A0A096M390_POEFO Loading...

Mevalonate kinase

Catalyzes the phosphorylation of mevalonate to mevalonate 5-phosphate, a key step in isoprenoid and cholesterol biosynthesis.

AlphaFold DB , UniProt , Accession A0A096M390, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 380 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	59	Low	85.3	Confident	139 Å²	139	68.3 Å²	68.3	69%	0.685	33%	0.325	S	S	*	.				0	122.9	0	-162.1	170	-148	0	0	107	V3 T161	M1-V3 PolarHBondContact O-N 3.37Å; M1-T161 VanDerWaalsContact CE-CA 3.44Å; M1-T161 WeakPolarHBondContact CE-O 3.46Å
2	E	65.2	Low	86.1	Confident	181 Å²	181	62.6 Å²	62.6	85%	0.846	30%	0.298	S	S	*	.			trans	-91.3	96.6	-177.6	-158.8	174.7	-155.7	0	0	108.5	R4	E2-R4 PolarHBondContact O-N 2.66Å
3	V	77.5	Confident	86.8	Confident	16 Å²	16	59.3 Å²	59.3	10%	0.097	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-70.8	128.4	177.2	176.4	0	0	0	0	108.2	M1 L41 A43 P127 A160	M1-V3 PolarHBondContact O-N 3.37Å; V3-L41 HydrophobicContact CG1-CD2 3.49Å; V3-L41 VanDerWaalsContact CG1-CD2 3.49Å; V3-A43 HydrophobicContact CB-CB 4.33Å; V3-A43 HydrophobicContact CG1-CB 4.45Å; V3-A43 VanDerWaalsContact O-CB 3.3Å; V3-A43 WeakPolarHBondContact O-CB 3.39Å; V3-P127 HydrophobicContact CG2-CB 3.45Å; V3-P127 VanDerWaalsContact CG2-CB 3.45Å; V3-P127 HydrophobicContact CG2-CG 3.88Å; V3-A160 HydrophobicContact CG1-CB 3.87Å; V3-A160 HydrophobicContact CG2-CB 4.31Å
4	R	82.2	Confident	87.4	Confident	194 Å²	194	55.1 Å²	55.1	73%	0.732	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-93.9	148.8	174.7	-66	-176.8	179.2	179.6	-1.2	110	E2 C6	E2-R4 PolarHBondContact O-N 2.66Å; R4-C6 PolarHBondContact O-N 2.85Å
5	D	88.6	Confident	88	Confident	103 Å²	103	52.8 Å²	52.8	55%	0.551	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-60.7	135.6	169.2	-72.4	9	0	0	0	109.2	L41 K42 A43	D5-L41 VanDerWaalsContact CA-O 3.27Å; D5-L41 WeakPolarHBondContact CA-O 3.33Å; D5-K42 VanDerWaalsContact OD1-CA 3.31Å; D5-K42 WeakPolarHBondContact OD1-CA 3.39Å; D5-A43 PolarHBondContact OD1-N 3.03Å
6	C	89.3	Confident	88.6	Confident	16 Å²	16	49.9 Å²	49.9	11%	0.108	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	149.3	174.9	74.1	0	0	0	0	111.2	R4 Q40 L41	R4-C6 PolarHBondContact O-N 2.85Å; C6-Q40 WeakPolarHBondContact O-CA 3.36Å; C6-L41 PolarHBondContact N-O 2.74Å; C6-L41 PolarHBondContact O-N 2.84Å; C6-L41 VanDerWaalsContact SG-CB 3.58Å
7	L	93.1	Very high	89.2	Confident	89 Å²	89	47.1 Å²	47.1	47%	0.466	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.7	169	-177	68.1	0	0	0	105.9	L39 Q40 V380	L7-L39 CarbonylContact C-O 3.59Å; L7-L39 WeakPolarHBondContact CA-O 2.78Å; L7-Q40 HydrophobicContact CD1-CB 4.15Å; L7-V380 WeakPolarHBondContact O-CA 3.24Å; L7-V380 WeakPolarHBondContact O-CG1 3.49Å
8	V	94.6	Very high	89.5	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	155.4	175.7	-54	0	0	0	0	109.2	Y38 L39 C152 A156 W177 S379 V380	V8-Y38 WeakPolarHBondContact O-CA 3.34Å; V8-L39 HydrophobicContact CG2-CB 3.77Å; V8-L39 HydrophobicContact CG2-CD2 4.06Å; V8-L39 HydrophobicContact CG2-CG 4.37Å; V8-L39 PolarHBondContact N-O 2.83Å; V8-L39 PolarHBondContact O-N 3.4Å; V8-C152 HydrophobicContact CG2-CB 3.8Å; V8-C152 WeakPolarHBondContact CG2-O 3.38Å; V8-A156 HydrophobicContact CG1-CB 4.42Å; V8-A156 HydrophobicContact CG2-CB 4.13Å; V8-W177 HydrophobicContact CG1-CH2 4.22Å; V8-S379 CarbonylContact C-O 3.53Å; V8-S379 WeakPolarHBondContact CA-O 3.09Å; V8-V380 HydrophobicContact CG1-CG1 4.36Å; V8-V380 HydrophobicContact CG1-CG2 3.96Å
9	S	96.1	Very high	89.8	Confident	10 Å²	10	43 Å²	43	7%	0.07	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	143	174.8	68.8	0	0	0	0	112.9	R36 T37 D378 S379	S9-R36 PolarHBondContact O-NH2 3.37Å; S9-R36 PolarHBondContact OG-NE 3.08Å; S9-R36 PolarHBondContact OG-NH2 2.9Å; S9-T37 CarbonylContact C-O 3.58Å; S9-T37 WeakPolarHBondContact CA-O 3.44Å; S9-T37 VanDerWaalsContact CB-O 3.28Å; S9-T37 WeakPolarHBondContact CB-O 3.22Å; S9-D378 WeakPolarHBondContact O-CA 3.4Å; S9-S379 PolarHBondContact N-O 3.42Å; S9-S379 PolarHBondContact O-N 2.79Å; S9-S379 PolarHBondContact OG-OG 3.39Å
10	A	96.5	Very high	90	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.3	176.6	0	0	0	0	0	110.6	R36 T37 A148 V151 C152	A10-R36 CarbonylContact O-C 3.57Å; A10-R36 WeakPolarHBondContact O-CA 3.44Å; A10-T37 PolarHBondContact N-O 3.11Å; A10-T37 PolarHBondContact O-N 3.25Å; A10-A148 HydrophobicContact CB-CB 4.2Å; A10-V151 HydrophobicContact CB-CB 3.97Å; A10-V151 HydrophobicContact CB-CG1 3.71Å; A10-C152 PolarHBondContact N-SG 3.04Å; A10-C152 VanDerWaalsContact N-SG 3.36Å
11	P	96.1	Very high	90.2	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.013	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	161.5	176	33.5	-37.3	0	0	0	111.6	L33 G208 P376 G377	P11-L33 WeakPolarHBondContact CB-O 3.31Å; P11-G208 WeakPolarHBondContact CD-O 3.35Å; P11-P376 WeakPolarHBondContact CG-O 3.41Å; P11-G377 VanDerWaalsContact CD-C 3.46Å
12	G	95	Very high	91.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-166.1	163	0	0	0	0	0	112.5	S32 L33 L35 L143	G12-S32 WeakPolarHBondContact O-CA 3.08Å; G12-L33 PolarHBondContact N-O 3.16Å; G12-L33 VanDerWaalsContact N-O 3.09Å; G12-L33 PolarHBondContact O-N 3.21Å; G12-L35 PolarHBondContact N-O 3.42Å; G12-L143 CarbonylContact C-O 3.58Å; G12-L143 VanDerWaalsContact CA-O 3.31Å; G12-L143 WeakPolarHBondContact CA-O 3.46Å
13	K	95	Very high	93	Very high	20 Å²	20	29.3 Å²	29.3	9%	0.087	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	144.2	-179.5	165.4	-82.8	-138.4	150.3	0	111.3	I15 A30 V31 L143 D204 V207	K13-I15 HydrophobicContact CD-CD1 4.27Å; K13-I15 VanDerWaalsContact CE-CD1 3.44Å; K13-A30 HydrophobicContact CG-CB 4.39Å; K13-V31 CarbonylContact C-O 3.53Å; K13-V31 VanDerWaalsContact CA-O 3.29Å; K13-V31 WeakPolarHBondContact CA-O 3.38Å; K13-L143 PolarHBondContact N-O 2.81Å; K13-L143 CarbonylContact O-C 3.13Å; K13-L143 VanDerWaalsContact O-CA 3.24Å; K13-L143 WeakPolarHBondContact O-CA 3.33Å; K13-D204 WeakPolarHBondContact CE-OD1 3.32Å; K13-D204 IonicContact NZ-OD1 3.5Å; K13-D204 PolarHBondContact NZ-OD1 3.26Å; K13-D204 IonicContact NZ-OD2 3.69Å; K13-V207 HydrophobicContact CB-CB 4.01Å; K13-V207 HydrophobicContact CB-CG1 3.7Å; K13-V207 HydrophobicContact CB-CG2 4.45Å; K13-V207 HydrophobicContact CG-CB 4.06Å; K13-V207 HydrophobicContact CG-CG1 4.01Å; K13-V207 HydrophobicContact CG-CG2 3.95Å
14	A	95.6	Very high	93.7	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.008	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	155.7	163.6	0	0	0	0	0	110.2	A30 V31 I342	A14-A30 WeakPolarHBondContact O-CA 3.2Å; A14-V31 HydrophobicContact CB-CG2 3.92Å; A14-V31 PolarHBondContact N-O 3.16Å; A14-V31 PolarHBondContact O-N 3.3Å; A14-I342 HydrophobicContact CB-CG2 4.47Å
15	I	97.1	Very high	94.2	Very high	20 Å²	20	24.3 Å²	24.3	10%	0.103	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	119.6	164.7	-55.2	-62.5	0	0	0	107	K13 H17 E19 A30 T333	K13-I15 HydrophobicContact CD-CD1 4.27Å; K13-I15 VanDerWaalsContact CE-CD1 3.44Å; I15-H17 WeakPolarHBondContact CG2-O 3.27Å; I15-E19 HydrophobicContact CB-CG 4.11Å; I15-E19 HydrophobicContact CG2-CB 4.47Å; I15-E19 HydrophobicContact CG2-CG 3.78Å; I15-E19 WeakPolarHBondContact CG2-OE1 3.39Å; I15-A30 HydrophobicContact CD1-CB 3.93Å; I15-T333 PolarHBondContact N-OG1 2.76Å; I15-T333 PolarHBondContact O-OG1 3.46Å
16	L	97.2	Very high	94.6	Very high	7 Å²	7	21.5 Å²	21.5	4%	0.037	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-51.5	175.7	-176.3	57.3	0	0	0	109.1	L29 V31 M213 L279 K331 I342 I373	L16-L29 HydrophobicContact CB-CB 4.39Å; L16-L29 PolarHBondContact N-O 2.84Å; L16-V31 HydrophobicContact CB-CG1 3.92Å; L16-V31 HydrophobicContact CB-CG2 4.47Å; L16-V31 HydrophobicContact CD2-CG1 4.21Å; L16-M213 HydrophobicContact CD2-CE 4.01Å; L16-L279 HydrophobicContact CD2-CD1 4.11Å; L16-K331 VanDerWaalsContact O-CE 3.29Å; L16-K331 WeakPolarHBondContact O-CE 3.35Å; L16-K331 PolarHBondContact O-NZ 3.14Å; L16-I342 HydrophobicContact CD1-CD1 3.77Å; L16-I373 HydrophobicContact CD1-CD1 4.19Å
17	H	98.2	Very high	94.9	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	157.5	174.8	-58.2	-54.9	0	0	0	112.2	I15 A28 L29 I271 S272 C275 N302	I15-H17 WeakPolarHBondContact CG2-O 3.27Å; H17-A28 CarbonylContact O-C 3.51Å; H17-A28 VanDerWaalsContact O-CA 3.26Å; H17-A28 WeakPolarHBondContact O-CA 3.33Å; H17-A28 WeakPolarHBondContact O-CB 3.23Å; H17-L29 PolarHBondContact O-N 2.97Å; H17-I271 HydrophobicContact CB-CG2 4.27Å; H17-S272 WeakPolarHBondContact CB-OG 3.47Å; H17-C275 VanDerWaalsContact CD2-CB 3.47Å; H17-C275 WeakPolarHBondContact CD2-CB 3.39Å; H17-C275 PolarHBondContact CD2-SG 2.91Å; H17-N302 WeakPolarHBondContact CB-ND2 3.47Å; H17-N302 PolarHBondContact ND1-ND2 2.83Å
18	G	95.1	Very high	95.1	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.1	C	C	.	.			trans	94.7	16.6	173.2	0	0	0	0	0	115.7	H20 A21 V22 V27	G18-H20 PolarHBondContact O-N 2.04Å; G18-A21 PolarHBondContact O-N 2.94Å; G18-V22 PolarHBondContact O-N 3.28Å; G18-V27 WeakPolarHBondContact CA-O 3.03Å
19	E	95.1	Very high	95.3	Very high	17 Å²	17	16.8 Å²	16.8	8%	0.079	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-41.7	-70.5	-171.6	-70.4	71	-167.4	0	0	114.4	I15 L306 K331 L332 G334	I15-E19 HydrophobicContact CB-CG 4.11Å; I15-E19 HydrophobicContact CG2-CB 4.47Å; I15-E19 HydrophobicContact CG2-CG 3.78Å; I15-E19 WeakPolarHBondContact CG2-OE1 3.39Å; E19-L306 HydrophobicContact CB-CD2 4.08Å; E19-L306 HydrophobicContact CG-CD2 4.44Å; E19-K331 IonicContact OE1-NZ 3.83Å; E19-K331 PolarHBondContact OE1-NZ 2.86Å; E19-K331 IonicContact OE2-NZ 3.78Å; E19-L332 HydrophobicContact CG-CD1 4.43Å; E19-G334 WeakPolarHBondContact CG-O 3.43Å
20	H	94.4	Very high	95.3	Very high	6 Å²	6	16.3 Å²	16.3	3%	0.028	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-20.2	179.1	-73.4	-93.7	0	0	0	111.8	G18 V22 V23 H24 V250 A335	G18-H20 PolarHBondContact O-N 2.04Å; H20-V22 PolarHBondContact O-N 3.06Å; H20-V23 WeakPolarHBondContact O-CB 3.33Å; H20-V23 PolarHBondContact O-N 2.87Å; H20-H24 PolarHBondContact O-CD2 2.84Å; H20-V250 HydrophobicContact CB-CG1 4.34Å; H20-A335 PolarHBondContact CE1-O 3.35Å; H20-A335 PolarHBondContact NE2-O 3.25Å
21	A	94	Very high	95.3	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.008	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-63.7	-33.3	-178.4	0	0	0	0	0	111.8	G18 V23 H24 K26 L265 V268	G18-A21 PolarHBondContact O-N 2.94Å; A21-V23 VanDerWaalsContact C-N 3.26Å; A21-V23 PolarHBondContact O-N 3.16Å; A21-H24 CarbonylContact O-C 3.59Å; A21-H24 WeakPolarHBondContact O-CA 3.25Å; A21-H24 PolarHBondContact O-N 3.49Å; A21-K26 HydrophobicContact CB-CB 3.69Å; A21-K26 HydrophobicContact CB-CG 3.96Å; A21-K26 WeakPolarHBondContact O-CB 3.19Å; A21-K26 WeakPolarHBondContact O-CG 3.31Å; A21-K26 PolarHBondContact O-N 2.92Å; A21-L265 HydrophobicContact CB-CD2 4.1Å; A21-V268 HydrophobicContact CB-CB 4.08Å; A21-V268 HydrophobicContact CB-CG1 3.62Å
22	V	92.3	Very high	95.3	Very high	27 Å²	27	16.3 Å²	16.3	16%	0.164	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-66.5	-26.4	-179.6	71.7	0	0	0	0	114.6	G18 H20 H24 G25 K26 A28 F216	G18-V22 PolarHBondContact O-N 3.28Å; H20-V22 PolarHBondContact O-N 3.06Å; V22-H24 PolarHBondContact O-N 2.93Å; V22-G25 PolarHBondContact O-N 2.83Å; V22-K26 WeakPolarHBondContact CA-O 3.3Å; V22-K26 VanDerWaalsContact CG2-O 3.32Å; V22-K26 WeakPolarHBondContact CG2-O 3.45Å; V22-A28 HydrophobicContact CB-CB 3.81Å; V22-A28 HydrophobicContact CG1-CB 4.15Å; V22-A28 HydrophobicContact CG2-CB 4.14Å; V22-F216 HydrophobicContact CB-CD1 4.3Å; V22-F216 HydrophobicContact CG1-CD1 4.31Å; V22-F216 HydrophobicContact CG2-CD1 3.18Å; V22-F216 HydrophobicContact CG2-CE1 3.52Å; V22-F216 HydrophobicContact CG2-CG 4.19Å
23	V	90.6	Very high	95.3	Very high	84 Å²	84	16.3 Å²	16.3	51%	0.509	10%	0.096	S	C	.	.	G	3₁₀ helix	trans	-63.5	-21.5	171.9	-176.6	0	0	0	0	111.2	H20 A21 V247	H20-V23 WeakPolarHBondContact O-CB 3.33Å; H20-V23 PolarHBondContact O-N 2.87Å; A21-V23 VanDerWaalsContact C-N 3.26Å; A21-V23 PolarHBondContact O-N 3.16Å; V23-V247 HydrophobicContact CG1-CG1 4.32Å
24	H	91.9	Very high	95.3	Very high	61 Å²	61	18 Å²	18	28%	0.282	11%	0.107	S	C	.	.	G	3₁₀ helix	trans	-109.2	25.8	-179.5	-58.9	-73.2	0	0	0	112.5	H20 A21 V22 K26 I254 L265	H20-H24 PolarHBondContact O-CD2 2.84Å; A21-H24 CarbonylContact O-C 3.59Å; A21-H24 WeakPolarHBondContact O-CA 3.25Å; A21-H24 PolarHBondContact O-N 3.49Å; V22-H24 PolarHBondContact O-N 2.93Å; H24-K26 PolarHBondContact O-N 3.42Å; H24-I254 WeakPolarHBondContact CE1-CD1 3.2Å; H24-I254 WeakPolarHBondContact NE2-CD1 3.44Å; H24-L265 HydrophobicContact CB-CD1 3.89Å
25	G	92.6	Very high	95.2	Very high	44 Å²	44	18.5 Å²	18.5	45%	0.454	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	14.8	172.2	0	0	0	0	0	114.9	V22 L217	V22-G25 PolarHBondContact O-N 2.83Å; G25-L217 WeakPolarHBondContact O-CD1 3.24Å
26	K	96.5	Very high	95.2	Very high	44 Å²	44	18.3 Å²	18.3	19%	0.191	11%	0.107	C	C	.	.			trans	-90.4	168.6	174.5	-53.2	-49	-169.3	176.6	0	112	A21 V22 H24 L265 D266 D269	A21-K26 HydrophobicContact CB-CB 3.69Å; A21-K26 HydrophobicContact CB-CG 3.96Å; A21-K26 WeakPolarHBondContact O-CB 3.19Å; A21-K26 WeakPolarHBondContact O-CG 3.31Å; A21-K26 PolarHBondContact O-N 2.92Å; V22-K26 WeakPolarHBondContact CA-O 3.3Å; V22-K26 VanDerWaalsContact CG2-O 3.32Å; V22-K26 WeakPolarHBondContact CG2-O 3.45Å; H24-K26 PolarHBondContact O-N 3.42Å; K26-L265 HydrophobicContact CG-CB 4.35Å; K26-D266 WeakPolarHBondContact CE-OD1 3.5Å; K26-D266 IonicContact NZ-OD1 2.67Å; K26-D266 PolarHBondContact NZ-OD1 3.01Å; K26-D269 WeakPolarHBondContact CA-OD1 3.45Å; K26-D269 HydrophobicContact CB-CB 3.96Å; K26-D269 WeakPolarHBondContact CB-OD1 3.41Å; K26-D269 HydrophobicContact CD-CB 3.91Å; K26-D269 HydrophobicContact CG-CB 4.11Å
27	V	97	Very high	95.2	Very high	3 Å²	3	18 Å²	18	2%	0.018	11%	0.106	C	C	.	.			trans	-72.1	141.3	175.3	178.1	0	0	0	0	110.6	G18 R215 L217 D269 S272	G18-V27 WeakPolarHBondContact CA-O 3.03Å; V27-R215 HydrophobicContact CG1-CG 4.15Å; V27-R215 VanDerWaalsContact CG1-NH1 3.34Å; V27-L217 HydrophobicContact CG2-CD1 4.07Å; V27-L217 HydrophobicContact CG2-CD2 4.46Å; V27-D269 WeakPolarHBondContact CG2-OD1 3.26Å; V27-D269 PolarHBondContact N-OD1 2.92Å; V27-S272 PolarHBondContact O-OG 2.95Å
28	A	96.9	Very high	95.1	Very high	4 Å²	4	21.6 Å²	21.6	3%	0.033	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148.4	161.2	0	0	0	0	0	111.8	H17 V22 F216	H17-A28 CarbonylContact O-C 3.51Å; H17-A28 VanDerWaalsContact O-CA 3.26Å; H17-A28 WeakPolarHBondContact O-CA 3.33Å; H17-A28 WeakPolarHBondContact O-CB 3.23Å; V22-A28 HydrophobicContact CB-CB 3.81Å; V22-A28 HydrophobicContact CG1-CB 4.15Å; V22-A28 HydrophobicContact CG2-CB 4.14Å; A28-F216 PolarHBondContact N-O 3.38Å; A28-F216 PolarHBondContact O-N 3.19Å
29	L	97.4	Very high	95.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	111.1	172.2	-62.4	-178.9	0	0	0	109	L16 H17 M213 R215 S272 C275 E276	L16-L29 HydrophobicContact CB-CB 4.39Å; L16-L29 PolarHBondContact N-O 2.84Å; H17-L29 PolarHBondContact O-N 2.97Å; L29-M213 HydrophobicContact CB-SD 4.18Å; L29-M213 HydrophobicContact CD1-SD 4.04Å; L29-M213 HydrophobicContact CD2-SD 4.31Å; L29-M213 HydrophobicContact CG-SD 4.42Å; L29-R215 HydrophobicContact CD2-CB 4.23Å; L29-S272 WeakPolarHBondContact CD1-O 3.31Å; L29-C275 HydrophobicContact CD1-CB 3.87Å; L29-E276 HydrophobicContact CD1-CB 4.2Å; L29-E276 HydrophobicContact CD2-CB 4.29Å
30	A	96.7	Very high	95.3	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	137.1	171.6	0	0	0	0	0	109.3	K13 A14 I15 V203 V207 M213 L214	K13-A30 HydrophobicContact CG-CB 4.39Å; A14-A30 WeakPolarHBondContact O-CA 3.2Å; I15-A30 HydrophobicContact CD1-CB 3.93Å; A30-V203 HydrophobicContact CB-CG1 3.55Å; A30-V207 HydrophobicContact CB-CG2 3.77Å; A30-M213 CarbonylContact O-C 3.51Å; A30-M213 WeakPolarHBondContact O-CA 3.24Å; A30-L214 PolarHBondContact N-O 2.89Å; A30-L214 PolarHBondContact O-N 2.86Å
31	V	96.3	Very high	95.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.8	-175.2	-58.5	0	0	0	0	110.2	K13 A14 L16 M213 I373	K13-V31 CarbonylContact C-O 3.53Å; K13-V31 VanDerWaalsContact CA-O 3.29Å; K13-V31 WeakPolarHBondContact CA-O 3.38Å; A14-V31 HydrophobicContact CB-CG2 3.92Å; A14-V31 PolarHBondContact N-O 3.16Å; A14-V31 PolarHBondContact O-N 3.3Å; L16-V31 HydrophobicContact CB-CG1 3.92Å; L16-V31 HydrophobicContact CB-CG2 4.47Å; L16-V31 HydrophobicContact CD2-CG1 4.21Å; V31-M213 HydrophobicContact CG1-CB 4.31Å; V31-M213 HydrophobicContact CG1-CE 3.37Å; V31-M213 HydrophobicContact CG1-CG 3.82Å; V31-M213 HydrophobicContact CG1-SD 4.01Å; V31-I373 HydrophobicContact CB-CB 4.23Å; V31-I373 HydrophobicContact CG2-CB 3.78Å; V31-I373 HydrophobicContact CG2-CD1 4.12Å; V31-I373 HydrophobicContact CG2-CG2 3.82Å
32	S	96.3	Very high	95.5	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	135.5	168.2	52.9	0	0	0	0	109.9	G12 G212 I373 G374 G375	G12-S32 WeakPolarHBondContact O-CA 3.08Å; S32-G212 PolarHBondContact N-O 3.15Å; S32-G212 PolarHBondContact OG-N 2.68Å; S32-G212 VanDerWaalsContact OG-N 3.16Å; S32-G212 PolarHBondContact OG-O 2.85Å; S32-I373 CarbonylContact O-C 3.6Å; S32-I373 WeakPolarHBondContact O-CA 3.3Å; S32-I373 WeakPolarHBondContact O-CB 3.47Å; S32-G374 PolarHBondContact O-N 3.23Å; S32-G374 WeakPolarHBondContact OG-CA 3.42Å; S32-G374 PolarHBondContact OG-N 2.58Å; S32-G375 PolarHBondContact OG-N 2.93Å; S32-G375 PolarHBondContact OG-O 2.87Å
33	L	96.3	Very high	95.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.2	176.7	175.6	68.3	0	0	0	107.6	P11 G12 L35 L137 L143 I232 L234 T371 I373	P11-L33 WeakPolarHBondContact CB-O 3.31Å; G12-L33 PolarHBondContact N-O 3.16Å; G12-L33 VanDerWaalsContact N-O 3.09Å; G12-L33 PolarHBondContact O-N 3.21Å; L33-L35 HydrophobicContact CD2-CB 4.47Å; L33-L35 HydrophobicContact CD2-CD1 4.34Å; L33-L35 HydrophobicContact CG-CB 4.34Å; L33-L35 HydrophobicContact CG-CG 4.39Å; L33-L35 PolarHBondContact O-N 2.78Å; L33-L137 HydrophobicContact CD2-CD2 3.86Å; L33-L143 HydrophobicContact CD2-CB 4.22Å; L33-L143 HydrophobicContact CD2-CD1 4.01Å; L33-L143 HydrophobicContact CD2-CD2 4.13Å; L33-L143 HydrophobicContact CD2-CG 4.36Å; L33-I232 HydrophobicContact CD1-CD1 3.96Å; L33-L234 HydrophobicContact CD1-CD2 4.5Å; L33-L234 HydrophobicContact CD2-CD1 4.45Å; L33-L234 HydrophobicContact CD2-CD2 3.89Å; L33-T371 HydrophobicContact CD1-CG2 3.63Å; L33-I373 HydrophobicContact CD1-CG2 4.06Å
34	N	94.2	Very high	95.6	Very high	57 Å²	57	30.2 Å²	30.2	31%	0.305	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	41.3	-175.1	-160.8	41.2	0	0	0	113.3	T371 S372	N34-T371 VanDerWaalsContact C-OG1 3.28Å; N34-T371 PolarHBondContact O-OG1 3.24Å; N34-T371 VanDerWaalsContact O-OG1 3.09Å; N34-S372 WeakPolarHBondContact CB-O 3.34Å; N34-S372 VanDerWaalsContact CB-OG 3.31Å; N34-S372 WeakPolarHBondContact CB-OG 3.39Å; N34-S372 PolarHBondContact N-O 2.98Å
35	L	94.2	Very high	95.5	Very high	11 Å²	11	33.3 Å²	33.3	6%	0.058	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.4	157.5	-66.4	-178.6	0	0	0	106	G12 L33 E136 L137 L234 W369 T371	G12-L35 PolarHBondContact N-O 3.42Å; L33-L35 HydrophobicContact CD2-CB 4.47Å; L33-L35 HydrophobicContact CD2-CD1 4.34Å; L33-L35 HydrophobicContact CG-CB 4.34Å; L33-L35 HydrophobicContact CG-CG 4.39Å; L33-L35 PolarHBondContact O-N 2.78Å; L35-E136 WeakPolarHBondContact CA-OE2 3.26Å; L35-E136 HydrophobicContact CB-CB 4.06Å; L35-E136 HydrophobicContact CD2-CB 4.21Å; L35-L137 HydrophobicContact CB-CD2 3.65Å; L35-L137 HydrophobicContact CB-CG 4.15Å; L35-L137 WeakPolarHBondContact O-CD2 3.5Å; L35-L137 WeakPolarHBondContact O-CG 3.38Å; L35-L234 HydrophobicContact CD1-CD2 3.44Å; L35-L234 VanDerWaalsContact CD1-CD2 3.44Å; L35-W369 HydrophobicContact CD1-CB 4.43Å; L35-W369 HydrophobicContact CD1-CD2 4.49Å; L35-W369 HydrophobicContact CD1-CG 4.31Å; L35-T371 HydrophobicContact CG-CG2 4.39Å
36	R	95.7	Very high	95.5	Very high	15 Å²	15	34.6 Å²	34.6	6%	0.057	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	150.7	-165.1	-54.4	-176.9	74.7	80.4	-1.3	111.9	S9 A10 Y38 E136 P376 G377 S379	S9-R36 PolarHBondContact O-NH2 3.37Å; S9-R36 PolarHBondContact OG-NE 3.08Å; S9-R36 PolarHBondContact OG-NH2 2.9Å; A10-R36 CarbonylContact O-C 3.57Å; A10-R36 WeakPolarHBondContact O-CA 3.44Å; R36-Y38 HydrophobicContact CB-CD2 4.34Å; R36-Y38 HydrophobicContact CB-CE1 4.5Å; R36-Y38 HydrophobicContact CB-CE2 3.71Å; R36-E136 PolarHBondContact N-OE2 2.76Å; R36-E136 PolarHBondContact O-N 2.63Å; R36-P376 PolarHBondContact NH1-O 3.18Å; R36-G377 PolarHBondContact NH2-O 2.81Å; R36-S379 PolarHBondContact NH2-OG 2.86Å; R36-S379 VanDerWaalsContact NH2-OG 3.16Å
37	T	97.1	Very high	95.3	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	132.6	160.7	-64	0	0	0	0	108	S9 A10 V133 S135 A148 C152	S9-T37 CarbonylContact C-O 3.58Å; S9-T37 WeakPolarHBondContact CA-O 3.44Å; S9-T37 VanDerWaalsContact CB-O 3.28Å; S9-T37 WeakPolarHBondContact CB-O 3.22Å; A10-T37 PolarHBondContact N-O 3.11Å; A10-T37 PolarHBondContact O-N 3.25Å; T37-V133 HydrophobicContact CG2-CG1 3.38Å; T37-S135 WeakPolarHBondContact OG1-CB 3.27Å; T37-S135 PolarHBondContact OG1-OG 2.96Å; T37-A148 WeakPolarHBondContact OG1-CB 3.33Å; T37-C152 PolarHBondContact O-SG 3.43Å; T37-C152 VanDerWaalsContact O-SG 3.41Å
38	Y	97.4	Very high	95.2	Very high	76 Å²	76	37 Å²	37	30%	0.298	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.3	179.6	-62.2	-92.5	0	0	0	109.2	V8 R36 V133 W134 E136	V8-Y38 WeakPolarHBondContact O-CA 3.34Å; R36-Y38 HydrophobicContact CB-CD2 4.34Å; R36-Y38 HydrophobicContact CB-CE1 4.5Å; R36-Y38 HydrophobicContact CB-CE2 3.71Å; Y38-V133 CarbonylContact O-C 3.46Å; Y38-V133 WeakPolarHBondContact O-CA 3.42Å; Y38-V133 WeakPolarHBondContact O-CG1 3.14Å; Y38-W134 AromaticContact CD2-CE3 3.73Å; Y38-W134 HydrophobicContact CD2-CE3 3.73Å; Y38-W134 AromaticContact CD2-CZ3 3.79Å; Y38-W134 HydrophobicContact CD2-CZ3 3.79Å; Y38-W134 HydrophobicContact CE2-CE3 4.35Å; Y38-W134 AromaticContact CE2-CZ3 3.94Å; Y38-W134 HydrophobicContact CE2-CZ3 3.94Å; Y38-W134 PolarHBondContact N-O 3.08Å; Y38-W134 PolarHBondContact O-N 2.92Å; Y38-E136 HydrophobicContact CE2-CG 4.14Å
39	L	97.6	Very high	95.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126	175.3	179.1	160	0	0	0	109.4	L7 V8 L41 V131 S132 V133 C152 L153 A156	L7-L39 CarbonylContact C-O 3.59Å; L7-L39 WeakPolarHBondContact CA-O 2.78Å; V8-L39 HydrophobicContact CG2-CB 3.77Å; V8-L39 HydrophobicContact CG2-CD2 4.06Å; V8-L39 HydrophobicContact CG2-CG 4.37Å; V8-L39 PolarHBondContact N-O 2.83Å; V8-L39 PolarHBondContact O-N 3.4Å; L39-L41 HydrophobicContact CD2-CB 4.04Å; L39-V131 HydrophobicContact CD1-CG1 3.55Å; L39-V131 HydrophobicContact CD2-CG1 3.99Å; L39-V131 HydrophobicContact CG-CG1 3.62Å; L39-S132 CarbonylContact C-O 3.46Å; L39-S132 WeakPolarHBondContact CA-O 3.36Å; L39-V133 HydrophobicContact CB-CG1 4.45Å; L39-V133 HydrophobicContact CB-CG2 4.17Å; L39-V133 HydrophobicContact CD1-CG2 3.81Å; L39-V133 HydrophobicContact CG-CG2 3.88Å; L39-C152 HydrophobicContact CB-CB 3.68Å; L39-C152 HydrophobicContact CD1-CB 3.91Å; L39-C152 HydrophobicContact CG-CB 4.45Å; L39-L153 HydrophobicContact CD1-CD2 3.71Å; L39-L153 HydrophobicContact CD1-CG 4.13Å; L39-A156 HydrophobicContact CD1-CB 4.43Å; L39-A156 HydrophobicContact CD2-CB 3.5Å; L39-A156 VanDerWaalsContact CD2-CB 3.5Å
40	Q	96.9	Very high	95.2	Very high	81 Å²	81	36.8 Å²	36.8	38%	0.379	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.7	169.4	-177.9	175.2	66.2	0	0	109.5	C6 L7 K42 V131 S132	C6-Q40 WeakPolarHBondContact O-CA 3.36Å; L7-Q40 HydrophobicContact CD1-CB 4.15Å; Q40-K42 HydrophobicContact CG-CG 4.18Å; Q40-K42 VanDerWaalsContact OE1-CE 3.24Å; Q40-V131 CarbonylContact O-C 3.49Å; Q40-V131 WeakPolarHBondContact O-CA 3.46Å; Q40-S132 PolarHBondContact N-O 3.49Å; Q40-S132 PolarHBondContact O-N 3.01Å
41	L	96.1	Very high	95.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.6	170.7	-171.4	154.9	0	0	0	108.2	V3 D5 C6 L39 L129 T130 V131 A156 F157 A160	V3-L41 HydrophobicContact CG1-CD2 3.49Å; V3-L41 VanDerWaalsContact CG1-CD2 3.49Å; D5-L41 VanDerWaalsContact CA-O 3.27Å; D5-L41 WeakPolarHBondContact CA-O 3.33Å; C6-L41 PolarHBondContact N-O 2.74Å; C6-L41 PolarHBondContact O-N 2.84Å; C6-L41 VanDerWaalsContact SG-CB 3.58Å; L39-L41 HydrophobicContact CD2-CB 4.04Å; L41-L129 HydrophobicContact CD1-CD2 4.33Å; L41-T130 CarbonylContact C-O 3.55Å; L41-T130 WeakPolarHBondContact CA-O 3.18Å; L41-V131 HydrophobicContact CD1-CG2 4.47Å; L41-V131 HydrophobicContact CG-CG2 4.41Å; L41-A156 HydrophobicContact CB-CB 4.45Å; L41-A156 HydrophobicContact CD1-CB 3.98Å; L41-F157 HydrophobicContact CD1-CD1 3.85Å; L41-F157 HydrophobicContact CD1-CE1 4.05Å; L41-A160 HydrophobicContact CD1-CB 4.27Å
42	K	95.1	Very high	95.2	Very high	93 Å²	93	39 Å²	39	40%	0.404	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	134.2	172.9	-68	-171.9	175.7	172.7	0	111.2	D5 Q40 L129 T130	D5-K42 VanDerWaalsContact OD1-CA 3.31Å; D5-K42 WeakPolarHBondContact OD1-CA 3.39Å; Q40-K42 HydrophobicContact CG-CG 4.18Å; Q40-K42 VanDerWaalsContact OE1-CE 3.24Å; K42-L129 CarbonylContact O-C 3.59Å; K42-L129 VanDerWaalsContact O-CA 3.3Å; K42-L129 WeakPolarHBondContact O-CA 3.25Å; K42-T130 PolarHBondContact N-O 3.13Å; K42-T130 PolarHBondContact O-N 2.92Å
43	A	92.9	Very high	95.2	Very high	45 Å²	45	39.4 Å²	39.4	37%	0.372	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	149.2	171.9	0	0	0	0	0	111	V3 D5	V3-A43 HydrophobicContact CB-CB 4.33Å; V3-A43 HydrophobicContact CG1-CB 4.45Å; V3-A43 VanDerWaalsContact O-CB 3.3Å; V3-A43 WeakPolarHBondContact O-CB 3.39Å; D5-A43 PolarHBondContact OD1-N 3.03Å
44	R	92.2	Very high	95.2	Very high	97 Å²	97	42.7 Å²	42.7	37%	0.366	23%	0.23	S	C	.	.			trans	-130.3	165.5	173.8	-56.7	177.3	76.1	78	1.4	110.5	D46 K48 S128 L129 T130	R44-D46 WeakPolarHBondContact CB-OD1 3.23Å; R44-D46 IonicContact CZ-OD1 3.58Å; R44-D46 IonicContact CZ-OD2 3.45Å; R44-D46 IonicContact NE-OD1 2.79Å; R44-D46 PolarHBondContact NE-OD1 3.34Å; R44-D46 IonicContact NE-OD2 3.42Å; R44-D46 PolarHBondContact NE-OD2 3.47Å; R44-D46 IonicContact NH2-OD1 3.57Å; R44-D46 IonicContact NH2-OD2 2.66Å; R44-D46 PolarHBondContact NH2-OD2 2.83Å; R44-K48 WeakPolarHBondContact CD-O 3.43Å; R44-S128 PolarHBondContact N-O 2.85Å; R44-L129 VanDerWaalsContact CD-C 3.44Å; R44-L129 WeakPolarHBondContact CD-O 3.42Å; R44-T130 VanDerWaalsContact CD-OG1 3.24Å; R44-T130 WeakPolarHBondContact CD-OG1 3.31Å; R44-T130 PolarHBondContact NH1-OG1 3.48Å
45	S	89.9	Confident	95.1	Very high	126 Å²	126	43.3 Å²	43.3	88%	0.881	23%	0.233	S	C	*	.	S	Bend	trans	-125.8	5.1	178.1	54.7	0	0	0	0	113.8
46	D	92.4	Very high	94.9	Very high	71 Å²	71	45 Å²	45	38%	0.38	24%	0.242	S	C	.	.	S	Bend	trans	-99.6	10.9	-172.3	69.3	-24.9	0	0	0	114.5	R44 K48	R44-D46 WeakPolarHBondContact CB-OD1 3.23Å; R44-D46 IonicContact CZ-OD1 3.58Å; R44-D46 IonicContact CZ-OD2 3.45Å; R44-D46 IonicContact NE-OD1 2.79Å; R44-D46 PolarHBondContact NE-OD1 3.34Å; R44-D46 IonicContact NE-OD2 3.42Å; R44-D46 PolarHBondContact NE-OD2 3.47Å; R44-D46 IonicContact NH2-OD1 3.57Å; R44-D46 IonicContact NH2-OD2 2.66Å; R44-D46 PolarHBondContact NH2-OD2 2.83Å; D46-K48 VanDerWaalsContact C-N 3.35Å
47	G	92.8	Very high	94.7	Very high	25 Å²	25	51.8 Å²	51.8	26%	0.258	28%	0.28	S	S	.	.	S	Bend	trans	79.9	12.2	176.8	0	0	0	0	0	114.9	L64 S128	G47-L64 VanDerWaalsContact O-CB 3.31Å; G47-L64 WeakPolarHBondContact O-CB 3.38Å; G47-L64 WeakPolarHBondContact O-CG 3.27Å; G47-L64 PolarHBondContact O-N 3.01Å; G47-S128 WeakPolarHBondContact CA-OG 3.45Å; G47-S128 PolarHBondContact N-OG 3Å; G47-S128 VanDerWaalsContact N-OG 3.16Å
48	K	95.4	Very high	94.6	Very high	71 Å²	71	52.6 Å²	52.6	31%	0.309	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.4	-172.9	-68	179	174.2	178.2	0	113.9	R44 D46 W62 E63 S128 L129	R44-K48 WeakPolarHBondContact CD-O 3.43Å; D46-K48 VanDerWaalsContact C-N 3.35Å; K48-W62 WeakPolarHBondContact CA-O 3.46Å; K48-E63 VanDerWaalsContact CE-CD 3.41Å; K48-E63 WeakPolarHBondContact CE-OE1 3.48Å; K48-E63 IonicContact NZ-OE1 3.37Å; K48-E63 PolarHBondContact NZ-OE1 3.35Å; K48-S128 PolarHBondContact N-OG 2.84Å; K48-S128 CarbonylContact O-C 3.56Å; K48-S128 WeakPolarHBondContact O-CA 3.45Å; K48-S128 VanDerWaalsContact O-CB 3.31Å; K48-S128 WeakPolarHBondContact O-CB 3.34Å; K48-L129 PolarHBondContact O-N 3.2Å
49	V	96.3	Very high	94.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.7	169	178.3	0	0	0	0	108.1	C61 W62 L64 L67 F113 Y117 L129	V49-C61 CarbonylContact O-C 3.51Å; V49-C61 WeakPolarHBondContact O-CA 3.5Å; V49-W62 PolarHBondContact N-O 2.9Å; V49-W62 PolarHBondContact O-N 3.33Å; V49-L64 HydrophobicContact CG2-CD2 3.44Å; V49-L64 VanDerWaalsContact CG2-CD2 3.44Å; V49-L64 HydrophobicContact CG2-CG 4.23Å; V49-L67 HydrophobicContact CB-CD1 4.09Å; V49-L67 HydrophobicContact CG2-CD1 4.14Å; V49-F113 HydrophobicContact CG1-CE1 3.8Å; V49-F113 HydrophobicContact CG1-CZ 3.66Å; V49-Y117 HydrophobicContact CG1-CE2 4.29Å; V49-Y117 HydrophobicContact CG2-CE1 4.07Å; V49-Y117 HydrophobicContact CG2-CE2 4.17Å; V49-Y117 VanDerWaalsContact CG2-OH 3.23Å; V49-Y117 WeakPolarHBondContact CG2-OH 3.43Å; V49-L129 CarbonylContact C-O 3.47Å; V49-L129 WeakPolarHBondContact CA-O 3.41Å; V49-L129 HydrophobicContact CG1-CD1 3.91Å; V49-L129 HydrophobicContact CG1-CG 4.49Å
50	C	96.9	Very high	94.4	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.3	-178.2	-59.3	0	0	0	0	111.8	F59 V60 C61 L129 T130 V131	C50-F59 HydrophobicContact CB-CE2 4.37Å; C50-F59 HydrophobicContact CB-CZ 4.42Å; C50-V60 CarbonylContact C-O 3.54Å; C50-V60 VanDerWaalsContact CA-O 3.27Å; C50-V60 WeakPolarHBondContact CA-O 3.46Å; C50-C61 HydrophobicContact CB-CB 4.12Å; C50-C61 WeakPolarHBondContact CB-SG 3.49Å; C50-C61 WeakPolarHBondContact SG-CB 3.42Å; C50-C61 CovalentContact SG-SG 2.04Å; C50-C61 PolarHBondContact SG-SG 3.45Å; C50-L129 PolarHBondContact N-O 3.05Å; C50-T130 HydrophobicContact CB-CG2 4.29Å; C50-T130 CarbonylContact O-C 3.53Å; C50-T130 WeakPolarHBondContact O-CA 3.21Å; C50-V131 PolarHBondContact O-N 3.32Å
51	I	97.3	Very high	94.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	132.6	170.3	-175.3	164.7	0	0	0	109.8	L53 F59 V60 W62 F113 V131 Y149	I51-L53 HydrophobicContact CD1-CD1 4.06Å; I51-L53 HydrophobicContact CD1-CD2 3.94Å; I51-L53 HydrophobicContact CD1-CG 4.09Å; I51-L53 HydrophobicContact CG1-CD1 4.33Å; I51-L53 HydrophobicContact CG1-CD2 3.89Å; I51-L53 HydrophobicContact CG1-CG 3.9Å; I51-F59 WeakPolarHBondContact O-CA 3.36Å; I51-V60 HydrophobicContact CG2-CB 4.13Å; I51-V60 PolarHBondContact N-O 3.42Å; I51-V60 PolarHBondContact O-N 3.49Å; I51-W62 HydrophobicContact CB-CZ3 4.39Å; I51-W62 HydrophobicContact CG2-CH2 3.54Å; I51-W62 HydrophobicContact CG2-CZ3 3.63Å; I51-F113 HydrophobicContact CB-CD1 4.48Å; I51-F113 HydrophobicContact CB-CD2 4.33Å; I51-F113 HydrophobicContact CB-CE1 4.38Å; I51-F113 HydrophobicContact CB-CE2 4.14Å; I51-F113 HydrophobicContact CB-CG 4.48Å; I51-F113 HydrophobicContact CB-CZ 4.2Å; I51-F113 HydrophobicContact CD1-CB 3.68Å; I51-F113 HydrophobicContact CD1-CD1 4.28Å; I51-F113 HydrophobicContact CD1-CD2 3.46Å; I51-F113 VanDerWaalsContact CD1-CD2 3.46Å; I51-F113 HydrophobicContact CD1-CE2 4.09Å; I51-F113 HydrophobicContact CD1-CG 3.55Å; I51-F113 HydrophobicContact CG1-CD2 4.22Å; I51-F113 HydrophobicContact CG1-CE2 4.38Å; I51-V131 CarbonylContact C-O 3.57Å; I51-V131 WeakPolarHBondContact CA-O 3.39Å; I51-Y149 VanDerWaalsContact CD1-OH 3.23Å; I51-Y149 WeakPolarHBondContact CD1-OH 3.41Å
52	N	97.1	Very high	94.3	Very high	48 Å²	48	56.7 Å²	56.7	26%	0.257	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	119.8	176.8	-178	23.7	0	0	0	109.5	F59 V131 S132 V133	N52-F59 HydrophobicContact CB-CD2 3.79Å; N52-F59 HydrophobicContact CB-CE2 4.3Å; N52-V131 PolarHBondContact N-O 2.74Å; N52-S132 CarbonylContact O-C 3.6Å; N52-S132 WeakPolarHBondContact O-CA 3.21Å; N52-V133 PolarHBondContact O-N 3.35Å
53	L	96.3	Very high	94.3	Very high	9 Å²	9	55.5 Å²	55.5	5%	0.047	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	80.3	-178.2	-53.3	176	0	0	0	109.8	I51 N55 I56 D57 T58 A109 V133 Y149	I51-L53 HydrophobicContact CD1-CD1 4.06Å; I51-L53 HydrophobicContact CD1-CD2 3.94Å; I51-L53 HydrophobicContact CD1-CG 4.09Å; I51-L53 HydrophobicContact CG1-CD1 4.33Å; I51-L53 HydrophobicContact CG1-CD2 3.89Å; I51-L53 HydrophobicContact CG1-CG 3.9Å; L53-N55 VanDerWaalsContact C-N 3.28Å; L53-N55 PolarHBondContact O-N 2.74Å; L53-I56 HydrophobicContact CB-CD1 4.03Å; L53-I56 HydrophobicContact CB-CG1 3.64Å; L53-I56 HydrophobicContact CD1-CD1 3.63Å; L53-I56 HydrophobicContact CD1-CG1 4.23Å; L53-I56 HydrophobicContact CG-CD1 4.49Å; L53-I56 CarbonylContact O-C 3.42Å; L53-I56 PolarHBondContact O-N 2.91Å; L53-I56 VanDerWaalsContact O-N 3.16Å; L53-D57 PolarHBondContact O-N 3.29Å; L53-T58 PolarHBondContact N-O 3.25Å; L53-T58 PolarHBondContact O-N 2.81Å; L53-A109 HydrophobicContact CD1-CB 3.76Å; L53-V133 HydrophobicContact CD2-CB 3.72Å; L53-V133 HydrophobicContact CD2-CG2 3.89Å; L53-Y149 HydrophobicContact CD2-CE2 3.79Å
54	P	94.8	Very high	94.3	Very high	69 Å²	69	54.2 Å²	54.2	45%	0.448	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-60.8	-31.5	-175.2	-26.1	36.6	0	0	0	114.3	I56 D57 V133	P54-I56 PolarHBondContact O-N 3.21Å; P54-I56 VanDerWaalsContact O-N 3.15Å; P54-D57 PolarHBondContact O-N 3.38Å; P54-V133 WeakPolarHBondContact CD-O 3.3Å
55	N	92.8	Very high	94.3	Very high	69 Å²	69	53.2 Å²	53.2	37%	0.369	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-63.1	-20.1	179.5	-63.3	102.2	0	0	0	113.9	L53 W134 S135	L53-N55 VanDerWaalsContact C-N 3.28Å; L53-N55 PolarHBondContact O-N 2.74Å; N55-W134 VanDerWaalsContact OD1-CA 3.24Å; N55-W134 WeakPolarHBondContact OD1-CA 3.37Å; N55-S135 PolarHBondContact ND2-O 3.45Å; N55-S135 PolarHBondContact OD1-N 3.04Å
56	I	90.9	Very high	94.3	Very high	47 Å²	47	51.4 Å²	51.4	24%	0.241	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-128.1	21.9	-179.5	59.3	166	0	0	0	111.8	L53 P54 T58 S106 T139	L53-I56 HydrophobicContact CB-CD1 4.03Å; L53-I56 HydrophobicContact CB-CG1 3.64Å; L53-I56 HydrophobicContact CD1-CD1 3.63Å; L53-I56 HydrophobicContact CD1-CG1 4.23Å; L53-I56 HydrophobicContact CG-CD1 4.49Å; L53-I56 CarbonylContact O-C 3.42Å; L53-I56 PolarHBondContact O-N 2.91Å; L53-I56 VanDerWaalsContact O-N 3.16Å; P54-I56 PolarHBondContact O-N 3.21Å; P54-I56 VanDerWaalsContact O-N 3.15Å; I56-T58 VanDerWaalsContact C-N 3.3Å; I56-T58 PolarHBondContact O-N 3.49Å; I56-T58 PolarHBondContact O-OG1 2.98Å; I56-S106 WeakPolarHBondContact CD1-OG 3.46Å; I56-T139 HydrophobicContact CG2-CG2 4.48Å
57	D	91.7	Very high	94.2	Very high	158 Å²	158	48 Å²	48	85%	0.845	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	48.6	176.7	-163.7	26	0	0	0	114	L53 P54	L53-D57 PolarHBondContact O-N 3.29Å; P54-D57 PolarHBondContact O-N 3.38Å
58	T	93	Very high	94	Very high	18 Å²	18	51.5 Å²	51.5	11%	0.11	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.2	-174.6	-60.9	0	0	0	0	110.6	L53 I56 V60 S106 I110	L53-T58 PolarHBondContact N-O 3.25Å; L53-T58 PolarHBondContact O-N 2.81Å; I56-T58 VanDerWaalsContact C-N 3.3Å; I56-T58 PolarHBondContact O-N 3.49Å; I56-T58 PolarHBondContact O-OG1 2.98Å; T58-V60 HydrophobicContact CG2-CG2 4.12Å; T58-S106 WeakPolarHBondContact OG1-CB 3.35Å; T58-S106 PolarHBondContact OG1-OG 3.05Å; T58-I110 HydrophobicContact CG2-CD1 3.94Å; T58-I110 HydrophobicContact CG2-CG1 4.48Å
59	F	95.8	Very high	93.5	Very high	130 Å²	130	54.9 Å²	54.9	57%	0.57	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	123.4	171.5	177.9	-97.8	0	0	0	109.8	C50 I51 N52 C61	C50-F59 HydrophobicContact CB-CE2 4.37Å; C50-F59 HydrophobicContact CB-CZ 4.42Å; I51-F59 WeakPolarHBondContact O-CA 3.36Å; N52-F59 HydrophobicContact CB-CD2 3.79Å; N52-F59 HydrophobicContact CB-CE2 4.3Å; F59-C61 WeakPolarHBondContact CZ-SG 3.3Å
60	V	95.3	Very high	92.9	Very high	41 Å²	41	56.2 Å²	56.2	25%	0.248	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.2	-179.7	-168.2	0	0	0	0	109.7	C50 I51 T58 W62 I110	C50-V60 CarbonylContact C-O 3.54Å; C50-V60 VanDerWaalsContact CA-O 3.27Å; C50-V60 WeakPolarHBondContact CA-O 3.46Å; I51-V60 HydrophobicContact CG2-CB 4.13Å; I51-V60 PolarHBondContact N-O 3.42Å; I51-V60 PolarHBondContact O-N 3.49Å; T58-V60 HydrophobicContact CG2-CG2 4.12Å; V60-W62 HydrophobicContact CB-CH2 3.87Å; V60-W62 HydrophobicContact CB-CZ2 3.83Å; V60-W62 HydrophobicContact CB-CZ3 4.46Å; V60-W62 HydrophobicContact CG1-CD2 4.18Å; V60-W62 VanDerWaalsContact CG1-CE2 3.47Å; V60-W62 HydrophobicContact CG1-CH2 3.85Å; V60-W62 HydrophobicContact CG1-CZ2 3.3Å; V60-W62 HydrophobicContact CG1-CZ3 4.47Å; V60-I110 HydrophobicContact CG2-CD1 3.83Å
61	C	96.1	Very high	91.9	Very high	52 Å²	52	57 Å²	57	35%	0.351	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.9	173.4	-69.9	0	0	0	0	110	V49 C50 F59	V49-C61 CarbonylContact O-C 3.51Å; V49-C61 WeakPolarHBondContact O-CA 3.5Å; C50-C61 HydrophobicContact CB-CB 4.12Å; C50-C61 WeakPolarHBondContact CB-SG 3.49Å; C50-C61 WeakPolarHBondContact SG-CB 3.42Å; C50-C61 CovalentContact SG-SG 2.04Å; C50-C61 PolarHBondContact SG-SG 3.45Å; F59-C61 WeakPolarHBondContact CZ-SG 3.3Å
62	W	95.9	Very high	90.4	Very high	21 Å²	21	61 Å²	61	8%	0.08	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.5	176.1	-56.4	-80.8	0	0	0	110.5	K48 V49 I51 V60 L67 F95 I110 F113 L114	K48-W62 WeakPolarHBondContact CA-O 3.46Å; V49-W62 PolarHBondContact N-O 2.9Å; V49-W62 PolarHBondContact O-N 3.33Å; I51-W62 HydrophobicContact CB-CZ3 4.39Å; I51-W62 HydrophobicContact CG2-CH2 3.54Å; I51-W62 HydrophobicContact CG2-CZ3 3.63Å; V60-W62 HydrophobicContact CB-CH2 3.87Å; V60-W62 HydrophobicContact CB-CZ2 3.83Å; V60-W62 HydrophobicContact CB-CZ3 4.46Å; V60-W62 HydrophobicContact CG1-CD2 4.18Å; V60-W62 VanDerWaalsContact CG1-CE2 3.47Å; V60-W62 HydrophobicContact CG1-CH2 3.85Å; V60-W62 HydrophobicContact CG1-CZ2 3.3Å; V60-W62 HydrophobicContact CG1-CZ3 4.47Å; W62-L67 HydrophobicContact CB-CD1 4.08Å; W62-L67 HydrophobicContact CB-CD2 4.09Å; W62-L67 HydrophobicContact CB-CG 3.99Å; W62-L67 HydrophobicContact CG-CD2 4.24Å; W62-F95 AromaticContact CD1-CE1 3.58Å; W62-F95 AromaticContact CD1-CZ 3.63Å; W62-F95 HydrophobicContact CG-CE1 4.38Å; W62-F95 HydrophobicContact CG-CZ 4.47Å; W62-F95 AromaticContact NE1-CE1 3.55Å; W62-I110 HydrophobicContact CH2-CG2 3.75Å; W62-I110 HydrophobicContact CZ2-CG2 3.63Å; W62-F113 HydrophobicContact CE3-CE1 4.36Å; W62-F113 HydrophobicContact CH2-CD1 4.35Å; W62-F113 HydrophobicContact CH2-CE1 4.47Å; W62-F113 AromaticContact CZ3-CD1 3.97Å; W62-F113 HydrophobicContact CZ3-CD1 3.97Å; W62-F113 AromaticContact CZ3-CE1 3.66Å; W62-F113 HydrophobicContact CZ3-CE1 3.66Å; W62-L114 HydrophobicContact CD2-CD2 4.17Å; W62-L114 HydrophobicContact CE3-CD2 3.98Å; W62-L114 HydrophobicContact CH2-CD1 4.4Å; W62-L114 HydrophobicContact CH2-CD2 4.1Å; W62-L114 HydrophobicContact CH2-CG 4.25Å; W62-L114 HydrophobicContact CZ2-CD1 4.04Å; W62-L114 HydrophobicContact CZ2-CD2 4.28Å; W62-L114 HydrophobicContact CZ2-CG 4.36Å; W62-L114 HydrophobicContact CZ3-CD2 3.96Å
63	E	95.1	Very high	88.7	Confident	68 Å²	68	65.4 Å²	65.4	32%	0.318	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	138.3	168.9	-64.1	-68.5	174.5	0	0	109.5	K48 S65 E66 L67	K48-E63 VanDerWaalsContact CE-CD 3.41Å; K48-E63 WeakPolarHBondContact CE-OE1 3.48Å; K48-E63 IonicContact NZ-OE1 3.37Å; K48-E63 PolarHBondContact NZ-OE1 3.35Å; E63-S65 PolarHBondContact O-N 2.92Å; E63-S65 VanDerWaalsContact O-N 3.16Å; E63-E66 HydrophobicContact CB-CG 4.12Å; E63-E66 WeakPolarHBondContact O-CB 3.24Å; E63-E66 PolarHBondContact O-N 3.3Å; E63-L67 PolarHBondContact O-N 2.91Å
64	L	92.6	Very high	87.1	Confident	18 Å²	18	67.4 Å²	67.4	9%	0.094	35%	0.354	C	S	.	.	H	α-helix	trans	-59	-30.3	177.3	-78.7	178.4	0	0	0	112.6	G47 V49 E66 L67 K68 Y117 M126 S128	G47-L64 VanDerWaalsContact O-CB 3.31Å; G47-L64 WeakPolarHBondContact O-CB 3.38Å; G47-L64 WeakPolarHBondContact O-CG 3.27Å; G47-L64 PolarHBondContact O-N 3.01Å; V49-L64 HydrophobicContact CG2-CD2 3.44Å; V49-L64 VanDerWaalsContact CG2-CD2 3.44Å; V49-L64 HydrophobicContact CG2-CG 4.23Å; L64-E66 VanDerWaalsContact C-N 3.32Å; L64-E66 PolarHBondContact O-N 2.98Å; L64-L67 PolarHBondContact O-N 3.26Å; L64-K68 WeakPolarHBondContact O-CB 3.31Å; L64-K68 VanDerWaalsContact O-CG 3.25Å; L64-K68 WeakPolarHBondContact O-CG 3.39Å; L64-K68 PolarHBondContact O-N 2.86Å; L64-Y117 WeakPolarHBondContact CD2-OH 3.38Å; L64-M126 VanDerWaalsContact CD1-O 3.24Å; L64-M126 WeakPolarHBondContact CD1-O 3.42Å; L64-M126 HydrophobicContact CD2-CB 3.73Å; L64-S128 VanDerWaalsContact CD1-OG 3.23Å; L64-S128 WeakPolarHBondContact CD1-OG 3.46Å
65	S	91.2	Very high	85	Confident	76 Å²	76	67.8 Å²	67.8	53%	0.531	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-35.2	176.7	53	0	0	0	0	112.9	E63	E63-S65 PolarHBondContact O-N 2.92Å; E63-S65 VanDerWaalsContact O-N 3.16Å
66	E	91.3	Very high	83.1	Confident	87 Å²	87	71.8 Å²	71.8	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-70.6	-46.4	176	-65.2	173.9	171.8	0	0	110.2	E63 L64 K68 Q69	E63-E66 HydrophobicContact CB-CG 4.12Å; E63-E66 WeakPolarHBondContact O-CB 3.24Å; E63-E66 PolarHBondContact O-N 3.3Å; L64-E66 VanDerWaalsContact C-N 3.32Å; L64-E66 PolarHBondContact O-N 2.98Å; E66-K68 VanDerWaalsContact C-N 3.31Å; E66-K68 PolarHBondContact O-N 3.04Å; E66-Q69 WeakPolarHBondContact O-CB 3.43Å; E66-Q69 PolarHBondContact O-N 2.79Å
67	L	90.2	Very high	81.1	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-63.6	-35	178.5	-64.4	-175.3	0	0	0	112.4	V49 W62 E63 L64 Q69 L70 F95 L114 Y117 L118 M126	V49-L67 HydrophobicContact CB-CD1 4.09Å; V49-L67 HydrophobicContact CG2-CD1 4.14Å; W62-L67 HydrophobicContact CB-CD1 4.08Å; W62-L67 HydrophobicContact CB-CD2 4.09Å; W62-L67 HydrophobicContact CB-CG 3.99Å; W62-L67 HydrophobicContact CG-CD2 4.24Å; E63-L67 PolarHBondContact O-N 2.91Å; L64-L67 PolarHBondContact O-N 3.26Å; L67-Q69 PolarHBondContact O-N 2.86Å; L67-L70 HydrophobicContact CD2-CD1 4.17Å; L67-L70 WeakPolarHBondContact O-CB 3.23Å; L67-L70 PolarHBondContact O-N 3.4Å; L67-L70 VanDerWaalsContact O-N 3.08Å; L67-F95 HydrophobicContact CD2-CE1 4.05Å; L67-F95 HydrophobicContact CD2-CZ 4.11Å; L67-L114 HydrophobicContact CD2-CD2 3.99Å; L67-Y117 HydrophobicContact CD1-CD1 4.44Å; L67-Y117 HydrophobicContact CD1-CE1 4.02Å; L67-L118 HydrophobicContact CB-CD2 4.12Å; L67-M126 HydrophobicContact CB-CE 4.03Å
68	K	87.3	Confident	79	Confident	98 Å²	98	79 Å²	79	43%	0.426	40%	0.402	S	S	.	.	H	α-helix	trans	-60.7	-28.6	176.8	-81.2	178.3	-177.2	-174.9	0	112.7	L64 E66 L70 T71 M126	L64-K68 WeakPolarHBondContact O-CB 3.31Å; L64-K68 VanDerWaalsContact O-CG 3.25Å; L64-K68 WeakPolarHBondContact O-CG 3.39Å; L64-K68 PolarHBondContact O-N 2.86Å; E66-K68 VanDerWaalsContact C-N 3.31Å; E66-K68 PolarHBondContact O-N 3.04Å; K68-L70 VanDerWaalsContact C-N 3.25Å; K68-L70 PolarHBondContact O-N 2.91Å; K68-T71 PolarHBondContact O-N 2.89Å; K68-T71 PolarHBondContact O-OG1 3.49Å; K68-T71 VanDerWaalsContact O-OG1 3.11Å; K68-M126 HydrophobicContact CB-CE 3.99Å; K68-M126 HydrophobicContact CD-CE 4.35Å; K68-M126 HydrophobicContact CG-CE 3.18Å
69	Q	86.1	Confident	76.6	Confident	142 Å²	142	87.1 Å²	87.1	66%	0.664	44%	0.438	S	S	*	.	H	α-helix	trans	-68.5	-30.4	178.5	-63	174.5	22.6	0	0	111.4	E66 L67 S72	E66-Q69 WeakPolarHBondContact O-CB 3.43Å; E66-Q69 PolarHBondContact O-N 2.79Å; L67-Q69 PolarHBondContact O-N 2.86Å; Q69-S72 PolarHBondContact O-OG 3.39Å
70	L	83.9	Confident	74.3	Confident	28 Å²	28	86.9 Å²	86.9	15%	0.147	44%	0.439	C	S	.	.	H	α-helix	trans	-74.6	-25.8	180	-57.1	173.5	0	0	0	112.7	L67 K68 L92 F95 L118	L67-L70 HydrophobicContact CD2-CD1 4.17Å; L67-L70 WeakPolarHBondContact O-CB 3.23Å; L67-L70 PolarHBondContact O-N 3.4Å; L67-L70 VanDerWaalsContact O-N 3.08Å; K68-L70 VanDerWaalsContact C-N 3.25Å; K68-L70 PolarHBondContact O-N 2.91Å; L70-L92 HydrophobicContact CD1-CD2 4.02Å; L70-F95 HydrophobicContact CD1-CB 4.35Å; L70-F95 HydrophobicContact CD1-CD1 4.01Å; L70-F95 HydrophobicContact CD1-CD2 3.96Å; L70-F95 HydrophobicContact CD1-CE1 4.27Å; L70-F95 HydrophobicContact CD1-CE2 4.23Å; L70-F95 HydrophobicContact CD1-CG 3.84Å; L70-F95 HydrophobicContact CD1-CZ 4.37Å; L70-F95 HydrophobicContact CD2-CB 4.38Å; L70-F95 HydrophobicContact CD2-CD2 4.23Å; L70-F95 HydrophobicContact CD2-CG 4.43Å; L70-L118 HydrophobicContact CB-CD1 4.24Å; L70-L118 HydrophobicContact CD1-CD1 4.24Å
71	T	75.8	Confident	72.3	Confident	18 Å²	18	89.7 Å²	89.7	11%	0.11	45%	0.45	C	S	.	.	H	α-helix	trans	-91	-8.6	-175.1	62.3	0	0	0	0	114.5	K68 F73 L74 L118 G122 M126	K68-T71 PolarHBondContact O-N 2.89Å; K68-T71 PolarHBondContact O-OG1 3.49Å; K68-T71 VanDerWaalsContact O-OG1 3.11Å; T71-F73 PolarHBondContact O-N 3Å; T71-L74 HydrophobicContact CG2-CD1 3.88Å; T71-L74 PolarHBondContact O-N 2.83Å; T71-L118 HydrophobicContact CG2-CB 4.25Å; T71-L118 HydrophobicContact CG2-CD2 3.7Å; T71-L118 HydrophobicContact CG2-CG 4.38Å; T71-G122 WeakPolarHBondContact CB-O 3.23Å; T71-M126 HydrophobicContact CG2-SD 4.4Å
72	S	65.4	Low	70.3	Confident	84 Å²	84	95.1 Å²	95.1	59%	0.587	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-10.5	-177.3	54.1	0	0	0	0	115.9	Q69	Q69-S72 PolarHBondContact O-OG 3.39Å
73	F	61.2	Low	68.9	Low	140 Å²	140	102.9 Å²	102.9	61%	0.614	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	2.3	-178.3	-59.5	-94.6	0	0	0	114.1	T71 S75	T71-F73 PolarHBondContact O-N 3Å; F73-S75 PolarHBondContact O-N 2.75Å
74	L	63.7	Low	68.1	Low	52 Å²	52	102 Å²	102	27%	0.272	50%	0.497	S	S	.	.			trans	-66.5	86.8	173.4	-68.6	174.3	0	0	0	108.3	T71 L88	T71-L74 HydrophobicContact CG2-CD1 3.88Å; T71-L74 PolarHBondContact O-N 2.83Å; L74-L88 HydrophobicContact CD2-CD2 4.24Å
75	S	50.8	Low	67.6	Low	76 Å²	76	104.2 Å²	104.2	53%	0.531	51%	0.509	S	S	.	.			trans	-58.8	150	172.1	58	0	0	0	0	109.7	F73 K77	F73-S75 PolarHBondContact O-N 2.75Å; S75-K77 PolarHBondContact O-N 2.84Å
76	D	51.7	Low	67.3	Low	154 Å²	154	104.3 Å²	104.3	82%	0.824	52%	0.515	S	S	*	.	S	Bend	trans	-58.9	27.1	176.4	-85.7	-40.6	0	0	0	115.5	K78	D76-K78 PolarHBondContact O-N 3.07Å
77	K	48.8	Very low	67	Low	172 Å²	172	104.5 Å²	104.5	75%	0.748	52%	0.515	S	S	*	.			trans	-76.6	65.6	175.3	-66.9	-173.7	-180	-174.8	0	110.6	S75 E79	S75-K77 PolarHBondContact O-N 2.84Å; K77-E79 PolarHBondContact O-N 2.83Å
78	K	47.6	Very low	66.8	Low	184 Å²	184	104.8 Å²	104.8	80%	0.8	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-62.7	-10.5	165.6	-83.2	-177.6	174.5	176.7	0	113	D76	D76-K78 PolarHBondContact O-N 3.07Å
79	E	42.3	Very low	66.8	Low	189 Å²	189	101 Å²	101	88%	0.883	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-85.1	-9.8	-167.5	-69.1	-173.5	157.8	0	0	115.9	K77	K77-E79 PolarHBondContact O-N 2.83Å
80	E	48.8	Very low	66.9	Low	125 Å²	125	99.5 Å²	99.5	58%	0.584	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-121.5	54.4	178.5	-69.2	-166.9	-176.9	0	0	113.5	Q82 R83	E80-Q82 PolarHBondContact O-N 3.2Å; E80-R83 PolarHBondContact O-N 2.85Å
81	M	52.5	Low	67.1	Low	99 Å²	99	101.1 Å²	101.1	49%	0.488	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-5.2	174.7	-146.3	171.5	95.4	0	0	114.4	L184 S187 Q191	M81-L184 HydrophobicContact CE-CD1 3.53Å; M81-L184 HydrophobicContact SD-CD1 4.32Å; M81-S187 WeakPolarHBondContact CE-OG 3.34Å; M81-Q191 PolarHBondContact O-NE2 3.21Å
82	Q	53.8	Low	67.7	Low	167 Å²	167	100.3 Å²	100.3	78%	0.78	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-18.4	-177	-66.9	-171.9	-3.1	0	0	114.6	E80 K194	E80-Q82 PolarHBondContact O-N 3.2Å; Q82-K194 PolarHBondContact O-NZ 2.86Å
83	R	67.6	Low	68.9	Low	183 Å²	183	101.2 Å²	101.2	69%	0.691	48%	0.483	S	S	*	.	S	Bend	trans	-117.2	139.5	-176.8	-71.1	-178.4	177.1	158.7	-0.6	111.5	E80 D85	E80-R83 PolarHBondContact O-N 2.85Å; R83-D85 PolarHBondContact O-N 3.28Å
84	L	77.9	Confident	70.2	Confident	50 Å²	50	99.5 Å²	99.5	26%	0.262	48%	0.477	S	S	.	.			trans	-61.3	133.6	171.7	-78.9	173.3	0	0	0	109.3	A86 Y115 Q191 K194 I195	L84-A86 PolarHBondContact O-N 2.88Å; L84-Y115 HydrophobicContact CD2-CE1 3.92Å; L84-Y115 HydrophobicContact CD2-CE2 4.16Å; L84-Q191 HydrophobicContact CD2-CB 4.12Å; L84-K194 HydrophobicContact CD1-CB 3.51Å; L84-K194 HydrophobicContact CD1-CD 4.18Å; L84-K194 HydrophobicContact CD1-CG 4.48Å; L84-K194 HydrophobicContact CD2-CB 4.47Å; L84-K194 HydrophobicContact CG-CB 4.13Å; L84-K194 HydrophobicContact CG-CD 4.13Å; L84-I195 HydrophobicContact CD1-CG1 4.36Å; L84-I195 HydrophobicContact CD2-CD1 4.03Å; L84-I195 HydrophobicContact CD2-CG1 3.77Å
85	D	82.4	Confident	71.4	Confident	65 Å²	65	100.4 Å²	100.4	35%	0.348	48%	0.479	S	S	.	.			trans	-70.9	97.9	168.3	-174.7	-21.4	0	0	0	108.8	R83 E87 L88 V89 Y115	R83-D85 PolarHBondContact O-N 3.28Å; D85-E87 PolarHBondContact O-N 3.39Å; D85-E87 PolarHBondContact OD1-N 2.84Å; D85-L88 HydrophobicContact CB-CB 3.87Å; D85-L88 PolarHBondContact O-N 3.49Å; D85-L88 PolarHBondContact OD1-N 2.98Å; D85-V89 WeakPolarHBondContact O-CG2 3.34Å; D85-V89 PolarHBondContact O-N 3.32Å; D85-Y115 HydrophobicContact CB-CE2 4.39Å; D85-Y115 PolarHBondContact N-OH 3.04Å; D85-Y115 VanDerWaalsContact N-OH 3.11Å
86	A	83.5	Confident	73.1	Confident	78 Å²	78	98.8 Å²	98.8	65%	0.645	46%	0.464	S	S	*	.	H	α-helix	trans	-62.3	-30.8	-177.1	0	0	0	0	0	112.7	L84 K90	L84-A86 PolarHBondContact O-N 2.88Å; A86-K90 WeakPolarHBondContact O-CB 3.23Å; A86-K90 PolarHBondContact O-N 3.44Å
87	E	84.9	Confident	74.5	Confident	90 Å²	90	94.2 Å²	94.2	42%	0.421	45%	0.453	S	S	.	.	H	α-helix	trans	-74.7	-43.3	179	179.9	60.1	-162.2	0	0	110.4	D85 V89 K90 R91	D85-E87 PolarHBondContact O-N 3.39Å; D85-E87 PolarHBondContact OD1-N 2.84Å; E87-V89 PolarHBondContact O-N 2.86Å; E87-K90 PolarHBondContact O-N 2.83Å; E87-R91 WeakPolarHBondContact O-CG 3.48Å; E87-R91 PolarHBondContact O-N 3.48Å; E87-R91 IonicContact OE1-CZ 3.8Å; E87-R91 IonicContact OE1-NE 3.93Å; E87-R91 PolarHBondContact OE1-NE 2.97Å; E87-R91 IonicContact OE1-NH2 2.6Å; E87-R91 PolarHBondContact OE1-NH2 3.42Å
88	L	86.3	Confident	75.8	Confident	7 Å²	7	87.8 Å²	87.8	4%	0.037	43%	0.428	C	S	.	.	H	α-helix	trans	-59.9	-46.7	173.3	-179.3	62.1	0	0	0	111.3	L74 D85 K90 R91 L92 Y115 L118	L74-L88 HydrophobicContact CD2-CD2 4.24Å; D85-L88 HydrophobicContact CB-CB 3.87Å; D85-L88 PolarHBondContact O-N 3.49Å; D85-L88 PolarHBondContact OD1-N 2.98Å; L88-K90 VanDerWaalsContact C-N 3.31Å; L88-K90 PolarHBondContact O-N 2.99Å; L88-R91 PolarHBondContact O-N 3.06Å; L88-L92 HydrophobicContact CD1-CD1 4.12Å; L88-L92 HydrophobicContact CD1-CG 4.14Å; L88-L92 HydrophobicContact CG-CD1 3.95Å; L88-L92 HydrophobicContact CG-CG 4.38Å; L88-L92 WeakPolarHBondContact O-CB 3.45Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.48Å; L88-L92 PolarHBondContact O-N 3.43Å; L88-Y115 HydrophobicContact CB-CE2 4.48Å; L88-Y115 HydrophobicContact CD2-CD2 3.73Å; L88-Y115 HydrophobicContact CD2-CE2 3.81Å; L88-Y115 HydrophobicContact CG-CD2 4.11Å; L88-Y115 HydrophobicContact CG-CE2 4.33Å; L88-L118 HydrophobicContact CD1-CD1 4.31Å
89	V	88.2	Confident	76.2	Confident	18 Å²	18	84.1 Å²	84.1	11%	0.109	42%	0.421	C	S	.	.	H	α-helix	trans	-59.6	-43	177.8	172.2	0	0	0	0	111.2	D85 E87 L92 R93 Y115 I195	D85-V89 WeakPolarHBondContact O-CG2 3.34Å; D85-V89 PolarHBondContact O-N 3.32Å; E87-V89 PolarHBondContact O-N 2.86Å; V89-L92 PolarHBondContact O-N 3.13Å; V89-R93 WeakPolarHBondContact O-CG 3.45Å; V89-R93 PolarHBondContact O-N 3.18Å; V89-Y115 HydrophobicContact CG2-CD2 3.74Å; V89-Y115 HydrophobicContact CG2-CE2 3.69Å; V89-I195 HydrophobicContact CG2-CG1 4.4Å
90	K	87.8	Confident	76.6	Confident	111 Å²	111	82.9 Å²	82.9	48%	0.483	42%	0.421	S	S	.	.	H	α-helix	trans	-61.5	-48.6	178.1	-178	-173.8	170.1	-163.5	0	111.6	A86 E87 L88 L92 R93 E94	A86-K90 WeakPolarHBondContact O-CB 3.23Å; A86-K90 PolarHBondContact O-N 3.44Å; E87-K90 PolarHBondContact O-N 2.83Å; L88-K90 VanDerWaalsContact C-N 3.31Å; L88-K90 PolarHBondContact O-N 2.99Å; K90-L92 VanDerWaalsContact C-N 3.34Å; K90-L92 PolarHBondContact O-N 3.27Å; K90-R93 WeakPolarHBondContact O-CB 3.32Å; K90-R93 PolarHBondContact O-N 3.27Å; K90-E94 VanDerWaalsContact CE-OE1 3.27Å; K90-E94 WeakPolarHBondContact CE-OE1 3.27Å; K90-E94 PolarHBondContact O-N 3.36Å
91	R	87.3	Confident	77	Confident	62 Å²	62	79.7 Å²	79.7	23%	0.234	42%	0.421	C	S	.	.	H	α-helix	trans	-64.5	-38.6	178.8	-71.2	179.8	-178.4	-153.3	2.4	112.7	E87 L88 R93 E94 F95	E87-R91 WeakPolarHBondContact O-CG 3.48Å; E87-R91 PolarHBondContact O-N 3.48Å; E87-R91 IonicContact OE1-CZ 3.8Å; E87-R91 IonicContact OE1-NE 3.93Å; E87-R91 PolarHBondContact OE1-NE 2.97Å; E87-R91 IonicContact OE1-NH2 2.6Å; E87-R91 PolarHBondContact OE1-NH2 3.42Å; L88-R91 PolarHBondContact O-N 3.06Å; R91-R93 VanDerWaalsContact C-N 3.31Å; R91-R93 PolarHBondContact O-N 2.64Å; R91-E94 PolarHBondContact O-N 3.43Å; R91-F95 WeakPolarHBondContact O-CB 3.46Å; R91-F95 PolarHBondContact O-N 3.49Å
92	L	90.2	Very high	77.4	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	44%	0.442	C	S	.	.	H	α-helix	trans	-65	-38.3	176.2	-74.1	175.1	0	0	0	111.9	L70 L88 V89 K90 E94 F95 I96 L111 L114 Y115 L118	L70-L92 HydrophobicContact CD1-CD2 4.02Å; L88-L92 HydrophobicContact CD1-CD1 4.12Å; L88-L92 HydrophobicContact CD1-CG 4.14Å; L88-L92 HydrophobicContact CG-CD1 3.95Å; L88-L92 HydrophobicContact CG-CG 4.38Å; L88-L92 WeakPolarHBondContact O-CB 3.45Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.48Å; L88-L92 PolarHBondContact O-N 3.43Å; V89-L92 PolarHBondContact O-N 3.13Å; K90-L92 VanDerWaalsContact C-N 3.34Å; K90-L92 PolarHBondContact O-N 3.27Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-F95 PolarHBondContact O-N 3.23Å; L92-I96 WeakPolarHBondContact O-CG1 3.11Å; L92-I96 PolarHBondContact O-N 3.24Å; L92-L111 HydrophobicContact CB-CD1 3.33Å; L92-L111 HydrophobicContact CD1-CD1 4.29Å; L92-L111 HydrophobicContact CG-CD1 4.43Å; L92-L114 HydrophobicContact CD1-CB 4.22Å; L92-L114 HydrophobicContact CD2-CB 3.88Å; L92-L114 HydrophobicContact CD2-CD1 4.15Å; L92-Y115 HydrophobicContact CD1-CD2 4.33Å; L92-L118 HydrophobicContact CD1-CD1 4.49Å; L92-L118 HydrophobicContact CD2-CD1 3.71Å; L92-L118 HydrophobicContact CG-CD1 4.49Å
93	R	88.8	Confident	78.1	Confident	104 Å²	104	76.9 Å²	76.9	39%	0.392	41%	0.413	S	S	.	.	H	α-helix	trans	-60.5	-43.9	171.9	-76.2	177.5	177.8	-153.4	-1.1	111.9	V89 K90 R91 I96 G97 V98 L111	V89-R93 WeakPolarHBondContact O-CG 3.45Å; V89-R93 PolarHBondContact O-N 3.18Å; K90-R93 WeakPolarHBondContact O-CB 3.32Å; K90-R93 PolarHBondContact O-N 3.27Å; R91-R93 VanDerWaalsContact C-N 3.31Å; R91-R93 PolarHBondContact O-N 2.64Å; R93-I96 WeakPolarHBondContact O-CG1 3.33Å; R93-G97 PolarHBondContact O-N 3.37Å; R93-V98 CarbonylContact C-O 3.53Å; R93-V98 CarbonylContact O-C 3.46Å; R93-V98 PolarHBondContact O-N 3.2Å; R93-L111 HydrophobicContact CG-CD1 4.21Å; R93-L111 HydrophobicContact CG-CD2 3.78Å
94	E	88.6	Confident	78.9	Confident	104 Å²	104	73 Å²	73	49%	0.486	41%	0.406	S	S	.	.	H	α-helix	trans	-62.9	-42.9	174.4	-69.1	170.2	-174	0	0	111.7	K90 R91 L92 I96 G97	K90-E94 VanDerWaalsContact CE-OE1 3.27Å; K90-E94 WeakPolarHBondContact CE-OE1 3.27Å; K90-E94 PolarHBondContact O-N 3.36Å; R91-E94 PolarHBondContact O-N 3.43Å; L92-E94 VanDerWaalsContact C-N 3.35Å; E94-I96 PolarHBondContact O-N 3.32Å; E94-G97 PolarHBondContact O-N 3.42Å
95	F	88.8	Confident	79.1	Confident	70 Å²	70	74.2 Å²	74.2	31%	0.307	42%	0.419	S	S	.	.	H	α-helix	trans	-62.9	-41.1	179.8	179.1	-105.6	0	0	0	113.1	W62 L67 L70 R91 L92 G97 L114	W62-F95 AromaticContact CD1-CE1 3.58Å; W62-F95 AromaticContact CD1-CZ 3.63Å; W62-F95 HydrophobicContact CG-CE1 4.38Å; W62-F95 HydrophobicContact CG-CZ 4.47Å; W62-F95 AromaticContact NE1-CE1 3.55Å; L67-F95 HydrophobicContact CD2-CE1 4.05Å; L67-F95 HydrophobicContact CD2-CZ 4.11Å; L70-F95 HydrophobicContact CD1-CB 4.35Å; L70-F95 HydrophobicContact CD1-CD1 4.01Å; L70-F95 HydrophobicContact CD1-CD2 3.96Å; L70-F95 HydrophobicContact CD1-CE1 4.27Å; L70-F95 HydrophobicContact CD1-CE2 4.23Å; L70-F95 HydrophobicContact CD1-CG 3.84Å; L70-F95 HydrophobicContact CD1-CZ 4.37Å; L70-F95 HydrophobicContact CD2-CB 4.38Å; L70-F95 HydrophobicContact CD2-CD2 4.23Å; L70-F95 HydrophobicContact CD2-CG 4.43Å; R91-F95 WeakPolarHBondContact O-CB 3.46Å; R91-F95 PolarHBondContact O-N 3.49Å; L92-F95 PolarHBondContact O-N 3.23Å; F95-G97 PolarHBondContact O-N 2.85Å; F95-L114 HydrophobicContact CD1-CD1 4.16Å; F95-L114 HydrophobicContact CE1-CD1 4.28Å
96	I	87.6	Confident	79.3	Confident	43 Å²	43	72.5 Å²	72.5	22%	0.221	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	4	175.5	68.8	178.1	0	0	0	113	L92 R93 E94 V98 L103 A107 I110 L111 L114	L92-I96 WeakPolarHBondContact O-CG1 3.11Å; L92-I96 PolarHBondContact O-N 3.24Å; R93-I96 WeakPolarHBondContact O-CG1 3.33Å; E94-I96 PolarHBondContact O-N 3.32Å; I96-V98 HydrophobicContact CD1-CB 4.35Å; I96-V98 HydrophobicContact CD1-CG2 3.99Å; I96-V98 HydrophobicContact CG1-CB 4.12Å; I96-V98 HydrophobicContact CG1-CG2 3.86Å; I96-L103 HydrophobicContact CD1-CD2 4.17Å; I96-A107 HydrophobicContact CD1-CB 4.39Å; I96-I110 HydrophobicContact CG2-CG2 3.91Å; I96-L111 HydrophobicContact CD1-CB 4.16Å; I96-L111 HydrophobicContact CD1-CD1 4.29Å; I96-L114 HydrophobicContact CG2-CD1 3.87Å
97	G	81.5	Confident	79.6	Confident	58 Å²	58	69.4 Å²	69.4	60%	0.598	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	17.5	178	0	0	0	0	0	115	R93 E94 F95	R93-G97 PolarHBondContact O-N 3.37Å; E94-G97 PolarHBondContact O-N 3.42Å; F95-G97 PolarHBondContact O-N 2.85Å
98	V	74.7	Confident	79.8	Confident	37 Å²	37	65.7 Å²	65.7	22%	0.224	37%	0.371	C	S	.	.			trans	-103.2	89.8	179.7	-177.8	0	0	0	0	109.7	R93 I96 L103 A107	R93-V98 CarbonylContact C-O 3.53Å; R93-V98 CarbonylContact O-C 3.46Å; R93-V98 PolarHBondContact O-N 3.2Å; I96-V98 HydrophobicContact CD1-CB 4.35Å; I96-V98 HydrophobicContact CD1-CG2 3.99Å; I96-V98 HydrophobicContact CG1-CB 4.12Å; I96-V98 HydrophobicContact CG1-CG2 3.86Å; V98-L103 HydrophobicContact CB-CD2 4.08Å; V98-L103 HydrophobicContact CG1-CD2 3.7Å; V98-L103 HydrophobicContact CG1-CG 4.41Å; V98-L103 HydrophobicContact CG2-CD2 3.97Å; V98-A107 HydrophobicContact CG2-CB 4.26Å
99	T	56.2	Low	80.1	Confident	106 Å²	106	65.9 Å²	65.9	65%	0.65	37%	0.373	S	S	*	.	S	Bend	trans	-93.6	-27.6	-175.7	50.6	0	0	0	0	113.9
100	N	52	Low	80.4	Confident	164 Å²	164	66 Å²	66	88%	0.877	37%	0.373	S	S	*	.	S	Bend	trans	-161.6	116.1	173.5	-83.2	-45.8	0	0	0	111.6
101	G	57	Low	80.7	Confident	58 Å²	58	60.7 Å²	60.7	60%	0.598	35%	0.35	S	S	*	.	S	Bend	trans	158.5	168.7	177.1	0	0	0	0	0	112.7	L103	G101-L103 PolarHBondContact O-N 3.44Å
102	N	60.7	Low	81.1	Confident	171 Å²	171	57.7 Å²	57.7	91%	0.914	34%	0.339	S	S	*	.			trans	-68.3	129.7	164.3	-78.1	-13.2	0	0	0	108	D104	N102-D104 PolarHBondContact O-N 2.85Å
103	L	69.3	Low	81.4	Confident	35 Å²	35	57.7 Å²	57.7	18%	0.183	34%	0.339	C	S	.	.			trans	-62.2	132.4	170.6	-69	156.9	0	0	0	108.2	I96 V98 G101 A107 S108 L111	I96-L103 HydrophobicContact CD1-CD2 4.17Å; V98-L103 HydrophobicContact CB-CD2 4.08Å; V98-L103 HydrophobicContact CG1-CD2 3.7Å; V98-L103 HydrophobicContact CG1-CG 4.41Å; V98-L103 HydrophobicContact CG2-CD2 3.97Å; G101-L103 PolarHBondContact O-N 3.44Å; L103-A107 HydrophobicContact CB-CB 4.37Å; L103-A107 HydrophobicContact CD2-CB 3.6Å; L103-S108 WeakPolarHBondContact CB-OG 3.43Å; L103-L111 HydrophobicContact CD1-CD2 3.76Å
104	D	82.5	Confident	81.7	Confident	101 Å²	101	52.8 Å²	52.8	54%	0.54	32%	0.32	S	S	.	.			trans	-68.7	174.5	163.1	65.8	24	0	0	0	110	N102 S106 A107 S108	N102-D104 PolarHBondContact O-N 2.85Å; D104-S106 VanDerWaalsContact C-N 3.28Å; D104-S106 PolarHBondContact O-N 3.03Å; D104-S106 PolarHBondContact OD1-N 3.42Å; D104-A107 WeakPolarHBondContact OD1-CB 3.3Å; D104-A107 PolarHBondContact OD1-N 3.08Å; D104-S108 WeakPolarHBondContact O-CB 3.44Å; D104-S108 PolarHBondContact O-N 2.69Å; D104-S108 PolarHBondContact O-OG 3.21Å
105	S	82	Confident	82	Confident	77 Å²	77	48.3 Å²	48.3	54%	0.538	30%	0.299	S	S	.	.	H	α-helix	trans	-62.6	-36.1	-177.4	-59.2	0	0	0	0	112.4	A109	S105-A109 WeakPolarHBondContact O-CB 3.37Å; S105-A109 PolarHBondContact O-N 2.81Å; S105-A109 VanDerWaalsContact O-N 3.08Å
106	S	86.9	Confident	82.3	Confident	28 Å²	28	45 Å²	45	20%	0.196	28%	0.284	C	S	.	.	H	α-helix	trans	-70.2	-48.2	-179.6	-61.6	0	0	0	0	111.8	I56 T58 D104 S108 A109 I110	I56-S106 WeakPolarHBondContact CD1-OG 3.46Å; T58-S106 WeakPolarHBondContact OG1-CB 3.35Å; T58-S106 PolarHBondContact OG1-OG 3.05Å; D104-S106 VanDerWaalsContact C-N 3.28Å; D104-S106 PolarHBondContact O-N 3.03Å; D104-S106 PolarHBondContact OD1-N 3.42Å; S106-S108 VanDerWaalsContact C-N 3.31Å; S106-S108 PolarHBondContact O-N 3.32Å; S106-A109 PolarHBondContact O-N 3.24Å; S106-I110 WeakPolarHBondContact O-CB 3.46Å; S106-I110 VanDerWaalsContact O-CG1 3.3Å; S106-I110 WeakPolarHBondContact O-CG1 3.5Å; S106-I110 PolarHBondContact O-N 3.39Å
107	A	89.6	Confident	82.6	Confident	14 Å²	14	42.9 Å²	42.9	12%	0.116	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-38.1	177.5	0	0	0	0	0	111.6	I96 V98 L103 D104 L111	I96-A107 HydrophobicContact CD1-CB 4.39Å; V98-A107 HydrophobicContact CG2-CB 4.26Å; L103-A107 HydrophobicContact CB-CB 4.37Å; L103-A107 HydrophobicContact CD2-CB 3.6Å; D104-A107 WeakPolarHBondContact OD1-CB 3.3Å; D104-A107 PolarHBondContact OD1-N 3.08Å; A107-L111 WeakPolarHBondContact O-CB 3.48Å; A107-L111 PolarHBondContact O-N 3.01Å
108	S	90.2	Very high	83.1	Confident	12 Å²	12	40.1 Å²	40.1	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-44.5	175.2	-58	0	0	0	0	112.1	L103 D104 S106 L111 A112	L103-S108 WeakPolarHBondContact CB-OG 3.43Å; D104-S108 WeakPolarHBondContact O-CB 3.44Å; D104-S108 PolarHBondContact O-N 2.69Å; D104-S108 PolarHBondContact O-OG 3.21Å; S106-S108 VanDerWaalsContact C-N 3.31Å; S106-S108 PolarHBondContact O-N 3.32Å; S108-L111 PolarHBondContact O-N 2.86Å; S108-A112 PolarHBondContact O-N 2.98Å
109	A	93.1	Very high	83.9	Confident	11 Å²	11	40 Å²	40	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-46.7	177.8	0	0	0	0	0	111.6	L53 S105 S106 L111 A112 F113 Y149	L53-A109 HydrophobicContact CD1-CB 3.76Å; S105-A109 WeakPolarHBondContact O-CB 3.37Å; S105-A109 PolarHBondContact O-N 2.81Å; S105-A109 VanDerWaalsContact O-N 3.08Å; S106-A109 PolarHBondContact O-N 3.24Å; A109-L111 VanDerWaalsContact C-N 3.33Å; A109-L111 PolarHBondContact O-N 3.43Å; A109-A112 PolarHBondContact O-N 3Å; A109-F113 WeakPolarHBondContact O-CB 3.21Å; A109-F113 PolarHBondContact O-N 3.46Å; A109-Y149 HydrophobicContact CB-CE1 4.16Å; A109-Y149 PolarHBondContact O-OH 3.04Å
110	I	94.8	Very high	85.5	Confident	19 Å²	19	36 Å²	36	10%	0.097	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-44.1	176	-70.1	164.7	0	0	0	111.1	T58 V60 W62 I96 S106 F113 L114	T58-I110 HydrophobicContact CG2-CD1 3.94Å; T58-I110 HydrophobicContact CG2-CG1 4.48Å; V60-I110 HydrophobicContact CG2-CD1 3.83Å; W62-I110 HydrophobicContact CH2-CG2 3.75Å; W62-I110 HydrophobicContact CZ2-CG2 3.63Å; I96-I110 HydrophobicContact CG2-CG2 3.91Å; S106-I110 WeakPolarHBondContact O-CB 3.46Å; S106-I110 VanDerWaalsContact O-CG1 3.3Å; S106-I110 WeakPolarHBondContact O-CG1 3.5Å; S106-I110 PolarHBondContact O-N 3.39Å; I110-F113 WeakPolarHBondContact O-CB 3.16Å; I110-F113 PolarHBondContact O-N 3.3Å; I110-L114 HydrophobicContact CG2-CD1 3.87Å; I110-L114 HydrophobicContact CG2-CG 4.3Å; I110-L114 WeakPolarHBondContact O-CB 2.86Å; I110-L114 WeakPolarHBondContact O-CG 3.27Å; I110-L114 PolarHBondContact O-N 3.45Å
111	L	94.1	Very high	87.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-43.9	179.8	-174.6	62	0	0	0	111.6	L92 R93 I96 L103 A107 S108 A109 Y115 I195	L92-L111 HydrophobicContact CB-CD1 3.33Å; L92-L111 HydrophobicContact CD1-CD1 4.29Å; L92-L111 HydrophobicContact CG-CD1 4.43Å; R93-L111 HydrophobicContact CG-CD1 4.21Å; R93-L111 HydrophobicContact CG-CD2 3.78Å; I96-L111 HydrophobicContact CD1-CB 4.16Å; I96-L111 HydrophobicContact CD1-CD1 4.29Å; L103-L111 HydrophobicContact CD1-CD2 3.76Å; A107-L111 WeakPolarHBondContact O-CB 3.48Å; A107-L111 PolarHBondContact O-N 3.01Å; S108-L111 PolarHBondContact O-N 2.86Å; A109-L111 VanDerWaalsContact C-N 3.33Å; A109-L111 PolarHBondContact O-N 3.43Å; L111-Y115 VanDerWaalsContact O-CB 3.25Å; L111-Y115 WeakPolarHBondContact O-CB 3.49Å; L111-Y115 PolarHBondContact O-N 3.26Å; L111-I195 HydrophobicContact CB-CG2 4.05Å; L111-I195 HydrophobicContact CD2-CG2 3.62Å; L111-I195 HydrophobicContact CG-CG2 3.56Å
112	A	94.9	Very high	88.6	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-43.9	175.5	0	0	0	0	0	111.8	S108 A109 Y115 I116 Y149 I195 I196	S108-A112 PolarHBondContact O-N 2.98Å; A109-A112 PolarHBondContact O-N 3Å; A112-Y115 PolarHBondContact O-N 3.29Å; A112-I116 VanDerWaalsContact O-CG1 3.3Å; A112-I116 WeakPolarHBondContact O-CG1 3.37Å; A112-I116 PolarHBondContact O-N 3.03Å; A112-Y149 HydrophobicContact CB-CE1 4.37Å; A112-I195 HydrophobicContact CB-CG2 4.34Å; A112-I196 HydrophobicContact CB-CD1 4.02Å; A112-I196 HydrophobicContact CB-CG1 4.03Å
113	F	96.8	Very high	89.5	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-55.7	-56	174.2	171.5	-91.1	0	0	0	112.2	V49 I51 W62 A109 I110 Y115 I116 Y117 L129 V131 L153 F157	V49-F113 HydrophobicContact CG1-CE1 3.8Å; V49-F113 HydrophobicContact CG1-CZ 3.66Å; I51-F113 HydrophobicContact CB-CD1 4.48Å; I51-F113 HydrophobicContact CB-CD2 4.33Å; I51-F113 HydrophobicContact CB-CE1 4.38Å; I51-F113 HydrophobicContact CB-CE2 4.14Å; I51-F113 HydrophobicContact CB-CG 4.48Å; I51-F113 HydrophobicContact CB-CZ 4.2Å; I51-F113 HydrophobicContact CD1-CB 3.68Å; I51-F113 HydrophobicContact CD1-CD1 4.28Å; I51-F113 HydrophobicContact CD1-CD2 3.46Å; I51-F113 VanDerWaalsContact CD1-CD2 3.46Å; I51-F113 HydrophobicContact CD1-CE2 4.09Å; I51-F113 HydrophobicContact CD1-CG 3.55Å; I51-F113 HydrophobicContact CG1-CD2 4.22Å; I51-F113 HydrophobicContact CG1-CE2 4.38Å; W62-F113 HydrophobicContact CE3-CE1 4.36Å; W62-F113 HydrophobicContact CH2-CD1 4.35Å; W62-F113 HydrophobicContact CH2-CE1 4.47Å; W62-F113 AromaticContact CZ3-CD1 3.97Å; W62-F113 HydrophobicContact CZ3-CD1 3.97Å; W62-F113 AromaticContact CZ3-CE1 3.66Å; W62-F113 HydrophobicContact CZ3-CE1 3.66Å; A109-F113 WeakPolarHBondContact O-CB 3.21Å; A109-F113 PolarHBondContact O-N 3.46Å; I110-F113 WeakPolarHBondContact O-CB 3.16Å; I110-F113 PolarHBondContact O-N 3.3Å; F113-Y115 VanDerWaalsContact C-N 3.3Å; F113-Y115 PolarHBondContact O-N 3.36Å; F113-I116 PolarHBondContact O-N 2.97Å; F113-Y117 VanDerWaalsContact O-CB 3.23Å; F113-Y117 WeakPolarHBondContact O-CB 2.83Å; F113-Y117 PolarHBondContact O-N 3.24Å; F113-L129 HydrophobicContact CZ-CD1 4.39Å; F113-V131 HydrophobicContact CE2-CB 3.81Å; F113-V131 HydrophobicContact CE2-CG1 4.37Å; F113-V131 HydrophobicContact CE2-CG2 3.66Å; F113-V131 HydrophobicContact CZ-CG2 4.38Å; F113-L153 HydrophobicContact CB-CD1 4.3Å; F113-L153 HydrophobicContact CD2-CD2 3.67Å; F113-L153 HydrophobicContact CE2-CD2 4.33Å; F113-F157 HydrophobicContact CD2-CE2 4.24Å; F113-F157 AromaticContact CD2-CZ 3.85Å; F113-F157 HydrophobicContact CD2-CZ 3.85Å; F113-F157 HydrophobicContact CE2-CE1 4.37Å; F113-F157 HydrophobicContact CE2-CE2 4.28Å; F113-F157 AromaticContact CE2-CZ 3.46Å; F113-F157 HydrophobicContact CE2-CZ 3.46Å; F113-F157 VanDerWaalsContact CE2-CZ 3.46Å; F113-F157 HydrophobicContact CZ-CZ 4.06Å
114	L	95.3	Very high	89.9	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-40	-177.2	-72.1	174.8	0	0	0	111	W62 L67 L92 F95 I96 I110 Y117 L118	W62-L114 HydrophobicContact CD2-CD2 4.17Å; W62-L114 HydrophobicContact CE3-CD2 3.98Å; W62-L114 HydrophobicContact CH2-CD1 4.4Å; W62-L114 HydrophobicContact CH2-CD2 4.1Å; W62-L114 HydrophobicContact CH2-CG 4.25Å; W62-L114 HydrophobicContact CZ2-CD1 4.04Å; W62-L114 HydrophobicContact CZ2-CD2 4.28Å; W62-L114 HydrophobicContact CZ2-CG 4.36Å; W62-L114 HydrophobicContact CZ3-CD2 3.96Å; L67-L114 HydrophobicContact CD2-CD2 3.99Å; L92-L114 HydrophobicContact CD1-CB 4.22Å; L92-L114 HydrophobicContact CD2-CB 3.88Å; L92-L114 HydrophobicContact CD2-CD1 4.15Å; F95-L114 HydrophobicContact CD1-CD1 4.16Å; F95-L114 HydrophobicContact CE1-CD1 4.28Å; I96-L114 HydrophobicContact CG2-CD1 3.87Å; I110-L114 HydrophobicContact CG2-CD1 3.87Å; I110-L114 HydrophobicContact CG2-CG 4.3Å; I110-L114 WeakPolarHBondContact O-CB 2.86Å; I110-L114 WeakPolarHBondContact O-CG 3.27Å; I110-L114 PolarHBondContact O-N 3.45Å; L114-Y117 PolarHBondContact O-N 3.05Å; L114-L118 WeakPolarHBondContact O-CB 2.98Å; L114-L118 VanDerWaalsContact O-CG 3.23Å; L114-L118 WeakPolarHBondContact O-CG 3.44Å; L114-L118 PolarHBondContact O-N 3.47Å
115	Y	94.3	Very high	89.9	Confident	10 Å²	10	24 Å²	24	4%	0.039	16%	0.164	C	C	.	.	H	α-helix	trans	-62.4	-51	178.5	-179.6	-88.2	0	0	0	112	L84 D85 L88 V89 L92 L111 A112 F113 Y117 S119 W188 Q191 I195	L84-Y115 HydrophobicContact CD2-CE1 3.92Å; L84-Y115 HydrophobicContact CD2-CE2 4.16Å; D85-Y115 HydrophobicContact CB-CE2 4.39Å; D85-Y115 PolarHBondContact N-OH 3.04Å; D85-Y115 VanDerWaalsContact N-OH 3.11Å; L88-Y115 HydrophobicContact CB-CE2 4.48Å; L88-Y115 HydrophobicContact CD2-CD2 3.73Å; L88-Y115 HydrophobicContact CD2-CE2 3.81Å; L88-Y115 HydrophobicContact CG-CD2 4.11Å; L88-Y115 HydrophobicContact CG-CE2 4.33Å; V89-Y115 HydrophobicContact CG2-CD2 3.74Å; V89-Y115 HydrophobicContact CG2-CE2 3.69Å; L92-Y115 HydrophobicContact CD1-CD2 4.33Å; L111-Y115 VanDerWaalsContact O-CB 3.25Å; L111-Y115 WeakPolarHBondContact O-CB 3.49Å; L111-Y115 PolarHBondContact O-N 3.26Å; A112-Y115 PolarHBondContact O-N 3.29Å; F113-Y115 VanDerWaalsContact C-N 3.3Å; F113-Y115 PolarHBondContact O-N 3.36Å; Y115-Y117 VanDerWaalsContact C-N 3.35Å; Y115-S119 WeakPolarHBondContact O-CB 3.39Å; Y115-S119 PolarHBondContact O-N 3.27Å; Y115-S119 PolarHBondContact O-OG 3.43Å; Y115-W188 HydrophobicContact CE1-CZ3 4.47Å; Y115-Q191 HydrophobicContact CE1-CB 4.1Å; Y115-I195 HydrophobicContact CD1-CD1 3.32Å; Y115-I195 HydrophobicContact CD2-CD1 3.74Å; Y115-I195 HydrophobicContact CE1-CD1 3.99Å; Y115-I195 HydrophobicContact CE2-CD1 4.34Å; Y115-I195 HydrophobicContact CG-CD1 3.17Å
116	I	94.2	Very high	90.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.2	-42.9	-179.6	-59.5	171.1	0	0	0	109.5	A112 F113 S119 L120 L153 F157 W188	A112-I116 VanDerWaalsContact O-CG1 3.3Å; A112-I116 WeakPolarHBondContact O-CG1 3.37Å; A112-I116 PolarHBondContact O-N 3.03Å; F113-I116 PolarHBondContact O-N 2.97Å; I116-S119 PolarHBondContact O-N 2.96Å; I116-L120 HydrophobicContact CG2-CD1 3.79Å; I116-L120 HydrophobicContact CG2-CG 4.45Å; I116-L120 WeakPolarHBondContact O-CB 3.09Å; I116-L120 WeakPolarHBondContact O-CG 3.33Å; I116-L120 PolarHBondContact O-N 2.91Å; I116-L153 HydrophobicContact CD1-CB 4.23Å; I116-L153 HydrophobicContact CD1-CD1 4.3Å; I116-F157 HydrophobicContact CB-CD2 4.35Å; I116-F157 HydrophobicContact CG2-CD2 3.82Å; I116-W188 HydrophobicContact CG2-CE3 4.32Å
117	Y	94.6	Very high	90.4	Very high	0 Å²	0	20 Å²	20	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.7	-54.7	177.6	178.7	-95.3	0	0	0	112.1	V49 L64 L67 F113 L114 Y115 S119 L120 F121 M126 P127 L129 F157	V49-Y117 HydrophobicContact CG1-CE2 4.29Å; V49-Y117 HydrophobicContact CG2-CE1 4.07Å; V49-Y117 HydrophobicContact CG2-CE2 4.17Å; V49-Y117 VanDerWaalsContact CG2-OH 3.23Å; V49-Y117 WeakPolarHBondContact CG2-OH 3.43Å; L64-Y117 WeakPolarHBondContact CD2-OH 3.38Å; L67-Y117 HydrophobicContact CD1-CD1 4.44Å; L67-Y117 HydrophobicContact CD1-CE1 4.02Å; F113-Y117 VanDerWaalsContact O-CB 3.23Å; F113-Y117 WeakPolarHBondContact O-CB 2.83Å; F113-Y117 PolarHBondContact O-N 3.24Å; L114-Y117 PolarHBondContact O-N 3.05Å; Y115-Y117 VanDerWaalsContact C-N 3.35Å; Y117-S119 VanDerWaalsContact C-N 3.3Å; Y117-S119 PolarHBondContact O-N 2.98Å; Y117-L120 PolarHBondContact O-N 3.49Å; Y117-F121 AromaticContact CD2-CD2 3.39Å; Y117-F121 HydrophobicContact CD2-CD2 3.39Å; Y117-F121 AromaticContact CD2-CE2 3.72Å; Y117-F121 HydrophobicContact CD2-CE2 3.72Å; Y117-F121 HydrophobicContact CD2-CG 4.41Å; Y117-F121 AromaticContact CE2-CD2 3.49Å; Y117-F121 HydrophobicContact CE2-CD2 3.49Å; Y117-F121 VanDerWaalsContact CE2-CD2 3.49Å; Y117-F121 AromaticContact CE2-CE2 3.91Å; Y117-F121 HydrophobicContact CE2-CE2 3.91Å; Y117-F121 HydrophobicContact CE2-CG 4.15Å; Y117-F121 HydrophobicContact CG-CD2 4.03Å; Y117-F121 WeakPolarHBondContact O-CB 3.44Å; Y117-F121 VanDerWaalsContact O-CD2 3.27Å; Y117-F121 WeakPolarHBondContact O-CD2 3.49Å; Y117-F121 PolarHBondContact O-N 3.03Å; Y117-M126 HydrophobicContact CE1-CG 4.45Å; Y117-M126 HydrophobicContact CE1-SD 3.73Å; Y117-P127 PolarHBondContact OH-O 3.47Å; Y117-L129 HydrophobicContact CD2-CD2 4.34Å; Y117-L129 HydrophobicContact CE2-CD1 4.4Å; Y117-L129 HydrophobicContact CE2-CD2 3.81Å; Y117-L129 HydrophobicContact CE2-CG 4.13Å; Y117-F157 HydrophobicContact CD2-CE1 4.28Å; Y117-F157 HydrophobicContact CD2-CE2 4.36Å; Y117-F157 HydrophobicContact CD2-CZ 4Å
118	L	92.6	Very high	90.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.6	-31	-178	-64.3	178.2	0	0	0	112.4	L67 L70 T71 L88 L92 L114 L120 G122 M126	L67-L118 HydrophobicContact CB-CD2 4.12Å; L70-L118 HydrophobicContact CB-CD1 4.24Å; L70-L118 HydrophobicContact CD1-CD1 4.24Å; T71-L118 HydrophobicContact CG2-CB 4.25Å; T71-L118 HydrophobicContact CG2-CD2 3.7Å; T71-L118 HydrophobicContact CG2-CG 4.38Å; L88-L118 HydrophobicContact CD1-CD1 4.31Å; L92-L118 HydrophobicContact CD1-CD1 4.49Å; L92-L118 HydrophobicContact CD2-CD1 3.71Å; L92-L118 HydrophobicContact CG-CD1 4.49Å; L114-L118 WeakPolarHBondContact O-CB 2.98Å; L114-L118 VanDerWaalsContact O-CG 3.23Å; L114-L118 WeakPolarHBondContact O-CG 3.44Å; L114-L118 PolarHBondContact O-N 3.47Å; L118-L120 VanDerWaalsContact C-N 3.34Å; L118-G122 WeakPolarHBondContact O-CA 3.4Å; L118-G122 PolarHBondContact O-N 2.92Å; L118-M126 HydrophobicContact CD2-SD 3.74Å
119	S	90.8	Very high	90.8	Very high	33 Å²	33	19.7 Å²	19.7	23%	0.231	13%	0.132	C	C	.	.	H	α-helix	trans	-70.1	-33.9	177.5	-59.2	0	0	0	0	111.9	Y115 I116 Y117 W188	Y115-S119 WeakPolarHBondContact O-CB 3.39Å; Y115-S119 PolarHBondContact O-N 3.27Å; Y115-S119 PolarHBondContact O-OG 3.43Å; I116-S119 PolarHBondContact O-N 2.96Å; Y117-S119 VanDerWaalsContact C-N 3.3Å; Y117-S119 PolarHBondContact O-N 2.98Å; S119-W188 VanDerWaalsContact CB-CZ3 3.49Å
120	L	90.1	Very high	91	Very high	24 Å²	24	20 Å²	20	13%	0.126	13%	0.133	C	C	.	.	H	α-helix	trans	-85.7	-40.9	178.7	-73.1	176.2	0	0	0	113.3	I116 Y117 L118 F157 L158 T161 W188	I116-L120 HydrophobicContact CG2-CD1 3.79Å; I116-L120 HydrophobicContact CG2-CG 4.45Å; I116-L120 WeakPolarHBondContact O-CB 3.09Å; I116-L120 WeakPolarHBondContact O-CG 3.33Å; I116-L120 PolarHBondContact O-N 2.91Å; Y117-L120 PolarHBondContact O-N 3.49Å; L118-L120 VanDerWaalsContact C-N 3.34Å; L120-F157 HydrophobicContact CD1-CB 3.5Å; L120-F157 VanDerWaalsContact CD1-CB 3.5Å; L120-L158 HydrophobicContact CD1-CD2 4.35Å; L120-L158 HydrophobicContact CD1-CG 4.35Å; L120-L158 HydrophobicContact CD2-CD2 3.86Å; L120-T161 HydrophobicContact CB-CG2 4.09Å; L120-W188 HydrophobicContact CD2-CD2 4.25Å; L120-W188 HydrophobicContact CD2-CH2 4.26Å; L120-W188 HydrophobicContact CD2-CZ2 3.59Å; L120-W188 HydrophobicContact CG-CH2 4.49Å; L120-W188 HydrophobicContact CG-CZ2 4.27Å
121	F	90.1	Very high	91.1	Very high	6 Å²	6	19.1 Å²	19.1	3%	0.026	13%	0.128	C	C	.	.	H	α-helix	trans	-104	-16.3	-174	-61.5	-76.3	0	0	0	114.4	Y117 S123 G124 M126 P127 F157 A160 T161	Y117-F121 AromaticContact CD2-CD2 3.39Å; Y117-F121 HydrophobicContact CD2-CD2 3.39Å; Y117-F121 AromaticContact CD2-CE2 3.72Å; Y117-F121 HydrophobicContact CD2-CE2 3.72Å; Y117-F121 HydrophobicContact CD2-CG 4.41Å; Y117-F121 AromaticContact CE2-CD2 3.49Å; Y117-F121 HydrophobicContact CE2-CD2 3.49Å; Y117-F121 VanDerWaalsContact CE2-CD2 3.49Å; Y117-F121 AromaticContact CE2-CE2 3.91Å; Y117-F121 HydrophobicContact CE2-CE2 3.91Å; Y117-F121 HydrophobicContact CE2-CG 4.15Å; Y117-F121 HydrophobicContact CG-CD2 4.03Å; Y117-F121 WeakPolarHBondContact O-CB 3.44Å; Y117-F121 VanDerWaalsContact O-CD2 3.27Å; Y117-F121 WeakPolarHBondContact O-CD2 3.49Å; Y117-F121 PolarHBondContact O-N 3.03Å; F121-S123 VanDerWaalsContact C-N 3.28Å; F121-S123 PolarHBondContact O-N 3.32Å; F121-G124 PolarHBondContact O-N 3.34Å; F121-M126 HydrophobicContact CB-CG 3.96Å; F121-M126 WeakPolarHBondContact O-CG 3.48Å; F121-P127 HydrophobicContact CD1-CG 3.61Å; F121-P127 HydrophobicContact CE1-CG 3.52Å; F121-P127 HydrophobicContact CG-CG 4.16Å; F121-P127 HydrophobicContact CZ-CG 4.04Å; F121-F157 HydrophobicContact CE2-CB 3.96Å; F121-F157 AromaticContact CE2-CD1 3.98Å; F121-F157 HydrophobicContact CE2-CD1 3.98Å; F121-F157 AromaticContact CE2-CG 3.95Å; F121-F157 HydrophobicContact CE2-CG 3.95Å; F121-F157 HydrophobicContact CZ-CB 4.33Å; F121-F157 HydrophobicContact CZ-CD1 4.49Å; F121-A160 HydrophobicContact CE1-CB 4.42Å; F121-A160 HydrophobicContact CZ-CB 3.89Å; F121-T161 HydrophobicContact CD1-CG2 3.6Å; F121-T161 HydrophobicContact CE1-CG2 3.18Å; F121-T161 HydrophobicContact CE2-CG2 4.23Å; F121-T161 HydrophobicContact CG-CG2 4.29Å; F121-T161 HydrophobicContact CZ-CG2 3.53Å
122	G	83.9	Confident	91.3	Very high	10 Å²	10	20.6 Å²	20.6	10%	0.103	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-16.4	-166.6	0	0	0	0	0	116.1	T71 L118	T71-G122 WeakPolarHBondContact CB-O 3.23Å; L118-G122 WeakPolarHBondContact O-CA 3.4Å; L118-G122 PolarHBondContact O-N 2.92Å
123	S	78.6	Confident	91.4	Very high	92 Å²	92	20.9 Å²	20.9	64%	0.643	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-7.3	173.9	54.5	0	0	0	0	113.6	F121	F121-S123 VanDerWaalsContact C-N 3.28Å; F121-S123 PolarHBondContact O-N 3.32Å
124	G	78.2	Confident	91.5	Very high	51 Å²	51	26.9 Å²	26.9	53%	0.526	16%	0.163	S	C	.	.	S	Bend	trans	-130.9	-155.7	-175.8	0	0	0	0	0	113.3	F121 M126	F121-G124 PolarHBondContact O-N 3.34Å; G124-M126 PolarHBondContact O-N 3.4Å
125	D	82.1	Confident	91.4	Very high	118 Å²	118	27.6 Å²	27.6	63%	0.631	17%	0.168	S	C	*	.			trans	-80.1	109.7	174.9	-163.7	22.5	0	0	0	109.8	P127	D125-P127 WeakPolarHBondContact O-CD 3.21Å
126	M	88.5	Confident	91.4	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.03	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-71.9	120.4	-177.2	-75.6	-161.3	-71.5	0	0	111	L64 L67 K68 T71 Y117 L118 F121 G124	L64-M126 VanDerWaalsContact CD1-O 3.24Å; L64-M126 WeakPolarHBondContact CD1-O 3.42Å; L64-M126 HydrophobicContact CD2-CB 3.73Å; L67-M126 HydrophobicContact CB-CE 4.03Å; K68-M126 HydrophobicContact CB-CE 3.99Å; K68-M126 HydrophobicContact CD-CE 4.35Å; K68-M126 HydrophobicContact CG-CE 3.18Å; T71-M126 HydrophobicContact CG2-SD 4.4Å; Y117-M126 HydrophobicContact CE1-CG 4.45Å; Y117-M126 HydrophobicContact CE1-SD 3.73Å; L118-M126 HydrophobicContact CD2-SD 3.74Å; F121-M126 HydrophobicContact CB-CG 3.96Å; F121-M126 WeakPolarHBondContact O-CG 3.48Å; G124-M126 PolarHBondContact O-N 3.4Å
127	P	91.5	Very high	91.3	Very high	15 Å²	15	30.5 Å²	30.5	10%	0.097	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-76.8	144.6	-178.7	30.3	-34	0	0	0	111.8	V3 Y117 F121 D125 L129	V3-P127 HydrophobicContact CG2-CB 3.45Å; V3-P127 VanDerWaalsContact CG2-CB 3.45Å; V3-P127 HydrophobicContact CG2-CG 3.88Å; Y117-P127 PolarHBondContact OH-O 3.47Å; F121-P127 HydrophobicContact CD1-CG 3.61Å; F121-P127 HydrophobicContact CE1-CG 3.52Å; F121-P127 HydrophobicContact CG-CG 4.16Å; F121-P127 HydrophobicContact CZ-CG 4.04Å; D125-P127 WeakPolarHBondContact O-CD 3.21Å; P127-L129 HydrophobicContact CG-CD2 4.09Å
128	S	93.4	Very high	90.9	Very high	18 Å²	18	31.4 Å²	31.4	13%	0.126	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-77.5	127.4	167.9	-55.8	0	0	0	0	109.3	R44 G47 K48 L64	R44-S128 PolarHBondContact N-O 2.85Å; G47-S128 WeakPolarHBondContact CA-OG 3.45Å; G47-S128 PolarHBondContact N-OG 3Å; G47-S128 VanDerWaalsContact N-OG 3.16Å; K48-S128 PolarHBondContact N-OG 2.84Å; K48-S128 CarbonylContact O-C 3.56Å; K48-S128 WeakPolarHBondContact O-CA 3.45Å; K48-S128 VanDerWaalsContact O-CB 3.31Å; K48-S128 WeakPolarHBondContact O-CB 3.34Å; L64-S128 VanDerWaalsContact CD1-OG 3.23Å; L64-S128 WeakPolarHBondContact CD1-OG 3.46Å
129	L	95.3	Very high	90.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	158.3	-174.8	57.7	79.4	0	0	0	113.4	L41 K42 R44 K48 V49 C50 F113 Y117 P127 V131 F157	L41-L129 HydrophobicContact CD1-CD2 4.33Å; K42-L129 CarbonylContact O-C 3.59Å; K42-L129 VanDerWaalsContact O-CA 3.3Å; K42-L129 WeakPolarHBondContact O-CA 3.25Å; R44-L129 VanDerWaalsContact CD-C 3.44Å; R44-L129 WeakPolarHBondContact CD-O 3.42Å; K48-L129 PolarHBondContact O-N 3.2Å; V49-L129 CarbonylContact C-O 3.47Å; V49-L129 WeakPolarHBondContact CA-O 3.41Å; V49-L129 HydrophobicContact CG1-CD1 3.91Å; V49-L129 HydrophobicContact CG1-CG 4.49Å; C50-L129 PolarHBondContact N-O 3.05Å; F113-L129 HydrophobicContact CZ-CD1 4.39Å; Y117-L129 HydrophobicContact CD2-CD2 4.34Å; Y117-L129 HydrophobicContact CE2-CD1 4.4Å; Y117-L129 HydrophobicContact CE2-CD2 3.81Å; Y117-L129 HydrophobicContact CE2-CG 4.13Å; P127-L129 HydrophobicContact CG-CD2 4.09Å; L129-V131 HydrophobicContact CD1-CG2 3.66Å; L129-F157 HydrophobicContact CD1-CE1 4.19Å; L129-F157 HydrophobicContact CD2-CE1 4.14Å
130	T	96.8	Very high	89.8	Confident	18 Å²	18	37.1 Å²	37.1	11%	0.11	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.8	167.3	-63.9	0	0	0	0	109.2	L41 K42 R44 C50	L41-T130 CarbonylContact C-O 3.55Å; L41-T130 WeakPolarHBondContact CA-O 3.18Å; K42-T130 PolarHBondContact N-O 3.13Å; K42-T130 PolarHBondContact O-N 2.92Å; R44-T130 VanDerWaalsContact CD-OG1 3.24Å; R44-T130 WeakPolarHBondContact CD-OG1 3.31Å; R44-T130 PolarHBondContact NH1-OG1 3.48Å; C50-T130 HydrophobicContact CB-CG2 4.29Å; C50-T130 CarbonylContact O-C 3.53Å; C50-T130 WeakPolarHBondContact O-CA 3.21Å
131	V	97.6	Very high	89.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.2	170.4	178.8	0	0	0	0	109	L39 Q40 L41 C50 I51 N52 F113 L129 V133 L153 F157	L39-V131 HydrophobicContact CD1-CG1 3.55Å; L39-V131 HydrophobicContact CD2-CG1 3.99Å; L39-V131 HydrophobicContact CG-CG1 3.62Å; Q40-V131 CarbonylContact O-C 3.49Å; Q40-V131 WeakPolarHBondContact O-CA 3.46Å; L41-V131 HydrophobicContact CD1-CG2 4.47Å; L41-V131 HydrophobicContact CG-CG2 4.41Å; C50-V131 PolarHBondContact O-N 3.32Å; I51-V131 CarbonylContact C-O 3.57Å; I51-V131 WeakPolarHBondContact CA-O 3.39Å; N52-V131 PolarHBondContact N-O 2.74Å; F113-V131 HydrophobicContact CE2-CB 3.81Å; F113-V131 HydrophobicContact CE2-CG1 4.37Å; F113-V131 HydrophobicContact CE2-CG2 3.66Å; F113-V131 HydrophobicContact CZ-CG2 4.38Å; L129-V131 HydrophobicContact CD1-CG2 3.66Å; V131-V133 HydrophobicContact CG1-CG2 3.76Å; V131-L153 HydrophobicContact CG1-CD2 4.13Å; V131-F157 HydrophobicContact CG2-CE1 3.73Å; V131-F157 HydrophobicContact CG2-CZ 4.07Å
132	S	97.9	Very high	89.2	Confident	32 Å²	32	38 Å²	38	22%	0.224	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.8	170.6	-61.5	0	0	0	0	109.5	L39 Q40 N52	L39-S132 CarbonylContact C-O 3.46Å; L39-S132 WeakPolarHBondContact CA-O 3.36Å; Q40-S132 PolarHBondContact N-O 3.49Å; Q40-S132 PolarHBondContact O-N 3.01Å; N52-S132 CarbonylContact O-C 3.6Å; N52-S132 WeakPolarHBondContact O-CA 3.21Å
133	V	97.7	Very high	89.6	Confident	6 Å²	6	37.8 Å²	37.8	4%	0.036	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.1	-179.9	-165.9	0	0	0	0	110.9	T37 Y38 L39 N52 L53 P54 V131 Y149	T37-V133 HydrophobicContact CG2-CG1 3.38Å; Y38-V133 CarbonylContact O-C 3.46Å; Y38-V133 WeakPolarHBondContact O-CA 3.42Å; Y38-V133 WeakPolarHBondContact O-CG1 3.14Å; L39-V133 HydrophobicContact CB-CG1 4.45Å; L39-V133 HydrophobicContact CB-CG2 4.17Å; L39-V133 HydrophobicContact CD1-CG2 3.81Å; L39-V133 HydrophobicContact CG-CG2 3.88Å; N52-V133 PolarHBondContact O-N 3.35Å; L53-V133 HydrophobicContact CD2-CB 3.72Å; L53-V133 HydrophobicContact CD2-CG2 3.89Å; P54-V133 WeakPolarHBondContact CD-O 3.3Å; V131-V133 HydrophobicContact CG1-CG2 3.76Å; V133-Y149 HydrophobicContact CB-CD2 4.28Å; V133-Y149 HydrophobicContact CB-CE2 4.32Å; V133-Y149 HydrophobicContact CG1-CD2 3.94Å; V133-Y149 HydrophobicContact CG1-CE2 4.46Å; V133-Y149 HydrophobicContact CG2-CD2 4.14Å; V133-Y149 HydrophobicContact CG2-CE2 3.88Å
134	W	97.1	Very high	90.2	Very high	125 Å²	125	33.6 Å²	33.6	47%	0.473	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.4	174.5	178.1	86.5	0	0	0	110.3	Y38 N55 E136	Y38-W134 AromaticContact CD2-CE3 3.73Å; Y38-W134 HydrophobicContact CD2-CE3 3.73Å; Y38-W134 AromaticContact CD2-CZ3 3.79Å; Y38-W134 HydrophobicContact CD2-CZ3 3.79Å; Y38-W134 HydrophobicContact CE2-CE3 4.35Å; Y38-W134 AromaticContact CE2-CZ3 3.94Å; Y38-W134 HydrophobicContact CE2-CZ3 3.94Å; Y38-W134 PolarHBondContact N-O 3.08Å; Y38-W134 PolarHBondContact O-N 2.92Å; N55-W134 VanDerWaalsContact OD1-CA 3.24Å; N55-W134 WeakPolarHBondContact OD1-CA 3.37Å; W134-E136 HydrophobicContact CH2-CB 4.49Å; W134-E136 HydrophobicContact CH2-CG 3.46Å; W134-E136 VanDerWaalsContact CH2-CG 3.46Å; W134-E136 HydrophobicContact CZ3-CG 3.47Å; W134-E136 VanDerWaalsContact CZ3-CG 3.47Å
135	S	95	Very high	90.9	Very high	15 Å²	15	32.5 Å²	32.5	11%	0.105	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	140.4	-176.9	-167.7	0	0	0	0	112.5	T37 N55 L137	T37-S135 WeakPolarHBondContact OG1-CB 3.27Å; T37-S135 PolarHBondContact OG1-OG 2.96Å; N55-S135 PolarHBondContact ND2-O 3.45Å; N55-S135 PolarHBondContact OD1-N 3.04Å; S135-L137 VanDerWaalsContact C-N 3.28Å; S135-L137 WeakPolarHBondContact OG-CB 3.25Å; S135-L137 PolarHBondContact OG-N 2.54Å; S135-L137 VanDerWaalsContact OG-N 3.13Å
136	E	94.4	Very high	91.4	Very high	67 Å²	67	27.9 Å²	27.9	31%	0.313	18%	0.181	S	C	.	.	S	Bend	trans	-76.7	-17.8	167.2	-62	176.8	138	0	0	112	L35 R36 Y38 W134	L35-E136 WeakPolarHBondContact CA-OE2 3.26Å; L35-E136 HydrophobicContact CB-CB 4.06Å; L35-E136 HydrophobicContact CD2-CB 4.21Å; R36-E136 PolarHBondContact N-OE2 2.76Å; R36-E136 PolarHBondContact O-N 2.63Å; Y38-E136 HydrophobicContact CE2-CG 4.14Å; W134-E136 HydrophobicContact CH2-CB 4.49Å; W134-E136 HydrophobicContact CH2-CG 3.46Å; W134-E136 VanDerWaalsContact CH2-CG 3.46Å; W134-E136 HydrophobicContact CZ3-CG 3.47Å; W134-E136 VanDerWaalsContact CZ3-CG 3.47Å
137	L	90.5	Very high	91.7	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	18%	0.18	C	C	.	.	S	Bend	trans	-75.1	131	-176.3	-65.9	161.8	0	0	0	110.6	L33 L35 S135 T139 L143 A148	L33-L137 HydrophobicContact CD2-CD2 3.86Å; L35-L137 HydrophobicContact CB-CD2 3.65Å; L35-L137 HydrophobicContact CB-CG 4.15Å; L35-L137 WeakPolarHBondContact O-CD2 3.5Å; L35-L137 WeakPolarHBondContact O-CG 3.38Å; S135-L137 VanDerWaalsContact C-N 3.28Å; S135-L137 WeakPolarHBondContact OG-CB 3.25Å; S135-L137 PolarHBondContact OG-N 2.54Å; S135-L137 VanDerWaalsContact OG-N 3.13Å; L137-T139 PolarHBondContact O-N 3.29Å; L137-L143 HydrophobicContact CD2-CB 4.03Å; L137-A148 HydrophobicContact CD1-CB 4.09Å
138	P	86.3	Confident	92	Very high	19 Å²	19	27 Å²	27	12%	0.123	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-64.5	126	172.6	25.1	-32.3	0	0	0	110.5	G140 A141 L143 W369	P138-G140 PolarHBondContact O-N 2.87Å; P138-A141 HydrophobicContact CB-CB 4.15Å; P138-A141 HydrophobicContact CG-CB 3.8Å; P138-A141 WeakPolarHBondContact O-CB 3.39Å; P138-A141 PolarHBondContact O-N 2.77Å; P138-L143 HydrophobicContact CG-CD1 3.7Å; P138-W369 HydrophobicContact CB-CH2 4.14Å; P138-W369 HydrophobicContact CG-CH2 3.95Å; P138-W369 HydrophobicContact CG-CZ3 4.27Å
139	T	82.6	Confident	92.2	Very high	82 Å²	82	27 Å²	27	50%	0.503	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	134.1	-178.6	-46.8	0	0	0	0	111	I56 L137 A141	I56-T139 HydrophobicContact CG2-CG2 4.48Å; L137-T139 PolarHBondContact O-N 3.29Å; T139-A141 PolarHBondContact O-N 3.42Å
140	G	78.1	Confident	92.3	Very high	71 Å²	71	27 Å²	27	73%	0.732	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.1	2.9	174.7	0	0	0	0	0	115.6	P138 G142	P138-G140 PolarHBondContact O-N 2.87Å; G140-G142 PolarHBondContact O-N 2.78Å
141	A	83.8	Confident	92.3	Very high	7 Å²	7	26.1 Å²	26.1	6%	0.058	17%	0.168	C	C	.	.	S	Bend	trans	-74	-10.9	-179.4	0	0	0	0	0	114.2	P138 T139 L143 R241	P138-A141 HydrophobicContact CB-CB 4.15Å; P138-A141 HydrophobicContact CG-CB 3.8Å; P138-A141 WeakPolarHBondContact O-CB 3.39Å; P138-A141 PolarHBondContact O-N 2.77Å; T139-A141 PolarHBondContact O-N 3.42Å; A141-L143 HydrophobicContact CB-CD1 4.09Å; A141-L143 HydrophobicContact CB-CG 4.05Å; A141-R241 PolarHBondContact O-NH2 3.07Å
142	G	84.7	Confident	92.3	Very high	43 Å²	43	26.1 Å²	26.1	44%	0.443	17%	0.168	S	C	.	.	S	Bend	trans	82.6	24.2	-175.3	0	0	0	0	0	113.8	G140	G140-G142 PolarHBondContact O-N 2.78Å
143	L	90.5	Very high	92.2	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.021	16%	0.157	C	C	.	.	S	Bend	trans	-97.9	18.5	179.8	-58.4	175	0	0	0	113.4	G12 K13 L33 L137 P138 A141 L234 T333 C340	G12-L143 CarbonylContact C-O 3.58Å; G12-L143 VanDerWaalsContact CA-O 3.31Å; G12-L143 WeakPolarHBondContact CA-O 3.46Å; K13-L143 PolarHBondContact N-O 2.81Å; K13-L143 CarbonylContact O-C 3.13Å; K13-L143 VanDerWaalsContact O-CA 3.24Å; K13-L143 WeakPolarHBondContact O-CA 3.33Å; L33-L143 HydrophobicContact CD2-CB 4.22Å; L33-L143 HydrophobicContact CD2-CD1 4.01Å; L33-L143 HydrophobicContact CD2-CD2 4.13Å; L33-L143 HydrophobicContact CD2-CG 4.36Å; L137-L143 HydrophobicContact CD2-CB 4.03Å; P138-L143 HydrophobicContact CG-CD1 3.7Å; A141-L143 HydrophobicContact CB-CD1 4.09Å; A141-L143 HydrophobicContact CB-CG 4.05Å; L143-L234 HydrophobicContact CD1-CD1 4.23Å; L143-L234 HydrophobicContact CD1-CD2 3.67Å; L143-L234 HydrophobicContact CD1-CG 4.46Å; L143-L234 HydrophobicContact CD2-CD1 4.07Å; L143-T333 HydrophobicContact CD2-CG2 4.38Å; L143-C340 HydrophobicContact CD2-CB 4.33Å
144	G	91.6	Very high	92.2	Very high	4 Å²	4	24.3 Å²	24.3	4%	0.041	16%	0.155	C	C	.	.	S	Bend	trans	73.5	28.2	177.6	0	0	0	0	0	115.4	S146 A147 A148	G144-S146 VanDerWaalsContact C-N 3.35Å; G144-S146 PolarHBondContact O-N 2.96Å; G144-A147 PolarHBondContact O-N 3.09Å; G144-A148 PolarHBondContact O-N 2.85Å
145	S	93	Very high	92.1	Very high	29 Å²	29	18.3 Å²	18.3	20%	0.203	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-38	-179.5	63	0	0	0	0	113.5	Y149	S145-Y149 WeakPolarHBondContact O-CB 3.07Å; S145-Y149 PolarHBondContact O-N 3.44Å
146	S	93.6	Very high	92.1	Very high	21 Å²	21	17.6 Å²	17.6	15%	0.147	13%	0.128	C	C	.	.	H	α-helix	trans	-70.1	-34.9	176.1	61	0	0	0	0	112.5	G144 Y149 S150 E193 H197	G144-S146 VanDerWaalsContact C-N 3.35Å; G144-S146 PolarHBondContact O-N 2.96Å; S146-Y149 WeakPolarHBondContact O-CB 3.34Å; S146-Y149 PolarHBondContact O-N 2.98Å; S146-S150 WeakPolarHBondContact O-CB 3.4Å; S146-S150 PolarHBondContact O-N 3.35Å; S146-S150 PolarHBondContact O-OG 2.84Å; S146-E193 WeakPolarHBondContact CB-OE1 3.28Å; S146-E193 PolarHBondContact OG-OE1 3.31Å; S146-E193 PolarHBondContact OG-OE2 3.41Å; S146-H197 PolarHBondContact OG-NE2 3.32Å
147	A	95	Very high	92.1	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.8	-48.7	175	0	0	0	0	0	110.8	G144 Y149 S150 V151 E193 D204 N205	G144-A147 PolarHBondContact O-N 3.09Å; A147-Y149 VanDerWaalsContact C-N 3.28Å; A147-Y149 PolarHBondContact O-N 2.98Å; A147-S150 PolarHBondContact O-N 3.37Å; A147-S150 VanDerWaalsContact O-N 3.08Å; A147-V151 VanDerWaalsContact O-CG2 3.3Å; A147-V151 WeakPolarHBondContact O-CG2 3.3Å; A147-V151 PolarHBondContact O-N 2.99Å; A147-E193 HydrophobicContact CB-CG 4.1Å; A147-E193 PolarHBondContact N-OE1 3.47Å; A147-E193 VanDerWaalsContact N-OE1 3.13Å; A147-D204 VanDerWaalsContact CB-C 3.44Å; A147-D204 HydrophobicContact CB-CB 3.56Å; A147-N205 HydrophobicContact CB-CB 4.31Å
148	A	96.5	Very high	92.3	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-57.4	-41.8	174.7	0	0	0	0	0	111.7	A10 T37 L137 G144 V151 C152	A10-A148 HydrophobicContact CB-CB 4.2Å; T37-A148 WeakPolarHBondContact OG1-CB 3.33Å; L137-A148 HydrophobicContact CD1-CB 4.09Å; G144-A148 PolarHBondContact O-N 2.85Å; A148-V151 PolarHBondContact O-N 3.36Å; A148-C152 PolarHBondContact O-N 2.99Å; A148-C152 PolarHBondContact O-SG 3.23Å
149	Y	97.2	Very high	92.5	Very high	18 Å²	18	14.1 Å²	14.1	7%	0.071	11%	0.112	C	C	.	.	H	α-helix	trans	-57.3	-49.6	171.6	169.9	-99.7	0	0	0	112.6	I51 L53 A109 A112 V133 S145 S146 A147 V151 C152 L153 I196	I51-Y149 VanDerWaalsContact CD1-OH 3.23Å; I51-Y149 WeakPolarHBondContact CD1-OH 3.41Å; L53-Y149 HydrophobicContact CD2-CE2 3.79Å; A109-Y149 HydrophobicContact CB-CE1 4.16Å; A109-Y149 PolarHBondContact O-OH 3.04Å; A112-Y149 HydrophobicContact CB-CE1 4.37Å; V133-Y149 HydrophobicContact CB-CD2 4.28Å; V133-Y149 HydrophobicContact CB-CE2 4.32Å; V133-Y149 HydrophobicContact CG1-CD2 3.94Å; V133-Y149 HydrophobicContact CG1-CE2 4.46Å; V133-Y149 HydrophobicContact CG2-CD2 4.14Å; V133-Y149 HydrophobicContact CG2-CE2 3.88Å; S145-Y149 WeakPolarHBondContact O-CB 3.07Å; S145-Y149 PolarHBondContact O-N 3.44Å; S146-Y149 WeakPolarHBondContact O-CB 3.34Å; S146-Y149 PolarHBondContact O-N 2.98Å; A147-Y149 VanDerWaalsContact C-N 3.28Å; A147-Y149 PolarHBondContact O-N 2.98Å; Y149-V151 VanDerWaalsContact C-N 3.35Å; Y149-V151 PolarHBondContact O-N 3.25Å; Y149-C152 PolarHBondContact O-N 2.97Å; Y149-L153 HydrophobicContact CD1-CD1 3.91Å; Y149-L153 HydrophobicContact CE1-CD1 3.29Å; Y149-L153 HydrophobicContact CE1-CG 4.27Å; Y149-L153 HydrophobicContact CE2-CD1 4.03Å; Y149-L153 HydrophobicContact CE2-CG 4.26Å; Y149-L153 WeakPolarHBondContact O-CG 3.13Å; Y149-L153 PolarHBondContact O-N 2.78Å; Y149-I196 HydrophobicContact CD1-CD1 4.49Å
150	S	97.4	Very high	92.9	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.4	-35.7	-179.2	-57.7	0	0	0	0	112.4	S146 A147 A154 A189	S146-S150 WeakPolarHBondContact O-CB 3.4Å; S146-S150 PolarHBondContact O-N 3.35Å; S146-S150 PolarHBondContact O-OG 2.84Å; A147-S150 PolarHBondContact O-N 3.37Å; A147-S150 VanDerWaalsContact O-N 3.08Å; S150-A154 WeakPolarHBondContact O-CB 3.16Å; S150-A154 PolarHBondContact O-N 3.47Å; S150-A189 WeakPolarHBondContact CB-O 3.43Å
151	V	97.5	Very high	93.5	Very high	0 Å²	0	8 Å²	8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-63.6	-51.3	173.7	171.8	0	0	0	0	110.4	A10 A147 A148 Y149 L153 A154 A155 I185 A189 N205 T209 D378	A10-V151 HydrophobicContact CB-CB 3.97Å; A10-V151 HydrophobicContact CB-CG1 3.71Å; A147-V151 VanDerWaalsContact O-CG2 3.3Å; A147-V151 WeakPolarHBondContact O-CG2 3.3Å; A147-V151 PolarHBondContact O-N 2.99Å; A148-V151 PolarHBondContact O-N 3.36Å; Y149-V151 VanDerWaalsContact C-N 3.35Å; Y149-V151 PolarHBondContact O-N 3.25Å; V151-L153 VanDerWaalsContact C-N 3.32Å; V151-L153 PolarHBondContact O-N 3.16Å; V151-A154 PolarHBondContact O-N 3.17Å; V151-A155 WeakPolarHBondContact O-CB 3.41Å; V151-A155 PolarHBondContact O-N 3.46Å; V151-I185 HydrophobicContact CG1-CG2 3.96Å; V151-A189 HydrophobicContact CB-CB 4.3Å; V151-A189 HydrophobicContact CG2-CB 3.59Å; V151-N205 HydrophobicContact CG2-CB 4.35Å; V151-T209 WeakPolarHBondContact CG2-OG1 3.38Å; V151-D378 HydrophobicContact CG1-CB 3.78Å
152	C	97.3	Very high	93.6	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.4	-42.8	177.3	-70.8	0	0	0	0	112.4	V8 A10 T37 L39 A148 Y149 A156	V8-C152 HydrophobicContact CG2-CB 3.8Å; V8-C152 WeakPolarHBondContact CG2-O 3.38Å; A10-C152 PolarHBondContact N-SG 3.04Å; A10-C152 VanDerWaalsContact N-SG 3.36Å; T37-C152 PolarHBondContact O-SG 3.43Å; T37-C152 VanDerWaalsContact O-SG 3.41Å; L39-C152 HydrophobicContact CB-CB 3.68Å; L39-C152 HydrophobicContact CD1-CB 3.91Å; L39-C152 HydrophobicContact CG-CB 4.45Å; A148-C152 PolarHBondContact O-N 2.99Å; A148-C152 PolarHBondContact O-SG 3.23Å; Y149-C152 PolarHBondContact O-N 2.97Å; C152-A156 VanDerWaalsContact O-CB 3.3Å; C152-A156 WeakPolarHBondContact O-CB 3.23Å; C152-A156 PolarHBondContact O-N 3.47Å
153	L	97.2	Very high	93.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61	-50.3	176.6	-78.2	178	0	0	0	112	L39 F113 I116 V131 Y149 V151 A155 A156 F157	L39-L153 HydrophobicContact CD1-CD2 3.71Å; L39-L153 HydrophobicContact CD1-CG 4.13Å; F113-L153 HydrophobicContact CB-CD1 4.3Å; F113-L153 HydrophobicContact CD2-CD2 3.67Å; F113-L153 HydrophobicContact CE2-CD2 4.33Å; I116-L153 HydrophobicContact CD1-CB 4.23Å; I116-L153 HydrophobicContact CD1-CD1 4.3Å; V131-L153 HydrophobicContact CG1-CD2 4.13Å; Y149-L153 HydrophobicContact CD1-CD1 3.91Å; Y149-L153 HydrophobicContact CE1-CD1 3.29Å; Y149-L153 HydrophobicContact CE1-CG 4.27Å; Y149-L153 HydrophobicContact CE2-CD1 4.03Å; Y149-L153 HydrophobicContact CE2-CG 4.26Å; Y149-L153 WeakPolarHBondContact O-CG 3.13Å; Y149-L153 PolarHBondContact O-N 2.78Å; V151-L153 VanDerWaalsContact C-N 3.32Å; V151-L153 PolarHBondContact O-N 3.16Å; L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 2.77Å; L153-A156 PolarHBondContact O-N 2.9Å; L153-F157 HydrophobicContact CD2-CE2 4.06Å; L153-F157 HydrophobicContact CD2-CZ 4.13Å; L153-F157 WeakPolarHBondContact O-CB 3.47Å; L153-F157 WeakPolarHBondContact O-CD2 3.48Å; L153-F157 VanDerWaalsContact O-CG 3.32Å; L153-F157 WeakPolarHBondContact O-CG 3.35Å; L153-F157 PolarHBondContact O-N 2.91Å
154	A	96.5	Very high	93.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.7	-49.1	179.6	0	0	0	0	0	110.7	S150 V151 F157 L158 I185 W188 A189	S150-A154 WeakPolarHBondContact O-CB 3.16Å; S150-A154 PolarHBondContact O-N 3.47Å; V151-A154 PolarHBondContact O-N 3.17Å; A154-F157 PolarHBondContact O-N 3.42Å; A154-L158 VanDerWaalsContact O-CB 3.23Å; A154-L158 WeakPolarHBondContact O-CB 3.45Å; A154-L158 WeakPolarHBondContact O-CD1 3.36Å; A154-L158 WeakPolarHBondContact O-CG 3.38Å; A154-L158 PolarHBondContact O-N 2.98Å; A154-I185 HydrophobicContact CB-CG2 4.26Å; A154-W188 HydrophobicContact CB-CB 3.63Å; A154-A189 HydrophobicContact CB-CB 4.46Å
155	A	95.3	Very high	93.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-50.6	180	0	0	0	0	0	112.8	V151 L153 F157 L158 C159 W177 I185 D378	V151-A155 WeakPolarHBondContact O-CB 3.41Å; V151-A155 PolarHBondContact O-N 3.46Å; L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 2.77Å; A155-F157 PolarHBondContact O-N 2.89Å; A155-L158 PolarHBondContact O-N 3.21Å; A155-C159 WeakPolarHBondContact O-CB 3.46Å; A155-C159 PolarHBondContact O-N 3.01Å; A155-W177 HydrophobicContact CB-CH2 3.6Å; A155-W177 HydrophobicContact CB-CZ2 4.03Å; A155-W177 HydrophobicContact CB-CZ3 4.31Å; A155-I185 HydrophobicContact CB-CD1 4.07Å; A155-I185 HydrophobicContact CB-CG1 4.25Å; A155-I185 HydrophobicContact CB-CG2 4.25Å; A155-D378 WeakPolarHBondContact CB-OD2 3.33Å
156	A	95.1	Very high	92.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.9	-41.3	-179.2	0	0	0	0	0	112.5	V8 L39 L41 C152 L153 A160	V8-A156 HydrophobicContact CG1-CB 4.42Å; V8-A156 HydrophobicContact CG2-CB 4.13Å; L39-A156 HydrophobicContact CD1-CB 4.43Å; L39-A156 HydrophobicContact CD2-CB 3.5Å; L39-A156 VanDerWaalsContact CD2-CB 3.5Å; L41-A156 HydrophobicContact CB-CB 4.45Å; L41-A156 HydrophobicContact CD1-CB 3.98Å; C152-A156 VanDerWaalsContact O-CB 3.3Å; C152-A156 WeakPolarHBondContact O-CB 3.23Å; C152-A156 PolarHBondContact O-N 3.47Å; L153-A156 PolarHBondContact O-N 2.9Å; A156-A160 WeakPolarHBondContact O-CB 3.43Å; A156-A160 PolarHBondContact O-N 2.92Å
157	F	95.1	Very high	91.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-72.8	-39.7	178.7	-67.8	-20.7	0	0	0	113.2	L41 F113 I116 Y117 L120 F121 L129 V131 L153 A154 A155 C159 A160 T161	L41-F157 HydrophobicContact CD1-CD1 3.85Å; L41-F157 HydrophobicContact CD1-CE1 4.05Å; F113-F157 HydrophobicContact CD2-CE2 4.24Å; F113-F157 AromaticContact CD2-CZ 3.85Å; F113-F157 HydrophobicContact CD2-CZ 3.85Å; F113-F157 HydrophobicContact CE2-CE1 4.37Å; F113-F157 HydrophobicContact CE2-CE2 4.28Å; F113-F157 AromaticContact CE2-CZ 3.46Å; F113-F157 HydrophobicContact CE2-CZ 3.46Å; F113-F157 VanDerWaalsContact CE2-CZ 3.46Å; F113-F157 HydrophobicContact CZ-CZ 4.06Å; I116-F157 HydrophobicContact CB-CD2 4.35Å; I116-F157 HydrophobicContact CG2-CD2 3.82Å; Y117-F157 HydrophobicContact CD2-CE1 4.28Å; Y117-F157 HydrophobicContact CD2-CE2 4.36Å; Y117-F157 HydrophobicContact CD2-CZ 4Å; L120-F157 HydrophobicContact CD1-CB 3.5Å; L120-F157 VanDerWaalsContact CD1-CB 3.5Å; F121-F157 HydrophobicContact CE2-CB 3.96Å; F121-F157 AromaticContact CE2-CD1 3.98Å; F121-F157 HydrophobicContact CE2-CD1 3.98Å; F121-F157 AromaticContact CE2-CG 3.95Å; F121-F157 HydrophobicContact CE2-CG 3.95Å; F121-F157 HydrophobicContact CZ-CB 4.33Å; F121-F157 HydrophobicContact CZ-CD1 4.49Å; L129-F157 HydrophobicContact CD1-CE1 4.19Å; L129-F157 HydrophobicContact CD2-CE1 4.14Å; V131-F157 HydrophobicContact CG2-CE1 3.73Å; V131-F157 HydrophobicContact CG2-CZ 4.07Å; L153-F157 HydrophobicContact CD2-CE2 4.06Å; L153-F157 HydrophobicContact CD2-CZ 4.13Å; L153-F157 WeakPolarHBondContact O-CB 3.47Å; L153-F157 WeakPolarHBondContact O-CD2 3.48Å; L153-F157 VanDerWaalsContact O-CG 3.32Å; L153-F157 WeakPolarHBondContact O-CG 3.35Å; L153-F157 PolarHBondContact O-N 2.91Å; A154-F157 PolarHBondContact O-N 3.42Å; A155-F157 PolarHBondContact O-N 2.89Å; F157-C159 VanDerWaalsContact C-N 3.29Å; F157-C159 PolarHBondContact O-N 2.98Å; F157-A160 CarbonylContact O-C 3.59Å; F157-A160 PolarHBondContact O-N 3.1Å; F157-A160 VanDerWaalsContact O-N 3.13Å; F157-T161 WeakPolarHBondContact O-CG2 3.39Å; F157-T161 PolarHBondContact O-N 2.89Å; F157-T161 PolarHBondContact O-OG1 3.29Å
158	L	93.4	Very high	90.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.6	-36	174.3	-73	167.6	0	0	0	111.9	L120 A154 A155 T161 G162 N163 I164 L184 I185	L120-L158 HydrophobicContact CD1-CD2 4.35Å; L120-L158 HydrophobicContact CD1-CG 4.35Å; L120-L158 HydrophobicContact CD2-CD2 3.86Å; A154-L158 VanDerWaalsContact O-CB 3.23Å; A154-L158 WeakPolarHBondContact O-CB 3.45Å; A154-L158 WeakPolarHBondContact O-CD1 3.36Å; A154-L158 WeakPolarHBondContact O-CG 3.38Å; A154-L158 PolarHBondContact O-N 2.98Å; A155-L158 PolarHBondContact O-N 3.21Å; L158-T161 PolarHBondContact O-OG1 3.2Å; L158-T161 VanDerWaalsContact O-OG1 3.06Å; L158-G162 PolarHBondContact O-N 2.99Å; L158-N163 HydrophobicContact CD2-CB 3.83Å; L158-N163 PolarHBondContact O-N 3.01Å; L158-I164 HydrophobicContact CB-CD1 3.57Å; L158-I164 HydrophobicContact CB-CG1 3.74Å; L158-I164 HydrophobicContact CB-CG2 4.25Å; L158-I164 HydrophobicContact CD1-CD1 4.35Å; L158-I164 PolarHBondContact O-N 3.29Å; L158-L184 HydrophobicContact CD1-CD2 4.27Å; L158-L184 HydrophobicContact CD1-CG 3.9Å; L158-L184 HydrophobicContact CD2-CD2 3.86Å; L158-L184 HydrophobicContact CD2-CG 4.09Å; L158-I185 HydrophobicContact CD1-CB 4.5Å; L158-I185 HydrophobicContact CD1-CG1 3.86Å
159	C	91.4	Very high	88.8	Confident	17 Å²	17	27.4 Å²	27.4	12%	0.115	16%	0.164	C	C	.	.	H	α-helix	trans	-64.9	-44.9	170.4	-80	0	0	0	0	111.4	A155 F157 T161 G162 I164	A155-C159 WeakPolarHBondContact O-CB 3.46Å; A155-C159 PolarHBondContact O-N 3.01Å; F157-C159 VanDerWaalsContact C-N 3.29Å; F157-C159 PolarHBondContact O-N 2.98Å; C159-T161 VanDerWaalsContact C-N 3.32Å; C159-T161 PolarHBondContact O-N 3.48Å; C159-G162 PolarHBondContact O-N 2.87Å; C159-I164 HydrophobicContact CB-CG1 4.48Å
160	A	91.2	Very high	86.9	Confident	10 Å²	10	36.5 Å²	36.5	8%	0.083	21%	0.207	C	C	.	.	H	α-helix	trans	-67	-30	-179.5	0	0	0	0	0	113.3	V3 L41 F121 A156 F157 G162	V3-A160 HydrophobicContact CG1-CB 3.87Å; V3-A160 HydrophobicContact CG2-CB 4.31Å; L41-A160 HydrophobicContact CD1-CB 4.27Å; F121-A160 HydrophobicContact CE1-CB 4.42Å; F121-A160 HydrophobicContact CZ-CB 3.89Å; A156-A160 WeakPolarHBondContact O-CB 3.43Å; A156-A160 PolarHBondContact O-N 2.92Å; F157-A160 CarbonylContact O-C 3.59Å; F157-A160 PolarHBondContact O-N 3.1Å; F157-A160 VanDerWaalsContact O-N 3.13Å; A160-G162 VanDerWaalsContact C-N 3.28Å
161	T	89.6	Confident	84.8	Confident	15 Å²	15	45.3 Å²	45.3	9%	0.092	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-4.1	170	61.1	0	0	0	0	113.4	M1 L120 F121 F157 L158 C159 N163	M1-T161 VanDerWaalsContact CE-CA 3.44Å; M1-T161 WeakPolarHBondContact CE-O 3.46Å; L120-T161 HydrophobicContact CB-CG2 4.09Å; F121-T161 HydrophobicContact CD1-CG2 3.6Å; F121-T161 HydrophobicContact CE1-CG2 3.18Å; F121-T161 HydrophobicContact CE2-CG2 4.23Å; F121-T161 HydrophobicContact CG-CG2 4.29Å; F121-T161 HydrophobicContact CZ-CG2 3.53Å; F157-T161 WeakPolarHBondContact O-CG2 3.39Å; F157-T161 PolarHBondContact O-N 2.89Å; F157-T161 PolarHBondContact O-OG1 3.29Å; L158-T161 PolarHBondContact O-OG1 3.2Å; L158-T161 VanDerWaalsContact O-OG1 3.06Å; C159-T161 VanDerWaalsContact C-N 3.32Å; C159-T161 PolarHBondContact O-N 3.48Å; T161-N163 WeakPolarHBondContact CB-OD1 3.34Å; T161-N163 PolarHBondContact O-N 2.99Å; T161-N163 WeakPolarHBondContact OG1-CB 3.35Å; T161-N163 VanDerWaalsContact OG1-CG 3.31Å; T161-N163 PolarHBondContact OG1-N 3.33Å; T161-N163 PolarHBondContact OG1-OD1 3.17Å
162	G	87.7	Confident	83.3	Confident	59 Å²	59	48.3 Å²	48.3	61%	0.608	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	16.8	-174.4	0	0	0	0	0	114	L158 C159 A160 I164	L158-G162 PolarHBondContact O-N 2.99Å; C159-G162 PolarHBondContact O-N 2.87Å; A160-G162 VanDerWaalsContact C-N 3.28Å; G162-I164 VanDerWaalsContact C-N 3.27Å
163	N	86.8	Confident	81.6	Confident	99 Å²	99	56.8 Å²	56.8	53%	0.529	29%	0.294	S	S	.	.	S	Bend	trans	-69.7	-29.9	173.6	-81	69.5	0	0	0	111.5	L158 T161	L158-N163 HydrophobicContact CD2-CB 3.83Å; L158-N163 PolarHBondContact O-N 3.01Å; T161-N163 WeakPolarHBondContact CB-OD1 3.34Å; T161-N163 PolarHBondContact O-N 2.99Å; T161-N163 WeakPolarHBondContact OG1-CB 3.35Å; T161-N163 VanDerWaalsContact OG1-CG 3.31Å; T161-N163 PolarHBondContact OG1-N 3.33Å; T161-N163 PolarHBondContact OG1-OD1 3.17Å
164	I	89.3	Confident	80.2	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	33%	0.325	C	S	.	.	S	Bend	trans	-128.2	148	172.4	69.6	-176.7	0	0	0	109.1	L158 C159 G162 W177 D181 L184 I185	L158-I164 HydrophobicContact CB-CD1 3.57Å; L158-I164 HydrophobicContact CB-CG1 3.74Å; L158-I164 HydrophobicContact CB-CG2 4.25Å; L158-I164 HydrophobicContact CD1-CD1 4.35Å; L158-I164 PolarHBondContact O-N 3.29Å; C159-I164 HydrophobicContact CB-CG1 4.48Å; G162-I164 VanDerWaalsContact C-N 3.27Å; I164-W177 HydrophobicContact CD1-CD2 4.45Å; I164-W177 HydrophobicContact CD1-CG 4.44Å; I164-W177 HydrophobicContact CD1-CZ2 4.11Å; I164-W177 VanDerWaalsContact CD1-NE1 3.34Å; I164-D181 HydrophobicContact CB-CB 4.35Å; I164-D181 HydrophobicContact CG2-CB 3.99Å; I164-D181 WeakPolarHBondContact CG2-OD1 3.3Å; I164-L184 HydrophobicContact CG2-CD2 3.99Å; I164-I185 HydrophobicContact CD1-CD1 3.82Å; I164-I185 HydrophobicContact CD1-CG1 3.94Å
165	P	85.8	Confident	79.3	Confident	80 Å²	80	62 Å²	62	52%	0.519	33%	0.328	S	S	.	.			trans	-66.3	156.6	176.5	28.7	-35.2	0	0	0	111.5	P167 W177 D181	P165-P167 WeakPolarHBondContact O-CD 3.3Å; P165-W177 PolarHBondContact O-NE1 3.46Å; P165-D181 WeakPolarHBondContact CD-OD2 3.47Å
166	T	81.1	Confident	78.6	Confident	66 Å²	66	67.7 Å²	67.7	41%	0.405	35%	0.349	S	S	.	.			trans	-78.6	116.7	162	-48.9	0	0	0	0	107.5	L168 V380	T166-L168 HydrophobicContact CG2-CB 4.49Å; T166-L168 PolarHBondContact O-N 2.76Å; T166-V380 HydrophobicContact CG2-CG1 4.23Å
167	P	68.4	Low	78.2	Confident	21 Å²	21	68.4 Å²	68.4	14%	0.136	35%	0.352	C	S	.	.			trans	-75.3	-11.8	-170	28.9	-32	0	0	0	113	P165 K169 R176 W177 V380	P165-P167 WeakPolarHBondContact O-CD 3.3Å; P167-K169 PolarHBondContact O-N 2.8Å; P167-R176 WeakPolarHBondContact CB-O 3.46Å; P167-W177 HydrophobicContact CG-CD2 4.06Å; P167-W177 HydrophobicContact CG-CG 4.36Å; P167-W177 HydrophobicContact CG-CZ2 4.37Å; P167-V380 VanDerWaalsContact CD-CG2 3.46Å; P167-V380 HydrophobicContact CG-CB 3.79Å; P167-V380 HydrophobicContact CG-CG2 3.48Å; P167-V380 VanDerWaalsContact CG-CG2 3.48Å
168	L	70.3	Confident	77.9	Confident	62 Å²	62	71.3 Å²	71.3	33%	0.325	37%	0.371	S	S	.	.			trans	-74.3	114.3	177.2	-70	172	0	0	0	111.6	T166 V380	T166-L168 HydrophobicContact CG2-CB 4.49Å; T166-L168 PolarHBondContact O-N 2.76Å; L168-V380 HydrophobicContact CD1-CB 4.22Å; L168-V380 HydrophobicContact CD1-CG1 3.59Å; L168-V380 HydrophobicContact CG-CB 4.2Å; L168-V380 HydrophobicContact CG-CG1 4.01Å
169	K	62	Low	77.7	Confident	124 Å²	124	75.7 Å²	75.7	54%	0.539	39%	0.392	S	S	.	.			trans	-77.5	157.3	159.9	-64.6	173.7	-174.1	162.6	0	109.7	P167 W171 E172	P167-K169 PolarHBondContact O-N 2.8Å; K169-W171 HydrophobicContact CD-CZ2 3.93Å; K169-W171 PolarHBondContact O-N 2.97Å; K169-E172 HydrophobicContact CB-CG 4.37Å; K169-E172 PolarHBondContact O-N 3.46Å
170	E	56.1	Low	77.7	Confident	210 Å²	210	81.2 Å²	81.2	98%	0.981	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-17.2	-175.7	-69.7	-177.9	166	0	0	115.6
171	W	54.6	Low	77.7	Confident	185 Å²	185	82 Å²	82	70%	0.701	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-4.1	-177.6	55.1	-90.5	0	0	0	114.5	K169	K169-W171 HydrophobicContact CD-CZ2 3.93Å; K169-W171 PolarHBondContact O-N 2.97Å
172	E	65.4	Low	77.8	Confident	62 Å²	62	82.1 Å²	82.1	29%	0.29	42%	0.419	S	S	.	.			trans	-91.8	137	179.2	-71.8	174.3	165.7	0	0	110.4	K169	K169-E172 HydrophobicContact CB-CG 4.37Å; K169-E172 PolarHBondContact O-N 3.46Å
173	Q	61.2	Low	78.1	Confident	178 Å²	178	84.2 Å²	84.2	83%	0.832	41%	0.413	S	S	*	.	S	Bend	trans	-86.9	-20.3	179	-66.2	-68	-31.8	0	0	112.9
174	T	69.2	Low	78.4	Confident	105 Å²	105	81.4 Å²	81.4	64%	0.644	40%	0.397	S	S	*	.	S	Bend	trans	-150.9	133.7	179.5	56.9	0	0	0	0	109.7	V380	T174-V380 WeakPolarHBondContact CA-O 3.3Å
175	G	76.9	Confident	78.7	Confident	6 Å²	6	81.2 Å²	81.2	6%	0.062	40%	0.396	C	S	.	.			trans	-120.6	154.1	178.8	0	0	0	0	0	113.1	S379 V380	G175-S379 WeakPolarHBondContact O-CA 3.49Å; G175-V380 PolarHBondContact N-O 2.94Å; G175-V380 PolarHBondContact O-N 3.18Å; G175-V380 VanDerWaalsContact O-N 3.1Å
176	R	81.1	Confident	79.2	Confident	119 Å²	119	78.6 Å²	78.6	45%	0.449	38%	0.378	S	S	.	.			trans	-127.8	146.2	171.3	-77.7	179.8	163.6	-111.3	-56	110.2	P167 P376 G377 D378	P167-R176 WeakPolarHBondContact CB-O 3.46Å; R176-P376 VanDerWaalsContact NH2-C 3.27Å; R176-G377 PolarHBondContact NH2-O 2.9Å; R176-D378 PolarHBondContact NH2-O 3.37Å
177	W	86.9	Confident	79.8	Confident	14 Å²	14	77 Å²	77	5%	0.053	37%	0.369	C	S	.	.			trans	-79.1	163.3	174.7	-62.6	-90.8	0	0	0	112.7	V8 A155 I164 P165 P167 D181 L182 I185 D378 V380	V8-W177 HydrophobicContact CG1-CH2 4.22Å; A155-W177 HydrophobicContact CB-CH2 3.6Å; A155-W177 HydrophobicContact CB-CZ2 4.03Å; A155-W177 HydrophobicContact CB-CZ3 4.31Å; I164-W177 HydrophobicContact CD1-CD2 4.45Å; I164-W177 HydrophobicContact CD1-CG 4.44Å; I164-W177 HydrophobicContact CD1-CZ2 4.11Å; I164-W177 VanDerWaalsContact CD1-NE1 3.34Å; P165-W177 PolarHBondContact O-NE1 3.46Å; P167-W177 HydrophobicContact CG-CD2 4.06Å; P167-W177 HydrophobicContact CG-CG 4.36Å; P167-W177 HydrophobicContact CG-CZ2 4.37Å; W177-D181 HydrophobicContact CB-CB 3.59Å; W177-D181 HydrophobicContact CG-CB 4.14Å; W177-L182 HydrophobicContact CB-CD2 4.32Å; W177-L182 HydrophobicContact CB-CG 4.26Å; W177-L182 HydrophobicContact CE3-CD2 4.4Å; W177-I185 HydrophobicContact CD2-CD1 3.8Å; W177-I185 HydrophobicContact CE3-CD1 3.83Å; W177-I185 HydrophobicContact CG-CD1 4.18Å; W177-I185 HydrophobicContact CH2-CD1 4.43Å; W177-I185 HydrophobicContact CZ2-CD1 4.44Å; W177-I185 HydrophobicContact CZ3-CD1 4.18Å; W177-D378 HydrophobicContact CZ3-CB 4.16Å; W177-D378 VanDerWaalsContact CZ3-CG 3.5Å; W177-D378 VanDerWaalsContact CZ3-OD2 3.3Å; W177-D378 WeakPolarHBondContact CZ3-OD2 3.38Å; W177-V380 HydrophobicContact CD2-CG2 4.48Å; W177-V380 HydrophobicContact CE3-CG2 4.43Å; W177-V380 HydrophobicContact CH2-CB 4.34Å; W177-V380 HydrophobicContact CH2-CG2 2.97Å; W177-V380 HydrophobicContact CZ2-CB 4.48Å; W177-V380 HydrophobicContact CZ2-CG2 2.98Å; W177-V380 HydrophobicContact CZ3-CG2 3.72Å
178	C	88.8	Confident	81.1	Confident	61 Å²	61	77.5 Å²	77.5	41%	0.412	37%	0.369	S	S	.	.			trans	-72.6	172.3	173.4	71.2	0	0	0	0	111.5	E180 D181 L182	C178-E180 VanDerWaalsContact C-N 3.31Å; C178-E180 PolarHBondContact O-N 2.82Å; C178-E180 PolarHBondContact SG-OE2 2.86Å; C178-D181 PolarHBondContact O-N 3.41Å; C178-D181 VanDerWaalsContact SG-CG 3.52Å; C178-D181 PolarHBondContact SG-OD2 2.83Å; C178-D181 VanDerWaalsContact SG-OD2 3.38Å; C178-L182 VanDerWaalsContact O-CG 3.31Å; C178-L182 WeakPolarHBondContact O-CG 3.1Å; C178-L182 PolarHBondContact O-N 3.35Å
179	Q	87.8	Confident	82.3	Confident	93 Å²	93	74.5 Å²	74.5	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-40.5	-175.1	-176.7	63.3	21.8	0	0	112.1	L182 E183	Q179-L182 PolarHBondContact O-N 3.11Å; Q179-E183 PolarHBondContact NE2-OE1 2.86Å; Q179-E183 WeakPolarHBondContact O-CG 3.39Å; Q179-E183 PolarHBondContact O-N 3.44Å
180	E	90.8	Very high	83.8	Confident	133 Å²	133	71.2 Å²	71.2	62%	0.621	34%	0.339	S	S	*	.	H	α-helix	trans	-64.1	-42.7	-179.8	-60.4	78.1	-170.7	0	0	111.7	C178 E183 L184	C178-E180 VanDerWaalsContact C-N 3.31Å; C178-E180 PolarHBondContact O-N 2.82Å; C178-E180 PolarHBondContact SG-OE2 2.86Å; E180-E183 PolarHBondContact O-N 3.1Å; E180-L184 PolarHBondContact O-N 3.1Å; E180-L184 VanDerWaalsContact O-N 3.14Å
181	D	92.9	Very high	85.6	Confident	25 Å²	25	61.7 Å²	61.7	13%	0.134	29%	0.294	C	S	.	.	H	α-helix	trans	-67	-41.4	176.2	-71.6	-20.7	0	0	0	111.5	I164 P165 W177 C178 E183 L184 I185	I164-D181 HydrophobicContact CB-CB 4.35Å; I164-D181 HydrophobicContact CG2-CB 3.99Å; I164-D181 WeakPolarHBondContact CG2-OD1 3.3Å; P165-D181 WeakPolarHBondContact CD-OD2 3.47Å; W177-D181 HydrophobicContact CB-CB 3.59Å; W177-D181 HydrophobicContact CG-CB 4.14Å; C178-D181 PolarHBondContact O-N 3.41Å; C178-D181 VanDerWaalsContact SG-CG 3.52Å; C178-D181 PolarHBondContact SG-OD2 2.83Å; C178-D181 VanDerWaalsContact SG-OD2 3.38Å; D181-E183 VanDerWaalsContact C-N 3.31Å; D181-E183 PolarHBondContact O-N 3.5Å; D181-L184 WeakPolarHBondContact O-CB 3.11Å; D181-L184 PolarHBondContact O-N 2.63Å; D181-L184 VanDerWaalsContact O-N 3.17Å; D181-I185 WeakPolarHBondContact O-CG1 3.49Å; D181-I185 PolarHBondContact O-N 3.01Å
182	L	91.8	Very high	87.4	Confident	18 Å²	18	52.9 Å²	52.9	9%	0.094	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-37.2	175.9	-70.7	172.8	0	0	0	111.6	W177 C178 Q179 L184 I185 N186 T209	W177-L182 HydrophobicContact CB-CD2 4.32Å; W177-L182 HydrophobicContact CB-CG 4.26Å; W177-L182 HydrophobicContact CE3-CD2 4.4Å; C178-L182 VanDerWaalsContact O-CG 3.31Å; C178-L182 WeakPolarHBondContact O-CG 3.1Å; C178-L182 PolarHBondContact O-N 3.35Å; Q179-L182 PolarHBondContact O-N 3.11Å; L182-L184 VanDerWaalsContact C-N 3.32Å; L182-I185 HydrophobicContact CD2-CD1 4.3Å; L182-I185 PolarHBondContact O-N 2.91Å; L182-N186 VanDerWaalsContact O-CB 3.26Å; L182-N186 WeakPolarHBondContact O-CB 3.42Å; L182-N186 PolarHBondContact O-N 2.94Å; L182-T209 HydrophobicContact CB-CG2 3.98Å; L182-T209 HydrophobicContact CD2-CG2 3.77Å; L182-T209 HydrophobicContact CG-CG2 4.47Å; L182-T209 VanDerWaalsContact O-CG2 3.26Å; L182-T209 WeakPolarHBondContact O-CG2 3.34Å
183	E	92.6	Very high	88.7	Confident	104 Å²	104	50 Å²	50	49%	0.486	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-40.4	173.2	-75.5	174	-166.3	0	0	111.7	Q179 E180 D181 N186 S187 W210	Q179-E183 PolarHBondContact NE2-OE1 2.86Å; Q179-E183 WeakPolarHBondContact O-CG 3.39Å; Q179-E183 PolarHBondContact O-N 3.44Å; E180-E183 PolarHBondContact O-N 3.1Å; D181-E183 VanDerWaalsContact C-N 3.31Å; D181-E183 PolarHBondContact O-N 3.5Å; E183-N186 PolarHBondContact O-N 3.23Å; E183-S187 WeakPolarHBondContact O-CB 3.42Å; E183-S187 PolarHBondContact O-N 2.95Å; E183-W210 HydrophobicContact CG-CZ2 4.47Å
184	L	94.2	Very high	90.2	Very high	39 Å²	39	43.6 Å²	43.6	20%	0.204	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-46.9	174.9	-174.8	59.4	0	0	0	111.7	M81 L158 I164 E180 D181 L182 N186 S187 W188	M81-L184 HydrophobicContact CE-CD1 3.53Å; M81-L184 HydrophobicContact SD-CD1 4.32Å; L158-L184 HydrophobicContact CD1-CD2 4.27Å; L158-L184 HydrophobicContact CD1-CG 3.9Å; L158-L184 HydrophobicContact CD2-CD2 3.86Å; L158-L184 HydrophobicContact CD2-CG 4.09Å; I164-L184 HydrophobicContact CG2-CD2 3.99Å; E180-L184 PolarHBondContact O-N 3.1Å; E180-L184 VanDerWaalsContact O-N 3.14Å; D181-L184 WeakPolarHBondContact O-CB 3.11Å; D181-L184 PolarHBondContact O-N 2.63Å; D181-L184 VanDerWaalsContact O-N 3.17Å; L182-L184 VanDerWaalsContact C-N 3.32Å; L184-N186 VanDerWaalsContact C-N 3.35Å; L184-N186 PolarHBondContact O-N 2.85Å; L184-S187 PolarHBondContact O-N 2.99Å; L184-S187 PolarHBondContact O-OG 3.31Å; L184-W188 PolarHBondContact O-N 2.84Å
185	I	95.3	Very high	91.2	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.1	-50.5	175.1	-68.7	164.6	0	0	0	110.2	V151 A154 A155 L158 I164 W177 D181 L182 S187 W188 A189 T209	V151-I185 HydrophobicContact CG1-CG2 3.96Å; A154-I185 HydrophobicContact CB-CG2 4.26Å; A155-I185 HydrophobicContact CB-CD1 4.07Å; A155-I185 HydrophobicContact CB-CG1 4.25Å; A155-I185 HydrophobicContact CB-CG2 4.25Å; L158-I185 HydrophobicContact CD1-CB 4.5Å; L158-I185 HydrophobicContact CD1-CG1 3.86Å; I164-I185 HydrophobicContact CD1-CD1 3.82Å; I164-I185 HydrophobicContact CD1-CG1 3.94Å; W177-I185 HydrophobicContact CD2-CD1 3.8Å; W177-I185 HydrophobicContact CE3-CD1 3.83Å; W177-I185 HydrophobicContact CG-CD1 4.18Å; W177-I185 HydrophobicContact CH2-CD1 4.43Å; W177-I185 HydrophobicContact CZ2-CD1 4.44Å; W177-I185 HydrophobicContact CZ3-CD1 4.18Å; D181-I185 WeakPolarHBondContact O-CG1 3.49Å; D181-I185 PolarHBondContact O-N 3.01Å; L182-I185 HydrophobicContact CD2-CD1 4.3Å; L182-I185 PolarHBondContact O-N 2.91Å; I185-S187 VanDerWaalsContact C-N 3.29Å; I185-S187 PolarHBondContact O-N 2.92Å; I185-W188 PolarHBondContact O-N 3.41Å; I185-A189 WeakPolarHBondContact O-CB 2.93Å; I185-A189 PolarHBondContact O-N 2.9Å; I185-T209 HydrophobicContact CB-CG2 4.23Å; I185-T209 HydrophobicContact CG2-CG2 4.05Å
186	N	95.1	Very high	91.7	Very high	25 Å²	25	40.4 Å²	40.4	13%	0.134	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-39	-179.7	-178	54.6	0	0	0	111.9	L182 E183 L184 A189 F190 N205 A206 T209	L182-N186 VanDerWaalsContact O-CB 3.26Å; L182-N186 WeakPolarHBondContact O-CB 3.42Å; L182-N186 PolarHBondContact O-N 2.94Å; E183-N186 PolarHBondContact O-N 3.23Å; L184-N186 VanDerWaalsContact C-N 3.35Å; L184-N186 PolarHBondContact O-N 2.85Å; N186-A189 PolarHBondContact O-N 3.24Å; N186-F190 VanDerWaalsContact O-CB 3.31Å; N186-F190 WeakPolarHBondContact O-CB 3.35Å; N186-F190 PolarHBondContact O-N 3.13Å; N186-N205 PolarHBondContact OD1-ND2 2.68Å; N186-A206 WeakPolarHBondContact OD1-CA 3.2Å; N186-A206 PolarHBondContact OD1-N 2.98Å; N186-T209 HydrophobicContact CB-CG2 3.98Å
187	S	94.3	Very high	91.9	Very high	32 Å²	32	40 Å²	40	22%	0.224	20%	0.197	C	C	.	.	H	α-helix	trans	-63.7	-41.4	178.9	77.3	0	0	0	0	112.6	M81 E183 L184 I185 Q191	M81-S187 WeakPolarHBondContact CE-OG 3.34Å; E183-S187 WeakPolarHBondContact O-CB 3.42Å; E183-S187 PolarHBondContact O-N 2.95Å; L184-S187 PolarHBondContact O-N 2.99Å; L184-S187 PolarHBondContact O-OG 3.31Å; I185-S187 VanDerWaalsContact C-N 3.29Å; I185-S187 PolarHBondContact O-N 2.92Å; S187-Q191 WeakPolarHBondContact O-CG 3.31Å; S187-Q191 PolarHBondContact O-N 3.45Å
188	W	95.1	Very high	91.9	Very high	32 Å²	32	41.7 Å²	41.7	12%	0.121	22%	0.218	C	C	.	.	H	α-helix	trans	-73	-41.9	176.3	-82.3	106.7	0	0	0	112.2	Y115 I116 S119 L120 A154 L184 I185 F190 Q191 G192	Y115-W188 HydrophobicContact CE1-CZ3 4.47Å; I116-W188 HydrophobicContact CG2-CE3 4.32Å; S119-W188 VanDerWaalsContact CB-CZ3 3.49Å; L120-W188 HydrophobicContact CD2-CD2 4.25Å; L120-W188 HydrophobicContact CD2-CH2 4.26Å; L120-W188 HydrophobicContact CD2-CZ2 3.59Å; L120-W188 HydrophobicContact CG-CH2 4.49Å; L120-W188 HydrophobicContact CG-CZ2 4.27Å; A154-W188 HydrophobicContact CB-CB 3.63Å; L184-W188 PolarHBondContact O-N 2.84Å; I185-W188 PolarHBondContact O-N 3.41Å; W188-F190 PolarHBondContact O-N 2.87Å; W188-Q191 WeakPolarHBondContact O-CB 3.37Å; W188-Q191 PolarHBondContact O-N 2.93Å; W188-G192 PolarHBondContact O-N 3.1Å; W188-G192 VanDerWaalsContact O-N 3.1Å
189	A	96	Very high	91.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-38.5	174.5	0	0	0	0	0	111.5	S150 V151 A154 I185 N186 Q191 G192 E193 N205	S150-A189 WeakPolarHBondContact CB-O 3.43Å; V151-A189 HydrophobicContact CB-CB 4.3Å; V151-A189 HydrophobicContact CG2-CB 3.59Å; A154-A189 HydrophobicContact CB-CB 4.46Å; I185-A189 WeakPolarHBondContact O-CB 2.93Å; I185-A189 PolarHBondContact O-N 2.9Å; N186-A189 PolarHBondContact O-N 3.24Å; A189-Q191 VanDerWaalsContact C-N 3.33Å; A189-Q191 PolarHBondContact O-N 3.42Å; A189-G192 PolarHBondContact O-N 3.21Å; A189-E193 PolarHBondContact O-N 3.34Å; A189-N205 HydrophobicContact CB-CB 4.03Å
190	F	94.5	Very high	91.6	Very high	54 Å²	54	43 Å²	43	24%	0.237	23%	0.225	C	C	.	.	H	α-helix	trans	-64	-35	175	-173.3	-130.8	0	0	0	113	N186 W188 E193 K194 P200	N186-F190 VanDerWaalsContact O-CB 3.31Å; N186-F190 WeakPolarHBondContact O-CB 3.35Å; N186-F190 PolarHBondContact O-N 3.13Å; W188-F190 PolarHBondContact O-N 2.87Å; F190-E193 PolarHBondContact O-N 3.04Å; F190-K194 HydrophobicContact CE1-CD 4.39Å; F190-K194 WeakPolarHBondContact O-CG 3.46Å; F190-K194 PolarHBondContact O-N 2.72Å; F190-P200 HydrophobicContact CD2-CG 4.17Å; F190-P200 HydrophobicContact CE2-CB 4.33Å; F190-P200 HydrophobicContact CE2-CG 3.74Å
191	Q	92.3	Very high	91.4	Very high	10 Å²	10	40 Å²	40	5%	0.047	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-42.3	172.7	-58.2	-59	-23.4	0	0	111.2	M81 L84 Y115 S187 W188 A189 E193 K194 I195	M81-Q191 PolarHBondContact O-NE2 3.21Å; L84-Q191 HydrophobicContact CD2-CB 4.12Å; Y115-Q191 HydrophobicContact CE1-CB 4.1Å; S187-Q191 WeakPolarHBondContact O-CG 3.31Å; S187-Q191 PolarHBondContact O-N 3.45Å; W188-Q191 WeakPolarHBondContact O-CB 3.37Å; W188-Q191 PolarHBondContact O-N 2.93Å; A189-Q191 VanDerWaalsContact C-N 3.33Å; A189-Q191 PolarHBondContact O-N 3.42Å; Q191-E193 VanDerWaalsContact C-N 3.34Å; Q191-E193 PolarHBondContact O-N 3.11Å; Q191-K194 PolarHBondContact O-N 3.41Å; Q191-I195 WeakPolarHBondContact O-CG1 3.47Å; Q191-I195 PolarHBondContact O-N 3.3Å; Q191-I195 VanDerWaalsContact O-N 3.1Å
192	G	93.4	Very high	91.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-56.5	-46.4	172.2	0	0	0	0	0	112.4	W188 A189 K194 I195 I196	W188-G192 PolarHBondContact O-N 3.1Å; W188-G192 VanDerWaalsContact O-N 3.1Å; A189-G192 PolarHBondContact O-N 3.21Å; G192-K194 VanDerWaalsContact C-N 3.35Å; G192-K194 PolarHBondContact O-N 3.45Å; G192-I195 WeakPolarHBondContact O-CB 3.45Å; G192-I195 PolarHBondContact O-N 3.15Å; G192-I195 VanDerWaalsContact O-N 3.1Å; G192-I196 WeakPolarHBondContact O-CG1 3.45Å; G192-I196 PolarHBondContact O-N 2.98Å; G192-I196 VanDerWaalsContact O-N 3.11Å
193	E	93.3	Very high	91.1	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.014	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-35.4	176.8	-79.3	-73.2	97.9	0	0	113	S146 A147 A189 F190 Q191 I195 I196 H197 P200 N205	S146-E193 WeakPolarHBondContact CB-OE1 3.28Å; S146-E193 PolarHBondContact OG-OE1 3.31Å; S146-E193 PolarHBondContact OG-OE2 3.41Å; A147-E193 HydrophobicContact CB-CG 4.1Å; A147-E193 PolarHBondContact N-OE1 3.47Å; A147-E193 VanDerWaalsContact N-OE1 3.13Å; A189-E193 PolarHBondContact O-N 3.34Å; F190-E193 PolarHBondContact O-N 3.04Å; Q191-E193 VanDerWaalsContact C-N 3.34Å; Q191-E193 PolarHBondContact O-N 3.11Å; E193-I195 VanDerWaalsContact C-N 3.27Å; E193-I195 PolarHBondContact O-N 2.86Å; E193-I196 PolarHBondContact O-N 2.88Å; E193-H197 WeakPolarHBondContact O-CB 3.24Å; E193-H197 PolarHBondContact O-N 2.88Å; E193-H197 IonicContact OE1-CD2 3.22Å; E193-H197 IonicContact OE1-NE2 3.57Å; E193-H197 IonicContact OE2-CD2 3.43Å; E193-H197 PolarHBondContact OE2-CD2 2.87Å; E193-H197 IonicContact OE2-NE2 2.86Å; E193-P200 HydrophobicContact CB-CB 4.22Å; E193-P200 HydrophobicContact CB-CG 3.96Å; E193-N205 HydrophobicContact CG-CB 4.3Å
194	K	91.4	Very high	91.1	Very high	43 Å²	43	35.3 Å²	35.3	19%	0.187	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-32	173.5	-72.9	172.6	179.7	166.8	0	112.1	Q82 L84 F190 Q191 G192 G198 P200	Q82-K194 PolarHBondContact O-NZ 2.86Å; L84-K194 HydrophobicContact CD1-CB 3.51Å; L84-K194 HydrophobicContact CD1-CD 4.18Å; L84-K194 HydrophobicContact CD1-CG 4.48Å; L84-K194 HydrophobicContact CD2-CB 4.47Å; L84-K194 HydrophobicContact CG-CB 4.13Å; L84-K194 HydrophobicContact CG-CD 4.13Å; F190-K194 HydrophobicContact CE1-CD 4.39Å; F190-K194 WeakPolarHBondContact O-CG 3.46Å; F190-K194 PolarHBondContact O-N 2.72Å; Q191-K194 PolarHBondContact O-N 3.41Å; G192-K194 VanDerWaalsContact C-N 3.35Å; G192-K194 PolarHBondContact O-N 3.45Å; K194-G198 WeakPolarHBondContact O-CA 3.48Å; K194-G198 PolarHBondContact O-N 2.9Å; K194-P200 HydrophobicContact CB-CG 4.42Å; K194-P200 HydrophobicContact CG-CG 3.8Å
195	I	90.3	Very high	91.1	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.041	19%	0.19	C	C	.	.	H	α-helix	trans	-69.3	-42.6	176	-70	165.3	0	0	0	110.8	L84 V89 L111 A112 Y115 Q191 G192 E193	L84-I195 HydrophobicContact CD1-CG1 4.36Å; L84-I195 HydrophobicContact CD2-CD1 4.03Å; L84-I195 HydrophobicContact CD2-CG1 3.77Å; V89-I195 HydrophobicContact CG2-CG1 4.4Å; L111-I195 HydrophobicContact CB-CG2 4.05Å; L111-I195 HydrophobicContact CD2-CG2 3.62Å; L111-I195 HydrophobicContact CG-CG2 3.56Å; A112-I195 HydrophobicContact CB-CG2 4.34Å; Y115-I195 HydrophobicContact CD1-CD1 3.32Å; Y115-I195 HydrophobicContact CD2-CD1 3.74Å; Y115-I195 HydrophobicContact CE1-CD1 3.99Å; Y115-I195 HydrophobicContact CE2-CD1 4.34Å; Y115-I195 HydrophobicContact CG-CD1 3.17Å; Q191-I195 WeakPolarHBondContact O-CG1 3.47Å; Q191-I195 PolarHBondContact O-N 3.3Å; Q191-I195 VanDerWaalsContact O-N 3.1Å; G192-I195 WeakPolarHBondContact O-CB 3.45Å; G192-I195 PolarHBondContact O-N 3.15Å; G192-I195 VanDerWaalsContact O-N 3.1Å; E193-I195 VanDerWaalsContact C-N 3.27Å; E193-I195 PolarHBondContact O-N 2.86Å
196	I	88.9	Confident	91.1	Very high	36 Å²	36	33.5 Å²	33.5	19%	0.185	19%	0.19	C	C	.	.	H	α-helix	trans	-74.9	-46.1	-177.1	-62.2	171.5	0	0	0	111.2	A112 Y149 G192 E193	A112-I196 HydrophobicContact CB-CD1 4.02Å; A112-I196 HydrophobicContact CB-CG1 4.03Å; Y149-I196 HydrophobicContact CD1-CD1 4.49Å; G192-I196 WeakPolarHBondContact O-CG1 3.45Å; G192-I196 PolarHBondContact O-N 2.98Å; G192-I196 VanDerWaalsContact O-N 3.11Å; E193-I196 PolarHBondContact O-N 2.88Å
197	H	85.2	Confident	91.1	Very high	111 Å²	111	32.3 Å²	32.3	51%	0.514	18%	0.184	S	C	.	.	H	α-helix	trans	-112.2	-6.2	-170.2	-64.8	-69.2	0	0	0	114.9	S146 E193 N199	S146-H197 PolarHBondContact OG-NE2 3.32Å; E193-H197 WeakPolarHBondContact O-CB 3.24Å; E193-H197 PolarHBondContact O-N 2.88Å; E193-H197 IonicContact OE1-CD2 3.22Å; E193-H197 IonicContact OE1-NE2 3.57Å; E193-H197 IonicContact OE2-CD2 3.43Å; E193-H197 PolarHBondContact OE2-CD2 2.87Å; E193-H197 IonicContact OE2-NE2 2.86Å; H197-N199 PolarHBondContact O-N 3.09Å
198	G	85.3	Confident	91	Very high	48 Å²	48	30.9 Å²	30.9	50%	0.495	17%	0.173	S	C	.	.	S	Bend	trans	79.7	-75.6	-178	0	0	0	0	0	113.1	K194 P200	K194-G198 WeakPolarHBondContact O-CA 3.48Å; K194-G198 PolarHBondContact O-N 2.9Å; G198-P200 VanDerWaalsContact O-CD 3.28Å; G198-P200 WeakPolarHBondContact O-CD 3.42Å
199	N	84.1	Confident	91	Very high	158 Å²	158	29.3 Å²	29.3	85%	0.845	17%	0.168	S	C	*	.	S	Bend	trans	-121.2	64.6	-175.4	-168	41.9	0	0	0	112.7	H197	H197-N199 PolarHBondContact O-N 3.09Å
200	P	87	Confident	90.9	Very high	23 Å²	23	31.7 Å²	31.7	15%	0.149	18%	0.177	C	C	.	.			trans	-68.4	153.5	176.6	30.9	-37	0	0	0	112	F190 E193 K194 G198 G202	F190-P200 HydrophobicContact CD2-CG 4.17Å; F190-P200 HydrophobicContact CE2-CB 4.33Å; F190-P200 HydrophobicContact CE2-CG 3.74Å; E193-P200 HydrophobicContact CB-CB 4.22Å; E193-P200 HydrophobicContact CB-CG 3.96Å; K194-P200 HydrophobicContact CB-CG 4.42Å; K194-P200 HydrophobicContact CG-CG 3.8Å; G198-P200 VanDerWaalsContact O-CD 3.28Å; G198-P200 WeakPolarHBondContact O-CD 3.42Å; P200-G202 VanDerWaalsContact C-N 3.31Å
201	S	85.7	Confident	90.8	Very high	71 Å²	71	29.3 Å²	29.3	50%	0.497	17%	0.167	S	C	.	.			trans	-76.4	-16.4	177.3	61.2	0	0	0	0	114.2	V203	S201-V203 VanDerWaalsContact C-N 3.33Å; S201-V203 PolarHBondContact OG-N 3.47Å
202	G	88.7	Confident	90.8	Very high	6 Å²	6	29.6 Å²	29.6	6%	0.062	17%	0.173	C	C	.	.	S	Bend	trans	89	-8.5	-174.3	0	0	0	0	0	114.5	P200 N205 A206 I221	P200-G202 VanDerWaalsContact C-N 3.31Å; G202-N205 VanDerWaalsContact C-OD1 3.32Å; G202-N205 VanDerWaalsContact CA-OD1 3.23Å; G202-N205 WeakPolarHBondContact CA-OD1 3.38Å; G202-N205 PolarHBondContact O-ND2 3.15Å; G202-N205 PolarHBondContact O-OD1 2.72Å; G202-A206 WeakPolarHBondContact O-CB 3.47Å; G202-A206 PolarHBondContact O-N 3.02Å; G202-A206 VanDerWaalsContact O-N 3.09Å; G202-I221 WeakPolarHBondContact O-CD1 3.42Å
203	V	91.2	Very high	90.9	Very high	7 Å²	7	29.8 Å²	29.8	4%	0.042	17%	0.174	C	C	.	.	H	α-helix	trans	-67.1	-43	-176.9	175.3	0	0	0	0	111.5	A30 S201 A206 V207 F216 I221	A30-V203 HydrophobicContact CB-CG1 3.55Å; S201-V203 VanDerWaalsContact C-N 3.33Å; S201-V203 PolarHBondContact OG-N 3.47Å; V203-A206 PolarHBondContact O-N 2.88Å; V203-V207 HydrophobicContact CG1-CG2 4.3Å; V203-V207 WeakPolarHBondContact O-CG2 3.3Å; V203-V207 PolarHBondContact O-N 3.05Å; V203-F216 HydrophobicContact CG2-CB 4.16Å; V203-F216 HydrophobicContact CG2-CD1 3.96Å; V203-F216 HydrophobicContact CG2-CD2 3.55Å; V203-F216 HydrophobicContact CG2-CE1 4.29Å; V203-F216 HydrophobicContact CG2-CE2 3.85Å; V203-F216 HydrophobicContact CG2-CG 3.64Å; V203-F216 HydrophobicContact CG2-CZ 4.24Å; V203-I221 HydrophobicContact CG2-CD1 4.11Å; V203-I221 HydrophobicContact CG2-CG1 4.14Å
204	D	92.9	Very high	90.9	Very high	35 Å²	35	29.8 Å²	29.8	19%	0.187	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-47.1	-172.6	-68.7	12.9	0	0	0	111.2	K13 A147 V207 G208	K13-D204 WeakPolarHBondContact CE-OD1 3.32Å; K13-D204 IonicContact NZ-OD1 3.5Å; K13-D204 PolarHBondContact NZ-OD1 3.26Å; K13-D204 IonicContact NZ-OD2 3.69Å; A147-D204 VanDerWaalsContact CB-C 3.44Å; A147-D204 HydrophobicContact CB-CB 3.56Å; D204-V207 PolarHBondContact O-N 3.4Å; D204-G208 PolarHBondContact O-N 3.45Å
205	N	94	Very high	91.2	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.011	17%	0.173	C	C	.	.	H	α-helix	trans	-68	-38.5	174.9	53.9	-77.7	0	0	0	112	A147 V151 N186 A189 E193 G202 V207 G208 T209	A147-N205 HydrophobicContact CB-CB 4.31Å; V151-N205 HydrophobicContact CG2-CB 4.35Å; N186-N205 PolarHBondContact OD1-ND2 2.68Å; A189-N205 HydrophobicContact CB-CB 4.03Å; E193-N205 HydrophobicContact CG-CB 4.3Å; G202-N205 VanDerWaalsContact C-OD1 3.32Å; G202-N205 VanDerWaalsContact CA-OD1 3.23Å; G202-N205 WeakPolarHBondContact CA-OD1 3.38Å; G202-N205 PolarHBondContact O-ND2 3.15Å; G202-N205 PolarHBondContact O-OD1 2.72Å; N205-V207 VanDerWaalsContact C-N 3.33Å; N205-V207 PolarHBondContact O-N 3.4Å; N205-G208 PolarHBondContact O-N 3.47Å; N205-G208 VanDerWaalsContact O-N 3.16Å; N205-T209 PolarHBondContact O-N 3.17Å; N205-T209 PolarHBondContact O-OG1 3.19Å; N205-T209 VanDerWaalsContact O-OG1 3.06Å
206	A	94.4	Very high	91.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.2	-42.6	176.1	0	0	0	0	0	112.3	N186 G202 V203 T209 W210 L214 I221	N186-A206 WeakPolarHBondContact OD1-CA 3.2Å; N186-A206 PolarHBondContact OD1-N 2.98Å; G202-A206 WeakPolarHBondContact O-CB 3.47Å; G202-A206 PolarHBondContact O-N 3.02Å; G202-A206 VanDerWaalsContact O-N 3.09Å; V203-A206 PolarHBondContact O-N 2.88Å; A206-T209 PolarHBondContact O-N 2.88Å; A206-W210 HydrophobicContact CB-CE3 3.72Å; A206-W210 HydrophobicContact CB-CH2 4.37Å; A206-W210 HydrophobicContact CB-CZ3 3.51Å; A206-W210 PolarHBondContact O-N 3.43Å; A206-L214 VanDerWaalsContact C-CD1 3.49Å; A206-L214 HydrophobicContact CB-CD1 3.56Å; A206-I221 HydrophobicContact CB-CD1 4Å; A206-I221 HydrophobicContact CB-CG2 4.16Å
207	V	94.8	Very high	91.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.1	-43.6	174.8	173.4	0	0	0	0	110.6	K13 A30 V203 D204 N205 T209 G211 L214	K13-V207 HydrophobicContact CB-CB 4.01Å; K13-V207 HydrophobicContact CB-CG1 3.7Å; K13-V207 HydrophobicContact CB-CG2 4.45Å; K13-V207 HydrophobicContact CG-CB 4.06Å; K13-V207 HydrophobicContact CG-CG1 4.01Å; K13-V207 HydrophobicContact CG-CG2 3.95Å; A30-V207 HydrophobicContact CB-CG2 3.77Å; V203-V207 HydrophobicContact CG1-CG2 4.3Å; V203-V207 WeakPolarHBondContact O-CG2 3.3Å; V203-V207 PolarHBondContact O-N 3.05Å; D204-V207 PolarHBondContact O-N 3.4Å; N205-V207 VanDerWaalsContact C-N 3.33Å; N205-V207 PolarHBondContact O-N 3.4Å; V207-T209 VanDerWaalsContact C-N 3.29Å; V207-T209 PolarHBondContact O-N 3.34Å; V207-G211 WeakPolarHBondContact O-CA 3.5Å; V207-G211 PolarHBondContact O-N 2.87Å; V207-L214 HydrophobicContact CB-CD1 4.24Å; V207-L214 HydrophobicContact CG2-CB 4.37Å; V207-L214 HydrophobicContact CG2-CD1 3.52Å; V207-L214 HydrophobicContact CG2-CG 3.9Å
208	G	93.3	Very high	91.5	Very high	1 Å²	1	30 Å²	30	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-38.3	176.4	0	0	0	0	0	112.8	P11 D204 N205 G377 D378	P11-G208 WeakPolarHBondContact CD-O 3.35Å; D204-G208 PolarHBondContact O-N 3.45Å; N205-G208 PolarHBondContact O-N 3.47Å; N205-G208 VanDerWaalsContact O-N 3.16Å; G208-G377 CarbonylContact O-C 3.56Å; G208-D378 PolarHBondContact O-N 3.18Å
209	T	94.3	Very high	91.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-78	-59.3	-179.4	-56.3	0	0	0	0	112.5	V151 L182 I185 N186 N205 A206 V207 D378	V151-T209 WeakPolarHBondContact CG2-OG1 3.38Å; L182-T209 HydrophobicContact CB-CG2 3.98Å; L182-T209 HydrophobicContact CD2-CG2 3.77Å; L182-T209 HydrophobicContact CG-CG2 4.47Å; L182-T209 VanDerWaalsContact O-CG2 3.26Å; L182-T209 WeakPolarHBondContact O-CG2 3.34Å; I185-T209 HydrophobicContact CB-CG2 4.23Å; I185-T209 HydrophobicContact CG2-CG2 4.05Å; N186-T209 HydrophobicContact CB-CG2 3.98Å; N205-T209 PolarHBondContact O-N 3.17Å; N205-T209 PolarHBondContact O-OG1 3.19Å; N205-T209 VanDerWaalsContact O-OG1 3.06Å; A206-T209 PolarHBondContact O-N 2.88Å; V207-T209 VanDerWaalsContact C-N 3.29Å; V207-T209 PolarHBondContact O-N 3.34Å; T209-D378 PolarHBondContact O-N 3.4Å
210	W	93.4	Very high	91.6	Very high	50 Å²	50	30.1 Å²	30.1	19%	0.189	18%	0.183	C	C	.	.	H	α-helix	trans	-82.1	-32.3	-172.7	-60.7	-46.8	0	0	0	112.9	E183 A206 L214 I221 P223	E183-W210 HydrophobicContact CG-CZ2 4.47Å; A206-W210 HydrophobicContact CB-CE3 3.72Å; A206-W210 HydrophobicContact CB-CH2 4.37Å; A206-W210 HydrophobicContact CB-CZ3 3.51Å; A206-W210 PolarHBondContact O-N 3.43Å; W210-L214 HydrophobicContact CE3-CD1 4.03Å; W210-L214 HydrophobicContact CE3-CD2 4.07Å; W210-L214 HydrophobicContact CZ3-CD1 4.49Å; W210-I221 HydrophobicContact CZ3-CG2 4Å; W210-P223 HydrophobicContact CD2-CG 4.49Å; W210-P223 HydrophobicContact CE3-CG 4.04Å; W210-P223 HydrophobicContact CZ3-CG 4.3Å
211	G	92.9	Very high	91.9	Very high	4 Å²	4	31.2 Å²	31.2	4%	0.041	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	73.7	-154.3	-172.3	0	0	0	0	0	113.3	V207 M213 G377	V207-G211 WeakPolarHBondContact O-CA 3.5Å; V207-G211 PolarHBondContact O-N 2.87Å; G211-M213 PolarHBondContact O-N 3.22Å; G211-G377 VanDerWaalsContact CA-CA 3.4Å
212	G	93	Very high	92.2	Very high	16 Å²	16	31.8 Å²	31.8	17%	0.165	18%	0.184	C	C	.	.	S	Bend	trans	59.5	-129	179.4	0	0	0	0	0	110.8	S32 G375	S32-G212 PolarHBondContact N-O 3.15Å; S32-G212 PolarHBondContact OG-N 2.68Å; S32-G212 VanDerWaalsContact OG-N 3.16Å; S32-G212 PolarHBondContact OG-O 2.85Å; G212-G375 PolarHBondContact N-O 3.37Å
213	M	93.9	Very high	92.3	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	138.6	178.7	-173.6	166.7	-48.2	0	0	110.6	L16 L29 A30 V31 G211 L224 V227 L279	L16-M213 HydrophobicContact CD2-CE 4.01Å; L29-M213 HydrophobicContact CB-SD 4.18Å; L29-M213 HydrophobicContact CD1-SD 4.04Å; L29-M213 HydrophobicContact CD2-SD 4.31Å; L29-M213 HydrophobicContact CG-SD 4.42Å; A30-M213 CarbonylContact O-C 3.51Å; A30-M213 WeakPolarHBondContact O-CA 3.24Å; V31-M213 HydrophobicContact CG1-CB 4.31Å; V31-M213 HydrophobicContact CG1-CE 3.37Å; V31-M213 HydrophobicContact CG1-CG 3.82Å; V31-M213 HydrophobicContact CG1-SD 4.01Å; G211-M213 PolarHBondContact O-N 3.22Å; M213-L224 HydrophobicContact CB-CB 4.44Å; M213-L224 HydrophobicContact CB-CD2 4.19Å; M213-L224 HydrophobicContact CG-CD1 4.38Å; M213-L224 HydrophobicContact CG-CD2 4.03Å; M213-L224 PolarHBondContact O-N 3.06Å; M213-L224 HydrophobicContact SD-CD2 3.9Å; M213-V227 HydrophobicContact CB-CB 4.33Å; M213-V227 HydrophobicContact CB-CG1 3.54Å; M213-V227 HydrophobicContact CB-CG2 4.15Å; M213-V227 HydrophobicContact CE-CG1 4.19Å; M213-V227 HydrophobicContact CG-CG1 4.47Å; M213-V227 HydrophobicContact SD-CG1 4.4Å; M213-L279 HydrophobicContact CE-CD1 3.25Å; M213-L279 HydrophobicContact CE-CD2 4.47Å; M213-L279 HydrophobicContact CE-CG 4.4Å; M213-L279 HydrophobicContact SD-CD1 3.47Å; M213-L279 WeakPolarHBondContact SD-CD1 3.31Å
214	L	94.9	Very high	92.2	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.6	178.9	-52.8	-173.9	0	0	0	109.9	A30 A206 V207 W210 I221 P223	A30-L214 PolarHBondContact N-O 2.89Å; A30-L214 PolarHBondContact O-N 2.86Å; A206-L214 VanDerWaalsContact C-CD1 3.49Å; A206-L214 HydrophobicContact CB-CD1 3.56Å; V207-L214 HydrophobicContact CB-CD1 4.24Å; V207-L214 HydrophobicContact CG2-CB 4.37Å; V207-L214 HydrophobicContact CG2-CD1 3.52Å; V207-L214 HydrophobicContact CG2-CG 3.9Å; W210-L214 HydrophobicContact CE3-CD1 4.03Å; W210-L214 HydrophobicContact CE3-CD2 4.07Å; W210-L214 HydrophobicContact CZ3-CD1 4.49Å; L214-I221 HydrophobicContact CB-CG2 4.07Å; L214-I221 HydrophobicContact CD1-CG2 3.71Å; L214-I221 HydrophobicContact CG-CG2 4.35Å; L214-P223 HydrophobicContact CD2-CB 3.68Å; L214-P223 HydrophobicContact CD2-CG 3.91Å
215	R	96	Very high	91.5	Very high	44 Å²	44	39.9 Å²	39.9	17%	0.166	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	126.6	167.1	174.6	-172.3	169.1	85.2	3.5	108.9	V27 L29 I222 L224 E276	V27-R215 HydrophobicContact CG1-CG 4.15Å; V27-R215 VanDerWaalsContact CG1-NH1 3.34Å; L29-R215 HydrophobicContact CD2-CB 4.23Å; R215-I222 HydrophobicContact CB-CB 4.3Å; R215-I222 PolarHBondContact N-O 3.37Å; R215-I222 PolarHBondContact O-N 3.34Å; R215-L224 HydrophobicContact CB-CD1 3.83Å; R215-E276 WeakPolarHBondContact CD-OE2 3.28Å; R215-E276 IonicContact CZ-OE2 2.58Å; R215-E276 IonicContact NH1-OE2 3.8Å; R215-E276 PolarHBondContact NH1-OE2 3.22Å
216	F	94.8	Very high	91	Very high	27 Å²	27	48.3 Å²	48.3	12%	0.118	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.4	174.5	-174.4	-122.1	0	0	0	110.3	V22 A28 V203 G219 K220 I221	V22-F216 HydrophobicContact CB-CD1 4.3Å; V22-F216 HydrophobicContact CG1-CD1 4.31Å; V22-F216 HydrophobicContact CG2-CD1 3.18Å; V22-F216 HydrophobicContact CG2-CE1 3.52Å; V22-F216 HydrophobicContact CG2-CG 4.19Å; A28-F216 PolarHBondContact N-O 3.38Å; A28-F216 PolarHBondContact O-N 3.19Å; V203-F216 HydrophobicContact CG2-CB 4.16Å; V203-F216 HydrophobicContact CG2-CD1 3.96Å; V203-F216 HydrophobicContact CG2-CD2 3.55Å; V203-F216 HydrophobicContact CG2-CE1 4.29Å; V203-F216 HydrophobicContact CG2-CE2 3.85Å; V203-F216 HydrophobicContact CG2-CG 3.64Å; V203-F216 HydrophobicContact CG2-CZ 4.24Å; F216-G219 VanDerWaalsContact CE2-CA 3.46Å; F216-K220 WeakPolarHBondContact CA-O 3.31Å; F216-K220 VanDerWaalsContact CD2-O 3.31Å; F216-K220 WeakPolarHBondContact CD2-O 3.44Å; F216-I221 HydrophobicContact CD2-CG1 3.69Å; F216-I221 HydrophobicContact CE2-CG1 4.06Å
217	L	92.6	Very high	90.5	Very high	52 Å²	52	49.6 Å²	49.6	27%	0.272	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	122.7	177.7	177.6	64.8	0	0	0	110.3	G25 V27 G219 K220	G25-L217 WeakPolarHBondContact O-CD1 3.24Å; V27-L217 HydrophobicContact CG2-CD1 4.07Å; V27-L217 HydrophobicContact CG2-CD2 4.46Å; L217-G219 VanDerWaalsContact C-N 3.25Å; L217-G219 PolarHBondContact O-N 2.98Å; L217-G219 VanDerWaalsContact O-N 3.16Å; L217-K220 PolarHBondContact N-O 3.33Å; L217-K220 WeakPolarHBondContact O-CB 3.12Å; L217-K220 PolarHBondContact O-N 3.17Å
218	A	84.1	Confident	90.4	Very high	79 Å²	79	50.2 Å²	50.2	65%	0.653	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	43.2	174	0	0	0	0	0	113.9	K220	A218-K220 VanDerWaalsContact C-N 3.3Å; A218-K220 PolarHBondContact O-N 3.45Å
219	G	83.3	Confident	90.4	Very high	56 Å²	56	55.3 Å²	55.3	58%	0.577	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	-5.1	-180	0	0	0	0	0	115.2	F216 L217	F216-G219 VanDerWaalsContact CE2-CA 3.46Å; L217-G219 VanDerWaalsContact C-N 3.25Å; L217-G219 PolarHBondContact O-N 2.98Å; L217-G219 VanDerWaalsContact O-N 3.16Å
220	K	88.8	Confident	90.5	Very high	153 Å²	153	55.5 Å²	55.5	67%	0.665	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.3	176.4	-61.3	-178.2	179.4	-178.7	0	110.5	F216 L217 A218	F216-K220 WeakPolarHBondContact CA-O 3.31Å; F216-K220 VanDerWaalsContact CD2-O 3.31Å; F216-K220 WeakPolarHBondContact CD2-O 3.44Å; L217-K220 PolarHBondContact N-O 3.33Å; L217-K220 WeakPolarHBondContact O-CB 3.12Å; L217-K220 PolarHBondContact O-N 3.17Å; A218-K220 VanDerWaalsContact C-N 3.3Å; A218-K220 PolarHBondContact O-N 3.45Å
221	I	92.8	Very high	90.6	Very high	47 Å²	47	57.3 Å²	57.3	24%	0.241	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.9	175	-58.5	169.4	0	0	0	107.4	G202 V203 A206 W210 L214 F216	G202-I221 WeakPolarHBondContact O-CD1 3.42Å; V203-I221 HydrophobicContact CG2-CD1 4.11Å; V203-I221 HydrophobicContact CG2-CG1 4.14Å; A206-I221 HydrophobicContact CB-CD1 4Å; A206-I221 HydrophobicContact CB-CG2 4.16Å; W210-I221 HydrophobicContact CZ3-CG2 4Å; L214-I221 HydrophobicContact CB-CG2 4.07Å; L214-I221 HydrophobicContact CD1-CG2 3.71Å; L214-I221 HydrophobicContact CG-CG2 4.35Å; F216-I221 HydrophobicContact CD2-CG1 3.69Å; F216-I221 HydrophobicContact CE2-CG1 4.06Å
222	I	92.8	Very high	90.9	Very high	83 Å²	83	57.2 Å²	57.2	43%	0.426	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	109.7	-177.1	-55.8	171.2	0	0	0	107.6	R215	R215-I222 HydrophobicContact CB-CB 4.3Å; R215-I222 PolarHBondContact N-O 3.37Å; R215-I222 PolarHBondContact O-N 3.34Å
223	P	90.8	Very high	91.2	Very high	65 Å²	65	56.4 Å²	56.4	42%	0.422	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	137.8	174	-18.6	31.1	0	0	0	111.9	W210 L214	W210-P223 HydrophobicContact CD2-CG 4.49Å; W210-P223 HydrophobicContact CE3-CG 4.04Å; W210-P223 HydrophobicContact CZ3-CG 4.3Å; L214-P223 HydrophobicContact CD2-CB 3.68Å; L214-P223 HydrophobicContact CD2-CG 3.91Å
224	L	88.6	Confident	91.4	Very high	27 Å²	27	56.2 Å²	56.2	14%	0.141	31%	0.306	C	S	.	.			trans	-81.2	132.9	168.1	-78.8	64.5	0	0	0	108.3	M213 R215 R226 V227 E276	M213-L224 HydrophobicContact CB-CB 4.44Å; M213-L224 HydrophobicContact CB-CD2 4.19Å; M213-L224 HydrophobicContact CG-CD1 4.38Å; M213-L224 HydrophobicContact CG-CD2 4.03Å; M213-L224 PolarHBondContact O-N 3.06Å; M213-L224 HydrophobicContact SD-CD2 3.9Å; R215-L224 HydrophobicContact CB-CD1 3.83Å; L224-R226 VanDerWaalsContact C-N 3.34Å; L224-R226 PolarHBondContact O-N 3.38Å; L224-V227 HydrophobicContact CB-CG1 3.9Å; L224-V227 HydrophobicContact CD2-CG1 3.87Å; L224-E276 HydrophobicContact CD2-CG 4.12Å
225	S	79.1	Confident	91.5	Very high	126 Å²	126	56.1 Å²	56.1	88%	0.881	31%	0.305	S	S	*	.	S	Bend	trans	-65.5	-34.8	-172.1	54	0	0	0	0	113.5
226	R	82.3	Confident	91.6	Very high	179 Å²	179	55 Å²	55	68%	0.675	30%	0.303	S	S	*	.			trans	-145.2	138.2	175.9	-65.4	-176	175.2	178.7	-2.1	109.2	L224 T283	L224-R226 VanDerWaalsContact C-N 3.34Å; L224-R226 PolarHBondContact O-N 3.38Å; R226-T283 HydrophobicContact CB-CG2 3.93Å
227	V	84.9	Confident	91.7	Very high	27 Å²	27	54 Å²	54	16%	0.164	30%	0.298	C	S	.	.			trans	-138.5	147.8	171.2	-71.6	0	0	0	0	110.7	M213 L224	M213-V227 HydrophobicContact CB-CB 4.33Å; M213-V227 HydrophobicContact CB-CG1 3.54Å; M213-V227 HydrophobicContact CB-CG2 4.15Å; M213-V227 HydrophobicContact CE-CG1 4.19Å; M213-V227 HydrophobicContact CG-CG1 4.47Å; M213-V227 HydrophobicContact SD-CG1 4.4Å; L224-V227 HydrophobicContact CB-CG1 3.9Å; L224-V227 HydrophobicContact CD2-CG1 3.87Å
228	P	91.3	Very high	91.8	Very high	13 Å²	13	56.8 Å²	56.8	8%	0.084	31%	0.308	C	S	.	.			trans	-69.4	151.3	173.6	31.4	-35.5	0	0	0	110.2	L230 L279 M282 I287	P228-L230 HydrophobicContact CB-CD2 4.18Å; P228-L230 HydrophobicContact CG-CD2 3.99Å; P228-L230 HydrophobicContact CG-CG 4.38Å; P228-L279 WeakPolarHBondContact CD-O 3.26Å; P228-L279 HydrophobicContact CG-CD2 3.73Å; P228-M282 HydrophobicContact CB-CB 4.37Å; P228-M282 HydrophobicContact CB-CE 4.33Å; P228-M282 HydrophobicContact CG-CB 4.02Å; P228-M282 HydrophobicContact CG-CE 4.14Å; P228-M282 HydrophobicContact CG-SD 4.09Å; P228-I287 HydrophobicContact CB-CD1 4.4Å
229	L	93.4	Very high	92.3	Very high	107 Å²	107	54.8 Å²	54.8	56%	0.56	29%	0.288	S	S	*	.			trans	-81.6	117.6	167.6	-170.1	73.6	0	0	0	108.5
230	L	95.9	Very high	92.6	Very high	5 Å²	5	57.8 Å²	57.8	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.2	-179.9	-54.3	177.5	0	0	0	110.2	P228 L279 M282 Y292 L295 L344 S372 I373	P228-L230 HydrophobicContact CB-CD2 4.18Å; P228-L230 HydrophobicContact CG-CD2 3.99Å; P228-L230 HydrophobicContact CG-CG 4.38Å; L230-L279 HydrophobicContact CD1-CD2 3.86Å; L230-M282 HydrophobicContact CD2-CE 3.9Å; L230-Y292 HydrophobicContact CD2-CE1 4.46Å; L230-L295 HydrophobicContact CD1-CD1 4.23Å; L230-L344 HydrophobicContact CB-CD1 4.19Å; L230-L344 HydrophobicContact CD1-CD1 4.37Å; L230-S372 CarbonylContact O-C 3.59Å; L230-S372 WeakPolarHBondContact O-CA 3.43Å; L230-S372 VanDerWaalsContact O-CB 3.31Å; L230-S372 WeakPolarHBondContact O-CB 3.18Å; L230-I373 HydrophobicContact CB-CD1 4.3Å; L230-I373 HydrophobicContact CB-CG1 3.8Å; L230-I373 HydrophobicContact CD1-CD1 4.22Å; L230-I373 HydrophobicContact CD1-CG1 4.45Å; L230-I373 PolarHBondContact N-O 3.13Å; L230-I373 PolarHBondContact O-N 2.76Å
231	R	97.3	Very high	92.5	Very high	87 Å²	87	53.2 Å²	53.2	33%	0.328	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.2	172.4	-72.6	174.1	63.5	-149.2	0.3	109.5	L345 E370	R231-L345 HydrophobicContact CB-CB 3.9Å; R231-L345 HydrophobicContact CB-CD1 4.43Å; R231-L345 WeakPolarHBondContact O-CB 3.32Å; R231-L345 PolarHBondContact O-N 3.18Å; R231-E370 IonicContact CZ-OE1 3.63Å; R231-E370 IonicContact NE-OE1 2.76Å; R231-E370 IonicContact NH2-OE1 2.76Å; R231-E370 PolarHBondContact NH2-OE1 3.07Å
232	I	98.3	Very high	92.3	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	160.1	178.5	64.6	155.5	0	0	0	111.9	L33 I342 T343 L344 T371 I373	L33-I232 HydrophobicContact CD1-CD1 3.96Å; I232-I342 HydrophobicContact CD1-CB 4.43Å; I232-I342 HydrophobicContact CD1-CG2 4.04Å; I232-T343 CarbonylContact C-O 3.57Å; I232-T343 WeakPolarHBondContact CA-O 3.2Å; I232-T343 VanDerWaalsContact CB-O 3.26Å; I232-T343 WeakPolarHBondContact CB-O 3.42Å; I232-L344 HydrophobicContact CG2-CD1 4.39Å; I232-T371 HydrophobicContact CD1-CG2 4.05Å; I232-T371 HydrophobicContact CG1-CG2 3.82Å; I232-T371 PolarHBondContact N-O 3.49Å; I232-T371 PolarHBondContact O-N 3.17Å; I232-T371 VanDerWaalsContact O-O 3.06Å; I232-I373 HydrophobicContact CD1-CG2 3.54Å; I232-I373 HydrophobicContact CG1-CG2 4.11Å; I232-I373 HydrophobicContact CG2-CD1 4Å; I232-I373 HydrophobicContact CG2-CG1 4.01Å
233	L	98.4	Very high	92	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.7	151.8	-58.7	175.9	0	0	0	109.3	I342 T343 L345 V354 T357 M358 W369 E370	L233-I342 CarbonylContact O-C 3.53Å; L233-I342 WeakPolarHBondContact O-CA 3.45Å; L233-T343 PolarHBondContact N-O 3.42Å; L233-T343 PolarHBondContact O-N 3.18Å; L233-L345 HydrophobicContact CD1-CD2 4.44Å; L233-L345 HydrophobicContact CD2-CD1 4.14Å; L233-L345 HydrophobicContact CG-CD1 4.1Å; L233-L345 HydrophobicContact CG-CD2 4.13Å; L233-L345 HydrophobicContact CG-CG 4.34Å; L233-V354 HydrophobicContact CD2-CG1 3.94Å; L233-T357 HydrophobicContact CD1-CG2 3.85Å; L233-M358 HydrophobicContact CD1-CG 4.12Å; L233-M358 HydrophobicContact CD2-CE 4.41Å; L233-M358 HydrophobicContact CD2-CG 3.74Å; L233-M358 HydrophobicContact CD2-SD 3.99Å; L233-W369 CarbonylContact C-O 3.59Å; L233-W369 WeakPolarHBondContact CA-O 3.34Å; L233-E370 HydrophobicContact CD2-CB 3.85Å; L233-E370 HydrophobicContact CD2-CG 4.26Å
234	L	98.2	Very high	91.9	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.6	166	177.3	77	0	0	0	108.1	L33 L35 L143 C340 I342 C368 W369 T371	L33-L234 HydrophobicContact CD1-CD2 4.5Å; L33-L234 HydrophobicContact CD2-CD1 4.45Å; L33-L234 HydrophobicContact CD2-CD2 3.89Å; L35-L234 HydrophobicContact CD1-CD2 3.44Å; L35-L234 VanDerWaalsContact CD1-CD2 3.44Å; L143-L234 HydrophobicContact CD1-CD1 4.23Å; L143-L234 HydrophobicContact CD1-CD2 3.67Å; L143-L234 HydrophobicContact CD1-CG 4.46Å; L143-L234 HydrophobicContact CD2-CD1 4.07Å; L234-C340 HydrophobicContact CD1-CB 4.14Å; L234-I342 HydrophobicContact CD1-CG2 4.38Å; L234-C368 WeakPolarHBondContact O-CA 3.48Å; L234-W369 HydrophobicContact CD2-CE3 4.01Å; L234-W369 HydrophobicContact CD2-CZ3 4.49Å; L234-W369 HydrophobicContact CG-CE3 4.32Å; L234-W369 PolarHBondContact N-O 2.93Å; L234-W369 PolarHBondContact O-N 3.23Å; L234-T371 HydrophobicContact CB-CG2 4.19Å
235	T	98.2	Very high	92.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	121.4	-179.9	-57.4	0	0	0	0	110.1	L319 C340 G341 L361 Y366 D367 C368	T235-L319 HydrophobicContact CG2-CD1 3.75Å; T235-L319 HydrophobicContact CG2-CG 4.18Å; T235-C340 CarbonylContact O-C 3.6Å; T235-C340 WeakPolarHBondContact O-CA 3.31Å; T235-C340 WeakPolarHBondContact O-CB 3.44Å; T235-G341 PolarHBondContact N-O 2.87Å; T235-G341 PolarHBondContact O-N 2.8Å; T235-L361 HydrophobicContact CG2-CD1 4.29Å; T235-L361 HydrophobicContact CG2-CD2 4.32Å; T235-L361 WeakPolarHBondContact OG1-CD1 3.38Å; T235-Y366 HydrophobicContact CG2-CD2 3.94Å; T235-Y366 HydrophobicContact CG2-CG 4.21Å; T235-D367 CarbonylContact C-O 3.6Å; T235-D367 VanDerWaalsContact CA-O 3.3Å; T235-D367 WeakPolarHBondContact CA-O 3.5Å; T235-C368 PolarHBondContact OG1-SG 3.46Å
236	N	97.5	Very high	92.8	Very high	20 Å²	20	55.3 Å²	55.3	11%	0.107	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.7	171.9	-179.5	9.3	0	0	0	109.4	K238 Y366 D367 W369	N236-K238 PolarHBondContact O-N 3.37Å; N236-K238 PolarHBondContact OD1-N 2.71Å; N236-Y366 WeakPolarHBondContact O-CA 3.46Å; N236-Y366 WeakPolarHBondContact O-CB 3.25Å; N236-D367 HydrophobicContact CB-CB 4.34Å; N236-D367 PolarHBondContact N-O 2.97Å; N236-D367 PolarHBondContact O-N 3.25Å; N236-W369 HydrophobicContact CB-CH2 4.14Å; N236-W369 HydrophobicContact CB-CZ3 3.74Å
237	T	97	Very high	93.3	Very high	5 Å²	5	49 Å²	49	3%	0.031	26%	0.258	C	S	.	.			trans	-69.6	-9.9	179.8	64.4	0	0	0	0	113.5	V239 L316 L319 G339 Y366	T237-V239 PolarHBondContact O-N 3.31Å; T237-V239 PolarHBondContact OG1-N 3.14Å; T237-L316 HydrophobicContact CG2-CD2 4.04Å; T237-L319 HydrophobicContact CG2-CD1 4.37Å; T237-G339 WeakPolarHBondContact CB-O 3.41Å; T237-G339 WeakPolarHBondContact CG2-O 3.4Å; T237-G339 PolarHBondContact N-O 2.93Å; T237-G339 PolarHBondContact OG1-N 3.46Å; T237-G339 PolarHBondContact OG1-O 2.97Å; T237-Y366 HydrophobicContact CG2-CE1 4.45Å
238	K	94.9	Very high	93.7	Very high	111 Å²	111	49.9 Å²	49.9	48%	0.483	27%	0.268	S	S	.	.			trans	58.8	7.3	-173.1	-58.8	177.2	-179.2	160.7	0	114.7	N236 P240 G365 D367	N236-K238 PolarHBondContact O-N 3.37Å; N236-K238 PolarHBondContact OD1-N 2.71Å; K238-P240 WeakPolarHBondContact O-CD 3.44Å; K238-G365 PolarHBondContact NZ-O 3.49Å; K238-D367 WeakPolarHBondContact CE-OD1 3.46Å; K238-D367 WeakPolarHBondContact CE-OD2 3.35Å; K238-D367 VanDerWaalsContact NZ-CG 3.34Å; K238-D367 IonicContact NZ-OD1 2.69Å; K238-D367 PolarHBondContact NZ-OD1 3.25Å; K238-D367 IonicContact NZ-OD2 3.53Å
239	V	94.3	Very high	93.9	Very high	38 Å²	38	56.7 Å²	56.7	23%	0.23	29%	0.292	C	S	.	.			trans	-76.8	120.1	176.3	175.9	0	0	0	0	108.8	T237 G339	T237-V239 PolarHBondContact O-N 3.31Å; T237-V239 PolarHBondContact OG1-N 3.14Å; V239-G339 PolarHBondContact O-N 3.03Å
240	P	89.6	Confident	94	Very high	119 Å²	119	51.7 Å²	51.7	77%	0.773	27%	0.266	S	S	*	.			trans	-68	147.6	178.4	29.7	-35	0	0	0	110.5	K238	K238-P240 WeakPolarHBondContact O-CD 3.44Å
241	R	87.9	Confident	94	Very high	57 Å²	57	57.3 Å²	57.3	22%	0.215	29%	0.29	C	S	.	.			trans	-143.8	156.7	-176.5	61.1	178	-179.5	-178.3	-0.7	111.8	A141 L246 G336	A141-R241 PolarHBondContact O-NH2 3.07Å; R241-L246 HydrophobicContact CB-CD1 4.38Å; R241-G336 WeakPolarHBondContact CD-O 3.46Å; R241-G336 PolarHBondContact NH1-O 3.33Å; R241-G336 VanDerWaalsContact NH1-O 3.14Å
242	S	87.8	Confident	93.9	Very high	59 Å²	59	58 Å²	58	41%	0.413	30%	0.301	S	S	.	.			trans	-114.7	105	169.3	179.7	0	0	0	0	110.1	K244 V245 L246	S242-K244 PolarHBondContact O-N 3.16Å; S242-V245 PolarHBondContact O-N 2.69Å; S242-V245 VanDerWaalsContact O-N 3.13Å; S242-V245 WeakPolarHBondContact OG-CG2 3.39Å; S242-V245 PolarHBondContact OG-N 3.08Å; S242-L246 PolarHBondContact O-N 3.38Å
243	T	86.7	Confident	93.9	Very high	80 Å²	80	61.1 Å²	61.1	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-54.3	-42.5	176.5	-56	0	0	0	0	111.3	V245 L246 V247 A335	T243-V245 VanDerWaalsContact C-N 3.35Å; T243-V245 PolarHBondContact O-N 3.45Å; T243-L246 PolarHBondContact O-N 2.92Å; T243-V247 HydrophobicContact CG2-CG2 4.3Å; T243-V247 WeakPolarHBondContact O-CG2 2.98Å; T243-V247 PolarHBondContact O-N 3.05Å; T243-A335 HydrophobicContact CG2-CB 3.85Å
244	K	88.5	Confident	93.8	Very high	176 Å²	176	62 Å²	62	77%	0.765	32%	0.318	S	S	*	.	H	α-helix	trans	-59.7	-43.2	178.6	-174.8	177.9	179.2	179.3	0	112.2	S242 A248	S242-K244 PolarHBondContact O-N 3.16Å; K244-A248 WeakPolarHBondContact O-CB 3.41Å; K244-A248 PolarHBondContact O-N 3.29Å
245	V	92.6	Very high	93.7	Very high	64 Å²	64	67.2 Å²	67.2	39%	0.388	35%	0.346	S	S	.	.	H	α-helix	trans	-68	-42.1	178.8	173	0	0	0	0	110.9	S242 T243 A248 R249	S242-V245 PolarHBondContact O-N 2.69Å; S242-V245 VanDerWaalsContact O-N 3.13Å; S242-V245 WeakPolarHBondContact OG-CG2 3.39Å; S242-V245 PolarHBondContact OG-N 3.08Å; T243-V245 VanDerWaalsContact C-N 3.35Å; T243-V245 PolarHBondContact O-N 3.45Å; V245-A248 PolarHBondContact O-N 3.07Å; V245-R249 HydrophobicContact CG1-CG 4.43Å; V245-R249 VanDerWaalsContact O-CG 3.31Å; V245-R249 WeakPolarHBondContact O-CG 3.05Å; V245-R249 PolarHBondContact O-N 3.43Å
246	L	93.6	Very high	93.7	Very high	12 Å²	12	75.3 Å²	75.3	6%	0.063	38%	0.381	C	S	.	.	H	α-helix	trans	-63.8	-47.7	179.1	-69.4	165.7	0	0	0	111.3	R241 S242 T243 A248 R249 V250 V311 A335 G336	R241-L246 HydrophobicContact CB-CD1 4.38Å; S242-L246 PolarHBondContact O-N 3.38Å; T243-L246 PolarHBondContact O-N 2.92Å; L246-A248 VanDerWaalsContact C-N 3.33Å; L246-A248 PolarHBondContact O-N 2.86Å; L246-R249 PolarHBondContact O-N 2.68Å; L246-V250 WeakPolarHBondContact O-CG2 3.33Å; L246-V250 PolarHBondContact O-N 2.86Å; L246-V311 HydrophobicContact CB-CG1 4.45Å; L246-V311 HydrophobicContact CD2-CG1 4.36Å; L246-A335 HydrophobicContact CD1-CB 4.06Å; L246-A335 WeakPolarHBondContact CD1-O 3.15Å; L246-G336 VanDerWaalsContact CD1-O 3.28Å; L246-G336 WeakPolarHBondContact CD1-O 3.28Å
247	V	92.8	Very high	93.7	Very high	46 Å²	46	77.6 Å²	77.6	28%	0.279	39%	0.394	S	S	.	.	H	α-helix	trans	-59.6	-42.7	176.5	172.4	0	0	0	0	111.5	V23 T243 V250 K251	V23-V247 HydrophobicContact CG1-CG1 4.32Å; T243-V247 HydrophobicContact CG2-CG2 4.3Å; T243-V247 WeakPolarHBondContact O-CG2 2.98Å; T243-V247 PolarHBondContact O-N 3.05Å; V247-V250 PolarHBondContact O-N 2.99Å; V247-K251 PolarHBondContact O-N 2.97Å
248	A	93.8	Very high	93.7	Very high	46 Å²	46	80.2 Å²	80.2	38%	0.38	41%	0.41	S	S	.	.	H	α-helix	trans	-61.9	-45.5	176.5	0	0	0	0	0	112	K244 V245 L246 V250 K251 D252	K244-A248 WeakPolarHBondContact O-CB 3.41Å; K244-A248 PolarHBondContact O-N 3.29Å; V245-A248 PolarHBondContact O-N 3.07Å; L246-A248 VanDerWaalsContact C-N 3.33Å; L246-A248 PolarHBondContact O-N 2.86Å; A248-V250 VanDerWaalsContact C-N 3.33Å; A248-V250 PolarHBondContact O-N 2.93Å; A248-K251 WeakPolarHBondContact O-CB 3.28Å; A248-K251 PolarHBondContact O-N 2.97Å; A248-D252 VanDerWaalsContact O-CG 3.31Å; A248-D252 PolarHBondContact O-N 3.27Å
249	R	94.4	Very high	93.9	Very high	156 Å²	156	79.7 Å²	79.7	59%	0.589	42%	0.421	S	S	*	.	H	α-helix	trans	-60.7	-40.2	177.1	-73.8	175.9	-174.6	176.9	3.4	112.5	V245 L246 D252 K253	V245-R249 HydrophobicContact CG1-CG 4.43Å; V245-R249 VanDerWaalsContact O-CG 3.31Å; V245-R249 WeakPolarHBondContact O-CG 3.05Å; V245-R249 PolarHBondContact O-N 3.43Å; L246-R249 PolarHBondContact O-N 2.68Å; R249-D252 PolarHBondContact O-N 2.87Å; R249-K253 WeakPolarHBondContact O-CB 3.27Å; R249-K253 PolarHBondContact O-N 2.93Å
250	V	96.1	Very high	94.1	Very high	2 Å²	2	82.4 Å²	82.4	1%	0.012	43%	0.433	C	S	.	.	H	α-helix	trans	-62.4	-47.5	176.1	172.9	0	0	0	0	110.5	H20 L246 V247 A248 D252 K253 I254 I309 V311	H20-V250 HydrophobicContact CB-CG1 4.34Å; L246-V250 WeakPolarHBondContact O-CG2 3.33Å; L246-V250 PolarHBondContact O-N 2.86Å; V247-V250 PolarHBondContact O-N 2.99Å; A248-V250 VanDerWaalsContact C-N 3.33Å; A248-V250 PolarHBondContact O-N 2.93Å; V250-D252 VanDerWaalsContact C-N 3.33Å; V250-D252 PolarHBondContact O-N 2.88Å; V250-K253 PolarHBondContact O-N 3Å; V250-I254 HydrophobicContact CG1-CD1 3.66Å; V250-I254 HydrophobicContact CG1-CG1 4.44Å; V250-I254 WeakPolarHBondContact O-CD1 3.42Å; V250-I254 WeakPolarHBondContact O-CG1 3.44Å; V250-I254 PolarHBondContact O-N 2.67Å; V250-I309 HydrophobicContact CB-CG2 4.22Å; V250-I309 HydrophobicContact CG1-CG2 3.79Å; V250-I309 HydrophobicContact CG2-CG2 3.41Å; V250-I309 VanDerWaalsContact CG2-CG2 3.41Å; V250-V311 HydrophobicContact CG2-CG1 3.4Å
251	K	95.8	Very high	94.5	Very high	123 Å²	123	76.9 Å²	76.9	54%	0.535	40%	0.397	S	S	.	.	H	α-helix	trans	-57	-46.1	176	-174.9	179.8	-179.6	179.8	0	111.9	V247 A248 K253 I254 N255	V247-K251 PolarHBondContact O-N 2.97Å; A248-K251 WeakPolarHBondContact O-CB 3.28Å; A248-K251 PolarHBondContact O-N 2.97Å; K251-K253 VanDerWaalsContact C-N 3.34Å; K251-K253 PolarHBondContact O-N 2.93Å; K251-I254 PolarHBondContact O-N 3.16Å; K251-N255 VanDerWaalsContact O-CG 3.27Å; K251-N255 PolarHBondContact O-N 2.92Å; K251-N255 PolarHBondContact O-ND2 3.4Å
252	D	96.5	Very high	94.9	Very high	103 Å²	103	78.2 Å²	78.2	55%	0.551	41%	0.407	S	S	*	.	H	α-helix	trans	-63.4	-40.5	179.1	-67.6	-19.4	0	0	0	111.8	A248 R249 V250 N255 K256	A248-D252 VanDerWaalsContact O-CG 3.31Å; A248-D252 PolarHBondContact O-N 3.27Å; R249-D252 PolarHBondContact O-N 2.87Å; V250-D252 VanDerWaalsContact C-N 3.33Å; V250-D252 PolarHBondContact O-N 2.88Å; D252-N255 PolarHBondContact O-N 3.28Å; D252-K256 WeakPolarHBondContact O-CB 2.96Å; D252-K256 PolarHBondContact O-N 3.34Å
253	K	96.9	Very high	95.5	Very high	67 Å²	67	78.7 Å²	78.7	29%	0.291	41%	0.409	S	S	.	.	H	α-helix	trans	-66.4	-40	177.7	-168	175.3	-175.7	168.3	0	112.4	R249 V250 K251 K256 L257 M261 V308 I309	R249-K253 WeakPolarHBondContact O-CB 3.27Å; R249-K253 PolarHBondContact O-N 2.93Å; V250-K253 PolarHBondContact O-N 3Å; K251-K253 VanDerWaalsContact C-N 3.34Å; K251-K253 PolarHBondContact O-N 2.93Å; K253-K256 PolarHBondContact O-N 3.26Å; K253-L257 PolarHBondContact O-N 3.05Å; K253-M261 HydrophobicContact CD-SD 4.2Å; K253-M261 HydrophobicContact CG-CG 4.27Å; K253-M261 HydrophobicContact CG-SD 4.21Å; K253-V308 WeakPolarHBondContact CE-O 3.41Å; K253-V308 PolarHBondContact NZ-O 3.01Å; K253-I309 VanDerWaalsContact CD-O 3.22Å; K253-I309 WeakPolarHBondContact CD-O 3.32Å; K253-I309 PolarHBondContact NZ-O 3.38Å
254	I	96.3	Very high	96	Very high	17 Å²	17	75.7 Å²	75.7	9%	0.087	39%	0.391	C	S	.	.	H	α-helix	trans	-62.3	-46.2	174.7	-68.4	158.9	0	0	0	110.4	H24 V250 K251 K256 L257 P258 M261 L265	H24-I254 WeakPolarHBondContact CE1-CD1 3.2Å; H24-I254 WeakPolarHBondContact NE2-CD1 3.44Å; V250-I254 HydrophobicContact CG1-CD1 3.66Å; V250-I254 HydrophobicContact CG1-CG1 4.44Å; V250-I254 WeakPolarHBondContact O-CD1 3.42Å; V250-I254 WeakPolarHBondContact O-CG1 3.44Å; V250-I254 PolarHBondContact O-N 2.67Å; K251-I254 PolarHBondContact O-N 3.16Å; I254-K256 VanDerWaalsContact C-N 3.28Å; I254-K256 PolarHBondContact O-N 3.09Å; I254-L257 CarbonylContact O-C 3.51Å; I254-L257 PolarHBondContact O-N 3.47Å; I254-P258 VanDerWaalsContact O-CA 3.25Å; I254-P258 WeakPolarHBondContact O-CA 3.3Å; I254-P258 WeakPolarHBondContact O-CD 3.33Å; I254-P258 VanDerWaalsContact O-N 3.12Å; I254-M261 HydrophobicContact CB-CB 4.32Å; I254-M261 HydrophobicContact CG1-CB 3.83Å; I254-M261 HydrophobicContact CG1-CG 4.31Å; I254-L265 HydrophobicContact CD1-CD1 3.77Å; I254-L265 HydrophobicContact CG1-CD1 4.21Å
255	N	97.1	Very high	96.5	Very high	111 Å²	111	67.6 Å²	67.6	59%	0.594	36%	0.356	S	S	*	.	H	α-helix	trans	-63.5	-35.2	177.6	-68.6	-22.4	0	0	0	112.2	K251 D252	K251-N255 VanDerWaalsContact O-CG 3.27Å; K251-N255 PolarHBondContact O-N 2.92Å; K251-N255 PolarHBondContact O-ND2 3.4Å; D252-N255 PolarHBondContact O-N 3.28Å
256	K	97.7	Very high	96.7	Very high	169 Å²	169	68 Å²	68	74%	0.735	36%	0.356	S	S	*	.	H	α-helix	trans	-73.8	-38.2	179.3	-171.4	179.3	-179.9	178.3	0	113	D252 K253 I254 P258	D252-K256 WeakPolarHBondContact O-CB 2.96Å; D252-K256 PolarHBondContact O-N 3.34Å; K253-K256 PolarHBondContact O-N 3.26Å; I254-K256 VanDerWaalsContact C-N 3.28Å; I254-K256 PolarHBondContact O-N 3.09Å; K256-P258 VanDerWaalsContact C-CD 3.5Å
257	L	97.5	Very high	97	Very high	69 Å²	69	69.4 Å²	69.4	36%	0.361	37%	0.367	S	S	.	.	S	Bend	trans	-132.4	58.3	-172.1	-60.4	173.5	0	0	0	111.8	K253 I254 S259 I260 M261	K253-L257 PolarHBondContact O-N 3.05Å; I254-L257 CarbonylContact O-C 3.51Å; I254-L257 PolarHBondContact O-N 3.47Å; L257-S259 PolarHBondContact O-N 3.14Å; L257-I260 HydrophobicContact CB-CB 4.46Å; L257-I260 PolarHBondContact O-N 2.75Å; L257-M261 HydrophobicContact CB-CG 4.27Å; L257-M261 WeakPolarHBondContact O-CB 3.36Å; L257-M261 WeakPolarHBondContact O-CG 3.49Å; L257-M261 PolarHBondContact O-N 3.33Å
258	P	97.7	Very high	97.3	Very high	59 Å²	59	67.3 Å²	67.3	38%	0.383	35%	0.354	S	S	.	.	H	α-helix	trans	-64.4	-39.7	-169.6	24.5	-34.4	0	0	0	113	I254 K256 I260 M261 I262	I254-P258 VanDerWaalsContact O-CA 3.25Å; I254-P258 WeakPolarHBondContact O-CA 3.3Å; I254-P258 WeakPolarHBondContact O-CD 3.33Å; I254-P258 VanDerWaalsContact O-N 3.12Å; K256-P258 VanDerWaalsContact C-CD 3.5Å; P258-I260 PolarHBondContact O-N 3.06Å; P258-M261 PolarHBondContact O-N 3.23Å; P258-I262 HydrophobicContact CB-CD1 4.06Å; P258-I262 VanDerWaalsContact O-CB 3.3Å; P258-I262 WeakPolarHBondContact O-CB 3.26Å; P258-I262 WeakPolarHBondContact O-CD1 3.12Å; P258-I262 VanDerWaalsContact O-CG1 3.24Å; P258-I262 WeakPolarHBondContact O-CG1 3.35Å; P258-I262 PolarHBondContact O-N 3.04Å
259	S	98.1	Very high	97.5	Very high	101 Å²	101	67 Å²	67	71%	0.706	35%	0.346	S	S	*	.	H	α-helix	trans	-64.4	-20.4	179.6	55.3	0	0	0	0	114	L257 P263	L257-S259 PolarHBondContact O-N 3.14Å; S259-P263 WeakPolarHBondContact O-CD 3.49Å; S259-P263 WeakPolarHBondContact O-CG 3.11Å
260	I	97.9	Very high	97.7	Very high	94 Å²	94	62 Å²	62	48%	0.482	34%	0.338	S	S	.	.	H	α-helix	trans	-96.1	-47.4	176.4	-60.9	172.6	0	0	0	109.7	L257 P258 P263 V264	L257-I260 HydrophobicContact CB-CB 4.46Å; L257-I260 PolarHBondContact O-N 2.75Å; P258-I260 PolarHBondContact O-N 3.06Å; I260-P263 WeakPolarHBondContact O-CD 3.14Å; I260-V264 WeakPolarHBondContact O-CG2 3.33Å; I260-V264 PolarHBondContact O-N 2.83Å
261	M	98.3	Very high	97.8	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-74.8	-32.1	-171.8	-66.4	-51.1	-50.2	0	0	113.2	K253 I254 L257 P258 V264 L265 I309	K253-M261 HydrophobicContact CD-SD 4.2Å; K253-M261 HydrophobicContact CG-CG 4.27Å; K253-M261 HydrophobicContact CG-SD 4.21Å; I254-M261 HydrophobicContact CB-CB 4.32Å; I254-M261 HydrophobicContact CG1-CB 3.83Å; I254-M261 HydrophobicContact CG1-CG 4.31Å; L257-M261 HydrophobicContact CB-CG 4.27Å; L257-M261 WeakPolarHBondContact O-CB 3.36Å; L257-M261 WeakPolarHBondContact O-CG 3.49Å; L257-M261 PolarHBondContact O-N 3.33Å; P258-M261 PolarHBondContact O-N 3.23Å; M261-V264 HydrophobicContact CE-CB 4.34Å; M261-V264 HydrophobicContact CE-CG1 4.22Å; M261-V264 PolarHBondContact O-N 2.84Å; M261-L265 VanDerWaalsContact O-CG 3.3Å; M261-L265 WeakPolarHBondContact O-CG 3.29Å; M261-L265 PolarHBondContact O-N 2.87Å; M261-I309 HydrophobicContact CE-CB 4.26Å; M261-I309 HydrophobicContact CE-CG1 3.69Å
262	I	97.9	Very high	97.9	Very high	85 Å²	85	56.5 Å²	56.5	44%	0.436	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-51.2	177.3	-67.3	166.8	0	0	0	110.8	P258 V264 L265 D266	P258-I262 HydrophobicContact CB-CD1 4.06Å; P258-I262 VanDerWaalsContact O-CB 3.3Å; P258-I262 WeakPolarHBondContact O-CB 3.26Å; P258-I262 WeakPolarHBondContact O-CD1 3.12Å; P258-I262 VanDerWaalsContact O-CG1 3.24Å; P258-I262 WeakPolarHBondContact O-CG1 3.35Å; P258-I262 PolarHBondContact O-N 3.04Å; I262-V264 VanDerWaalsContact C-N 3.27Å; I262-V264 PolarHBondContact O-N 3.45Å; I262-L265 WeakPolarHBondContact O-CB 3.31Å; I262-L265 PolarHBondContact O-N 3.05Å; I262-D266 PolarHBondContact O-N 3.03Å
263	P	98.5	Very high	98	Very high	70 Å²	70	53.2 Å²	53.2	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-57.5	-35.6	173.4	-28.4	35.3	0	0	0	114.5	S259 I260 D266 S267	S259-P263 WeakPolarHBondContact O-CD 3.49Å; S259-P263 WeakPolarHBondContact O-CG 3.11Å; I260-P263 WeakPolarHBondContact O-CD 3.14Å; P263-D266 PolarHBondContact O-N 3.48Å; P263-S267 PolarHBondContact O-N 2.98Å
264	V	98.4	Very high	98	Very high	17 Å²	17	52.7 Å²	52.7	10%	0.103	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-43.5	174.6	171.1	0	0	0	0	110.8	I260 M261 I262 S267 V268 H305 V308 I309	I260-V264 WeakPolarHBondContact O-CG2 3.33Å; I260-V264 PolarHBondContact O-N 2.83Å; M261-V264 HydrophobicContact CE-CB 4.34Å; M261-V264 HydrophobicContact CE-CG1 4.22Å; M261-V264 PolarHBondContact O-N 2.84Å; I262-V264 VanDerWaalsContact C-N 3.27Å; I262-V264 PolarHBondContact O-N 3.45Å; V264-S267 PolarHBondContact O-N 3.2Å; V264-V268 WeakPolarHBondContact O-CG2 3.19Å; V264-V268 PolarHBondContact O-N 2.88Å; V264-V268 VanDerWaalsContact O-N 3.08Å; V264-H305 HydrophobicContact CG1-CB 4.28Å; V264-V308 HydrophobicContact CG1-CG1 4.34Å; V264-V308 HydrophobicContact CG2-CG1 4.01Å; V264-I309 HydrophobicContact CG1-CD1 4.25Å; V264-I309 HydrophobicContact CG1-CG1 3.92Å
265	L	98	Very high	98.1	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-67.3	-37.1	176.4	-64.6	174.4	0	0	0	112.3	A21 H24 K26 I254 M261 I262 S267 V268 D269 I309	A21-L265 HydrophobicContact CB-CD2 4.1Å; H24-L265 HydrophobicContact CB-CD1 3.89Å; K26-L265 HydrophobicContact CG-CB 4.35Å; I254-L265 HydrophobicContact CD1-CD1 3.77Å; I254-L265 HydrophobicContact CG1-CD1 4.21Å; M261-L265 VanDerWaalsContact O-CG 3.3Å; M261-L265 WeakPolarHBondContact O-CG 3.29Å; M261-L265 PolarHBondContact O-N 2.87Å; I262-L265 WeakPolarHBondContact O-CB 3.31Å; I262-L265 PolarHBondContact O-N 3.05Å; L265-S267 VanDerWaalsContact C-N 3.28Å; L265-S267 PolarHBondContact O-N 2.9Å; L265-V268 PolarHBondContact O-N 3.34Å; L265-D269 PolarHBondContact O-N 3.14Å; L265-I309 HydrophobicContact CD2-CD1 4.34Å
266	D	98.4	Very high	98.1	Very high	71 Å²	71	48.8 Å²	48.8	38%	0.38	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-37	173.5	-64.8	-25.2	0	0	0	111.4	K26 I262 P263 D269 A270	K26-D266 WeakPolarHBondContact CE-OD1 3.5Å; K26-D266 IonicContact NZ-OD1 2.67Å; K26-D266 PolarHBondContact NZ-OD1 3.01Å; I262-D266 PolarHBondContact O-N 3.03Å; P263-D266 PolarHBondContact O-N 3.48Å; D266-D269 WeakPolarHBondContact O-CB 3.3Å; D266-D269 PolarHBondContact O-N 3.39Å; D266-A270 PolarHBondContact O-N 2.82Å
267	S	98.6	Very high	98	Very high	43 Å²	43	47 Å²	47	30%	0.301	27%	0.271	S	S	.	.	H	α-helix	trans	-67.3	-41.3	175	-168.1	0	0	0	0	112.1	P263 V264 L265 D269 A270 I271 H305	P263-S267 PolarHBondContact O-N 2.98Å; V264-S267 PolarHBondContact O-N 3.2Å; L265-S267 VanDerWaalsContact C-N 3.28Å; L265-S267 PolarHBondContact O-N 2.9Å; S267-D269 VanDerWaalsContact C-N 3.3Å; S267-D269 PolarHBondContact O-N 2.95Å; S267-A270 WeakPolarHBondContact O-CB 3.47Å; S267-A270 PolarHBondContact O-N 2.99Å; S267-I271 WeakPolarHBondContact O-CG1 3.34Å; S267-I271 PolarHBondContact O-N 3.16Å; S267-H305 PolarHBondContact OG-NE2 2.69Å
268	V	98.4	Very high	97.9	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-64.3	-35.2	174	176.9	0	0	0	0	112.1	A21 V264 L265 I271 S272 H305 I309	A21-V268 HydrophobicContact CB-CB 4.08Å; A21-V268 HydrophobicContact CB-CG1 3.62Å; V264-V268 WeakPolarHBondContact O-CG2 3.19Å; V264-V268 PolarHBondContact O-N 2.88Å; V264-V268 VanDerWaalsContact O-N 3.08Å; L265-V268 PolarHBondContact O-N 3.34Å; V268-I271 PolarHBondContact O-N 2.89Å; V268-S272 PolarHBondContact O-N 2.94Å; V268-S272 VanDerWaalsContact O-N 3.09Å; V268-S272 PolarHBondContact O-OG 2.94Å; V268-H305 HydrophobicContact CG2-CB 3.72Å; V268-I309 HydrophobicContact CG2-CD1 4.44Å
269	D	98.4	Very high	97.8	Very high	41 Å²	41	41.1 Å²	41.1	22%	0.219	24%	0.237	C	C	.	.	H	α-helix	trans	-62.5	-46.7	172.6	-171.2	77.2	0	0	0	111.6	K26 V27 L265 D266 S267 I271 S272 C273	K26-D269 WeakPolarHBondContact CA-OD1 3.45Å; K26-D269 HydrophobicContact CB-CB 3.96Å; K26-D269 WeakPolarHBondContact CB-OD1 3.41Å; K26-D269 HydrophobicContact CD-CB 3.91Å; K26-D269 HydrophobicContact CG-CB 4.11Å; V27-D269 WeakPolarHBondContact CG2-OD1 3.26Å; V27-D269 PolarHBondContact N-OD1 2.92Å; L265-D269 PolarHBondContact O-N 3.14Å; D266-D269 WeakPolarHBondContact O-CB 3.3Å; D266-D269 PolarHBondContact O-N 3.39Å; S267-D269 VanDerWaalsContact C-N 3.3Å; S267-D269 PolarHBondContact O-N 2.95Å; D269-I271 VanDerWaalsContact C-N 3.33Å; D269-I271 PolarHBondContact O-N 3.04Å; D269-S272 PolarHBondContact O-N 3.3Å; D269-C273 PolarHBondContact O-N 3.3Å; D269-C273 PolarHBondContact O-SG 2.84Å; D269-C273 VanDerWaalsContact O-SG 3.32Å
270	A	98.6	Very high	97.5	Very high	51 Å²	51	39.1 Å²	39.1	42%	0.421	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-39.5	176.1	0	0	0	0	0	112	D266 S267 S272 C273 T274	D266-A270 PolarHBondContact O-N 2.82Å; S267-A270 WeakPolarHBondContact O-CB 3.47Å; S267-A270 PolarHBondContact O-N 2.99Å; A270-S272 VanDerWaalsContact C-N 3.35Å; A270-S272 PolarHBondContact O-N 3.41Å; A270-C273 PolarHBondContact O-N 2.89Å; A270-T274 WeakPolarHBondContact O-CB 3.41Å; A270-T274 PolarHBondContact O-N 3Å; A270-T274 PolarHBondContact O-OG1 3.19Å
271	I	98.8	Very high	97.2	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-58.5	-48.1	174	-71.2	165.6	0	0	0	110.9	H17 S267 V268 D269 C273 T274 C275 L298 I301 N302	H17-I271 HydrophobicContact CB-CG2 4.27Å; S267-I271 WeakPolarHBondContact O-CG1 3.34Å; S267-I271 PolarHBondContact O-N 3.16Å; V268-I271 PolarHBondContact O-N 2.89Å; D269-I271 VanDerWaalsContact C-N 3.33Å; D269-I271 PolarHBondContact O-N 3.04Å; I271-C273 VanDerWaalsContact C-N 3.35Å; I271-C273 PolarHBondContact O-N 3.16Å; I271-T274 PolarHBondContact O-N 3.27Å; I271-C275 WeakPolarHBondContact O-CB 3.44Å; I271-C275 PolarHBondContact O-N 3.13Å; I271-L298 HydrophobicContact CB-CD2 4.35Å; I271-L298 HydrophobicContact CG1-CD2 4.14Å; I271-L298 HydrophobicContact CG2-CB 4.13Å; I271-L298 HydrophobicContact CG2-CD2 4.1Å; I271-I301 HydrophobicContact CD1-CB 4.19Å; I271-I301 HydrophobicContact CD1-CG2 3.62Å; I271-I301 HydrophobicContact CG1-CG2 4.43Å; I271-N302 HydrophobicContact CD1-CB 3.96Å; I271-N302 HydrophobicContact CG2-CB 4.21Å
272	S	98.3	Very high	97	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-43.3	-179.2	-55.3	0	0	0	0	111.1	H17 V27 L29 V268 D269 A270 C275 E276	H17-S272 WeakPolarHBondContact CB-OG 3.47Å; V27-S272 PolarHBondContact O-OG 2.95Å; L29-S272 WeakPolarHBondContact CD1-O 3.31Å; V268-S272 PolarHBondContact O-N 2.94Å; V268-S272 VanDerWaalsContact O-N 3.09Å; V268-S272 PolarHBondContact O-OG 2.94Å; D269-S272 PolarHBondContact O-N 3.3Å; A270-S272 VanDerWaalsContact C-N 3.35Å; A270-S272 PolarHBondContact O-N 3.41Å; S272-C275 PolarHBondContact O-N 3.07Å; S272-E276 PolarHBondContact O-N 2.94Å
273	C	97.9	Very high	96.5	Very high	34 Å²	34	36.9 Å²	36.9	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-67.7	-36.4	177.4	-64.7	0	0	0	0	113.1	D269 A270 I271 K277	D269-C273 PolarHBondContact O-N 3.3Å; D269-C273 PolarHBondContact O-SG 2.84Å; D269-C273 VanDerWaalsContact O-SG 3.32Å; A270-C273 PolarHBondContact O-N 2.89Å; I271-C273 VanDerWaalsContact C-N 3.35Å; I271-C273 PolarHBondContact O-N 3.16Å; C273-K277 WeakPolarHBondContact O-CG 3.38Å; C273-K277 PolarHBondContact O-N 2.8Å
274	T	98.3	Very high	96	Very high	57 Å²	57	38.5 Å²	38.5	35%	0.35	22%	0.221	S	C	.	.	H	α-helix	trans	-69.8	-43	176.4	-60.1	0	0	0	0	110.9	A270 I271 E276 K277 V278 L298	A270-T274 WeakPolarHBondContact O-CB 3.41Å; A270-T274 PolarHBondContact O-N 3Å; A270-T274 PolarHBondContact O-OG1 3.19Å; I271-T274 PolarHBondContact O-N 3.27Å; T274-E276 VanDerWaalsContact C-N 3.34Å; T274-E276 PolarHBondContact O-N 3Å; T274-K277 WeakPolarHBondContact O-CB 3.41Å; T274-K277 PolarHBondContact O-N 3.38Å; T274-V278 HydrophobicContact CG2-CG2 4.47Å; T274-V278 WeakPolarHBondContact O-CG2 3.39Å; T274-V278 PolarHBondContact O-N 2.77Å; T274-L298 HydrophobicContact CG2-CD1 4.07Å; T274-L298 HydrophobicContact CG2-CD2 4.32Å
275	C	97.8	Very high	95.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-46.2	175.1	-175.4	0	0	0	0	111.5	H17 L29 I271 S272 K277 V278 L279 L298	H17-C275 VanDerWaalsContact CD2-CB 3.47Å; H17-C275 WeakPolarHBondContact CD2-CB 3.39Å; H17-C275 PolarHBondContact CD2-SG 2.91Å; L29-C275 HydrophobicContact CD1-CB 3.87Å; I271-C275 WeakPolarHBondContact O-CB 3.44Å; I271-C275 PolarHBondContact O-N 3.13Å; S272-C275 PolarHBondContact O-N 3.07Å; C275-K277 VanDerWaalsContact C-N 3.28Å; C275-K277 PolarHBondContact O-N 2.76Å; C275-V278 PolarHBondContact O-N 3.46Å; C275-L279 WeakPolarHBondContact O-CB 3.44Å; C275-L279 WeakPolarHBondContact O-CD1 3.14Å; C275-L279 WeakPolarHBondContact O-CG 3.33Å; C275-L279 PolarHBondContact O-N 3.33Å; C275-L279 WeakPolarHBondContact SG-CD1 3.34Å; C275-L298 HydrophobicContact CB-CD1 3.87Å
276	E	96.3	Very high	94.9	Very high	46 Å²	46	48.5 Å²	48.5	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-54.6	-42.9	175.9	179.6	174.4	166.4	0	0	112.3	L29 R215 L224 S272 T274 T280	L29-E276 HydrophobicContact CD1-CB 4.2Å; L29-E276 HydrophobicContact CD2-CB 4.29Å; R215-E276 WeakPolarHBondContact CD-OE2 3.28Å; R215-E276 IonicContact CZ-OE2 2.58Å; R215-E276 IonicContact NH1-OE2 3.8Å; R215-E276 PolarHBondContact NH1-OE2 3.22Å; L224-E276 HydrophobicContact CD2-CG 4.12Å; S272-E276 PolarHBondContact O-N 2.94Å; T274-E276 VanDerWaalsContact C-N 3.34Å; T274-E276 PolarHBondContact O-N 3Å; E276-T280 WeakPolarHBondContact O-CB 3.46Å; E276-T280 PolarHBondContact O-N 2.95Å; E276-T280 PolarHBondContact O-OG1 2.8Å
277	K	95.6	Very high	94.5	Very high	130 Å²	130	49.2 Å²	49.2	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-65.1	-51.7	177.4	-69.5	171	-176	177.9	0	112.1	C273 T274 C275 L279 T280 E281	C273-K277 WeakPolarHBondContact O-CG 3.38Å; C273-K277 PolarHBondContact O-N 2.8Å; T274-K277 WeakPolarHBondContact O-CB 3.41Å; T274-K277 PolarHBondContact O-N 3.38Å; C275-K277 VanDerWaalsContact C-N 3.28Å; C275-K277 PolarHBondContact O-N 2.76Å; K277-L279 VanDerWaalsContact C-N 3.29Å; K277-L279 PolarHBondContact O-N 3.02Å; K277-T280 WeakPolarHBondContact O-CB 3.36Å; K277-T280 PolarHBondContact O-N 2.6Å; K277-E281 WeakPolarHBondContact O-CG 3.43Å; K277-E281 PolarHBondContact O-N 2.9Å
278	V	96.2	Very high	94.2	Very high	5 Å²	5	50.2 Å²	50.2	3%	0.03	28%	0.284	C	S	.	.	H	α-helix	trans	-58.3	-43.3	-179.8	173.6	0	0	0	0	110.9	T274 C275 T280 E281 M282 H291 I294 L295	T274-V278 HydrophobicContact CG2-CG2 4.47Å; T274-V278 WeakPolarHBondContact O-CG2 3.39Å; T274-V278 PolarHBondContact O-N 2.77Å; C275-V278 PolarHBondContact O-N 3.46Å; V278-T280 VanDerWaalsContact C-N 3.32Å; V278-T280 PolarHBondContact O-N 2.93Å; V278-E281 WeakPolarHBondContact O-CB 3.38Å; V278-E281 PolarHBondContact O-N 3.42Å; V278-M282 HydrophobicContact CG1-SD 4.26Å; V278-M282 VanDerWaalsContact O-CG 3.27Å; V278-M282 WeakPolarHBondContact O-CG 3.35Å; V278-M282 PolarHBondContact O-N 3.24Å; V278-H291 HydrophobicContact CG1-CB 4.06Å; V278-I294 HydrophobicContact CG2-CB 4.4Å; V278-I294 HydrophobicContact CG2-CD1 4.35Å; V278-I294 HydrophobicContact CG2-CG2 3.78Å; V278-L295 HydrophobicContact CB-CD2 4.49Å; V278-L295 HydrophobicContact CG1-CD2 4.1Å; V278-L295 HydrophobicContact CG1-CG 4.13Å
279	L	94.4	Very high	93.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.1	-36.6	178.2	-67.6	166.1	0	0	0	112.3	L16 M213 P228 L230 C275 K277 M282 T283 L295	L16-L279 HydrophobicContact CD2-CD1 4.11Å; M213-L279 HydrophobicContact CE-CD1 3.25Å; M213-L279 HydrophobicContact CE-CD2 4.47Å; M213-L279 HydrophobicContact CE-CG 4.4Å; M213-L279 HydrophobicContact SD-CD1 3.47Å; M213-L279 WeakPolarHBondContact SD-CD1 3.31Å; P228-L279 WeakPolarHBondContact CD-O 3.26Å; P228-L279 HydrophobicContact CG-CD2 3.73Å; L230-L279 HydrophobicContact CD1-CD2 3.86Å; C275-L279 WeakPolarHBondContact O-CB 3.44Å; C275-L279 WeakPolarHBondContact O-CD1 3.14Å; C275-L279 WeakPolarHBondContact O-CG 3.33Å; C275-L279 PolarHBondContact O-N 3.33Å; C275-L279 WeakPolarHBondContact SG-CD1 3.34Å; K277-L279 VanDerWaalsContact C-N 3.29Å; K277-L279 PolarHBondContact O-N 3.02Å; L279-M282 HydrophobicContact CD2-SD 4.22Å; L279-M282 PolarHBondContact O-N 2.76Å; L279-T283 WeakPolarHBondContact O-CG2 3.21Å; L279-T283 PolarHBondContact O-N 2.74Å; L279-L295 HydrophobicContact CD2-CD1 4.26Å; L279-L295 HydrophobicContact CD2-CD2 4.3Å; L279-L295 HydrophobicContact CG-CD2 4.39Å
280	T	92.5	Very high	93.7	Very high	60 Å²	60	55 Å²	55	37%	0.368	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-45.2	174.4	-57.9	0	0	0	0	110.4	E276 K277 V278 M282 T283 C284	E276-T280 WeakPolarHBondContact O-CB 3.46Å; E276-T280 PolarHBondContact O-N 2.95Å; E276-T280 PolarHBondContact O-OG1 2.8Å; K277-T280 WeakPolarHBondContact O-CB 3.36Å; K277-T280 PolarHBondContact O-N 2.6Å; V278-T280 VanDerWaalsContact C-N 3.32Å; V278-T280 PolarHBondContact O-N 2.93Å; T280-M282 VanDerWaalsContact C-N 3.35Å; T280-M282 PolarHBondContact O-N 2.85Å; T280-T283 PolarHBondContact O-N 2.8Å; T280-T283 PolarHBondContact O-OG1 3.06Å; T280-C284 PolarHBondContact O-N 2.94Å
281	E	92.8	Very high	93.6	Very high	87 Å²	87	53.4 Å²	53.4	41%	0.407	30%	0.302	S	S	.	.	H	α-helix	trans	-57.7	-45.1	175.8	-71.4	164	-172.6	0	0	111.4	K277 V278 T283 C284 E285	K277-E281 WeakPolarHBondContact O-CG 3.43Å; K277-E281 PolarHBondContact O-N 2.9Å; V278-E281 WeakPolarHBondContact O-CB 3.38Å; V278-E281 PolarHBondContact O-N 3.42Å; E281-T283 PolarHBondContact O-N 2.92Å; E281-C284 PolarHBondContact O-N 3.39Å; E281-E285 PolarHBondContact O-N 3.26Å
282	M	92.9	Very high	93.6	Very high	7 Å²	7	53.6 Å²	53.6	3%	0.034	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-16.7	175	-71.7	174.1	82.1	0	0	114.6	P228 L230 V278 L279 T280 I287 H291 Y292 L295	P228-M282 HydrophobicContact CB-CB 4.37Å; P228-M282 HydrophobicContact CB-CE 4.33Å; P228-M282 HydrophobicContact CG-CB 4.02Å; P228-M282 HydrophobicContact CG-CE 4.14Å; P228-M282 HydrophobicContact CG-SD 4.09Å; L230-M282 HydrophobicContact CD2-CE 3.9Å; V278-M282 HydrophobicContact CG1-SD 4.26Å; V278-M282 VanDerWaalsContact O-CG 3.27Å; V278-M282 WeakPolarHBondContact O-CG 3.35Å; V278-M282 PolarHBondContact O-N 3.24Å; L279-M282 HydrophobicContact CD2-SD 4.22Å; L279-M282 PolarHBondContact O-N 2.76Å; T280-M282 VanDerWaalsContact C-N 3.35Å; T280-M282 PolarHBondContact O-N 2.85Å; M282-I287 HydrophobicContact CB-CG1 4.08Å; M282-I287 HydrophobicContact CE-CD1 4.18Å; M282-I287 HydrophobicContact CE-CG1 4.23Å; M282-I287 HydrophobicContact CE-CG2 3.69Å; M282-I287 HydrophobicContact CG-CG1 4.39Å; M282-I287 WeakPolarHBondContact O-CG1 3.23Å; M282-H291 HydrophobicContact CE-CB 4.4Å; M282-H291 HydrophobicContact CG-CB 3.72Å; M282-H291 HydrophobicContact SD-CB 3.9Å; M282-Y292 HydrophobicContact CE-CD2 4.36Å; M282-Y292 HydrophobicContact CE-CE2 3.79Å; M282-L295 HydrophobicContact CE-CD1 4.39Å; M282-L295 HydrophobicContact SD-CD1 3.88Å
283	T	88.4	Confident	93.6	Very high	41 Å²	41	56.3 Å²	56.3	25%	0.252	32%	0.317	S	S	.	.	H	α-helix	trans	-98	-19.3	174.9	68.5	0	0	0	0	114.5	R226 L279 T280 E281	R226-T283 HydrophobicContact CB-CG2 3.93Å; L279-T283 WeakPolarHBondContact O-CG2 3.21Å; L279-T283 PolarHBondContact O-N 2.74Å; T280-T283 PolarHBondContact O-N 2.8Å; T280-T283 PolarHBondContact O-OG1 3.06Å; E281-T283 PolarHBondContact O-N 2.92Å
284	C	86.4	Confident	93.6	Very high	103 Å²	103	57.8 Å²	57.8	70%	0.696	32%	0.322	S	S	*	.	H	α-helix	trans	-98.2	-25.5	-179.9	-67.5	0	0	0	0	111.9	T280 E281	T280-C284 PolarHBondContact O-N 2.94Å; E281-C284 PolarHBondContact O-N 3.39Å
285	E	86.3	Confident	93.6	Very high	120 Å²	120	55.3 Å²	55.3	56%	0.561	31%	0.307	S	S	*	.	S	Bend	trans	-128.2	160.3	-173.2	-58.4	-169.5	177.7	0	0	111.3	E281 I287	E281-E285 PolarHBondContact O-N 3.26Å; E285-I287 PolarHBondContact O-N 3.34Å
286	P	88.1	Confident	93.6	Very high	113 Å²	113	55.8 Å²	55.8	73%	0.734	31%	0.309	S	S	*	.			trans	-56.9	131.4	173.7	-23.6	34.4	0	0	0	111.4	T288	P286-T288 PolarHBondContact O-N 3.21Å; P286-T288 VanDerWaalsContact O-N 3.15Å
287	I	90.4	Very high	93.7	Very high	87 Å²	87	59.4 Å²	59.4	45%	0.446	33%	0.325	S	S	.	.			trans	-67.8	115	178.4	-61.9	173.8	0	0	0	109.5	P228 M282 E285 Y292	P228-I287 HydrophobicContact CB-CD1 4.4Å; M282-I287 HydrophobicContact CB-CG1 4.08Å; M282-I287 HydrophobicContact CE-CD1 4.18Å; M282-I287 HydrophobicContact CE-CG1 4.23Å; M282-I287 HydrophobicContact CE-CG2 3.69Å; M282-I287 HydrophobicContact CG-CG1 4.39Å; M282-I287 WeakPolarHBondContact O-CG1 3.23Å; E285-I287 PolarHBondContact O-N 3.34Å; I287-Y292 HydrophobicContact CG2-CD2 4.18Å; I287-Y292 HydrophobicContact CG2-CE2 3.65Å
288	T	91.2	Very high	93.9	Very high	63 Å²	63	53.9 Å²	53.9	39%	0.387	30%	0.302	S	S	.	.			trans	-100.8	166	175.1	67.8	0	0	0	0	112.3	P286 D290 H291	P286-T288 PolarHBondContact O-N 3.21Å; P286-T288 VanDerWaalsContact O-N 3.15Å; T288-D290 PolarHBondContact O-N 3.39Å; T288-D290 PolarHBondContact OG1-N 3.06Å; T288-H291 PolarHBondContact N-ND1 3.37Å; T288-H291 VanDerWaalsContact N-ND1 3.16Å; T288-H291 PolarHBondContact O-N 2.96Å; T288-H291 PolarHBondContact OG1-ND1 2.94Å
289	G	92.4	Very high	94	Very high	37 Å²	37	53.9 Å²	53.9	38%	0.381	30%	0.302	S	S	.	.	H	α-helix	trans	-64	-26.3	172.1	0	0	0	0	0	113.4	H291 Y292 N293	G289-H291 VanDerWaalsContact C-N 3.35Å; G289-H291 PolarHBondContact O-N 2.99Å; G289-Y292 PolarHBondContact O-N 3.39Å; G289-N293 PolarHBondContact O-N 3.23Å; G289-N293 PolarHBondContact O-ND2 3.1Å; G289-N293 PolarHBondContact O-OD1 2.96Å
290	D	94.9	Very high	94.2	Very high	107 Å²	107	56.3 Å²	56.3	57%	0.572	32%	0.315	S	S	*	.	H	α-helix	trans	-66.7	-35.5	178	-68.7	-28.3	0	0	0	112.3	T288 Y292 N293 I294	T288-D290 PolarHBondContact O-N 3.39Å; T288-D290 PolarHBondContact OG1-N 3.06Å; D290-Y292 VanDerWaalsContact C-N 3.3Å; D290-Y292 PolarHBondContact O-N 3.44Å; D290-N293 WeakPolarHBondContact O-CB 3.38Å; D290-N293 PolarHBondContact O-N 3.02Å; D290-N293 PolarHBondContact OD1-ND2 3.35Å; D290-I294 WeakPolarHBondContact O-CG1 3.27Å; D290-I294 PolarHBondContact O-N 3.19Å
291	H	96.5	Very high	94.5	Very high	16 Å²	16	56.9 Å²	56.9	7%	0.074	32%	0.315	C	S	.	.	H	α-helix	trans	-59.7	-43.7	172.2	-59.4	131.8	0	0	0	111.3	V278 M282 T288 G289 I294 L295	V278-H291 HydrophobicContact CG1-CB 4.06Å; M282-H291 HydrophobicContact CE-CB 4.4Å; M282-H291 HydrophobicContact CG-CB 3.72Å; M282-H291 HydrophobicContact SD-CB 3.9Å; T288-H291 PolarHBondContact N-ND1 3.37Å; T288-H291 VanDerWaalsContact N-ND1 3.16Å; T288-H291 PolarHBondContact O-N 2.96Å; T288-H291 PolarHBondContact OG1-ND1 2.94Å; G289-H291 VanDerWaalsContact C-N 3.35Å; G289-H291 PolarHBondContact O-N 2.99Å; H291-I294 PolarHBondContact O-N 3.37Å; H291-L295 WeakPolarHBondContact O-CG 3.32Å; H291-L295 PolarHBondContact O-N 3.3Å
292	Y	97.6	Very high	94.8	Very high	13 Å²	13	52.7 Å²	52.7	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-67.7	-39.2	177.3	-83.2	-89.3	0	0	0	112.2	L230 M282 I287 G289 D290 I294 L295 E296 L344 R346 P347	L230-Y292 HydrophobicContact CD2-CE1 4.46Å; M282-Y292 HydrophobicContact CE-CD2 4.36Å; M282-Y292 HydrophobicContact CE-CE2 3.79Å; I287-Y292 HydrophobicContact CG2-CD2 4.18Å; I287-Y292 HydrophobicContact CG2-CE2 3.65Å; G289-Y292 PolarHBondContact O-N 3.39Å; D290-Y292 VanDerWaalsContact C-N 3.3Å; D290-Y292 PolarHBondContact O-N 3.44Å; Y292-I294 VanDerWaalsContact C-N 3.29Å; Y292-I294 PolarHBondContact O-N 3.33Å; Y292-L295 PolarHBondContact O-N 2.92Å; Y292-E296 WeakPolarHBondContact O-CB 3.47Å; Y292-E296 VanDerWaalsContact O-CG 3.32Å; Y292-E296 WeakPolarHBondContact O-CG 3.49Å; Y292-E296 PolarHBondContact O-N 3.17Å; Y292-L344 HydrophobicContact CD1-CD2 3.94Å; Y292-L344 HydrophobicContact CD1-CG 4.29Å; Y292-L344 HydrophobicContact CE1-CD1 4.23Å; Y292-L344 HydrophobicContact CE1-CD2 4.33Å; Y292-L344 HydrophobicContact CE1-CG 4.34Å; Y292-R346 HydrophobicContact CD1-CB 4.3Å; Y292-R346 HydrophobicContact CD1-CG 3.92Å; Y292-R346 HydrophobicContact CG-CG 4.29Å; Y292-P347 HydrophobicContact CE2-CG 3.88Å; Y292-P347 VanDerWaalsContact CZ-CD 3.43Å
293	N	97.9	Very high	95.1	Very high	57 Å²	57	52.7 Å²	52.7	31%	0.305	30%	0.295	S	S	.	.	H	α-helix	trans	-54.4	-47.8	173.4	-64	-22.6	0	0	0	110.6	G289 D290 E296 E297 R346	G289-N293 PolarHBondContact O-N 3.23Å; G289-N293 PolarHBondContact O-ND2 3.1Å; G289-N293 PolarHBondContact O-OD1 2.96Å; D290-N293 WeakPolarHBondContact O-CB 3.38Å; D290-N293 PolarHBondContact O-N 3.02Å; D290-N293 PolarHBondContact OD1-ND2 3.35Å; N293-E296 PolarHBondContact O-N 3.09Å; N293-E297 WeakPolarHBondContact O-CG 3.46Å; N293-E297 PolarHBondContact O-N 3.39Å; N293-R346 PolarHBondContact OD1-NH1 3.23Å; N293-R346 PolarHBondContact OD1-NH2 2.9Å
294	I	98.2	Very high	95.5	Very high	64 Å²	64	56.6 Å²	56.6	33%	0.328	31%	0.31	S	S	.	.	H	α-helix	trans	-64.6	-45.9	178.8	-61.8	163.3	0	0	0	110.8	V278 D290 H291 Y292 E296 E297 L298	V278-I294 HydrophobicContact CG2-CB 4.4Å; V278-I294 HydrophobicContact CG2-CD1 4.35Å; V278-I294 HydrophobicContact CG2-CG2 3.78Å; D290-I294 WeakPolarHBondContact O-CG1 3.27Å; D290-I294 PolarHBondContact O-N 3.19Å; H291-I294 PolarHBondContact O-N 3.37Å; Y292-I294 VanDerWaalsContact C-N 3.29Å; Y292-I294 PolarHBondContact O-N 3.33Å; I294-E296 VanDerWaalsContact C-N 3.3Å; I294-E296 PolarHBondContact O-N 3.45Å; I294-E297 PolarHBondContact O-N 3.01Å; I294-L298 HydrophobicContact CG2-CD1 3.99Å; I294-L298 HydrophobicContact CG2-CG 4.17Å; I294-L298 WeakPolarHBondContact O-CB 3.49Å; I294-L298 VanDerWaalsContact O-CG 3.22Å; I294-L298 WeakPolarHBondContact O-CG 3.05Å; I294-L298 PolarHBondContact O-N 3.28Å
295	L	98.3	Very high	96.1	Very high	6 Å²	6	53.2 Å²	53.2	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-39.9	179.6	-70	178.6	0	0	0	112.5	L230 V278 L279 M282 H291 Y292 L298 I299 L344	L230-L295 HydrophobicContact CD1-CD1 4.23Å; V278-L295 HydrophobicContact CB-CD2 4.49Å; V278-L295 HydrophobicContact CG1-CD2 4.1Å; V278-L295 HydrophobicContact CG1-CG 4.13Å; L279-L295 HydrophobicContact CD2-CD1 4.26Å; L279-L295 HydrophobicContact CD2-CD2 4.3Å; L279-L295 HydrophobicContact CG-CD2 4.39Å; M282-L295 HydrophobicContact CE-CD1 4.39Å; M282-L295 HydrophobicContact SD-CD1 3.88Å; H291-L295 WeakPolarHBondContact O-CG 3.32Å; H291-L295 PolarHBondContact O-N 3.3Å; Y292-L295 PolarHBondContact O-N 2.92Å; L295-L298 PolarHBondContact O-N 2.85Å; L295-I299 VanDerWaalsContact O-CG1 3.29Å; L295-I299 WeakPolarHBondContact O-CG1 3.47Å; L295-I299 PolarHBondContact O-N 3.39Å; L295-L344 HydrophobicContact CB-CD2 3.77Å; L295-L344 HydrophobicContact CD1-CD2 4.4Å
296	E	98.6	Very high	96.7	Very high	10 Å²	10	47.6 Å²	47.6	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-44.3	177.1	-72	179.5	175.8	0	0	112.2	Y292 N293 I294 L298 I299 D300 H329 L344 R346	Y292-E296 WeakPolarHBondContact O-CB 3.47Å; Y292-E296 VanDerWaalsContact O-CG 3.32Å; Y292-E296 WeakPolarHBondContact O-CG 3.49Å; Y292-E296 PolarHBondContact O-N 3.17Å; N293-E296 PolarHBondContact O-N 3.09Å; I294-E296 VanDerWaalsContact C-N 3.3Å; I294-E296 PolarHBondContact O-N 3.45Å; E296-L298 VanDerWaalsContact C-N 3.34Å; E296-L298 PolarHBondContact O-N 3.5Å; E296-I299 WeakPolarHBondContact O-CB 3.31Å; E296-I299 PolarHBondContact O-N 2.98Å; E296-I299 VanDerWaalsContact O-N 3.15Å; E296-D300 PolarHBondContact O-N 3.07Å; E296-H329 HydrophobicContact CB-CB 3.93Å; E296-H329 HydrophobicContact CG-CB 3.93Å; E296-H329 IonicContact OE1-CD2 3.41Å; E296-H329 IonicContact OE2-CD2 3.58Å; E296-H329 PolarHBondContact OE2-CD2 2.96Å; E296-H329 VanDerWaalsContact OE2-CD2 3.24Å; E296-H329 IonicContact OE2-NE2 2.72Å; E296-H329 PolarHBondContact OE2-NE2 2.94Å; E296-L344 HydrophobicContact CG-CD2 3.93Å; E296-R346 VanDerWaalsContact CD-NE 3.29Å; E296-R346 VanDerWaalsContact OE1-CG 3.27Å; E296-R346 WeakPolarHBondContact OE1-CG 3.42Å; E296-R346 IonicContact OE1-CZ 2.7Å; E296-R346 IonicContact OE1-NE 3.15Å; E296-R346 PolarHBondContact OE1-NE 3.25Å; E296-R346 IonicContact OE1-NH2 3.25Å; E296-R346 IonicContact OE2-CZ 3.24Å; E296-R346 IonicContact OE2-NE 2.82Å; E296-R346 PolarHBondContact OE2-NE 2.7Å; E296-R346 IonicContact OE2-NH2 3.33Å; E296-R346 PolarHBondContact OE2-NH2 3.15Å
297	E	98.6	Very high	97.2	Very high	121 Å²	121	44.7 Å²	44.7	57%	0.565	24%	0.236	S	C	*	.	H	α-helix	trans	-60.4	-43.4	173.7	-74	-178.6	-169.9	0	0	111.7	N293 I294 I299 D300 I301	N293-E297 WeakPolarHBondContact O-CG 3.46Å; N293-E297 PolarHBondContact O-N 3.39Å; I294-E297 PolarHBondContact O-N 3.01Å; E297-I299 VanDerWaalsContact C-N 3.28Å; E297-I299 PolarHBondContact O-N 3.44Å; E297-D300 PolarHBondContact O-N 2.97Å; E297-I301 WeakPolarHBondContact O-CB 3.41Å; E297-I301 WeakPolarHBondContact O-CD1 3.07Å; E297-I301 WeakPolarHBondContact O-CG1 3.38Å; E297-I301 PolarHBondContact O-N 3.42Å
298	L	98.8	Very high	97.5	Very high	14 Å²	14	43.8 Å²	43.8	7%	0.073	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-35.6	176.3	-68.5	179.4	0	0	0	112.1	I271 T274 C275 I294 L295 E296 N302	I271-L298 HydrophobicContact CB-CD2 4.35Å; I271-L298 HydrophobicContact CG1-CD2 4.14Å; I271-L298 HydrophobicContact CG2-CB 4.13Å; I271-L298 HydrophobicContact CG2-CD2 4.1Å; T274-L298 HydrophobicContact CG2-CD1 4.07Å; T274-L298 HydrophobicContact CG2-CD2 4.32Å; C275-L298 HydrophobicContact CB-CD1 3.87Å; I294-L298 HydrophobicContact CG2-CD1 3.99Å; I294-L298 HydrophobicContact CG2-CG 4.17Å; I294-L298 WeakPolarHBondContact O-CB 3.49Å; I294-L298 VanDerWaalsContact O-CG 3.22Å; I294-L298 WeakPolarHBondContact O-CG 3.05Å; I294-L298 PolarHBondContact O-N 3.28Å; L295-L298 PolarHBondContact O-N 2.85Å; E296-L298 VanDerWaalsContact C-N 3.34Å; E296-L298 PolarHBondContact O-N 3.5Å; L298-N302 WeakPolarHBondContact O-CB 3.47Å; L298-N302 PolarHBondContact O-N 3.15Å; L298-N302 VanDerWaalsContact O-N 3.07Å
299	I	98.8	Very high	97.8	Very high	5 Å²	5	41 Å²	41	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-50.7	174.2	-79.7	168.1	0	0	0	110.4	L295 E296 E297 N302 Q303 H329 S330 K331 L344	L295-I299 VanDerWaalsContact O-CG1 3.29Å; L295-I299 WeakPolarHBondContact O-CG1 3.47Å; L295-I299 PolarHBondContact O-N 3.39Å; E296-I299 WeakPolarHBondContact O-CB 3.31Å; E296-I299 PolarHBondContact O-N 2.98Å; E296-I299 VanDerWaalsContact O-N 3.15Å; E297-I299 VanDerWaalsContact C-N 3.28Å; E297-I299 PolarHBondContact O-N 3.44Å; I299-N302 PolarHBondContact O-N 3.44Å; I299-Q303 WeakPolarHBondContact O-CB 3.49Å; I299-Q303 PolarHBondContact O-N 2.93Å; I299-H329 HydrophobicContact CG2-CB 4.19Å; I299-S330 VanDerWaalsContact CG2-C 3.44Å; I299-K331 HydrophobicContact CB-CD 4.29Å; I299-K331 HydrophobicContact CG1-CD 4.07Å; I299-K331 HydrophobicContact CG1-CG 4.42Å; I299-K331 HydrophobicContact CG2-CB 3.98Å; I299-K331 HydrophobicContact CG2-CD 4.2Å; I299-K331 HydrophobicContact CG2-CG 3.92Å; I299-L344 HydrophobicContact CD1-CB 3.65Å; I299-L344 HydrophobicContact CD1-CD2 4.01Å; I299-L344 HydrophobicContact CD1-CG 4.42Å
300	D	98.8	Very high	98	Very high	51 Å²	51	41.1 Å²	41.1	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-65.3	-48.6	-177.8	-69.3	-13.5	0	0	0	111.8	E296 E297 N302 Q303 H304 H329	E296-D300 PolarHBondContact O-N 3.07Å; E297-D300 PolarHBondContact O-N 2.97Å; D300-N302 VanDerWaalsContact C-N 3.29Å; D300-N302 PolarHBondContact O-N 2.83Å; D300-Q303 PolarHBondContact O-N 2.63Å; D300-H304 PolarHBondContact O-CD2 3.05Å; D300-H304 PolarHBondContact O-N 3.24Å; D300-H329 IonicContact OD1-CG 3.68Å; D300-H329 IonicContact OD1-ND1 3.52Å; D300-H329 PolarHBondContact OD1-ND1 3.4Å; D300-H329 VanDerWaalsContact OD1-ND1 3.15Å; D300-H329 IonicContact OD2-CE1 3.56Å; D300-H329 PolarHBondContact OD2-CE1 3.4Å; D300-H329 VanDerWaalsContact OD2-CE1 3.25Å; D300-H329 IonicContact OD2-CG 2.8Å; D300-H329 IonicContact OD2-ND1 3.55Å; D300-H329 PolarHBondContact OD2-ND1 3.4Å
301	I	98.7	Very high	98.1	Very high	72 Å²	72	36.1 Å²	36.1	37%	0.369	19%	0.192	S	C	.	.	H	α-helix	trans	-58.9	-44.5	179.3	-64.4	165.6	0	0	0	109.7	I271 E297 H304 H305	I271-I301 HydrophobicContact CD1-CB 4.19Å; I271-I301 HydrophobicContact CD1-CG2 3.62Å; I271-I301 HydrophobicContact CG1-CG2 4.43Å; E297-I301 WeakPolarHBondContact O-CB 3.41Å; E297-I301 WeakPolarHBondContact O-CD1 3.07Å; E297-I301 WeakPolarHBondContact O-CG1 3.38Å; E297-I301 PolarHBondContact O-N 3.42Å; I301-H304 PolarHBondContact O-N 2.82Å; I301-H305 WeakPolarHBondContact CG2-NE2 3.22Å; I301-H305 PolarHBondContact O-CD2 2.9Å; I301-H305 VanDerWaalsContact O-CD2 3.25Å; I301-H305 PolarHBondContact O-N 2.99Å
302	N	98.8	Very high	98.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-39.6	179.1	-164.5	-1.1	0	0	0	111.9	H17 I271 L298 I299 D300 H304 H305 L306	H17-N302 WeakPolarHBondContact CB-ND2 3.47Å; H17-N302 PolarHBondContact ND1-ND2 2.83Å; I271-N302 HydrophobicContact CD1-CB 3.96Å; I271-N302 HydrophobicContact CG2-CB 4.21Å; L298-N302 WeakPolarHBondContact O-CB 3.47Å; L298-N302 PolarHBondContact O-N 3.15Å; L298-N302 VanDerWaalsContact O-N 3.07Å; I299-N302 PolarHBondContact O-N 3.44Å; D300-N302 VanDerWaalsContact C-N 3.29Å; D300-N302 PolarHBondContact O-N 2.83Å; N302-H304 VanDerWaalsContact C-N 3.29Å; N302-H304 PolarHBondContact O-N 2.95Å; N302-H305 PolarHBondContact O-N 3.32Å; N302-H305 VanDerWaalsContact O-N 3.17Å; N302-L306 WeakPolarHBondContact O-CB 3.49Å; N302-L306 WeakPolarHBondContact O-CD1 3.49Å; N302-L306 VanDerWaalsContact O-CG 3.24Å; N302-L306 WeakPolarHBondContact O-CG 3.25Å; N302-L306 PolarHBondContact O-N 3.37Å
303	Q	98.8	Very high	98.2	Very high	7 Å²	7	38.8 Å²	38.8	3%	0.033	21%	0.211	C	C	.	.	H	α-helix	trans	-57.3	-44.4	174	178.9	51.8	30.3	0	0	111.5	I299 D300 L306 N307 K331	I299-Q303 WeakPolarHBondContact O-CB 3.49Å; I299-Q303 PolarHBondContact O-N 2.93Å; D300-Q303 PolarHBondContact O-N 2.63Å; Q303-L306 PolarHBondContact O-N 3.45Å; Q303-N307 PolarHBondContact NE2-OD1 3.49Å; Q303-N307 PolarHBondContact O-N 3.45Å; Q303-K331 HydrophobicContact CB-CB 3.76Å; Q303-K331 HydrophobicContact CG-CB 4.39Å
304	H	98.6	Very high	98.2	Very high	122 Å²	122	40.2 Å²	40.2	57%	0.565	22%	0.224	S	C	*	.	H	α-helix	trans	-64.7	-40.8	175.6	-69.6	-53.2	0	0	0	112.5	D300 I301 N302 L306 N307 V308	D300-H304 PolarHBondContact O-CD2 3.05Å; D300-H304 PolarHBondContact O-N 3.24Å; I301-H304 PolarHBondContact O-N 2.82Å; N302-H304 VanDerWaalsContact C-N 3.29Å; N302-H304 PolarHBondContact O-N 2.95Å; H304-L306 VanDerWaalsContact C-N 3.34Å; H304-L306 PolarHBondContact O-N 2.82Å; H304-N307 WeakPolarHBondContact O-CB 3.43Å; H304-N307 PolarHBondContact O-N 3.27Å; H304-V308 WeakPolarHBondContact O-CG2 3.26Å; H304-V308 PolarHBondContact O-N 3.18Å
305	H	98.6	Very high	98.2	Very high	33 Å²	33	37.6 Å²	37.6	15%	0.153	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-39.5	173.5	-74.8	-45.8	0	0	0	112.9	V264 S267 V268 I301 N302 N307 V308 I309	V264-H305 HydrophobicContact CG1-CB 4.28Å; S267-H305 PolarHBondContact OG-NE2 2.69Å; V268-H305 HydrophobicContact CG2-CB 3.72Å; I301-H305 WeakPolarHBondContact CG2-NE2 3.22Å; I301-H305 PolarHBondContact O-CD2 2.9Å; I301-H305 VanDerWaalsContact O-CD2 3.25Å; I301-H305 PolarHBondContact O-N 2.99Å; N302-H305 PolarHBondContact O-N 3.32Å; N302-H305 VanDerWaalsContact O-N 3.17Å; H305-N307 VanDerWaalsContact C-N 3.29Å; H305-N307 PolarHBondContact O-N 2.92Å; H305-V308 CarbonylContact O-C 3.48Å; H305-V308 WeakPolarHBondContact O-CB 3.48Å; H305-V308 PolarHBondContact O-N 3.22Å; H305-V308 VanDerWaalsContact O-N 3.14Å; H305-I309 WeakPolarHBondContact O-CB 3.24Å; H305-I309 WeakPolarHBondContact O-CD1 3.29Å; H305-I309 WeakPolarHBondContact O-CG1 3.36Å; H305-I309 PolarHBondContact O-N 3.43Å
306	L	98.3	Very high	98.2	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-36.5	176.1	-68.9	163.1	0	0	0	111.5	E19 N302 Q303 H304 I309 G310 V311 L332	E19-L306 HydrophobicContact CB-CD2 4.08Å; E19-L306 HydrophobicContact CG-CD2 4.44Å; N302-L306 WeakPolarHBondContact O-CB 3.49Å; N302-L306 WeakPolarHBondContact O-CD1 3.49Å; N302-L306 VanDerWaalsContact O-CG 3.24Å; N302-L306 WeakPolarHBondContact O-CG 3.25Å; N302-L306 PolarHBondContact O-N 3.37Å; Q303-L306 PolarHBondContact O-N 3.45Å; H304-L306 VanDerWaalsContact C-N 3.34Å; H304-L306 PolarHBondContact O-N 2.82Å; L306-I309 HydrophobicContact CD2-CD1 4.43Å; L306-I309 PolarHBondContact O-N 3.35Å; L306-G310 PolarHBondContact O-N 3.38Å; L306-G310 VanDerWaalsContact O-N 3.1Å; L306-V311 HydrophobicContact CB-CG2 3.97Å; L306-V311 HydrophobicContact CD2-CG2 3.89Å; L306-V311 VanDerWaalsContact O-CG2 3.25Å; L306-V311 WeakPolarHBondContact O-CG2 3.47Å; L306-V311 PolarHBondContact O-N 3.43Å; L306-V311 VanDerWaalsContact O-N 3.09Å; L306-L332 HydrophobicContact CB-CD2 4Å; L306-L332 HydrophobicContact CB-CG 4.4Å; L306-L332 HydrophobicContact CD1-CD1 3.76Å; L306-L332 HydrophobicContact CD1-CD2 4.32Å; L306-L332 HydrophobicContact CD1-CG 3.79Å
307	N	98.3	Very high	98.2	Very high	52 Å²	52	40 Å²	40	28%	0.278	23%	0.225	S	C	.	.	H	α-helix	trans	-65.3	-43.5	170.1	-77.9	-4.9	0	0	0	111.7	Q303 H304 H305 I309 G310 G312 D317	Q303-N307 PolarHBondContact NE2-OD1 3.49Å; Q303-N307 PolarHBondContact O-N 3.45Å; H304-N307 WeakPolarHBondContact O-CB 3.43Å; H304-N307 PolarHBondContact O-N 3.27Å; H305-N307 VanDerWaalsContact C-N 3.29Å; H305-N307 PolarHBondContact O-N 2.92Å; N307-I309 VanDerWaalsContact C-N 3.31Å; N307-I309 PolarHBondContact O-N 3.29Å; N307-G310 WeakPolarHBondContact O-CA 3.45Å; N307-G310 PolarHBondContact O-N 3.48Å; N307-G312 WeakPolarHBondContact OD1-CA 3.29Å; N307-D317 PolarHBondContact ND2-OD1 3.48Å
308	V	97.6	Very high	98.2	Very high	69 Å²	69	36.7 Å²	36.7	42%	0.418	21%	0.212	S	C	.	.	H	α-helix	trans	-61.7	-38.3	174	170.7	0	0	0	0	111.7	K253 V264 H304 H305 G310	K253-V308 WeakPolarHBondContact CE-O 3.41Å; K253-V308 PolarHBondContact NZ-O 3.01Å; V264-V308 HydrophobicContact CG1-CG1 4.34Å; V264-V308 HydrophobicContact CG2-CG1 4.01Å; H304-V308 WeakPolarHBondContact O-CG2 3.26Å; H304-V308 PolarHBondContact O-N 3.18Å; H305-V308 CarbonylContact O-C 3.48Å; H305-V308 WeakPolarHBondContact O-CB 3.48Å; H305-V308 PolarHBondContact O-N 3.22Å; H305-V308 VanDerWaalsContact O-N 3.14Å; V308-G310 PolarHBondContact O-N 3.03Å
309	I	96.8	Very high	98.2	Very high	4 Å²	4	36 Å²	36	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-26.9	174.5	-71.4	163	0	0	0	110.6	V250 K253 M261 V264 L265 V268 H305 L306 N307 V311	V250-I309 HydrophobicContact CB-CG2 4.22Å; V250-I309 HydrophobicContact CG1-CG2 3.79Å; V250-I309 HydrophobicContact CG2-CG2 3.41Å; V250-I309 VanDerWaalsContact CG2-CG2 3.41Å; K253-I309 VanDerWaalsContact CD-O 3.22Å; K253-I309 WeakPolarHBondContact CD-O 3.32Å; K253-I309 PolarHBondContact NZ-O 3.38Å; M261-I309 HydrophobicContact CE-CB 4.26Å; M261-I309 HydrophobicContact CE-CG1 3.69Å; V264-I309 HydrophobicContact CG1-CD1 4.25Å; V264-I309 HydrophobicContact CG1-CG1 3.92Å; L265-I309 HydrophobicContact CD2-CD1 4.34Å; V268-I309 HydrophobicContact CG2-CD1 4.44Å; H305-I309 WeakPolarHBondContact O-CB 3.24Å; H305-I309 WeakPolarHBondContact O-CD1 3.29Å; H305-I309 WeakPolarHBondContact O-CG1 3.36Å; H305-I309 PolarHBondContact O-N 3.43Å; L306-I309 HydrophobicContact CD2-CD1 4.43Å; L306-I309 PolarHBondContact O-N 3.35Å; N307-I309 VanDerWaalsContact C-N 3.31Å; N307-I309 PolarHBondContact O-N 3.29Å; I309-V311 HydrophobicContact CG2-CG1 4.15Å; I309-V311 HydrophobicContact CG2-CG2 4.23Å
310	G	96.6	Very high	98.2	Very high	40 Å²	40	37 Å²	37	41%	0.412	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	94	24.4	176.8	0	0	0	0	0	113.3	L306 N307 V308	L306-G310 PolarHBondContact O-N 3.38Å; L306-G310 VanDerWaalsContact O-N 3.1Å; N307-G310 WeakPolarHBondContact O-CA 3.45Å; N307-G310 PolarHBondContact O-N 3.48Å; V308-G310 PolarHBondContact O-N 3.03Å
311	V	97.5	Very high	98.2	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	24%	0.235	C	C	.	.			trans	-106.6	11.2	175.1	-62.3	0	0	0	0	112.2	L246 V250 L306 I309 G336 G337	L246-V311 HydrophobicContact CB-CG1 4.45Å; L246-V311 HydrophobicContact CD2-CG1 4.36Å; V250-V311 HydrophobicContact CG2-CG1 3.4Å; L306-V311 HydrophobicContact CB-CG2 3.97Å; L306-V311 HydrophobicContact CD2-CG2 3.89Å; L306-V311 VanDerWaalsContact O-CG2 3.25Å; L306-V311 WeakPolarHBondContact O-CG2 3.47Å; L306-V311 PolarHBondContact O-N 3.43Å; L306-V311 VanDerWaalsContact O-N 3.09Å; I309-V311 HydrophobicContact CG2-CG1 4.15Å; I309-V311 HydrophobicContact CG2-CG2 4.23Å; V311-G336 CarbonylContact O-C 3.42Å; V311-G336 WeakPolarHBondContact O-CA 3.32Å; V311-G337 PolarHBondContact O-N 3.32Å
312	G	96.9	Very high	98.2	Very high	24 Å²	24	39.3 Å²	39.3	25%	0.247	23%	0.226	C	C	.	.			trans	-65.6	174.6	168	0	0	0	0	0	113.5	N307	N307-G312 WeakPolarHBondContact OD1-CA 3.29Å
313	H	98.2	Very high	98.1	Very high	61 Å²	61	39.3 Å²	39.3	28%	0.282	23%	0.226	S	C	.	.			trans	-161.3	146	173.4	-171.3	-94.5	0	0	0	109.8	S315 L316 D317	H313-S315 PolarHBondContact ND1-N 3.39Å; H313-S315 VanDerWaalsContact ND1-N 3.17Å; H313-S315 PolarHBondContact ND1-OG 3.27Å; H313-S315 PolarHBondContact O-N 3.47Å; H313-L316 HydrophobicContact CB-CD1 4.01Å; H313-L316 HydrophobicContact CB-CG 4.29Å; H313-L316 WeakPolarHBondContact O-CA 3.46Å; H313-L316 WeakPolarHBondContact O-CB 3.47Å; H313-L316 PolarHBondContact O-N 3.3Å; H313-D317 PolarHBondContact O-N 3.28Å
314	P	98.3	Very high	98.1	Very high	87 Å²	87	42 Å²	42	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-53.3	-33.8	180	-30.4	36.4	0	0	0	115	D317 T318	P314-D317 PolarHBondContact O-N 2.94Å; P314-T318 WeakPolarHBondContact O-CB 3.33Å; P314-T318 PolarHBondContact O-N 2.84Å; P314-T318 PolarHBondContact O-OG1 3.45Å
315	S	98.3	Very high	98.1	Very high	9 Å²	9	40.4 Å²	40.4	6%	0.063	26%	0.257	C	S	.	.	H	α-helix	trans	-67.9	-33.5	175.1	63.3	0	0	0	0	113.4	H313 L319 Y366	H313-S315 PolarHBondContact ND1-N 3.39Å; H313-S315 VanDerWaalsContact ND1-N 3.17Å; H313-S315 PolarHBondContact ND1-OG 3.27Å; H313-S315 PolarHBondContact O-N 3.47Å; S315-L319 WeakPolarHBondContact O-CB 3.31Å; S315-L319 PolarHBondContact O-N 2.76Å; S315-Y366 WeakPolarHBondContact CA-OH 3.36Å; S315-Y366 WeakPolarHBondContact CB-OH 3.38Å; S315-Y366 PolarHBondContact O-OH 3.37Å
316	L	98.4	Very high	98	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-74.9	-36.6	175.2	-66.5	167.5	0	0	0	110.8	T237 H313 T318 L319 C320 L332	T237-L316 HydrophobicContact CG2-CD2 4.04Å; H313-L316 HydrophobicContact CB-CD1 4.01Å; H313-L316 HydrophobicContact CB-CG 4.29Å; H313-L316 WeakPolarHBondContact O-CA 3.46Å; H313-L316 WeakPolarHBondContact O-CB 3.47Å; H313-L316 PolarHBondContact O-N 3.3Å; L316-T318 VanDerWaalsContact C-N 3.34Å; L316-L319 HydrophobicContact CD2-CD1 4.47Å; L316-L319 WeakPolarHBondContact O-CB 3.47Å; L316-L319 PolarHBondContact O-N 3.06Å; L316-C320 PolarHBondContact O-N 3.39Å; L316-C320 PolarHBondContact O-SG 3.16Å; L316-L332 HydrophobicContact CD1-CB 3.68Å; L316-L332 HydrophobicContact CD1-CD2 3.76Å; L316-L332 HydrophobicContact CD1-CG 4.37Å; L316-L332 HydrophobicContact CD2-CB 3.83Å; L316-L332 HydrophobicContact CG-CB 4.27Å
317	D	98.5	Very high	97.9	Very high	67 Å²	67	45.7 Å²	45.7	36%	0.358	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-41.4	173.1	-59.4	-41.8	0	0	0	110.6	N307 H313 P314 C320 Q321	N307-D317 PolarHBondContact ND2-OD1 3.48Å; H313-D317 PolarHBondContact O-N 3.28Å; P314-D317 PolarHBondContact O-N 2.94Å; D317-C320 PolarHBondContact O-N 2.93Å; D317-Q321 WeakPolarHBondContact O-CB 3.35Å; D317-Q321 PolarHBondContact O-N 3.44Å
318	T	98.6	Very high	97.9	Very high	50 Å²	50	43.5 Å²	43.5	31%	0.307	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-45.6	173.8	-57.3	0	0	0	0	111.3	P314 L316 C320 Q321 V322	P314-T318 WeakPolarHBondContact O-CB 3.33Å; P314-T318 PolarHBondContact O-N 2.84Å; P314-T318 PolarHBondContact O-OG1 3.45Å; L316-T318 VanDerWaalsContact C-N 3.34Å; T318-C320 PolarHBondContact O-N 3.29Å; T318-Q321 PolarHBondContact O-N 2.9Å; T318-V322 HydrophobicContact CG2-CG2 4.39Å; T318-V322 WeakPolarHBondContact O-CG2 3.35Å; T318-V322 PolarHBondContact O-N 3.34Å
319	L	98.6	Very high	98	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-54	-52.8	174	178.7	173.3	0	0	0	110.6	T235 T237 S315 L316 Q321 V322 T323 S330 L361 Y366	T235-L319 HydrophobicContact CG2-CD1 3.75Å; T235-L319 HydrophobicContact CG2-CG 4.18Å; T237-L319 HydrophobicContact CG2-CD1 4.37Å; S315-L319 WeakPolarHBondContact O-CB 3.31Å; S315-L319 PolarHBondContact O-N 2.76Å; L316-L319 HydrophobicContact CD2-CD1 4.47Å; L316-L319 WeakPolarHBondContact O-CB 3.47Å; L316-L319 PolarHBondContact O-N 3.06Å; L319-Q321 VanDerWaalsContact C-N 3.3Å; L319-Q321 PolarHBondContact O-N 3.06Å; L319-V322 PolarHBondContact O-N 2.83Å; L319-T323 HydrophobicContact CD2-CG2 4.25Å; L319-T323 WeakPolarHBondContact O-CG2 3.41Å; L319-T323 PolarHBondContact O-N 2.98Å; L319-T323 VanDerWaalsContact O-N 3.08Å; L319-T323 PolarHBondContact O-OG1 3.03Å; L319-S330 VanDerWaalsContact CD2-CB 3.48Å; L319-L361 HydrophobicContact CB-CD2 4.47Å; L319-L361 HydrophobicContact CG-CD2 4.23Å; L319-Y366 HydrophobicContact CB-CE2 4.43Å
320	C	98.6	Very high	98.1	Very high	26 Å²	26	42.7 Å²	42.7	18%	0.176	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-37.7	-178.7	-60.3	0	0	0	0	111.8	L316 D317 T318 T323 A324	L316-C320 PolarHBondContact O-N 3.39Å; L316-C320 PolarHBondContact O-SG 3.16Å; D317-C320 PolarHBondContact O-N 2.93Å; T318-C320 PolarHBondContact O-N 3.29Å; C320-T323 PolarHBondContact O-OG1 2.74Å; C320-T323 VanDerWaalsContact O-OG1 3.07Å; C320-A324 WeakPolarHBondContact O-CB 3.39Å; C320-A324 PolarHBondContact O-N 3.32Å
321	Q	98.6	Very high	98.2	Very high	145 Å²	145	40.8 Å²	40.8	68%	0.678	25%	0.252	S	S	*	.	H	α-helix	trans	-64.2	-45.5	176.8	-175.9	-179	-5.3	0	0	112.2	D317 T318 L319 A324 A325	D317-Q321 WeakPolarHBondContact O-CB 3.35Å; D317-Q321 PolarHBondContact O-N 3.44Å; T318-Q321 PolarHBondContact O-N 2.9Å; L319-Q321 VanDerWaalsContact C-N 3.3Å; L319-Q321 PolarHBondContact O-N 3.06Å; Q321-A324 PolarHBondContact O-N 3.48Å; Q321-A325 PolarHBondContact O-N 3.15Å
322	V	98.4	Very high	98.2	Very high	27 Å²	27	40.7 Å²	40.7	16%	0.164	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-42.6	179.2	169.2	0	0	0	0	111	T318 L319 D360 L361	T318-V322 HydrophobicContact CG2-CG2 4.39Å; T318-V322 WeakPolarHBondContact O-CG2 3.35Å; T318-V322 PolarHBondContact O-N 3.34Å; L319-V322 PolarHBondContact O-N 2.83Å; V322-D360 HydrophobicContact CG1-CB 3.64Å; V322-L361 HydrophobicContact CB-CD2 4Å; V322-L361 HydrophobicContact CG1-CD2 3.81Å; V322-L361 HydrophobicContact CG1-CG 3.96Å
323	T	98.4	Very high	98.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-71.1	-40.9	179.4	62.5	0	0	0	0	111.5	L319 C320 A325 R326 G327 L328 S330 T343 T357 L361	L319-T323 HydrophobicContact CD2-CG2 4.25Å; L319-T323 WeakPolarHBondContact O-CG2 3.41Å; L319-T323 PolarHBondContact O-N 2.98Å; L319-T323 VanDerWaalsContact O-N 3.08Å; L319-T323 PolarHBondContact O-OG1 3.03Å; C320-T323 PolarHBondContact O-OG1 2.74Å; C320-T323 VanDerWaalsContact O-OG1 3.07Å; T323-A325 VanDerWaalsContact C-N 3.27Å; T323-A325 PolarHBondContact O-N 3.43Å; T323-R326 CarbonylContact O-C 3.42Å; T323-R326 PolarHBondContact O-N 2.6Å; T323-G327 PolarHBondContact O-N 3.29Å; T323-L328 CarbonylContact C-O 3.57Å; T323-L328 WeakPolarHBondContact CB-O 3.4Å; T323-L328 WeakPolarHBondContact O-CB 3.22Å; T323-L328 PolarHBondContact O-N 3Å; T323-L328 PolarHBondContact OG1-O 3.42Å; T323-S330 VanDerWaalsContact CB-OG 3.28Å; T323-S330 WeakPolarHBondContact CB-OG 3.18Å; T323-S330 WeakPolarHBondContact CG2-OG 3.27Å; T323-S330 WeakPolarHBondContact OG1-CB 3.48Å; T323-S330 PolarHBondContact OG1-OG 2.98Å; T323-T343 HydrophobicContact CG2-CG2 3.96Å; T323-T357 HydrophobicContact CG2-CG2 3.87Å; T323-L361 HydrophobicContact CG2-CD1 4.27Å
324	A	98.1	Very high	97.9	Very high	63 Å²	63	37.6 Å²	37.6	52%	0.521	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-32.5	178.8	0	0	0	0	0	112.4	C320 Q321 R326 G327 L328	C320-A324 WeakPolarHBondContact O-CB 3.39Å; C320-A324 PolarHBondContact O-N 3.32Å; Q321-A324 PolarHBondContact O-N 3.48Å; A324-R326 PolarHBondContact O-N 3.21Å; A324-G327 PolarHBondContact O-N 2.97Å; A324-L328 WeakPolarHBondContact CA-O 3.44Å; A324-L328 PolarHBondContact N-O 3.1Å
325	A	97.7	Very high	97.6	Very high	89 Å²	89	33.9 Å²	33.9	74%	0.736	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-16.5	173.9	0	0	0	0	0	113.6	Q321 T323	Q321-A325 PolarHBondContact O-N 3.15Å; T323-A325 VanDerWaalsContact C-N 3.27Å; T323-A325 PolarHBondContact O-N 3.43Å
326	R	96.5	Very high	97.4	Very high	93 Å²	93	33.4 Å²	33.4	35%	0.351	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112	13.5	175.7	-65.9	177.5	173.4	-89.5	1.9	112.9	T323 A324 L328 T353 G356 T357 D360	T323-R326 CarbonylContact O-C 3.42Å; T323-R326 PolarHBondContact O-N 2.6Å; A324-R326 PolarHBondContact O-N 3.21Å; R326-L328 VanDerWaalsContact C-N 3.31Å; R326-L328 HydrophobicContact CB-CG 4.49Å; R326-T353 HydrophobicContact CB-CG2 4.29Å; R326-G356 VanDerWaalsContact CZ-C 3.41Å; R326-T357 WeakPolarHBondContact CD-OG1 3.48Å; R326-D360 IonicContact CZ-OD2 3.92Å; R326-D360 IonicContact NE-OD2 3.24Å; R326-D360 PolarHBondContact NE-OD2 3.01Å; R326-D360 IonicContact NH2-OD1 3.69Å; R326-D360 IonicContact NH2-OD2 3.94Å; R326-D360 PolarHBondContact NH2-OD2 2.97Å
327	G	97.1	Very high	97.3	Very high	51 Å²	51	34 Å²	34	53%	0.526	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	22.4	-178.3	0	0	0	0	0	114.1	T323 A324	T323-G327 PolarHBondContact O-N 3.29Å; A324-G327 PolarHBondContact O-N 2.97Å
328	L	98.4	Very high	97.1	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.037	20%	0.198	C	C	.	.			trans	-107.3	135.5	-179.7	-59.1	176.6	0	0	0	111.3	T323 A324 R326 T343 L345 T349 T353 T357	T323-L328 CarbonylContact C-O 3.57Å; T323-L328 WeakPolarHBondContact CB-O 3.4Å; T323-L328 WeakPolarHBondContact O-CB 3.22Å; T323-L328 PolarHBondContact O-N 3Å; T323-L328 PolarHBondContact OG1-O 3.42Å; A324-L328 WeakPolarHBondContact CA-O 3.44Å; A324-L328 PolarHBondContact N-O 3.1Å; R326-L328 VanDerWaalsContact C-N 3.31Å; R326-L328 HydrophobicContact CB-CG 4.49Å; L328-T343 HydrophobicContact CB-CG2 3.67Å; L328-T343 HydrophobicContact CD1-CG2 4.27Å; L328-L345 HydrophobicContact CD1-CD2 4.06Å; L328-L345 HydrophobicContact CD2-CD2 4.07Å; L328-T349 HydrophobicContact CD2-CG2 4.02Å; L328-T353 HydrophobicContact CD1-CG2 4.47Å; L328-T357 HydrophobicContact CD1-CG2 4.01Å; L328-T357 WeakPolarHBondContact CD1-OG1 3.35Å
329	H	98.7	Very high	96.9	Very high	51 Å²	51	28.6 Å²	28.6	24%	0.236	19%	0.185	C	C	.	.			trans	-98.5	132	-174.1	-64.2	-97.2	0	0	0	111.1	E296 I299 D300 T343 L344	E296-H329 HydrophobicContact CB-CB 3.93Å; E296-H329 HydrophobicContact CG-CB 3.93Å; E296-H329 IonicContact OE1-CD2 3.41Å; E296-H329 IonicContact OE2-CD2 3.58Å; E296-H329 PolarHBondContact OE2-CD2 2.96Å; E296-H329 VanDerWaalsContact OE2-CD2 3.24Å; E296-H329 IonicContact OE2-NE2 2.72Å; E296-H329 PolarHBondContact OE2-NE2 2.94Å; I299-H329 HydrophobicContact CG2-CB 4.19Å; D300-H329 IonicContact OD1-CG 3.68Å; D300-H329 IonicContact OD1-ND1 3.52Å; D300-H329 PolarHBondContact OD1-ND1 3.4Å; D300-H329 VanDerWaalsContact OD1-ND1 3.15Å; D300-H329 IonicContact OD2-CE1 3.56Å; D300-H329 PolarHBondContact OD2-CE1 3.4Å; D300-H329 VanDerWaalsContact OD2-CE1 3.25Å; D300-H329 IonicContact OD2-CG 2.8Å; D300-H329 IonicContact OD2-ND1 3.55Å; D300-H329 PolarHBondContact OD2-ND1 3.4Å; H329-T343 WeakPolarHBondContact O-CA 3.46Å; H329-L344 PolarHBondContact O-N 3.46Å
330	S	98.8	Very high	96.8	Very high	4 Å²	4	28.6 Å²	28.6	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	152.1	-171.5	-60.6	0	0	0	0	112.9	I299 L319 T323 I342 T343	I299-S330 VanDerWaalsContact CG2-C 3.44Å; L319-S330 VanDerWaalsContact CD2-CB 3.48Å; T323-S330 VanDerWaalsContact CB-OG 3.28Å; T323-S330 WeakPolarHBondContact CB-OG 3.18Å; T323-S330 WeakPolarHBondContact CG2-OG 3.27Å; T323-S330 WeakPolarHBondContact OG1-CB 3.48Å; T323-S330 PolarHBondContact OG1-OG 2.98Å; S330-I342 CarbonylContact C-O 3.53Å; S330-I342 WeakPolarHBondContact CA-O 3.39Å; S330-T343 VanDerWaalsContact OG-CB 3.3Å; S330-T343 WeakPolarHBondContact OG-CB 3.49Å; S330-T343 VanDerWaalsContact OG-CG2 3.27Å; S330-T343 WeakPolarHBondContact OG-CG2 3.16Å; S330-T343 PolarHBondContact OG-OG1 2.91Å
331	K	98.7	Very high	96.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	159.5	169.5	62.2	177.6	-72.1	-67.1	0	111.9	L16 E19 I299 Q303 G341 I342	L16-K331 VanDerWaalsContact O-CE 3.29Å; L16-K331 WeakPolarHBondContact O-CE 3.35Å; L16-K331 PolarHBondContact O-NZ 3.14Å; E19-K331 IonicContact OE1-NZ 3.83Å; E19-K331 PolarHBondContact OE1-NZ 2.86Å; E19-K331 IonicContact OE2-NZ 3.78Å; I299-K331 HydrophobicContact CB-CD 4.29Å; I299-K331 HydrophobicContact CG1-CD 4.07Å; I299-K331 HydrophobicContact CG1-CG 4.42Å; I299-K331 HydrophobicContact CG2-CB 3.98Å; I299-K331 HydrophobicContact CG2-CD 4.2Å; I299-K331 HydrophobicContact CG2-CG 3.92Å; Q303-K331 HydrophobicContact CB-CB 3.76Å; Q303-K331 HydrophobicContact CG-CB 4.39Å; K331-G341 CarbonylContact O-C 3.55Å; K331-G341 WeakPolarHBondContact O-CA 3.45Å; K331-I342 HydrophobicContact CD-CD1 4.42Å; K331-I342 HydrophobicContact CG-CD1 4.03Å; K331-I342 HydrophobicContact CG-CG1 3.71Å; K331-I342 PolarHBondContact N-O 3.27Å; K331-I342 PolarHBondContact O-N 3.22Å
332	L	98	Very high	96.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	156.4	169	73.4	81.9	0	0	0	111	E19 L306 L316	E19-L332 HydrophobicContact CG-CD1 4.43Å; L306-L332 HydrophobicContact CB-CD2 4Å; L306-L332 HydrophobicContact CB-CG 4.4Å; L306-L332 HydrophobicContact CD1-CD1 3.76Å; L306-L332 HydrophobicContact CD1-CD2 4.32Å; L306-L332 HydrophobicContact CD1-CG 3.79Å; L316-L332 HydrophobicContact CD1-CB 3.68Å; L316-L332 HydrophobicContact CD1-CD2 3.76Å; L316-L332 HydrophobicContact CD1-CG 4.37Å; L316-L332 HydrophobicContact CD2-CB 3.83Å; L316-L332 HydrophobicContact CG-CB 4.27Å
333	T	96.6	Very high	96.8	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139	171.2	-171.4	0	0	0	0	111.7	I15 L143 C340 I342	I15-T333 PolarHBondContact N-OG1 2.76Å; I15-T333 PolarHBondContact O-OG1 3.46Å; L143-T333 HydrophobicContact CD2-CG2 4.38Å; T333-C340 HydrophobicContact CG2-CB 3.93Å; T333-C340 PolarHBondContact N-O 3.35Å; T333-I342 HydrophobicContact CG2-CG2 3.97Å
334	G	92.8	Very high	96.8	Very high	17 Å²	17	19.5 Å²	19.5	18%	0.175	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	-136.1	-176.3	0	0	0	0	0	113.1	E19 G336	E19-G334 WeakPolarHBondContact CG-O 3.43Å; G334-G336 VanDerWaalsContact C-N 3.29Å; G334-G336 PolarHBondContact O-N 2.94Å
335	A	92.2	Very high	96.8	Very high	9 Å²	9	16.5 Å²	16.5	7%	0.074	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-19	-166.3	0	0	0	0	0	115.7	H20 T243 L246	H20-A335 PolarHBondContact CE1-O 3.35Å; H20-A335 PolarHBondContact NE2-O 3.25Å; T243-A335 HydrophobicContact CG2-CB 3.85Å; L246-A335 HydrophobicContact CD1-CB 4.06Å; L246-A335 WeakPolarHBondContact CD1-O 3.15Å
336	G	94.3	Very high	96.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.087	C	C	.	.			trans	73.5	-161	-168.5	0	0	0	0	0	113.4	R241 L246 V311 G334 G338	R241-G336 WeakPolarHBondContact CD-O 3.46Å; R241-G336 PolarHBondContact NH1-O 3.33Å; R241-G336 VanDerWaalsContact NH1-O 3.14Å; L246-G336 VanDerWaalsContact CD1-O 3.28Å; L246-G336 WeakPolarHBondContact CD1-O 3.28Å; V311-G336 CarbonylContact O-C 3.42Å; V311-G336 WeakPolarHBondContact O-CA 3.32Å; G334-G336 VanDerWaalsContact C-N 3.29Å; G334-G336 PolarHBondContact O-N 2.94Å; G336-G338 VanDerWaalsContact C-N 3.26Å; G336-G338 PolarHBondContact O-N 3.05Å
337	G	95	Very high	96.6	Very high	13 Å²	13	13.9 Å²	13.9	13%	0.134	9%	0.094	C	C	.	.	S	Bend	trans	66.6	21.2	177.9	0	0	0	0	0	114.9	V311	V311-G337 PolarHBondContact O-N 3.32Å
338	G	94.3	Very high	96.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	119.8	-144.2	-164.7	0	0	0	0	0	110.5	G336	G336-G338 VanDerWaalsContact C-N 3.26Å; G336-G338 PolarHBondContact O-N 3.05Å
339	G	94.3	Very high	96.2	Very high	3 Å²	3	17.8 Å²	17.8	3%	0.031	10%	0.1	C	C	.	.	S	Bend	trans	63.8	-136.3	-178.8	0	0	0	0	0	112.5	T237 V239	T237-G339 WeakPolarHBondContact CB-O 3.41Å; T237-G339 WeakPolarHBondContact CG2-O 3.4Å; T237-G339 PolarHBondContact N-O 2.93Å; T237-G339 PolarHBondContact OG1-N 3.46Å; T237-G339 PolarHBondContact OG1-O 2.97Å; V239-G339 PolarHBondContact O-N 3.03Å
340	C	97.1	Very high	96.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	154.9	-173.8	-59	0	0	0	0	114.6	L143 L234 T235 T333	L143-C340 HydrophobicContact CD2-CB 4.33Å; L234-C340 HydrophobicContact CD1-CB 4.14Å; T235-C340 CarbonylContact O-C 3.6Å; T235-C340 WeakPolarHBondContact O-CA 3.31Å; T235-C340 WeakPolarHBondContact O-CB 3.44Å; T333-C340 HydrophobicContact CG2-CB 3.93Å; T333-C340 PolarHBondContact N-O 3.35Å
341	G	98	Very high	95.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	160	163.4	0	0	0	0	0	112	T235 K331	T235-G341 PolarHBondContact N-O 2.87Å; T235-G341 PolarHBondContact O-N 2.8Å; K331-G341 CarbonylContact O-C 3.55Å; K331-G341 WeakPolarHBondContact O-CA 3.45Å
342	I	98.4	Very high	95.8	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	139.2	174.4	58.6	175	0	0	0	109	A14 L16 I232 L233 L234 S330 K331 T333	A14-I342 HydrophobicContact CB-CG2 4.47Å; L16-I342 HydrophobicContact CD1-CD1 3.77Å; I232-I342 HydrophobicContact CD1-CB 4.43Å; I232-I342 HydrophobicContact CD1-CG2 4.04Å; L233-I342 CarbonylContact O-C 3.53Å; L233-I342 WeakPolarHBondContact O-CA 3.45Å; L234-I342 HydrophobicContact CD1-CG2 4.38Å; S330-I342 CarbonylContact C-O 3.53Å; S330-I342 WeakPolarHBondContact CA-O 3.39Å; K331-I342 HydrophobicContact CD-CD1 4.42Å; K331-I342 HydrophobicContact CG-CD1 4.03Å; K331-I342 HydrophobicContact CG-CG1 3.71Å; K331-I342 PolarHBondContact N-O 3.27Å; K331-I342 PolarHBondContact O-N 3.22Å; T333-I342 HydrophobicContact CG2-CG2 3.97Å
343	T	98.8	Very high	95.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.9	174.1	-52.5	0	0	0	0	108.1	I232 L233 T323 L328 H329 S330	I232-T343 CarbonylContact C-O 3.57Å; I232-T343 WeakPolarHBondContact CA-O 3.2Å; I232-T343 VanDerWaalsContact CB-O 3.26Å; I232-T343 WeakPolarHBondContact CB-O 3.42Å; L233-T343 PolarHBondContact N-O 3.42Å; L233-T343 PolarHBondContact O-N 3.18Å; T323-T343 HydrophobicContact CG2-CG2 3.96Å; L328-T343 HydrophobicContact CB-CG2 3.67Å; L328-T343 HydrophobicContact CD1-CG2 4.27Å; H329-T343 WeakPolarHBondContact O-CA 3.46Å; S330-T343 VanDerWaalsContact OG-CB 3.3Å; S330-T343 WeakPolarHBondContact OG-CB 3.49Å; S330-T343 VanDerWaalsContact OG-CG2 3.27Å; S330-T343 WeakPolarHBondContact OG-CG2 3.16Å; S330-T343 PolarHBondContact OG-OG1 2.91Å
344	L	98.6	Very high	95.9	Very high	6 Å²	6	29.1 Å²	29.1	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	136.4	179	-174.9	61.1	0	0	0	110.3	L230 I232 Y292 L295 E296 I299 H329	L230-L344 HydrophobicContact CB-CD1 4.19Å; L230-L344 HydrophobicContact CD1-CD1 4.37Å; I232-L344 HydrophobicContact CG2-CD1 4.39Å; Y292-L344 HydrophobicContact CD1-CD2 3.94Å; Y292-L344 HydrophobicContact CD1-CG 4.29Å; Y292-L344 HydrophobicContact CE1-CD1 4.23Å; Y292-L344 HydrophobicContact CE1-CD2 4.33Å; Y292-L344 HydrophobicContact CE1-CG 4.34Å; L295-L344 HydrophobicContact CB-CD2 3.77Å; L295-L344 HydrophobicContact CD1-CD2 4.4Å; E296-L344 HydrophobicContact CG-CD2 3.93Å; I299-L344 HydrophobicContact CD1-CB 3.65Å; I299-L344 HydrophobicContact CD1-CD2 4.01Å; I299-L344 HydrophobicContact CD1-CG 4.42Å; H329-L344 PolarHBondContact O-N 3.46Å
345	L	98.2	Very high	96.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.6	173.7	-59.7	-179.8	0	0	0	109.1	R231 L233 L328 T349 V354 E370	R231-L345 HydrophobicContact CB-CB 3.9Å; R231-L345 HydrophobicContact CB-CD1 4.43Å; R231-L345 WeakPolarHBondContact O-CB 3.32Å; R231-L345 PolarHBondContact O-N 3.18Å; L233-L345 HydrophobicContact CD1-CD2 4.44Å; L233-L345 HydrophobicContact CD2-CD1 4.14Å; L233-L345 HydrophobicContact CG-CD1 4.1Å; L233-L345 HydrophobicContact CG-CD2 4.13Å; L233-L345 HydrophobicContact CG-CG 4.34Å; L328-L345 HydrophobicContact CD1-CD2 4.06Å; L328-L345 HydrophobicContact CD2-CD2 4.07Å; L345-T349 HydrophobicContact CD2-CG2 4.36Å; L345-V354 HydrophobicContact CD1-CG1 4.32Å; L345-V354 HydrophobicContact CD1-CG2 4.04Å; L345-V354 HydrophobicContact CD2-CG2 4.17Å; L345-E370 HydrophobicContact CD1-CG 4.19Å
346	R	96.4	Very high	96.4	Very high	48 Å²	48	32.8 Å²	32.8	18%	0.181	19%	0.189	C	C	.	.			trans	-68.8	154.2	172.6	-54.2	-169.5	176.9	-146	-1.2	111.5	Y292 N293 E296 E348 T349	Y292-R346 HydrophobicContact CD1-CB 4.3Å; Y292-R346 HydrophobicContact CD1-CG 3.92Å; Y292-R346 HydrophobicContact CG-CG 4.29Å; N293-R346 PolarHBondContact OD1-NH1 3.23Å; N293-R346 PolarHBondContact OD1-NH2 2.9Å; E296-R346 VanDerWaalsContact CD-NE 3.29Å; E296-R346 VanDerWaalsContact OE1-CG 3.27Å; E296-R346 WeakPolarHBondContact OE1-CG 3.42Å; E296-R346 IonicContact OE1-CZ 2.7Å; E296-R346 IonicContact OE1-NE 3.15Å; E296-R346 PolarHBondContact OE1-NE 3.25Å; E296-R346 IonicContact OE1-NH2 3.25Å; E296-R346 IonicContact OE2-CZ 3.24Å; E296-R346 IonicContact OE2-NE 2.82Å; E296-R346 PolarHBondContact OE2-NE 2.7Å; E296-R346 IonicContact OE2-NH2 3.33Å; E296-R346 PolarHBondContact OE2-NH2 3.15Å; R346-E348 VanDerWaalsContact CB-CD 3.47Å; R346-E348 HydrophobicContact CB-CG 4.12Å; R346-E348 WeakPolarHBondContact CB-OE2 3.46Å; R346-E348 WeakPolarHBondContact CD-OE1 3.49Å; R346-E348 IonicContact NH1-OE1 2.63Å; R346-E348 PolarHBondContact O-N 3.29Å; R346-T349 PolarHBondContact N-OG1 3.42Å; R346-T349 VanDerWaalsContact O-CB 3.3Å; R346-T349 WeakPolarHBondContact O-CB 3.38Å; R346-T349 PolarHBondContact O-N 3Å; R346-T349 PolarHBondContact O-OG1 3.32Å
347	P	93.7	Very high	96.6	Very high	78 Å²	78	32.8 Å²	32.8	51%	0.506	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-37.3	176.3	-27.5	36.1	0	0	0	113.6	Y292 T349	Y292-P347 HydrophobicContact CE2-CG 3.88Å; Y292-P347 VanDerWaalsContact CZ-CD 3.43Å; P347-T349 VanDerWaalsContact C-N 3.3Å; P347-T349 PolarHBondContact O-N 3.09Å
348	E	93.3	Very high	96.7	Very high	121 Å²	121	32.5 Å²	32.5	57%	0.565	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-7.2	179.1	63.4	-89.7	-155.3	0	0	114.6	R346 D350	R346-E348 VanDerWaalsContact CB-CD 3.47Å; R346-E348 HydrophobicContact CB-CG 4.12Å; R346-E348 WeakPolarHBondContact CB-OE2 3.46Å; R346-E348 WeakPolarHBondContact CD-OE1 3.49Å; R346-E348 IonicContact NH1-OE1 2.63Å; R346-E348 PolarHBondContact O-N 3.29Å; E348-D350 PolarHBondContact O-N 2.78Å; E348-D350 VanDerWaalsContact O-N 3.15Å
349	T	95.1	Very high	96.9	Very high	20 Å²	20	38.5 Å²	38.5	12%	0.123	21%	0.21	C	C	.	.			trans	-67	115.9	179.8	-45.5	0	0	0	0	109.8	L328 L345 R346 P347 T353 V354	L328-T349 HydrophobicContact CD2-CG2 4.02Å; L345-T349 HydrophobicContact CD2-CG2 4.36Å; R346-T349 PolarHBondContact N-OG1 3.42Å; R346-T349 VanDerWaalsContact O-CB 3.3Å; R346-T349 WeakPolarHBondContact O-CB 3.38Å; R346-T349 PolarHBondContact O-N 3Å; R346-T349 PolarHBondContact O-OG1 3.32Å; P347-T349 VanDerWaalsContact C-N 3.3Å; P347-T349 PolarHBondContact O-N 3.09Å; T349-T353 HydrophobicContact CG2-CG2 4.15Å; T349-V354 HydrophobicContact CG2-CG2 3.85Å
350	D	95.1	Very high	97.1	Very high	71 Å²	71	40.9 Å²	40.9	38%	0.38	22%	0.222	S	C	.	.			trans	-73.8	156.2	-176.3	76.5	81.7	0	0	0	112.5	E348 T352 T353 V354	E348-D350 PolarHBondContact O-N 2.78Å; E348-D350 VanDerWaalsContact O-N 3.15Å; D350-T352 VanDerWaalsContact C-N 3.27Å; D350-T352 PolarHBondContact O-N 2.98Å; D350-T352 VanDerWaalsContact OD1-CA 3.26Å; D350-T352 WeakPolarHBondContact OD1-CA 3.17Å; D350-T352 VanDerWaalsContact OD1-CB 3.27Å; D350-T352 WeakPolarHBondContact OD1-CB 3.43Å; D350-T352 PolarHBondContact OD1-N 3.37Å; D350-T352 PolarHBondContact OD1-OG1 3.04Å; D350-T353 PolarHBondContact O-N 3.48Å; D350-T353 PolarHBondContact OD1-N 3.2Å; D350-T353 WeakPolarHBondContact OD2-CB 3.33Å; D350-T353 PolarHBondContact OD2-OG1 3.3Å; D350-V354 WeakPolarHBondContact O-CG2 3.46Å; D350-V354 PolarHBondContact O-N 3.16Å; D350-V354 VanDerWaalsContact O-N 3.15Å
351	S	95.7	Very high	97.2	Very high	81 Å²	81	40.9 Å²	40.9	57%	0.566	22%	0.222	S	C	*	.	H	α-helix	trans	-63.4	-30.2	-177.8	-173.5	0	0	0	0	113.2	V354 Q355	S351-V354 PolarHBondContact O-N 2.93Å; S351-Q355 WeakPolarHBondContact O-CB 3.34Å; S351-Q355 VanDerWaalsContact O-CG 3.25Å; S351-Q355 WeakPolarHBondContact O-CG 3.47Å; S351-Q355 PolarHBondContact O-N 3.46Å
352	T	96.8	Very high	97.2	Very high	110 Å²	110	46.6 Å²	46.6	68%	0.675	24%	0.244	S	C	*	.	H	α-helix	trans	-70.3	-38.7	179.7	73.7	0	0	0	0	111.7	D350 G356	D350-T352 VanDerWaalsContact C-N 3.27Å; D350-T352 PolarHBondContact O-N 2.98Å; D350-T352 VanDerWaalsContact OD1-CA 3.26Å; D350-T352 WeakPolarHBondContact OD1-CA 3.17Å; D350-T352 VanDerWaalsContact OD1-CB 3.27Å; D350-T352 WeakPolarHBondContact OD1-CB 3.43Å; D350-T352 PolarHBondContact OD1-N 3.37Å; D350-T352 PolarHBondContact OD1-OG1 3.04Å; T352-G356 PolarHBondContact O-N 3.32Å
353	T	97.4	Very high	97.1	Very high	32 Å²	32	52.1 Å²	52.1	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-62.5	-49.4	172.3	-63.9	0	0	0	0	110.2	R326 L328 T349 D350 G356 T357	R326-T353 HydrophobicContact CB-CG2 4.29Å; L328-T353 HydrophobicContact CD1-CG2 4.47Å; T349-T353 HydrophobicContact CG2-CG2 4.15Å; D350-T353 PolarHBondContact O-N 3.48Å; D350-T353 PolarHBondContact OD1-N 3.2Å; D350-T353 WeakPolarHBondContact OD2-CB 3.33Å; D350-T353 PolarHBondContact OD2-OG1 3.3Å; T353-G356 PolarHBondContact O-N 3.02Å; T353-T357 PolarHBondContact O-N 3.48Å; T353-T357 PolarHBondContact O-OG1 2.87Å
354	V	97.7	Very high	97.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-53	178.7	177.4	0	0	0	0	111.6	L233 L345 T349 D350 S351 G356 T357 M358 E370	L233-V354 HydrophobicContact CD2-CG1 3.94Å; L345-V354 HydrophobicContact CD1-CG1 4.32Å; L345-V354 HydrophobicContact CD1-CG2 4.04Å; L345-V354 HydrophobicContact CD2-CG2 4.17Å; T349-V354 HydrophobicContact CG2-CG2 3.85Å; D350-V354 WeakPolarHBondContact O-CG2 3.46Å; D350-V354 PolarHBondContact O-N 3.16Å; D350-V354 VanDerWaalsContact O-N 3.15Å; S351-V354 PolarHBondContact O-N 2.93Å; V354-G356 VanDerWaalsContact C-N 3.31Å; V354-G356 PolarHBondContact O-N 3.18Å; V354-T357 PolarHBondContact O-N 3.28Å; V354-M358 HydrophobicContact CG1-CG 4.46Å; V354-M358 HydrophobicContact CG1-SD 4.2Å; V354-M358 VanDerWaalsContact O-CG 3.31Å; V354-M358 WeakPolarHBondContact O-CG 3.41Å; V354-M358 PolarHBondContact O-N 2.82Å; V354-E370 HydrophobicContact CG1-CG 4.43Å; V354-E370 WeakPolarHBondContact CG1-OE2 3.39Å
355	Q	97.7	Very high	97	Very high	88 Å²	88	56.3 Å²	56.3	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-65.2	-35.8	-178.8	-67.1	-55.6	-47.5	0	0	112.3	S351 M358 K359	S351-Q355 WeakPolarHBondContact O-CB 3.34Å; S351-Q355 VanDerWaalsContact O-CG 3.25Å; S351-Q355 WeakPolarHBondContact O-CG 3.47Å; S351-Q355 PolarHBondContact O-N 3.46Å; Q355-M358 PolarHBondContact O-N 3.43Å; Q355-K359 WeakPolarHBondContact O-CB 3.41Å; Q355-K359 PolarHBondContact O-N 3.31Å
356	G	98.1	Very high	97	Very high	15 Å²	15	57.4 Å²	57.4	16%	0.155	31%	0.314	C	S	.	.	H	α-helix	trans	-60.7	-49.3	172.3	0	0	0	0	0	112.1	R326 T352 T353 V354 M358 K359 D360	R326-G356 VanDerWaalsContact CZ-C 3.41Å; T352-G356 PolarHBondContact O-N 3.32Å; T353-G356 PolarHBondContact O-N 3.02Å; V354-G356 VanDerWaalsContact C-N 3.31Å; V354-G356 PolarHBondContact O-N 3.18Å; G356-M358 PolarHBondContact O-N 3.44Å; G356-K359 PolarHBondContact O-N 2.93Å; G356-D360 PolarHBondContact O-N 3.38Å
357	T	98.3	Very high	97	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-46.6	176.1	-50.3	0	0	0	0	111.5	L233 T323 R326 L328 T353 V354 K359 D360 L361	L233-T357 HydrophobicContact CD1-CG2 3.85Å; T323-T357 HydrophobicContact CG2-CG2 3.87Å; R326-T357 WeakPolarHBondContact CD-OG1 3.48Å; L328-T357 HydrophobicContact CD1-CG2 4.01Å; L328-T357 WeakPolarHBondContact CD1-OG1 3.35Å; T353-T357 PolarHBondContact O-N 3.48Å; T353-T357 PolarHBondContact O-OG1 2.87Å; V354-T357 PolarHBondContact O-N 3.28Å; T357-K359 VanDerWaalsContact C-N 3.28Å; T357-K359 PolarHBondContact O-N 3.41Å; T357-D360 PolarHBondContact O-N 3.33Å; T357-L361 HydrophobicContact CG2-CD1 3.93Å; T357-L361 HydrophobicContact CG2-CG 4.43Å; T357-L361 VanDerWaalsContact O-CG 3.3Å; T357-L361 WeakPolarHBondContact O-CG 3.38Å; T357-L361 PolarHBondContact O-N 3.27Å
358	M	98.4	Very high	97.2	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-37.8	179.2	-68.4	-176.6	86.8	0	0	111.9	L233 V354 Q355 G356 R362 C368 E370	L233-M358 HydrophobicContact CD1-CG 4.12Å; L233-M358 HydrophobicContact CD2-CE 4.41Å; L233-M358 HydrophobicContact CD2-CG 3.74Å; L233-M358 HydrophobicContact CD2-SD 3.99Å; V354-M358 HydrophobicContact CG1-CG 4.46Å; V354-M358 HydrophobicContact CG1-SD 4.2Å; V354-M358 VanDerWaalsContact O-CG 3.31Å; V354-M358 WeakPolarHBondContact O-CG 3.41Å; V354-M358 PolarHBondContact O-N 2.82Å; Q355-M358 PolarHBondContact O-N 3.43Å; G356-M358 PolarHBondContact O-N 3.44Å; M358-R362 VanDerWaalsContact CE-NH2 3.27Å; M358-R362 WeakPolarHBondContact O-CB 3.38Å; M358-R362 WeakPolarHBondContact O-CD 3.48Å; M358-R362 WeakPolarHBondContact O-CG 3.22Å; M358-R362 PolarHBondContact O-N 3.38Å; M358-C368 HydrophobicContact CE-CB 4.33Å; M358-C368 WeakPolarHBondContact CE-O 3.49Å; M358-E370 HydrophobicContact CE-CB 4.39Å; M358-E370 HydrophobicContact SD-CB 4.24Å
359	K	98.3	Very high	97.3	Very high	126 Å²	126	52 Å²	52	55%	0.548	28%	0.283	S	S	.	.	H	α-helix	trans	-64.7	-50.5	174.8	-176.5	-175.9	172.9	-172.3	0	111	Q355 G356 T357 L361 R362 D363	Q355-K359 WeakPolarHBondContact O-CB 3.41Å; Q355-K359 PolarHBondContact O-N 3.31Å; G356-K359 PolarHBondContact O-N 2.93Å; T357-K359 VanDerWaalsContact C-N 3.28Å; T357-K359 PolarHBondContact O-N 3.41Å; K359-L361 VanDerWaalsContact C-N 3.26Å; K359-L361 PolarHBondContact O-N 3.35Å; K359-R362 WeakPolarHBondContact O-CB 3.49Å; K359-R362 PolarHBondContact O-N 2.93Å; K359-D363 PolarHBondContact O-N 3.06Å
360	D	98.3	Very high	97.4	Very high	53 Å²	53	54.6 Å²	54.6	28%	0.283	29%	0.294	S	S	.	.	H	α-helix	trans	-59.8	-38.6	-178.7	-60.7	-20.5	0	0	0	111.5	V322 R326 G356 T357 D363 C364	V322-D360 HydrophobicContact CG1-CB 3.64Å; R326-D360 IonicContact CZ-OD2 3.92Å; R326-D360 IonicContact NE-OD2 3.24Å; R326-D360 PolarHBondContact NE-OD2 3.01Å; R326-D360 IonicContact NH2-OD1 3.69Å; R326-D360 IonicContact NH2-OD2 3.94Å; R326-D360 PolarHBondContact NH2-OD2 2.97Å; G356-D360 PolarHBondContact O-N 3.38Å; T357-D360 PolarHBondContact O-N 3.33Å; D360-D363 PolarHBondContact O-N 3.36Å; D360-C364 PolarHBondContact O-N 3.05Å; D360-C364 PolarHBondContact O-SG 3.27Å
361	L	98.4	Very high	97.5	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-38	174.7	-68.8	168.9	0	0	0	112.7	T235 L319 V322 T323 T357 K359 C364 Y366 C368	T235-L361 HydrophobicContact CG2-CD1 4.29Å; T235-L361 HydrophobicContact CG2-CD2 4.32Å; T235-L361 WeakPolarHBondContact OG1-CD1 3.38Å; L319-L361 HydrophobicContact CB-CD2 4.47Å; L319-L361 HydrophobicContact CG-CD2 4.23Å; V322-L361 HydrophobicContact CB-CD2 4Å; V322-L361 HydrophobicContact CG1-CD2 3.81Å; V322-L361 HydrophobicContact CG1-CG 3.96Å; T323-L361 HydrophobicContact CG2-CD1 4.27Å; T357-L361 HydrophobicContact CG2-CD1 3.93Å; T357-L361 HydrophobicContact CG2-CG 4.43Å; T357-L361 VanDerWaalsContact O-CG 3.3Å; T357-L361 WeakPolarHBondContact O-CG 3.38Å; T357-L361 PolarHBondContact O-N 3.27Å; K359-L361 VanDerWaalsContact C-N 3.26Å; K359-L361 PolarHBondContact O-N 3.35Å; L361-C364 WeakPolarHBondContact O-CB 3.45Å; L361-C364 PolarHBondContact O-N 3.08Å; L361-Y366 HydrophobicContact CD2-CD2 4.13Å; L361-Y366 WeakPolarHBondContact O-CB 3.36Å; L361-Y366 PolarHBondContact O-N 3.43Å; L361-C368 HydrophobicContact CB-CB 4.48Å
362	R	98.1	Very high	97.5	Very high	120 Å²	120	48.7 Å²	48.7	45%	0.453	26%	0.257	S	S	.	.	H	α-helix	trans	-68.4	-35.4	174.6	-74.2	169.4	-174.1	148.2	1.4	112.1	M358 K359 C364 G365 Y366 C368	M358-R362 VanDerWaalsContact CE-NH2 3.27Å; M358-R362 WeakPolarHBondContact O-CB 3.38Å; M358-R362 WeakPolarHBondContact O-CD 3.48Å; M358-R362 WeakPolarHBondContact O-CG 3.22Å; M358-R362 PolarHBondContact O-N 3.38Å; K359-R362 WeakPolarHBondContact O-CB 3.49Å; K359-R362 PolarHBondContact O-N 2.93Å; R362-C364 PolarHBondContact O-N 3.29Å; R362-G365 WeakPolarHBondContact O-CA 3.33Å; R362-G365 PolarHBondContact O-N 2.93Å; R362-Y366 WeakPolarHBondContact CA-O 3.3Å; R362-C368 PolarHBondContact NH2-O 3.33Å
363	D	98	Very high	97.5	Very high	118 Å²	118	43.6 Å²	43.6	63%	0.631	23%	0.226	S	C	*	.	H	α-helix	trans	-64.9	-24.9	174.1	-69	-14.7	0	0	0	111.3	K359 D360 G365	K359-D363 PolarHBondContact O-N 3.06Å; D360-D363 PolarHBondContact O-N 3.36Å; D363-G365 PolarHBondContact O-N 2.9Å
364	C	97.2	Very high	97.1	Very high	53 Å²	53	42.6 Å²	42.6	36%	0.358	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	0.1	168.2	-58.6	0	0	0	0	114.1	D360 L361 R362 Y366	D360-C364 PolarHBondContact O-N 3.05Å; D360-C364 PolarHBondContact O-SG 3.27Å; L361-C364 WeakPolarHBondContact O-CB 3.45Å; L361-C364 PolarHBondContact O-N 3.08Å; R362-C364 PolarHBondContact O-N 3.29Å; C364-Y366 HydrophobicContact CB-CD1 4.49Å; C364-Y366 HydrophobicContact CB-CD2 3.92Å; C364-Y366 HydrophobicContact CB-CE1 4.29Å; C364-Y366 HydrophobicContact CB-CE2 3.72Å; C364-Y366 HydrophobicContact CB-CG 4.3Å; C364-Y366 WeakPolarHBondContact O-CE1 3.4Å
365	G	97.4	Very high	96.6	Very high	41 Å²	41	43 Å²	43	42%	0.423	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	7.1	-177.9	0	0	0	0	0	115	K238 R362 D363	K238-G365 PolarHBondContact NZ-O 3.49Å; R362-G365 WeakPolarHBondContact O-CA 3.33Å; R362-G365 PolarHBondContact O-N 2.93Å; D363-G365 PolarHBondContact O-N 2.9Å
366	Y	97.9	Very high	95.8	Very high	23 Å²	23	41.8 Å²	41.8	9%	0.09	23%	0.226	C	C	.	.			trans	-85.5	156.5	-178.2	-51.4	-25.5	0	0	0	111.9	T235 N236 T237 S315 L319 L361 R362 C364	T235-Y366 HydrophobicContact CG2-CD2 3.94Å; T235-Y366 HydrophobicContact CG2-CG 4.21Å; N236-Y366 WeakPolarHBondContact O-CA 3.46Å; N236-Y366 WeakPolarHBondContact O-CB 3.25Å; T237-Y366 HydrophobicContact CG2-CE1 4.45Å; S315-Y366 WeakPolarHBondContact CA-OH 3.36Å; S315-Y366 WeakPolarHBondContact CB-OH 3.38Å; S315-Y366 PolarHBondContact O-OH 3.37Å; L319-Y366 HydrophobicContact CB-CE2 4.43Å; L361-Y366 HydrophobicContact CD2-CD2 4.13Å; L361-Y366 WeakPolarHBondContact O-CB 3.36Å; L361-Y366 PolarHBondContact O-N 3.43Å; R362-Y366 WeakPolarHBondContact CA-O 3.3Å; C364-Y366 HydrophobicContact CB-CD1 4.49Å; C364-Y366 HydrophobicContact CB-CD2 3.92Å; C364-Y366 HydrophobicContact CB-CE1 4.29Å; C364-Y366 HydrophobicContact CB-CE2 3.72Å; C364-Y366 HydrophobicContact CB-CG 4.3Å; C364-Y366 WeakPolarHBondContact O-CE1 3.4Å
367	D	96.6	Very high	94.9	Very high	56 Å²	56	41.1 Å²	41.1	30%	0.299	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	143	162.6	-64.3	-31.3	0	0	0	109.4	T235 N236 K238 W369	T235-D367 CarbonylContact C-O 3.6Å; T235-D367 VanDerWaalsContact CA-O 3.3Å; T235-D367 WeakPolarHBondContact CA-O 3.5Å; N236-D367 HydrophobicContact CB-CB 4.34Å; N236-D367 PolarHBondContact N-O 2.97Å; N236-D367 PolarHBondContact O-N 3.25Å; K238-D367 WeakPolarHBondContact CE-OD1 3.46Å; K238-D367 WeakPolarHBondContact CE-OD2 3.35Å; K238-D367 VanDerWaalsContact NZ-CG 3.34Å; K238-D367 IonicContact NZ-OD1 2.69Å; K238-D367 PolarHBondContact NZ-OD1 3.25Å; K238-D367 IonicContact NZ-OD2 3.53Å; D367-W369 HydrophobicContact CB-CE3 4.33Å; D367-W369 HydrophobicContact CB-CH2 3.19Å; D367-W369 HydrophobicContact CB-CZ2 3.79Å; D367-W369 HydrophobicContact CB-CZ3 3.51Å
368	C	96.8	Very high	93.5	Very high	6 Å²	6	41.1 Å²	41.1	4%	0.041	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	132.5	-177.9	-166.7	0	0	0	0	110.9	L234 T235 M358 L361 R362	L234-C368 WeakPolarHBondContact O-CA 3.48Å; T235-C368 PolarHBondContact OG1-SG 3.46Å; M358-C368 HydrophobicContact CE-CB 4.33Å; M358-C368 WeakPolarHBondContact CE-O 3.49Å; L361-C368 HydrophobicContact CB-CB 4.48Å; R362-C368 PolarHBondContact NH2-O 3.33Å
369	W	96.7	Very high	92.5	Very high	71 Å²	71	41.6 Å²	41.6	27%	0.269	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.7	179.2	-59.6	-94.8	0	0	0	110	L35 P138 L233 L234 N236 D367	L35-W369 HydrophobicContact CD1-CB 4.43Å; L35-W369 HydrophobicContact CD1-CD2 4.49Å; L35-W369 HydrophobicContact CD1-CG 4.31Å; P138-W369 HydrophobicContact CB-CH2 4.14Å; P138-W369 HydrophobicContact CG-CH2 3.95Å; P138-W369 HydrophobicContact CG-CZ3 4.27Å; L233-W369 CarbonylContact C-O 3.59Å; L233-W369 WeakPolarHBondContact CA-O 3.34Å; L234-W369 HydrophobicContact CD2-CE3 4.01Å; L234-W369 HydrophobicContact CD2-CZ3 4.49Å; L234-W369 HydrophobicContact CG-CE3 4.32Å; L234-W369 PolarHBondContact N-O 2.93Å; L234-W369 PolarHBondContact O-N 3.23Å; N236-W369 HydrophobicContact CB-CH2 4.14Å; N236-W369 HydrophobicContact CB-CZ3 3.74Å; D367-W369 HydrophobicContact CB-CE3 4.33Å; D367-W369 HydrophobicContact CB-CH2 3.19Å; D367-W369 HydrophobicContact CB-CZ2 3.79Å; D367-W369 HydrophobicContact CB-CZ3 3.51Å
370	E	97	Very high	91.2	Very high	75 Å²	75	36.4 Å²	36.4	35%	0.35	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	124.8	163.1	-175.8	178.2	-178.4	0	0	108	R231 L233 L345 V354 M358	R231-E370 IonicContact CZ-OE1 3.63Å; R231-E370 IonicContact NE-OE1 2.76Å; R231-E370 IonicContact NH2-OE1 2.76Å; R231-E370 PolarHBondContact NH2-OE1 3.07Å; L233-E370 HydrophobicContact CD2-CB 3.85Å; L233-E370 HydrophobicContact CD2-CG 4.26Å; L345-E370 HydrophobicContact CD1-CG 4.19Å; V354-E370 HydrophobicContact CG1-CG 4.43Å; V354-E370 WeakPolarHBondContact CG1-OE2 3.39Å; M358-E370 HydrophobicContact CE-CB 4.39Å; M358-E370 HydrophobicContact SD-CB 4.24Å
371	T	96.2	Very high	90.8	Very high	15 Å²	15	35.6 Å²	35.6	9%	0.092	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	-167.6	-177.6	-171.8	0	0	0	0	109.6	L33 N34 L35 I232 L234	L33-T371 HydrophobicContact CD1-CG2 3.63Å; N34-T371 VanDerWaalsContact C-OG1 3.28Å; N34-T371 PolarHBondContact O-OG1 3.24Å; N34-T371 VanDerWaalsContact O-OG1 3.09Å; L35-T371 HydrophobicContact CG-CG2 4.39Å; I232-T371 HydrophobicContact CD1-CG2 4.05Å; I232-T371 HydrophobicContact CG1-CG2 3.82Å; I232-T371 PolarHBondContact N-O 3.49Å; I232-T371 PolarHBondContact O-N 3.17Å; I232-T371 VanDerWaalsContact O-O 3.06Å; L234-T371 HydrophobicContact CB-CG2 4.19Å
372	S	96.3	Very high	90.4	Very high	13 Å²	13	37.5 Å²	37.5	9%	0.091	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	158.8	177.5	57	0	0	0	0	112.2	N34 L230	N34-S372 WeakPolarHBondContact CB-O 3.34Å; N34-S372 VanDerWaalsContact CB-OG 3.31Å; N34-S372 WeakPolarHBondContact CB-OG 3.39Å; N34-S372 PolarHBondContact N-O 2.98Å; L230-S372 CarbonylContact O-C 3.59Å; L230-S372 WeakPolarHBondContact O-CA 3.43Å; L230-S372 VanDerWaalsContact O-CB 3.31Å; L230-S372 WeakPolarHBondContact O-CB 3.18Å
373	I	95.9	Very high	90	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.015	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.6	172.4	57.9	173.5	0	0	0	111.3	L16 V31 S32 L33 L230 I232	L16-I373 HydrophobicContact CD1-CD1 4.19Å; V31-I373 HydrophobicContact CB-CB 4.23Å; V31-I373 HydrophobicContact CG2-CB 3.78Å; V31-I373 HydrophobicContact CG2-CD1 4.12Å; V31-I373 HydrophobicContact CG2-CG2 3.82Å; S32-I373 CarbonylContact O-C 3.6Å; S32-I373 WeakPolarHBondContact O-CA 3.3Å; S32-I373 WeakPolarHBondContact O-CB 3.47Å; L33-I373 HydrophobicContact CD1-CG2 4.06Å; L230-I373 HydrophobicContact CB-CD1 4.3Å; L230-I373 HydrophobicContact CB-CG1 3.8Å; L230-I373 HydrophobicContact CD1-CD1 4.22Å; L230-I373 HydrophobicContact CD1-CG1 4.45Å; L230-I373 PolarHBondContact N-O 3.13Å; L230-I373 PolarHBondContact O-N 2.76Å; I232-I373 HydrophobicContact CD1-CG2 3.54Å; I232-I373 HydrophobicContact CG1-CG2 4.11Å; I232-I373 HydrophobicContact CG2-CD1 4Å; I232-I373 HydrophobicContact CG2-CG1 4.01Å
374	G	89.9	Confident	89.5	Confident	11 Å²	11	27.9 Å²	27.9	11%	0.113	17%	0.169	C	C	.	.	S	Bend	trans	83.2	15.8	-177.9	0	0	0	0	0	113.7	S32	S32-G374 PolarHBondContact O-N 3.23Å; S32-G374 WeakPolarHBondContact OG-CA 3.42Å; S32-G374 PolarHBondContact OG-N 2.58Å
375	G	86.8	Confident	89.1	Confident	8 Å²	8	26.3 Å²	26.3	8%	0.082	16%	0.157	C	C	.	.			trans	-76.3	-176.9	178.4	0	0	0	0	0	114.5	S32 G212	S32-G375 PolarHBondContact OG-N 2.93Å; S32-G375 PolarHBondContact OG-O 2.87Å; G212-G375 PolarHBondContact N-O 3.37Å
376	P	81.8	Confident	88.5	Confident	63 Å²	63	25.3 Å²	25.3	41%	0.409	14%	0.139	S	C	.	.	B	Isolated β-bridge	trans	-65.6	138.1	176.2	26.6	-32.8	0	0	0	112.1	P11 R36 R176	P11-P376 WeakPolarHBondContact CG-O 3.41Å; R36-P376 PolarHBondContact NH1-O 3.18Å; R176-P376 VanDerWaalsContact NH2-C 3.27Å
377	G	79.3	Confident	87.8	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.143	C	C	.	.			trans	-60.9	-145.9	162.6	0	0	0	0	0	114.3	P11 R36 R176 G208 G211	P11-G377 VanDerWaalsContact CD-C 3.46Å; R36-G377 PolarHBondContact NH2-O 2.81Å; R176-G377 PolarHBondContact NH2-O 2.9Å; G208-G377 CarbonylContact O-C 3.56Å; G211-G377 VanDerWaalsContact CA-CA 3.4Å
378	D	68.3	Low	87.2	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-57.4	147.9	-177.5	-163	16.5	0	0	0	112.8	S9 V151 A155 R176 W177 G208 T209	S9-D378 WeakPolarHBondContact O-CA 3.4Å; V151-D378 HydrophobicContact CG1-CB 3.78Å; A155-D378 WeakPolarHBondContact CB-OD2 3.33Å; R176-D378 PolarHBondContact NH2-O 3.37Å; W177-D378 HydrophobicContact CZ3-CB 4.16Å; W177-D378 VanDerWaalsContact CZ3-CG 3.5Å; W177-D378 VanDerWaalsContact CZ3-OD2 3.3Å; W177-D378 WeakPolarHBondContact CZ3-OD2 3.38Å; G208-D378 PolarHBondContact O-N 3.18Å; T209-D378 PolarHBondContact O-N 3.4Å
379	S	77.4	Confident	86.4	Confident	18 Å²	18	24.6 Å²	24.6	13%	0.126	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-157.4	148	-179.3	64.3	0	0	0	0	111.9	V8 S9 R36 G175	V8-S379 CarbonylContact C-O 3.53Å; V8-S379 WeakPolarHBondContact CA-O 3.09Å; S9-S379 PolarHBondContact N-O 3.42Å; S9-S379 PolarHBondContact O-N 2.79Å; S9-S379 PolarHBondContact OG-OG 3.39Å; R36-S379 PolarHBondContact NH2-OG 2.86Å; R36-S379 VanDerWaalsContact NH2-OG 3.16Å; G175-S379 WeakPolarHBondContact O-CA 3.49Å
380	V	71	Confident	85.4	Confident	18 Å²	18	20.4 Å²	20.4	11%	0.109	13%	0.126	C	C	.	.			trans	-98.9	0	167.9	-168.9	0	0	0	0	110	L7 V8 T166 P167 L168 T174 G175 W177	L7-V380 WeakPolarHBondContact O-CA 3.24Å; L7-V380 WeakPolarHBondContact O-CG1 3.49Å; V8-V380 HydrophobicContact CG1-CG1 4.36Å; V8-V380 HydrophobicContact CG1-CG2 3.96Å; T166-V380 HydrophobicContact CG2-CG1 4.23Å; P167-V380 VanDerWaalsContact CD-CG2 3.46Å; P167-V380 HydrophobicContact CG-CB 3.79Å; P167-V380 HydrophobicContact CG-CG2 3.48Å; P167-V380 VanDerWaalsContact CG-CG2 3.48Å; L168-V380 HydrophobicContact CD1-CB 4.22Å; L168-V380 HydrophobicContact CD1-CG1 3.59Å; L168-V380 HydrophobicContact CG-CB 4.2Å; L168-V380 HydrophobicContact CG-CG1 4.01Å; T174-V380 WeakPolarHBondContact CA-O 3.3Å; G175-V380 PolarHBondContact N-O 2.94Å; G175-V380 PolarHBondContact O-N 3.18Å; G175-V380 VanDerWaalsContact O-N 3.1Å; W177-V380 HydrophobicContact CD2-CG2 4.48Å; W177-V380 HydrophobicContact CE3-CG2 4.43Å; W177-V380 HydrophobicContact CH2-CB 4.34Å; W177-V380 HydrophobicContact CH2-CG2 2.97Å; W177-V380 HydrophobicContact CZ2-CB 4.48Å; W177-V380 HydrophobicContact CZ2-CG2 2.98Å; W177-V380 HydrophobicContact CZ3-CG2 3.72Å

Retrieved 380 of 380 residues in 114.6 ms (Link to these results)

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