHBondContact OD1-ND1 3.21Å
179	I	85.3	Confident	78.5	Confident	75 Å²	75	70 Å²	70	39%	0.385	35%	0.348	S	S	.	.	S	Bend	trans	-135.9	122.3	-179.8	-63.4	162.9	0	0	0	106.7	E177 E181 R203 Y204 T205	E177-I179 VanDerWaalsContact C-N 3.34Å; I179-E181 HydrophobicContact CG2-CG 4.39Å; I179-R203 VanDerWaalsContact CD1-NH2 3.26Å; I179-R203 HydrophobicContact CG2-CG 3.6Å; I179-R203 VanDerWaalsContact CG2-NE 3.29Å; I179-Y204 WeakPolarHBondContact CA-O 3.36Å; I179-T205 HydrophobicContact CG1-CG2 4.09Å
180	Y	83.5	Confident	78.4	Confident	32 Å²	32	70.4 Å²	70.4	13%	0.125	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.3	174.4	175.1	-105.3	0	0	0	110.5	R175 E177 L182 R203 Y204	R175-Y180 HydrophobicContact CB-CD2 4.12Å; R175-Y180 HydrophobicContact CB-CG 4.14Å; R175-Y180 HydrophobicContact CG-CD1 4.09Å; R175-Y180 HydrophobicContact CG-CD2 3.58Å; R175-Y180 HydrophobicContact CG-CE1 4.27Å; R175-Y180 HydrophobicContact CG-CE2 3.77Å; R175-Y180 HydrophobicContact CG-CG 3.74Å; E177-Y180 WeakPolarHBondContact OE2-CD2 3.29Å; Y180-L182 HydrophobicContact CE1-CD2 3.99Å; Y180-L182 HydrophobicContact CE1-CG 4.23Å; Y180-R203 CarbonylContact O-C 3.59Å; Y180-R203 WeakPolarHBondContact O-CA 3.41Å; Y180-Y204 HydrophobicContact CD1-CD2 4.27Å; Y180-Y204 PolarHBondContact N-O 3.04Å; Y180-Y204 PolarHBondContact O-N 2.69Å
181	E	83	Confident	78.7	Confident	128 Å²	128	69.9 Å²	69.9	60%	0.598	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	128	176.9	-66	-173.4	174	0	0	110.9	I179 S183 R203	I179-E181 HydrophobicContact CG2-CG 4.39Å; E181-S183 PolarHBondContact O-N 2.94Å; E181-R203 HydrophobicContact CG-CB 4.18Å; E181-R203 HydrophobicContact CG-CG 4.01Å
182	L	78.8	Confident	79.3	Confident	34 Å²	34	70.9 Å²	70.9	18%	0.178	35%	0.35	C	S	.	.			trans	-66.3	123.1	174.7	-84.9	174.1	0	0	0	111	R151 Y180 D184 I189 G202 Y204	R151-L182 VanDerWaalsContact NH2-CD2 3.29Å; Y180-L182 HydrophobicContact CE1-CD2 3.99Å; Y180-L182 HydrophobicContact CE1-CG 4.23Å; L182-D184 VanDerWaalsContact C-N 3.3Å; L182-D184 PolarHBondContact O-N 3.38Å; L182-I189 HydrophobicContact CD1-CD1 3.95Å; L182-I189 HydrophobicContact CD1-CG1 4.29Å; L182-G202 PolarHBondContact N-O 2.94Å; L182-Y204 HydrophobicContact CD1-CE2 3.65Å; L182-Y204 HydrophobicContact CG-CE2 3.94Å
183	S	75.7	Confident	80.2	Confident	112 Å²	112	72 Å²	72	78%	0.783	35%	0.352	S	S	*	.	S	Bend	trans	-69.4	-27.7	171.8	60.2	0	0	0	0	113.1	E181	E181-S183 PolarHBondContact O-N 2.94Å
184	D	70.4	Confident	81.1	Confident	88 Å²	88	71 Å²	71	47%	0.471	35%	0.348	S	S	.	.			trans	-133.4	117.8	174.3	-174.1	-2.1	0	0	0	109.9	L182 R186	L182-D184 VanDerWaalsContact C-N 3.3Å; L182-D184 PolarHBondContact O-N 3.38Å; D184-R186 PolarHBondContact O-N 3.36Å; D184-R186 VanDerWaalsContact OD1-CB 3.29Å; D184-R186 WeakPolarHBondContact OD1-CB 3.36Å; D184-R186 WeakPolarHBondContact OD1-CG 3.44Å; D184-R186 PolarHBondContact OD1-N 2.79Å
185	K	65.7	Low	82	Confident	123 Å²	123	71 Å²	71	54%	0.535	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-6.6	179.1	-63.3	-172.9	-179.7	-172.6	0	113.2	R200 T201	K185-R200 PolarHBondContact NZ-O 3.38Å; K185-T201 WeakPolarHBondContact CE-O 3.47Å; K185-T201 PolarHBondContact NZ-O 2.75Å; K185-T201 VanDerWaalsContact NZ-O 3.11Å
186	R	60.9	Low	82.6	Confident	231 Å²	231	70.1 Å²	70.1	87%	0.872	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-4.9	179.2	-61.6	-179.5	179.6	-171.5	0.9	114.1	D184	D184-R186 PolarHBondContact O-N 3.36Å; D184-R186 VanDerWaalsContact OD1-CB 3.29Å; D184-R186 WeakPolarHBondContact OD1-CB 3.36Å; D184-R186 WeakPolarHBondContact OD1-CG 3.44Å; D184-R186 PolarHBondContact OD1-N 2.79Å
187	G	63.8	Low	83.4	Confident	41 Å²	41	65.6 Å²	65.6	42%	0.423	32%	0.324	S	S	.	.	S	Bend	trans	-56.7	156.2	175.2	0	0	0	0	0	112.4	I189	G187-I189 PolarHBondContact O-N 2.84Å
188	Q	71.4	Confident	84	Confident	149 Å²	149	61.8 Å²	61.8	70%	0.696	31%	0.306	S	S	*	.			trans	-62.2	105.6	172	-78.4	-177	-11	0	0	109.3
189	I	85.8	Confident	84.6	Confident	30 Å²	30	55.7 Å²	55.7	15%	0.154	28%	0.278	C	S	.	.			trans	-102.2	132.3	175.2	-64.4	167.3	0	0	0	107.6	L182 G187 I191 T194 L199	L182-I189 HydrophobicContact CD1-CD1 3.95Å; L182-I189 HydrophobicContact CD1-CG1 4.29Å; G187-I189 PolarHBondContact O-N 2.84Å; I189-I191 HydrophobicContact CB-CD1 3.96Å; I189-I191 HydrophobicContact CG2-CD1 3.85Å; I189-I191 WeakPolarHBondContact O-CG1 3.05Å; I189-I191 PolarHBondContact O-N 3.4Å; I189-T194 HydrophobicContact CG2-CG2 3.92Å; I189-T194 VanDerWaalsContact CG2-OG1 3.3Å; I189-T194 WeakPolarHBondContact CG2-OG1 3.25Å; I189-L199 HydrophobicContact CG2-CD2 4.05Å
190	P	92.7	Very high	84.9	Confident	19 Å²	19	58.6 Å²	58.6	12%	0.123	28%	0.284	C	S	.	.			trans	-74.3	71.9	175.3	33.5	-37.7	0	0	0	110.4	D152 R156 K192 W193 T194	D152-P190 WeakPolarHBondContact OD1-CB 3.37Å; D152-P190 WeakPolarHBondContact OD1-CG 3.4Å; R156-P190 VanDerWaalsContact NH2-CB 3.32Å; P190-K192 PolarHBondContact O-N 3.41Å; P190-W193 HydrophobicContact CB-CE3 4.3Å; P190-W193 PolarHBondContact O-N 2.89Å; P190-T194 VanDerWaalsContact C-OG1 3.3Å; P190-T194 PolarHBondContact O-N 2.97Å; P190-T194 VanDerWaalsContact O-N 3.15Å; P190-T194 PolarHBondContact O-OG1 3.45Å
191	I	94.4	Very high	85.2	Confident	19 Å²	19	60.4 Å²	60.4	10%	0.097	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-46.4	-44.9	-166.6	-59.9	-64.3	0	0	0	113.1	I189 W193 T194 L199 N233	I189-I191 HydrophobicContact CB-CD1 3.96Å; I189-I191 HydrophobicContact CG2-CD1 3.85Å; I189-I191 WeakPolarHBondContact O-CG1 3.05Å; I189-I191 PolarHBondContact O-N 3.4Å; I191-W193 PolarHBondContact O-N 3.16Å; I191-T194 PolarHBondContact O-N 2.77Å; I191-T194 VanDerWaalsContact O-N 3.1Å; I191-L199 HydrophobicContact CD1-CD2 3.47Å; I191-L199 VanDerWaalsContact CD1-CD2 3.47Å; I191-L199 HydrophobicContact CG2-CD1 4.37Å; I191-L199 HydrophobicContact CG2-CD2 4.31Å; I191-N233 HydrophobicContact CB-CB 4.17Å; I191-N233 HydrophobicContact CG1-CB 3.99Å; I191-N233 HydrophobicContact CG2-CB 4.22Å; I191-N233 WeakPolarHBondContact CG2-O 3.32Å
192	K	97.2	Very high	85.6	Confident	22 Å²	22	54.5 Å²	54.5	10%	0.096	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-69.9	-14.7	-175.7	-58.8	-175.8	156.3	-158.3	0	114.7	P190 P227 Y228 W231 T236	P190-K192 PolarHBondContact O-N 3.41Å; K192-P227 HydrophobicContact CB-CB 4.34Å; K192-P227 VanDerWaalsContact CD-O 3.26Å; K192-P227 WeakPolarHBondContact CD-O 3.44Å; K192-P227 WeakPolarHBondContact CE-O 3.49Å; K192-P227 PolarHBondContact NZ-O 3.15Å; K192-Y228 HydrophobicContact CB-CD2 4.11Å; K192-Y228 HydrophobicContact CG-CD2 4.39Å; K192-Y228 PolarHBondContact NZ-O 3.38Å; K192-W231 PolarHBondContact NZ-O 3.41Å; K192-T236 HydrophobicContact CG-CG2 4.13Å
193	W	97.9	Very high	86.3	Confident	31 Å²	31	58.1 Å²	58.1	12%	0.117	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-107.8	-7	174	-68.4	-101.3	0	0	0	112.2	A154 R156 P190 I191 W211 S212 V215 E219 P227	A154-W193 HydrophobicContact CB-CD2 4.22Å; A154-W193 HydrophobicContact CB-CG 4.13Å; A154-W193 HydrophobicContact CB-CZ2 4.5Å; R156-W193 VanDerWaalsContact NH1-CH2 3.35Å; P190-W193 HydrophobicContact CB-CE3 4.3Å; P190-W193 PolarHBondContact O-N 2.89Å; I191-W193 PolarHBondContact O-N 3.16Å; W193-W211 VanDerWaalsContact O-CD1 3.24Å; W193-S212 WeakPolarHBondContact O-CA 3.45Å; W193-S212 PolarHBondContact O-OG 3.03Å; W193-V215 VanDerWaalsContact CD1-CG1 3.43Å; W193-V215 HydrophobicContact CD2-CG1 4.36Å; W193-V215 HydrophobicContact CG-CB 4.35Å; W193-V215 HydrophobicContact CG-CG1 3.99Å; W193-E219 WeakPolarHBondContact CZ2-OE1 3.36Å; W193-E219 VanDerWaalsContact NE1-CD 3.34Å; W193-E219 PolarHBondContact NE1-OE2 2.73Å; W193-P227 HydrophobicContact CH2-CG 4.29Å; W193-P227 HydrophobicContact CZ2-CG 3.78Å
194	T	96.1	Very high	87.2	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	25%	0.246	C	C	.	.	S	Bend	trans	-92	134.6	-170.3	-55	0	0	0	0	111.4	I189 P190 I191 A198 L199 Y204	I189-T194 HydrophobicContact CG2-CG2 3.92Å; I189-T194 VanDerWaalsContact CG2-OG1 3.3Å; I189-T194 WeakPolarHBondContact CG2-OG1 3.25Å; P190-T194 VanDerWaalsContact C-OG1 3.3Å; P190-T194 PolarHBondContact O-N 2.97Å; P190-T194 VanDerWaalsContact O-N 3.15Å; P190-T194 PolarHBondContact O-OG1 3.45Å; I191-T194 PolarHBondContact O-N 2.77Å; I191-T194 VanDerWaalsContact O-N 3.1Å; T194-A198 HydrophobicContact CG2-CB 3.71Å; T194-L199 HydrophobicContact CG2-CD2 3.69Å; T194-L199 HydrophobicContact CG2-CG 3.82Å; T194-Y204 HydrophobicContact CG2-CE1 4.16Å
195	A	97.2	Very high	88.4	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.232	C	C	.	.			trans	-64.2	148.9	177.7	0	0	0	0	0	113.1	E197 A198 L199 C208 W211	A195-E197 VanDerWaalsContact C-N 3.33Å; A195-E197 WeakPolarHBondContact CB-OE1 3.15Å; A195-E197 WeakPolarHBondContact CB-OE2 3.49Å; A195-E197 PolarHBondContact O-N 2.91Å; A195-A198 PolarHBondContact O-N 3.03Å; A195-A198 VanDerWaalsContact O-N 3.07Å; A195-L199 WeakPolarHBondContact O-CG 3.44Å; A195-L199 PolarHBondContact O-N 3.2Å; A195-C208 HydrophobicContact CB-CB 4.07Å; A195-W211 HydrophobicContact CB-CB 3.69Å; A195-W211 HydrophobicContact CB-CD2 4.03Å; A195-W211 HydrophobicContact CB-CE3 4.37Å; A195-W211 HydrophobicContact CB-CG 3.72Å
196	P	95.9	Very high	89.9	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.032	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-36	-173.8	21.7	-32.7	0	0	0	113.6	L199 R200 W211 I240	P196-L199 PolarHBondContact O-N 3.32Å; P196-R200 WeakPolarHBondContact O-CG 3.42Å; P196-R200 PolarHBondContact O-N 3.3Å; P196-R200 PolarHBondContact O-NE 3.08Å; P196-R200 VanDerWaalsContact O-NE 3.13Å; P196-W211 VanDerWaalsContact CD-CZ3 3.41Å; P196-W211 HydrophobicContact CG-CE3 4.45Å; P196-W211 HydrophobicContact CG-CH2 4.11Å; P196-W211 HydrophobicContact CG-CZ3 3.9Å; P196-I240 HydrophobicContact CB-CG2 4.09Å; P196-I240 HydrophobicContact CG-CG2 4.4Å
197	E	95.4	Very high	91.7	Very high	21 Å²	21	36.4 Å²	36.4	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-39.5	175.3	72.5	-72.9	178.4	0	0	112.5	A195 R200 T201 C208 P268 R271	A195-E197 VanDerWaalsContact C-N 3.33Å; A195-E197 WeakPolarHBondContact CB-OE1 3.15Å; A195-E197 WeakPolarHBondContact CB-OE2 3.49Å; A195-E197 PolarHBondContact O-N 2.91Å; E197-R200 PolarHBondContact O-N 3.08Å; E197-T201 WeakPolarHBondContact O-CB 3.32Å; E197-T201 PolarHBondContact O-N 3.36Å; E197-T201 PolarHBondContact O-OG1 2.94Å; E197-C208 PolarHBondContact OE1-SG 2.77Å; E197-P268 HydrophobicContact CB-CG 4.4Å; E197-P268 HydrophobicContact CG-CG 3.8Å; E197-R271 IonicContact OE1-CZ 2.64Å; E197-R271 IonicContact OE1-NH1 3.69Å; E197-R271 PolarHBondContact OE1-NH1 3.39Å; E197-R271 IonicContact OE1-NH2 3.64Å; E197-R271 IonicContact OE2-CZ 2.89Å; E197-R271 IonicContact OE2-NH1 3.8Å; E197-R271 PolarHBondContact OE2-NH1 3.4Å; E197-R271 IonicContact OE2-NH2 2.72Å; E197-R271 PolarHBondContact OE2-NH2 3Å
198	A	94.1	Very high	93.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69.7	-36.3	176.9	0	0	0	0	0	111.1	T194 A195 G202 R203 Y204 C208	T194-A198 HydrophobicContact CG2-CB 3.71Å; A195-A198 PolarHBondContact O-N 3.03Å; A195-A198 VanDerWaalsContact O-N 3.07Å; A198-G202 WeakPolarHBondContact O-CA 3.29Å; A198-G202 PolarHBondContact O-N 2.75Å; A198-R203 VanDerWaalsContact CA-O 3.31Å; A198-R203 WeakPolarHBondContact CA-O 3.1Å; A198-R203 WeakPolarHBondContact CB-O 3.31Å; A198-Y204 HydrophobicContact CB-CD1 3.99Å; A198-Y204 HydrophobicContact CB-CD2 4.43Å; A198-Y204 HydrophobicContact CB-CE1 3.82Å; A198-Y204 HydrophobicContact CB-CE2 4.23Å; A198-Y204 HydrophobicContact CB-CG 4.3Å; A198-C208 HydrophobicContact CB-CB 4.48Å
199	L	92	Very high	94.6	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-62.2	-49.9	170.6	-68.1	179.2	0	0	0	111.6	I189 I191 T194 A195 P196 R237	I189-L199 HydrophobicContact CG2-CD2 4.05Å; I191-L199 HydrophobicContact CD1-CD2 3.47Å; I191-L199 VanDerWaalsContact CD1-CD2 3.47Å; I191-L199 HydrophobicContact CG2-CD1 4.37Å; I191-L199 HydrophobicContact CG2-CD2 4.31Å; T194-L199 HydrophobicContact CG2-CD2 3.69Å; T194-L199 HydrophobicContact CG2-CG 3.82Å; A195-L199 WeakPolarHBondContact O-CG 3.44Å; A195-L199 PolarHBondContact O-N 3.2Å; P196-L199 PolarHBondContact O-N 3.32Å; L199-R237 VanDerWaalsContact C-NH2 3.29Å; L199-R237 HydrophobicContact CD1-CG 4.21Å; L199-R237 PolarHBondContact O-NH2 3.45Å
200	R	91.1	Very high	95.2	Very high	136 Å²	136	26 Å²	26	51%	0.513	12%	0.12	S	C	.	.	H	α-helix	trans	-66.3	-49.6	-176.7	-73.5	175.7	-70.5	134.6	-7.7	112.4	K185 P196 E197 E241	K185-R200 PolarHBondContact NZ-O 3.38Å; P196-R200 WeakPolarHBondContact O-CG 3.42Å; P196-R200 PolarHBondContact O-N 3.3Å; P196-R200 PolarHBondContact O-NE 3.08Å; P196-R200 VanDerWaalsContact O-NE 3.13Å; E197-R200 PolarHBondContact O-N 3.08Å; R200-E241 WeakPolarHBondContact CG-OE1 3.4Å
201	T	90.7	Very high	95.5	Very high	71 Å²	71	25.1 Å²	25.1	44%	0.436	11%	0.114	S	C	.	.	H	α-helix	trans	-102	-22.2	-166.2	65.1	0	0	0	0	113.3	K185 E197 R203	K185-T201 WeakPolarHBondContact CE-O 3.47Å; K185-T201 PolarHBondContact NZ-O 2.75Å; K185-T201 VanDerWaalsContact NZ-O 3.11Å; E197-T201 WeakPolarHBondContact O-CB 3.32Å; E197-T201 PolarHBondContact O-N 3.36Å; E197-T201 PolarHBondContact O-OG1 2.94Å; T201-R203 VanDerWaalsContact OG1-CB 3.23Å; T201-R203 WeakPolarHBondContact OG1-CB 3.44Å; T201-R203 PolarHBondContact OG1-N 2.98Å; T201-R203 VanDerWaalsContact OG1-N 3.14Å
202	G	90.6	Very high	95.7	Very high	3 Å²	3	24.5 Å²	24.5	3%	0.031	11%	0.112	C	C	.	.			trans	76.3	7.5	-167.6	0	0	0	0	0	113.4	L182 A198 Y204	L182-G202 PolarHBondContact N-O 2.94Å; A198-G202 WeakPolarHBondContact O-CA 3.29Å; A198-G202 PolarHBondContact O-N 2.75Å; G202-Y204 WeakPolarHBondContact O-CD2 3.4Å
203	R	92.6	Very high	95.8	Very high	110 Å²	110	23.4 Å²	23.4	42%	0.415	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.1	179.4	-173.8	174	157.6	-179.7	-4.6	110.8	I179 Y180 E181 A198 T201	I179-R203 VanDerWaalsContact CD1-NH2 3.26Å; I179-R203 HydrophobicContact CG2-CG 3.6Å; I179-R203 VanDerWaalsContact CG2-NE 3.29Å; Y180-R203 CarbonylContact O-C 3.59Å; Y180-R203 WeakPolarHBondContact O-CA 3.41Å; E181-R203 HydrophobicContact CG-CB 4.18Å; E181-R203 HydrophobicContact CG-CG 4.01Å; A198-R203 VanDerWaalsContact CA-O 3.31Å; A198-R203 WeakPolarHBondContact CA-O 3.1Å; A198-R203 WeakPolarHBondContact CB-O 3.31Å; T201-R203 VanDerWaalsContact OG1-CB 3.23Å; T201-R203 WeakPolarHBondContact OG1-CB 3.44Å; T201-R203 PolarHBondContact OG1-N 2.98Å; T201-R203 VanDerWaalsContact OG1-N 3.14Å
204	Y	94.8	Very high	95.9	Very high	3 Å²	3	22 Å²	22	1%	0.012	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	144.2	179.1	-68.5	-100.8	0	0	0	110.3	R151 I179 Y180 L182 T194 A198 G202 C208	R151-Y204 HydrophobicContact CB-CD1 4.08Å; R151-Y204 HydrophobicContact CB-CE1 4.22Å; R151-Y204 HydrophobicContact CG-CD1 3.67Å; R151-Y204 HydrophobicContact CG-CE1 4.28Å; R151-Y204 HydrophobicContact CG-CG 4Å; I179-Y204 WeakPolarHBondContact CA-O 3.36Å; Y180-Y204 HydrophobicContact CD1-CD2 4.27Å; Y180-Y204 PolarHBondContact N-O 3.04Å; Y180-Y204 PolarHBondContact O-N 2.69Å; L182-Y204 HydrophobicContact CD1-CE2 3.65Å; L182-Y204 HydrophobicContact CG-CE2 3.94Å; T194-Y204 HydrophobicContact CG2-CE1 4.16Å; A198-Y204 HydrophobicContact CB-CD1 3.99Å; A198-Y204 HydrophobicContact CB-CD2 4.43Å; A198-Y204 HydrophobicContact CB-CE1 3.82Å; A198-Y204 HydrophobicContact CB-CE2 4.23Å; A198-Y204 HydrophobicContact CB-CG 4.3Å; G202-Y204 WeakPolarHBondContact O-CD2 3.4Å; Y204-C208 HydrophobicContact CD1-CB 4.24Å
205	T	96.6	Very high	96	Very high	28 Å²	28	21.8 Å²	21.8	17%	0.172	10%	0.1	C	C	.	.			trans	-141.2	173	169.5	64.3	0	0	0	0	107.8	I179 K207 C208	I179-T205 HydrophobicContact CG1-CG2 4.09Å; T205-K207 PolarHBondContact O-N 2.96Å; T205-K207 VanDerWaalsContact O-N 3.09Å; T205-K207 PolarHBondContact OG1-N 2.73Å; T205-C208 PolarHBondContact N-SG 3.29Å; T205-C208 VanDerWaalsContact N-SG 3.37Å; T205-C208 VanDerWaalsContact O-CB 3.29Å; T205-C208 WeakPolarHBondContact O-CB 3.34Å; T205-C208 PolarHBondContact O-N 2.88Å
206	I	97.2	Very high	96.1	Very high	33 Å²	33	21.8 Å²	21.8	17%	0.169	10%	0.1	C	C	.	.	H	α-helix	trans	-56.9	-26.3	172.9	-162.2	65.7	0	0	0	112.7	M140 E144 C208 D209 V210 F274	M140-I206 HydrophobicContact CE-CD1 4.27Å; E144-I206 HydrophobicContact CB-CD1 4.03Å; E144-I206 HydrophobicContact CB-CG1 3.85Å; E144-I206 HydrophobicContact CG-CG1 3.92Å; I206-C208 PolarHBondContact O-N 3.34Å; I206-D209 HydrophobicContact CD1-CB 4.38Å; I206-D209 WeakPolarHBondContact O-CB 3.49Å; I206-D209 PolarHBondContact O-N 3.16Å; I206-V210 PolarHBondContact O-N 3.4Å; I206-F274 HydrophobicContact CD1-CD2 4.18Å; I206-F274 HydrophobicContact CD1-CE2 3.98Å; I206-F274 HydrophobicContact CG1-CD2 3.97Å; I206-F274 HydrophobicContact CG1-CE2 3.97Å
207	K	98.3	Very high	96.2	Very high	35 Å²	35	21.6 Å²	21.6	15%	0.152	10%	0.099	C	C	.	.	H	α-helix	trans	-68	-21.1	175.7	-60.1	-60.8	-173.5	171.6	0	113.4	T205 V210 W211 P268 R271 P272	T205-K207 PolarHBondContact O-N 2.96Å; T205-K207 VanDerWaalsContact O-N 3.09Å; T205-K207 PolarHBondContact OG1-N 2.73Å; K207-V210 HydrophobicContact CD-CG2 4.48Å; K207-W211 PolarHBondContact O-N 3.29Å; K207-P268 HydrophobicContact CB-CB 3.9Å; K207-P268 WeakPolarHBondContact CD-O 3.4Å; K207-P268 HydrophobicContact CG-CB 4.39Å; K207-P268 WeakPolarHBondContact CG-O 3.39Å; K207-R271 HydrophobicContact CD-CB 4.38Å; K207-R271 PolarHBondContact NZ-O 2.81Å; K207-R271 WeakPolarHBondContact O-CD 3.34Å; K207-R271 PolarHBondContact O-NH1 2.97Å; K207-P272 PolarHBondContact NZ-O 2.87Å; K207-P272 VanDerWaalsContact NZ-O 3.08Å
208	C	98.1	Very high	96.3	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.014	10%	0.097	C	C	.	.	H	α-helix	trans	-74	-33.9	170.2	-52.2	0	0	0	0	111.2	A195 E197 A198 Y204 T205 I206 V210 W211 S212	A195-C208 HydrophobicContact CB-CB 4.07Å; E197-C208 PolarHBondContact OE1-SG 2.77Å; A198-C208 HydrophobicContact CB-CB 4.48Å; Y204-C208 HydrophobicContact CD1-CB 4.24Å; T205-C208 PolarHBondContact N-SG 3.29Å; T205-C208 VanDerWaalsContact N-SG 3.37Å; T205-C208 VanDerWaalsContact O-CB 3.29Å; T205-C208 WeakPolarHBondContact O-CB 3.34Å; T205-C208 PolarHBondContact O-N 2.88Å; I206-C208 PolarHBondContact O-N 3.34Å; C208-V210 VanDerWaalsContact C-N 3.34Å; C208-W211 WeakPolarHBondContact O-CB 3.35Å; C208-W211 PolarHBondContact O-N 3.13Å; C208-S212 PolarHBondContact O-N 2.91Å; C208-S212 VanDerWaalsContact O-N 3.13Å; C208-S212 PolarHBondContact O-OG 2.82Å
209	D	98.4	Very high	96.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-71.1	-32	173.1	-65.6	-30.4	0	0	0	111.4	M140 I149 H150 R151 I206 W211 S212 Y213 F274	M140-D209 HydrophobicContact CE-CB 3.55Å; I149-D209 WeakPolarHBondContact CA-OD2 3.38Å; I149-D209 WeakPolarHBondContact CG2-OD2 3.29Å; H150-D209 PolarHBondContact N-OD2 3.09Å; R151-D209 WeakPolarHBondContact CA-OD1 3.49Å; R151-D209 PolarHBondContact N-OD1 2.89Å; I206-D209 HydrophobicContact CD1-CB 4.38Å; I206-D209 WeakPolarHBondContact O-CB 3.49Å; I206-D209 PolarHBondContact O-N 3.16Å; D209-W211 VanDerWaalsContact C-N 3.31Å; D209-W211 PolarHBondContact O-N 3.11Å; D209-S212 CarbonylContact O-C 3.58Å; D209-S212 WeakPolarHBondContact O-CB 3.4Å; D209-S212 PolarHBondContact O-N 3.47Å; D209-S212 VanDerWaalsContact O-N 3.15Å; D209-Y213 WeakPolarHBondContact O-CB 3.24Å; D209-Y213 PolarHBondContact O-N 3.35Å; D209-F274 HydrophobicContact CB-CE2 3.97Å; D209-F274 HydrophobicContact CB-CZ 4.06Å
210	V	98.8	Very high	96.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.8	-42.1	171.5	173.3	0	0	0	0	111.3	I206 K207 C208 S212 Y213 G214 C263 R271 P272 F274 I277	I206-V210 PolarHBondContact O-N 3.4Å; K207-V210 HydrophobicContact CD-CG2 4.48Å; C208-V210 VanDerWaalsContact C-N 3.34Å; V210-S212 VanDerWaalsContact C-N 3.34Å; V210-S212 PolarHBondContact O-N 3.44Å; V210-Y213 WeakPolarHBondContact O-CB 3.44Å; V210-Y213 PolarHBondContact O-N 3.48Å; V210-G214 PolarHBondContact O-N 3.42Å; V210-G214 VanDerWaalsContact O-N 3.1Å; V210-C263 HydrophobicContact CG1-CB 4.01Å; V210-C263 WeakPolarHBondContact O-CB 3.29Å; V210-R271 HydrophobicContact CG1-CB 3.88Å; V210-P272 HydrophobicContact CG1-CG 4.23Å; V210-P272 WeakPolarHBondContact CG2-O 3.36Å; V210-F274 HydrophobicContact CB-CZ 4.39Å; V210-F274 HydrophobicContact CG2-CD2 4Å; V210-F274 HydrophobicContact CG2-CE1 4.33Å; V210-F274 HydrophobicContact CG2-CE2 3.63Å; V210-F274 HydrophobicContact CG2-CG 4.5Å; V210-F274 HydrophobicContact CG2-CZ 3.82Å; V210-I277 HydrophobicContact CG1-CD1 3.98Å; V210-I277 HydrophobicContact CG2-CD1 4.4Å
211	W	98.7	Very high	97.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-59.3	-47.4	172.4	176.9	-73.7	0	0	0	111.6	W193 A195 P196 K207 C208 D209 Y213 G214 V215 I240 R245 C263 W264	W193-W211 VanDerWaalsContact O-CD1 3.24Å; A195-W211 HydrophobicContact CB-CB 3.69Å; A195-W211 HydrophobicContact CB-CD2 4.03Å; A195-W211 HydrophobicContact CB-CE3 4.37Å; A195-W211 HydrophobicContact CB-CG 3.72Å; P196-W211 VanDerWaalsContact CD-CZ3 3.41Å; P196-W211 HydrophobicContact CG-CE3 4.45Å; P196-W211 HydrophobicContact CG-CH2 4.11Å; P196-W211 HydrophobicContact CG-CZ3 3.9Å; K207-W211 PolarHBondContact O-N 3.29Å; C208-W211 WeakPolarHBondContact O-CB 3.35Å; C208-W211 PolarHBondContact O-N 3.13Å; D209-W211 VanDerWaalsContact C-N 3.31Å; D209-W211 PolarHBondContact O-N 3.11Å; W211-Y213 PolarHBondContact O-N 2.81Å; W211-G214 PolarHBondContact O-N 2.84Å; W211-V215 PolarHBondContact O-N 3Å; W211-I240 HydrophobicContact CH2-CG2 3.66Å; W211-I240 HydrophobicContact CZ2-CD1 4.21Å; W211-I240 HydrophobicContact CZ2-CG1 4.36Å; W211-I240 HydrophobicContact CZ2-CG2 3.68Å; W211-R245 VanDerWaalsContact CH2-CZ 3.44Å; W211-C263 WeakPolarHBondContact CA-O 3.46Å; W211-W264 AromaticContact CD2-CD1 3.61Å; W211-W264 HydrophobicContact CD2-CG 4.44Å; W211-W264 AromaticContact CE2-CD1 3.84Å; W211-W264 HydrophobicContact CE3-CB 4.11Å; W211-W264 AromaticContact CE3-CD1 3.89Å; W211-W264 HydrophobicContact CE3-CG 4.37Å; W211-W264 AromaticContact CG-CD1 3.92Å; W211-W264 HydrophobicContact CH2-CB 4.26Å; W211-W264 HydrophobicContact CZ3-CB 3.91Å; W211-W264 HydrophobicContact CZ3-CG 4.45Å; W211-W264 WeakPolarHBondContact CZ3-O 3.43Å; W211-W264 PolarHBondContact O-NE1 3.09Å; W211-W264 VanDerWaalsContact O-NE1 3.15Å
212	S	98.7	Very high	97.5	Very high	5 Å²	5	12.9 Å²	12.9	4%	0.035	6%	0.06	C	C	.	.	H	α-helix	trans	-59.4	-37.6	178.6	-52	0	0	0	0	111.3	W193 C208 D209 V210 V215 L216	W193-S212 WeakPolarHBondContact O-CA 3.45Å; W193-S212 PolarHBondContact O-OG 3.03Å; C208-S212 PolarHBondContact O-N 2.91Å; C208-S212 VanDerWaalsContact O-N 3.13Å; C208-S212 PolarHBondContact O-OG 2.82Å; D209-S212 CarbonylContact O-C 3.58Å; D209-S212 WeakPolarHBondContact O-CB 3.4Å; D209-S212 PolarHBondContact O-N 3.47Å; D209-S212 VanDerWaalsContact O-N 3.15Å; V210-S212 VanDerWaalsContact C-N 3.34Å; V210-S212 PolarHBondContact O-N 3.44Å; S212-V215 WeakPolarHBondContact O-CB 3.42Å; S212-V215 PolarHBondContact O-N 3.41Å; S212-V215 VanDerWaalsContact O-N 3.14Å; S212-L216 PolarHBondContact O-N 3.23Å
213	Y	98.9	Very high	97.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.6	-39.3	174.6	179.9	-93.9	0	0	0	112.3	S133 A136 A137 L153 D209 V210 W211 V215 L216 L217 F274 I277 I281	S133-Y213 PolarHBondContact O-OH 3.07Å; A136-Y213 HydrophobicContact CB-CD2 4.44Å; A136-Y213 HydrophobicContact CB-CE2 3.88Å; A137-Y213 HydrophobicContact CB-CE2 4.02Å; L153-Y213 HydrophobicContact CD2-CD2 4.29Å; D209-Y213 WeakPolarHBondContact O-CB 3.24Å; D209-Y213 PolarHBondContact O-N 3.35Å; V210-Y213 WeakPolarHBondContact O-CB 3.44Å; V210-Y213 PolarHBondContact O-N 3.48Å; W211-Y213 PolarHBondContact O-N 2.81Å; Y213-V215 VanDerWaalsContact C-N 3.27Å; Y213-V215 PolarHBondContact O-N 3.23Å; Y213-L216 HydrophobicContact CD2-CD2 4.36Å; Y213-L216 WeakPolarHBondContact O-CB 3.45Å; Y213-L216 PolarHBondContact O-N 3.14Å; Y213-L216 VanDerWaalsContact O-N 3.13Å; Y213-L217 HydrophobicContact CD1-CD1 4.16Å; Y213-L217 HydrophobicContact CD1-CG 4.14Å; Y213-L217 HydrophobicContact CE1-CD1 3.64Å; Y213-L217 HydrophobicContact CE1-CD2 3.9Å; Y213-L217 HydrophobicContact CE1-CG 3.66Å; Y213-L217 PolarHBondContact O-N 3.42Å; Y213-F274 HydrophobicContact CD1-CE1 4.44Å; Y213-F274 AromaticContact CD2-CE1 3.98Å; Y213-F274 HydrophobicContact CD2-CE1 3.98Å; Y213-F274 AromaticContact CG-CE1 3.78Å; Y213-F274 HydrophobicContact CG-CE1 3.78Å; Y213-I277 HydrophobicContact CD1-CD1 4.09Å; Y213-I277 HydrophobicContact CD1-CG2 4.06Å; Y213-I277 HydrophobicContact CE1-CD1 4.42Å; Y213-I277 HydrophobicContact CE1-CG2 3.34Å; Y213-I281 WeakPolarHBondContact OH-CD1 3.06Å
214	G	98.7	Very high	98	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-58	-40.5	171.4	0	0	0	0	0	112.3	V210 W211 L217 W218 M260 W264	V210-G214 PolarHBondContact O-N 3.42Å; V210-G214 VanDerWaalsContact O-N 3.1Å; W211-G214 PolarHBondContact O-N 2.84Å; G214-L217 PolarHBondContact O-N 3.11Å; G214-W218 PolarHBondContact O-N 3.01Å; G214-W218 VanDerWaalsContact O-N 3.17Å; G214-M260 WeakPolarHBondContact O-CG 3.36Å; G214-W264 VanDerWaalsContact O-CZ2 3.24Å; G214-W264 WeakPolarHBondContact O-CZ2 3.49Å
215	V	98.8	Very high	98.1	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-68.4	-38.3	174.7	-173.7	0	0	0	0	111.3	W193 W211 S212 Y213 L217 W218 E219 P227 L246 W264	W193-V215 VanDerWaalsContact CD1-CG1 3.43Å; W193-V215 HydrophobicContact CD2-CG1 4.36Å; W193-V215 HydrophobicContact CG-CB 4.35Å; W193-V215 HydrophobicContact CG-CG1 3.99Å; W211-V215 PolarHBondContact O-N 3Å; S212-V215 WeakPolarHBondContact O-CB 3.42Å; S212-V215 PolarHBondContact O-N 3.41Å; S212-V215 VanDerWaalsContact O-N 3.14Å; Y213-V215 VanDerWaalsContact C-N 3.27Å; Y213-V215 PolarHBondContact O-N 3.23Å; V215-L217 PolarHBondContact O-N 2.95Å; V215-W218 WeakPolarHBondContact O-CB 3.4Å; V215-W218 PolarHBondContact O-N 3.36Å; V215-W218 VanDerWaalsContact O-N 3.16Å; V215-E219 WeakPolarHBondContact O-CG 3.47Å; V215-E219 PolarHBondContact O-N 3Å; V215-P227 HydrophobicContact CG1-CB 4.02Å; V215-P227 HydrophobicContact CG1-CG 3.57Å; V215-L246 HydrophobicContact CG1-CD1 4.48Å; V215-W264 HydrophobicContact CG2-CZ2 4.07Å
216	L	98.8	Very high	98.2	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61.3	-42.3	174	175.8	62.2	0	0	0	112.2	L113 A136 L153 A155 S212 Y213 W218 E219 I220	L113-L216 HydrophobicContact CD2-CD1 3.93Å; A136-L216 HydrophobicContact CB-CD2 3.71Å; L153-L216 HydrophobicContact CD1-CD2 4.09Å; L153-L216 HydrophobicContact CD2-CD2 4.36Å; L153-L216 HydrophobicContact CG-CD2 4.17Å; A155-L216 HydrophobicContact CB-CD1 3.88Å; S212-L216 PolarHBondContact O-N 3.23Å; Y213-L216 HydrophobicContact CD2-CD2 4.36Å; Y213-L216 WeakPolarHBondContact O-CB 3.45Å; Y213-L216 PolarHBondContact O-N 3.14Å; Y213-L216 VanDerWaalsContact O-N 3.13Å; L216-W218 VanDerWaalsContact C-N 3.28Å; L216-W218 PolarHBondContact O-N 3Å; L216-E219 WeakPolarHBondContact O-CB 3.5Å; L216-E219 PolarHBondContact O-N 3.09Å; L216-I220 HydrophobicContact CD1-CD1 4.15Å; L216-I220 HydrophobicContact CD1-CG1 4.26Å; L216-I220 HydrophobicContact CG-CD1 3.99Å; L216-I220 VanDerWaalsContact O-CG1 3.3Å; L216-I220 WeakPolarHBondContact O-CG1 3.44Å; L216-I220 PolarHBondContact O-N 3.39Å
217	L	98.5	Very high	98.2	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-57.1	-45.2	172.6	-71.8	-179.1	0	0	0	111	S133 Y213 G214 V215 I220 F221 M252 L256 M260	S133-L217 WeakPolarHBondContact OG-CD2 3.34Å; Y213-L217 HydrophobicContact CD1-CD1 4.16Å; Y213-L217 HydrophobicContact CD1-CG 4.14Å; Y213-L217 HydrophobicContact CE1-CD1 3.64Å; Y213-L217 HydrophobicContact CE1-CD2 3.9Å; Y213-L217 HydrophobicContact CE1-CG 3.66Å; Y213-L217 PolarHBondContact O-N 3.42Å; G214-L217 PolarHBondContact O-N 3.11Å; V215-L217 PolarHBondContact O-N 2.95Å; L217-I220 PolarHBondContact O-N 2.96Å; L217-F221 WeakPolarHBondContact O-CD2 3.45Å; L217-F221 PolarHBondContact O-N 3.26Å; L217-M252 HydrophobicContact CB-CE 4.23Å; L217-L256 HydrophobicContact CD1-CD1 3.94Å; L217-L256 HydrophobicContact CD1-CG 4.49Å; L217-L256 HydrophobicContact CD2-CD1 4.21Å; L217-M260 HydrophobicContact CB-CG 4.23Å; L217-M260 HydrophobicContact CB-SD 4.39Å; L217-M260 HydrophobicContact CD1-CB 3.94Å; L217-M260 HydrophobicContact CD1-CG 4.25Å
218	W	98.6	Very high	98.2	Very high	17 Å²	17	8.8 Å²	8.8	6%	0.064	5%	0.047	C	C	.	.	H	α-helix	trans	-61.3	-44.5	176.7	-172	93.1	0	0	0	111.7	G214 V215 L216 I220 F221 T222 D225 P227 L246 P247 M260 W264	G214-W218 PolarHBondContact O-N 3.01Å; G214-W218 VanDerWaalsContact O-N 3.17Å; V215-W218 WeakPolarHBondContact O-CB 3.4Å; V215-W218 PolarHBondContact O-N 3.36Å; V215-W218 VanDerWaalsContact O-N 3.16Å; L216-W218 VanDerWaalsContact C-N 3.28Å; L216-W218 PolarHBondContact O-N 3Å; W218-I220 PolarHBondContact O-N 3.49Å; W218-F221 PolarHBondContact O-N 3.39Å; W218-T222 HydrophobicContact CD2-CG2 3.8Å; W218-T222 HydrophobicContact CE3-CG2 4.06Å; W218-T222 HydrophobicContact CG-CG2 4.45Å; W218-T222 HydrophobicContact CH2-CG2 3.89Å; W218-T222 HydrophobicContact CZ2-CG2 3.62Å; W218-T222 HydrophobicContact CZ3-CG2 4.09Å; W218-T222 WeakPolarHBondContact O-CB 2.82Å; W218-T222 WeakPolarHBondContact O-CG2 3.49Å; W218-T222 PolarHBondContact O-N 3.05Å; W218-T222 PolarHBondContact O-OG1 3.17Å; W218-D225 HydrophobicContact CH2-CB 3.71Å; W218-D225 HydrophobicContact CZ3-CB 3.87Å; W218-P227 HydrophobicContact CE3-CG 4.09Å; W218-P227 HydrophobicContact CZ3-CB 4.42Å; W218-P227 HydrophobicContact CZ3-CG 4.05Å; W218-L246 HydrophobicContact CB-CD1 4.22Å; W218-L246 HydrophobicContact CD2-CB 4.5Å; W218-L246 HydrophobicContact CD2-CD1 3.83Å; W218-L246 HydrophobicContact CE3-CD1 4.27Å; W218-L246 HydrophobicContact CG-CB 4.19Å; W218-L246 HydrophobicContact CG-CD1 3.79Å; W218-L246 HydrophobicContact CZ2-CD2 4.3Å; W218-P247 PolarHBondContact NE1-O 2.95Å; W218-M260 HydrophobicContact CB-SD 3.95Å; W218-W264 HydrophobicContact CB-CH2 4.25Å; W218-W264 HydrophobicContact CB-CZ2 4.44Å
219	E	98.6	Very high	98.1	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.009	7%	0.072	C	C	.	.	H	α-helix	trans	-59.5	-44.7	175	-70.9	-176.6	102.1	0	0	111.8	A155 W193 V215 L216 F221 T222 F223 G224 P227	A155-E219 HydrophobicContact CB-CB 3.99Å; A155-E219 HydrophobicContact CB-CG 4.41Å; A155-E219 WeakPolarHBondContact CB-OE1 3.36Å; A155-E219 PolarHBondContact N-OE2 3.02Å; W193-E219 WeakPolarHBondContact CZ2-OE1 3.36Å; W193-E219 VanDerWaalsContact NE1-CD 3.34Å; W193-E219 PolarHBondContact NE1-OE2 2.73Å; V215-E219 WeakPolarHBondContact O-CG 3.47Å; V215-E219 PolarHBondContact O-N 3Å; L216-E219 WeakPolarHBondContact O-CB 3.5Å; L216-E219 PolarHBondContact O-N 3.09Å; E219-F221 PolarHBondContact O-N 2.95Å; E219-T222 PolarHBondContact O-N 2.96Å; E219-T222 PolarHBondContact O-OG1 2.65Å; E219-F223 PolarHBondContact O-N 2.88Å; E219-G224 PolarHBondContact O-N 2.9Å; E219-P227 HydrophobicContact CG-CG 4.14Å
220	I	98.2	Very high	97.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.4	-49.1	179.3	-71.2	166.9	0	0	0	110.6	L113 L117 L129 M132 L216 L217 W218 T222 F223	L113-I220 HydrophobicContact CD2-CD1 4.32Å; L113-I220 HydrophobicContact CD2-CG1 3.97Å; L117-I220 HydrophobicContact CD1-CG1 4.39Å; L129-I220 HydrophobicContact CB-CG2 3.83Å; L129-I220 HydrophobicContact CD2-CG2 3.9Å; L129-I220 HydrophobicContact CG-CG2 4.4Å; M132-I220 HydrophobicContact CB-CD1 4.35Å; L216-I220 HydrophobicContact CD1-CD1 4.15Å; L216-I220 HydrophobicContact CD1-CG1 4.26Å; L216-I220 HydrophobicContact CG-CD1 3.99Å; L216-I220 VanDerWaalsContact O-CG1 3.3Å; L216-I220 WeakPolarHBondContact O-CG1 3.44Å; L216-I220 PolarHBondContact O-N 3.39Å; L217-I220 PolarHBondContact O-N 2.96Å; W218-I220 PolarHBondContact O-N 3.49Å; I220-T222 PolarHBondContact O-N 3.02Å; I220-F223 PolarHBondContact O-N 3.13Å
221	F	97.9	Very high	97.8	Very high	3 Å²	3	25.4 Å²	25.4	1%	0.013	12%	0.121	C	C	.	.	H	α-helix	trans	-81.8	-11.4	-175	-81.1	-95.6	0	0	0	114.7	V126 L129 L130 L217 W218 E219 P249 L251 M252 L256	V126-F221 HydrophobicContact CG1-CE1 4.33Å; L129-F221 HydrophobicContact CB-CE1 4.17Å; L129-F221 HydrophobicContact CB-CE2 4.13Å; L129-F221 HydrophobicContact CB-CZ 3.9Å; L129-F221 HydrophobicContact CD1-CD1 4.1Å; L129-F221 HydrophobicContact CD1-CE1 4.24Å; L130-F221 HydrophobicContact CD2-CZ 3.94Å; L130-F221 HydrophobicContact CG-CZ 4.22Å; L217-F221 WeakPolarHBondContact O-CD2 3.45Å; L217-F221 PolarHBondContact O-N 3.26Å; W218-F221 PolarHBondContact O-N 3.39Å; E219-F221 PolarHBondContact O-N 2.95Å; F221-P249 HydrophobicContact CB-CB 4.09Å; F221-P249 HydrophobicContact CB-CG 3.84Å; F221-L251 HydrophobicContact CD1-CB 4.49Å; F221-M252 HydrophobicContact CB-CB 4.4Å; F221-M252 HydrophobicContact CB-CE 3.73Å; F221-M252 HydrophobicContact CD1-CB 3.82Å; F221-M252 HydrophobicContact CD1-CE 4.48Å; F221-M252 HydrophobicContact CD1-CG 4.29Å; F221-M252 HydrophobicContact CD2-CE 3.64Å; F221-M252 HydrophobicContact CE1-CB 4.35Å; F221-M252 HydrophobicContact CE2-CE 4.42Å; F221-M252 HydrophobicContact CG-CB 4.14Å; F221-M252 HydrophobicContact CG-CE 3.68Å; F221-M252 HydrophobicContact CG-CG 4.37Å; F221-L256 HydrophobicContact CD2-CD2 4.12Å; F221-L256 HydrophobicContact CE1-CD2 4.29Å; F221-L256 HydrophobicContact CE2-CD2 3.26Å; F221-L256 HydrophobicContact CZ-CD2 3.36Å
222	T	97.3	Very high	97.7	Very high	30 Å²	30	28.3 Å²	28.3	18%	0.184	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	5.9	167.9	56.1	0	0	0	0	113.3	W218 E219 I220 G224 D225 P249	W218-T222 HydrophobicContact CD2-CG2 3.8Å; W218-T222 HydrophobicContact CE3-CG2 4.06Å; W218-T222 HydrophobicContact CG-CG2 4.45Å; W218-T222 HydrophobicContact CH2-CG2 3.89Å; W218-T222 HydrophobicContact CZ2-CG2 3.62Å; W218-T222 HydrophobicContact CZ3-CG2 4.09Å; W218-T222 WeakPolarHBondContact O-CB 2.82Å; W218-T222 WeakPolarHBondContact O-CG2 3.49Å; W218-T222 PolarHBondContact O-N 3.05Å; W218-T222 PolarHBondContact O-OG1 3.17Å; E219-T222 PolarHBondContact O-N 2.96Å; E219-T222 PolarHBondContact O-OG1 2.65Å; I220-T222 PolarHBondContact O-N 3.02Å; T222-G224 VanDerWaalsContact C-N 3.27Å; T222-G224 PolarHBondContact O-N 3.49Å; T222-D225 HydrophobicContact CG2-CB 4.41Å; T222-D225 PolarHBondContact OG1-N 3.16Å; T222-P249 HydrophobicContact CG2-CB 4.1Å; T222-P249 HydrophobicContact CG2-CG 3.39Å
223	F	97.7	Very high	97.5	Very high	12 Å²	12	32.2 Å²	32.2	5%	0.053	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	40.1	-175.8	-56.6	-89.9	0	0	0	113.6	L117 R118 N122 L124 L129 E219 I220 L251	L117-F223 CarbonylContact C-O 3.47Å; R118-F223 PolarHBondContact N-O 3.12Å; N122-F223 HydrophobicContact CB-CD1 4.48Å; N122-F223 HydrophobicContact CB-CD2 3.82Å; N122-F223 HydrophobicContact CB-CE1 4.4Å; N122-F223 HydrophobicContact CB-CE2 3.72Å; N122-F223 HydrophobicContact CB-CG 4.19Å; N122-F223 HydrophobicContact CB-CZ 4.03Å; N122-F223 WeakPolarHBondContact OD1-CB 3.44Å; N122-F223 WeakPolarHBondContact OD1-CD2 3.35Å; N122-F223 WeakPolarHBondContact OD1-CG 3.36Å; L124-F223 HydrophobicContact CB-CE1 4.03Å; L129-F223 HydrophobicContact CD1-CE1 4.15Å; L129-F223 HydrophobicContact CD1-CZ 3.96Å; L129-F223 HydrophobicContact CD2-CE1 4.12Å; E219-F223 PolarHBondContact O-N 2.88Å; I220-F223 PolarHBondContact O-N 3.13Å; F223-L251 HydrophobicContact CE2-CD1 3.56Å; F223-L251 HydrophobicContact CZ-CD1 3.95Å
224	G	97.5	Very high	97.3	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.01	19%	0.185	C	C	.	.	S	Bend	trans	82.4	31.9	174.3	0	0	0	0	0	113.7	R118 E219 T222	R118-G224 VanDerWaalsContact CZ-O 3.27Å; R118-G224 PolarHBondContact NE-O 2.77Å; R118-G224 PolarHBondContact NH2-O 2.65Å; E219-G224 PolarHBondContact O-N 2.9Å; T222-G224 VanDerWaalsContact C-N 3.27Å; T222-G224 PolarHBondContact O-N 3.49Å
225	D	96.8	Very high	97.2	Very high	59 Å²	59	41.7 Å²	41.7	32%	0.316	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-63.5	165.8	168.8	-164	12	0	0	0	110.6	W218 T222 P227 R229	W218-D225 HydrophobicContact CH2-CB 3.71Å; W218-D225 HydrophobicContact CZ3-CB 3.87Å; T222-D225 HydrophobicContact CG2-CB 4.41Å; T222-D225 PolarHBondContact OG1-N 3.16Å; D225-P227 WeakPolarHBondContact O-CD 3.34Å; D225-R229 IonicContact OD1-CZ 4Å; D225-R229 IonicContact OD1-NE 2.7Å; D225-R229 PolarHBondContact OD1-NE 2.93Å; D225-R229 IonicContact OD1-NH2 3.79Å; D225-R229 PolarHBondContact OD1-NH2 2.96Å
226	V	97.3	Very high	97.1	Very high	41 Å²	41	41.7 Å²	41.7	25%	0.248	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-90.4	117.8	-179.2	176.3	0	0	0	0	108.8	Y228 R229	V226-Y228 PolarHBondContact O-N 3.22Å; V226-R229 HydrophobicContact CB-CB 4.29Å; V226-R229 HydrophobicContact CG1-CB 4.48Å; V226-R229 WeakPolarHBondContact O-CB 3.44Å; V226-R229 PolarHBondContact O-N 3.43Å
227	P	98.1	Very high	96.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	137.8	174.4	-26.9	35.7	0	0	0	111.1	K192 W193 V215 W218 E219 D225 R229 L246	K192-P227 HydrophobicContact CB-CB 4.34Å; K192-P227 VanDerWaalsContact CD-O 3.26Å; K192-P227 WeakPolarHBondContact CD-O 3.44Å; K192-P227 WeakPolarHBondContact CE-O 3.49Å; K192-P227 PolarHBondContact NZ-O 3.15Å; W193-P227 HydrophobicContact CH2-CG 4.29Å; W193-P227 HydrophobicContact CZ2-CG 3.78Å; V215-P227 HydrophobicContact CG1-CB 4.02Å; V215-P227 HydrophobicContact CG1-CG 3.57Å; W218-P227 HydrophobicContact CE3-CG 4.09Å; W218-P227 HydrophobicContact CZ3-CB 4.42Å; W218-P227 HydrophobicContact CZ3-CG 4.05Å; E219-P227 HydrophobicContact CG-CG 4.14Å; D225-P227 WeakPolarHBondContact O-CD 3.34Å; P227-R229 PolarHBondContact O-N 2.87Å; P227-R229 VanDerWaalsContact O-N 3.08Å; P227-L246 HydrophobicContact CB-CD1 4.05Å
228	Y	97.5	Very high	96.8	Very high	11 Å²	11	48.1 Å²	48.1	4%	0.043	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	39.3	176.6	-47.8	-78.1	0	0	0	112.7	K192 V226 N230 W231 T236 I240 Y244 L246	K192-Y228 HydrophobicContact CB-CD2 4.11Å; K192-Y228 HydrophobicContact CG-CD2 4.39Å; K192-Y228 PolarHBondContact NZ-O 3.38Å; V226-Y228 PolarHBondContact O-N 3.22Å; Y228-N230 PolarHBondContact O-N 3.22Å; Y228-W231 AromaticContact CD1-CE3 3.79Å; Y228-W231 HydrophobicContact CD1-CE3 3.79Å; Y228-W231 AromaticContact CD1-CZ3 3.67Å; Y228-W231 HydrophobicContact CD1-CZ3 3.67Å; Y228-W231 HydrophobicContact CE1-CZ3 4.38Å; Y228-W231 HydrophobicContact CG-CE3 4.32Å; Y228-W231 PolarHBondContact O-N 3.14Å; Y228-T236 HydrophobicContact CD1-CG2 4.15Å; Y228-T236 HydrophobicContact CD2-CG2 3.5Å; Y228-T236 VanDerWaalsContact CD2-CG2 3.5Å; Y228-T236 HydrophobicContact CE2-CG2 4.04Å; Y228-T236 HydrophobicContact CG-CG2 3.55Å; Y228-I240 HydrophobicContact CE1-CG1 4.32Å; Y228-I240 HydrophobicContact CE2-CD1 4.12Å; Y228-Y244 HydrophobicContact CD1-CD1 4.4Å; Y228-Y244 HydrophobicContact CD1-CE1 4.17Å; Y228-Y244 HydrophobicContact CE1-CD1 4.01Å; Y228-Y244 HydrophobicContact CE1-CE1 4.01Å; Y228-L246 HydrophobicContact CD1-CD2 3.64Å; Y228-L246 HydrophobicContact CD1-CG 4.23Å; Y228-L246 HydrophobicContact CD2-CD2 4.14Å; Y228-L246 HydrophobicContact CE1-CD2 3.64Å; Y228-L246 HydrophobicContact CE1-CG 3.7Å; Y228-L246 HydrophobicContact CE2-CD1 3.97Å; Y228-L246 HydrophobicContact CE2-CD2 4.12Å; Y228-L246 HydrophobicContact CE2-CG 3.99Å; Y228-L246 HydrophobicContact CG-CD2 3.92Å
229	R	95.8	Very high	96.7	Very high	141 Å²	141	50.1 Å²	50.1	53%	0.532	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-38.5	-171.1	177	176.5	-72.6	-80.7	7.9	114.1	D225 V226 P227 W231	D225-R229 IonicContact OD1-CZ 4Å; D225-R229 IonicContact OD1-NE 2.7Å; D225-R229 PolarHBondContact OD1-NE 2.93Å; D225-R229 IonicContact OD1-NH2 3.79Å; D225-R229 PolarHBondContact OD1-NH2 2.96Å; V226-R229 HydrophobicContact CB-CB 4.29Å; V226-R229 HydrophobicContact CG1-CB 4.48Å; V226-R229 WeakPolarHBondContact O-CB 3.44Å; V226-R229 PolarHBondContact O-N 3.43Å; P227-R229 PolarHBondContact O-N 2.87Å; P227-R229 VanDerWaalsContact O-N 3.08Å; R229-W231 VanDerWaalsContact C-N 3.27Å; R229-W231 PolarHBondContact O-N 3.37Å
230	N	95.7	Very high	96.6	Very high	144 Å²	144	50 Å²	50	77%	0.77	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.8	-173.3	-59.9	-22.7	0	0	0	113.9	Y228	Y228-N230 PolarHBondContact O-N 3.22Å
231	W	96.6	Very high	96.3	Very high	67 Å²	67	54.6 Å²	54.6	25%	0.254	27%	0.267	S	S	.	.	S	Bend	trans	-120.4	140.8	-175.8	-62.6	-31.9	0	0	0	111.8	K192 Y228 R229 Q235 M239 Y244	K192-W231 PolarHBondContact NZ-O 3.41Å; Y228-W231 AromaticContact CD1-CE3 3.79Å; Y228-W231 HydrophobicContact CD1-CE3 3.79Å; Y228-W231 AromaticContact CD1-CZ3 3.67Å; Y228-W231 HydrophobicContact CD1-CZ3 3.67Å; Y228-W231 HydrophobicContact CE1-CZ3 4.38Å; Y228-W231 HydrophobicContact CG-CE3 4.32Å; Y228-W231 PolarHBondContact O-N 3.14Å; R229-W231 VanDerWaalsContact C-N 3.27Å; R229-W231 PolarHBondContact O-N 3.37Å; W231-Q235 HydrophobicContact CB-CB 3.76Å; W231-Q235 HydrophobicContact CG-CB 4.15Å; W231-M239 HydrophobicContact CD2-CG 3.86Å; W231-M239 HydrophobicContact CE3-CB 3.84Å; W231-M239 HydrophobicContact CE3-CG 3.68Å; W231-M239 HydrophobicContact CH2-CB 4.02Å; W231-M239 HydrophobicContact CH2-CE 3.62Å; W231-M239 HydrophobicContact CH2-CG 3.73Å; W231-M239 HydrophobicContact CH2-SD 4.35Å; W231-M239 HydrophobicContact CZ2-CE 3.84Å; W231-M239 HydrophobicContact CZ2-CG 3.89Å; W231-M239 HydrophobicContact CZ2-SD 4.27Å; W231-M239 HydrophobicContact CZ3-CB 3.55Å; W231-M239 HydrophobicContact CZ3-CE 4.33Å; W231-M239 HydrophobicContact CZ3-CG 3.61Å; W231-Y244 AromaticContact CH2-CD1 3.54Å; W231-Y244 HydrophobicContact CH2-CD1 3.54Å; W231-Y244 HydrophobicContact CH2-CD2 4.11Å; W231-Y244 AromaticContact CH2-CE1 3.4Å; W231-Y244 HydrophobicContact CH2-CE1 3.4Å; W231-Y244 VanDerWaalsContact CH2-CE1 3.4Å; W231-Y244 AromaticContact CH2-CE2 3.99Å; W231-Y244 HydrophobicContact CH2-CE2 3.99Å; W231-Y244 AromaticContact CH2-CG 3.9Å; W231-Y244 HydrophobicContact CH2-CG 3.9Å; W231-Y244 AromaticContact CH2-CZ 3.64Å; W231-Y244 AromaticContact CZ3-CD1 3.44Å; W231-Y244 HydrophobicContact CZ3-CD1 3.44Å; W231-Y244 VanDerWaalsContact CZ3-CD1 3.44Å; W231-Y244 AromaticContact CZ3-CE1 3.42Å; W231-Y244 HydrophobicContact CZ3-CE1 3.42Å; W231-Y244 VanDerWaalsContact CZ3-CE1 3.42Å; W231-Y244 HydrophobicContact CZ3-CG 4.17Å
232	S	96.8	Very high	96.2	Very high	60 Å²	60	58.4 Å²	58.4	42%	0.42	30%	0.295	S	S	.	.			trans	-62.8	169.8	165.6	74	0	0	0	0	110.7	Q234 Q235 T236	S232-Q234 VanDerWaalsContact C-N 3.3Å; S232-Q234 PolarHBondContact O-N 3.07Å; S232-Q235 PolarHBondContact O-N 3.1Å; S232-Q235 WeakPolarHBondContact OG-CG 3.44Å; S232-Q235 PolarHBondContact OG-N 2.82Å; S232-Q235 PolarHBondContact OG-OE1 3.47Å; S232-T236 WeakPolarHBondContact O-CB 3.13Å; S232-T236 PolarHBondContact O-N 3.34Å; S232-T236 PolarHBondContact O-OG1 3.27Å
233	N	94.3	Very high	96.1	Very high	88 Å²	88	58.8 Å²	58.8	47%	0.471	30%	0.304	S	S	.	.	H	α-helix	trans	-60.9	-38.8	176.4	-79.6	-4.3	0	0	0	112.4	I191 T236 R237	I191-N233 HydrophobicContact CB-CB 4.17Å; I191-N233 HydrophobicContact CG1-CB 3.99Å; I191-N233 HydrophobicContact CG2-CB 4.22Å; I191-N233 WeakPolarHBondContact CG2-O 3.32Å; N233-T236 PolarHBondContact O-N 2.8Å; N233-R237 PolarHBondContact O-N 2.96Å
234	Q	94.3	Very high	96	Very high	104 Å²	104	62.5 Å²	62.5	49%	0.486	32%	0.319	S	S	.	.	H	α-helix	trans	-67	-49.5	177.2	-173.6	58.3	48.2	0	0	110.8	S232 T236 R237 D238	S232-Q234 VanDerWaalsContact C-N 3.3Å; S232-Q234 PolarHBondContact O-N 3.07Å; Q234-T236 VanDerWaalsContact C-N 3.26Å; Q234-T236 PolarHBondContact O-N 2.82Å; Q234-R237 WeakPolarHBondContact O-CB 3.49Å; Q234-R237 PolarHBondContact O-N 3.05Å; Q234-R237 VanDerWaalsContact O-N 3.08Å; Q234-D238 PolarHBondContact NE2-OD1 2.95Å; Q234-D238 PolarHBondContact O-N 3.04Å
235	Q	97.2	Very high	96	Very high	94 Å²	94	64.5 Å²	64.5	44%	0.439	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-38.6	176.6	-72.2	169.1	-40.8	0	0	111.9	W231 S232 R237 D238 M239	W231-Q235 HydrophobicContact CB-CB 3.76Å; W231-Q235 HydrophobicContact CG-CB 4.15Å; S232-Q235 PolarHBondContact O-N 3.1Å; S232-Q235 WeakPolarHBondContact OG-CG 3.44Å; S232-Q235 PolarHBondContact OG-N 2.82Å; S232-Q235 PolarHBondContact OG-OE1 3.47Å; Q235-R237 VanDerWaalsContact C-N 3.34Å; Q235-R237 PolarHBondContact O-N 2.97Å; Q235-D238 PolarHBondContact O-N 3.27Å; Q235-M239 WeakPolarHBondContact O-CB 3.5Å; Q235-M239 VanDerWaalsContact O-CG 3.24Å; Q235-M239 WeakPolarHBondContact O-CG 3.3Å; Q235-M239 PolarHBondContact O-N 3.31Å
236	T	96.7	Very high	96	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-42.5	176.8	-57.5	0	0	0	0	111.2	K192 Y228 S232 N233 Q234 M239 I240	K192-T236 HydrophobicContact CG-CG2 4.13Å; Y228-T236 HydrophobicContact CD1-CG2 4.15Å; Y228-T236 HydrophobicContact CD2-CG2 3.5Å; Y228-T236 VanDerWaalsContact CD2-CG2 3.5Å; Y228-T236 HydrophobicContact CE2-CG2 4.04Å; Y228-T236 HydrophobicContact CG-CG2 3.55Å; S232-T236 WeakPolarHBondContact O-CB 3.13Å; S232-T236 PolarHBondContact O-N 3.34Å; S232-T236 PolarHBondContact O-OG1 3.27Å; N233-T236 PolarHBondContact O-N 2.8Å; Q234-T236 VanDerWaalsContact C-N 3.26Å; Q234-T236 PolarHBondContact O-N 2.82Å; T236-M239 PolarHBondContact O-N 2.85Å; T236-I240 HydrophobicContact CG2-CD1 3.75Å; T236-I240 HydrophobicContact CG2-CG1 4.36Å; T236-I240 WeakPolarHBondContact O-CB 3.49Å; T236-I240 VanDerWaalsContact O-CG1 3.28Å; T236-I240 WeakPolarHBondContact O-CG1 3.26Å; T236-I240 PolarHBondContact O-N 3.42Å
237	R	94.6	Very high	96	Very high	61 Å²	61	64.2 Å²	64.2	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-58.4	-51.6	174.3	-176.9	-169	-127.6	125.3	-1.8	110.5	L199 N233 Q234 Q235 M239 I240 E241	L199-R237 VanDerWaalsContact C-NH2 3.29Å; L199-R237 HydrophobicContact CD1-CG 4.21Å; L199-R237 PolarHBondContact O-NH2 3.45Å; N233-R237 PolarHBondContact O-N 2.96Å; Q234-R237 WeakPolarHBondContact O-CB 3.49Å; Q234-R237 PolarHBondContact O-N 3.05Å; Q234-R237 VanDerWaalsContact O-N 3.08Å; Q235-R237 VanDerWaalsContact C-N 3.34Å; Q235-R237 PolarHBondContact O-N 2.97Å; R237-M239 VanDerWaalsContact C-N 3.3Å; R237-M239 PolarHBondContact O-N 2.97Å; R237-I240 PolarHBondContact O-N 2.9Å; R237-E241 IonicContact NE-OE1 2.63Å; R237-E241 WeakPolarHBondContact O-CG 3.45Å; R237-E241 PolarHBondContact O-N 3.08Å
238	D	95.9	Very high	95.8	Very high	75 Å²	75	64.7 Å²	64.7	40%	0.401	33%	0.331	S	S	.	.	H	α-helix	trans	-60.1	-42	-177.5	-53.8	-22.6	0	0	0	111	Q234 Q235 E241 S242	Q234-D238 PolarHBondContact NE2-OD1 2.95Å; Q234-D238 PolarHBondContact O-N 3.04Å; Q235-D238 PolarHBondContact O-N 3.27Å; D238-E241 PolarHBondContact O-N 3.41Å; D238-S242 PolarHBondContact O-N 3.26Å
239	M	96.6	Very high	95.7	Very high	58 Å²	58	65 Å²	65	29%	0.286	34%	0.335	S	S	.	.	H	α-helix	trans	-67.1	-43.2	177.4	-69.1	-56.4	-58.5	0	0	112.3	W231 Q235 T236 R237 E241 S242 G243 Y244	W231-M239 HydrophobicContact CD2-CG 3.86Å; W231-M239 HydrophobicContact CE3-CB 3.84Å; W231-M239 HydrophobicContact CE3-CG 3.68Å; W231-M239 HydrophobicContact CH2-CB 4.02Å; W231-M239 HydrophobicContact CH2-CE 3.62Å; W231-M239 HydrophobicContact CH2-CG 3.73Å; W231-M239 HydrophobicContact CH2-SD 4.35Å; W231-M239 HydrophobicContact CZ2-CE 3.84Å; W231-M239 HydrophobicContact CZ2-CG 3.89Å; W231-M239 HydrophobicContact CZ2-SD 4.27Å; W231-M239 HydrophobicContact CZ3-CB 3.55Å; W231-M239 HydrophobicContact CZ3-CE 4.33Å; W231-M239 HydrophobicContact CZ3-CG 3.61Å; Q235-M239 WeakPolarHBondContact O-CB 3.5Å; Q235-M239 VanDerWaalsContact O-CG 3.24Å; Q235-M239 WeakPolarHBondContact O-CG 3.3Å; Q235-M239 PolarHBondContact O-N 3.31Å; T236-M239 PolarHBondContact O-N 2.85Å; R237-M239 VanDerWaalsContact C-N 3.3Å; R237-M239 PolarHBondContact O-N 2.97Å; M239-E241 VanDerWaalsContact C-N 3.31Å; M239-E241 PolarHBondContact O-N 3.13Å; M239-S242 PolarHBondContact O-N 3.41Å; M239-S242 PolarHBondContact O-OG 2.99Å; M239-G243 PolarHBondContact O-N 3.18Å; M239-Y244 HydrophobicContact CE-CD2 4.11Å; M239-Y244 HydrophobicContact CE-CG 3.98Å; M239-Y244 VanDerWaalsContact O-CB 3.27Å; M239-Y244 WeakPolarHBondContact O-CB 3.28Å; M239-Y244 PolarHBondContact O-N 2.95Å
240	I	95.5	Very high	95.5	Very high	1 Å²	1	66 Å²	66	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-60.8	-43.4	175.3	-72.7	169.1	0	0	0	110.6	P196 W211 Y228 T236 R237 S242 G243 R245	P196-I240 HydrophobicContact CB-CG2 4.09Å; P196-I240 HydrophobicContact CG-CG2 4.4Å; W211-I240 HydrophobicContact CH2-CG2 3.66Å; W211-I240 HydrophobicContact CZ2-CD1 4.21Å; W211-I240 HydrophobicContact CZ2-CG1 4.36Å; W211-I240 HydrophobicContact CZ2-CG2 3.68Å; Y228-I240 HydrophobicContact CE1-CG1 4.32Å; Y228-I240 HydrophobicContact CE2-CD1 4.12Å; T236-I240 HydrophobicContact CG2-CD1 3.75Å; T236-I240 HydrophobicContact CG2-CG1 4.36Å; T236-I240 WeakPolarHBondContact O-CB 3.49Å; T236-I240 VanDerWaalsContact O-CG1 3.28Å; T236-I240 WeakPolarHBondContact O-CG1 3.26Å; T236-I240 PolarHBondContact O-N 3.42Å; R237-I240 PolarHBondContact O-N 2.9Å; I240-S242 VanDerWaalsContact C-N 3.29Å; I240-S242 PolarHBondContact O-N 3.28Å; I240-G243 PolarHBondContact O-N 3.39Å; I240-G243 VanDerWaalsContact O-N 3.07Å; I240-R245 PolarHBondContact O-NH1 3.28Å
241	E	92.4	Very high	95.3	Very high	95 Å²	95	63.5 Å²	63.5	44%	0.444	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-30.5	177.5	-73.6	-178.6	177	0	0	112.6	R200 R237 D238 M239 G243	R200-E241 WeakPolarHBondContact CG-OE1 3.4Å; R237-E241 IonicContact NE-OE1 2.63Å; R237-E241 WeakPolarHBondContact O-CG 3.45Å; R237-E241 PolarHBondContact O-N 3.08Å; D238-E241 PolarHBondContact O-N 3.41Å; M239-E241 VanDerWaalsContact C-N 3.31Å; M239-E241 PolarHBondContact O-N 3.13Å; E241-G243 PolarHBondContact O-N 2.85Å
242	S	94.9	Very high	95.3	Very high	84 Å²	84	60.6 Å²	60.6	59%	0.587	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-3	172.5	77.1	0	0	0	0	114.6	D238 M239 I240	D238-S242 PolarHBondContact O-N 3.26Å; M239-S242 PolarHBondContact O-N 3.41Å; M239-S242 PolarHBondContact O-OG 2.99Å; I240-S242 VanDerWaalsContact C-N 3.29Å; I240-S242 PolarHBondContact O-N 3.28Å
243	G	95.1	Very high	95.2	Very high	38 Å²	38	58.8 Å²	58.8	39%	0.392	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	0.8	-178.4	0	0	0	0	0	114.6	M239 I240 E241 R245	M239-G243 PolarHBondContact O-N 3.18Å; I240-G243 PolarHBondContact O-N 3.39Å; I240-G243 VanDerWaalsContact O-N 3.07Å; E241-G243 PolarHBondContact O-N 2.85Å; G243-R245 PolarHBondContact O-NH1 3.01Å
244	Y	96.6	Very high	95.2	Very high	90 Å²	90	60 Å²	60	35%	0.353	32%	0.323	S	S	.	.			trans	-66	140.3	176	-178	-86.8	0	0	0	111.3	Y228 W231 M239	Y228-Y244 HydrophobicContact CD1-CD1 4.4Å; Y228-Y244 HydrophobicContact CD1-CE1 4.17Å; Y228-Y244 HydrophobicContact CE1-CD1 4.01Å; Y228-Y244 HydrophobicContact CE1-CE1 4.01Å; W231-Y244 AromaticContact CH2-CD1 3.54Å; W231-Y244 HydrophobicContact CH2-CD1 3.54Å; W231-Y244 HydrophobicContact CH2-CD2 4.11Å; W231-Y244 AromaticContact CH2-CE1 3.4Å; W231-Y244 HydrophobicContact CH2-CE1 3.4Å; W231-Y244 VanDerWaalsContact CH2-CE1 3.4Å; W231-Y244 AromaticContact CH2-CE2 3.99Å; W231-Y244 HydrophobicContact CH2-CE2 3.99Å; W231-Y244 AromaticContact CH2-CG 3.9Å; W231-Y244 HydrophobicContact CH2-CG 3.9Å; W231-Y244 AromaticContact CH2-CZ 3.64Å; W231-Y244 AromaticContact CZ3-CD1 3.44Å; W231-Y244 HydrophobicContact CZ3-CD1 3.44Å; W231-Y244 VanDerWaalsContact CZ3-CD1 3.44Å; W231-Y244 AromaticContact CZ3-CE1 3.42Å; W231-Y244 HydrophobicContact CZ3-CE1 3.42Å; W231-Y244 VanDerWaalsContact CZ3-CE1 3.42Å; W231-Y244 HydrophobicContact CZ3-CG 4.17Å; M239-Y244 HydrophobicContact CE-CD2 4.11Å; M239-Y244 HydrophobicContact CE-CG 3.98Å; M239-Y244 VanDerWaalsContact O-CB 3.27Å; M239-Y244 WeakPolarHBondContact O-CB 3.28Å; M239-Y244 PolarHBondContact O-N 2.95Å
245	R	97.2	Very high	95.2	Very high	43 Å²	43	59.7 Å²	59.7	16%	0.162	32%	0.318	C	S	.	.			trans	-132.5	155.4	175.5	-60.7	-60.6	-179.1	-93.4	-1.9	110.5	W211 I240 G243 W264 D266	W211-R245 VanDerWaalsContact CH2-CZ 3.44Å; I240-R245 PolarHBondContact O-NH1 3.28Å; G243-R245 PolarHBondContact O-NH1 3.01Å; R245-W264 HydrophobicContact CB-CE3 3.94Å; R245-W264 HydrophobicContact CB-CZ3 4.32Å; R245-W264 HydrophobicContact CG-CB 4.39Å; R245-W264 HydrophobicContact CG-CE3 4.33Å; R245-W264 PolarHBondContact NE-O 3.37Å; R245-W264 PolarHBondContact NH2-O 3.33Å; R245-D266 IonicContact CZ-OD1 2.66Å; R245-D266 IonicContact NH2-OD1 3.96Å; R245-D266 PolarHBondContact NH2-OD1 2.81Å; R245-D266 IonicContact NH2-OD2 3.15Å
246	L	97.4	Very high	95.2	Very high	9 Å²	9	55.2 Å²	55.2	5%	0.047	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-61.5	138	178.6	-65.9	163.1	0	0	0	110.3	V215 W218 P227 Y228 W264	V215-L246 HydrophobicContact CG1-CD1 4.48Å; W218-L246 HydrophobicContact CB-CD1 4.22Å; W218-L246 HydrophobicContact CD2-CB 4.5Å; W218-L246 HydrophobicContact CD2-CD1 3.83Å; W218-L246 HydrophobicContact CE3-CD1 4.27Å; W218-L246 HydrophobicContact CG-CB 4.19Å; W218-L246 HydrophobicContact CG-CD1 3.79Å; W218-L246 HydrophobicContact CZ2-CD2 4.3Å; P227-L246 HydrophobicContact CB-CD1 4.05Å; Y228-L246 HydrophobicContact CD1-CD2 3.64Å; Y228-L246 HydrophobicContact CD1-CG 4.23Å; Y228-L246 HydrophobicContact CD2-CD2 4.14Å; Y228-L246 HydrophobicContact CE1-CD2 3.64Å; Y228-L246 HydrophobicContact CE1-CG 3.7Å; Y228-L246 HydrophobicContact CE2-CD1 3.97Å; Y228-L246 HydrophobicContact CE2-CD2 4.12Å; Y228-L246 HydrophobicContact CE2-CG 3.99Å; Y228-L246 HydrophobicContact CG-CD2 3.92Å; L246-W264 HydrophobicContact CB-CH2 3.72Å; L246-W264 HydrophobicContact CB-CZ3 4.04Å; L246-W264 HydrophobicContact CD1-CH2 3.99Å; L246-W264 HydrophobicContact CD1-CZ2 4.09Å; L246-W264 HydrophobicContact CG-CH2 4.32Å
247	P	96.3	Very high	95.1	Very high	84 Å²	84	59 Å²	59	55%	0.545	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-67.7	137	172.9	29.1	-33.6	0	0	0	109.4	W218	W218-P247 PolarHBondContact NE1-O 2.95Å
248	A	95.2	Very high	95.2	Very high	11 Å²	11	59.3 Å²	59.3	9%	0.091	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-71.3	136.1	178.2	0	0	0	0	0	111.5	M252 R257 M260	A248-M252 HydrophobicContact CB-SD 4.11Å; A248-R257 HydrophobicContact CB-CB 4Å; A248-R257 HydrophobicContact CB-CG 3.5Å; A248-R257 PolarHBondContact O-NH1 3.48Å; A248-R257 PolarHBondContact O-NH2 3.49Å; A248-M260 HydrophobicContact CB-CE 3.61Å
249	P	94.4	Very high	95.3	Very high	18 Å²	18	55.8 Å²	55.8	12%	0.117	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-63.6	151.9	-178.4	-22.7	36.1	0	0	0	112.7	F221 T222 L251 M252 R257	F221-P249 HydrophobicContact CB-CB 4.09Å; F221-P249 HydrophobicContact CB-CG 3.84Å; T222-P249 HydrophobicContact CG2-CB 4.1Å; T222-P249 HydrophobicContact CG2-CG 3.39Å; P249-L251 VanDerWaalsContact C-N 3.26Å; P249-L251 PolarHBondContact O-N 2.88Å; P249-M252 VanDerWaalsContact O-CB 3.29Å; P249-M252 WeakPolarHBondContact O-CB 3.41Å; P249-M252 PolarHBondContact O-N 3.23Å; P249-R257 PolarHBondContact O-NH2 2.94Å
250	D	91.5	Very high	95.3	Very high	162 Å²	162	53 Å²	53	87%	0.866	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-33.9	-175.8	-64.8	-24.6	0	0	0	113.2	M252	D250-M252 VanDerWaalsContact C-N 3.25Å; D250-M252 PolarHBondContact O-N 3.18Å
251	L	92.6	Very high	95.4	Very high	91 Å²	91	56.6 Å²	56.6	48%	0.476	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-11.9	179.2	-68.2	171.1	0	0	0	113.7	F221 F223 P249 P253	F221-L251 HydrophobicContact CD1-CB 4.49Å; F223-L251 HydrophobicContact CE2-CD1 3.56Å; F223-L251 HydrophobicContact CZ-CD1 3.95Å; P249-L251 VanDerWaalsContact C-N 3.26Å; P249-L251 PolarHBondContact O-N 2.88Å; L251-P253 WeakPolarHBondContact O-CD 3.39Å
252	M	95.6	Very high	95.7	Very high	7 Å²	7	56.4 Å²	56.4	3%	0.034	31%	0.305	C	S	.	.	S	Bend	trans	-75.5	121.7	-176.8	-175.6	174.8	-78.8	0	0	110.4	L217 F221 A248 P249 D250 L256 R257 M260	L217-M252 HydrophobicContact CB-CE 4.23Å; F221-M252 HydrophobicContact CB-CB 4.4Å; F221-M252 HydrophobicContact CB-CE 3.73Å; F221-M252 HydrophobicContact CD1-CB 3.82Å; F221-M252 HydrophobicContact CD1-CE 4.48Å; F221-M252 HydrophobicContact CD1-CG 4.29Å; F221-M252 HydrophobicContact CD2-CE 3.64Å; F221-M252 HydrophobicContact CE1-CB 4.35Å; F221-M252 HydrophobicContact CE2-CE 4.42Å; F221-M252 HydrophobicContact CG-CB 4.14Å; F221-M252 HydrophobicContact CG-CE 3.68Å; F221-M252 HydrophobicContact CG-CG 4.37Å; A248-M252 HydrophobicContact CB-SD 4.11Å; P249-M252 VanDerWaalsContact O-CB 3.29Å; P249-M252 WeakPolarHBondContact O-CB 3.41Å; P249-M252 PolarHBondContact O-N 3.23Å; D250-M252 VanDerWaalsContact C-N 3.25Å; D250-M252 PolarHBondContact O-N 3.18Å; M252-L256 HydrophobicContact CE-CD2 4.5Å; M252-L256 HydrophobicContact CG-CB 4.02Å; M252-L256 HydrophobicContact CG-CD2 4.13Å; M252-L256 HydrophobicContact CG-CG 4.11Å; M252-L256 HydrophobicContact SD-CG 4.34Å; M252-R257 HydrophobicContact CG-CB 4.32Å; M252-R257 HydrophobicContact SD-CB 4.09Å; M252-M260 HydrophobicContact CE-SD 3.74Å; M252-M260 HydrophobicContact SD-CB 4.38Å; M252-M260 HydrophobicContact SD-CE 4.14Å; M252-M260 HydrophobicContact SD-SD 3.93Å
253	P	94.9	Very high	95.9	Very high	22 Å²	22	52.4 Å²	52.4	14%	0.143	28%	0.277	C	S	.	.			trans	-53.8	143.8	174.3	-26.2	34.9	0	0	0	111.7	V126 L251 W255 L256 R257	V126-P253 HydrophobicContact CG1-CG 4.29Å; L251-P253 WeakPolarHBondContact O-CD 3.39Å; P253-W255 VanDerWaalsContact C-N 3.26Å; P253-W255 HydrophobicContact CB-CG 4.37Å; P253-W255 PolarHBondContact O-N 2.87Å; P253-L256 HydrophobicContact CB-CB 4.4Å; P253-L256 PolarHBondContact O-N 2.8Å; P253-R257 PolarHBondContact O-N 3.1Å
254	V	95	Very high	96	Very high	113 Å²	113	50.8 Å²	50.8	69%	0.685	26%	0.259	S	S	*	.	H	α-helix	trans	-55.4	-42	-176	176.9	0	0	0	0	111.9	L256 R257 T258	V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 3.15Å; V254-R257 WeakPolarHBondContact O-CB 3.46Å; V254-R257 PolarHBondContact O-N 2.99Å; V254-T258 PolarHBondContact O-N 3.14Å; V254-T258 PolarHBondContact O-OG1 3.49Å
255	W	94.3	Very high	96.1	Very high	97 Å²	97	50 Å²	50	37%	0.367	26%	0.259	S	S	.	.	H	α-helix	trans	-62.8	-38.6	177.9	67.1	-99.8	0	0	0	112.1	L130 P253 T258 L259 I281	L130-W255 HydrophobicContact CD2-CH2 3.87Å; L130-W255 HydrophobicContact CD2-CZ2 3.64Å; P253-W255 VanDerWaalsContact C-N 3.26Å; P253-W255 HydrophobicContact CB-CG 4.37Å; P253-W255 PolarHBondContact O-N 2.87Å; W255-T258 WeakPolarHBondContact O-CB 3.39Å; W255-T258 PolarHBondContact O-N 3.15Å; W255-L259 PolarHBondContact O-N 3.15Å; W255-I281 HydrophobicContact CH2-CB 4.4Å; W255-I281 HydrophobicContact CH2-CG1 4.13Å; W255-I281 HydrophobicContact CH2-CG2 4.32Å; W255-I281 HydrophobicContact CZ3-CG1 3.99Å
256	L	96	Very high	96	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-73.6	-34.2	179.4	-173.7	62.8	0	0	0	111.3	L130 L217 F221 M252 P253 V254 T258 L259 M260 I281	L130-L256 HydrophobicContact CD2-CD2 3.74Å; L217-L256 HydrophobicContact CD1-CD1 3.94Å; L217-L256 HydrophobicContact CD1-CG 4.49Å; L217-L256 HydrophobicContact CD2-CD1 4.21Å; F221-L256 HydrophobicContact CD2-CD2 4.12Å; F221-L256 HydrophobicContact CE1-CD2 4.29Å; F221-L256 HydrophobicContact CE2-CD2 3.26Å; F221-L256 HydrophobicContact CZ-CD2 3.36Å; M252-L256 HydrophobicContact CE-CD2 4.5Å; M252-L256 HydrophobicContact CG-CB 4.02Å; M252-L256 HydrophobicContact CG-CD2 4.13Å; M252-L256 HydrophobicContact CG-CG 4.11Å; M252-L256 HydrophobicContact SD-CG 4.34Å; P253-L256 HydrophobicContact CB-CB 4.4Å; P253-L256 PolarHBondContact O-N 2.8Å; V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 3.15Å; L256-T258 VanDerWaalsContact C-N 3.29Å; L256-T258 PolarHBondContact O-N 3.36Å; L256-L259 HydrophobicContact CD1-CB 4.45Å; L256-L259 HydrophobicContact CD1-CD2 4.05Å; L256-L259 PolarHBondContact O-N 3.43Å; L256-M260 WeakPolarHBondContact O-CB 3.48Å; L256-M260 PolarHBondContact O-N 3.42Å; L256-I281 HydrophobicContact CD1-CD1 4.44Å; L256-I281 HydrophobicContact CD1-CG1 4.37Å
257	R	96.2	Very high	96	Very high	81 Å²	81	56.6 Å²	56.6	31%	0.306	29%	0.294	S	S	.	.	H	α-helix	trans	-57.6	-44.4	169.2	169.4	-177.3	-50.9	-109.7	-5.9	111	A248 P249 M252 P253 V254 M260 N261	A248-R257 HydrophobicContact CB-CB 4Å; A248-R257 HydrophobicContact CB-CG 3.5Å; A248-R257 PolarHBondContact O-NH1 3.48Å; A248-R257 PolarHBondContact O-NH2 3.49Å; P249-R257 PolarHBondContact O-NH2 2.94Å; M252-R257 HydrophobicContact CG-CB 4.32Å; M252-R257 HydrophobicContact SD-CB 4.09Å; P253-R257 PolarHBondContact O-N 3.1Å; V254-R257 WeakPolarHBondContact O-CB 3.46Å; V254-R257 PolarHBondContact O-N 2.99Å; R257-M260 PolarHBondContact O-N 3.31Å; R257-N261 PolarHBondContact O-N 3.44Å; R257-N261 PolarHBondContact O-ND2 3.29Å
258	T	96.3	Very high	96.1	Very high	67 Å²	67	53.6 Å²	53.6	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.9	-59.5	0	0	0	0	111.3	V254 W255 L256 M260 N261 H262	V254-T258 PolarHBondContact O-N 3.14Å; V254-T258 PolarHBondContact O-OG1 3.49Å; W255-T258 WeakPolarHBondContact O-CB 3.39Å; W255-T258 PolarHBondContact O-N 3.15Å; L256-T258 VanDerWaalsContact C-N 3.29Å; L256-T258 PolarHBondContact O-N 3.36Å; T258-M260 PolarHBondContact O-N 3.49Å; T258-N261 PolarHBondContact O-N 3.27Å; T258-H262 VanDerWaalsContact CG2-CE1 3.45Å; T258-H262 WeakPolarHBondContact CG2-CE1 3.45Å; T258-H262 PolarHBondContact O-N 3.49Å; T258-H262 PolarHBondContact O-ND1 3.13Å
259	L	96.9	Very high	96.1	Very high	1 Å²	1	60 Å²	60	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-45.5	175.7	179.9	55.9	0	0	0	112.5	W255 L256 N261 H262 C263 P272 I277 E280 I281	W255-L259 PolarHBondContact O-N 3.15Å; L256-L259 HydrophobicContact CD1-CB 4.45Å; L256-L259 HydrophobicContact CD1-CD2 4.05Å; L256-L259 PolarHBondContact O-N 3.43Å; L259-N261 VanDerWaalsContact C-N 3.33Å; L259-N261 PolarHBondContact O-N 3.04Å; L259-H262 WeakPolarHBondContact O-CB 3.43Å; L259-H262 PolarHBondContact O-N 3.24Å; L259-C263 PolarHBondContact O-N 3.37Å; L259-C263 PolarHBondContact O-SG 2.99Å; L259-P272 HydrophobicContact CD1-CG 4.19Å; L259-I277 HydrophobicContact CD1-CG1 4.05Å; L259-I277 HydrophobicContact CD2-CG2 4.22Å; L259-E280 WeakPolarHBondContact CD1-OE2 3.4Å; L259-E280 HydrophobicContact CD2-CB 4.24Å; L259-I281 HydrophobicContact CD2-CD1 4.12Å; L259-I281 HydrophobicContact CD2-CG1 3.85Å
260	M	98	Very high	96.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-43.7	177.1	-173.3	-170.9	68.2	0	0	111.3	G214 L217 W218 A248 M252 L256 R257 T258 H262 C263 W264	G214-M260 WeakPolarHBondContact O-CG 3.36Å; L217-M260 HydrophobicContact CB-CG 4.23Å; L217-M260 HydrophobicContact CB-SD 4.39Å; L217-M260 HydrophobicContact CD1-CB 3.94Å; L217-M260 HydrophobicContact CD1-CG 4.25Å; W218-M260 HydrophobicContact CB-SD 3.95Å; A248-M260 HydrophobicContact CB-CE 3.61Å; M252-M260 HydrophobicContact CE-SD 3.74Å; M252-M260 HydrophobicContact SD-CB 4.38Å; M252-M260 HydrophobicContact SD-CE 4.14Å; M252-M260 HydrophobicContact SD-SD 3.93Å; L256-M260 WeakPolarHBondContact O-CB 3.48Å; L256-M260 PolarHBondContact O-N 3.42Å; R257-M260 PolarHBondContact O-N 3.31Å; T258-M260 PolarHBondContact O-N 3.49Å; M260-H262 PolarHBondContact O-N 3.34Å; M260-C263 VanDerWaalsContact O-CB 3.28Å; M260-C263 WeakPolarHBondContact O-CB 3.29Å; M260-C263 PolarHBondContact O-N 3.02Å; M260-C263 VanDerWaalsContact O-N 3.14Å; M260-W264 HydrophobicContact CE-CE3 4.43Å; M260-W264 HydrophobicContact CE-CH2 3.56Å; M260-W264 HydrophobicContact CE-CZ3 3.44Å; M260-W264 VanDerWaalsContact CE-CZ3 3.44Å; M260-W264 HydrophobicContact CG-CE3 4.44Å; M260-W264 HydrophobicContact CG-CH2 3.71Å; M260-W264 HydrophobicContact CG-CZ2 3.95Å; M260-W264 HydrophobicContact CG-CZ3 4Å; M260-W264 PolarHBondContact O-N 3.19Å; M260-W264 HydrophobicContact SD-CH2 3.45Å; M260-W264 WeakPolarHBondContact SD-CH2 3.4Å; M260-W264 HydrophobicContact SD-CZ2 4.09Å; M260-W264 HydrophobicContact SD-CZ3 3.95Å
261	N	97.4	Very high	96.6	Very high	75 Å²	75	56.3 Å²	56.3	40%	0.401	28%	0.284	S	S	.	.	H	α-helix	trans	-64.8	-38.2	176.2	-72.9	-20.9	0	0	0	112.3	R257 T258 L259 C263 W264 H265	R257-N261 PolarHBondContact O-N 3.44Å; R257-N261 PolarHBondContact O-ND2 3.29Å; T258-N261 PolarHBondContact O-N 3.27Å; L259-N261 VanDerWaalsContact C-N 3.33Å; L259-N261 PolarHBondContact O-N 3.04Å; N261-C263 PolarHBondContact O-N 3.05Å; N261-W264 CarbonylContact O-C 3.58Å; N261-W264 PolarHBondContact O-N 3.19Å; N261-H265 PolarHBondContact O-N 2.98Å
262	H	97.9	Very high	96.9	Very high	91 Å²	91	52.5 Å²	52.5	42%	0.421	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-31	173.2	-67.3	152.4	0	0	0	112.7	T258 L259 M260 W264 H265 P272	T258-H262 VanDerWaalsContact CG2-CE1 3.45Å; T258-H262 WeakPolarHBondContact CG2-CE1 3.45Å; T258-H262 PolarHBondContact O-N 3.49Å; T258-H262 PolarHBondContact O-ND1 3.13Å; L259-H262 WeakPolarHBondContact O-CB 3.43Å; L259-H262 PolarHBondContact O-N 3.24Å; M260-H262 PolarHBondContact O-N 3.34Å; H262-W264 PolarHBondContact O-N 3.4Å; H262-H265 PolarHBondContact O-N 3.37Å; H262-P272 HydrophobicContact CB-CG 4.49Å; H262-P272 WeakPolarHBondContact O-CD 3.49Å
263	C	98.7	Very high	97.1	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-23.2	173.2	-62.9	0	0	0	0	112.7	V210 W211 L259 M260 N261 R271	V210-C263 HydrophobicContact CG1-CB 4.01Å; V210-C263 WeakPolarHBondContact O-CB 3.29Å; W211-C263 WeakPolarHBondContact CA-O 3.46Å; L259-C263 PolarHBondContact O-N 3.37Å; L259-C263 PolarHBondContact O-SG 2.99Å; M260-C263 VanDerWaalsContact O-CB 3.28Å; M260-C263 WeakPolarHBondContact O-CB 3.29Å; M260-C263 PolarHBondContact O-N 3.02Å; M260-C263 VanDerWaalsContact O-N 3.14Å; N261-C263 PolarHBondContact O-N 3.05Å; C263-R271 VanDerWaalsContact O-CD 3.29Å; C263-R271 WeakPolarHBondContact O-CD 3.44Å
264	W	98.4	Very high	97.2	Very high	4 Å²	4	53 Å²	53	2%	0.015	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	20.5	-179.2	-58.7	-34.8	0	0	0	114.7	W211 G214 V215 W218 R245 L246 M260 N261 H262 D266	W211-W264 AromaticContact CD2-CD1 3.61Å; W211-W264 HydrophobicContact CD2-CG 4.44Å; W211-W264 AromaticContact CE2-CD1 3.84Å; W211-W264 HydrophobicContact CE3-CB 4.11Å; W211-W264 AromaticContact CE3-CD1 3.89Å; W211-W264 HydrophobicContact CE3-CG 4.37Å; W211-W264 AromaticContact CG-CD1 3.92Å; W211-W264 HydrophobicContact CH2-CB 4.26Å; W211-W264 HydrophobicContact CZ3-CB 3.91Å; W211-W264 HydrophobicContact CZ3-CG 4.45Å; W211-W264 WeakPolarHBondContact CZ3-O 3.43Å; W211-W264 PolarHBondContact O-NE1 3.09Å; W211-W264 VanDerWaalsContact O-NE1 3.15Å; G214-W264 VanDerWaalsContact O-CZ2 3.24Å; G214-W264 WeakPolarHBondContact O-CZ2 3.49Å; V215-W264 HydrophobicContact CG2-CZ2 4.07Å; W218-W264 HydrophobicContact CB-CH2 4.25Å; W218-W264 HydrophobicContact CB-CZ2 4.44Å; R245-W264 HydrophobicContact CB-CE3 3.94Å; R245-W264 HydrophobicContact CB-CZ3 4.32Å; R245-W264 HydrophobicContact CG-CB 4.39Å; R245-W264 HydrophobicContact CG-CE3 4.33Å; R245-W264 PolarHBondContact NE-O 3.37Å; R245-W264 PolarHBondContact NH2-O 3.33Å; L246-W264 HydrophobicContact CB-CH2 3.72Å; L246-W264 HydrophobicContact CB-CZ3 4.04Å; L246-W264 HydrophobicContact CD1-CH2 3.99Å; L246-W264 HydrophobicContact CD1-CZ2 4.09Å; L246-W264 HydrophobicContact CG-CH2 4.32Å; M260-W264 HydrophobicContact CE-CE3 4.43Å; M260-W264 HydrophobicContact CE-CH2 3.56Å; M260-W264 HydrophobicContact CE-CZ3 3.44Å; M260-W264 VanDerWaalsContact CE-CZ3 3.44Å; M260-W264 HydrophobicContact CG-CE3 4.44Å; M260-W264 HydrophobicContact CG-CH2 3.71Å; M260-W264 HydrophobicContact CG-CZ2 3.95Å; M260-W264 HydrophobicContact CG-CZ3 4Å; M260-W264 PolarHBondContact O-N 3.19Å; M260-W264 HydrophobicContact SD-CH2 3.45Å; M260-W264 WeakPolarHBondContact SD-CH2 3.4Å; M260-W264 HydrophobicContact SD-CZ2 4.09Å; M260-W264 HydrophobicContact SD-CZ3 3.95Å; N261-W264 CarbonylContact O-C 3.58Å; N261-W264 PolarHBondContact O-N 3.19Å; H262-W264 PolarHBondContact O-N 3.4Å; W264-D266 PolarHBondContact O-N 2.87Å
265	H	98	Very high	97.3	Very high	73 Å²	73	50.1 Å²	50.1	34%	0.338	25%	0.254	S	S	.	.			trans	-57.2	137.1	170.3	-166.1	-65.5	0	0	0	110.2	N261 H262 E267 N270 R271	N261-H265 PolarHBondContact O-N 2.98Å; H262-H265 PolarHBondContact O-N 3.37Å; H265-E267 PolarHBondContact ND1-N 2.92Å; H265-E267 PolarHBondContact ND1-O 3.09Å; H265-N270 HydrophobicContact CB-CB 4.29Å; H265-N270 PolarHBondContact CE1-ND2 2.77Å; H265-N270 WeakPolarHBondContact ND1-CB 3.47Å; H265-N270 PolarHBondContact NE2-ND2 3.28Å; H265-N270 VanDerWaalsContact NE2-ND2 3.18Å; H265-R271 HydrophobicContact CB-CG 4.02Å; H265-R271 PolarHBondContact O-NE 2.77Å; H265-R271 PolarHBondContact O-NH2 3.06Å
266	D	95.8	Very high	97.4	Very high	92 Å²	92	50.6 Å²	50.6	49%	0.492	26%	0.259	S	S	.	.	S	Bend	trans	-59.1	-54.7	-178.3	-71.3	-55.1	0	0	0	111.8	R245 W264 P268 R271	R245-D266 IonicContact CZ-OD1 2.66Å; R245-D266 IonicContact NH2-OD1 3.96Å; R245-D266 PolarHBondContact NH2-OD1 2.81Å; R245-D266 IonicContact NH2-OD2 3.15Å; W264-D266 PolarHBondContact O-N 2.87Å; D266-P268 VanDerWaalsContact O-CD 3.28Å; D266-P268 WeakPolarHBondContact O-CD 3.44Å; D266-R271 PolarHBondContact O-NH2 3.46Å
267	E	96.7	Very high	97.5	Very high	99 Å²	99	50.6 Å²	50.6	46%	0.463	26%	0.259	S	S	.	.	S	Bend	trans	-67.8	116	173.8	-175.4	51.3	-125.2	0	0	111.1	H265 M269 N270	H265-E267 PolarHBondContact ND1-N 2.92Å; H265-E267 PolarHBondContact ND1-O 3.09Å; E267-M269 HydrophobicContact CG-CB 4.41Å; E267-M269 PolarHBondContact O-N 2.94Å; E267-N270 HydrophobicContact CB-CB 4.44Å; E267-N270 PolarHBondContact O-N 2.75Å; E267-N270 VanDerWaalsContact O-N 3.09Å
268	P	97.6	Very high	97.5	Very high	22 Å²	22	46.8 Å²	46.8	14%	0.143	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-57.7	-33	-176.4	-27.6	36.1	0	0	0	114.1	E197 K207 D266 N270 R271	E197-P268 HydrophobicContact CB-CG 4.4Å; E197-P268 HydrophobicContact CG-CG 3.8Å; K207-P268 HydrophobicContact CB-CB 3.9Å; K207-P268 WeakPolarHBondContact CD-O 3.4Å; K207-P268 HydrophobicContact CG-CB 4.39Å; K207-P268 WeakPolarHBondContact CG-O 3.39Å; D266-P268 VanDerWaalsContact O-CD 3.28Å; D266-P268 WeakPolarHBondContact O-CD 3.44Å; P268-N270 PolarHBondContact O-N 3.08Å; P268-R271 WeakPolarHBondContact O-CB 3.34Å; P268-R271 PolarHBondContact O-N 3.03Å
269	M	96.8	Very high	97.4	Very high	146 Å²	146	47.1 Å²	47.1	72%	0.719	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-69.4	-22.6	-178.5	-61.1	-59.1	-90.1	0	0	113.2	E267 R271	E267-M269 HydrophobicContact CG-CB 4.41Å; E267-M269 PolarHBondContact O-N 2.94Å; M269-R271 VanDerWaalsContact C-N 3.34Å
270	N	98	Very high	97.2	Very high	98 Å²	98	50.3 Å²	50.3	52%	0.524	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-85.2	-9.1	177.3	-68.8	-5.8	0	0	0	112.8	H265 E267 P268	H265-N270 HydrophobicContact CB-CB 4.29Å; H265-N270 PolarHBondContact CE1-ND2 2.77Å; H265-N270 WeakPolarHBondContact ND1-CB 3.47Å; H265-N270 PolarHBondContact NE2-ND2 3.28Å; H265-N270 VanDerWaalsContact NE2-ND2 3.18Å; E267-N270 HydrophobicContact CB-CB 4.44Å; E267-N270 PolarHBondContact O-N 2.75Å; E267-N270 VanDerWaalsContact O-N 3.09Å; P268-N270 PolarHBondContact O-N 3.08Å
271	R	98.6	Very high	97	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.015	26%	0.264	C	S	.	.	S	Bend	trans	-71.5	144.3	171.8	-57.8	175.7	-166.4	150.9	10.9	109.5	E197 K207 V210 C263 H265 D266 P268 M269	E197-R271 IonicContact OE1-CZ 2.64Å; E197-R271 IonicContact OE1-NH1 3.69Å; E197-R271 PolarHBondContact OE1-NH1 3.39Å; E197-R271 IonicContact OE1-NH2 3.64Å; E197-R271 IonicContact OE2-CZ 2.89Å; E197-R271 IonicContact OE2-NH1 3.8Å; E197-R271 PolarHBondContact OE2-NH1 3.4Å; E197-R271 IonicContact OE2-NH2 2.72Å; E197-R271 PolarHBondContact OE2-NH2 3Å; K207-R271 HydrophobicContact CD-CB 4.38Å; K207-R271 PolarHBondContact NZ-O 2.81Å; K207-R271 WeakPolarHBondContact O-CD 3.34Å; K207-R271 PolarHBondContact O-NH1 2.97Å; V210-R271 HydrophobicContact CG1-CB 3.88Å; C263-R271 VanDerWaalsContact O-CD 3.29Å; C263-R271 WeakPolarHBondContact O-CD 3.44Å; H265-R271 HydrophobicContact CB-CG 4.02Å; H265-R271 PolarHBondContact O-NE 2.77Å; H265-R271 PolarHBondContact O-NH2 3.06Å; D266-R271 PolarHBondContact O-NH2 3.46Å; P268-R271 WeakPolarHBondContact O-CB 3.34Å; P268-R271 PolarHBondContact O-N 3.03Å; M269-R271 VanDerWaalsContact C-N 3.34Å
272	P	98.3	Very high	95.9	Very high	11 Å²	11	52.4 Å²	52.4	7%	0.071	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-62.6	162.1	179.3	27.2	-34.6	0	0	0	112.1	K207 V210 L259 H262 K276 I277	K207-P272 PolarHBondContact NZ-O 2.87Å; K207-P272 VanDerWaalsContact NZ-O 3.08Å; V210-P272 HydrophobicContact CG1-CG 4.23Å; V210-P272 WeakPolarHBondContact CG2-O 3.36Å; L259-P272 HydrophobicContact CD1-CG 4.19Å; H262-P272 HydrophobicContact CB-CG 4.49Å; H262-P272 WeakPolarHBondContact O-CD 3.49Å; P272-K276 HydrophobicContact CB-CB 4.27Å; P272-K276 HydrophobicContact CB-CD 4.1Å; P272-K276 HydrophobicContact CB-CG 4.26Å; P272-I277 HydrophobicContact CB-CG1 3.98Å; P272-I277 HydrophobicContact CG-CD1 3.97Å; P272-I277 HydrophobicContact CG-CG1 3.72Å
273	S	98.4	Very high	93.8	Very high	39 Å²	39	54.2 Å²	54.2	27%	0.273	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-79.7	162	164	57.5	0	0	0	0	110.1	S275 K276 I277	S273-S275 PolarHBondContact O-N 3.07Å; S273-K276 PolarHBondContact O-N 3.19Å; S273-K276 VanDerWaalsContact O-N 3.13Å; S273-K276 PolarHBondContact OG-N 2.89Å; S273-I277 WeakPolarHBondContact O-CG1 3.44Å; S273-I277 PolarHBondContact O-N 3.44Å
274	F	98.4	Very high	91.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-30.1	174.5	-78.1	-67.7	0	0	0	112.2	M140 M141 E144 I206 D209 V210 Y213 K276 I277 S278	M140-F274 HydrophobicContact CB-CB 4.36Å; M140-F274 HydrophobicContact CB-CD1 3.33Å; M140-F274 HydrophobicContact CB-CD2 3.75Å; M140-F274 HydrophobicContact CB-CE1 3.3Å; M140-F274 HydrophobicContact CB-CE2 3.72Å; M140-F274 HydrophobicContact CB-CG 3.55Å; M140-F274 HydrophobicContact CB-CZ 3.5Å; M140-F274 VanDerWaalsContact CB-CZ 3.5Å; M140-F274 HydrophobicContact CE-CD2 4.41Å; M140-F274 HydrophobicContact CE-CE2 3.6Å; M140-F274 HydrophobicContact CE-CZ 3.72Å; M140-F274 HydrophobicContact CG-CD1 4.22Å; M140-F274 HydrophobicContact CG-CE1 3.7Å; M140-F274 HydrophobicContact CG-CE2 4.29Å; M140-F274 HydrophobicContact CG-CZ 3.72Å; M141-F274 HydrophobicContact CB-CB 3.93Å; E144-F274 HydrophobicContact CB-CD2 4.27Å; E144-F274 WeakPolarHBondContact OE2-CB 3.48Å; E144-F274 PolarHBondContact OE2-N 3.47Å; I206-F274 HydrophobicContact CD1-CD2 4.18Å; I206-F274 HydrophobicContact CD1-CE2 3.98Å; I206-F274 HydrophobicContact CG1-CD2 3.97Å; I206-F274 HydrophobicContact CG1-CE2 3.97Å; D209-F274 HydrophobicContact CB-CE2 3.97Å; D209-F274 HydrophobicContact CB-CZ 4.06Å; V210-F274 HydrophobicContact CB-CZ 4.39Å; V210-F274 HydrophobicContact CG2-CD2 4Å; V210-F274 HydrophobicContact CG2-CE1 4.33Å; V210-F274 HydrophobicContact CG2-CE2 3.63Å; V210-F274 HydrophobicContact CG2-CG 4.5Å; V210-F274 HydrophobicContact CG2-CZ 3.82Å; Y213-F274 HydrophobicContact CD1-CE1 4.44Å; Y213-F274 AromaticContact CD2-CE1 3.98Å; Y213-F274 HydrophobicContact CD2-CE1 3.98Å; Y213-F274 AromaticContact CG-CE1 3.78Å; Y213-F274 HydrophobicContact CG-CE1 3.78Å; F274-K276 VanDerWaalsContact C-N 3.35Å; F274-K276 PolarHBondContact O-N 3.07Å; F274-I277 HydrophobicContact CD1-CD1 3.74Å; F274-I277 HydrophobicContact CE1-CD1 4.02Å; F274-I277 HydrophobicContact CG-CD1 4.47Å; F274-I277 PolarHBondContact O-N 3.27Å; F274-S278 VanDerWaalsContact O-CB 3.31Å; F274-S278 WeakPolarHBondContact O-CB 3.29Å; F274-S278 PolarHBondContact O-N 2.92Å
275	S	96.7	Very high	88.7	Confident	52 Å²	52	63.8 Å²	63.8	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-43.9	168.8	178	0	0	0	0	112.6	E144 S273 N279	E144-S275 PolarHBondContact OE2-N 2.98Å; S273-S275 PolarHBondContact O-N 3.07Å; S275-N279 WeakPolarHBondContact O-CB 3.5Å; S275-N279 VanDerWaalsContact O-CG 3.27Å; S275-N279 PolarHBondContact O-N 3.38Å; S275-N279 PolarHBondContact O-ND2 3.03Å; S275-N279 VanDerWaalsContact O-ND2 3.09Å
276	K	96.5	Very high	86.2	Confident	108 Å²	108	65 Å²	65	47%	0.47	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-43.6	176.3	-179.2	170.3	174.8	176.4	0	111.7	P272 S273 F274 N279 E280	P272-K276 HydrophobicContact CB-CB 4.27Å; P272-K276 HydrophobicContact CB-CD 4.1Å; P272-K276 HydrophobicContact CB-CG 4.26Å; S273-K276 PolarHBondContact O-N 3.19Å; S273-K276 VanDerWaalsContact O-N 3.13Å; S273-K276 PolarHBondContact OG-N 2.89Å; F274-K276 VanDerWaalsContact C-N 3.35Å; F274-K276 PolarHBondContact O-N 3.07Å; K276-N279 PolarHBondContact O-N 2.68Å; K276-E280 WeakPolarHBondContact CE-OE1 3.31Å; K276-E280 HydrophobicContact CG-CG 4.48Å; K276-E280 WeakPolarHBondContact CG-OE1 3.46Å; K276-E280 IonicContact NZ-OE1 3.91Å; K276-E280 WeakPolarHBondContact O-CB 3.16Å; K276-E280 WeakPolarHBondContact O-CG 3.18Å; K276-E280 PolarHBondContact O-N 3.4Å
277	I	97.9	Very high	83.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-58.4	-52.2	176.5	-67.8	165.9	0	0	0	110.7	A137 V210 Y213 L259 P272 S273 F274 N279 E280 I281	A137-I277 HydrophobicContact CB-CG2 3.76Å; V210-I277 HydrophobicContact CG1-CD1 3.98Å; V210-I277 HydrophobicContact CG2-CD1 4.4Å; Y213-I277 HydrophobicContact CD1-CD1 4.09Å; Y213-I277 HydrophobicContact CD1-CG2 4.06Å; Y213-I277 HydrophobicContact CE1-CD1 4.42Å; Y213-I277 HydrophobicContact CE1-CG2 3.34Å; L259-I277 HydrophobicContact CD1-CG1 4.05Å; L259-I277 HydrophobicContact CD2-CG2 4.22Å; P272-I277 HydrophobicContact CB-CG1 3.98Å; P272-I277 HydrophobicContact CG-CD1 3.97Å; P272-I277 HydrophobicContact CG-CG1 3.72Å; S273-I277 WeakPolarHBondContact O-CG1 3.44Å; S273-I277 PolarHBondContact O-N 3.44Å; F274-I277 HydrophobicContact CD1-CD1 3.74Å; F274-I277 HydrophobicContact CE1-CD1 4.02Å; F274-I277 HydrophobicContact CG-CD1 4.47Å; F274-I277 PolarHBondContact O-N 3.27Å; I277-N279 PolarHBondContact O-N 3.11Å; I277-E280 PolarHBondContact O-N 3.3Å; I277-I281 HydrophobicContact CG2-CD1 3.92Å; I277-I281 WeakPolarHBondContact O-CG1 3.49Å; I277-I281 PolarHBondContact O-N 3.22Å; I277-I281 VanDerWaalsContact O-N 3.11Å
278	S	97	Very high	80.6	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-56.9	-50.9	179.6	170.2	0	0	0	0	110.1	N138 F274 E280 I281 Q282	N138-S278 PolarHBondContact OD1-OG 3.5Å; F274-S278 VanDerWaalsContact O-CB 3.31Å; F274-S278 WeakPolarHBondContact O-CB 3.29Å; F274-S278 PolarHBondContact O-N 2.92Å; S278-E280 PolarHBondContact O-N 3.27Å; S278-I281 PolarHBondContact O-N 2.75Å; S278-I281 VanDerWaalsContact O-N 3.16Å; S278-Q282 WeakPolarHBondContact O-CB 3.43Å; S278-Q282 PolarHBondContact O-N 3.46Å
279	N	94	Very high	77.8	Confident	75 Å²	75	70.9 Å²	70.9	40%	0.401	38%	0.382	S	S	.	.	H	α-helix	trans	-59	-45	177.7	-73.7	-33.7	0	0	0	113	S275 K276 I277 I281 Q282 I283	S275-N279 WeakPolarHBondContact O-CB 3.5Å; S275-N279 VanDerWaalsContact O-CG 3.27Å; S275-N279 PolarHBondContact O-N 3.38Å; S275-N279 PolarHBondContact O-ND2 3.03Å; S275-N279 VanDerWaalsContact O-ND2 3.09Å; K276-N279 PolarHBondContact O-N 2.68Å; I277-N279 PolarHBondContact O-N 3.11Å; N279-I281 PolarHBondContact O-N 3.49Å; N279-Q282 PolarHBondContact O-N 2.7Å; N279-Q282 VanDerWaalsContact O-N 3.13Å; N279-I283 WeakPolarHBondContact O-CD1 3.38Å; N279-I283 WeakPolarHBondContact O-CG1 3.44Å; N279-I283 PolarHBondContact O-N 2.85Å
280	E	92.6	Very high	74.8	Confident	68 Å²	68	69 Å²	69	32%	0.318	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-31.6	179.2	-77.9	-174.8	-153.4	0	0	112.9	L259 K276 I277 S278	L259-E280 WeakPolarHBondContact CD1-OE2 3.4Å; L259-E280 HydrophobicContact CD2-CB 4.24Å; K276-E280 WeakPolarHBondContact CE-OE1 3.31Å; K276-E280 HydrophobicContact CG-CG 4.48Å; K276-E280 WeakPolarHBondContact CG-OE1 3.46Å; K276-E280 IonicContact NZ-OE1 3.91Å; K276-E280 WeakPolarHBondContact O-CB 3.16Å; K276-E280 WeakPolarHBondContact O-CG 3.18Å; K276-E280 PolarHBondContact O-N 3.4Å; I277-E280 PolarHBondContact O-N 3.3Å; S278-E280 PolarHBondContact O-N 3.27Å
281	I	92.7	Very high	71.8	Confident	21 Å²	21	69.3 Å²	69.3	11%	0.108	39%	0.387	C	S	.	.	H	α-helix	trans	-82.4	-32.5	174.6	-58.5	169.1	0	0	0	111.2	L134 A137 Y213 W255 L256 L259 I277 S278 N279	L134-I281 HydrophobicContact CB-CG2 3.67Å; L134-I281 HydrophobicContact CD1-CB 4.09Å; L134-I281 HydrophobicContact CD1-CG2 3.99Å; L134-I281 HydrophobicContact CG-CG2 4.28Å; A137-I281 HydrophobicContact CB-CD1 4.31Å; Y213-I281 WeakPolarHBondContact OH-CD1 3.06Å; W255-I281 HydrophobicContact CH2-CB 4.4Å; W255-I281 HydrophobicContact CH2-CG1 4.13Å; W255-I281 HydrophobicContact CH2-CG2 4.32Å; W255-I281 HydrophobicContact CZ3-CG1 3.99Å; L256-I281 HydrophobicContact CD1-CD1 4.44Å; L256-I281 HydrophobicContact CD1-CG1 4.37Å; L259-I281 HydrophobicContact CD2-CD1 4.12Å; L259-I281 HydrophobicContact CD2-CG1 3.85Å; I277-I281 HydrophobicContact CG2-CD1 3.92Å; I277-I281 WeakPolarHBondContact O-CG1 3.49Å; I277-I281 PolarHBondContact O-N 3.22Å; I277-I281 VanDerWaalsContact O-N 3.11Å; S278-I281 PolarHBondContact O-N 2.75Å; S278-I281 VanDerWaalsContact O-N 3.16Å; N279-I281 PolarHBondContact O-N 3.49Å
282	Q	75	Confident	69	Low	97 Å²	97	74 Å²	74	45%	0.453	41%	0.412	S	S	.	.	H	α-helix	trans	-83.6	-15.9	-174.7	-157.2	172.8	24.1	0	0	113.3	L134 S278 N279 P284	L134-Q282 HydrophobicContact CD1-CB 3.94Å; L134-Q282 HydrophobicContact CD1-CG 4.32Å; L134-Q282 HydrophobicContact CD2-CG 4.39Å; S278-Q282 WeakPolarHBondContact O-CB 3.43Å; S278-Q282 PolarHBondContact O-N 3.46Å; N279-Q282 PolarHBondContact O-N 2.7Å; N279-Q282 VanDerWaalsContact O-N 3.13Å; Q282-P284 WeakPolarHBondContact O-CD 3.23Å; Q282-P284 VanDerWaalsContact O-N 3.16Å
283	I	54.5	Low	66.4	Low	130 Å²	130	77.6 Å²	77.6	67%	0.667	43%	0.43	S	S	*	.	S	Bend	trans	-67.7	111.5	177.4	-70.8	157.3	0	0	0	109.6	N279	N279-I283 WeakPolarHBondContact O-CD1 3.38Å; N279-I283 WeakPolarHBondContact O-CG1 3.44Å; N279-I283 PolarHBondContact O-N 2.85Å
284	P	48.7	Very low	63.4	Low	104 Å²	104	81.2 Å²	81.2	68%	0.675	45%	0.446	S	S	*	.			trans	-103.6	144.7	-160.5	30.5	-16.7	0	0	0	113	Q282	Q282-P284 WeakPolarHBondContact O-CD 3.23Å; Q282-P284 VanDerWaalsContact O-N 3.16Å
285	N	41.3	Very low	60.7	Low	100 Å²	100	89.1 Å²	89.1	54%	0.535	48%	0.476	S	S	.	.				-169.9	128.9	103.7	-125.6	-31.7	0	0	0	109.5	N287 S288	N285-N287 HydrophobicContact CB-CB 4.31Å; N285-N287 PolarHBondContact O-N 3.2Å; N285-S288 PolarHBondContact O-N 3.35Å; N285-S288 PolarHBondContact O-OG 3.14Å
286	V	44	Very low	58.1	Low	99 Å²	99	90.1 Å²	90.1	60%	0.6	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-57.2	-14.4	170.6	-174.4	0	0	0	0	111.4	M127	M127-V286 HydrophobicContact CE-CG2 3.94Å
287	N	36.9	Very low	55.7	Low	139 Å²	139	89.5 Å²	89.5	74%	0.743	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-80.8	-8.1	173.2	-62.8	-22.7	0	0	0	115.3	N285	N285-N287 HydrophobicContact CB-CB 4.31Å; N285-N287 PolarHBondContact O-N 3.2Å
288	S	38.7	Very low	53	Low	87 Å²	87	93.7 Å²	93.7	61%	0.608	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-92.4	-4.5	173.6	64	0	0	0	0	113.5	N285 T290	N285-S288 PolarHBondContact O-N 3.35Å; N285-S288 PolarHBondContact O-OG 3.14Å; S288-T290 PolarHBondContact O-N 3.09Å
289	F	39.1	Very low	50.5	Low	110 Å²	110	98.5 Å²	98.5	48%	0.482	53%	0.532	S	S	.	.			trans	-77.5	80.5	162.4	-83	-84	0	0	0	109.9
290	T	33.3	Very low	48.2	Very low	106 Å²	106	97.9 Å²	97.9	65%	0.65	54%	0.538	S	S	*	.			trans	-55.3	150.9	158.9	48.5	0	0	0	0	110.1	S288 N292	S288-T290 PolarHBondContact O-N 3.09Å; T290-N292 VanDerWaalsContact C-N 3.3Å; T290-N292 PolarHBondContact O-N 3.18Å
291	P	35.2	Very low	46	Very low	106 Å²	106	101 Å²	101	69%	0.688	55%	0.552	S	S	*	*	S	Bend	trans	-79.8	51	-138.2	33	-38.5	0	0	0	115.8
292	N	40.8	Very low	43.7	Very low	101 Å²	101	105 Å²	105	54%	0.54	57%	0.574	S	S	.	*			trans	-107.3	-4.4	179.7	-77.8	-37.7	0	0	0	114.8	T290	T290-N292 VanDerWaalsContact C-N 3.3Å; T290-N292 PolarHBondContact O-N 3.18Å
293	L	43.1	Very low	42.2	Very low	88 Å²	88	107.8 Å²	107.8	46%	0.461	58%	0.584	S	S	.	*	S	Bend	trans	-81.6	-27.2	174.3	-147.3	75.1	0	0	0	113	S296	L293-S296 PolarHBondContact O-N 3.21Å
294	N	35.7	Very low	41.8	Very low	114 Å²	114	108.7 Å²	108.7	61%	0.61	58%	0.583	S	S	*	*	H	α-helix	trans	-73.5	-24.6	174.3	-73.6	-9.5	0	0	0	113	S296 I297 D298	N294-S296 VanDerWaalsContact C-N 3.27Å; N294-S296 PolarHBondContact O-N 3.33Å; N294-I297 PolarHBondContact O-N 3.23Å; N294-D298 PolarHBondContact O-N 2.91Å; N294-D298 VanDerWaalsContact O-N 3.14Å
295	R	41.5	Very low	41.7	Very low	167 Å²	167	106.3 Å²	106.3	63%	0.63	57%	0.569	S	S	*	*	H	α-helix	trans	-69	-23.3	175.1	-85.8	-177.8	170.7	174	-3.3	113.7	N299	R295-N299 WeakPolarHBondContact O-CB 3.47Å; R295-N299 PolarHBondContact O-N 3.36Å; R295-N299 PolarHBondContact O-ND2 2.95Å
296	S	41.6	Very low	42	Very low	73 Å²	73	104 Å²	104	51%	0.51	56%	0.564	S	S	.	*	H	α-helix	trans	-75.6	-31.2	175.3	-46.9	0	0	0	0	111.8	L293 N294 A300	L293-S296 PolarHBondContact O-N 3.21Å; N294-S296 VanDerWaalsContact C-N 3.27Å; N294-S296 PolarHBondContact O-N 3.33Å; S296-A300 WeakPolarHBondContact O-CB 3.24Å; S296-A300 PolarHBondContact O-N 3.28Å
297	I	47	Very low	42.1	Very low	94 Å²	94	105.1 Å²	105.1	48%	0.482	57%	0.565	S	S	.	*	H	α-helix	trans	-75.3	-42.1	178.2	-59.6	176.2	0	0	0	109.8	N294 A300 Q301	N294-I297 PolarHBondContact O-N 3.23Å; I297-A300 PolarHBondContact O-N 3.45Å; I297-Q301 PolarHBondContact O-N 3.49Å
298	D	40.5	Very low	42.5	Very low	89 Å²	89	103.5 Å²	103.5	48%	0.476	56%	0.556	S	S	.	*	H	α-helix	trans	-65.6	-41.2	176.5	-68.5	-25.2	0	0	0	112	N294 A300 Q301 L302	N294-D298 PolarHBondContact O-N 2.91Å; N294-D298 VanDerWaalsContact O-N 3.14Å; D298-A300 PolarHBondContact O-N 3.33Å; D298-Q301 PolarHBondContact O-N 3Å; D298-L302 VanDerWaalsContact O-CB 3.23Å; D298-L302 WeakPolarHBondContact O-CB 3.43Å; D298-L302 WeakPolarHBondContact O-CD1 3.28Å; D298-L302 VanDerWaalsContact O-CG 3.26Å; D298-L302 WeakPolarHBondContact O-CG 3.45Å; D298-L302 PolarHBondContact O-N 3.08Å
299	N	43.5	Very low	42.6	Very low	100 Å²	100	105.5 Å²	105.5	54%	0.535	56%	0.56	S	S	.	*	H	α-helix	trans	-72.6	-28.5	179.3	-79	-41.1	0	0	0	113.8	R295 K303	R295-N299 WeakPolarHBondContact O-CB 3.47Å; R295-N299 PolarHBondContact O-N 3.36Å; R295-N299 PolarHBondContact O-ND2 2.95Å; N299-K303 WeakPolarHBondContact O-CB 3.34Å; N299-K303 WeakPolarHBondContact O-CG 3.44Å; N299-K303 PolarHBondContact O-N 3.03Å; N299-K303 VanDerWaalsContact O-N 3.08Å
300	A	47.1	Very low	42.6	Very low	63 Å²	63	107.3 Å²	107.3	52%	0.521	57%	0.574	S	S	.	*	H	α-helix	trans	-76.5	-36	175.1	0	0	0	0	0	112.1	S296 I297 D298 K304	S296-A300 WeakPolarHBondContact O-CB 3.24Å; S296-A300 PolarHBondContact O-N 3.28Å; I297-A300 PolarHBondContact O-N 3.45Å; D298-A300 PolarHBondContact O-N 3.33Å; A300-K304 PolarHBondContact O-N 3.44Å
301	Q	45.2	Very low	42.8	Very low	132 Å²	132	106.7 Å²	106.7	62%	0.617	57%	0.574	S	S	*	*	H	α-helix	trans	-73.2	-37.2	172.3	-80.2	-178.6	-21.5	0	0	112.5	I297 D298 K304 S305	I297-Q301 PolarHBondContact O-N 3.49Å; D298-Q301 PolarHBondContact O-N 3Å; Q301-K304 PolarHBondContact O-N 2.68Å; Q301-S305 PolarHBondContact O-N 3.46Å; Q301-S305 PolarHBondContact O-OG 3.39Å
302	L	45	Very low	42.7	Very low	107 Å²	107	107.2 Å²	107.2	56%	0.56	58%	0.576	S	S	*	*	H	α-helix	trans	-63.5	-41.6	173.3	-80.7	159.5	0	0	0	111.7	D298 K304 S305 A306	D298-L302 VanDerWaalsContact O-CB 3.23Å; D298-L302 WeakPolarHBondContact O-CB 3.43Å; D298-L302 WeakPolarHBondContact O-CD1 3.28Å; D298-L302 VanDerWaalsContact O-CG 3.26Å; D298-L302 WeakPolarHBondContact O-CG 3.45Å; D298-L302 PolarHBondContact O-N 3.08Å; L302-K304 VanDerWaalsContact C-N 3.33Å; L302-K304 PolarHBondContact O-N 2.84Å; L302-S305 PolarHBondContact O-N 2.92Å; L302-S305 PolarHBondContact O-OG 3.44Å; L302-A306 WeakPolarHBondContact O-CB 3.27Å; L302-A306 PolarHBondContact O-N 3.07Å
303	K	44.7	Very low	42.4	Very low	155 Å²	155	108 Å²	108	67%	0.674	58%	0.584	S	S	*	*	H	α-helix	trans	-64.3	-34.8	173.4	-82.6	-176.3	176.1	-177.5	0	113	N299 I307	N299-K303 WeakPolarHBondContact O-CB 3.34Å; N299-K303 WeakPolarHBondContact O-CG 3.44Å; N299-K303 PolarHBondContact O-N 3.03Å; N299-K303 VanDerWaalsContact O-N 3.08Å; K303-I307 VanDerWaalsContact O-CD1 3.23Å; K303-I307 WeakPolarHBondContact O-CD1 3.32Å; K303-I307 WeakPolarHBondContact O-CG1 3.49Å; K303-I307 PolarHBondContact O-N 2.88Å
304	K	45.8	Very low	41.8	Very low	149 Å²	149	109.7 Å²	109.7	65%	0.648	60%	0.6	S	S	*	*	H	α-helix	trans	-71.3	-41.7	177	-141.3	174.8	-176.5	-177.1	0	112	A300 Q301 L302 A306 I307 D308	A300-K304 PolarHBondContact O-N 3.44Å; Q301-K304 PolarHBondContact O-N 2.68Å; L302-K304 VanDerWaalsContact C-N 3.33Å; L302-K304 PolarHBondContact O-N 2.84Å; K304-A306 PolarHBondContact O-N 3.21Å; K304-I307 PolarHBondContact O-N 3.22Å; K304-D308 PolarHBondContact O-N 2.65Å; K304-D308 VanDerWaalsContact O-N 3.08Å
305	S	46.5	Very low	41.7	Very low	54 Å²	54	112 Å²	112	38%	0.378	61%	0.612	S	S	.	*	H	α-helix	trans	-68.5	-30.3	175.7	70	0	0	0	0	113.9	Q301 L302 N309	Q301-S305 PolarHBondContact O-N 3.46Å; Q301-S305 PolarHBondContact O-OG 3.39Å; L302-S305 PolarHBondContact O-N 2.92Å; L302-S305 PolarHBondContact O-OG 3.44Å; S305-N309 WeakPolarHBondContact O-CB 3.28Å; S305-N309 PolarHBondContact O-N 3.5Å; S305-N309 VanDerWaalsContact O-N 3.13Å; S305-N309 PolarHBondContact O-ND2 3.13Å
306	A	46.3	Very low	41.3	Very low	52 Å²	52	112.4 Å²	112.4	43%	0.43	62%	0.621	S	S	.	*	H	α-helix	trans	-71.9	-31.2	174.3	0	0	0	0	0	112.2	L302 K304 L310	L302-A306 WeakPolarHBondContact O-CB 3.27Å; L302-A306 PolarHBondContact O-N 3.07Å; K304-A306 PolarHBondContact O-N 3.21Å; A306-L310 WeakPolarHBondContact O-CD1 3.43Å
307	I	47.4	Very low	40.7	Very low	121 Å²	121	116.2 Å²	116.2	62%	0.621	63%	0.634	S	S	*	*	H	α-helix	trans	-77.3	-36.4	177.1	-63.5	162.9	0	0	0	110.8	K303 K304 L310	K303-I307 VanDerWaalsContact O-CD1 3.23Å; K303-I307 WeakPolarHBondContact O-CD1 3.32Å; K303-I307 WeakPolarHBondContact O-CG1 3.49Å; K303-I307 PolarHBondContact O-N 2.88Å; K304-I307 PolarHBondContact O-N 3.22Å; I307-L310 PolarHBondContact O-N 2.95Å
308	D	43.7	Very low	40	Very low	105 Å²	105	116.8 Å²	116.8	56%	0.561	65%	0.647	S	S	*	*	H	α-helix	trans	-73.3	-30.2	178	-69.6	-25.6	0	0	0	112.7	K304 L310 S311	K304-D308 PolarHBondContact O-N 2.65Å; K304-D308 VanDerWaalsContact O-N 3.08Å; D308-L310 VanDerWaalsContact C-N 3.33Å; D308-L310 PolarHBondContact O-N 2.63Å; D308-S311 PolarHBondContact O-OG 3.29Å
309	N	42.5	Very low	39.4	Very low	129 Å²	129	118.6 Å²	118.6	69%	0.69	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-2.7	176.9	-76.6	-24.6	0	0	0	115.1	S305	S305-N309 WeakPolarHBondContact O-CB 3.28Å; S305-N309 PolarHBondContact O-N 3.5Å; S305-N309 VanDerWaalsContact O-N 3.13Å; S305-N309 PolarHBondContact O-ND2 3.13Å
310	L	38.6	Very low	38.8	Very low	149 Å²	149	118.6 Å²	118.6	78%	0.78	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	10.6	175	-100.8	143.5	0	0	0	113.2	A306 I307 D308	A306-L310 WeakPolarHBondContact O-CD1 3.43Å; I307-L310 PolarHBondContact O-N 2.95Å; D308-L310 VanDerWaalsContact C-N 3.33Å; D308-L310 PolarHBondContact O-N 2.63Å
311	S	36.6	Very low	38	Very low	93 Å²	93	122.8 Å²	122.8	65%	0.65	68%	0.681	S	S	*	*	S	Bend	trans	-105.2	10.3	-176.5	70.8	0	0	0	0	115.8	D308	D308-S311 PolarHBondContact O-OG 3.29Å
312	T	33	Very low	37.4	Very low	117 Å²	117	121.4 Å²	121.4	72%	0.718	68%	0.681	S	S	*	*			trans	-125	63.4	-179.8	54.3	0	0	0	0	112.8
313	T	34.9	Very low	36.6	Very low	116 Å²	116	124.6 Å²	124.6	71%	0.712	70%	0.698	S	S	*	*			trans	-128.9	122.5	155.2	45.1	0	0	0	0	108.7	L315	T313-L315 PolarHBondContact O-N 3.09Å; T313-L315 VanDerWaalsContact O-N 3.16Å
314	P	30.8	Very low	36.1	Very low	124 Å²	124	125 Å²	125	81%	0.805	70%	0.702	S	S	*	*			trans	-72.4	110.2	171.7	14.8	-4.4	0	0	0	107.4	H316	P314-H316 VanDerWaalsContact C-N 3.32Å; P314-H316 PolarHBondContact O-N 3.18Å
315	L	33.7	Very low	35.6	Very low	162 Å²	162	125.6 Å²	125.6	85%	0.848	71%	0.712	S	S	*	*			trans	-64.5	98.5	165.4	-87.9	159.7	0	0	0	107.8	T313 L317	T313-L315 PolarHBondContact O-N 3.09Å; T313-L315 VanDerWaalsContact O-N 3.16Å; L315-L317 VanDerWaalsContact C-N 3.31Å; L315-L317 PolarHBondContact O-N 3.05Å
316	H	33.6	Very low	35.2	Very low	177 Å²	177	132.2 Å²	132.2	82%	0.819	75%	0.753	S	S	*	*			trans	-64.5	94.5	167.1	-143.1	-82	0	0	0	107.4	P314 S318	P314-H316 VanDerWaalsContact C-N 3.32Å; P314-H316 PolarHBondContact O-N 3.18Å; H316-S318 PolarHBondContact O-N 3.27Å
317	L	28.5	Very low	34.6	Very low	152 Å²	152	136.2 Å²	136.2	80%	0.796	77%	0.769	S	S	*	*			trans	-63.8	98	168.4	-94.9	145.9	0	0	0	108.4	L315 V319	L315-L317 VanDerWaalsContact C-N 3.31Å; L315-L317 PolarHBondContact O-N 3.05Å; L317-V319 PolarHBondContact O-N 2.95Å
318	S	32.8	Very low	34	Very low	107 Å²	107	137 Å²	137	75%	0.748	78%	0.777	S	S	*	*			trans	-80.2	100.9	159.8	39.6	0	0	0	0	107.6	H316	H316-S318 PolarHBondContact O-N 3.27Å
319	V	28.1	Very low	33.4	Very low	126 Å²	126	138.8 Å²	138.8	76%	0.764	79%	0.789	S	S	*	*			trans	-73	125.1	168	176.1	0	0	0	0	107.4	L317	L317-V319 PolarHBondContact O-N 2.95Å
320	S	30.9	Very low	32.9	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	80%	0.795	S	S	*	*			trans	-150.4	112.9	167.7	-85.3	0	0	0	0	111.6
321	I	30.1	Very low	32.5	Very low	152 Å²	152	138.8 Å²	138.8	78%	0.779	80%	0.796	S	S	*	*			trans	77.3	132.7	148.8	-39.7	160.8	0	0	0	112.7
322	T	31.6	Very low	32.3	Very low	102 Å²	102	141.8 Å²	141.8	63%	0.626	81%	0.805	S	S	*	*			cis	-157.4	137.7	20.4	-33.5	0	0	0	0	107.9
323	L	29	Very low	32.2	Very low	175 Å²	175	143.6 Å²	143.6	92%	0.916	81%	0.812	S	S	*	*			trans	-90.2	126.2	158.2	-85.7	157	0	0	0	107.8
324	H	33.1	Very low	32	Very low	164 Å²	164	145.7 Å²	145.7	76%	0.759	82%	0.819	S	S	*	*			trans	-118.3	121.6	162.4	-91.3	30	0	0	0	107.7
325	L	34.9	Very low	32.1	Very low	161 Å²	161	147.5 Å²	147.5	84%	0.843	82%	0.82	S	S	*	*			trans	167.9	150.8	138.3	-87	165.2	0	0	0	108.4
326	P	38.8	Very low	31.9	Very low	192 Å²	192	146.2 Å²	146.2	100%	1.247	82%	0.818	S	S	*	*			cis	-87.4	0	5.9	2.6	17.6	0	0	0	114

Retrieved 326 of 326 residues in 595.3 ms (Link to these results)

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