A0A060X743_ONCMY Loading...

N-glycosylase/DNA lyase

DNA repair enzyme that incises DNA at 8-oxoG residues. Excises 7,8-dihydro-8-oxoguanine and 2,6-diamino-4-hydroxy-5-N-methylformamidopyrimidine (FAPY) from damaged DNA. Has a beta-lyase activity that nicks DNA 3' to the lesion.

AlphaFold DB , UniProt , Accession A0A060X743, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ogg1, Length 401 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	53.6	Low	67.5	Low	230 Å²	230	74.3 Å²	74.3	100%	1.133	46%	0.456	S	S	*	.				0	134	0	-75	-172.8	-85.1	0	0	107	Q3	M1-Q3 PolarHBondContact O-N 3.34Å
2	S	68.6	Low	66.9	Low	76 Å²	76	82.4 Å²	82.4	53%	0.531	48%	0.48	S	S	.	.			trans	-55.1	126	175.5	176.1	0	0	0	0	109.5	H4 D203	S2-H4 PolarHBondContact OG-N 3.47Å; S2-H4 PolarHBondContact OG-O 3.38Å; S2-D203 WeakPolarHBondContact CA-OD1 3.39Å
3	Q	74.1	Confident	68	Low	104 Å²	104	80.2 Å²	80.2	49%	0.486	47%	0.472	S	S	.	.	S	Bend	trans	-82.4	-20.3	172.8	-64.7	-176.1	-13.1	0	0	111.3	M1 A5 Y69 Q201 L202 D203	M1-Q3 PolarHBondContact O-N 3.34Å; Q3-A5 PolarHBondContact O-N 3.31Å; Q3-Y69 WeakPolarHBondContact O-CE1 3.36Å; Q3-Q201 PolarHBondContact OE1-O 3.17Å; Q3-Q201 VanDerWaalsContact OE1-O 3.13Å; Q3-L202 HydrophobicContact CB-CB 4.23Å; Q3-L202 HydrophobicContact CB-CD2 4.28Å; Q3-L202 VanDerWaalsContact OE1-CA 3.29Å; Q3-D203 VanDerWaalsContact N-CG 3.35Å; Q3-D203 PolarHBondContact N-OD1 3.33Å; Q3-D203 PolarHBondContact N-OD2 3.14Å
4	H	79.1	Confident	69.5	Low	14 Å²	14	74.6 Å²	74.6	7%	0.065	44%	0.439	C	S	.	.	S	Bend	trans	-66.8	120.4	163.9	-69.1	84.8	0	0	0	109.6	S2 T47 L202 D203 Y207	S2-H4 PolarHBondContact OG-N 3.47Å; S2-H4 PolarHBondContact OG-O 3.38Å; H4-T47 PolarHBondContact CD2-OG1 2.75Å; H4-L202 PolarHBondContact CE1-O 2.85Å; H4-D203 IonicContact CE1-OD2 3.76Å; H4-D203 IonicContact CG-OD2 3.09Å; H4-D203 PolarHBondContact N-OD2 2.92Å; H4-D203 IonicContact ND1-OD2 3.88Å; H4-D203 PolarHBondContact ND1-OD2 3.12Å; H4-Y207 AromaticContact NE2-CE2 3.85Å; H4-Y207 AromaticContact NE2-CZ 3.83Å; H4-Y207 PolarHBondContact NE2-OH 3.45Å
5	A	77.4	Confident	71	Confident	17 Å²	17	73.3 Å²	73.3	14%	0.14	42%	0.424	C	S	.	.			trans	-64.9	132	175.8	0	0	0	0	0	110.4	Q3 W14 H67 Y69	Q3-A5 PolarHBondContact O-N 3.31Å; A5-W14 HydrophobicContact CB-CZ2 3.81Å; A5-H67 HydrophobicContact CB-CB 4.42Å; A5-H67 VanDerWaalsContact CB-CD2 3.49Å; A5-H67 WeakPolarHBondContact CB-CD2 3.31Å; A5-Y69 WeakPolarHBondContact CB-OH 3.25Å; A5-Y69 PolarHBondContact N-OH 3.46Å
6	L	80.5	Confident	72.4	Confident	56 Å²	56	70.7 Å²	70.7	29%	0.293	41%	0.411	S	S	.	.			trans	-114.8	141.3	168.4	-62.7	175.7	0	0	0	107.6	S8 A9 W14 H45	L6-S8 PolarHBondContact O-N 3.37Å; L6-S8 VanDerWaalsContact O-N 3.15Å; L6-A9 WeakPolarHBondContact O-CB 3.43Å; L6-A9 PolarHBondContact O-N 3.07Å; L6-W14 PolarHBondContact O-NE1 3.5Å; L6-H45 HydrophobicContact CD2-CB 4.38Å
7	L	74.6	Confident	73.7	Confident	45 Å²	45	67.6 Å²	67.6	24%	0.236	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.4	-177.6	-173.3	62.5	0	0	0	112.8	A9 W14 H45 T58 W65	L7-A9 VanDerWaalsContact C-N 3.26Å; L7-A9 PolarHBondContact O-N 3.32Å; L7-W14 HydrophobicContact CB-CZ2 4.33Å; L7-W14 HydrophobicContact CD1-CB 3.91Å; L7-W14 HydrophobicContact CD1-CD2 3.69Å; L7-W14 HydrophobicContact CD1-CE3 4.2Å; L7-W14 HydrophobicContact CD1-CG 3.55Å; L7-H45 PolarHBondContact N-NE2 2.94Å; L7-T58 HydrophobicContact CB-CG2 4.14Å; L7-T58 HydrophobicContact CD2-CG2 4.07Å; L7-W65 HydrophobicContact CD1-CD2 4.22Å; L7-W65 HydrophobicContact CD1-CE3 4.06Å; L7-W65 HydrophobicContact CD1-CG 4.46Å; L7-W65 HydrophobicContact CD2-CB 4.48Å; L7-W65 HydrophobicContact CD2-CD2 4.19Å; L7-W65 HydrophobicContact CD2-CG 4.01Å
8	S	70.5	Confident	74.9	Confident	113 Å²	113	69.1 Å²	69.1	79%	0.79	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.7	172.6	55.6	0	0	0	0	114	L6 G10	L6-S8 PolarHBondContact O-N 3.37Å; L6-S8 VanDerWaalsContact O-N 3.15Å; S8-G10 PolarHBondContact O-N 3.49Å
9	A	55.5	Low	76.1	Confident	69 Å²	69	66.3 Å²	66.3	57%	0.57	40%	0.398	S	S	*	.	S	Bend	trans	-97.6	80.4	-178.8	0	0	0	0	0	110.6	L6 L7	L6-A9 WeakPolarHBondContact O-CB 3.43Å; L6-A9 PolarHBondContact O-N 3.07Å; L7-A9 VanDerWaalsContact C-N 3.26Å; L7-A9 PolarHBondContact O-N 3.32Å
10	G	53.1	Low	77.2	Confident	48 Å²	48	65.2 Å²	65.2	50%	0.495	39%	0.393	S	S	.	.			trans	71.8	106.2	168	0	0	0	0	0	115	S8 K12	S8-G10 PolarHBondContact O-N 3.49Å; G10-K12 PolarHBondContact O-N 3.47Å
11	T	55.3	Low	78.1	Confident	45 Å²	45	66.3 Å²	66.3	28%	0.276	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-68.6	-14.9	-174.7	51.2	0	0	0	0	114.8	S13 W14 P112	T11-S13 PolarHBondContact O-N 2.84Å; T11-S13 VanDerWaalsContact O-N 3.14Å; T11-W14 PolarHBondContact O-N 3.01Å; T11-P112 HydrophobicContact CG2-CB 3.52Å; T11-P112 HydrophobicContact CG2-CG 3.88Å
12	K	61.2	Low	80.1	Confident	172 Å²	172	58.2 Å²	58.2	75%	0.748	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-67.5	-12.9	-174.7	-67.4	-179.3	-178.2	169.6	0	114.7	G10 V115	G10-K12 PolarHBondContact O-N 3.47Å; K12-V115 VanDerWaalsContact O-CG2 3.3Å; K12-V115 WeakPolarHBondContact O-CG2 3.4Å
13	S	80.1	Confident	81.6	Confident	54 Å²	54	56.7 Å²	56.7	38%	0.378	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-108.4	-7.4	-179.7	60.9	0	0	0	0	114.7	T11 H67	T11-S13 PolarHBondContact O-N 2.84Å; T11-S13 VanDerWaalsContact O-N 3.14Å; S13-H67 PolarHBondContact O-ND1 3.25Å
14	W	89.8	Confident	82.7	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	32%	0.318	C	S	.	.			trans	-94.2	142	-179.4	-72.9	87.9	0	0	0	111.1	A5 L6 L7 T11 H45 T56 T58 W65 Y66 H67	A5-W14 HydrophobicContact CB-CZ2 3.81Å; L6-W14 PolarHBondContact O-NE1 3.5Å; L7-W14 HydrophobicContact CB-CZ2 4.33Å; L7-W14 HydrophobicContact CD1-CB 3.91Å; L7-W14 HydrophobicContact CD1-CD2 3.69Å; L7-W14 HydrophobicContact CD1-CE3 4.2Å; L7-W14 HydrophobicContact CD1-CG 3.55Å; T11-W14 PolarHBondContact O-N 3.01Å; W14-H45 AromaticContact CH2-CD2 3.82Å; W14-T56 HydrophobicContact CH2-CG2 3.83Å; W14-T58 HydrophobicContact CH2-CG2 3.94Å; W14-T58 HydrophobicContact CZ3-CG2 3.78Å; W14-W65 HydrophobicContact CB-CE3 4.26Å; W14-W65 HydrophobicContact CE3-CB 3.91Å; W14-W65 HydrophobicContact CZ3-CB 4.19Å; W14-Y66 VanDerWaalsContact CE3-C 3.41Å; W14-H67 HydrophobicContact CD2-CB 4.01Å; W14-H67 HydrophobicContact CE3-CB 3.98Å; W14-H67 HydrophobicContact CH2-CB 4.36Å; W14-H67 HydrophobicContact CZ2-CB 4.38Å; W14-H67 HydrophobicContact CZ3-CB 4.16Å
15	R	92.4	Very high	83.6	Confident	56 Å²	56	53.6 Å²	53.6	21%	0.211	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	162.7	172	-66.7	171.5	174.7	135.1	2.8	108.8	W65 Y66 E121	R15-W65 CarbonylContact O-C 3.07Å; R15-W65 WeakPolarHBondContact O-CA 3.48Å; R15-Y66 HydrophobicContact CB-CD1 4.13Å; R15-Y66 HydrophobicContact CB-CD2 4.05Å; R15-Y66 HydrophobicContact CB-CE1 3.61Å; R15-Y66 HydrophobicContact CB-CE2 3.52Å; R15-Y66 HydrophobicContact CB-CG 4.33Å; R15-Y66 HydrophobicContact CG-CE2 4.2Å; R15-Y66 PolarHBondContact N-O 2.8Å; R15-Y66 WeakPolarHBondContact O-CD1 3.48Å; R15-Y66 PolarHBondContact O-N 3.49Å; R15-E121 IonicContact CZ-OE2 3.31Å; R15-E121 IonicContact NE-OE2 2.71Å; R15-E121 IonicContact NH1-OE1 3.23Å; R15-E121 PolarHBondContact NH1-OE1 3.31Å; R15-E121 VanDerWaalsContact NH1-OE1 3.09Å; R15-E121 IonicContact NH1-OE2 3.64Å; R15-E121 PolarHBondContact NH1-OE2 3.12Å
16	S	93.1	Very high	84.6	Confident	31 Å²	31	52.9 Å²	52.9	22%	0.217	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	159.2	-177.7	59	0	0	0	0	112.9	L64	S16-L64 CarbonylContact C-O 3.54Å; S16-L64 VanDerWaalsContact CA-O 3.27Å; S16-L64 WeakPolarHBondContact CA-O 3.47Å
17	L	94.1	Very high	85.4	Confident	18 Å²	18	52 Å²	52	9%	0.094	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	132.8	171	179.6	108.1	0	0	0	107.9	C19 L64 E122 L131	L17-C19 HydrophobicContact CD2-CB 4.13Å; L17-C19 PolarHBondContact O-N 3.33Å; L17-C19 VanDerWaalsContact O-N 3.15Å; L17-L64 PolarHBondContact N-O 3.47Å; L17-L64 PolarHBondContact O-N 2.94Å; L17-E122 HydrophobicContact CD1-CG 3.49Å; L17-E122 VanDerWaalsContact CD1-CG 3.49Å; L17-L131 HydrophobicContact CD2-CD1 3.23Å
18	A	96.1	Very high	86.5	Confident	95 Å²	95	49.8 Å²	49.8	79%	0.785	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.5	117.4	171.5	0	0	0	0	0	109.8
19	C	97.5	Very high	87.8	Confident	16 Å²	16	44.4 Å²	44.4	11%	0.108	27%	0.265	C	S	.	.			trans	-161.6	107.2	-178	-169.3	0	0	0	0	109.4	L17 E23 L24 D62 T63 L64	L17-C19 HydrophobicContact CD2-CB 4.13Å; L17-C19 PolarHBondContact O-N 3.33Å; L17-C19 VanDerWaalsContact O-N 3.15Å; C19-E23 PolarHBondContact SG-O 3.29Å; C19-L24 VanDerWaalsContact SG-CB 3.54Å; C19-D62 CarbonylContact C-O 3.56Å; C19-D62 VanDerWaalsContact C-O 3.24Å; C19-D62 PolarHBondContact N-O 3.08Å; C19-D62 CarbonylContact O-C 3.49Å; C19-T63 PolarHBondContact O-N 3.41Å; C19-L64 HydrophobicContact CB-CB 3.91Å
20	S	97.6	Very high	89.8	Confident	43 Å²	43	41.3 Å²	41.3	30%	0.301	24%	0.238	S	C	.	.			trans	-71.9	152.6	179.2	66.1	0	0	0	0	112.3	S22 E23 L24 D61	S20-S22 PolarHBondContact O-N 3.26Å; S20-S22 PolarHBondContact OG-OG 3.04Å; S20-E23 CarbonylContact O-C 3.37Å; S20-E23 WeakPolarHBondContact O-CA 3.41Å; S20-E23 PolarHBondContact O-N 3.21Å; S20-L24 PolarHBondContact O-N 3.45Å; S20-D61 CarbonylContact C-O 3.58Å; S20-D61 WeakPolarHBondContact CA-O 3.4Å
21	R	96.3	Very high	91.7	Very high	90 Å²	90	39.6 Å²	39.6	34%	0.34	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-59.9	-29.6	175.1	-77	-179.1	176.5	-175.5	-10.2	114.2	E23 L24 Q59 T60 D61 G158	R21-E23 PolarHBondContact O-N 3.06Å; R21-L24 VanDerWaalsContact CA-O 3.3Å; R21-L24 WeakPolarHBondContact CA-O 3.4Å; R21-L24 CarbonylContact O-C 3.46Å; R21-L24 PolarHBondContact O-N 3.38Å; R21-Q59 PolarHBondContact NH2-O 3.47Å; R21-T60 WeakPolarHBondContact CG-O 3.38Å; R21-T60 PolarHBondContact NE-O 3.35Å; R21-D61 VanDerWaalsContact CD-OD1 3.3Å; R21-D61 WeakPolarHBondContact CD-OD1 3.43Å; R21-D61 IonicContact CZ-OD1 3.23Å; R21-D61 VanDerWaalsContact CZ-OD1 3.23Å; R21-D61 PolarHBondContact N-O 3.4Å; R21-D61 IonicContact NE-OD1 2.84Å; R21-D61 PolarHBondContact NE-OD1 2.9Å; R21-D61 IonicContact NH1-OD1 2.88Å; R21-D61 PolarHBondContact NH1-OD1 2.97Å; R21-G158 WeakPolarHBondContact O-CA 3.37Å
22	S	96.4	Very high	93.5	Very high	59 Å²	59	37.5 Å²	37.5	41%	0.413	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-60.6	-25.7	173.2	61.9	0	0	0	0	112	S20 T157 G158	S20-S22 PolarHBondContact O-N 3.26Å; S20-S22 PolarHBondContact OG-OG 3.04Å; S22-T157 WeakPolarHBondContact CA-OG1 3.44Å; S22-T157 PolarHBondContact O-OG1 3.18Å; S22-G158 WeakPolarHBondContact O-CA 3.46Å; S22-G158 PolarHBondContact O-N 3.37Å
23	E	98.1	Very high	95	Very high	45 Å²	45	29.9 Å²	29.9	21%	0.21	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-131.1	40.8	169.4	49.8	-163.6	89.9	0	0	115.9	C19 S20 R21 K134 L135 G136 R160	C19-E23 PolarHBondContact SG-O 3.29Å; S20-E23 CarbonylContact O-C 3.37Å; S20-E23 WeakPolarHBondContact O-CA 3.41Å; S20-E23 PolarHBondContact O-N 3.21Å; R21-E23 PolarHBondContact O-N 3.06Å; E23-K134 WeakPolarHBondContact OE2-CA 3.48Å; E23-L135 HydrophobicContact CB-CB 3.72Å; E23-L135 HydrophobicContact CB-CD2 4.32Å; E23-L135 PolarHBondContact OE1-N 3.26Å; E23-L135 PolarHBondContact OE2-N 2.74Å; E23-G136 PolarHBondContact OE1-N 2.91Å; E23-R160 VanDerWaalsContact C-NH1 3.26Å; E23-R160 PolarHBondContact O-NH1 3.08Å; E23-R160 PolarHBondContact O-NH2 2.95Å
24	L	98.4	Very high	95.8	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	16%	0.161	C	C	.	.			trans	-169.7	126.1	140.7	-174.2	41.7	0	0	0	107.5	C19 S20 R21 L26 T29 Q59 L64 F129 G158 R160	C19-L24 VanDerWaalsContact SG-CB 3.54Å; S20-L24 PolarHBondContact O-N 3.45Å; R21-L24 VanDerWaalsContact CA-O 3.3Å; R21-L24 WeakPolarHBondContact CA-O 3.4Å; R21-L24 CarbonylContact O-C 3.46Å; R21-L24 PolarHBondContact O-N 3.38Å; L24-L26 HydrophobicContact CD2-CD2 3.97Å; L24-L26 HydrophobicContact CG-CD2 4.26Å; L24-L26 HydrophobicContact CG-CG 4.48Å; L24-T29 HydrophobicContact CD1-CG2 4.27Å; L24-Q59 PolarHBondContact O-OE1 2.78Å; L24-Q59 VanDerWaalsContact O-OE1 3.09Å; L24-L64 HydrophobicContact CD2-CD1 4.18Å; L24-L64 HydrophobicContact CD2-CD2 4.03Å; L24-F129 HydrophobicContact CD1-CD1 3.93Å; L24-F129 HydrophobicContact CD1-CE1 4.08Å; L24-F129 HydrophobicContact CD2-CD1 4.12Å; L24-F129 HydrophobicContact CD2-CD2 4.45Å; L24-F129 HydrophobicContact CD2-CE1 4.23Å; L24-F129 HydrophobicContact CD2-CG 4.23Å; L24-F129 HydrophobicContact CD2-CZ 4.45Å; L24-G158 CarbonylContact C-O 3.54Å; L24-R160 VanDerWaalsContact CG-NH2 3.33Å
25	R	97.9	Very high	96.1	Very high	51 Å²	51	27.6 Å²	27.6	19%	0.192	16%	0.162	C	C	.	.			trans	-116.4	102.3	163.3	-80.6	-75.7	-62.5	-108.5	-7.1	108	D27 L28 T29 T157 G158	R25-D27 VanDerWaalsContact C-N 3.29Å; R25-D27 IonicContact CZ-OD1 2.79Å; R25-D27 IonicContact CZ-OD2 3.6Å; R25-D27 IonicContact NE-OD1 2.77Å; R25-D27 PolarHBondContact NE-OD1 3.49Å; R25-D27 IonicContact NE-OD2 4Å; R25-D27 IonicContact NH2-OD1 3.25Å; R25-D27 IonicContact NH2-OD2 2.58Å; R25-D27 PolarHBondContact NH2-OD2 3.09Å; R25-D27 PolarHBondContact O-N 2.86Å; R25-L28 HydrophobicContact CB-CB 3.98Å; R25-L28 HydrophobicContact CB-CD1 3.94Å; R25-L28 HydrophobicContact CB-CG 3.95Å; R25-L28 HydrophobicContact CG-CD1 4.22Å; R25-L28 PolarHBondContact O-N 2.97Å; R25-T29 WeakPolarHBondContact O-CB 3.46Å; R25-T29 PolarHBondContact O-N 3.36Å; R25-T29 PolarHBondContact O-OG1 3.07Å; R25-T157 VanDerWaalsContact CG-O 3.26Å; R25-T157 WeakPolarHBondContact CG-O 3.5Å; R25-G158 PolarHBondContact N-O 3.41Å
26	L	98.3	Very high	96.4	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-54	-45.4	180	-71.6	175.2	0	0	0	112.1	L24 L28 T29 L30 W46 L57 Q59 L64 F129	L24-L26 HydrophobicContact CD2-CD2 3.97Å; L24-L26 HydrophobicContact CG-CD2 4.26Å; L24-L26 HydrophobicContact CG-CG 4.48Å; L26-L28 PolarHBondContact O-N 2.89Å; L26-T29 PolarHBondContact O-N 3.38Å; L26-L30 HydrophobicContact CB-CD1 4.41Å; L26-L30 HydrophobicContact CD2-CD1 3.86Å; L26-L30 HydrophobicContact CD2-CG 4.41Å; L26-L30 VanDerWaalsContact O-CB 3.25Å; L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 WeakPolarHBondContact O-CG 3.39Å; L26-L30 PolarHBondContact O-N 3.01Å; L26-W46 HydrophobicContact CB-CG 4.48Å; L26-L57 HydrophobicContact CD1-CB 3.92Å; L26-L57 HydrophobicContact CD2-CB 4.24Å; L26-L57 HydrophobicContact CD2-CD1 4.07Å; L26-Q59 HydrophobicContact CD1-CB 4.09Å; L26-Q59 HydrophobicContact CD1-CG 4.12Å; L26-Q59 HydrophobicContact CG-CG 4.43Å; L26-Q59 VanDerWaalsContact N-OE1 3.13Å; L26-L64 HydrophobicContact CD1-CD1 3.9Å; L26-L64 HydrophobicContact CD2-CD1 4.03Å; L26-L64 HydrophobicContact CG-CD1 4.24Å; L26-F129 HydrophobicContact CD2-CE1 4.34Å; L26-F129 HydrophobicContact CD2-CZ 4Å
27	D	96.5	Very high	96.6	Very high	37 Å²	37	24.8 Å²	24.8	20%	0.198	15%	0.146	C	C	.	.	H	α-helix	trans	-59.6	-43.3	-179.9	62	-46.3	0	0	0	113	R25 G31 W46 F354	R25-D27 VanDerWaalsContact C-N 3.29Å; R25-D27 IonicContact CZ-OD1 2.79Å; R25-D27 IonicContact CZ-OD2 3.6Å; R25-D27 IonicContact NE-OD1 2.77Å; R25-D27 PolarHBondContact NE-OD1 3.49Å; R25-D27 IonicContact NE-OD2 4Å; R25-D27 IonicContact NH2-OD1 3.25Å; R25-D27 IonicContact NH2-OD2 2.58Å; R25-D27 PolarHBondContact NH2-OD2 3.09Å; R25-D27 PolarHBondContact O-N 2.86Å; D27-G31 WeakPolarHBondContact O-CA 3.38Å; D27-G31 PolarHBondContact O-N 3.11Å; D27-W46 HydrophobicContact CB-CZ2 4.13Å; D27-F354 WeakPolarHBondContact O-CZ 3.49Å
28	L	97.4	Very high	96.8	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-77.9	-38.5	179.1	-57.5	-177.3	0	0	0	111.9	R25 L26 C32 F156 V159 F354 L357	R25-L28 HydrophobicContact CB-CB 3.98Å; R25-L28 HydrophobicContact CB-CD1 3.94Å; R25-L28 HydrophobicContact CB-CG 3.95Å; R25-L28 HydrophobicContact CG-CD1 4.22Å; R25-L28 PolarHBondContact O-N 2.97Å; L26-L28 PolarHBondContact O-N 2.89Å; L28-C32 WeakPolarHBondContact O-CB 3.27Å; L28-C32 PolarHBondContact O-N 3.36Å; L28-C32 PolarHBondContact O-SG 3.39Å; L28-F156 HydrophobicContact CD1-CD1 4.18Å; L28-F156 HydrophobicContact CD2-CD1 4.27Å; L28-F156 HydrophobicContact CD2-CE1 4.35Å; L28-V159 HydrophobicContact CB-CG2 3.83Å; L28-V159 HydrophobicContact CD1-CG2 3.77Å; L28-V159 HydrophobicContact CG-CG2 4.44Å; L28-F354 HydrophobicContact CD2-CD1 3.77Å; L28-F354 HydrophobicContact CD2-CD2 4.38Å; L28-F354 HydrophobicContact CD2-CE1 3.8Å; L28-F354 HydrophobicContact CD2-CE2 4.4Å; L28-F354 HydrophobicContact CD2-CG 4.08Å; L28-F354 HydrophobicContact CD2-CZ 4.12Å; L28-L357 HydrophobicContact CD2-CD1 3.72Å
29	T	98	Very high	96.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-77.2	-47.9	-174.7	-62	0	0	0	0	111.8	L24 R25 L26 C32 F129 G158 R160 L162	L24-T29 HydrophobicContact CD1-CG2 4.27Å; R25-T29 WeakPolarHBondContact O-CB 3.46Å; R25-T29 PolarHBondContact O-N 3.36Å; R25-T29 PolarHBondContact O-OG1 3.07Å; L26-T29 PolarHBondContact O-N 3.38Å; T29-C32 PolarHBondContact O-SG 3.36Å; T29-F129 HydrophobicContact CG2-CE1 4.43Å; T29-G158 PolarHBondContact OG1-O 2.92Å; T29-R160 WeakPolarHBondContact CG2-O 3.28Å; T29-R160 PolarHBondContact OG1-N 3.17Å; T29-L162 HydrophobicContact CG2-CD2 3.72Å; T29-L162 HydrophobicContact CG2-CG 4.14Å
30	L	97.5	Very high	96.7	Very high	3 Å²	3	26 Å²	26	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-81.8	-23.9	-179.1	-56.4	-178.5	0	0	0	112.2	L26 W38 W46 L57 F129 L162	L26-L30 HydrophobicContact CB-CD1 4.41Å; L26-L30 HydrophobicContact CD2-CD1 3.86Å; L26-L30 HydrophobicContact CD2-CG 4.41Å; L26-L30 VanDerWaalsContact O-CB 3.25Å; L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 WeakPolarHBondContact O-CG 3.39Å; L26-L30 PolarHBondContact O-N 3.01Å; L30-W38 HydrophobicContact CB-CB 4.05Å; L30-W38 HydrophobicContact CB-CG 4.28Å; L30-W38 HydrophobicContact CD1-CB 4.24Å; L30-W38 HydrophobicContact CD1-CD2 3.8Å; L30-W38 HydrophobicContact CD1-CE3 3.87Å; L30-W38 HydrophobicContact CD1-CG 3.97Å; L30-W38 HydrophobicContact CD2-CD2 4.1Å; L30-W38 HydrophobicContact CD2-CG 3.89Å; L30-W38 HydrophobicContact CG-CD2 4.49Å; L30-W38 HydrophobicContact CG-CG 4.27Å; L30-W46 HydrophobicContact CB-CD2 4.15Å; L30-W46 HydrophobicContact CB-CE3 3.66Å; L30-W46 HydrophobicContact CB-CZ3 3.88Å; L30-W46 HydrophobicContact CD1-CB 3.67Å; L30-W46 HydrophobicContact CD1-CD2 4.03Å; L30-W46 HydrophobicContact CD1-CE3 4.1Å; L30-W46 HydrophobicContact CD1-CG 3.84Å; L30-L57 HydrophobicContact CD1-CD1 4.45Å; L30-F129 HydrophobicContact CD2-CE1 3.98Å; L30-F129 HydrophobicContact CD2-CZ 4.22Å; L30-L162 HydrophobicContact CD2-CD1 4.27Å; L30-L162 HydrophobicContact CD2-CD2 4.44Å
31	G	93.9	Very high	96.5	Very high	13 Å²	13	26.3 Å²	26.3	13%	0.134	13%	0.132	C	C	.	.	H	α-helix	trans	-90.1	-6.7	-178.7	0	0	0	0	0	115.9	D27	D27-G31 WeakPolarHBondContact O-CA 3.38Å; D27-G31 PolarHBondContact O-N 3.11Å
32	C	92.8	Very high	96.3	Very high	1 Å²	1	23 Å²	23	1%	0.007	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	6.4	-173.9	65.5	0	0	0	0	115.4	L28 T29 Q34 F347 C348 L351 F354	L28-C32 WeakPolarHBondContact O-CB 3.27Å; L28-C32 PolarHBondContact O-N 3.36Å; L28-C32 PolarHBondContact O-SG 3.39Å; T29-C32 PolarHBondContact O-SG 3.36Å; C32-Q34 PolarHBondContact SG-NE2 3Å; C32-F347 WeakPolarHBondContact O-CE1 3.39Å; C32-C348 HydrophobicContact CB-CB 4.02Å; C32-L351 HydrophobicContact CB-CD1 3.81Å; C32-F354 HydrophobicContact CB-CE2 4.32Å
33	G	93	Very high	96.1	Very high	11 Å²	11	27.6 Å²	27.6	11%	0.113	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	20.7	175.9	0	0	0	0	0	115	F36	G33-F36 WeakPolarHBondContact O-CZ 3.45Å
34	Q	96.5	Very high	95.9	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.019	15%	0.149	C	C	.	.	S	Bend	trans	-71.2	-47	164.9	-69.4	-178.3	55.1	0	0	111.1	C32 R160 M161 L162 Q164 F173 M286	C32-Q34 PolarHBondContact SG-NE2 3Å; Q34-R160 PolarHBondContact NE2-O 3.24Å; Q34-R160 PolarHBondContact OE1-O 2.89Å; Q34-M161 PolarHBondContact OE1-SD 2.93Å; Q34-L162 HydrophobicContact CB-CD1 4.03Å; Q34-L162 HydrophobicContact CB-CG 4.46Å; Q34-Q164 PolarHBondContact O-NE2 2.92Å; Q34-Q164 PolarHBondContact O-OE1 3.4Å; Q34-F173 WeakPolarHBondContact O-CE2 3.17Å; Q34-M286 HydrophobicContact CB-SD 4.17Å; Q34-M286 HydrophobicContact CG-CE 4.18Å; Q34-M286 HydrophobicContact CG-SD 4.29Å
35	S	97.3	Very high	95.8	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.021	15%	0.153	C	C	.	.			trans	-118.5	153.4	172.2	176.7	0	0	0	0	109.5	R37	S35-R37 PolarHBondContact OG-N 2.77Å
36	F	97.8	Very high	95.8	Very high	6 Å²	6	25.7 Å²	25.7	3%	0.026	15%	0.145	C	C	.	.	S	Bend	trans	-113.4	6.5	178.8	-55.9	-74.7	0	0	0	112.6	G33 R39 F173 T176 I181 I184 Q185 V188	G33-F36 WeakPolarHBondContact O-CZ 3.45Å; F36-R39 PolarHBondContact O-NH1 3.36Å; F36-R39 VanDerWaalsContact O-NH1 3.14Å; F36-F173 HydrophobicContact CE2-CE1 4.42Å; F36-F173 HydrophobicContact CE2-CE2 4.4Å; F36-F173 HydrophobicContact CE2-CZ 4.18Å; F36-F173 HydrophobicContact CZ-CE1 4.48Å; F36-F173 HydrophobicContact CZ-CZ 4.47Å; F36-T176 HydrophobicContact CE2-CG2 3.85Å; F36-T176 HydrophobicContact CZ-CG2 3.68Å; F36-I181 HydrophobicContact CE1-CG2 4.4Å; F36-I184 HydrophobicContact CD1-CB 4Å; F36-I184 HydrophobicContact CD1-CG2 3.59Å; F36-I184 HydrophobicContact CD2-CG2 3.86Å; F36-I184 HydrophobicContact CE1-CB 3.93Å; F36-I184 HydrophobicContact CE1-CD1 4.2Å; F36-I184 HydrophobicContact CE1-CG2 3.58Å; F36-I184 HydrophobicContact CE2-CG2 3.84Å; F36-I184 HydrophobicContact CG-CG2 3.73Å; F36-I184 HydrophobicContact CZ-CB 4.44Å; F36-I184 HydrophobicContact CZ-CD1 4.38Å; F36-I184 HydrophobicContact CZ-CG2 3.72Å; F36-Q185 HydrophobicContact CB-CG 4.26Å; F36-Q185 WeakPolarHBondContact O-CG 3.33Å; F36-V188 HydrophobicContact CB-CB 4.17Å; F36-V188 HydrophobicContact CB-CG1 4.38Å; F36-V188 HydrophobicContact CB-CG2 4.09Å; F36-V188 HydrophobicContact CD2-CG2 4.42Å; F36-V188 HydrophobicContact CG-CG2 4.46Å
37	R	97.6	Very high	95.8	Very high	22 Å²	22	25.6 Å²	25.6	8%	0.083	15%	0.145	C	C	.	.	S	Bend	trans	-98.5	1.4	-171.3	-60.3	-66	-69.3	148.1	2.2	114.6	S35 G48 V49 E168 V188 C192 H208	S35-R37 PolarHBondContact OG-N 2.77Å; R37-G48 WeakPolarHBondContact O-CA 3.47Å; R37-V49 VanDerWaalsContact NH2-CB 3.28Å; R37-V49 VanDerWaalsContact NH2-CG2 3.25Å; R37-E168 VanDerWaalsContact CG-OE1 3.24Å; R37-E168 WeakPolarHBondContact CG-OE1 3.36Å; R37-V188 HydrophobicContact CG-CG1 4.48Å; R37-C192 PolarHBondContact NH1-SG 3.21Å; R37-H208 PolarHBondContact NH2-O 3.01Å
38	W	97.9	Very high	95.8	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.008	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	144.9	-179.3	-63.9	88	0	0	0	111.1	L30 W46 T47 M50 W55 L57 Y128	L30-W38 HydrophobicContact CB-CB 4.05Å; L30-W38 HydrophobicContact CB-CG 4.28Å; L30-W38 HydrophobicContact CD1-CB 4.24Å; L30-W38 HydrophobicContact CD1-CD2 3.8Å; L30-W38 HydrophobicContact CD1-CE3 3.87Å; L30-W38 HydrophobicContact CD1-CG 3.97Å; L30-W38 HydrophobicContact CD2-CD2 4.1Å; L30-W38 HydrophobicContact CD2-CG 3.89Å; L30-W38 HydrophobicContact CG-CD2 4.49Å; L30-W38 HydrophobicContact CG-CG 4.27Å; W38-W46 HydrophobicContact CB-CE3 4.11Å; W38-W46 HydrophobicContact CE3-CB 4.2Å; W38-W46 WeakPolarHBondContact CZ3-O 3.41Å; W38-T47 WeakPolarHBondContact CA-O 3.3Å; W38-M50 HydrophobicContact CZ2-CB 4.21Å; W38-W55 HydrophobicContact CH2-CB 3.75Å; W38-W55 HydrophobicContact CH2-CG 4.32Å; W38-W55 HydrophobicContact CZ3-CB 4.08Å; W38-L57 HydrophobicContact CE3-CD1 4.38Å; W38-L57 HydrophobicContact CH2-CD1 3.38Å; W38-L57 HydrophobicContact CH2-CG 3.79Å; W38-L57 HydrophobicContact CZ2-CD1 4.14Å; W38-L57 HydrophobicContact CZ3-CD1 3.54Å; W38-L57 HydrophobicContact CZ3-CG 3.66Å; W38-Y128 HydrophobicContact CZ2-CE1 4.17Å; W38-Y128 AromaticContact NE1-CE1 3.98Å; W38-Y128 AromaticContact NE1-CZ 3.83Å; W38-Y128 PolarHBondContact NE1-OH 3.32Å
39	R	95.8	Very high	95.8	Very high	59 Å²	59	23.9 Å²	23.9	22%	0.223	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.3	173.5	-66.1	-68.5	-178.7	-74.5	-1.8	108.8	F36 T41 W46 T47 Q185 E189	F36-R39 PolarHBondContact O-NH1 3.36Å; F36-R39 VanDerWaalsContact O-NH1 3.14Å; R39-T41 HydrophobicContact CB-CG2 4.03Å; R39-T41 PolarHBondContact O-N 3.37Å; R39-W46 CarbonylContact O-C 3.49Å; R39-W46 VanDerWaalsContact O-CA 3.25Å; R39-W46 WeakPolarHBondContact O-CA 3.43Å; R39-T47 PolarHBondContact N-O 3.44Å; R39-T47 PolarHBondContact O-N 3.46Å; R39-Q185 VanDerWaalsContact CD-NE2 3.31Å; R39-Q185 VanDerWaalsContact CZ-CG 3.45Å; R39-Q185 PolarHBondContact NH2-O 2.92Å; R39-E189 IonicContact CZ-OE2 2.72Å; R39-E189 IonicContact NE-OE2 2.93Å; R39-E189 IonicContact NH2-OE2 3.27Å; R39-E189 PolarHBondContact NH2-OE2 3.31Å
40	E	95.1	Very high	95.7	Very high	94 Å²	94	24.5 Å²	24.5	44%	0.439	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	106.7	164.1	-169.8	166.3	-155.4	0	0	107.8	G42 G44 H45 W46	E40-G42 VanDerWaalsContact CG-O 3.23Å; E40-G42 WeakPolarHBondContact CG-O 3.46Å; E40-G44 PolarHBondContact OE1-N 3.25Å; E40-H45 CarbonylContact C-O 3.57Å; E40-H45 VanDerWaalsContact CA-O 3.28Å; E40-H45 WeakPolarHBondContact CA-O 3.31Å; E40-W46 HydrophobicContact CB-CD2 4.31Å; E40-W46 HydrophobicContact CB-CE3 4.43Å; E40-W46 HydrophobicContact CB-CH2 4.23Å; E40-W46 HydrophobicContact CB-CZ2 4.03Å; E40-W46 HydrophobicContact CB-CZ3 4.42Å; E40-W46 HydrophobicContact CG-CZ2 4.39Å
41	T	94.2	Very high	95.5	Very high	50 Å²	50	27 Å²	27	31%	0.307	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-12.1	-174.9	49.8	0	0	0	0	112.5	R39 H45 T47	R39-T41 HydrophobicContact CB-CG2 4.03Å; R39-T41 PolarHBondContact O-N 3.37Å; T41-H45 PolarHBondContact N-O 3.28Å; T41-H45 PolarHBondContact OG1-O 3.41Å; T41-T47 PolarHBondContact OG1-OG1 3.49Å
42	G	91.8	Very high	95.4	Very high	21 Å²	21	27.9 Å²	27.9	22%	0.216	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	173.2	168.6	0	0	0	0	0	109.3	E40 G44 H45	E40-G42 VanDerWaalsContact CG-O 3.23Å; E40-G42 WeakPolarHBondContact CG-O 3.46Å; G42-G44 PolarHBondContact O-N 2.89Å; G42-H45 PolarHBondContact N-O 2.89Å; G42-H45 PolarHBondContact O-N 2.95Å
43	D	92.4	Very high	95.5	Very high	154 Å²	154	32 Å²	32	82%	0.824	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	112.1	-178.7	-174.1	26.9	0	0	0	111	H45	D43-H45 PolarHBondContact O-N 2.89Å; D43-H45 VanDerWaalsContact O-N 3.15Å; D43-H45 PolarHBondContact O-ND1 3.32Å
44	G	93.9	Very high	95.7	Very high	27 Å²	27	31.6 Å²	31.6	28%	0.278	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	4.3	-174.7	0	0	0	0	0	115.8	E40 G42 T58	E40-G44 PolarHBondContact OE1-N 3.25Å; G42-G44 PolarHBondContact O-N 2.89Å; G44-T58 PolarHBondContact O-OG1 2.91Å
45	H	96.7	Very high	95.7	Very high	21 Å²	21	31.4 Å²	31.4	10%	0.097	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.5	-179.4	-69.3	68.7	0	0	0	110.6	L6 L7 W14 E40 T41 G42 D43 T56 L57	L6-H45 HydrophobicContact CD2-CB 4.38Å; L7-H45 PolarHBondContact N-NE2 2.94Å; W14-H45 AromaticContact CH2-CD2 3.82Å; E40-H45 CarbonylContact C-O 3.57Å; E40-H45 VanDerWaalsContact CA-O 3.28Å; E40-H45 WeakPolarHBondContact CA-O 3.31Å; T41-H45 PolarHBondContact N-O 3.28Å; T41-H45 PolarHBondContact OG1-O 3.41Å; G42-H45 PolarHBondContact N-O 2.89Å; G42-H45 PolarHBondContact O-N 2.95Å; D43-H45 PolarHBondContact O-N 2.89Å; D43-H45 VanDerWaalsContact O-N 3.15Å; D43-H45 PolarHBondContact O-ND1 3.32Å; H45-T56 HydrophobicContact CB-CG2 4.24Å; H45-L57 CarbonylContact C-O 3.46Å; H45-L57 WeakPolarHBondContact CA-O 3.23Å
46	W	97.9	Very high	95.7	Very high	9 Å²	9	31.2 Å²	31.2	3%	0.034	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	113.2	-175.9	-68.5	78.5	0	0	0	110.7	L26 D27 L30 W38 R39 E40 T56 L57	L26-W46 HydrophobicContact CB-CG 4.48Å; D27-W46 HydrophobicContact CB-CZ2 4.13Å; L30-W46 HydrophobicContact CB-CD2 4.15Å; L30-W46 HydrophobicContact CB-CE3 3.66Å; L30-W46 HydrophobicContact CB-CZ3 3.88Å; L30-W46 HydrophobicContact CD1-CB 3.67Å; L30-W46 HydrophobicContact CD1-CD2 4.03Å; L30-W46 HydrophobicContact CD1-CE3 4.1Å; L30-W46 HydrophobicContact CD1-CG 3.84Å; W38-W46 HydrophobicContact CB-CE3 4.11Å; W38-W46 HydrophobicContact CE3-CB 4.2Å; W38-W46 WeakPolarHBondContact CZ3-O 3.41Å; R39-W46 CarbonylContact O-C 3.49Å; R39-W46 VanDerWaalsContact O-CA 3.25Å; R39-W46 WeakPolarHBondContact O-CA 3.43Å; E40-W46 HydrophobicContact CB-CD2 4.31Å; E40-W46 HydrophobicContact CB-CE3 4.43Å; E40-W46 HydrophobicContact CB-CH2 4.23Å; E40-W46 HydrophobicContact CB-CZ2 4.03Å; E40-W46 HydrophobicContact CB-CZ3 4.42Å; E40-W46 HydrophobicContact CG-CZ2 4.39Å; W46-T56 CarbonylContact O-C 3.57Å; W46-T56 WeakPolarHBondContact O-CA 3.48Å; W46-L57 PolarHBondContact N-O 3.46Å; W46-L57 PolarHBondContact O-N 2.93Å
47	T	97.9	Very high	95.7	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.3	175.8	-52.6	0	0	0	0	110.9	H4 W38 R39 T41 V54 W55 T56 L202 Y207	H4-T47 PolarHBondContact CD2-OG1 2.75Å; W38-T47 WeakPolarHBondContact CA-O 3.3Å; R39-T47 PolarHBondContact N-O 3.44Å; R39-T47 PolarHBondContact O-N 3.46Å; T41-T47 PolarHBondContact OG1-OG1 3.49Å; T47-V54 HydrophobicContact CG2-CG1 3.91Å; T47-W55 CarbonylContact C-O 3.03Å; T47-W55 WeakPolarHBondContact CA-O 3.27Å; T47-W55 VanDerWaalsContact CG2-O 3.3Å; T47-W55 WeakPolarHBondContact CG2-O 3.43Å; T47-T56 PolarHBondContact OG1-OG1 2.95Å; T47-L202 HydrophobicContact CG2-CD1 4.14Å; T47-Y207 HydrophobicContact CG2-CE1 3.9Å; T47-Y207 HydrophobicContact CG2-CE2 4.42Å; T47-Y207 WeakPolarHBondContact CG2-OH 3.19Å
48	G	97.4	Very high	95.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	179.6	-179	0	0	0	0	0	113.2	R37 V54 W55	R37-G48 WeakPolarHBondContact O-CA 3.47Å; G48-V54 WeakPolarHBondContact O-CA 3.4Å; G48-W55 PolarHBondContact N-O 3.43Å; G48-W55 PolarHBondContact O-N 3.1Å
49	V	97.4	Very high	95.6	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.4	179.8	-176.6	0	0	0	0	109.8	R37 R53 V54 L199 Y207	R37-V49 VanDerWaalsContact NH2-CB 3.28Å; R37-V49 VanDerWaalsContact NH2-CG2 3.25Å; V49-R53 VanDerWaalsContact CA-O 3.28Å; V49-R53 WeakPolarHBondContact CA-O 3.39Å; V49-V54 HydrophobicContact CG2-CG2 4.26Å; V49-L199 HydrophobicContact CG1-CD1 3.51Å; V49-L199 HydrophobicContact CG2-CD1 4.24Å; V49-Y207 HydrophobicContact CG2-CD1 3.83Å
50	M	95.7	Very high	95.6	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.059	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	132.5	178	179.5	-167.9	71.9	0	0	109	W38 G52 R53 W55 L124 L125 Y128	W38-M50 HydrophobicContact CZ2-CB 4.21Å; M50-G52 VanDerWaalsContact C-N 3.32Å; M50-G52 PolarHBondContact O-N 3.3Å; M50-R53 PolarHBondContact N-O 3.13Å; M50-R53 PolarHBondContact O-N 3.39Å; M50-W55 HydrophobicContact CE-CD2 3.89Å; M50-W55 VanDerWaalsContact CE-CE2 3.4Å; M50-W55 HydrophobicContact CE-CE3 4.33Å; M50-W55 HydrophobicContact CE-CG 4.47Å; M50-W55 HydrophobicContact CE-CH2 3.91Å; M50-W55 HydrophobicContact CE-CZ2 3.44Å; M50-W55 VanDerWaalsContact CE-CZ2 3.44Å; M50-W55 HydrophobicContact CE-CZ3 4.34Å; M50-W55 PolarHBondContact O-NE1 3.14Å; M50-L124 HydrophobicContact CE-CB 4.11Å; M50-L125 HydrophobicContact CE-CD2 3.94Å; M50-L125 HydrophobicContact CE-CG 4.39Å; M50-Y128 HydrophobicContact CG-CD1 4.45Å; M50-Y128 HydrophobicContact CG-CD2 3.84Å; M50-Y128 HydrophobicContact CG-CE2 4.11Å; M50-Y128 HydrophobicContact CG-CG 4.02Å; M50-Y128 WeakPolarHBondContact SD-CB 3.41Å; M50-Y128 HydrophobicContact SD-CD1 3.39Å; M50-Y128 WeakPolarHBondContact SD-CD1 3.48Å; M50-Y128 HydrophobicContact SD-CD2 3.66Å; M50-Y128 HydrophobicContact SD-CE1 4.01Å; M50-Y128 HydrophobicContact SD-CE2 4.24Å; M50-Y128 HydrophobicContact SD-CG 3.17Å
51	G	92.4	Very high	95.5	Very high	57 Å²	57	32.2 Å²	32.2	59%	0.588	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	38.9	176.5	0	0	0	0	0	113.9	R53	G51-R53 VanDerWaalsContact C-N 3.26Å; G51-R53 PolarHBondContact O-N 3.23Å
52	G	92.9	Very high	95.6	Very high	30 Å²	30	34.8 Å²	34.8	31%	0.309	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	19.8	-179.2	0	0	0	0	0	114.6	M50 L199 D209	M50-G52 VanDerWaalsContact C-N 3.32Å; M50-G52 PolarHBondContact O-N 3.3Å; G52-L199 WeakPolarHBondContact O-CD2 3.28Å; G52-D209 WeakPolarHBondContact CA-OD2 3.46Å
53	R	94.1	Very high	95.8	Very high	89 Å²	89	34.9 Å²	34.9	34%	0.336	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151.4	-178	-66.3	173.2	-175	-98.5	-5.2	110.9	V49 M50 G51 W55	V49-R53 VanDerWaalsContact CA-O 3.28Å; V49-R53 WeakPolarHBondContact CA-O 3.39Å; M50-R53 PolarHBondContact N-O 3.13Å; M50-R53 PolarHBondContact O-N 3.39Å; G51-R53 VanDerWaalsContact C-N 3.26Å; G51-R53 PolarHBondContact O-N 3.23Å; R53-W55 PolarHBondContact O-NE1 3Å
54	V	96.5	Very high	96.1	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133.3	169.1	-171.8	0	0	0	0	108.5	T47 G48 V49 T68 Y69 L199 C200 L202 Y207	T47-V54 HydrophobicContact CG2-CG1 3.91Å; G48-V54 WeakPolarHBondContact O-CA 3.4Å; V49-V54 HydrophobicContact CG2-CG2 4.26Å; V54-T68 WeakPolarHBondContact O-CA 3.46Å; V54-Y69 HydrophobicContact CB-CD2 3.86Å; V54-Y69 HydrophobicContact CB-CG 4.47Å; V54-Y69 HydrophobicContact CG1-CD2 3.7Å; V54-Y69 HydrophobicContact CG1-CE2 4.13Å; V54-Y69 WeakPolarHBondContact O-CD2 3.44Å; V54-Y69 PolarHBondContact O-N 2.9Å; V54-L199 HydrophobicContact CG2-CB 3.99Å; V54-L199 HydrophobicContact CG2-CD1 4.06Å; V54-C200 WeakPolarHBondContact CG2-SG 3.07Å; V54-L202 HydrophobicContact CG1-CD1 3.91Å; V54-Y207 HydrophobicContact CG1-CD1 3.95Å; V54-Y207 HydrophobicContact CG1-CD2 4.31Å; V54-Y207 HydrophobicContact CG1-CE1 4.27Å; V54-Y207 HydrophobicContact CG1-CG 3.97Å; V54-Y207 VanDerWaalsContact CG2-CB 3.5Å; V54-Y207 HydrophobicContact CG2-CD1 4.32Å; V54-Y207 HydrophobicContact CG2-CG 3.94Å
55	W	96.9	Very high	96.2	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.5	-178.1	-61	76	0	0	0	109.3	W38 T47 G48 M50 R53 L57 Y66 H67 T68 E121 L124 L125	W38-W55 HydrophobicContact CH2-CB 3.75Å; W38-W55 HydrophobicContact CH2-CG 4.32Å; W38-W55 HydrophobicContact CZ3-CB 4.08Å; T47-W55 CarbonylContact C-O 3.03Å; T47-W55 WeakPolarHBondContact CA-O 3.27Å; T47-W55 VanDerWaalsContact CG2-O 3.3Å; T47-W55 WeakPolarHBondContact CG2-O 3.43Å; G48-W55 PolarHBondContact N-O 3.43Å; G48-W55 PolarHBondContact O-N 3.1Å; M50-W55 HydrophobicContact CE-CD2 3.89Å; M50-W55 VanDerWaalsContact CE-CE2 3.4Å; M50-W55 HydrophobicContact CE-CE3 4.33Å; M50-W55 HydrophobicContact CE-CG 4.47Å; M50-W55 HydrophobicContact CE-CH2 3.91Å; M50-W55 HydrophobicContact CE-CZ2 3.44Å; M50-W55 VanDerWaalsContact CE-CZ2 3.44Å; M50-W55 HydrophobicContact CE-CZ3 4.34Å; M50-W55 PolarHBondContact O-NE1 3.14Å; R53-W55 PolarHBondContact O-NE1 3Å; W55-L57 HydrophobicContact CB-CD2 4.4Å; W55-L57 HydrophobicContact CE3-CD2 4.34Å; W55-Y66 HydrophobicContact CE3-CD2 4.14Å; W55-Y66 AromaticContact CZ3-CD2 3.7Å; W55-Y66 HydrophobicContact CZ3-CD2 3.7Å; W55-Y66 HydrophobicContact CZ3-CE2 4.15Å; W55-Y66 HydrophobicContact CZ3-CG 4.42Å; W55-H67 CarbonylContact C-O 3.47Å; W55-H67 WeakPolarHBondContact CA-O 3.25Å; W55-T68 HydrophobicContact CD2-CG2 3.56Å; W55-T68 HydrophobicContact CE3-CG2 3.29Å; W55-T68 HydrophobicContact CG-CG2 4.38Å; W55-T68 HydrophobicContact CH2-CG2 3.65Å; W55-T68 HydrophobicContact CZ2-CG2 3.87Å; W55-T68 HydrophobicContact CZ3-CG2 3.34Å; W55-E121 HydrophobicContact CH2-CB 3.61Å; W55-E121 HydrophobicContact CH2-CG 3.83Å; W55-E121 HydrophobicContact CZ3-CB 4.1Å; W55-E121 HydrophobicContact CZ3-CG 4.47Å; W55-L124 HydrophobicContact CH2-CB 4.48Å; W55-L124 HydrophobicContact CZ2-CB 4.46Å; W55-L124 HydrophobicContact CZ2-CD1 4.09Å; W55-L125 HydrophobicContact CE3-CD1 4.47Å; W55-L125 HydrophobicContact CE3-CD2 4.2Å; W55-L125 HydrophobicContact CE3-CG 4.42Å; W55-L125 HydrophobicContact CH2-CG 4.25Å; W55-L125 HydrophobicContact CZ3-CD1 3.82Å; W55-L125 HydrophobicContact CZ3-CD2 4.08Å; W55-L125 HydrophobicContact CZ3-CG 3.81Å
56	T	97.3	Very high	96.1	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.2	156.5	-58	0	0	0	0	108.6	W14 H45 W46 T47 Y66 H67 Y69	W14-T56 HydrophobicContact CH2-CG2 3.83Å; H45-T56 HydrophobicContact CB-CG2 4.24Å; W46-T56 CarbonylContact O-C 3.57Å; W46-T56 WeakPolarHBondContact O-CA 3.48Å; T47-T56 PolarHBondContact OG1-OG1 2.95Å; T56-Y66 CarbonylContact O-C 3.56Å; T56-Y66 VanDerWaalsContact O-CA 3.3Å; T56-Y66 WeakPolarHBondContact O-CA 3.28Å; T56-H67 PolarHBondContact N-O 3.29Å; T56-H67 PolarHBondContact O-N 3.02Å; T56-Y69 VanDerWaalsContact OG1-CE2 3.28Å; T56-Y69 WeakPolarHBondContact OG1-CE2 3.31Å; T56-Y69 PolarHBondContact OG1-OH 2.88Å
57	L	97.8	Very high	95.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140	-178.4	-53.6	-179.4	0	0	0	109.7	L26 L30 W38 H45 W46 W55 L64 W65 Y66 L125 F129	L26-L57 HydrophobicContact CD1-CB 3.92Å; L26-L57 HydrophobicContact CD2-CB 4.24Å; L26-L57 HydrophobicContact CD2-CD1 4.07Å; L30-L57 HydrophobicContact CD1-CD1 4.45Å; W38-L57 HydrophobicContact CE3-CD1 4.38Å; W38-L57 HydrophobicContact CH2-CD1 3.38Å; W38-L57 HydrophobicContact CH2-CG 3.79Å; W38-L57 HydrophobicContact CZ2-CD1 4.14Å; W38-L57 HydrophobicContact CZ3-CD1 3.54Å; W38-L57 HydrophobicContact CZ3-CG 3.66Å; H45-L57 CarbonylContact C-O 3.46Å; H45-L57 WeakPolarHBondContact CA-O 3.23Å; W46-L57 PolarHBondContact N-O 3.46Å; W46-L57 PolarHBondContact O-N 2.93Å; W55-L57 HydrophobicContact CB-CD2 4.4Å; W55-L57 HydrophobicContact CE3-CD2 4.34Å; L57-L64 HydrophobicContact CB-CD1 4.43Å; L57-W65 WeakPolarHBondContact CA-O 3.49Å; L57-Y66 VanDerWaalsContact CD2-CB 3.44Å; L57-L125 HydrophobicContact CD2-CD2 4.04Å; L57-F129 HydrophobicContact CD1-CE2 3.71Å; L57-F129 HydrophobicContact CD1-CZ 3.57Å
58	T	97.4	Very high	95.7	Very high	12 Å²	12	28.6 Å²	28.6	7%	0.074	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	168	168.6	-171	0	0	0	0	109.1	L7 W14 G44 W65	L7-T58 HydrophobicContact CB-CG2 4.14Å; L7-T58 HydrophobicContact CD2-CG2 4.07Å; W14-T58 HydrophobicContact CH2-CG2 3.94Å; W14-T58 HydrophobicContact CZ3-CG2 3.78Å; G44-T58 PolarHBondContact O-OG1 2.91Å; T58-W65 HydrophobicContact CG2-CB 3.75Å; T58-W65 HydrophobicContact CG2-CG 4.5Å; T58-W65 PolarHBondContact N-O 3.26Å; T58-W65 PolarHBondContact O-N 3.45Å; T58-W65 VanDerWaalsContact O-O 3.07Å
59	Q	96.6	Very high	95.4	Very high	28 Å²	28	30 Å²	30	13%	0.131	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	138.9	-174.3	67	-174.5	13.1	0	0	112.9	R21 L24 L26 T63	R21-Q59 PolarHBondContact NH2-O 3.47Å; L24-Q59 PolarHBondContact O-OE1 2.78Å; L24-Q59 VanDerWaalsContact O-OE1 3.09Å; L26-Q59 HydrophobicContact CD1-CB 4.09Å; L26-Q59 HydrophobicContact CD1-CG 4.12Å; L26-Q59 HydrophobicContact CG-CG 4.43Å; L26-Q59 VanDerWaalsContact N-OE1 3.13Å; Q59-T63 VanDerWaalsContact CA-O 3.31Å; Q59-T63 WeakPolarHBondContact CA-O 3.3Å
60	T	95.1	Very high	94.2	Very high	54 Å²	54	35.7 Å²	35.7	33%	0.331	20%	0.202	S	C	.	.			trans	-86.7	-160.9	160.7	60.1	0	0	0	0	109	R21 D62 T63	R21-T60 WeakPolarHBondContact CG-O 3.38Å; R21-T60 PolarHBondContact NE-O 3.35Å; T60-D62 PolarHBondContact OG1-OD1 2.93Å; T60-T63 PolarHBondContact N-O 3.15Å; T60-T63 VanDerWaalsContact OG1-CB 3.25Å; T60-T63 WeakPolarHBondContact OG1-CB 3.39Å; T60-T63 PolarHBondContact OG1-N 3.05Å; T60-T63 PolarHBondContact OG1-O 3.43Å
61	D	93.9	Very high	92.2	Very high	110 Å²	110	38 Å²	38	59%	0.588	22%	0.219	S	C	*	.	S	Bend	trans	-76.1	-28.4	178.5	-73.4	-26.9	0	0	0	113.3	S20 R21	S20-D61 CarbonylContact C-O 3.58Å; S20-D61 WeakPolarHBondContact CA-O 3.4Å; R21-D61 VanDerWaalsContact CD-OD1 3.3Å; R21-D61 WeakPolarHBondContact CD-OD1 3.43Å; R21-D61 IonicContact CZ-OD1 3.23Å; R21-D61 VanDerWaalsContact CZ-OD1 3.23Å; R21-D61 PolarHBondContact N-O 3.4Å; R21-D61 IonicContact NE-OD1 2.84Å; R21-D61 PolarHBondContact NE-OD1 2.9Å; R21-D61 IonicContact NH1-OD1 2.88Å; R21-D61 PolarHBondContact NH1-OD1 2.97Å
62	D	96.1	Very high	89.7	Confident	103 Å²	103	40.6 Å²	40.6	55%	0.551	23%	0.226	S	C	*	.	S	Bend	trans	-124.8	-4.5	-173.1	66.5	-10.7	0	0	0	114.4	C19 T60	C19-D62 CarbonylContact C-O 3.56Å; C19-D62 VanDerWaalsContact C-O 3.24Å; C19-D62 PolarHBondContact N-O 3.08Å; C19-D62 CarbonylContact O-C 3.49Å; T60-D62 PolarHBondContact OG1-OD1 2.93Å
63	T	96.5	Very high	87	Confident	24 Å²	24	45.7 Å²	45.7	15%	0.147	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	130.2	-170.8	-52.1	0	0	0	0	111.7	C19 Q59 T60 W65	C19-T63 PolarHBondContact O-N 3.41Å; Q59-T63 VanDerWaalsContact CA-O 3.31Å; Q59-T63 WeakPolarHBondContact CA-O 3.3Å; T60-T63 PolarHBondContact N-O 3.15Å; T60-T63 VanDerWaalsContact OG1-CB 3.25Å; T60-T63 WeakPolarHBondContact OG1-CB 3.39Å; T60-T63 PolarHBondContact OG1-N 3.05Å; T60-T63 PolarHBondContact OG1-O 3.43Å; T63-W65 HydrophobicContact CG2-CD2 4.28Å; T63-W65 HydrophobicContact CG2-CG 4.43Å; T63-W65 HydrophobicContact CG2-CZ2 4.1Å
64	L	97.5	Very high	84.1	Confident	1 Å²	1	48 Å²	48	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	121.8	165.3	175.1	67	0	0	0	108.9	S16 L17 C19 L24 L26 L57 F129	S16-L64 CarbonylContact C-O 3.54Å; S16-L64 VanDerWaalsContact CA-O 3.27Å; S16-L64 WeakPolarHBondContact CA-O 3.47Å; L17-L64 PolarHBondContact N-O 3.47Å; L17-L64 PolarHBondContact O-N 2.94Å; C19-L64 HydrophobicContact CB-CB 3.91Å; L24-L64 HydrophobicContact CD2-CD1 4.18Å; L24-L64 HydrophobicContact CD2-CD2 4.03Å; L26-L64 HydrophobicContact CD1-CD1 3.9Å; L26-L64 HydrophobicContact CD2-CD1 4.03Å; L26-L64 HydrophobicContact CG-CD1 4.24Å; L57-L64 HydrophobicContact CB-CD1 4.43Å; L64-F129 HydrophobicContact CD2-CE2 4.49Å
65	W	96.3	Very high	81	Confident	34 Å²	34	56 Å²	56	13%	0.129	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	140	175.2	-63.9	86.9	0	0	0	110.1	L7 W14 R15 L57 T58 T63	L7-W65 HydrophobicContact CD1-CD2 4.22Å; L7-W65 HydrophobicContact CD1-CE3 4.06Å; L7-W65 HydrophobicContact CD1-CG 4.46Å; L7-W65 HydrophobicContact CD2-CB 4.48Å; L7-W65 HydrophobicContact CD2-CD2 4.19Å; L7-W65 HydrophobicContact CD2-CG 4.01Å; W14-W65 HydrophobicContact CB-CE3 4.26Å; W14-W65 HydrophobicContact CE3-CB 3.91Å; W14-W65 HydrophobicContact CZ3-CB 4.19Å; R15-W65 CarbonylContact O-C 3.07Å; R15-W65 WeakPolarHBondContact O-CA 3.48Å; L57-W65 WeakPolarHBondContact CA-O 3.49Å; T58-W65 HydrophobicContact CG2-CB 3.75Å; T58-W65 HydrophobicContact CG2-CG 4.5Å; T58-W65 PolarHBondContact N-O 3.26Å; T58-W65 PolarHBondContact O-N 3.45Å; T58-W65 VanDerWaalsContact O-O 3.07Å; T63-W65 HydrophobicContact CG2-CD2 4.28Å; T63-W65 HydrophobicContact CG2-CG 4.43Å; T63-W65 HydrophobicContact CG2-CZ2 4.1Å
66	Y	95.4	Very high	77.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	149.8	179.7	65.8	-85.1	0	0	0	113	W14 R15 W55 T56 L57 E121 L125	W14-Y66 VanDerWaalsContact CE3-C 3.41Å; R15-Y66 HydrophobicContact CB-CD1 4.13Å; R15-Y66 HydrophobicContact CB-CD2 4.05Å; R15-Y66 HydrophobicContact CB-CE1 3.61Å; R15-Y66 HydrophobicContact CB-CE2 3.52Å; R15-Y66 HydrophobicContact CB-CG 4.33Å; R15-Y66 HydrophobicContact CG-CE2 4.2Å; R15-Y66 PolarHBondContact N-O 2.8Å; R15-Y66 WeakPolarHBondContact O-CD1 3.48Å; R15-Y66 PolarHBondContact O-N 3.49Å; W55-Y66 HydrophobicContact CE3-CD2 4.14Å; W55-Y66 AromaticContact CZ3-CD2 3.7Å; W55-Y66 HydrophobicContact CZ3-CD2 3.7Å; W55-Y66 HydrophobicContact CZ3-CE2 4.15Å; W55-Y66 HydrophobicContact CZ3-CG 4.42Å; T56-Y66 CarbonylContact O-C 3.56Å; T56-Y66 VanDerWaalsContact O-CA 3.3Å; T56-Y66 WeakPolarHBondContact O-CA 3.28Å; L57-Y66 VanDerWaalsContact CD2-CB 3.44Å; Y66-E121 HydrophobicContact CE2-CB 4.03Å; Y66-E121 WeakPolarHBondContact CE2-OE2 3.41Å; Y66-L125 HydrophobicContact CD1-CD1 3.49Å; Y66-L125 VanDerWaalsContact CD1-CD1 3.49Å; Y66-L125 HydrophobicContact CD2-CD1 3.9Å; Y66-L125 HydrophobicContact CE1-CD1 3.75Å; Y66-L125 HydrophobicContact CE2-CD1 4.11Å; Y66-L125 HydrophobicContact CG-CD1 3.57Å
67	H	93.9	Very high	74.6	Confident	34 Å²	34	63.5 Å²	63.5	16%	0.157	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134.8	171.2	-178.8	49.9	0	0	0	109.5	A5 S13 W14 W55 T56 Y69	A5-H67 HydrophobicContact CB-CB 4.42Å; A5-H67 VanDerWaalsContact CB-CD2 3.49Å; A5-H67 WeakPolarHBondContact CB-CD2 3.31Å; S13-H67 PolarHBondContact O-ND1 3.25Å; W14-H67 HydrophobicContact CD2-CB 4.01Å; W14-H67 HydrophobicContact CE3-CB 3.98Å; W14-H67 HydrophobicContact CH2-CB 4.36Å; W14-H67 HydrophobicContact CZ2-CB 4.38Å; W14-H67 HydrophobicContact CZ3-CB 4.16Å; W55-H67 CarbonylContact C-O 3.47Å; W55-H67 WeakPolarHBondContact CA-O 3.25Å; T56-H67 PolarHBondContact N-O 3.29Å; T56-H67 PolarHBondContact O-N 3.02Å; H67-Y69 AromaticContact CD2-CE1 3.79Å; H67-Y69 AromaticContact CD2-CZ 3.76Å; H67-Y69 AromaticContact NE2-CE1 3.89Å
68	T	92.9	Very high	71.3	Confident	10 Å²	10	68.8 Å²	68.8	6%	0.061	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.7	175.9	52.9	0	0	0	0	110.5	V54 W55 E121	V54-T68 WeakPolarHBondContact O-CA 3.46Å; W55-T68 HydrophobicContact CD2-CG2 3.56Å; W55-T68 HydrophobicContact CE3-CG2 3.29Å; W55-T68 HydrophobicContact CG-CG2 4.38Å; W55-T68 HydrophobicContact CH2-CG2 3.65Å; W55-T68 HydrophobicContact CZ2-CG2 3.87Å; W55-T68 HydrophobicContact CZ3-CG2 3.34Å; T68-E121 WeakPolarHBondContact CB-OE1 3.32Å; T68-E121 HydrophobicContact CG2-CG 4.29Å; T68-E121 WeakPolarHBondContact CG2-OE1 3.3Å; T68-E121 PolarHBondContact OG1-OE1 3.35Å; T68-E121 PolarHBondContact OG1-OE2 3.15Å
69	Y	90.4	Very high	68.3	Low	29 Å²	29	72 Å²	72	11%	0.114	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.3	173.4	-53.7	-94.2	0	0	0	107.9	Q3 A5 V54 T56 H67 S71 L202	Q3-Y69 WeakPolarHBondContact O-CE1 3.36Å; A5-Y69 WeakPolarHBondContact CB-OH 3.25Å; A5-Y69 PolarHBondContact N-OH 3.46Å; V54-Y69 HydrophobicContact CB-CD2 3.86Å; V54-Y69 HydrophobicContact CB-CG 4.47Å; V54-Y69 HydrophobicContact CG1-CD2 3.7Å; V54-Y69 HydrophobicContact CG1-CE2 4.13Å; V54-Y69 WeakPolarHBondContact O-CD2 3.44Å; V54-Y69 PolarHBondContact O-N 2.9Å; T56-Y69 VanDerWaalsContact OG1-CE2 3.28Å; T56-Y69 WeakPolarHBondContact OG1-CE2 3.31Å; T56-Y69 PolarHBondContact OG1-OH 2.88Å; H67-Y69 AromaticContact CD2-CE1 3.79Å; H67-Y69 AromaticContact CD2-CZ 3.76Å; H67-Y69 AromaticContact NE2-CE1 3.89Å; Y69-S71 PolarHBondContact O-N 3.31Å; Y69-L202 HydrophobicContact CD1-CD1 4.11Å; Y69-L202 HydrophobicContact CD1-CD2 3.49Å; Y69-L202 VanDerWaalsContact CD1-CD2 3.49Å; Y69-L202 HydrophobicContact CD1-CG 4.45Å; Y69-L202 HydrophobicContact CD2-CD1 3.87Å; Y69-L202 HydrophobicContact CE1-CD1 3.81Å; Y69-L202 HydrophobicContact CE1-CD2 3.58Å; Y69-L202 HydrophobicContact CE1-CG 4.37Å; Y69-L202 HydrophobicContact CE2-CD1 3.57Å; Y69-L202 HydrophobicContact CG-CD1 4.13Å; Y69-L202 HydrophobicContact CG-CD2 4.04Å
70	N	73.6	Confident	65.1	Low	121 Å²	121	80.2 Å²	80.2	65%	0.647	48%	0.48	S	S	*	.			trans	-66.2	128	173.4	-76.3	-26.7	0	0	0	109.3
71	S	53.4	Low	62.3	Low	62 Å²	62	87.7 Å²	87.7	43%	0.434	51%	0.508	S	S	.	.			trans	-63.6	130.6	162.5	-168.1	0	0	0	0	107.4	Y69 N73 L199	Y69-S71 PolarHBondContact O-N 3.31Å; S71-N73 PolarHBondContact O-N 3.27Å; S71-L199 PolarHBondContact OG-O 2.64Å
72	P	39.4	Very low	59.1	Low	111 Å²	111	94 Å²	94	72%	0.721	52%	0.523	S	S	*	.			trans	-59.6	113.6	172.5	23.3	-29.9	0	0	0	108	T74	P72-T74 PolarHBondContact O-N 3.2Å
73	N	35.8	Very low	55.8	Low	137 Å²	137	100.9 Å²	100.9	73%	0.733	54%	0.541	S	S	*	.			trans	3.6	107.7	172.1	-85.9	-14.4	0	0	0	115	S71 M75	S71-N73 PolarHBondContact O-N 3.27Å; N73-M75 PolarHBondContact O-N 3.37Å
74	T	32.6	Very low	52.5	Low	137 Å²	137	104.9 Å²	104.9	84%	0.84	58%	0.577	S	S	*	*			trans	-57.8	94.8	139.8	31.7	0	0	0	0	106.5	P72 G76	P72-T74 PolarHBondContact O-N 3.2Å; T74-G76 PolarHBondContact O-N 3.15Å
75	M	32.4	Very low	49.1	Very low	170 Å²	170	108.4 Å²	108.4	84%	0.837	61%	0.614	S	S	*	*			trans	-48.8	111	171.1	-81.4	-78.7	-153.3	0	0	107.8	N73 G77	N73-M75 PolarHBondContact O-N 3.37Å; M75-G77 PolarHBondContact O-N 3.06Å
76	G	31.1	Very low	45.7	Very low	70 Å²	70	111.9 Å²	111.9	72%	0.722	64%	0.643	S	S	*	*			trans	-54.4	126.5	170.7	0	0	0	0	0	109.2	T74 D78	T74-G76 PolarHBondContact O-N 3.15Å; G76-D78 PolarHBondContact O-N 2.99Å
77	G	29.3	Very low	42.3	Very low	86 Å²	86	118.6 Å²	118.6	89%	0.887	68%	0.678	S	S	*	*			trans	-65.6	81.6	161.3	0	0	0	0	0	109.1	M75 G79	M75-G77 PolarHBondContact O-N 3.06Å; G77-G79 PolarHBondContact O-N 3.2Å
78	D	28.6	Very low	39.1	Very low	112 Å²	112	124.2 Å²	124.2	60%	0.599	71%	0.709	S	S	*	*			trans	-79.6	98.7	159.8	-170.9	13.8	0	0	0	107.2	G76 R80	G76-D78 PolarHBondContact O-N 2.99Å; D78-R80 PolarHBondContact O-N 3.24Å; D78-R80 IonicContact OD2-CZ 2.62Å; D78-R80 IonicContact OD2-NE 3.14Å; D78-R80 IonicContact OD2-NH1 3.53Å
79	G	32.9	Very low	35.8	Very low	79 Å²	79	132.8 Å²	132.8	81%	0.814	75%	0.748	S	S	*	*			trans	-64.9	78.9	170.7	0	0	0	0	0	110.8	G77	G77-G79 PolarHBondContact O-N 3.2Å
80	R	29.5	Very low	32.7	Very low	200 Å²	200	134.9 Å²	134.9	76%	0.755	78%	0.778	S	S	*	*			trans	-101.1	100.6	164.4	-88.7	176.9	171.5	156.3	-4.1	110.3	D78 R82	D78-R80 PolarHBondContact O-N 3.24Å; D78-R80 IonicContact OD2-CZ 2.62Å; D78-R80 IonicContact OD2-NE 3.14Å; D78-R80 IonicContact OD2-NH1 3.53Å; R80-R82 PolarHBondContact O-N 2.97Å; R80-R82 VanDerWaalsContact O-N 3.13Å
81	K	36.4	Very low	30.3	Very low	212 Å²	212	134.7 Å²	134.7	92%	0.922	79%	0.786	S	S	*	*			trans	-34.9	115.5	157.4	-78.1	176.2	179.8	175	0	110
82	R	26.7	Very low	29	Very low	243 Å²	243	141.9 Å²	141.9	92%	0.917	81%	0.81	S	S	*	*			trans	-118.7	112.2	157	-85.1	-175	129.5	172.1	-3.4	109.2	R80	R80-R82 PolarHBondContact O-N 2.97Å; R80-R82 VanDerWaalsContact O-N 3.13Å
83	R	27.6	Very low	28.3	Very low	246 Å²	246	140.4 Å²	140.4	93%	0.928	82%	0.815	S	S	*	*			trans	-52.9	142	169.3	-79.9	174.5	163.1	175.8	-6	110.1
84	A	26.6	Very low	27.7	Very low	109 Å²	109	139.9 Å²	139.9	90%	0.901	82%	0.822	S	S	*	*			trans	-56.9	141.6	165.8	0	0	0	0	0	111.4
85	G	26.3	Very low	27.3	Very low	75 Å²	75	136.6 Å²	136.6	77%	0.773	82%	0.815	S	S	*	*			trans	-171.7	76.2	178.7	0	0	0	0	0	112.4
86	S	24.7	Very low	27	Very low	106 Å²	106	138.7 Å²	138.7	74%	0.741	82%	0.82	S	S	*	*			trans	23.9	122.7	141.1	-136.6	0	0	0	0	121.8
87	L	24.7	Very low	26.9	Very low	142 Å²	142	147.2 Å²	147.2	74%	0.743	83%	0.83	S	S	*	*				63.9	115.8	125.2	-96.3	146.5	0	0	0	122.1
88	L	26	Very low	26.8	Very low	151 Å²	151	149 Å²	149	79%	0.791	83%	0.828	S	S	*	*				146.8	142.7	115.8	-81.6	162.8	0	0	0	116.1
89	Q	24.9	Very low	26.7	Very low	191 Å²	191	154 Å²	154	89%	0.893	85%	0.845	S	S	*	*			trans	-49.3	158.6	177.5	-76.8	159	-6.6	0	0	118.4
90	G	23.4	Very low	26.4	Very low	72 Å²	72	153.5 Å²	153.5	74%	0.742	84%	0.839	S	S	*	*			trans	141.7	102.9	131.3	0	0	0	0	0	120
91	S	24.3	Very low	26.3	Very low	117 Å²	117	150.6 Å²	150.6	82%	0.818	84%	0.844	S	S	*	*			trans	69.8	117.3	134.6	-65.2	0	0	0	0	125.3
92	K	24.9	Very low	25.9	Very low	213 Å²	213	148 Å²	148	93%	0.926	84%	0.838	S	S	*	*				46.8	132.4	128.1	-69	-174.2	176.9	179.7	0	122.6
93	G	24.9	Very low	25.9	Very low	80 Å²	80	144.1 Å²	144.1	83%	0.825	83%	0.83	S	S	*	*			trans	-178.1	127.1	151.2	0	0	0	0	0	114.8
94	S	23.8	Very low	25.7	Very low	127 Å²	127	139 Å²	139	89%	0.888	83%	0.826	S	S	*	*			trans	-49.7	159	175.8	57.9	0	0	0	0	115.1
95	G	23.7	Very low	25.7	Very low	67 Å²	67	142.3 Å²	142.3	69%	0.691	82%	0.82	S	S	*	*			cis	136.5	131.9	22.7	0	0	0	0	0	107.7
96	K	27.3	Very low	25.7	Very low	215 Å²	215	147.6 Å²	147.6	94%	0.935	83%	0.825	S	S	*	*			trans	175.9	127.4	147.8	-104.2	170	-179.2	177.3	0	111.5
97	R	28	Very low	26	Very low	249 Å²	249	151 Å²	151	94%	0.94	83%	0.829	S	S	*	*			trans	-72.9	135.5	166.1	-87	172	159.4	171.5	-6	109.4
98	S	26.8	Very low	26.3	Very low	122 Å²	122	153.3 Å²	153.3	85%	0.853	84%	0.836	S	S	*	*			trans	-134.5	118.6	154.2	-69.1	0	0	0	0	108.8
99	K	28.4	Very low	26.6	Very low	219 Å²	219	156 Å²	156	95%	0.952	84%	0.844	S	S	*	*			trans	-72.2	124	167.1	-82.4	177.8	169.1	-178.8	0	107.7
100	G	25.8	Very low	26.9	Very low	67 Å²	67	149.8 Å²	149.8	69%	0.691	83%	0.832	S	S	*	*			trans	-125.3	116.3	167	0	0	0	0	0	108.6
101	V	26.9	Very low	27.5	Very low	140 Å²	140	154.6 Å²	154.6	85%	0.848	84%	0.835	S	S	*	*			trans	-65.9	126.8	171.4	174.7	0	0	0	0	107.5
102	I	29.2	Very low	28.1	Very low	156 Å²	156	152.8 Å²	152.8	80%	0.8	82%	0.821	S	S	*	*			trans	-99.5	110	171.2	-61.2	176.7	0	0	0	106.6
103	E	24.8	Very low	28.9	Very low	162 Å²	162	148.2 Å²	148.2	76%	0.757	81%	0.81	S	S	*	*			trans	-60.6	128.8	166.6	-76.4	175.6	150.9	0	0	109.6	K105	E103-K105 PolarHBondContact O-N 3.43Å
104	V	25.3	Very low	29.8	Very low	138 Å²	138	146.5 Å²	146.5	84%	0.836	79%	0.789	S	S	*	*			trans	-70.9	106.5	169.1	179.9	0	0	0	0	106.8
105	K	25.7	Very low	31.1	Very low	180 Å²	180	143.3 Å²	143.3	78%	0.783	76%	0.764	S	S	*	*			trans	-90.8	115.6	162	-82	-174.6	173.9	-177.3	0	107.7	E103 E107	E103-K105 PolarHBondContact O-N 3.43Å; K105-E107 PolarHBondContact O-N 3.36Å
106	E	26.6	Very low	32.3	Very low	186 Å²	186	145.7 Å²	145.7	87%	0.869	77%	0.765	S	S	*	*			trans	-53.6	121	166.9	-66	172.4	158.1	0	0	108.3
107	E	31	Very low	33.5	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	74%	0.738	S	S	*	*			trans	-82.1	114.4	171.3	-72.7	-168.7	160.6	0	0	107.9	K105	K105-E107 PolarHBondContact O-N 3.36Å
108	E	31.1	Very low	35.4	Very low	191 Å²	191	129.4 Å²	129.4	89%	0.893	71%	0.71	S	S	*	*			trans	-58	137.9	169.7	-72.6	-172.7	145.7	0	0	111.1	G110	E108-G110 PolarHBondContact O-N 3.21Å
109	E	31.4	Very low	37.9	Very low	207 Å²	207	133.1 Å²	133.1	97%	0.967	71%	0.705	S	S	*	*			trans	-63	94.2	170.8	-70.4	-169.8	153.7	0	0	110.3
110	G	32.1	Very low	40.7	Very low	62 Å²	62	129.6 Å²	129.6	64%	0.639	69%	0.689	S	S	*	*			trans	-85.5	141.7	172.1	0	0	0	0	0	112.6	E108	E108-G110 PolarHBondContact O-N 3.21Å
111	E	35.4	Very low	43.8	Very low	173 Å²	173	126.5 Å²	126.5	81%	0.808	66%	0.657	S	S	*	*			trans	-53.1	153.6	174.6	-71.9	-172.1	156.1	0	0	113.2	V113	E111-V113 PolarHBondContact O-N 3.08Å
112	P	36.9	Very low	47	Very low	79 Å²	79	122.8 Å²	122.8	51%	0.513	63%	0.631	S	S	.	*			trans	-61.3	103	180	-16.5	28.5	0	0	0	112.2	T11 A114	T11-P112 HydrophobicContact CG2-CB 3.52Å; T11-P112 HydrophobicContact CG2-CG 3.88Å; P112-A114 PolarHBondContact O-N 3.27Å
113	V	41.4	Very low	50.1	Low	116 Å²	116	121 Å²	121	70%	0.703	62%	0.619	S	S	*	*			trans	-86.4	105.4	168.7	-175.7	0	0	0	0	108.3	E111 V115	E111-V113 PolarHBondContact O-N 3.08Å; V113-V115 PolarHBondContact O-N 3.13Å
114	A	43.6	Very low	53.5	Low	45 Å²	45	116.3 Å²	116.3	37%	0.372	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-57.6	122.2	174.2	0	0	0	0	0	110.3	P112	P112-A114 PolarHBondContact O-N 3.27Å
115	V	52.3	Low	56.9	Low	60 Å²	60	109.8 Å²	109.8	36%	0.364	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-66.7	138	169.9	179.5	0	0	0	0	108.2	K12 V113	K12-V115 VanDerWaalsContact O-CG2 3.3Å; K12-V115 WeakPolarHBondContact O-CG2 3.4Å; V113-V115 PolarHBondContact O-N 3.13Å
116	T	48.2	Very low	60.4	Low	117 Å²	117	102.8 Å²	102.8	72%	0.718	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-53.4	136.7	-179.9	44.3	0	0	0	0	111.2	D118	T116-D118 PolarHBondContact O-N 2.92Å
117	P	53.1	Low	63.7	Low	56 Å²	56	97.3 Å²	97.3	36%	0.364	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-58.8	135.6	-178.3	-22.2	31.3	0	0	0	111.4	R119 E122	P117-R119 PolarHBondContact O-N 2.71Å; P117-E122 HydrophobicContact CB-CB 4.34Å; P117-E122 VanDerWaalsContact CB-OE2 3.25Å; P117-E122 WeakPolarHBondContact CB-OE2 3.46Å; P117-E122 WeakPolarHBondContact CG-OE2 3.39Å
118	D	67.2	Low	67	Low	65 Å²	65	89.6 Å²	89.6	35%	0.348	47%	0.47	S	S	.	.			trans	-67.7	112.6	155.7	-176.2	-16.7	0	0	0	106.2	T116 K120 E121 E122	T116-D118 PolarHBondContact O-N 2.92Å; D118-K120 PolarHBondContact O-N 3.03Å; D118-K120 PolarHBondContact OD1-N 3.45Å; D118-E121 HydrophobicContact CB-CB 4.42Å; D118-E121 HydrophobicContact CB-CG 4.17Å; D118-E121 PolarHBondContact O-N 2.88Å; D118-E122 PolarHBondContact O-N 3.14Å
119	R	78.7	Confident	70.2	Confident	201 Å²	201	80.5 Å²	80.5	76%	0.758	43%	0.428	S	S	*	.	H	α-helix	trans	-48.2	-33.3	-175.8	-127	-177.3	-170.6	-178.1	1.7	112.5	P117 E123	P117-R119 PolarHBondContact O-N 2.71Å; R119-E123 WeakPolarHBondContact O-CB 3.38Å; R119-E123 WeakPolarHBondContact O-CG 3.26Å; R119-E123 PolarHBondContact O-N 3.29Å
120	K	87.7	Confident	73.4	Confident	144 Å²	144	72.2 Å²	72.2	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-70.1	-37.6	179.7	-66	-179.4	-180	177.9	0	113.2	D118 L124	D118-K120 PolarHBondContact O-N 3.03Å; D118-K120 PolarHBondContact OD1-N 3.45Å; K120-L124 VanDerWaalsContact O-CG 3.29Å; K120-L124 WeakPolarHBondContact O-CG 3.47Å; K120-L124 PolarHBondContact O-N 2.89Å; K120-L124 VanDerWaalsContact O-N 3.08Å
121	E	91.8	Very high	76.5	Confident	3 Å²	3	70.7 Å²	70.7	1%	0.014	37%	0.366	C	S	.	.	H	α-helix	trans	-72.2	-40.7	-179.9	-70.6	-177.4	177.1	0	0	111.4	R15 W55 Y66 T68 D118 L124 L125	R15-E121 IonicContact CZ-OE2 3.31Å; R15-E121 IonicContact NE-OE2 2.71Å; R15-E121 IonicContact NH1-OE1 3.23Å; R15-E121 PolarHBondContact NH1-OE1 3.31Å; R15-E121 VanDerWaalsContact NH1-OE1 3.09Å; R15-E121 IonicContact NH1-OE2 3.64Å; R15-E121 PolarHBondContact NH1-OE2 3.12Å; W55-E121 HydrophobicContact CH2-CB 3.61Å; W55-E121 HydrophobicContact CH2-CG 3.83Å; W55-E121 HydrophobicContact CZ3-CB 4.1Å; W55-E121 HydrophobicContact CZ3-CG 4.47Å; Y66-E121 HydrophobicContact CE2-CB 4.03Å; Y66-E121 WeakPolarHBondContact CE2-OE2 3.41Å; T68-E121 WeakPolarHBondContact CB-OE1 3.32Å; T68-E121 HydrophobicContact CG2-CG 4.29Å; T68-E121 WeakPolarHBondContact CG2-OE1 3.3Å; T68-E121 PolarHBondContact OG1-OE1 3.35Å; T68-E121 PolarHBondContact OG1-OE2 3.15Å; D118-E121 HydrophobicContact CB-CB 4.42Å; D118-E121 HydrophobicContact CB-CG 4.17Å; D118-E121 PolarHBondContact O-N 2.88Å; E121-L124 PolarHBondContact O-N 2.94Å; E121-L125 PolarHBondContact O-N 2.86Å
122	E	93.1	Very high	79.4	Confident	62 Å²	62	71.4 Å²	71.4	29%	0.29	37%	0.366	S	S	.	.	H	α-helix	trans	-62.3	-42.8	173.8	-170.7	-178.9	148	0	0	111.6	L17 P117 D118 L124 L125 N126	L17-E122 HydrophobicContact CD1-CG 3.49Å; L17-E122 VanDerWaalsContact CD1-CG 3.49Å; P117-E122 HydrophobicContact CB-CB 4.34Å; P117-E122 VanDerWaalsContact CB-OE2 3.25Å; P117-E122 WeakPolarHBondContact CB-OE2 3.46Å; P117-E122 WeakPolarHBondContact CG-OE2 3.39Å; D118-E122 PolarHBondContact O-N 3.14Å; E122-L124 VanDerWaalsContact C-N 3.35Å; E122-L124 PolarHBondContact O-N 3.42Å; E122-L125 PolarHBondContact O-N 2.81Å; E122-N126 WeakPolarHBondContact CG-ND2 3.5Å; E122-N126 WeakPolarHBondContact O-CB 3.24Å; E122-N126 PolarHBondContact O-N 3.19Å; E122-N126 PolarHBondContact O-ND2 3.27Å
123	E	95	Very high	82.4	Confident	119 Å²	119	69 Å²	69	56%	0.556	35%	0.351	S	S	*	.	H	α-helix	trans	-59.9	-42.5	174	-77.9	168	-169.1	0	0	112	R119 N126 D127	R119-E123 WeakPolarHBondContact O-CB 3.38Å; R119-E123 WeakPolarHBondContact O-CG 3.26Å; R119-E123 PolarHBondContact O-N 3.29Å; E123-N126 PolarHBondContact O-N 2.75Å; E123-D127 WeakPolarHBondContact O-CB 3.49Å; E123-D127 PolarHBondContact O-N 3.4Å
124	L	96.1	Very high	85.1	Confident	63 Å²	63	70.3 Å²	70.3	33%	0.33	35%	0.347	S	S	.	.	H	α-helix	trans	-62.7	-43.3	176	-73.9	170.8	0	0	0	112.1	M50 W55 K120 E121 E122 D127 Y128	M50-L124 HydrophobicContact CE-CB 4.11Å; W55-L124 HydrophobicContact CH2-CB 4.48Å; W55-L124 HydrophobicContact CZ2-CB 4.46Å; W55-L124 HydrophobicContact CZ2-CD1 4.09Å; K120-L124 VanDerWaalsContact O-CG 3.29Å; K120-L124 WeakPolarHBondContact O-CG 3.47Å; K120-L124 PolarHBondContact O-N 2.89Å; K120-L124 VanDerWaalsContact O-N 3.08Å; E121-L124 PolarHBondContact O-N 2.94Å; E122-L124 VanDerWaalsContact C-N 3.35Å; E122-L124 PolarHBondContact O-N 3.42Å; L124-D127 PolarHBondContact O-N 3.41Å; L124-Y128 VanDerWaalsContact O-CB 3.23Å; L124-Y128 WeakPolarHBondContact O-CB 3.47Å; L124-Y128 PolarHBondContact O-N 3.29Å
125	L	97.3	Very high	87.7	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-66.5	-44.3	176.7	-73.1	170.6	0	0	0	111.8	M50 W55 L57 Y66 E121 E122 D127 Y128 F129	M50-L125 HydrophobicContact CE-CD2 3.94Å; M50-L125 HydrophobicContact CE-CG 4.39Å; W55-L125 HydrophobicContact CE3-CD1 4.47Å; W55-L125 HydrophobicContact CE3-CD2 4.2Å; W55-L125 HydrophobicContact CE3-CG 4.42Å; W55-L125 HydrophobicContact CH2-CG 4.25Å; W55-L125 HydrophobicContact CZ3-CD1 3.82Å; W55-L125 HydrophobicContact CZ3-CD2 4.08Å; W55-L125 HydrophobicContact CZ3-CG 3.81Å; L57-L125 HydrophobicContact CD2-CD2 4.04Å; Y66-L125 HydrophobicContact CD1-CD1 3.49Å; Y66-L125 VanDerWaalsContact CD1-CD1 3.49Å; Y66-L125 HydrophobicContact CD2-CD1 3.9Å; Y66-L125 HydrophobicContact CE1-CD1 3.75Å; Y66-L125 HydrophobicContact CE2-CD1 4.11Å; Y66-L125 HydrophobicContact CG-CD1 3.57Å; E121-L125 PolarHBondContact O-N 2.86Å; E122-L125 PolarHBondContact O-N 2.81Å; L125-D127 VanDerWaalsContact C-N 3.27Å; L125-D127 PolarHBondContact O-N 2.79Å; L125-Y128 PolarHBondContact O-N 3.09Å; L125-F129 HydrophobicContact CD2-CD2 4.04Å; L125-F129 HydrophobicContact CD2-CE2 3.73Å; L125-F129 WeakPolarHBondContact O-CB 3.3Å; L125-F129 PolarHBondContact O-N 3.4Å
126	N	97.6	Very high	89.9	Confident	33 Å²	33	66.9 Å²	66.9	18%	0.176	33%	0.328	C	S	.	.	H	α-helix	trans	-59.9	-38.9	176.6	-88.2	-83.5	0	0	0	112	E122 E123 Q130 L131	E122-N126 WeakPolarHBondContact CG-ND2 3.5Å; E122-N126 WeakPolarHBondContact O-CB 3.24Å; E122-N126 PolarHBondContact O-N 3.19Å; E122-N126 PolarHBondContact O-ND2 3.27Å; E123-N126 PolarHBondContact O-N 2.75Å; N126-Q130 CarbonylContact O-C 3.58Å; N126-Q130 WeakPolarHBondContact O-CA 3.28Å; N126-Q130 PolarHBondContact O-N 2.79Å; N126-L131 PolarHBondContact O-N 3.21Å
127	D	97.8	Very high	92.2	Very high	71 Å²	71	64.1 Å²	64.1	38%	0.38	31%	0.308	S	S	.	.	H	α-helix	trans	-72.8	-52.5	177.6	-174.1	78.7	0	0	0	111.8	E123 L124 L125 F129 Q130 R163	E123-D127 WeakPolarHBondContact O-CB 3.49Å; E123-D127 PolarHBondContact O-N 3.4Å; L124-D127 PolarHBondContact O-N 3.41Å; L125-D127 VanDerWaalsContact C-N 3.27Å; L125-D127 PolarHBondContact O-N 2.79Å; D127-F129 PolarHBondContact O-N 2.93Å; D127-Q130 WeakPolarHBondContact O-CG 3.45Å; D127-Q130 PolarHBondContact O-N 2.92Å; D127-R163 WeakPolarHBondContact O-CB 3.3Å; D127-R163 IonicContact OD1-CZ 3.7Å; D127-R163 IonicContact OD1-NE 2.81Å; D127-R163 IonicContact OD1-NH1 3.6Å; D127-R163 PolarHBondContact OD1-NH1 2.85Å; D127-R163 IonicContact OD2-CZ 3.62Å; D127-R163 IonicContact OD2-NH1 3.57Å; D127-R163 PolarHBondContact OD2-NH1 3.27Å
128	Y	98.6	Very high	94.4	Very high	14 Å²	14	62.4 Å²	62.4	6%	0.055	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-42.2	-176.6	-177.2	-103.9	0	0	0	112.6	W38 M50 L124 L125 Q130 L162 R163 Q164	W38-Y128 HydrophobicContact CZ2-CE1 4.17Å; W38-Y128 AromaticContact NE1-CE1 3.98Å; W38-Y128 AromaticContact NE1-CZ 3.83Å; W38-Y128 PolarHBondContact NE1-OH 3.32Å; M50-Y128 HydrophobicContact CG-CD1 4.45Å; M50-Y128 HydrophobicContact CG-CD2 3.84Å; M50-Y128 HydrophobicContact CG-CE2 4.11Å; M50-Y128 HydrophobicContact CG-CG 4.02Å; M50-Y128 WeakPolarHBondContact SD-CB 3.41Å; M50-Y128 HydrophobicContact SD-CD1 3.39Å; M50-Y128 WeakPolarHBondContact SD-CD1 3.48Å; M50-Y128 HydrophobicContact SD-CD2 3.66Å; M50-Y128 HydrophobicContact SD-CE1 4.01Å; M50-Y128 HydrophobicContact SD-CE2 4.24Å; M50-Y128 HydrophobicContact SD-CG 3.17Å; L124-Y128 VanDerWaalsContact O-CB 3.23Å; L124-Y128 WeakPolarHBondContact O-CB 3.47Å; L124-Y128 PolarHBondContact O-N 3.29Å; L125-Y128 PolarHBondContact O-N 3.09Å; Y128-Q130 VanDerWaalsContact C-N 3.34Å; Y128-L162 HydrophobicContact CD1-CD2 4.02Å; Y128-L162 HydrophobicContact CE1-CD1 4.15Å; Y128-L162 HydrophobicContact CE1-CD2 3.64Å; Y128-L162 HydrophobicContact CE1-CG 4.34Å; Y128-L162 CarbonylContact O-C 3.55Å; Y128-L162 WeakPolarHBondContact O-CA 3.4Å; Y128-R163 PolarHBondContact O-N 3.25Å; Y128-Q164 HydrophobicContact CE2-CG 4.15Å
129	F	98.6	Very high	95.9	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	7.2	173.2	-67.2	-70.5	0	0	0	112.6	L24 L26 T29 L30 L57 L64 L125 D127 L131 R160 L162	L24-F129 HydrophobicContact CD1-CD1 3.93Å; L24-F129 HydrophobicContact CD1-CE1 4.08Å; L24-F129 HydrophobicContact CD2-CD1 4.12Å; L24-F129 HydrophobicContact CD2-CD2 4.45Å; L24-F129 HydrophobicContact CD2-CE1 4.23Å; L24-F129 HydrophobicContact CD2-CG 4.23Å; L24-F129 HydrophobicContact CD2-CZ 4.45Å; L26-F129 HydrophobicContact CD2-CE1 4.34Å; L26-F129 HydrophobicContact CD2-CZ 4Å; T29-F129 HydrophobicContact CG2-CE1 4.43Å; L30-F129 HydrophobicContact CD2-CE1 3.98Å; L30-F129 HydrophobicContact CD2-CZ 4.22Å; L57-F129 HydrophobicContact CD1-CE2 3.71Å; L57-F129 HydrophobicContact CD1-CZ 3.57Å; L64-F129 HydrophobicContact CD2-CE2 4.49Å; L125-F129 HydrophobicContact CD2-CD2 4.04Å; L125-F129 HydrophobicContact CD2-CE2 3.73Å; L125-F129 WeakPolarHBondContact O-CB 3.3Å; L125-F129 PolarHBondContact O-N 3.4Å; D127-F129 PolarHBondContact O-N 2.93Å; F129-L131 HydrophobicContact CB-CD1 4.33Å; F129-L131 HydrophobicContact CB-CD2 3.55Å; F129-L131 HydrophobicContact CB-CG 3.74Å; F129-L131 PolarHBondContact O-N 3.15Å; F129-R160 WeakPolarHBondContact O-CD 3.43Å; F129-R160 PolarHBondContact O-NE 3.41Å; F129-L162 HydrophobicContact CD1-CD2 3.56Å; F129-L162 HydrophobicContact CE1-CD2 3.66Å
130	Q	98.4	Very high	96.9	Very high	34 Å²	34	57.3 Å²	57.3	16%	0.159	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	40.8	176.8	-58	-172.7	83.8	0	0	114.5	N126 D127 Y128 K132 V133 M161 R163 W341	N126-Q130 CarbonylContact O-C 3.58Å; N126-Q130 WeakPolarHBondContact O-CA 3.28Å; N126-Q130 PolarHBondContact O-N 2.79Å; D127-Q130 WeakPolarHBondContact O-CG 3.45Å; D127-Q130 PolarHBondContact O-N 2.92Å; Y128-Q130 VanDerWaalsContact C-N 3.34Å; Q130-K132 PolarHBondContact O-N 3.24Å; Q130-V133 PolarHBondContact O-N 3.24Å; Q130-M161 PolarHBondContact NE2-O 3.22Å; Q130-R163 HydrophobicContact CG-CB 3.66Å; Q130-W341 HydrophobicContact CB-CH2 3.84Å; Q130-W341 HydrophobicContact CB-CZ2 4.37Å; Q130-W341 HydrophobicContact CG-CH2 4.48Å; Q130-W341 VanDerWaalsContact NE2-CZ2 3.3Å
131	L	97.9	Very high	97.4	Very high	30 Å²	30	54.9 Å²	54.9	16%	0.157	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-9	-168	-59.8	179.8	0	0	0	114.2	L17 N126 F129 V133 R160	L17-L131 HydrophobicContact CD2-CD1 3.23Å; N126-L131 PolarHBondContact O-N 3.21Å; F129-L131 HydrophobicContact CB-CD1 4.33Å; F129-L131 HydrophobicContact CB-CD2 3.55Å; F129-L131 HydrophobicContact CB-CG 3.74Å; F129-L131 PolarHBondContact O-N 3.15Å; L131-V133 VanDerWaalsContact C-N 3.27Å; L131-R160 VanDerWaalsContact CD2-NH2 3.34Å
132	K	97.2	Very high	97.7	Very high	187 Å²	187	55 Å²	55	81%	0.813	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-21	171.8	-63.1	-179.2	-178.5	175	0	112.6	Q130	Q130-K132 PolarHBondContact O-N 3.24Å
133	V	98.3	Very high	97.9	Very high	30 Å²	30	52.5 Å²	52.5	18%	0.182	26%	0.257	C	S	.	.	S	Bend	trans	-84.2	115.6	175.5	-178.3	0	0	0	0	108.3	Q130 L131 L135 L138 Y338 W341	Q130-V133 PolarHBondContact O-N 3.24Å; L131-V133 VanDerWaalsContact C-N 3.27Å; V133-L135 PolarHBondContact O-N 2.81Å; V133-L138 HydrophobicContact CG1-CD1 3.66Å; V133-L138 HydrophobicContact CG1-CG 4.42Å; V133-Y338 HydrophobicContact CG1-CE1 4.07Å; V133-W341 HydrophobicContact CB-CH2 3.88Å; V133-W341 HydrophobicContact CB-CZ3 4.12Å; V133-W341 HydrophobicContact CG1-CH2 3.94Å; V133-W341 HydrophobicContact CG1-CZ3 3.85Å; V133-W341 HydrophobicContact CG2-CH2 3.94Å
134	K	98.1	Very high	98.1	Very high	142 Å²	142	51 Å²	51	62%	0.617	27%	0.265	S	S	*	.			trans	-70.1	101.3	178.1	-65.2	-178.6	177.9	-177.4	0	110	E23 G136 D137	E23-K134 WeakPolarHBondContact OE2-CA 3.48Å; K134-G136 VanDerWaalsContact C-N 3.31Å; K134-G136 PolarHBondContact O-N 2.97Å; K134-D137 HydrophobicContact CB-CB 4.27Å; K134-D137 WeakPolarHBondContact CB-OD2 3.17Å; K134-D137 VanDerWaalsContact CD-OD2 3.25Å; K134-D137 WeakPolarHBondContact CD-OD2 3.34Å; K134-D137 PolarHBondContact O-N 3.21Å
135	L	98.4	Very high	98.2	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-69.7	-32.8	-173.6	-171	67.7	0	0	0	111.3	E23 V133 D137 L138 Y139 W142 R160 W341	E23-L135 HydrophobicContact CB-CB 3.72Å; E23-L135 HydrophobicContact CB-CD2 4.32Å; E23-L135 PolarHBondContact OE1-N 3.26Å; E23-L135 PolarHBondContact OE2-N 2.74Å; V133-L135 PolarHBondContact O-N 2.81Å; L135-D137 VanDerWaalsContact C-N 3.25Å; L135-D137 PolarHBondContact O-N 3.37Å; L135-L138 HydrophobicContact CD1-CD1 4.26Å; L135-L138 PolarHBondContact O-N 2.86Å; L135-L138 VanDerWaalsContact O-N 3.17Å; L135-Y139 HydrophobicContact CD1-CD2 4Å; L135-Y139 HydrophobicContact CD1-CE2 3.73Å; L135-Y139 HydrophobicContact CD2-CD2 4.37Å; L135-Y139 HydrophobicContact CD2-CE2 3.76Å; L135-Y139 HydrophobicContact CG-CD2 3.72Å; L135-Y139 HydrophobicContact CG-CE2 3.54Å; L135-Y139 WeakPolarHBondContact O-CD2 3.32Å; L135-Y139 PolarHBondContact O-N 3.22Å; L135-W142 HydrophobicContact CD1-CH2 4.46Å; L135-W142 HydrophobicContact CD1-CZ3 4.46Å; L135-R160 HydrophobicContact CD1-CG 4.24Å; L135-R160 HydrophobicContact CD2-CB 4.35Å; L135-R160 HydrophobicContact CD2-CG 4.19Å; L135-W341 HydrophobicContact CD1-CE3 3.99Å; L135-W341 HydrophobicContact CD1-CZ3 4.24Å
136	G	98.1	Very high	98.2	Very high	32 Å²	32	50.7 Å²	50.7	33%	0.33	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-35.1	174.9	0	0	0	0	0	113.8	E23 K134 R140	E23-G136 PolarHBondContact OE1-N 2.91Å; K134-G136 VanDerWaalsContact C-N 3.31Å; K134-G136 PolarHBondContact O-N 2.97Å; G136-R140 PolarHBondContact O-N 3.35Å; G136-R140 VanDerWaalsContact O-N 3.15Å
137	D	98.4	Very high	98.2	Very high	59 Å²	59	54.3 Å²	54.3	32%	0.316	30%	0.296	S	S	.	.	H	α-helix	trans	-66.4	-45.1	175.6	-70.7	-31.6	0	0	0	111.1	K134 L135 Y139 R140 D141	K134-D137 HydrophobicContact CB-CB 4.27Å; K134-D137 WeakPolarHBondContact CB-OD2 3.17Å; K134-D137 VanDerWaalsContact CD-OD2 3.25Å; K134-D137 WeakPolarHBondContact CD-OD2 3.34Å; K134-D137 PolarHBondContact O-N 3.21Å; L135-D137 VanDerWaalsContact C-N 3.25Å; L135-D137 PolarHBondContact O-N 3.37Å; D137-Y139 PolarHBondContact O-N 3.42Å; D137-R140 PolarHBondContact O-N 2.87Å; D137-R140 IonicContact OD1-CZ 3.84Å; D137-R140 VanDerWaalsContact OD1-CZ 3.25Å; D137-R140 IonicContact OD1-NH1 3.89Å; D137-R140 PolarHBondContact OD1-NH1 2.93Å; D137-R140 IonicContact OD1-NH2 3.36Å; D137-R140 PolarHBondContact OD1-NH2 3.05Å; D137-D141 PolarHBondContact O-N 3.43Å; D137-D141 VanDerWaalsContact O-N 3.08Å
138	L	98.7	Very high	98.1	Very high	20 Å²	20	53.2 Å²	53.2	11%	0.105	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-43.6	177.2	-62.1	-179.2	0	0	0	112.2	V133 L135 R140 D141 W142 Y338 W341	V133-L138 HydrophobicContact CG1-CD1 3.66Å; V133-L138 HydrophobicContact CG1-CG 4.42Å; L135-L138 HydrophobicContact CD1-CD1 4.26Å; L135-L138 PolarHBondContact O-N 2.86Å; L135-L138 VanDerWaalsContact O-N 3.17Å; L138-R140 VanDerWaalsContact C-N 3.29Å; L138-R140 PolarHBondContact O-N 3.36Å; L138-D141 PolarHBondContact O-N 2.76Å; L138-W142 HydrophobicContact CB-CD2 4.19Å; L138-W142 HydrophobicContact CB-CE3 4.05Å; L138-W142 HydrophobicContact CB-CH2 3.49Å; L138-W142 VanDerWaalsContact CB-CH2 3.49Å; L138-W142 HydrophobicContact CB-CZ2 3.61Å; L138-W142 HydrophobicContact CB-CZ3 3.72Å; L138-W142 HydrophobicContact CD1-CH2 3.76Å; L138-W142 HydrophobicContact CD1-CZ2 3.9Å; L138-W142 HydrophobicContact CD2-CZ2 4.31Å; L138-W142 HydrophobicContact CG-CH2 4.21Å; L138-W142 HydrophobicContact CG-CZ2 4.16Å; L138-W142 WeakPolarHBondContact O-CB 3.37Å; L138-W142 PolarHBondContact O-N 3.18Å; L138-Y338 HydrophobicContact CD1-CD1 3.86Å; L138-Y338 HydrophobicContact CD1-CE1 4.3Å; L138-Y338 HydrophobicContact CD1-CG 4.09Å; L138-Y338 HydrophobicContact CD2-CD2 3.91Å; L138-Y338 HydrophobicContact CD2-CE2 4.4Å; L138-Y338 HydrophobicContact CD2-CG 3.98Å; L138-W341 HydrophobicContact CD1-CE3 3.89Å; L138-W341 HydrophobicContact CD1-CZ3 4.24Å
139	Y	98.6	Very high	98.1	Very high	20 Å²	20	52.6 Å²	52.6	8%	0.078	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-39.2	178.2	-91.4	-123.6	0	0	0	112.2	L135 D137 W142 G143 F149 A153 F156 V159 V345	L135-Y139 HydrophobicContact CD1-CD2 4Å; L135-Y139 HydrophobicContact CD1-CE2 3.73Å; L135-Y139 HydrophobicContact CD2-CD2 4.37Å; L135-Y139 HydrophobicContact CD2-CE2 3.76Å; L135-Y139 HydrophobicContact CG-CD2 3.72Å; L135-Y139 HydrophobicContact CG-CE2 3.54Å; L135-Y139 WeakPolarHBondContact O-CD2 3.32Å; L135-Y139 PolarHBondContact O-N 3.22Å; D137-Y139 PolarHBondContact O-N 3.42Å; Y139-W142 AromaticContact CD2-CE3 3.96Å; Y139-W142 HydrophobicContact CD2-CE3 3.96Å; Y139-W142 AromaticContact CD2-CZ3 3.63Å; Y139-W142 HydrophobicContact CD2-CZ3 3.63Å; Y139-W142 HydrophobicContact CE2-CE3 4.41Å; Y139-W142 AromaticContact CE2-CZ3 3.81Å; Y139-W142 HydrophobicContact CE2-CZ3 3.81Å; Y139-G143 PolarHBondContact O-N 3.06Å; Y139-F149 HydrophobicContact CD1-CE1 4.45Å; Y139-A153 HydrophobicContact CD1-CB 3.77Å; Y139-A153 HydrophobicContact CE1-CB 4.04Å; Y139-F156 WeakPolarHBondContact CE1-O 3.33Å; Y139-F156 PolarHBondContact OH-O 3.42Å; Y139-V159 PolarHBondContact OH-N 2.85Å; Y139-V159 PolarHBondContact OH-O 2.82Å; Y139-V345 HydrophobicContact CE1-CG1 4.49Å; Y139-V345 HydrophobicContact CE2-CG2 4.1Å; Y139-V345 WeakPolarHBondContact OH-CG2 3.3Å
140	R	98.4	Very high	98	Very high	139 Å²	139	56 Å²	56	53%	0.525	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-47.1	175.7	-179.4	-176.5	60.6	-111.5	-3.3	111.2	G136 D137 L138 G143 A144	G136-R140 PolarHBondContact O-N 3.35Å; G136-R140 VanDerWaalsContact O-N 3.15Å; D137-R140 PolarHBondContact O-N 2.87Å; D137-R140 IonicContact OD1-CZ 3.84Å; D137-R140 VanDerWaalsContact OD1-CZ 3.25Å; D137-R140 IonicContact OD1-NH1 3.89Å; D137-R140 PolarHBondContact OD1-NH1 2.93Å; D137-R140 IonicContact OD1-NH2 3.36Å; D137-R140 PolarHBondContact OD1-NH2 3.05Å; L138-R140 VanDerWaalsContact C-N 3.29Å; L138-R140 PolarHBondContact O-N 3.36Å; R140-G143 PolarHBondContact O-N 3.23Å; R140-A144 WeakPolarHBondContact O-CB 3.48Å; R140-A144 PolarHBondContact O-N 2.98Å
141	D	98.4	Very high	97.9	Very high	93 Å²	93	57.1 Å²	57.1	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-44	-177.7	-65.5	-8.4	0	0	0	111.3	D137 L138 A144 A145	D137-D141 PolarHBondContact O-N 3.43Å; D137-D141 VanDerWaalsContact O-N 3.08Å; L138-D141 PolarHBondContact O-N 2.76Å; D141-A144 PolarHBondContact O-N 2.66Å; D141-A145 PolarHBondContact O-N 2.83Å; D141-A145 VanDerWaalsContact O-N 3.09Å
142	W	98.6	Very high	97.8	Very high	6 Å²	6	56.4 Å²	56.4	2%	0.023	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-40.6	175.3	-58.1	-34.6	0	0	0	112.5	L135 L138 Y139 A144 A145 D146 F149 W335 Y338 W341 A342	L135-W142 HydrophobicContact CD1-CH2 4.46Å; L135-W142 HydrophobicContact CD1-CZ3 4.46Å; L138-W142 HydrophobicContact CB-CD2 4.19Å; L138-W142 HydrophobicContact CB-CE3 4.05Å; L138-W142 HydrophobicContact CB-CH2 3.49Å; L138-W142 VanDerWaalsContact CB-CH2 3.49Å; L138-W142 HydrophobicContact CB-CZ2 3.61Å; L138-W142 HydrophobicContact CB-CZ3 3.72Å; L138-W142 HydrophobicContact CD1-CH2 3.76Å; L138-W142 HydrophobicContact CD1-CZ2 3.9Å; L138-W142 HydrophobicContact CD2-CZ2 4.31Å; L138-W142 HydrophobicContact CG-CH2 4.21Å; L138-W142 HydrophobicContact CG-CZ2 4.16Å; L138-W142 WeakPolarHBondContact O-CB 3.37Å; L138-W142 PolarHBondContact O-N 3.18Å; Y139-W142 AromaticContact CD2-CE3 3.96Å; Y139-W142 HydrophobicContact CD2-CE3 3.96Å; Y139-W142 AromaticContact CD2-CZ3 3.63Å; Y139-W142 HydrophobicContact CD2-CZ3 3.63Å; Y139-W142 HydrophobicContact CE2-CE3 4.41Å; Y139-W142 AromaticContact CE2-CZ3 3.81Å; Y139-W142 HydrophobicContact CE2-CZ3 3.81Å; W142-A144 VanDerWaalsContact C-N 3.28Å; W142-A144 PolarHBondContact O-N 2.91Å; W142-A145 PolarHBondContact O-N 2.71Å; W142-D146 WeakPolarHBondContact O-CB 3.49Å; W142-D146 PolarHBondContact O-N 2.98Å; W142-F149 HydrophobicContact CB-CD1 3.62Å; W142-F149 HydrophobicContact CB-CE1 3.57Å; W142-F149 HydrophobicContact CB-CE2 4.48Å; W142-F149 HydrophobicContact CB-CG 4.16Å; W142-F149 HydrophobicContact CB-CZ 4.05Å; W142-F149 HydrophobicContact CD2-CE1 4.44Å; W142-F149 HydrophobicContact CD2-CZ 4.16Å; W142-F149 AromaticContact CE3-CE1 3.84Å; W142-F149 HydrophobicContact CE3-CE1 3.84Å; W142-F149 HydrophobicContact CE3-CE2 4.07Å; W142-F149 AromaticContact CE3-CZ 3.36Å; W142-F149 HydrophobicContact CE3-CZ 3.36Å; W142-F149 HydrophobicContact CG-CE1 4.42Å; W142-F149 HydrophobicContact CG-CZ 4.49Å; W142-F149 HydrophobicContact CZ3-CZ 4.1Å; W142-W335 AromaticContact CD1-CD1 3.89Å; W142-W335 AromaticContact CD1-CG 3.98Å; W142-W335 HydrophobicContact CG-CG 4.43Å; W142-W335 PolarHBondContact NE1-O 3.05Å; W142-Y338 WeakPolarHBondContact CZ2-O 3.45Å; W142-W341 HydrophobicContact CH2-CB 3.47Å; W142-W341 VanDerWaalsContact CH2-CB 3.47Å; W142-W341 HydrophobicContact CZ2-CB 3.78Å; W142-A342 HydrophobicContact CD2-CB 3.58Å; W142-A342 HydrophobicContact CE3-CB 3.97Å; W142-A342 HydrophobicContact CG-CB 3.89Å; W142-A342 HydrophobicContact CH2-CB 4.38Å; W142-A342 HydrophobicContact CZ2-CB 4.03Å; W142-A342 HydrophobicContact CZ3-CB 4.35Å
143	G	98.3	Very high	97.8	Very high	9 Å²	9	48.1 Å²	48.1	9%	0.093	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-30.8	177.1	0	0	0	0	0	113.2	Y139 R140	Y139-G143 PolarHBondContact O-N 3.06Å; R140-G143 PolarHBondContact O-N 3.23Å
144	A	98.1	Very high	97.6	Very high	87 Å²	87	53 Å²	53	72%	0.719	30%	0.297	S	S	*	.	H	α-helix	trans	-72	-37.4	172.9	0	0	0	0	0	112.3	R140 D141 W142	R140-A144 WeakPolarHBondContact O-CB 3.48Å; R140-A144 PolarHBondContact O-N 2.98Å; D141-A144 PolarHBondContact O-N 2.66Å; W142-A144 VanDerWaalsContact C-N 3.28Å; W142-A144 PolarHBondContact O-N 2.91Å
145	A	97.9	Very high	97.4	Very high	51 Å²	51	47.9 Å²	47.9	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-77.4	-27.1	178.3	0	0	0	0	0	113.6	D141 W142	D141-A145 PolarHBondContact O-N 2.83Å; D141-A145 VanDerWaalsContact O-N 3.09Å; W142-A145 PolarHBondContact O-N 2.71Å
146	D	98.2	Very high	97.4	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	28%	0.276	C	S	.	.			trans	-140.4	104.6	-170.7	178.8	1.4	0	0	0	112.3	W142 H148 F149 N150 Y308 L334 W335	W142-D146 WeakPolarHBondContact O-CB 3.49Å; W142-D146 PolarHBondContact O-N 2.98Å; D146-H148 VanDerWaalsContact C-N 3.28Å; D146-H148 PolarHBondContact O-N 2.82Å; D146-H148 WeakPolarHBondContact OD1-CA 3.5Å; D146-H148 WeakPolarHBondContact OD1-CB 3.37Å; D146-H148 PolarHBondContact OD1-N 2.86Å; D146-F149 HydrophobicContact CB-CB 3.78Å; D146-F149 PolarHBondContact O-N 2.84Å; D146-F149 PolarHBondContact OD1-N 3.22Å; D146-F149 VanDerWaalsContact OD2-CB 3.26Å; D146-F149 WeakPolarHBondContact OD2-CB 3.27Å; D146-N150 PolarHBondContact O-N 3.21Å; D146-Y308 VanDerWaalsContact OD2-CE1 3.23Å; D146-Y308 WeakPolarHBondContact OD2-CE1 3.1Å; D146-Y308 VanDerWaalsContact OD2-CZ 3.3Å; D146-Y308 PolarHBondContact OD2-OH 3.49Å; D146-L334 HydrophobicContact CB-CD1 4.28Å; D146-L334 HydrophobicContact CB-CD2 4.14Å; D146-L334 HydrophobicContact CB-CG 4.3Å; D146-W335 WeakPolarHBondContact OD2-CZ2 3.47Å; D146-W335 PolarHBondContact OD2-NE1 3.03Å
147	P	96.6	Very high	97.3	Very high	108 Å²	108	48.3 Å²	48.3	70%	0.701	27%	0.273	S	S	*	.	H	α-helix	trans	-60.4	-32.7	177.1	-24.9	34.7	0	0	0	114.2	N150 S151	P147-N150 PolarHBondContact O-N 3.27Å; P147-S151 PolarHBondContact O-N 3.14Å; P147-S151 VanDerWaalsContact O-N 3.17Å
148	H	96.9	Very high	97.2	Very high	49 Å²	49	45.5 Å²	45.5	23%	0.227	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-50.4	176.5	177.6	78.7	0	0	0	109.6	D146 N150 S151 I152 D307 Y308	D146-H148 VanDerWaalsContact C-N 3.28Å; D146-H148 PolarHBondContact O-N 2.82Å; D146-H148 WeakPolarHBondContact OD1-CA 3.5Å; D146-H148 WeakPolarHBondContact OD1-CB 3.37Å; D146-H148 PolarHBondContact OD1-N 2.86Å; H148-N150 VanDerWaalsContact C-N 3.29Å; H148-N150 PolarHBondContact O-N 3.25Å; H148-S151 WeakPolarHBondContact O-CB 3.3Å; H148-S151 PolarHBondContact O-N 2.88Å; H148-S151 VanDerWaalsContact O-N 3.1Å; H148-S151 PolarHBondContact O-OG 2.81Å; H148-I152 PolarHBondContact O-N 2.85Å; H148-D307 IonicContact CE1-OD1 3.45Å; H148-D307 IonicContact NE2-OD2 3.75Å; H148-Y308 AromaticContact CD2-CZ 3.84Å; H148-Y308 PolarHBondContact CD2-OH 2.89Å
149	F	98	Very high	97.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-54.7	-45.6	174.1	-178.3	-84.1	0	0	0	111.7	Y139 W142 D146 S151 I152 A153 W335 A342 V345 L346	Y139-F149 HydrophobicContact CD1-CE1 4.45Å; W142-F149 HydrophobicContact CB-CD1 3.62Å; W142-F149 HydrophobicContact CB-CE1 3.57Å; W142-F149 HydrophobicContact CB-CE2 4.48Å; W142-F149 HydrophobicContact CB-CG 4.16Å; W142-F149 HydrophobicContact CB-CZ 4.05Å; W142-F149 HydrophobicContact CD2-CE1 4.44Å; W142-F149 HydrophobicContact CD2-CZ 4.16Å; W142-F149 AromaticContact CE3-CE1 3.84Å; W142-F149 HydrophobicContact CE3-CE1 3.84Å; W142-F149 HydrophobicContact CE3-CE2 4.07Å; W142-F149 AromaticContact CE3-CZ 3.36Å; W142-F149 HydrophobicContact CE3-CZ 3.36Å; W142-F149 HydrophobicContact CG-CE1 4.42Å; W142-F149 HydrophobicContact CG-CZ 4.49Å; W142-F149 HydrophobicContact CZ3-CZ 4.1Å; D146-F149 HydrophobicContact CB-CB 3.78Å; D146-F149 PolarHBondContact O-N 2.84Å; D146-F149 PolarHBondContact OD1-N 3.22Å; D146-F149 VanDerWaalsContact OD2-CB 3.26Å; D146-F149 WeakPolarHBondContact OD2-CB 3.27Å; F149-S151 PolarHBondContact O-N 3.39Å; F149-I152 PolarHBondContact O-N 3.41Å; F149-A153 HydrophobicContact CD1-CB 4.13Å; F149-A153 HydrophobicContact CE1-CB 3.78Å; F149-A153 HydrophobicContact CZ-CB 4.44Å; F149-A153 VanDerWaalsContact O-CB 3.29Å; F149-A153 WeakPolarHBondContact O-CB 3.18Å; F149-A153 PolarHBondContact O-N 3.36Å; F149-W335 HydrophobicContact CD2-CZ2 4.29Å; F149-A342 HydrophobicContact CD2-CB 4.37Å; F149-A342 HydrophobicContact CE2-CB 3.96Å; F149-A342 WeakPolarHBondContact CE2-O 3.46Å; F149-V345 HydrophobicContact CE2-CB 3.76Å; F149-V345 HydrophobicContact CE2-CG1 4.2Å; F149-V345 HydrophobicContact CE2-CG2 3.88Å; F149-V345 HydrophobicContact CZ-CB 4.19Å; F149-V345 HydrophobicContact CZ-CG1 4.34Å; F149-V345 HydrophobicContact CZ-CG2 3.97Å; F149-L346 HydrophobicContact CD2-CD2 3.93Å; F149-L346 HydrophobicContact CD2-CG 4.25Å
150	N	97.5	Very high	97.1	Very high	72 Å²	72	43.9 Å²	43.9	39%	0.385	25%	0.25	S	S	.	.	H	α-helix	trans	-57.4	-35.9	179.3	-168.3	33.9	0	0	0	113	D146 P147 H148 K154	D146-N150 PolarHBondContact O-N 3.21Å; P147-N150 PolarHBondContact O-N 3.27Å; H148-N150 VanDerWaalsContact C-N 3.29Å; H148-N150 PolarHBondContact O-N 3.25Å; N150-K154 WeakPolarHBondContact O-CG 3.5Å
151	S	96.1	Very high	97.1	Very high	57 Å²	57	37.3 Å²	37.3	40%	0.399	23%	0.225	S	C	.	.	H	α-helix	trans	-68.2	-42	176	76.2	0	0	0	0	112.2	P147 H148 F149	P147-S151 PolarHBondContact O-N 3.14Å; P147-S151 VanDerWaalsContact O-N 3.17Å; H148-S151 WeakPolarHBondContact O-CB 3.3Å; H148-S151 PolarHBondContact O-N 2.88Å; H148-S151 VanDerWaalsContact O-N 3.1Å; H148-S151 PolarHBondContact O-OG 2.81Å; F149-S151 PolarHBondContact O-N 3.39Å
152	I	95.9	Very high	97.1	Very high	15 Å²	15	32.9 Å²	32.9	8%	0.077	20%	0.202	C	C	.	.	H	α-helix	trans	-69.9	-39.3	179.3	-62.3	-60.7	0	0	0	111	H148 F149 K154 I155 F156 V345 L346	H148-I152 PolarHBondContact O-N 2.85Å; F149-I152 PolarHBondContact O-N 3.41Å; I152-K154 PolarHBondContact O-N 3.01Å; I152-I155 PolarHBondContact O-N 3.33Å; I152-F156 HydrophobicContact CG2-CB 4.19Å; I152-F156 HydrophobicContact CG2-CD2 3.86Å; I152-F156 HydrophobicContact CG2-CG 4.29Å; I152-F156 PolarHBondContact O-N 3.21Å; I152-V345 HydrophobicContact CG2-CG1 4.4Å; I152-L346 HydrophobicContact CB-CD2 4.13Å; I152-L346 HydrophobicContact CG1-CD2 4.11Å; I152-L346 HydrophobicContact CG2-CD2 4.08Å
153	A	95.9	Very high	97.1	Very high	13 Å²	13	35.1 Å²	35.1	11%	0.107	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-25.8	-178.4	0	0	0	0	0	114	Y139 F149 I155	Y139-A153 HydrophobicContact CD1-CB 3.77Å; Y139-A153 HydrophobicContact CE1-CB 4.04Å; F149-A153 HydrophobicContact CD1-CB 4.13Å; F149-A153 HydrophobicContact CE1-CB 3.78Å; F149-A153 HydrophobicContact CZ-CB 4.44Å; F149-A153 VanDerWaalsContact O-CB 3.29Å; F149-A153 WeakPolarHBondContact O-CB 3.18Å; F149-A153 PolarHBondContact O-N 3.36Å; A153-I155 VanDerWaalsContact C-N 3.25Å; A153-I155 PolarHBondContact O-N 3.02Å
154	K	94	Very high	97.1	Very high	133 Å²	133	34.7 Å²	34.7	58%	0.578	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.1	174.4	-66.9	172.4	-174.8	-179.8	0	112.9	N150 I152	N150-K154 WeakPolarHBondContact O-CG 3.5Å; I152-K154 PolarHBondContact O-N 3.01Å
155	I	95.2	Very high	97.1	Very high	34 Å²	34	33.8 Å²	33.8	17%	0.174	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-45.7	-177.3	-48.9	177.6	0	0	0	110	I152 A153 T157 L357 K358 H361	I152-I155 PolarHBondContact O-N 3.33Å; A153-I155 VanDerWaalsContact C-N 3.25Å; A153-I155 PolarHBondContact O-N 3.02Å; I155-T157 PolarHBondContact O-N 2.87Å; I155-L357 HydrophobicContact CG2-CB 4.18Å; I155-K358 HydrophobicContact CD1-CG 4.43Å; I155-H361 HydrophobicContact CD1-CB 3.91Å; I155-H361 HydrophobicContact CG1-CB 4.05Å; I155-H361 HydrophobicContact CG2-CB 4.3Å
156	F	96.8	Very high	97.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	-100.9	64.6	-175.9	-68.9	-93.7	0	0	0	110.6	L28 Y139 I152 V159 V345 F354 L357 K358	L28-F156 HydrophobicContact CD1-CD1 4.18Å; L28-F156 HydrophobicContact CD2-CD1 4.27Å; L28-F156 HydrophobicContact CD2-CE1 4.35Å; Y139-F156 WeakPolarHBondContact CE1-O 3.33Å; Y139-F156 PolarHBondContact OH-O 3.42Å; I152-F156 HydrophobicContact CG2-CB 4.19Å; I152-F156 HydrophobicContact CG2-CD2 3.86Å; I152-F156 HydrophobicContact CG2-CG 4.29Å; I152-F156 PolarHBondContact O-N 3.21Å; F156-V159 HydrophobicContact CB-CG2 4.22Å; F156-V345 HydrophobicContact CB-CG1 3.9Å; F156-V345 WeakPolarHBondContact O-CG1 3.35Å; F156-F354 HydrophobicContact CE1-CB 3.69Å; F156-F354 HydrophobicContact CE1-CG 4.35Å; F156-F354 HydrophobicContact CZ-CB 4.04Å; F156-L357 HydrophobicContact CE1-CD1 4.28Å; F156-L357 HydrophobicContact CZ-CB 4.35Å; F156-K358 HydrophobicContact CE2-CD 4.25Å; F156-K358 HydrophobicContact CE2-CG 3.71Å; F156-K358 HydrophobicContact CZ-CG 4.15Å
157	T	95.8	Very high	97.1	Very high	43 Å²	43	31.7 Å²	31.7	26%	0.264	17%	0.171	S	C	.	.			trans	-82.8	161.7	172.8	-164.8	0	0	0	0	111.7	S22 R25 I155 V159	S22-T157 WeakPolarHBondContact CA-OG1 3.44Å; S22-T157 PolarHBondContact O-OG1 3.18Å; R25-T157 VanDerWaalsContact CG-O 3.26Å; R25-T157 WeakPolarHBondContact CG-O 3.5Å; I155-T157 PolarHBondContact O-N 2.87Å; T157-V159 PolarHBondContact O-N 3.15Å; T157-V159 VanDerWaalsContact O-N 3.1Å
158	G	97.5	Very high	97.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	67.8	8	174.6	0	0	0	0	0	115.9	R21 S22 L24 R25 T29 R160	R21-G158 WeakPolarHBondContact O-CA 3.37Å; S22-G158 WeakPolarHBondContact O-CA 3.46Å; S22-G158 PolarHBondContact O-N 3.37Å; L24-G158 CarbonylContact C-O 3.54Å; R25-G158 PolarHBondContact N-O 3.41Å; T29-G158 PolarHBondContact OG1-O 2.92Å; G158-R160 PolarHBondContact O-N 2.83Å
159	V	98.3	Very high	97.3	Very high	3 Å²	3	25 Å²	25	2%	0.018	13%	0.13	C	C	.	.			trans	-74.6	111.7	174.4	-172.2	0	0	0	0	108.3	L28 Y139 F156 T157 V345 C348	L28-V159 HydrophobicContact CB-CG2 3.83Å; L28-V159 HydrophobicContact CD1-CG2 3.77Å; L28-V159 HydrophobicContact CG-CG2 4.44Å; Y139-V159 PolarHBondContact OH-N 2.85Å; Y139-V159 PolarHBondContact OH-O 2.82Å; F156-V159 HydrophobicContact CB-CG2 4.22Å; T157-V159 PolarHBondContact O-N 3.15Å; T157-V159 VanDerWaalsContact O-N 3.1Å; V159-V345 HydrophobicContact CB-CG2 4.21Å; V159-V345 HydrophobicContact CG2-CG1 4.38Å; V159-C348 HydrophobicContact CG1-CB 4.03Å; V159-C348 HydrophobicContact CG2-CB 4.48Å
160	R	97.4	Very high	97.4	Very high	2 Å²	2	25 Å²	25	1%	0.008	13%	0.13	C	C	.	.			trans	-118.6	158.8	-175.1	-145.4	-155.7	-38.1	-56.8	-7.4	113.4	E23 L24 T29 Q34 F129 L131 L135 G158 W341	E23-R160 VanDerWaalsContact C-NH1 3.26Å; E23-R160 PolarHBondContact O-NH1 3.08Å; E23-R160 PolarHBondContact O-NH2 2.95Å; L24-R160 VanDerWaalsContact CG-NH2 3.33Å; T29-R160 WeakPolarHBondContact CG2-O 3.28Å; T29-R160 PolarHBondContact OG1-N 3.17Å; Q34-R160 PolarHBondContact NE2-O 3.24Å; Q34-R160 PolarHBondContact OE1-O 2.89Å; F129-R160 WeakPolarHBondContact O-CD 3.43Å; F129-R160 PolarHBondContact O-NE 3.41Å; L131-R160 VanDerWaalsContact CD2-NH2 3.34Å; L135-R160 HydrophobicContact CD1-CG 4.24Å; L135-R160 HydrophobicContact CD2-CB 4.35Å; L135-R160 HydrophobicContact CD2-CG 4.19Å; G158-R160 PolarHBondContact O-N 2.83Å; R160-W341 HydrophobicContact CG-CE3 4.32Å; R160-W341 HydrophobicContact CG-CZ3 3.8Å
161	M	98.4	Very high	97.4	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.112	C	C	.	.			trans	-84.2	126.9	173.6	-171.6	51.5	54	0	0	111.3	Q34 Q130 L285 M286 W341 S344	Q34-M161 PolarHBondContact OE1-SD 2.93Å; Q130-M161 PolarHBondContact NE2-O 3.22Å; M161-L285 HydrophobicContact CE-CD1 4.09Å; M161-L285 HydrophobicContact CE-CD2 3.63Å; M161-L285 HydrophobicContact CE-CG 3.75Å; M161-L285 HydrophobicContact CG-CD1 4.4Å; M161-L285 HydrophobicContact SD-CD1 4.37Å; M161-L285 HydrophobicContact SD-CD2 4.34Å; M161-L285 HydrophobicContact SD-CG 3.89Å; M161-M286 HydrophobicContact SD-CB 4.23Å; M161-M286 HydrophobicContact SD-CG 3.65Å; M161-W341 HydrophobicContact CB-CD2 3.52Å; M161-W341 HydrophobicContact CB-CE3 4.08Å; M161-W341 HydrophobicContact CB-CG 3.84Å; M161-W341 HydrophobicContact CB-CH2 4.34Å; M161-W341 HydrophobicContact CB-CZ2 3.83Å; M161-W341 HydrophobicContact CB-CZ3 4.46Å; M161-W341 HydrophobicContact CG-CD2 4.46Å; M161-W341 HydrophobicContact CG-CZ2 4.46Å; M161-S344 WeakPolarHBondContact CE-OG 3.48Å
162	L	98.6	Very high	97.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.093	C	C	.	.			trans	-76.9	146.2	172.1	-58.2	177.6	0	0	0	111	T29 L30 Q34 Y128 F129 Q164	T29-L162 HydrophobicContact CG2-CD2 3.72Å; T29-L162 HydrophobicContact CG2-CG 4.14Å; L30-L162 HydrophobicContact CD2-CD1 4.27Å; L30-L162 HydrophobicContact CD2-CD2 4.44Å; Q34-L162 HydrophobicContact CB-CD1 4.03Å; Q34-L162 HydrophobicContact CB-CG 4.46Å; Y128-L162 HydrophobicContact CD1-CD2 4.02Å; Y128-L162 HydrophobicContact CE1-CD1 4.15Å; Y128-L162 HydrophobicContact CE1-CD2 3.64Å; Y128-L162 HydrophobicContact CE1-CG 4.34Å; Y128-L162 CarbonylContact O-C 3.55Å; Y128-L162 WeakPolarHBondContact O-CA 3.4Å; F129-L162 HydrophobicContact CD1-CD2 3.56Å; F129-L162 HydrophobicContact CE1-CD2 3.66Å; L162-Q164 HydrophobicContact CB-CG 4.03Å
163	R	98.4	Very high	97.6	Very high	53 Å²	53	18.3 Å²	18.3	20%	0.2	9%	0.091	C	C	.	.			trans	-103	84.9	168.1	-173.6	175.8	-179.1	-103.7	16.1	109.4	D127 Y128 Q130 R258 E289	D127-R163 WeakPolarHBondContact O-CB 3.3Å; D127-R163 IonicContact OD1-CZ 3.7Å; D127-R163 IonicContact OD1-NE 2.81Å; D127-R163 IonicContact OD1-NH1 3.6Å; D127-R163 PolarHBondContact OD1-NH1 2.85Å; D127-R163 IonicContact OD2-CZ 3.62Å; D127-R163 IonicContact OD2-NH1 3.57Å; D127-R163 PolarHBondContact OD2-NH1 3.27Å; Y128-R163 PolarHBondContact O-N 3.25Å; Q130-R163 HydrophobicContact CG-CB 3.66Å; R163-R258 VanDerWaalsContact CZ-NH1 3.34Å; R163-R258 VanDerWaalsContact NH2-NH1 3.13Å; R163-E289 IonicContact CZ-OE1 3.3Å; R163-E289 IonicContact NE-OE1 3.54Å; R163-E289 PolarHBondContact NE-OE1 2.82Å; R163-E289 IonicContact NH2-OE1 3.41Å; R163-E289 PolarHBondContact NH2-OE1 3.34Å
164	Q	98.5	Very high	97.8	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	9%	0.086	C	C	.	.			trans	-78.3	161.1	-175.3	-64.6	179.1	82.8	0	0	112.1	Q34 Y128 L162 C169 R258 M286 S287	Q34-Q164 PolarHBondContact O-NE2 2.92Å; Q34-Q164 PolarHBondContact O-OE1 3.4Å; Y128-Q164 HydrophobicContact CE2-CG 4.15Å; L162-Q164 HydrophobicContact CB-CG 4.03Å; Q164-C169 HydrophobicContact CB-CB 4.01Å; Q164-R258 PolarHBondContact O-NH2 2.79Å; Q164-R258 VanDerWaalsContact O-NH2 3.12Å; Q164-M286 WeakPolarHBondContact CB-O 3.25Å; Q164-M286 PolarHBondContact N-O 2.83Å; Q164-S287 WeakPolarHBondContact O-CB 3.38Å
165	D	97.9	Very high	97.9	Very high	68 Å²	68	11.4 Å²	11.4	36%	0.364	6%	0.058	S	C	.	.			trans	-62	130.2	165.3	173.8	-98.8	0	0	0	109.8	T167 E168 C169 Q255	D165-T167 VanDerWaalsContact C-N 3.28Å; D165-T167 PolarHBondContact O-N 3.45Å; D165-T167 WeakPolarHBondContact OD1-CA 3.45Å; D165-T167 WeakPolarHBondContact OD1-CB 3.12Å; D165-T167 PolarHBondContact OD1-N 2.86Å; D165-E168 HydrophobicContact CB-CB 4.15Å; D165-E168 PolarHBondContact O-N 2.95Å; D165-E168 PolarHBondContact OD1-N 3.33Å; D165-C169 WeakPolarHBondContact O-CB 3.37Å; D165-C169 PolarHBondContact O-N 3.1Å; D165-Q255 PolarHBondContact OD2-NE2 3.21Å
166	P	98.3	Very high	97.9	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-57.4	-34.2	-179.6	-29.7	37.6	0	0	0	115	L170 L254 L288	P166-L170 WeakPolarHBondContact O-CB 3.47Å; P166-L170 PolarHBondContact O-N 3.23Å; P166-L254 HydrophobicContact CB-CB 3.95Å; P166-L288 HydrophobicContact CB-CD2 4.04Å; P166-L288 HydrophobicContact CG-CD2 4Å
167	T	98	Very high	97.6	Very high	14 Å²	14	12.1 Å²	12.1	9%	0.086	7%	0.065	C	C	.	.	H	α-helix	trans	-70.9	-55.1	178.5	-51.2	0	0	0	0	109.2	D165 C169 L170 F171 L213	D165-T167 VanDerWaalsContact C-N 3.28Å; D165-T167 PolarHBondContact O-N 3.45Å; D165-T167 WeakPolarHBondContact OD1-CA 3.45Å; D165-T167 WeakPolarHBondContact OD1-CB 3.12Å; D165-T167 PolarHBondContact OD1-N 2.86Å; T167-C169 VanDerWaalsContact C-N 3.28Å; T167-C169 PolarHBondContact O-N 3.27Å; T167-L170 PolarHBondContact O-N 3.37Å; T167-F171 HydrophobicContact CG2-CD2 3.74Å; T167-F171 HydrophobicContact CG2-CE2 3.81Å; T167-F171 VanDerWaalsContact O-CD2 3.24Å; T167-F171 WeakPolarHBondContact O-CD2 3.39Å; T167-F171 PolarHBondContact O-N 3.28Å; T167-F171 VanDerWaalsContact O-N 3.08Å; T167-L213 HydrophobicContact CG2-CD2 3.92Å; T167-L213 HydrophobicContact CG2-CG 4.13Å
168	E	98.6	Very high	97.2	Very high	15 Å²	15	17.3 Å²	17.3	7%	0.07	9%	0.091	C	C	.	.	H	α-helix	trans	-54	-47.3	177.2	175.3	170.3	124.8	0	0	111.6	R37 D165 S172 F210	R37-E168 VanDerWaalsContact CG-OE1 3.24Å; R37-E168 WeakPolarHBondContact CG-OE1 3.36Å; D165-E168 HydrophobicContact CB-CB 4.15Å; D165-E168 PolarHBondContact O-N 2.95Å; D165-E168 PolarHBondContact OD1-N 3.33Å; E168-S172 WeakPolarHBondContact O-CB 3.21Å; E168-S172 PolarHBondContact O-N 3.47Å; E168-S172 PolarHBondContact O-OG 3.01Å; E168-F210 HydrophobicContact CB-CB 4.25Å; E168-F210 HydrophobicContact CB-CD1 4.07Å; E168-F210 HydrophobicContact CB-CD2 3.88Å; E168-F210 HydrophobicContact CB-CE1 4.45Å; E168-F210 HydrophobicContact CB-CE2 4.26Å; E168-F210 HydrophobicContact CB-CG 3.78Å; E168-F210 HydrophobicContact CG-CB 4.45Å; E168-F210 HydrophobicContact CG-CD2 3.5Å; E168-F210 HydrophobicContact CG-CE2 3.83Å; E168-F210 HydrophobicContact CG-CG 3.93Å
169	C	98.7	Very high	96.9	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.6	-51.8	179.7	-173.4	0	0	0	0	111	Q164 D165 T167 F171 S172 F173	Q164-C169 HydrophobicContact CB-CB 4.01Å; D165-C169 WeakPolarHBondContact O-CB 3.37Å; D165-C169 PolarHBondContact O-N 3.1Å; T167-C169 VanDerWaalsContact C-N 3.28Å; T167-C169 PolarHBondContact O-N 3.27Å; C169-F171 PolarHBondContact O-N 3.25Å; C169-S172 PolarHBondContact O-N 3.4Å; C169-F173 WeakPolarHBondContact O-CB 3.49Å; C169-F173 VanDerWaalsContact O-CD2 3.24Å; C169-F173 WeakPolarHBondContact O-CD2 3.21Å; C169-F173 PolarHBondContact O-N 2.84Å
170	L	98.7	Very high	96.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57.2	-55.3	-178.7	173.2	61.9	0	0	0	112.5	P166 T167 S172 F173 I174 I244 L254 L269 L272 V275 V283	P166-L170 WeakPolarHBondContact O-CB 3.47Å; P166-L170 PolarHBondContact O-N 3.23Å; T167-L170 PolarHBondContact O-N 3.37Å; L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 3.21Å; L170-F173 PolarHBondContact O-N 3.08Å; L170-F173 VanDerWaalsContact O-N 3.17Å; L170-I174 HydrophobicContact CD1-CD1 4.16Å; L170-I174 HydrophobicContact CD1-CG1 4.38Å; L170-I174 HydrophobicContact CG-CD1 4.24Å; L170-I174 WeakPolarHBondContact O-CG1 3.4Å; L170-I174 PolarHBondContact O-N 3.07Å; L170-I244 HydrophobicContact CD2-CD1 3.84Å; L170-L254 HydrophobicContact CD2-CD1 4.09Å; L170-L254 HydrophobicContact CD2-CD2 3.84Å; L170-L269 HydrophobicContact CD1-CD2 4.34Å; L170-L272 HydrophobicContact CD1-CD1 4.34Å; L170-L272 HydrophobicContact CD2-CD1 3.65Å; L170-V275 HydrophobicContact CD1-CG2 3.84Å; L170-V283 HydrophobicContact CB-CG2 4.26Å; L170-V283 HydrophobicContact CD1-CG2 4.07Å
171	F	98.6	Very high	96.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-71	-31	-174.6	-71.7	-79	0	0	0	112	T167 C169 I174 C175 F210 L213 L216 L237 A241 I244	T167-F171 HydrophobicContact CG2-CD2 3.74Å; T167-F171 HydrophobicContact CG2-CE2 3.81Å; T167-F171 VanDerWaalsContact O-CD2 3.24Å; T167-F171 WeakPolarHBondContact O-CD2 3.39Å; T167-F171 PolarHBondContact O-N 3.28Å; T167-F171 VanDerWaalsContact O-N 3.08Å; C169-F171 PolarHBondContact O-N 3.25Å; F171-I174 HydrophobicContact CD1-CD1 4.26Å; F171-C175 PolarHBondContact O-SG 3.04Å; F171-C175 VanDerWaalsContact O-SG 3.34Å; F171-F210 HydrophobicContact CB-CE1 3.9Å; F171-F210 HydrophobicContact CB-CZ 3.7Å; F171-F210 HydrophobicContact CD2-CE1 4.46Å; F171-L213 HydrophobicContact CE2-CD2 3.45Å; F171-L213 VanDerWaalsContact CE2-CD2 3.45Å; F171-L213 HydrophobicContact CZ-CD2 3.72Å; F171-L216 HydrophobicContact CD1-CD1 3.97Å; F171-L216 HydrophobicContact CD2-CD1 3.75Å; F171-L216 HydrophobicContact CE1-CD1 4.13Å; F171-L216 HydrophobicContact CE2-CD1 3.95Å; F171-L216 HydrophobicContact CG-CD1 3.8Å; F171-L216 HydrophobicContact CZ-CD1 4.13Å; F171-L237 HydrophobicContact CB-CD2 3.98Å; F171-L237 HydrophobicContact CD1-CB 4.35Å; F171-L237 HydrophobicContact CD1-CD2 3.65Å; F171-L237 VanDerWaalsContact CE1-O 3.25Å; F171-L237 WeakPolarHBondContact CE1-O 3.44Å; F171-L237 HydrophobicContact CG-CD2 4.31Å; F171-L237 VanDerWaalsContact O-CD2 3.32Å; F171-L237 WeakPolarHBondContact O-CD2 3.5Å; F171-A241 HydrophobicContact CE1-CB 3.94Å; F171-A241 HydrophobicContact CZ-CB 3.77Å; F171-I244 HydrophobicContact CE2-CD1 4.32Å; F171-I244 HydrophobicContact CZ-CD1 4.06Å
172	S	98.6	Very high	96.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-44.9	169.2	-63.1	0	0	0	0	111.6	E168 C169 L170 I174 C175	E168-S172 WeakPolarHBondContact O-CB 3.21Å; E168-S172 PolarHBondContact O-N 3.47Å; E168-S172 PolarHBondContact O-OG 3.01Å; C169-S172 PolarHBondContact O-N 3.4Å; L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 3.21Å; S172-I174 PolarHBondContact O-N 3.3Å; S172-C175 VanDerWaalsContact O-CB 3.23Å; S172-C175 WeakPolarHBondContact O-CB 3.49Å; S172-C175 PolarHBondContact O-N 3.09Å; S172-C175 VanDerWaalsContact O-N 3.08Å
173	F	98.4	Very high	96	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-73	-26.9	-178	-85.4	-78.1	0	0	0	114	Q34 F36 C169 L170 C175 T176 V279 C282 V283 M286	Q34-F173 WeakPolarHBondContact O-CE2 3.17Å; F36-F173 HydrophobicContact CE2-CE1 4.42Å; F36-F173 HydrophobicContact CE2-CE2 4.4Å; F36-F173 HydrophobicContact CE2-CZ 4.18Å; F36-F173 HydrophobicContact CZ-CE1 4.48Å; F36-F173 HydrophobicContact CZ-CZ 4.47Å; C169-F173 WeakPolarHBondContact O-CB 3.49Å; C169-F173 VanDerWaalsContact O-CD2 3.24Å; C169-F173 WeakPolarHBondContact O-CD2 3.21Å; C169-F173 PolarHBondContact O-N 2.84Å; L170-F173 PolarHBondContact O-N 3.08Å; L170-F173 VanDerWaalsContact O-N 3.17Å; F173-C175 PolarHBondContact O-N 2.95Å; F173-T176 HydrophobicContact CB-CG2 4.47Å; F173-T176 HydrophobicContact CD1-CG2 3.65Å; F173-T176 HydrophobicContact CE1-CG2 4.08Å; F173-T176 HydrophobicContact CG-CG2 4.26Å; F173-T176 WeakPolarHBondContact O-CB 3.43Å; F173-T176 PolarHBondContact O-N 3.24Å; F173-T176 PolarHBondContact O-OG1 2.8Å; F173-V279 HydrophobicContact CB-CG1 4.05Å; F173-C282 HydrophobicContact CD1-CB 3.5Å; F173-C282 VanDerWaalsContact CD1-CB 3.5Å; F173-C282 HydrophobicContact CD2-CB 4.19Å; F173-C282 HydrophobicContact CE1-CB 3.7Å; F173-C282 HydrophobicContact CE2-CB 4.36Å; F173-C282 HydrophobicContact CG-CB 3.8Å; F173-C282 HydrophobicContact CZ-CB 4.16Å; F173-V283 HydrophobicContact CB-CG2 4.34Å; F173-M286 HydrophobicContact CE1-CE 4.48Å; F173-M286 HydrophobicContact CE1-SD 4.25Å; F173-M286 HydrophobicContact CE2-SD 3.47Å; F173-M286 WeakPolarHBondContact CE2-SD 3.29Å; F173-M286 HydrophobicContact CZ-CE 3.93Å; F173-M286 HydrophobicContact CZ-SD 3.24Å; F173-M286 WeakPolarHBondContact CZ-SD 2.95Å
174	I	98.4	Very high	95.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.9	-35.2	167.4	-71	170.2	0	0	0	110.6	L170 F171 S172 T176 S177 R233 F236 L237 V275 V279	L170-I174 HydrophobicContact CD1-CD1 4.16Å; L170-I174 HydrophobicContact CD1-CG1 4.38Å; L170-I174 HydrophobicContact CG-CD1 4.24Å; L170-I174 WeakPolarHBondContact O-CG1 3.4Å; L170-I174 PolarHBondContact O-N 3.07Å; F171-I174 HydrophobicContact CD1-CD1 4.26Å; S172-I174 PolarHBondContact O-N 3.3Å; I174-T176 PolarHBondContact O-N 3.32Å; I174-S177 PolarHBondContact O-OG 2.78Å; I174-R233 WeakPolarHBondContact O-CD 2.98Å; I174-F236 HydrophobicContact CG2-CB 3.76Å; I174-L237 HydrophobicContact CB-CD2 3.91Å; I174-L237 HydrophobicContact CD1-CD2 4.45Å; I174-L237 HydrophobicContact CG2-CD2 3.74Å; I174-L237 HydrophobicContact CG2-CG 4.12Å; I174-V275 HydrophobicContact CD1-CG2 4.08Å; I174-V275 HydrophobicContact CG1-CG2 3.97Å; I174-V279 HydrophobicContact CG1-CG1 4.45Å
175	C	97.3	Very high	95.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.7	177.3	-60.2	0	0	0	0	114.4	F171 S172 F173 N179 I184 M187	F171-C175 PolarHBondContact O-SG 3.04Å; F171-C175 VanDerWaalsContact O-SG 3.34Å; S172-C175 VanDerWaalsContact O-CB 3.23Å; S172-C175 WeakPolarHBondContact O-CB 3.49Å; S172-C175 PolarHBondContact O-N 3.09Å; S172-C175 VanDerWaalsContact O-N 3.08Å; F173-C175 PolarHBondContact O-N 2.95Å; C175-N179 PolarHBondContact O-ND2 3.22Å; C175-I184 HydrophobicContact CB-CG2 4.32Å; C175-M187 HydrophobicContact CB-CE 4.19Å
176	T	95.4	Very high	95.7	Very high	16 Å²	16	33.1 Å²	33.1	10%	0.098	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-22.1	-171.5	70.2	0	0	0	0	114.4	F36 F173 I174 N178 N179 I184	F36-T176 HydrophobicContact CE2-CG2 3.85Å; F36-T176 HydrophobicContact CZ-CG2 3.68Å; F173-T176 HydrophobicContact CB-CG2 4.47Å; F173-T176 HydrophobicContact CD1-CG2 3.65Å; F173-T176 HydrophobicContact CE1-CG2 4.08Å; F173-T176 HydrophobicContact CG-CG2 4.26Å; F173-T176 WeakPolarHBondContact O-CB 3.43Å; F173-T176 PolarHBondContact O-N 3.24Å; F173-T176 PolarHBondContact O-OG1 2.8Å; I174-T176 PolarHBondContact O-N 3.32Å; T176-N178 PolarHBondContact O-N 2.82Å; T176-N179 WeakPolarHBondContact O-CB 3.5Å; T176-N179 PolarHBondContact O-N 3.33Å; T176-I184 HydrophobicContact CG2-CD1 3.86Å; T176-I184 HydrophobicContact CG2-CG1 4.4Å; T176-I184 HydrophobicContact CG2-CG2 4.03Å
177	S	89.1	Confident	95.7	Very high	33 Å²	33	33.1 Å²	33.1	23%	0.231	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	124.6	-178.4	55.4	0	0	0	0	110.6	I174 N179 Y232 R233	I174-S177 PolarHBondContact O-OG 2.78Å; S177-N179 PolarHBondContact O-N 3.45Å; S177-Y232 PolarHBondContact OG-OH 2.79Å; S177-R233 VanDerWaalsContact O-CZ 3.25Å; S177-R233 PolarHBondContact O-NE 3.04Å; S177-R233 VanDerWaalsContact O-NE 3.08Å; S177-R233 PolarHBondContact O-NH2 2.92Å; S177-R233 PolarHBondContact OG-NE 3.13Å
178	N	88.5	Confident	95.7	Very high	152 Å²	152	32.5 Å²	32.5	81%	0.813	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.7	57.9	-178	-169.1	23.6	0	0	0	113.7	T176 R233	T176-N178 PolarHBondContact O-N 2.82Å; N178-R233 PolarHBondContact O-NH2 2.93Å
179	N	91.9	Very high	95.6	Very high	36 Å²	36	34.6 Å²	34.6	19%	0.193	18%	0.183	C	C	.	.			trans	-152	174.7	-174.6	-151.4	-8	0	0	0	110.9	C175 T176 S177 R183 I184 M187	C175-N179 PolarHBondContact O-ND2 3.22Å; T176-N179 WeakPolarHBondContact O-CB 3.5Å; T176-N179 PolarHBondContact O-N 3.33Å; S177-N179 PolarHBondContact O-N 3.45Å; N179-R183 WeakPolarHBondContact OD1-CB 3.37Å; N179-R183 WeakPolarHBondContact OD1-CD 3.29Å; N179-R183 VanDerWaalsContact OD1-CG 3.3Å; N179-R183 WeakPolarHBondContact OD1-CG 3.42Å; N179-R183 PolarHBondContact OD1-NH1 2.84Å; N179-I184 HydrophobicContact CB-CD1 4.04Å; N179-I184 HydrophobicContact CB-CG1 3.8Å; N179-I184 WeakPolarHBondContact ND2-CG1 3.41Å; N179-M187 PolarHBondContact ND2-SD 3.47Å
180	H	91.6	Very high	95.6	Very high	113 Å²	113	38.8 Å²	38.8	52%	0.523	20%	0.199	S	C	.	.			trans	-127.2	153.4	176.8	64.1	81.7	0	0	0	111.8	S182 R183 I184	H180-S182 PolarHBondContact O-N 3.38Å; H180-R183 WeakPolarHBondContact CE1-CB 3.19Å; H180-R183 PolarHBondContact CE1-N 3.25Å; H180-R183 PolarHBondContact ND1-N 3.17Å; H180-R183 WeakPolarHBondContact NE2-CB 3.5Å; H180-R183 PolarHBondContact O-N 3.17Å; H180-I184 WeakPolarHBondContact O-CD1 3.38Å; H180-I184 WeakPolarHBondContact O-CG1 3.42Å; H180-I184 PolarHBondContact O-N 3.28Å
181	I	91.7	Very high	95.6	Very high	51 Å²	51	38.8 Å²	38.8	26%	0.262	20%	0.199	S	C	.	.	H	α-helix	trans	-48.7	-53	-168	-63.7	174.3	0	0	0	112.2	F36 R183 I184 Q185 L351	F36-I181 HydrophobicContact CE1-CG2 4.4Å; I181-R183 PolarHBondContact O-N 2.9Å; I181-I184 PolarHBondContact O-N 2.89Å; I181-Q185 WeakPolarHBondContact O-CB 3.35Å; I181-Q185 PolarHBondContact O-N 3.34Å; I181-L351 HydrophobicContact CD1-CD1 4.13Å; I181-L351 HydrophobicContact CD1-CD2 3.92Å
182	S	93.3	Very high	95.6	Very high	86 Å²	86	38.8 Å²	38.8	60%	0.601	20%	0.199	S	C	*	.	H	α-helix	trans	-57.2	-42	-179.3	168.8	0	0	0	0	113.7	H180 Q185 G186	H180-S182 PolarHBondContact O-N 3.38Å; S182-Q185 VanDerWaalsContact O-CB 3.28Å; S182-Q185 WeakPolarHBondContact O-CB 3.48Å; S182-Q185 PolarHBondContact O-N 3.1Å; S182-G186 PolarHBondContact O-N 3.4Å
183	R	95.8	Very high	95.5	Very high	105 Å²	105	42.4 Å²	42.4	40%	0.396	22%	0.216	S	C	.	.	H	α-helix	trans	-71	-40.3	178	173.4	170.1	174.7	-139.9	9.5	111.5	N179 H180 I181 Q185 G186 M187	N179-R183 WeakPolarHBondContact OD1-CB 3.37Å; N179-R183 WeakPolarHBondContact OD1-CD 3.29Å; N179-R183 VanDerWaalsContact OD1-CG 3.3Å; N179-R183 WeakPolarHBondContact OD1-CG 3.42Å; N179-R183 PolarHBondContact OD1-NH1 2.84Å; H180-R183 WeakPolarHBondContact CE1-CB 3.19Å; H180-R183 PolarHBondContact CE1-N 3.25Å; H180-R183 PolarHBondContact ND1-N 3.17Å; H180-R183 WeakPolarHBondContact NE2-CB 3.5Å; H180-R183 PolarHBondContact O-N 3.17Å; I181-R183 PolarHBondContact O-N 2.9Å; R183-Q185 VanDerWaalsContact C-N 3.26Å; R183-Q185 PolarHBondContact O-N 3.32Å; R183-G186 PolarHBondContact O-N 3.19Å; R183-M187 HydrophobicContact CG-CG 4.39Å; R183-M187 HydrophobicContact CG-SD 4.13Å; R183-M187 VanDerWaalsContact O-CG 3.31Å; R183-M187 WeakPolarHBondContact O-CG 3.5Å; R183-M187 PolarHBondContact O-N 2.87Å
184	I	96.6	Very high	95.5	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.031	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-43.3	175.5	-60.3	153.9	0	0	0	109.7	F36 C175 T176 N179 H180 I181 G186 M187 V188	F36-I184 HydrophobicContact CD1-CB 4Å; F36-I184 HydrophobicContact CD1-CG2 3.59Å; F36-I184 HydrophobicContact CD2-CG2 3.86Å; F36-I184 HydrophobicContact CE1-CB 3.93Å; F36-I184 HydrophobicContact CE1-CD1 4.2Å; F36-I184 HydrophobicContact CE1-CG2 3.58Å; F36-I184 HydrophobicContact CE2-CG2 3.84Å; F36-I184 HydrophobicContact CG-CG2 3.73Å; F36-I184 HydrophobicContact CZ-CB 4.44Å; F36-I184 HydrophobicContact CZ-CD1 4.38Å; F36-I184 HydrophobicContact CZ-CG2 3.72Å; C175-I184 HydrophobicContact CB-CG2 4.32Å; T176-I184 HydrophobicContact CG2-CD1 3.86Å; T176-I184 HydrophobicContact CG2-CG1 4.4Å; T176-I184 HydrophobicContact CG2-CG2 4.03Å; N179-I184 HydrophobicContact CB-CD1 4.04Å; N179-I184 HydrophobicContact CB-CG1 3.8Å; N179-I184 WeakPolarHBondContact ND2-CG1 3.41Å; H180-I184 WeakPolarHBondContact O-CD1 3.38Å; H180-I184 WeakPolarHBondContact O-CG1 3.42Å; H180-I184 PolarHBondContact O-N 3.28Å; I181-I184 PolarHBondContact O-N 2.89Å; I184-G186 VanDerWaalsContact C-N 3.35Å; I184-G186 PolarHBondContact O-N 3.46Å; I184-M187 WeakPolarHBondContact O-CB 3.36Å; I184-M187 PolarHBondContact O-N 3.38Å; I184-M187 VanDerWaalsContact O-N 3.12Å; I184-V188 HydrophobicContact CG2-CG2 4.22Å; I184-V188 WeakPolarHBondContact O-CG2 3.45Å; I184-V188 PolarHBondContact O-N 3.29Å
185	Q	96.2	Very high	95.5	Very high	47 Å²	47	46.8 Å²	46.8	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-53.1	-49.2	175.4	-129.1	-176.1	-108.4	0	0	113	F36 R39 I181 S182 R183 E189	F36-Q185 HydrophobicContact CB-CG 4.26Å; F36-Q185 WeakPolarHBondContact O-CG 3.33Å; R39-Q185 VanDerWaalsContact CD-NE2 3.31Å; R39-Q185 VanDerWaalsContact CZ-CG 3.45Å; R39-Q185 PolarHBondContact NH2-O 2.92Å; I181-Q185 WeakPolarHBondContact O-CB 3.35Å; I181-Q185 PolarHBondContact O-N 3.34Å; S182-Q185 VanDerWaalsContact O-CB 3.28Å; S182-Q185 WeakPolarHBondContact O-CB 3.48Å; S182-Q185 PolarHBondContact O-N 3.1Å; R183-Q185 VanDerWaalsContact C-N 3.26Å; R183-Q185 PolarHBondContact O-N 3.32Å; Q185-E189 WeakPolarHBondContact O-CB 3.48Å; Q185-E189 PolarHBondContact O-N 3.43Å
186	G	96.8	Very high	95.5	Very high	17 Å²	17	47.3 Å²	47.3	18%	0.175	25%	0.249	C	C	.	.	H	α-helix	trans	-70.4	-32.4	177.2	0	0	0	0	0	113.3	S182 R183 I184 R190	S182-G186 PolarHBondContact O-N 3.4Å; R183-G186 PolarHBondContact O-N 3.19Å; I184-G186 VanDerWaalsContact C-N 3.35Å; I184-G186 PolarHBondContact O-N 3.46Å; G186-R190 WeakPolarHBondContact O-CG 3.43Å; G186-R190 PolarHBondContact O-N 3.32Å; G186-R190 VanDerWaalsContact O-N 3.08Å; G186-R190 PolarHBondContact O-NH1 3.28Å
187	M	97.8	Very high	95.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-52.4	173.6	-72	176.9	64.2	0	0	110.9	C175 N179 R183 I184 E189 R190 L191 F230	C175-M187 HydrophobicContact CB-CE 4.19Å; N179-M187 PolarHBondContact ND2-SD 3.47Å; R183-M187 HydrophobicContact CG-CG 4.39Å; R183-M187 HydrophobicContact CG-SD 4.13Å; R183-M187 VanDerWaalsContact O-CG 3.31Å; R183-M187 WeakPolarHBondContact O-CG 3.5Å; R183-M187 PolarHBondContact O-N 2.87Å; I184-M187 WeakPolarHBondContact O-CB 3.36Å; I184-M187 PolarHBondContact O-N 3.38Å; I184-M187 VanDerWaalsContact O-N 3.12Å; M187-E189 VanDerWaalsContact C-N 3.26Å; M187-E189 PolarHBondContact O-N 2.92Å; M187-R190 PolarHBondContact O-N 3.01Å; M187-L191 PolarHBondContact O-N 3.23Å; M187-F230 HydrophobicContact CB-CE1 4.12Å; M187-F230 HydrophobicContact CB-CZ 4Å; M187-F230 HydrophobicContact CE-CB 4.04Å; M187-F230 HydrophobicContact CE-CD1 3.35Å; M187-F230 HydrophobicContact CE-CD2 4.35Å; M187-F230 HydrophobicContact CE-CE1 3.81Å; M187-F230 HydrophobicContact CE-CG 3.66Å; M187-F230 HydrophobicContact CE-CZ 4.45Å; M187-F230 WeakPolarHBondContact O-CZ 3.25Å
188	V	98.2	Very high	95.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61	-37.5	179.2	173.9	0	0	0	0	111.2	F36 R37 I184 L191 C192 F210	F36-V188 HydrophobicContact CB-CB 4.17Å; F36-V188 HydrophobicContact CB-CG1 4.38Å; F36-V188 HydrophobicContact CB-CG2 4.09Å; F36-V188 HydrophobicContact CD2-CG2 4.42Å; F36-V188 HydrophobicContact CG-CG2 4.46Å; R37-V188 HydrophobicContact CG-CG1 4.48Å; I184-V188 HydrophobicContact CG2-CG2 4.22Å; I184-V188 WeakPolarHBondContact O-CG2 3.45Å; I184-V188 PolarHBondContact O-N 3.29Å; V188-L191 WeakPolarHBondContact O-CB 3.48Å; V188-L191 PolarHBondContact O-N 2.99Å; V188-C192 PolarHBondContact O-N 2.67Å; V188-C192 PolarHBondContact O-SG 3.09Å; V188-F210 HydrophobicContact CG1-CE2 4.25Å
189	E	96.9	Very high	96.2	Very high	59 Å²	59	47.7 Å²	47.7	28%	0.276	26%	0.257	S	S	.	.	H	α-helix	trans	-61.1	-49.4	174.4	-174.2	172.6	175.6	0	0	112.5	R39 Q185 M187 L191 C192 Q193	R39-E189 IonicContact CZ-OE2 2.72Å; R39-E189 IonicContact NE-OE2 2.93Å; R39-E189 IonicContact NH2-OE2 3.27Å; R39-E189 PolarHBondContact NH2-OE2 3.31Å; Q185-E189 WeakPolarHBondContact O-CB 3.48Å; Q185-E189 PolarHBondContact O-N 3.43Å; M187-E189 VanDerWaalsContact C-N 3.26Å; M187-E189 PolarHBondContact O-N 2.92Å; E189-L191 VanDerWaalsContact C-N 3.3Å; E189-L191 PolarHBondContact O-N 2.58Å; E189-C192 PolarHBondContact O-N 3.44Å; E189-Q193 WeakPolarHBondContact O-CG 3.45Å; E189-Q193 PolarHBondContact O-N 3.37Å
190	R	98	Very high	96.3	Very high	88 Å²	88	47.4 Å²	47.4	33%	0.332	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-34.7	175.9	-72.2	-167.7	-60.2	-80.3	4.2	112.8	G186 M187 Q193 S194 L228	G186-R190 WeakPolarHBondContact O-CG 3.43Å; G186-R190 PolarHBondContact O-N 3.32Å; G186-R190 VanDerWaalsContact O-N 3.08Å; G186-R190 PolarHBondContact O-NH1 3.28Å; M187-R190 PolarHBondContact O-N 3.01Å; R190-Q193 PolarHBondContact O-N 3.1Å; R190-S194 WeakPolarHBondContact O-CB 3.35Å; R190-S194 PolarHBondContact O-N 3.34Å; R190-S194 PolarHBondContact O-OG 3.28Å; R190-L228 PolarHBondContact NE-O 3.44Å; R190-L228 PolarHBondContact NH2-O 2.93Å
191	L	98.4	Very high	96.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.2	-52.1	174.4	-177.2	61.6	0	0	0	110.5	M187 V188 E189 S194 L195 F210 P211 L216 L225 F230	M187-L191 PolarHBondContact O-N 3.23Å; V188-L191 WeakPolarHBondContact O-CB 3.48Å; V188-L191 PolarHBondContact O-N 2.99Å; E189-L191 VanDerWaalsContact C-N 3.3Å; E189-L191 PolarHBondContact O-N 2.58Å; L191-S194 PolarHBondContact O-N 3.2Å; L191-L195 HydrophobicContact CD1-CD1 3.82Å; L191-L195 PolarHBondContact O-N 3.41Å; L191-F210 HydrophobicContact CD2-CE2 4.26Å; L191-F210 HydrophobicContact CD2-CZ 3.9Å; L191-P211 HydrophobicContact CG-CG 4.06Å; L191-L216 HydrophobicContact CD1-CD2 3.95Å; L191-L225 HydrophobicContact CD1-CD1 4.18Å; L191-L225 HydrophobicContact CD1-CD2 3.6Å; L191-F230 HydrophobicContact CB-CE1 4.38Å; L191-F230 HydrophobicContact CB-CZ 3.88Å; L191-F230 HydrophobicContact CD1-CZ 4.44Å
192	C	98.4	Very high	96.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-40.8	179.3	-62.8	0	0	0	0	112.2	R37 V188 E189 S194 G196 H208	R37-C192 PolarHBondContact NH1-SG 3.21Å; V188-C192 PolarHBondContact O-N 2.67Å; V188-C192 PolarHBondContact O-SG 3.09Å; E189-C192 PolarHBondContact O-N 3.44Å; C192-S194 VanDerWaalsContact C-N 3.27Å; C192-S194 PolarHBondContact O-N 3.08Å; C192-G196 WeakPolarHBondContact O-CA 3.36Å; C192-G196 PolarHBondContact O-N 3.05Å; C192-H208 HydrophobicContact CB-CB 4.24Å; C192-H208 WeakPolarHBondContact O-CB 3.47Å
193	Q	97.1	Very high	96.2	Very high	76 Å²	76	44 Å²	44	36%	0.355	23%	0.233	S	C	.	.	H	α-helix	trans	-63.3	-33.4	177.2	-74.3	170.9	-11.5	0	0	112.9	E189 R190	E189-Q193 WeakPolarHBondContact O-CG 3.45Å; E189-Q193 PolarHBondContact O-N 3.37Å; R190-Q193 PolarHBondContact O-N 3.1Å
194	S	97.7	Very high	95.8	Very high	57 Å²	57	48 Å²	48	40%	0.399	26%	0.256	S	S	.	.	H	α-helix	trans	-87.3	-34.7	-175.1	-52.3	0	0	0	0	113	R190 L191 C192 L228	R190-S194 WeakPolarHBondContact O-CB 3.35Å; R190-S194 PolarHBondContact O-N 3.34Å; R190-S194 PolarHBondContact O-OG 3.28Å; L191-S194 PolarHBondContact O-N 3.2Å; C192-S194 VanDerWaalsContact C-N 3.27Å; C192-S194 PolarHBondContact O-N 3.08Å; S194-L228 VanDerWaalsContact OG-CD1 3.23Å; S194-L228 WeakPolarHBondContact OG-CD1 3.46Å
195	L	98	Very high	95.6	Very high	39 Å²	39	50.1 Å²	50.1	20%	0.204	27%	0.269	C	S	.	.	H	α-helix	trans	-125	-6.9	-170.2	-55.6	178.7	0	0	0	114	L191 P211 L216 V221 L225	L191-L195 HydrophobicContact CD1-CD1 3.82Å; L191-L195 PolarHBondContact O-N 3.41Å; L195-P211 HydrophobicContact CB-CB 3.79Å; L195-P211 HydrophobicContact CB-CG 3.65Å; L195-L216 HydrophobicContact CD1-CD2 4.08Å; L195-V221 HydrophobicContact CD1-CG1 3.83Å; L195-V221 HydrophobicContact CD1-CG2 4.23Å; L195-V221 HydrophobicContact CD2-CG2 4.33Å; L195-L225 HydrophobicContact CD1-CD2 4.33Å
196	G	97.5	Very high	95.5	Very high	11 Å²	11	50 Å²	50	11%	0.113	27%	0.274	C	S	.	.	S	Bend	trans	-92.3	156.9	-177.2	0	0	0	0	0	112.6	C192 D209	C192-G196 WeakPolarHBondContact O-CA 3.36Å; C192-G196 PolarHBondContact O-N 3.05Å; G196-D209 WeakPolarHBondContact CA-O 3.4Å
197	T	96.5	Very high	95.5	Very high	97 Å²	97	50.2 Å²	50.2	60%	0.595	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-70.8	127.3	176.1	-55.6	0	0	0	0	110.1	L199 H208 D209	T197-L199 PolarHBondContact O-N 3.35Å; T197-H208 CarbonylContact O-C 3.32Å; T197-H208 VanDerWaalsContact O-CA 3.25Å; T197-H208 WeakPolarHBondContact O-CA 3.46Å; T197-D209 PolarHBondContact O-N 3.02Å
198	P	96.8	Very high	95.5	Very high	91 Å²	91	51.5 Å²	51.5	59%	0.591	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	134.8	174.8	-21.5	32.2	0	0	0	111.8
199	L	95.1	Very high	95.5	Very high	22 Å²	22	53.7 Å²	53.7	12%	0.115	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-58.6	-180	-64.5	177.3	0	0	0	111.6	V49 G52 V54 S71 T197 Y207 D209	V49-L199 HydrophobicContact CG1-CD1 3.51Å; V49-L199 HydrophobicContact CG2-CD1 4.24Å; G52-L199 WeakPolarHBondContact O-CD2 3.28Å; V54-L199 HydrophobicContact CG2-CB 3.99Å; V54-L199 HydrophobicContact CG2-CD1 4.06Å; S71-L199 PolarHBondContact OG-O 2.64Å; T197-L199 PolarHBondContact O-N 3.35Å; L199-Y207 WeakPolarHBondContact CB-O 3.31Å; L199-Y207 PolarHBondContact N-O 3.27Å; L199-D209 HydrophobicContact CD1-CB 4.13Å; L199-D209 HydrophobicContact CD2-CB 4.16Å; L199-D209 HydrophobicContact CG-CB 4.21Å
200	C	93.9	Very high	95.5	Very high	30 Å²	30	51.9 Å²	51.9	20%	0.203	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	172.2	174.4	69	0	0	0	0	110.6	V54 Y207	V54-C200 WeakPolarHBondContact CG2-SG 3.07Å; C200-Y207 PolarHBondContact N-O 3.23Å; C200-Y207 PolarHBondContact O-N 2.84Å
201	Q	93.6	Very high	95.5	Very high	114 Å²	114	47.8 Å²	47.8	53%	0.533	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.4	169.3	-177.6	177.8	-18.9	0	0	108	Q3 D203 T205	Q3-Q201 PolarHBondContact OE1-O 3.17Å; Q3-Q201 VanDerWaalsContact OE1-O 3.13Å; Q201-D203 PolarHBondContact NE2-O 2.96Å; Q201-D203 VanDerWaalsContact NE2-O 3.08Å; Q201-T205 WeakPolarHBondContact CA-O 3.36Å
202	L	91.2	Very high	95.5	Very high	9 Å²	9	50.8 Å²	50.8	5%	0.047	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	116.6	173.2	-53.6	177	0	0	0	108.1	Q3 H4 T47 V54 Y69 Q204 T205 Y207	Q3-L202 HydrophobicContact CB-CB 4.23Å; Q3-L202 HydrophobicContact CB-CD2 4.28Å; Q3-L202 VanDerWaalsContact OE1-CA 3.29Å; H4-L202 PolarHBondContact CE1-O 2.85Å; T47-L202 HydrophobicContact CG2-CD1 4.14Å; V54-L202 HydrophobicContact CG1-CD1 3.91Å; Y69-L202 HydrophobicContact CD1-CD1 4.11Å; Y69-L202 HydrophobicContact CD1-CD2 3.49Å; Y69-L202 VanDerWaalsContact CD1-CD2 3.49Å; Y69-L202 HydrophobicContact CD1-CG 4.45Å; Y69-L202 HydrophobicContact CD2-CD1 3.87Å; Y69-L202 HydrophobicContact CE1-CD1 3.81Å; Y69-L202 HydrophobicContact CE1-CD2 3.58Å; Y69-L202 HydrophobicContact CE1-CG 4.37Å; Y69-L202 HydrophobicContact CE2-CD1 3.57Å; Y69-L202 HydrophobicContact CG-CD1 4.13Å; Y69-L202 HydrophobicContact CG-CD2 4.04Å; L202-Q204 PolarHBondContact O-N 3.06Å; L202-T205 PolarHBondContact N-O 3.49Å; L202-T205 PolarHBondContact O-N 2.87Å; L202-Y207 HydrophobicContact CB-CD2 4.35Å; L202-Y207 HydrophobicContact CB-CE2 3.95Å; L202-Y207 HydrophobicContact CD1-CD2 4.19Å; L202-Y207 HydrophobicContact CD1-CE2 3.87Å; L202-Y207 HydrophobicContact CG-CD2 4.12Å; L202-Y207 HydrophobicContact CG-CE2 4.04Å
203	D	89.2	Confident	95.5	Very high	56 Å²	56	51.1 Å²	51.1	30%	0.299	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	-116.8	-172.9	-59.5	-53.1	0	0	0	110.7	S2 Q3 H4 Q201	S2-D203 WeakPolarHBondContact CA-OD1 3.39Å; Q3-D203 VanDerWaalsContact N-CG 3.35Å; Q3-D203 PolarHBondContact N-OD1 3.33Å; Q3-D203 PolarHBondContact N-OD2 3.14Å; H4-D203 IonicContact CE1-OD2 3.76Å; H4-D203 IonicContact CG-OD2 3.09Å; H4-D203 PolarHBondContact N-OD2 2.92Å; H4-D203 IonicContact ND1-OD2 3.88Å; H4-D203 PolarHBondContact ND1-OD2 3.12Å; Q201-D203 PolarHBondContact NE2-O 2.96Å; Q201-D203 VanDerWaalsContact NE2-O 3.08Å
204	Q	88.4	Confident	95.5	Very high	189 Å²	189	54 Å²	54	88%	0.883	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	4	177.2	-63.6	-176.1	-12.3	0	0	113	L202	L202-Q204 PolarHBondContact O-N 3.06Å
205	T	91.4	Very high	95.5	Very high	49 Å²	49	52.7 Å²	52.7	30%	0.301	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.1	-173.4	-53.4	0	0	0	0	110.9	Q201 L202 Y207	Q201-T205 WeakPolarHBondContact CA-O 3.36Å; L202-T205 PolarHBondContact N-O 3.49Å; L202-T205 PolarHBondContact O-N 2.87Å; T205-Y207 HydrophobicContact CG2-CD2 4.17Å; T205-Y207 HydrophobicContact CG2-CE1 4.47Å; T205-Y207 HydrophobicContact CG2-CE2 3.56Å; T205-Y207 WeakPolarHBondContact O-CD2 3.25Å
206	S	94.4	Very high	95.5	Very high	46 Å²	46	50.8 Å²	50.8	32%	0.322	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	118.8	174.7	-59.7	0	0	0	0	111.3	H208	S206-H208 PolarHBondContact O-ND1 3.29Å
207	Y	96.6	Very high	95.6	Very high	21 Å²	21	50.3 Å²	50.3	8%	0.082	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130	178.7	-69.5	-93.1	0	0	0	110.4	H4 T47 V49 V54 L199 C200 L202 T205	H4-Y207 AromaticContact NE2-CE2 3.85Å; H4-Y207 AromaticContact NE2-CZ 3.83Å; H4-Y207 PolarHBondContact NE2-OH 3.45Å; T47-Y207 HydrophobicContact CG2-CE1 3.9Å; T47-Y207 HydrophobicContact CG2-CE2 4.42Å; T47-Y207 WeakPolarHBondContact CG2-OH 3.19Å; V49-Y207 HydrophobicContact CG2-CD1 3.83Å; V54-Y207 HydrophobicContact CG1-CD1 3.95Å; V54-Y207 HydrophobicContact CG1-CD2 4.31Å; V54-Y207 HydrophobicContact CG1-CE1 4.27Å; V54-Y207 HydrophobicContact CG1-CG 3.97Å; V54-Y207 VanDerWaalsContact CG2-CB 3.5Å; V54-Y207 HydrophobicContact CG2-CD1 4.32Å; V54-Y207 HydrophobicContact CG2-CG 3.94Å; L199-Y207 WeakPolarHBondContact CB-O 3.31Å; L199-Y207 PolarHBondContact N-O 3.27Å; C200-Y207 PolarHBondContact N-O 3.23Å; C200-Y207 PolarHBondContact O-N 2.84Å; L202-Y207 HydrophobicContact CB-CD2 4.35Å; L202-Y207 HydrophobicContact CB-CE2 3.95Å; L202-Y207 HydrophobicContact CD1-CD2 4.19Å; L202-Y207 HydrophobicContact CD1-CE2 3.87Å; L202-Y207 HydrophobicContact CG-CD2 4.12Å; L202-Y207 HydrophobicContact CG-CE2 4.04Å; T205-Y207 HydrophobicContact CG2-CD2 4.17Å; T205-Y207 HydrophobicContact CG2-CE1 4.47Å; T205-Y207 HydrophobicContact CG2-CE2 3.56Å; T205-Y207 WeakPolarHBondContact O-CD2 3.25Å
208	H	97.9	Very high	95.6	Very high	26 Å²	26	49.6 Å²	49.6	12%	0.12	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	151.2	178.9	-62.1	71.9	0	0	0	108.6	R37 C192 T197 S206	R37-H208 PolarHBondContact NH2-O 3.01Å; C192-H208 HydrophobicContact CB-CB 4.24Å; C192-H208 WeakPolarHBondContact O-CB 3.47Å; T197-H208 CarbonylContact O-C 3.32Å; T197-H208 VanDerWaalsContact O-CA 3.25Å; T197-H208 WeakPolarHBondContact O-CA 3.46Å; S206-H208 PolarHBondContact O-ND1 3.29Å
209	D	97.6	Very high	95.6	Very high	47 Å²	47	51.1 Å²	51.1	25%	0.251	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-68.6	169	170.8	-153.6	-0.4	0	0	0	111.4	G52 G196 T197 L199	G52-D209 WeakPolarHBondContact CA-OD2 3.46Å; G196-D209 WeakPolarHBondContact CA-O 3.4Å; T197-D209 PolarHBondContact O-N 3.02Å; L199-D209 HydrophobicContact CD1-CB 4.13Å; L199-D209 HydrophobicContact CD2-CB 4.16Å; L199-D209 HydrophobicContact CG-CB 4.21Å
210	F	98.3	Very high	95.7	Very high	20 Å²	20	53.7 Å²	53.7	9%	0.088	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-68.2	140.1	172.4	-157.3	-93.3	0	0	0	110.8	E168 F171 V188 L191 L216	E168-F210 HydrophobicContact CB-CB 4.25Å; E168-F210 HydrophobicContact CB-CD1 4.07Å; E168-F210 HydrophobicContact CB-CD2 3.88Å; E168-F210 HydrophobicContact CB-CE1 4.45Å; E168-F210 HydrophobicContact CB-CE2 4.26Å; E168-F210 HydrophobicContact CB-CG 3.78Å; E168-F210 HydrophobicContact CG-CB 4.45Å; E168-F210 HydrophobicContact CG-CD2 3.5Å; E168-F210 HydrophobicContact CG-CE2 3.83Å; E168-F210 HydrophobicContact CG-CG 3.93Å; F171-F210 HydrophobicContact CB-CE1 3.9Å; F171-F210 HydrophobicContact CB-CZ 3.7Å; F171-F210 HydrophobicContact CD2-CE1 4.46Å; V188-F210 HydrophobicContact CG1-CE2 4.25Å; L191-F210 HydrophobicContact CD2-CE2 4.26Å; L191-F210 HydrophobicContact CD2-CZ 3.9Å; F210-L216 HydrophobicContact CE1-CD1 4.35Å
211	P	98.1	Very high	95.9	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.013	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-59.7	140.2	179.3	-26.4	36.4	0	0	0	112.9	L191 L195 A215 L216	L191-P211 HydrophobicContact CG-CG 4.06Å; L195-P211 HydrophobicContact CB-CB 3.79Å; L195-P211 HydrophobicContact CB-CG 3.65Å; P211-A215 HydrophobicContact CB-CB 4.42Å; P211-L216 HydrophobicContact CB-CD1 4.35Å; P211-L216 HydrophobicContact CB-CD2 4.01Å; P211-L216 HydrophobicContact CB-CG 3.87Å; P211-L216 HydrophobicContact CG-CD2 4.46Å
212	S	97.5	Very high	96.2	Very high	64 Å²	64	49 Å²	49	45%	0.448	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-67.8	158.8	171.7	74.5	0	0	0	0	111.5	H214 A215 L216	S212-H214 PolarHBondContact O-N 3.49Å; S212-A215 PolarHBondContact O-N 3.01Å; S212-A215 VanDerWaalsContact O-N 3.1Å; S212-A215 PolarHBondContact OG-N 3.03Å; S212-L216 WeakPolarHBondContact O-CG 3.38Å; S212-L216 PolarHBondContact O-N 3.32Å
213	L	97.8	Very high	96.5	Very high	7 Å²	7	51.3 Å²	51.3	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-55.7	-38.3	173.6	-73.7	175.9	0	0	0	112.5	T167 F171 L216 A217 A241 I244 L245 P251	T167-L213 HydrophobicContact CG2-CD2 3.92Å; T167-L213 HydrophobicContact CG2-CG 4.13Å; F171-L213 HydrophobicContact CE2-CD2 3.45Å; F171-L213 VanDerWaalsContact CE2-CD2 3.45Å; F171-L213 HydrophobicContact CZ-CD2 3.72Å; L213-L216 PolarHBondContact O-N 3.42Å; L213-A217 VanDerWaalsContact O-CB 3.25Å; L213-A217 WeakPolarHBondContact O-CB 3.44Å; L213-A217 PolarHBondContact O-N 3.27Å; L213-A241 HydrophobicContact CD2-CB 4.33Å; L213-I244 HydrophobicContact CD1-CB 4.49Å; L213-I244 HydrophobicContact CD1-CG2 3.62Å; L213-I244 HydrophobicContact CD2-CD1 4.21Å; L213-I244 HydrophobicContact CD2-CG2 4.4Å; L213-L245 HydrophobicContact CB-CD1 4.38Å; L213-L245 HydrophobicContact CB-CD2 3.97Å; L213-L245 HydrophobicContact CB-CG 4.17Å; L213-L245 HydrophobicContact CD1-CD2 4.4Å; L213-P251 HydrophobicContact CD1-CB 3.82Å; L213-P251 HydrophobicContact CD1-CG 4.41Å
214	H	97.6	Very high	96.9	Very high	136 Å²	136	50.7 Å²	50.7	63%	0.63	29%	0.287	S	S	*	.	H	α-helix	trans	-63.9	-43.4	177.3	-65.6	95.7	0	0	0	111.5	S212 L216 A217 D218	S212-H214 PolarHBondContact O-N 3.49Å; H214-L216 VanDerWaalsContact C-N 3.31Å; H214-L216 PolarHBondContact O-N 3.29Å; H214-A217 PolarHBondContact O-N 3.43Å; H214-D218 PolarHBondContact O-N 2.8Å
215	A	98.1	Very high	97.4	Very high	30 Å²	30	41.7 Å²	41.7	25%	0.248	25%	0.245	C	C	.	.	H	α-helix	trans	-64.4	-36	176.2	0	0	0	0	0	112.1	P211 S212 V221	P211-A215 HydrophobicContact CB-CB 4.42Å; S212-A215 PolarHBondContact O-N 3.01Å; S212-A215 VanDerWaalsContact O-N 3.1Å; S212-A215 PolarHBondContact OG-N 3.03Å; A215-V221 WeakPolarHBondContact O-CG2 3.39Å
216	L	98.3	Very high	97.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-74.7	-31	177.3	-70.6	166.5	0	0	0	113.5	F171 L191 L195 F210 P211 S212 L213 H214 D218 V221 Q238 A241	F171-L216 HydrophobicContact CD1-CD1 3.97Å; F171-L216 HydrophobicContact CD2-CD1 3.75Å; F171-L216 HydrophobicContact CE1-CD1 4.13Å; F171-L216 HydrophobicContact CE2-CD1 3.95Å; F171-L216 HydrophobicContact CG-CD1 3.8Å; F171-L216 HydrophobicContact CZ-CD1 4.13Å; L191-L216 HydrophobicContact CD1-CD2 3.95Å; L195-L216 HydrophobicContact CD1-CD2 4.08Å; F210-L216 HydrophobicContact CE1-CD1 4.35Å; P211-L216 HydrophobicContact CB-CD1 4.35Å; P211-L216 HydrophobicContact CB-CD2 4.01Å; P211-L216 HydrophobicContact CB-CG 3.87Å; P211-L216 HydrophobicContact CG-CD2 4.46Å; S212-L216 WeakPolarHBondContact O-CG 3.38Å; S212-L216 PolarHBondContact O-N 3.32Å; L213-L216 PolarHBondContact O-N 3.42Å; H214-L216 VanDerWaalsContact C-N 3.31Å; H214-L216 PolarHBondContact O-N 3.29Å; L216-D218 VanDerWaalsContact C-N 3.35Å; L216-V221 WeakPolarHBondContact O-CG1 3.41Å; L216-Q238 WeakPolarHBondContact O-CA 3.24Å; L216-A241 HydrophobicContact CB-CB 3.46Å; L216-A241 VanDerWaalsContact CB-CB 3.46Å
217	A	98.3	Very high	97.9	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-80.3	-14.6	-174.6	0	0	0	0	0	113.6	L213 H214 Q238 A241 R242 L245	L213-A217 VanDerWaalsContact O-CB 3.25Å; L213-A217 WeakPolarHBondContact O-CB 3.44Å; L213-A217 PolarHBondContact O-N 3.27Å; H214-A217 PolarHBondContact O-N 3.43Å; A217-Q238 PolarHBondContact O-NE2 3.08Å; A217-A241 HydrophobicContact CB-CB 3.99Å; A217-R242 HydrophobicContact CB-CB 4.34Å; A217-R242 PolarHBondContact O-NE 3.25Å; A217-R242 PolarHBondContact O-NH2 3.3Å; A217-L245 HydrophobicContact CB-CD1 3.52Å
218	D	98.2	Very high	97.9	Very high	81 Å²	81	50.7 Å²	50.7	43%	0.433	28%	0.281	S	S	.	.	S	Bend	trans	-54.4	145	-177.9	-168.7	-73.8	0	0	0	112.3	H214 L216 S220 V221 Q238	H214-D218 PolarHBondContact O-N 2.8Å; L216-D218 VanDerWaalsContact C-N 3.35Å; D218-S220 PolarHBondContact O-N 3.23Å; D218-S220 PolarHBondContact OD1-N 2.6Å; D218-S220 PolarHBondContact OD1-OG 2.89Å; D218-S220 VanDerWaalsContact OD1-OG 3.09Å; D218-V221 HydrophobicContact CB-CG2 3.81Å; D218-V221 WeakPolarHBondContact O-CB 3.47Å; D218-V221 WeakPolarHBondContact O-CG2 3.44Å; D218-V221 PolarHBondContact O-N 3.47Å; D218-V221 VanDerWaalsContact O-N 3.17Å; D218-Q238 WeakPolarHBondContact O-CG 3.36Å
219	N	96.9	Very high	97.9	Very high	124 Å²	124	51.1 Å²	51.1	66%	0.663	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-23.3	-174.7	-67	-21.9	0	0	0	112.9	V221 R242	N219-V221 VanDerWaalsContact C-N 3.31Å; N219-R242 PolarHBondContact OD1-NH2 3.15Å
220	S	97.1	Very high	97.8	Very high	75 Å²	75	48.9 Å²	48.9	52%	0.524	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-15	176.6	72.8	0	0	0	0	113.4	D218 E222 A223 C224	D218-S220 PolarHBondContact O-N 3.23Å; D218-S220 PolarHBondContact OD1-N 2.6Å; D218-S220 PolarHBondContact OD1-OG 2.89Å; D218-S220 VanDerWaalsContact OD1-OG 3.09Å; S220-E222 PolarHBondContact O-N 2.62Å; S220-A223 PolarHBondContact O-N 2.76Å; S220-C224 PolarHBondContact O-N 3.42Å; S220-C224 VanDerWaalsContact O-N 3.08Å
221	V	98.3	Very high	97.8	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-66.5	-39.9	-169.7	171.4	0	0	0	0	112.1	L195 A215 L216 D218 N219 A223 C224 L225 Q238	L195-V221 HydrophobicContact CD1-CG1 3.83Å; L195-V221 HydrophobicContact CD1-CG2 4.23Å; L195-V221 HydrophobicContact CD2-CG2 4.33Å; A215-V221 WeakPolarHBondContact O-CG2 3.39Å; L216-V221 WeakPolarHBondContact O-CG1 3.41Å; D218-V221 HydrophobicContact CB-CG2 3.81Å; D218-V221 WeakPolarHBondContact O-CB 3.47Å; D218-V221 WeakPolarHBondContact O-CG2 3.44Å; D218-V221 PolarHBondContact O-N 3.47Å; D218-V221 VanDerWaalsContact O-N 3.17Å; N219-V221 VanDerWaalsContact C-N 3.31Å; V221-A223 VanDerWaalsContact C-N 3.33Å; V221-A223 PolarHBondContact O-N 3.07Å; V221-C224 PolarHBondContact O-N 2.78Å; V221-L225 HydrophobicContact CG1-CD1 3.55Å; V221-L225 HydrophobicContact CG1-CG 3.88Å; V221-L225 WeakPolarHBondContact O-CB 3.42Å; V221-L225 VanDerWaalsContact O-CG 3.26Å; V221-L225 WeakPolarHBondContact O-CG 3.43Å; V221-L225 PolarHBondContact O-N 3.49Å; V221-Q238 HydrophobicContact CB-CB 4.4Å; V221-Q238 HydrophobicContact CB-CG 4.05Å; V221-Q238 HydrophobicContact CG1-CB 4.26Å; V221-Q238 HydrophobicContact CG1-CG 4.43Å
222	E	98.4	Very high	97.7	Very high	45 Å²	45	54.2 Å²	54.2	21%	0.21	31%	0.31	C	S	.	.	H	α-helix	trans	-59.2	-46.7	179.1	179.3	175.8	162.6	0	0	111	S220 L225 R226 A234 R235 Q238	S220-E222 PolarHBondContact O-N 2.62Å; E222-L225 PolarHBondContact O-N 3.01Å; E222-R226 VanDerWaalsContact O-CG 3.29Å; E222-R226 WeakPolarHBondContact O-CG 3.4Å; E222-R226 PolarHBondContact O-N 2.88Å; E222-R226 IonicContact OE1-CZ 3.67Å; E222-R226 VanDerWaalsContact OE1-CZ 3.27Å; E222-R226 IonicContact OE1-NE 2.74Å; E222-R226 PolarHBondContact OE1-NE 3.39Å; E222-R226 IonicContact OE1-NH2 3.58Å; E222-R226 PolarHBondContact OE1-NH2 3.36Å; E222-A234 HydrophobicContact CG-CB 4.2Å; E222-R235 HydrophobicContact CG-CB 4.37Å; E222-Q238 HydrophobicContact CB-CB 4.3Å
223	A	98.3	Very high	97.7	Very high	57 Å²	57	51.6 Å²	51.6	47%	0.471	29%	0.29	S	S	.	.	H	α-helix	trans	-62.7	-49.3	178.8	0	0	0	0	0	111.1	S220 V221 L225 R226 D227	S220-A223 PolarHBondContact O-N 2.76Å; V221-A223 VanDerWaalsContact C-N 3.33Å; V221-A223 PolarHBondContact O-N 3.07Å; A223-L225 VanDerWaalsContact C-N 3.34Å; A223-L225 PolarHBondContact O-N 2.98Å; A223-R226 WeakPolarHBondContact O-CB 3.3Å; A223-R226 PolarHBondContact O-N 2.96Å; A223-R226 VanDerWaalsContact O-N 3.09Å; A223-D227 PolarHBondContact O-N 3.05Å; A223-D227 VanDerWaalsContact O-N 3.12Å
224	C	98.1	Very high	97.7	Very high	43 Å²	43	51.2 Å²	51.2	29%	0.291	29%	0.288	S	S	.	.	H	α-helix	trans	-55.1	-46.6	177	176.4	0	0	0	0	112.4	S220 V221 R226 D227 L228	S220-C224 PolarHBondContact O-N 3.42Å; S220-C224 VanDerWaalsContact O-N 3.08Å; V221-C224 PolarHBondContact O-N 2.78Å; C224-R226 VanDerWaalsContact C-N 3.32Å; C224-R226 PolarHBondContact O-N 3.18Å; C224-D227 PolarHBondContact O-N 3.39Å; C224-L228 WeakPolarHBondContact O-CG 3.37Å; C224-L228 PolarHBondContact O-N 3.24Å; C224-L228 VanDerWaalsContact O-N 3.1Å
225	L	98.3	Very high	97.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-70.3	-28.4	-179.8	-65.8	-178.4	0	0	0	112.7	L191 L195 V221 E222 A223 L228 G229 F230 A234 L237	L191-L225 HydrophobicContact CD1-CD1 4.18Å; L191-L225 HydrophobicContact CD1-CD2 3.6Å; L195-L225 HydrophobicContact CD1-CD2 4.33Å; V221-L225 HydrophobicContact CG1-CD1 3.55Å; V221-L225 HydrophobicContact CG1-CG 3.88Å; V221-L225 WeakPolarHBondContact O-CB 3.42Å; V221-L225 VanDerWaalsContact O-CG 3.26Å; V221-L225 WeakPolarHBondContact O-CG 3.43Å; V221-L225 PolarHBondContact O-N 3.49Å; E222-L225 PolarHBondContact O-N 3.01Å; A223-L225 VanDerWaalsContact C-N 3.34Å; A223-L225 PolarHBondContact O-N 2.98Å; L225-L228 HydrophobicContact CD2-CD1 4.21Å; L225-L228 PolarHBondContact O-N 3.02Å; L225-G229 PolarHBondContact O-N 3.48Å; L225-F230 HydrophobicContact CB-CB 4.17Å; L225-F230 HydrophobicContact CB-CD2 4.11Å; L225-F230 HydrophobicContact CB-CG 4.06Å; L225-F230 HydrophobicContact CD2-CD2 4.13Å; L225-F230 HydrophobicContact CD2-CE1 4.43Å; L225-F230 HydrophobicContact CD2-CE2 3.93Å; L225-F230 HydrophobicContact CD2-CG 4.48Å; L225-F230 HydrophobicContact CD2-CZ 4.08Å; L225-F230 VanDerWaalsContact O-CB 3.27Å; L225-F230 WeakPolarHBondContact O-CB 2.75Å; L225-F230 VanDerWaalsContact O-CD2 3.23Å; L225-F230 WeakPolarHBondContact O-CD2 3.36Å; L225-F230 PolarHBondContact O-N 3.49Å; L225-A234 HydrophobicContact CB-CB 3.62Å; L225-L237 HydrophobicContact CD1-CB 4.06Å; L225-L237 HydrophobicContact CD1-CD1 3.71Å
226	R	98.2	Very high	97.8	Very high	111 Å²	111	51.9 Å²	51.9	42%	0.419	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-45.1	172	-75.3	174.8	-179.9	-74.7	0.1	110.9	E222 A223 C224 L228 G229 A234	E222-R226 VanDerWaalsContact O-CG 3.29Å; E222-R226 WeakPolarHBondContact O-CG 3.4Å; E222-R226 PolarHBondContact O-N 2.88Å; E222-R226 IonicContact OE1-CZ 3.67Å; E222-R226 VanDerWaalsContact OE1-CZ 3.27Å; E222-R226 IonicContact OE1-NE 2.74Å; E222-R226 PolarHBondContact OE1-NE 3.39Å; E222-R226 IonicContact OE1-NH2 3.58Å; E222-R226 PolarHBondContact OE1-NH2 3.36Å; A223-R226 WeakPolarHBondContact O-CB 3.3Å; A223-R226 PolarHBondContact O-N 2.96Å; A223-R226 VanDerWaalsContact O-N 3.09Å; C224-R226 VanDerWaalsContact C-N 3.32Å; C224-R226 PolarHBondContact O-N 3.18Å; R226-L228 PolarHBondContact O-N 2.94Å; R226-G229 PolarHBondContact O-N 3.17Å; R226-A234 HydrophobicContact CG-CB 3.69Å
227	D	97.9	Very high	97.8	Very high	145 Å²	145	51.9 Å²	51.9	78%	0.775	28%	0.28	S	S	*	.	H	α-helix	trans	-62.8	-32.9	176.9	-63.5	-20.1	0	0	0	111.9	A223 C224 G229	A223-D227 PolarHBondContact O-N 3.05Å; A223-D227 VanDerWaalsContact O-N 3.12Å; C224-D227 PolarHBondContact O-N 3.39Å; D227-G229 PolarHBondContact O-N 3.17Å
228	L	97.2	Very high	97.8	Very high	48 Å²	48	52.7 Å²	52.7	25%	0.251	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	4.5	175.1	-64.5	169.9	0	0	0	114.6	R190 S194 C224 L225 R226 F230	R190-L228 PolarHBondContact NE-O 3.44Å; R190-L228 PolarHBondContact NH2-O 2.93Å; S194-L228 VanDerWaalsContact OG-CD1 3.23Å; S194-L228 WeakPolarHBondContact OG-CD1 3.46Å; C224-L228 WeakPolarHBondContact O-CG 3.37Å; C224-L228 PolarHBondContact O-N 3.24Å; C224-L228 VanDerWaalsContact O-N 3.1Å; L225-L228 HydrophobicContact CD2-CD1 4.21Å; L225-L228 PolarHBondContact O-N 3.02Å; R226-L228 PolarHBondContact O-N 2.94Å; L228-F230 HydrophobicContact CB-CD2 3.97Å; L228-F230 HydrophobicContact CB-CE2 3.94Å
229	G	96.6	Very high	97.8	Very high	35 Å²	35	51.7 Å²	51.7	36%	0.361	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	22.7	172.2	0	0	0	0	0	115.6	L225 R226 D227 G231	L225-G229 PolarHBondContact O-N 3.48Å; R226-G229 PolarHBondContact O-N 3.17Å; D227-G229 PolarHBondContact O-N 3.17Å; G229-G231 VanDerWaalsContact C-N 3.27Å
230	F	97.4	Very high	97.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.			trans	-75.3	-18.7	176.4	-74.1	-114.6	0	0	0	113	M187 L191 L225 L228 R233 A234 L237	M187-F230 HydrophobicContact CB-CE1 4.12Å; M187-F230 HydrophobicContact CB-CZ 4Å; M187-F230 HydrophobicContact CE-CB 4.04Å; M187-F230 HydrophobicContact CE-CD1 3.35Å; M187-F230 HydrophobicContact CE-CD2 4.35Å; M187-F230 HydrophobicContact CE-CE1 3.81Å; M187-F230 HydrophobicContact CE-CG 3.66Å; M187-F230 HydrophobicContact CE-CZ 4.45Å; M187-F230 WeakPolarHBondContact O-CZ 3.25Å; L191-F230 HydrophobicContact CB-CE1 4.38Å; L191-F230 HydrophobicContact CB-CZ 3.88Å; L191-F230 HydrophobicContact CD1-CZ 4.44Å; L225-F230 HydrophobicContact CB-CB 4.17Å; L225-F230 HydrophobicContact CB-CD2 4.11Å; L225-F230 HydrophobicContact CB-CG 4.06Å; L225-F230 HydrophobicContact CD2-CD2 4.13Å; L225-F230 HydrophobicContact CD2-CE1 4.43Å; L225-F230 HydrophobicContact CD2-CE2 3.93Å; L225-F230 HydrophobicContact CD2-CG 4.48Å; L225-F230 HydrophobicContact CD2-CZ 4.08Å; L225-F230 VanDerWaalsContact O-CB 3.27Å; L225-F230 WeakPolarHBondContact O-CB 2.75Å; L225-F230 VanDerWaalsContact O-CD2 3.23Å; L225-F230 WeakPolarHBondContact O-CD2 3.36Å; L225-F230 PolarHBondContact O-N 3.49Å; L228-F230 HydrophobicContact CB-CD2 3.97Å; L228-F230 HydrophobicContact CB-CE2 3.94Å; F230-R233 PolarHBondContact O-N 2.77Å; F230-R233 PolarHBondContact O-NH1 3.33Å; F230-A234 HydrophobicContact CB-CB 4.1Å; F230-L237 HydrophobicContact CD1-CD1 3.44Å; F230-L237 VanDerWaalsContact CD1-CD1 3.44Å; F230-L237 HydrophobicContact CE1-CD1 3.69Å
231	G	96.9	Very high	98	Very high	31 Å²	31	42.2 Å²	42.2	32%	0.32	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	-135.8	-178.6	0	0	0	0	0	111.5	G229 R233 A234	G229-G231 VanDerWaalsContact C-N 3.27Å; G231-R233 PolarHBondContact O-N 3.32Å; G231-R233 VanDerWaalsContact O-N 3.12Å; G231-A234 WeakPolarHBondContact O-CB 3.31Å; G231-A234 PolarHBondContact O-N 3.15Å
232	Y	96.7	Very high	98	Very high	104 Å²	104	45.9 Å²	45.9	41%	0.408	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-21.6	-179	68.1	-98.5	0	0	0	113.8	S177 A234 R235 F236	S177-Y232 PolarHBondContact OG-OH 2.79Å; Y232-A234 VanDerWaalsContact C-N 3.26Å; Y232-A234 PolarHBondContact O-N 3.26Å; Y232-R235 PolarHBondContact O-N 2.95Å; Y232-F236 HydrophobicContact CD2-CD2 4.03Å; Y232-F236 AromaticContact CD2-CE2 3.42Å; Y232-F236 HydrophobicContact CD2-CE2 3.42Å; Y232-F236 VanDerWaalsContact CD2-CE2 3.42Å; Y232-F236 AromaticContact CD2-CZ 3.95Å; Y232-F236 HydrophobicContact CD2-CZ 3.95Å; Y232-F236 HydrophobicContact CE2-CD2 4.21Å; Y232-F236 AromaticContact CE2-CE2 3.58Å; Y232-F236 HydrophobicContact CE2-CE2 3.58Å; Y232-F236 HydrophobicContact CE2-CZ 4.42Å
233	R	97.7	Very high	98	Very high	8 Å²	8	46.1 Å²	46.1	3%	0.03	24%	0.235	C	C	.	.	H	α-helix	trans	-71.4	-22.3	-179	-58.5	179.3	-163.2	72.5	-3.5	112.5	I174 S177 N178 F230 G231 R235 F236 L237	I174-R233 WeakPolarHBondContact O-CD 2.98Å; S177-R233 VanDerWaalsContact O-CZ 3.25Å; S177-R233 PolarHBondContact O-NE 3.04Å; S177-R233 VanDerWaalsContact O-NE 3.08Å; S177-R233 PolarHBondContact O-NH2 2.92Å; S177-R233 PolarHBondContact OG-NE 3.13Å; N178-R233 PolarHBondContact O-NH2 2.93Å; F230-R233 PolarHBondContact O-N 2.77Å; F230-R233 PolarHBondContact O-NH1 3.33Å; G231-R233 PolarHBondContact O-N 3.32Å; G231-R233 VanDerWaalsContact O-N 3.12Å; R233-R235 VanDerWaalsContact C-N 3.26Å; R233-R235 PolarHBondContact O-N 3.24Å; R233-F236 WeakPolarHBondContact O-CB 3.44Å; R233-F236 PolarHBondContact O-N 3.39Å; R233-L237 WeakPolarHBondContact O-CG 3.47Å; R233-L237 PolarHBondContact O-N 2.88Å
234	A	98.3	Very high	98	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-52.8	-47	175.3	0	0	0	0	0	111.6	E222 L225 R226 F230 G231 Y232 F236 L237 Q238	E222-A234 HydrophobicContact CG-CB 4.2Å; L225-A234 HydrophobicContact CB-CB 3.62Å; R226-A234 HydrophobicContact CG-CB 3.69Å; F230-A234 HydrophobicContact CB-CB 4.1Å; G231-A234 WeakPolarHBondContact O-CB 3.31Å; G231-A234 PolarHBondContact O-N 3.15Å; Y232-A234 VanDerWaalsContact C-N 3.26Å; Y232-A234 PolarHBondContact O-N 3.26Å; A234-F236 VanDerWaalsContact C-N 3.34Å; A234-F236 PolarHBondContact O-N 3.4Å; A234-L237 PolarHBondContact O-N 2.91Å; A234-Q238 PolarHBondContact O-N 2.91Å; A234-Q238 VanDerWaalsContact O-N 3.16Å
235	R	98.4	Very high	98	Very high	125 Å²	125	42.8 Å²	42.8	47%	0.472	21%	0.206	S	C	.	.	H	α-helix	trans	-59.7	-43.7	175.2	-178.9	178.6	165.6	171.9	2.6	112	E222 Y232 R233 Q239	E222-R235 HydrophobicContact CG-CB 4.37Å; Y232-R235 PolarHBondContact O-N 2.95Å; R233-R235 VanDerWaalsContact C-N 3.26Å; R233-R235 PolarHBondContact O-N 3.24Å; R235-Q239 VanDerWaalsContact CG-CD 3.47Å; R235-Q239 HydrophobicContact CG-CG 4.09Å; R235-Q239 VanDerWaalsContact NE-CD 3.35Å; R235-Q239 VanDerWaalsContact NE-NE2 3.11Å; R235-Q239 VanDerWaalsContact O-CB 3.28Å; R235-Q239 WeakPolarHBondContact O-CB 3.36Å; R235-Q239 VanDerWaalsContact O-CG 3.28Å; R235-Q239 WeakPolarHBondContact O-CG 3.22Å; R235-Q239 PolarHBondContact O-N 3.31Å
236	F	98.5	Very high	97.9	Very high	54 Å²	54	48 Å²	48	24%	0.237	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-41	-178	-62.3	-20.4	0	0	0	112.5	I174 Y232 R233 A234 S240 P273	I174-F236 HydrophobicContact CG2-CB 3.76Å; Y232-F236 HydrophobicContact CD2-CD2 4.03Å; Y232-F236 AromaticContact CD2-CE2 3.42Å; Y232-F236 HydrophobicContact CD2-CE2 3.42Å; Y232-F236 VanDerWaalsContact CD2-CE2 3.42Å; Y232-F236 AromaticContact CD2-CZ 3.95Å; Y232-F236 HydrophobicContact CD2-CZ 3.95Å; Y232-F236 HydrophobicContact CE2-CD2 4.21Å; Y232-F236 AromaticContact CE2-CE2 3.58Å; Y232-F236 HydrophobicContact CE2-CE2 3.58Å; Y232-F236 HydrophobicContact CE2-CZ 4.42Å; R233-F236 WeakPolarHBondContact O-CB 3.44Å; R233-F236 PolarHBondContact O-N 3.39Å; A234-F236 VanDerWaalsContact C-N 3.34Å; A234-F236 PolarHBondContact O-N 3.4Å; F236-S240 WeakPolarHBondContact O-CB 3.43Å; F236-S240 PolarHBondContact O-N 3.22Å; F236-S240 PolarHBondContact O-OG 3.35Å; F236-P273 HydrophobicContact CB-CB 4.45Å; F236-P273 HydrophobicContact CD1-CB 3.97Å
237	L	98.6	Very high	97.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-51.8	177.1	-63.9	167.8	0	0	0	110.7	F171 I174 L225 F230 R233 A234 A241	F171-L237 HydrophobicContact CB-CD2 3.98Å; F171-L237 HydrophobicContact CD1-CB 4.35Å; F171-L237 HydrophobicContact CD1-CD2 3.65Å; F171-L237 VanDerWaalsContact CE1-O 3.25Å; F171-L237 WeakPolarHBondContact CE1-O 3.44Å; F171-L237 HydrophobicContact CG-CD2 4.31Å; F171-L237 VanDerWaalsContact O-CD2 3.32Å; F171-L237 WeakPolarHBondContact O-CD2 3.5Å; I174-L237 HydrophobicContact CB-CD2 3.91Å; I174-L237 HydrophobicContact CD1-CD2 4.45Å; I174-L237 HydrophobicContact CG2-CD2 3.74Å; I174-L237 HydrophobicContact CG2-CG 4.12Å; L225-L237 HydrophobicContact CD1-CB 4.06Å; L225-L237 HydrophobicContact CD1-CD1 3.71Å; F230-L237 HydrophobicContact CD1-CD1 3.44Å; F230-L237 VanDerWaalsContact CD1-CD1 3.44Å; F230-L237 HydrophobicContact CE1-CD1 3.69Å; R233-L237 WeakPolarHBondContact O-CG 3.47Å; R233-L237 PolarHBondContact O-N 2.88Å; A234-L237 PolarHBondContact O-N 2.91Å; L237-A241 PolarHBondContact O-N 2.54Å; L237-A241 VanDerWaalsContact O-N 3.14Å
238	Q	98.6	Very high	97.6	Very high	18 Å²	18	42.9 Å²	42.9	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-46.5	-178.2	-172.3	-82	-20	0	0	112.1	L216 A217 D218 V221 E222 A234 A241 R242	L216-Q238 WeakPolarHBondContact O-CA 3.24Å; A217-Q238 PolarHBondContact O-NE2 3.08Å; D218-Q238 WeakPolarHBondContact O-CG 3.36Å; V221-Q238 HydrophobicContact CB-CB 4.4Å; V221-Q238 HydrophobicContact CB-CG 4.05Å; V221-Q238 HydrophobicContact CG1-CB 4.26Å; V221-Q238 HydrophobicContact CG1-CG 4.43Å; E222-Q238 HydrophobicContact CB-CB 4.3Å; A234-Q238 PolarHBondContact O-N 2.91Å; A234-Q238 VanDerWaalsContact O-N 3.16Å; Q238-A241 PolarHBondContact O-N 2.87Å; Q238-R242 PolarHBondContact O-N 3.38Å
239	Q	98.5	Very high	97.3	Very high	61 Å²	61	43.6 Å²	43.6	29%	0.285	24%	0.238	S	C	.	.	H	α-helix	trans	-69.9	-36.1	-177.5	-67.8	-175.3	-9.8	0	0	112.7	R235 R242 Q243 P273	R235-Q239 VanDerWaalsContact CG-CD 3.47Å; R235-Q239 HydrophobicContact CG-CG 4.09Å; R235-Q239 VanDerWaalsContact NE-CD 3.35Å; R235-Q239 VanDerWaalsContact NE-NE2 3.11Å; R235-Q239 VanDerWaalsContact O-CB 3.28Å; R235-Q239 WeakPolarHBondContact O-CB 3.36Å; R235-Q239 VanDerWaalsContact O-CG 3.28Å; R235-Q239 WeakPolarHBondContact O-CG 3.22Å; R235-Q239 PolarHBondContact O-N 3.31Å; Q239-R242 PolarHBondContact O-N 3.25Å; Q239-Q243 WeakPolarHBondContact O-CB 3.39Å; Q239-Q243 PolarHBondContact O-N 3.07Å; Q239-P273 HydrophobicContact CB-CB 4.3Å; Q239-P273 HydrophobicContact CB-CG 3.86Å
240	S	98.6	Very high	97.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-42.3	174.5	-61.9	0	0	0	0	111.3	F236 Q243 I244 P273	F236-S240 WeakPolarHBondContact O-CB 3.43Å; F236-S240 PolarHBondContact O-N 3.22Å; F236-S240 PolarHBondContact O-OG 3.35Å; S240-Q243 PolarHBondContact O-N 3.38Å; S240-I244 WeakPolarHBondContact O-CD1 3.26Å; S240-I244 WeakPolarHBondContact O-CG1 3.32Å; S240-I244 PolarHBondContact O-N 2.93Å; S240-P273 WeakPolarHBondContact OG-CD 3.48Å; S240-P273 PolarHBondContact OG-O 3.17Å
241	A	98.6	Very high	96.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-44.4	176.6	0	0	0	0	0	111.8	F171 L213 L216 A217 L237 Q238 I244 L245	F171-A241 HydrophobicContact CE1-CB 3.94Å; F171-A241 HydrophobicContact CZ-CB 3.77Å; L213-A241 HydrophobicContact CD2-CB 4.33Å; L216-A241 HydrophobicContact CB-CB 3.46Å; L216-A241 VanDerWaalsContact CB-CB 3.46Å; A217-A241 HydrophobicContact CB-CB 3.99Å; L237-A241 PolarHBondContact O-N 2.54Å; L237-A241 VanDerWaalsContact O-N 3.14Å; Q238-A241 PolarHBondContact O-N 2.87Å; A241-I244 PolarHBondContact O-N 2.99Å; A241-L245 WeakPolarHBondContact O-CG 3.32Å; A241-L245 PolarHBondContact O-N 2.81Å; A241-L245 VanDerWaalsContact O-N 3.12Å
242	R	98.4	Very high	96.6	Very high	78 Å²	78	50.5 Å²	50.5	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-48.5	175.3	-174.4	67	70.5	-176	11.9	111.8	A217 N219 Q238 Q239 I244 L245 D246	A217-R242 HydrophobicContact CB-CB 4.34Å; A217-R242 PolarHBondContact O-NE 3.25Å; A217-R242 PolarHBondContact O-NH2 3.3Å; N219-R242 PolarHBondContact OD1-NH2 3.15Å; Q238-R242 PolarHBondContact O-N 3.38Å; Q239-R242 PolarHBondContact O-N 3.25Å; R242-I244 VanDerWaalsContact C-N 3.32Å; R242-I244 PolarHBondContact O-N 3.09Å; R242-L245 PolarHBondContact O-N 3.43Å; R242-D246 WeakPolarHBondContact CD-OD2 3.18Å; R242-D246 VanDerWaalsContact CG-OD2 3.26Å; R242-D246 WeakPolarHBondContact CG-OD2 3.39Å; R242-D246 WeakPolarHBondContact O-CB 3.41Å; R242-D246 VanDerWaalsContact O-CG 3.27Å; R242-D246 PolarHBondContact O-N 3.39Å
243	Q	98.4	Very high	96.6	Very high	50 Å²	50	47.8 Å²	47.8	23%	0.234	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-39.2	179	-176.9	174.8	-21.9	0	0	112.4	Q239 S240 S247 H248 T271 L272 P273	Q239-Q243 WeakPolarHBondContact O-CB 3.39Å; Q239-Q243 PolarHBondContact O-N 3.07Å; S240-Q243 PolarHBondContact O-N 3.38Å; Q243-S247 WeakPolarHBondContact O-CA 3.12Å; Q243-S247 VanDerWaalsContact O-CB 3.3Å; Q243-S247 WeakPolarHBondContact O-CB 3.23Å; Q243-S247 PolarHBondContact O-N 3.02Å; Q243-H248 PolarHBondContact O-N 3.37Å; Q243-T271 PolarHBondContact NE2-O 2.84Å; Q243-L272 HydrophobicContact CB-CD2 4.28Å; Q243-L272 HydrophobicContact CG-CD2 4.09Å; Q243-P273 VanDerWaalsContact OE1-CD 3.3Å
244	I	98.4	Very high	96.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-43.7	176.8	-67.8	164.9	0	0	0	111.1	L170 F171 L213 S240 A241 R242 H248 G249 G250 W253 L254 L272	L170-I244 HydrophobicContact CD2-CD1 3.84Å; F171-I244 HydrophobicContact CE2-CD1 4.32Å; F171-I244 HydrophobicContact CZ-CD1 4.06Å; L213-I244 HydrophobicContact CD1-CB 4.49Å; L213-I244 HydrophobicContact CD1-CG2 3.62Å; L213-I244 HydrophobicContact CD2-CD1 4.21Å; L213-I244 HydrophobicContact CD2-CG2 4.4Å; S240-I244 WeakPolarHBondContact O-CD1 3.26Å; S240-I244 WeakPolarHBondContact O-CG1 3.32Å; S240-I244 PolarHBondContact O-N 2.93Å; A241-I244 PolarHBondContact O-N 2.99Å; R242-I244 VanDerWaalsContact C-N 3.32Å; R242-I244 PolarHBondContact O-N 3.09Å; I244-H248 CarbonylContact O-C 3.24Å; I244-H248 WeakPolarHBondContact O-CB 3.47Å; I244-H248 PolarHBondContact O-N 3.36Å; I244-G249 PolarHBondContact O-N 3.01Å; I244-G250 WeakPolarHBondContact CG2-O 3.23Å; I244-G250 PolarHBondContact O-N 2.74Å; I244-W253 HydrophobicContact CD1-CZ3 4.15Å; I244-W253 HydrophobicContact CG1-CE3 4.05Å; I244-W253 HydrophobicContact CG1-CZ3 3.73Å; I244-W253 HydrophobicContact CG2-CE3 4.13Å; I244-L254 HydrophobicContact CD1-CD1 4.05Å; I244-L254 HydrophobicContact CD1-CD2 4.44Å; I244-L254 HydrophobicContact CD1-CG 4.32Å; I244-L272 HydrophobicContact CD1-CD1 4.01Å; I244-L272 HydrophobicContact CD1-CD2 4.41Å; I244-L272 HydrophobicContact CG1-CD1 4.27Å; I244-L272 HydrophobicContact CG1-CD2 3.89Å
245	L	98.1	Very high	96.4	Very high	31 Å²	31	50.5 Å²	50.5	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-51.1	177.9	-69.4	173.2	0	0	0	111.6	L213 A217 A241 R242	L213-L245 HydrophobicContact CB-CD1 4.38Å; L213-L245 HydrophobicContact CB-CD2 3.97Å; L213-L245 HydrophobicContact CB-CG 4.17Å; L213-L245 HydrophobicContact CD1-CD2 4.4Å; A217-L245 HydrophobicContact CB-CD1 3.52Å; A241-L245 WeakPolarHBondContact O-CG 3.32Å; A241-L245 PolarHBondContact O-N 2.81Å; A241-L245 VanDerWaalsContact O-N 3.12Å; R242-L245 PolarHBondContact O-N 3.43Å
246	D	96.8	Very high	96.4	Very high	109 Å²	109	46.5 Å²	46.5	58%	0.583	26%	0.258	S	S	*	.	H	α-helix	trans	-80.5	-37.6	-167.7	-62.1	-7.5	0	0	0	112.8	R242	R242-D246 WeakPolarHBondContact CD-OD2 3.18Å; R242-D246 VanDerWaalsContact CG-OD2 3.26Å; R242-D246 WeakPolarHBondContact CG-OD2 3.39Å; R242-D246 WeakPolarHBondContact O-CB 3.41Å; R242-D246 VanDerWaalsContact O-CG 3.27Å; R242-D246 PolarHBondContact O-N 3.39Å
247	S	96.1	Very high	96.4	Very high	87 Å²	87	44.5 Å²	44.5	61%	0.608	25%	0.25	S	C	*	.	H	α-helix	trans	-107.3	-20	-171.5	-55.1	0	0	0	0	114.1	Q243	Q243-S247 WeakPolarHBondContact O-CA 3.12Å; Q243-S247 VanDerWaalsContact O-CB 3.3Å; Q243-S247 WeakPolarHBondContact O-CB 3.23Å; Q243-S247 PolarHBondContact O-N 3.02Å
248	H	93.9	Very high	96.3	Very high	62 Å²	62	46.6 Å²	46.6	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-118.5	-0.3	-173.8	-64.1	-59.4	0	0	0	114.3	Q243 I244 W253	Q243-H248 PolarHBondContact O-N 3.37Å; I244-H248 CarbonylContact O-C 3.24Å; I244-H248 WeakPolarHBondContact O-CB 3.47Å; I244-H248 PolarHBondContact O-N 3.36Å; H248-W253 HydrophobicContact CB-CB 3.92Å; H248-W253 HydrophobicContact CB-CD2 3.64Å; H248-W253 HydrophobicContact CB-CE3 4.1Å; H248-W253 HydrophobicContact CB-CG 3.55Å; H248-W253 AromaticContact CG-CD2 3.83Å; H248-W253 AromaticContact CG-CE2 3.72Å; H248-W253 AromaticContact CG-NE1 3.92Å; H248-W253 AromaticContact ND1-CE2 3.76Å; H248-W253 AromaticContact ND1-NE1 3.62Å; H248-W253 VanDerWaalsContact O-CB 3.32Å; H248-W253 WeakPolarHBondContact O-CB 3.37Å
249	G	89.4	Confident	96.3	Very high	62 Å²	62	51.1 Å²	51.1	64%	0.639	29%	0.291	S	S	*	.			trans	79.2	20.9	176.8	0	0	0	0	0	114.1	I244	I244-G249 PolarHBondContact O-N 3.01Å
250	G	93.1	Very high	96.3	Very high	3 Å²	3	49.2 Å²	49.2	3%	0.031	29%	0.286	C	S	.	.	S	Bend	trans	85.3	-154.2	169.6	0	0	0	0	0	115.3	I244 H252 W253	I244-G250 WeakPolarHBondContact CG2-O 3.23Å; I244-G250 PolarHBondContact O-N 2.74Å; G250-H252 VanDerWaalsContact C-N 3.25Å; G250-H252 PolarHBondContact O-N 2.78Å; G250-W253 WeakPolarHBondContact O-CB 3.2Å; G250-W253 PolarHBondContact O-N 3.28Å
251	P	89.9	Confident	96.2	Very high	55 Å²	55	52.9 Å²	52.9	36%	0.357	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-26	-165.6	24.2	-32.9	0	0	0	114	L213 W253 L254 Q255	L213-P251 HydrophobicContact CD1-CB 3.82Å; L213-P251 HydrophobicContact CD1-CG 4.41Å; P251-W253 PolarHBondContact O-N 3.09Å; P251-L254 PolarHBondContact O-N 3.34Å; P251-Q255 PolarHBondContact O-N 3.17Å
252	H	93.9	Very high	96.2	Very high	154 Å²	154	54.5 Å²	54.5	71%	0.713	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-26.9	178.8	-67.3	-65.2	0	0	0	113.2	G250 Q255 G256	G250-H252 VanDerWaalsContact C-N 3.25Å; G250-H252 PolarHBondContact O-N 2.78Å; H252-Q255 PolarHBondContact O-N 3.2Å; H252-G256 PolarHBondContact O-N 3.12Å
253	W	97.5	Very high	96.1	Very high	47 Å²	47	55.5 Å²	55.5	18%	0.178	33%	0.326	C	S	.	.	H	α-helix	trans	-63.3	-48.6	175.4	170.9	81	0	0	0	111.8	I244 H248 G250 P251 Q255 G256 L257 A268 L272	I244-W253 HydrophobicContact CD1-CZ3 4.15Å; I244-W253 HydrophobicContact CG1-CE3 4.05Å; I244-W253 HydrophobicContact CG1-CZ3 3.73Å; I244-W253 HydrophobicContact CG2-CE3 4.13Å; H248-W253 HydrophobicContact CB-CB 3.92Å; H248-W253 HydrophobicContact CB-CD2 3.64Å; H248-W253 HydrophobicContact CB-CE3 4.1Å; H248-W253 HydrophobicContact CB-CG 3.55Å; H248-W253 AromaticContact CG-CD2 3.83Å; H248-W253 AromaticContact CG-CE2 3.72Å; H248-W253 AromaticContact CG-NE1 3.92Å; H248-W253 AromaticContact ND1-CE2 3.76Å; H248-W253 AromaticContact ND1-NE1 3.62Å; H248-W253 VanDerWaalsContact O-CB 3.32Å; H248-W253 WeakPolarHBondContact O-CB 3.37Å; G250-W253 WeakPolarHBondContact O-CB 3.2Å; G250-W253 PolarHBondContact O-N 3.28Å; P251-W253 PolarHBondContact O-N 3.09Å; W253-Q255 VanDerWaalsContact C-N 3.32Å; W253-Q255 PolarHBondContact O-N 3.33Å; W253-G256 PolarHBondContact O-N 3.43Å; W253-G256 VanDerWaalsContact O-N 3.16Å; W253-L257 HydrophobicContact CH2-CD1 4.3Å; W253-L257 HydrophobicContact CZ2-CD1 4.24Å; W253-L257 WeakPolarHBondContact O-CG 3.4Å; W253-L257 PolarHBondContact O-N 3.03Å; W253-A268 HydrophobicContact CZ2-CB 4.03Å; W253-L272 HydrophobicContact CH2-CD1 4.01Å; W253-L272 HydrophobicContact CH2-CD2 4.37Å; W253-L272 HydrophobicContact CH2-CG 4.28Å; W253-L272 HydrophobicContact CZ3-CD1 4.05Å
254	L	95.8	Very high	96.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.6	-43.6	176.9	-76.1	177.8	0	0	0	111.6	P166 L170 I244 P251 G256 L257 L269	P166-L254 HydrophobicContact CB-CB 3.95Å; L170-L254 HydrophobicContact CD2-CD1 4.09Å; L170-L254 HydrophobicContact CD2-CD2 3.84Å; I244-L254 HydrophobicContact CD1-CD1 4.05Å; I244-L254 HydrophobicContact CD1-CD2 4.44Å; I244-L254 HydrophobicContact CD1-CG 4.32Å; P251-L254 PolarHBondContact O-N 3.34Å; L254-G256 VanDerWaalsContact C-N 3.33Å; L254-G256 PolarHBondContact O-N 3.45Å; L254-L257 HydrophobicContact CD2-CD1 4.42Å; L254-L257 WeakPolarHBondContact O-CB 3.45Å; L254-L257 PolarHBondContact O-N 2.89Å; L254-L269 HydrophobicContact CD2-CD2 4.06Å
255	Q	95.8	Very high	96.1	Very high	65 Å²	65	59.1 Å²	59.1	30%	0.304	34%	0.344	S	S	.	.	H	α-helix	trans	-62.4	-41.2	176.9	-65	-66.5	-10.8	0	0	111.6	D165 P251 H252 W253 L257 R258	D165-Q255 PolarHBondContact OD2-NE2 3.21Å; P251-Q255 PolarHBondContact O-N 3.17Å; H252-Q255 PolarHBondContact O-N 3.2Å; W253-Q255 VanDerWaalsContact C-N 3.32Å; W253-Q255 PolarHBondContact O-N 3.33Å; Q255-L257 PolarHBondContact O-N 3.35Å; Q255-R258 WeakPolarHBondContact O-CB 3.41Å; Q255-R258 PolarHBondContact O-N 2.99Å; Q255-R258 VanDerWaalsContact O-N 3.12Å
256	G	97.4	Very high	96.1	Very high	40 Å²	40	58.9 Å²	58.9	41%	0.412	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-25.5	177.8	0	0	0	0	0	114	H252 W253 L254 R258 S259 A260	H252-G256 PolarHBondContact O-N 3.12Å; W253-G256 PolarHBondContact O-N 3.43Å; W253-G256 VanDerWaalsContact O-N 3.16Å; L254-G256 VanDerWaalsContact C-N 3.33Å; L254-G256 PolarHBondContact O-N 3.45Å; G256-R258 PolarHBondContact O-N 3.08Å; G256-S259 PolarHBondContact O-N 2.87Å; G256-A260 PolarHBondContact O-N 3.06Å
257	L	98.1	Very high	96.1	Very high	13 Å²	13	57.2 Å²	57.2	7%	0.068	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.1	176.9	-59.3	-177.5	0	0	0	113.4	W253 L254 Q255 S259 A260 A265 A268 L269 L288 K290	W253-L257 HydrophobicContact CH2-CD1 4.3Å; W253-L257 HydrophobicContact CZ2-CD1 4.24Å; W253-L257 WeakPolarHBondContact O-CG 3.4Å; W253-L257 PolarHBondContact O-N 3.03Å; L254-L257 HydrophobicContact CD2-CD1 4.42Å; L254-L257 WeakPolarHBondContact O-CB 3.45Å; L254-L257 PolarHBondContact O-N 2.89Å; Q255-L257 PolarHBondContact O-N 3.35Å; L257-S259 PolarHBondContact O-N 3.26Å; L257-A260 HydrophobicContact CD2-CB 4.45Å; L257-A260 PolarHBondContact O-N 3.18Å; L257-A265 HydrophobicContact CB-CB 4.22Å; L257-A268 HydrophobicContact CD2-CB 4.17Å; L257-L269 HydrophobicContact CD1-CD2 3.91Å; L257-L269 HydrophobicContact CD1-CG 3.99Å; L257-L288 HydrophobicContact CB-CD1 3.75Å; L257-L288 HydrophobicContact CB-CD2 4.06Å; L257-L288 HydrophobicContact CB-CG 4.47Å; L257-L288 HydrophobicContact CD1-CD1 4.19Å; L257-K290 PolarHBondContact O-NZ 2.89Å
258	R	97.9	Very high	96.2	Very high	43 Å²	43	54.2 Å²	54.2	16%	0.162	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-36.3	169.6	-78.6	172.7	172.7	-177.8	-5.1	112.1	R163 Q164 Q255 G256 S287 L288 E289 K290	R163-R258 VanDerWaalsContact CZ-NH1 3.34Å; R163-R258 VanDerWaalsContact NH2-NH1 3.13Å; Q164-R258 PolarHBondContact O-NH2 2.79Å; Q164-R258 VanDerWaalsContact O-NH2 3.12Å; Q255-R258 WeakPolarHBondContact O-CB 3.41Å; Q255-R258 PolarHBondContact O-N 2.99Å; Q255-R258 VanDerWaalsContact O-N 3.12Å; G256-R258 PolarHBondContact O-N 3.08Å; R258-S287 PolarHBondContact NE-O 3.41Å; R258-S287 PolarHBondContact NH2-O 3.21Å; R258-L288 HydrophobicContact CG-CB 4.44Å; R258-L288 HydrophobicContact CG-CD2 4.15Å; R258-E289 WeakPolarHBondContact CD-OE1 3.26Å; R258-E289 IonicContact NE-OE1 3.81Å; R258-K290 PolarHBondContact O-NZ 2.95Å
259	S	97.6	Very high	96.5	Very high	113 Å²	113	51.3 Å²	51.3	79%	0.79	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-17.6	178.8	-55	0	0	0	0	113.3	G256 L257	G256-S259 PolarHBondContact O-N 2.87Å; L257-S259 PolarHBondContact O-N 3.26Å
260	A	97.9	Very high	96.9	Very high	22 Å²	22	52.6 Å²	52.6	18%	0.182	28%	0.284	C	S	.	.	S	Bend	trans	-72.3	149	-179.3	0	0	0	0	0	112.4	G256 L257 A265 K290	G256-A260 PolarHBondContact O-N 3.06Å; L257-A260 HydrophobicContact CD2-CB 4.45Å; L257-A260 PolarHBondContact O-N 3.18Å; A260-A265 HydrophobicContact CB-CB 4.37Å; A260-K290 WeakPolarHBondContact O-CE 3.33Å; A260-K290 PolarHBondContact O-NZ 3.47Å
261	P	98.1	Very high	97.1	Very high	76 Å²	76	56 Å²	56	49%	0.494	30%	0.304	S	S	.	.			trans	-56.2	146.1	169.8	-25.6	35	0	0	0	112.4	L263 Q264 A265	P261-L263 PolarHBondContact O-N 3.21Å; P261-Q264 HydrophobicContact CB-CG 4.32Å; P261-Q264 HydrophobicContact CG-CG 4.48Å; P261-Q264 WeakPolarHBondContact O-CB 3.23Å; P261-Q264 PolarHBondContact O-N 3.12Å; P261-A265 PolarHBondContact O-N 2.99Å
262	Y	97.1	Very high	97.5	Very high	35 Å²	35	53.6 Å²	53.6	14%	0.137	29%	0.289	C	S	.	.	H	α-helix	trans	-49.3	-51.8	-175.2	157.5	-130.1	0	0	0	113.3	Q264 A265 R266 D281 C284 V293	Y262-Q264 VanDerWaalsContact C-N 3.28Å; Y262-Q264 PolarHBondContact O-N 2.72Å; Y262-A265 PolarHBondContact O-N 3.32Å; Y262-R266 HydrophobicContact CD2-CB 4.24Å; Y262-R266 HydrophobicContact CE2-CB 3.85Å; Y262-R266 HydrophobicContact CE2-CG 4.22Å; Y262-R266 WeakPolarHBondContact O-CB 3.27Å; Y262-R266 PolarHBondContact O-N 3.46Å; Y262-D281 PolarHBondContact OH-OD1 3.23Å; Y262-D281 VanDerWaalsContact OH-OD1 3.13Å; Y262-D281 PolarHBondContact OH-OD2 3.01Å; Y262-C284 HydrophobicContact CD2-CB 4.34Å; Y262-C284 HydrophobicContact CE2-CB 4.47Å; Y262-V293 HydrophobicContact CD1-CG2 4.04Å; Y262-V293 HydrophobicContact CD2-CG2 3.26Å; Y262-V293 HydrophobicContact CE1-CG2 4.08Å; Y262-V293 HydrophobicContact CE2-CB 4.3Å; Y262-V293 HydrophobicContact CE2-CG1 3.9Å; Y262-V293 HydrophobicContact CE2-CG2 3.35Å; Y262-V293 HydrophobicContact CG-CG2 3.66Å
263	L	96.5	Very high	97.7	Very high	98 Å²	98	47.7 Å²	47.7	51%	0.513	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-37.5	-177.2	-63	179.9	0	0	0	112	P261 D267	P261-L263 PolarHBondContact O-N 3.21Å; L263-D267 WeakPolarHBondContact O-CB 3.29Å; L263-D267 PolarHBondContact O-N 3.48Å
264	Q	98.3	Very high	97.7	Very high	127 Å²	127	46.5 Å²	46.5	59%	0.593	27%	0.266	S	S	*	.	H	α-helix	trans	-68	-45	176.6	-63.5	-179.5	14.6	0	0	111.3	P261 Y262 R266 D267 A268	P261-Q264 HydrophobicContact CB-CG 4.32Å; P261-Q264 HydrophobicContact CG-CG 4.48Å; P261-Q264 WeakPolarHBondContact O-CB 3.23Å; P261-Q264 PolarHBondContact O-N 3.12Å; Y262-Q264 VanDerWaalsContact C-N 3.28Å; Y262-Q264 PolarHBondContact O-N 2.72Å; Q264-R266 VanDerWaalsContact C-N 3.35Å; Q264-R266 PolarHBondContact O-N 3.27Å; Q264-D267 PolarHBondContact O-N 2.93Å; Q264-A268 WeakPolarHBondContact O-CB 3.2Å; Q264-A268 PolarHBondContact O-N 3.43Å
265	A	98.5	Very high	97.8	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-45.2	176	0	0	0	0	0	111.6	L257 A260 P261 Y262 A268 L269 L288	L257-A265 HydrophobicContact CB-CB 4.22Å; A260-A265 HydrophobicContact CB-CB 4.37Å; P261-A265 PolarHBondContact O-N 2.99Å; Y262-A265 PolarHBondContact O-N 3.32Å; A265-A268 PolarHBondContact O-N 2.87Å; A265-L269 VanDerWaalsContact O-CG 3.27Å; A265-L269 WeakPolarHBondContact O-CG 3.34Å; A265-L269 PolarHBondContact O-N 2.87Å; A265-L288 HydrophobicContact CB-CD1 4.34Å
266	R	97.9	Very high	97.8	Very high	26 Å²	26	45.3 Å²	45.3	10%	0.098	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-49.8	177.7	-173.8	-161.9	68.6	-162	-4.3	111.5	Y262 Q264 A268 L269 R270 A280 D281	Y262-R266 HydrophobicContact CD2-CB 4.24Å; Y262-R266 HydrophobicContact CE2-CB 3.85Å; Y262-R266 HydrophobicContact CE2-CG 4.22Å; Y262-R266 WeakPolarHBondContact O-CB 3.27Å; Y262-R266 PolarHBondContact O-N 3.46Å; Q264-R266 VanDerWaalsContact C-N 3.35Å; Q264-R266 PolarHBondContact O-N 3.27Å; R266-A268 VanDerWaalsContact C-N 3.32Å; R266-A268 PolarHBondContact O-N 2.85Å; R266-L269 PolarHBondContact O-N 3.5Å; R266-R270 VanDerWaalsContact O-CG 3.28Å; R266-R270 WeakPolarHBondContact O-CG 3.39Å; R266-R270 PolarHBondContact O-N 3.32Å; R266-A280 HydrophobicContact CG-CB 3.78Å; R266-D281 VanDerWaalsContact CD-OD1 3.31Å; R266-D281 WeakPolarHBondContact CD-OD1 3.44Å; R266-D281 WeakPolarHBondContact CG-OD1 3.4Å
267	D	98.1	Very high	97.7	Very high	74 Å²	74	45 Å²	45	40%	0.396	26%	0.26	S	S	.	.	H	α-helix	trans	-69.1	-34.4	-176.2	-65.3	-13.8	0	0	0	111	L263 Q264 R270 T271	L263-D267 WeakPolarHBondContact O-CB 3.29Å; L263-D267 PolarHBondContact O-N 3.48Å; Q264-D267 PolarHBondContact O-N 2.93Å; D267-R270 PolarHBondContact O-N 3.34Å; D267-T271 WeakPolarHBondContact O-CG2 3.23Å
268	A	98.4	Very high	97.5	Very high	24 Å²	24	47 Å²	47	20%	0.198	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-48	171	0	0	0	0	0	112.1	W253 L257 Q264 A265 R266 R270 T271	W253-A268 HydrophobicContact CZ2-CB 4.03Å; L257-A268 HydrophobicContact CD2-CB 4.17Å; Q264-A268 WeakPolarHBondContact O-CB 3.2Å; Q264-A268 PolarHBondContact O-N 3.43Å; A265-A268 PolarHBondContact O-N 2.87Å; R266-A268 VanDerWaalsContact C-N 3.32Å; R266-A268 PolarHBondContact O-N 2.85Å; A268-R270 VanDerWaalsContact C-N 3.31Å; A268-R270 PolarHBondContact O-N 3.27Å; A268-T271 WeakPolarHBondContact O-CB 3.33Å; A268-T271 WeakPolarHBondContact O-CG2 3.42Å; A268-T271 PolarHBondContact O-N 3.08Å; A268-T271 PolarHBondContact O-OG1 3.3Å
269	L	98.6	Very high	97.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.6	-38.8	176.6	-73.1	171.1	0	0	0	112.4	L170 L254 L257 A265 R266 T271 L272 V275 A280 V283 L288	L170-L269 HydrophobicContact CD1-CD2 4.34Å; L254-L269 HydrophobicContact CD2-CD2 4.06Å; L257-L269 HydrophobicContact CD1-CD2 3.91Å; L257-L269 HydrophobicContact CD1-CG 3.99Å; A265-L269 VanDerWaalsContact O-CG 3.27Å; A265-L269 WeakPolarHBondContact O-CG 3.34Å; A265-L269 PolarHBondContact O-N 2.87Å; R266-L269 PolarHBondContact O-N 3.5Å; L269-T271 PolarHBondContact O-N 3.08Å; L269-T271 VanDerWaalsContact O-N 3.15Å; L269-L272 WeakPolarHBondContact O-CB 3.32Å; L269-L272 WeakPolarHBondContact O-CG 3.46Å; L269-L272 PolarHBondContact O-N 3.29Å; L269-V275 HydrophobicContact CB-CG1 4.12Å; L269-V275 WeakPolarHBondContact O-CB 3.37Å; L269-V275 VanDerWaalsContact O-CG1 3.3Å; L269-V275 WeakPolarHBondContact O-CG1 3.23Å; L269-A280 HydrophobicContact CB-CB 4.08Å; L269-A280 HydrophobicContact CD1-CB 4.39Å; L269-V283 HydrophobicContact CD1-CB 3.85Å; L269-V283 HydrophobicContact CD1-CG1 3.72Å; L269-V283 HydrophobicContact CD2-CG1 4.11Å; L269-L288 HydrophobicContact CD1-CD1 3.78Å; L269-L288 HydrophobicContact CG-CD1 4.49Å
270	R	98	Very high	97.6	Very high	90 Å²	90	39.9 Å²	39.9	34%	0.34	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.7	179.9	-73.7	174.5	66.5	164.9	9	114.3	R266 D267 A268 L272 A280 D321	R266-R270 VanDerWaalsContact O-CG 3.28Å; R266-R270 WeakPolarHBondContact O-CG 3.39Å; R266-R270 PolarHBondContact O-N 3.32Å; D267-R270 PolarHBondContact O-N 3.34Å; A268-R270 VanDerWaalsContact C-N 3.31Å; A268-R270 PolarHBondContact O-N 3.27Å; R270-L272 PolarHBondContact O-N 3.29Å; R270-A280 HydrophobicContact CG-CB 3.84Å; R270-D321 IonicContact CZ-OD1 3.22Å; R270-D321 IonicContact NH1-OD1 2.86Å; R270-D321 PolarHBondContact NH1-OD1 3.08Å; R270-D321 IonicContact NH2-OD1 2.96Å; R270-D321 PolarHBondContact NH2-OD1 3.35Å
271	T	98	Very high	97.6	Very high	74 Å²	74	38.9 Å²	38.9	45%	0.454	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-16	171.3	69.9	0	0	0	0	112.7	Q243 D267 A268 L269	Q243-T271 PolarHBondContact NE2-O 2.84Å; D267-T271 WeakPolarHBondContact O-CG2 3.23Å; A268-T271 WeakPolarHBondContact O-CB 3.33Å; A268-T271 WeakPolarHBondContact O-CG2 3.42Å; A268-T271 PolarHBondContact O-N 3.08Å; A268-T271 PolarHBondContact O-OG1 3.3Å; L269-T271 PolarHBondContact O-N 3.08Å; L269-T271 VanDerWaalsContact O-N 3.15Å
272	L	98.6	Very high	97.6	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.026	19%	0.194	C	C	.	.	S	Bend	trans	-84.6	142.2	-177.2	-59.4	175.6	0	0	0	112	L170 Q243 I244 W253 L269 R270 G274 V275	L170-L272 HydrophobicContact CD1-CD1 4.34Å; L170-L272 HydrophobicContact CD2-CD1 3.65Å; Q243-L272 HydrophobicContact CB-CD2 4.28Å; Q243-L272 HydrophobicContact CG-CD2 4.09Å; I244-L272 HydrophobicContact CD1-CD1 4.01Å; I244-L272 HydrophobicContact CD1-CD2 4.41Å; I244-L272 HydrophobicContact CG1-CD1 4.27Å; I244-L272 HydrophobicContact CG1-CD2 3.89Å; W253-L272 HydrophobicContact CH2-CD1 4.01Å; W253-L272 HydrophobicContact CH2-CD2 4.37Å; W253-L272 HydrophobicContact CH2-CG 4.28Å; W253-L272 HydrophobicContact CZ3-CD1 4.05Å; L269-L272 WeakPolarHBondContact O-CB 3.32Å; L269-L272 WeakPolarHBondContact O-CG 3.46Å; L269-L272 PolarHBondContact O-N 3.29Å; R270-L272 PolarHBondContact O-N 3.29Å; L272-G274 PolarHBondContact O-N 3.49Å; L272-V275 HydrophobicContact CB-CB 4.29Å; L272-V275 HydrophobicContact CB-CG2 3.77Å; L272-V275 WeakPolarHBondContact O-CB 3.5Å; L272-V275 PolarHBondContact O-N 3.45Å; L272-V275 VanDerWaalsContact O-N 3.15Å
273	P	97.9	Very high	97.7	Very high	29 Å²	29	33.7 Å²	33.7	19%	0.188	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	128.8	175	-28.7	35.4	0	0	0	113.3	F236 Q239 S240 Q243 V275	F236-P273 HydrophobicContact CB-CB 4.45Å; F236-P273 HydrophobicContact CD1-CB 3.97Å; Q239-P273 HydrophobicContact CB-CB 4.3Å; Q239-P273 HydrophobicContact CB-CG 3.86Å; S240-P273 WeakPolarHBondContact OG-CD 3.48Å; S240-P273 PolarHBondContact OG-O 3.17Å; Q243-P273 VanDerWaalsContact OE1-CD 3.3Å; P273-V275 VanDerWaalsContact C-N 3.29Å; P273-V275 PolarHBondContact O-N 2.9Å
274	G	96.4	Very high	97.8	Very high	23 Å²	23	29 Å²	29	24%	0.237	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	2.8	178.3	0	0	0	0	0	115.2	L272	L272-G274 PolarHBondContact O-N 3.49Å
275	V	98.2	Very high	97.8	Very high	10 Å²	10	23.2 Å²	23.2	6%	0.061	14%	0.136	C	C	.	.			trans	-100	94.1	178.6	-175.5	0	0	0	0	111	L170 I174 L269 L272 P273 V279 A280	L170-V275 HydrophobicContact CD1-CG2 3.84Å; I174-V275 HydrophobicContact CD1-CG2 4.08Å; I174-V275 HydrophobicContact CG1-CG2 3.97Å; L269-V275 HydrophobicContact CB-CG1 4.12Å; L269-V275 WeakPolarHBondContact O-CB 3.37Å; L269-V275 VanDerWaalsContact O-CG1 3.3Å; L269-V275 WeakPolarHBondContact O-CG1 3.23Å; L272-V275 HydrophobicContact CB-CB 4.29Å; L272-V275 HydrophobicContact CB-CG2 3.77Å; L272-V275 WeakPolarHBondContact O-CB 3.5Å; L272-V275 PolarHBondContact O-N 3.45Å; L272-V275 VanDerWaalsContact O-N 3.15Å; P273-V275 VanDerWaalsContact C-N 3.29Å; P273-V275 PolarHBondContact O-N 2.9Å; V275-V279 HydrophobicContact CB-CG1 4.37Å; V275-V279 HydrophobicContact CG1-CB 4.2Å; V275-V279 HydrophobicContact CG1-CG1 3.95Å; V275-V279 HydrophobicContact CG2-CG1 4.21Å; V275-A280 HydrophobicContact CG1-CB 3.95Å
276	G	95.9	Very high	97.8	Very high	30 Å²	30	24 Å²	24	31%	0.309	14%	0.14	S	C	.	.			trans	-86.1	-179	170.3	0	0	0	0	0	113.4	K278 V279 A280	G276-K278 VanDerWaalsContact C-N 3.35Å; G276-K278 PolarHBondContact O-N 3.38Å; G276-V279 PolarHBondContact O-N 2.93Å; G276-V279 VanDerWaalsContact O-N 3.17Å; G276-A280 PolarHBondContact O-N 3Å
277	P	94.9	Very high	97.8	Very high	34 Å²	34	22.8 Å²	22.8	22%	0.221	14%	0.135	C	C	.	.	H	α-helix	trans	-50.9	-48.5	-179.9	-27.7	34.3	0	0	0	113.7	V279 A280 D281	P277-V279 PolarHBondContact O-N 3.5Å; P277-A280 PolarHBondContact O-N 2.64Å; P277-D281 WeakPolarHBondContact O-CB 3.49Å; P277-D281 PolarHBondContact O-N 3.45Å
278	K	95.4	Very high	97.8	Very high	53 Å²	53	19.3 Å²	19.3	23%	0.23	12%	0.116	C	C	.	.	H	α-helix	trans	-62.1	-45.6	179.7	-171.5	-83.7	-177.1	-171	0	112.6	G276 D281 C282 D297	G276-K278 VanDerWaalsContact C-N 3.35Å; G276-K278 PolarHBondContact O-N 3.38Å; K278-D281 PolarHBondContact O-N 2.79Å; K278-C282 VanDerWaalsContact CE-SG 3.54Å; K278-C282 PolarHBondContact NZ-SG 3.42Å; K278-C282 PolarHBondContact O-N 2.83Å; K278-C282 PolarHBondContact O-SG 3.05Å; K278-C282 VanDerWaalsContact O-SG 3.4Å; K278-D297 HydrophobicContact CD-CB 4.48Å; K278-D297 HydrophobicContact CG-CB 3.98Å
279	V	97.8	Very high	97.8	Very high	7 Å²	7	22.5 Å²	22.5	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-65	-45.9	-179.1	174.4	0	0	0	0	109.7	F173 I174 V275 G276 P277 D281 C282 V283	F173-V279 HydrophobicContact CB-CG1 4.05Å; I174-V279 HydrophobicContact CG1-CG1 4.45Å; V275-V279 HydrophobicContact CB-CG1 4.37Å; V275-V279 HydrophobicContact CG1-CB 4.2Å; V275-V279 HydrophobicContact CG1-CG1 3.95Å; V275-V279 HydrophobicContact CG2-CG1 4.21Å; G276-V279 PolarHBondContact O-N 2.93Å; G276-V279 VanDerWaalsContact O-N 3.17Å; P277-V279 PolarHBondContact O-N 3.5Å; V279-D281 VanDerWaalsContact C-N 3.32Å; V279-D281 PolarHBondContact O-N 2.97Å; V279-C282 PolarHBondContact O-N 3.39Å; V279-V283 WeakPolarHBondContact O-CG2 3.42Å; V279-V283 PolarHBondContact O-N 2.91Å
280	A	98.4	Very high	97.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.3	-44.6	176.2	0	0	0	0	0	111.5	R266 L269 R270 V275 G276 P277 V283 C284	R266-A280 HydrophobicContact CG-CB 3.78Å; L269-A280 HydrophobicContact CB-CB 4.08Å; L269-A280 HydrophobicContact CD1-CB 4.39Å; R270-A280 HydrophobicContact CG-CB 3.84Å; V275-A280 HydrophobicContact CG1-CB 3.95Å; G276-A280 PolarHBondContact O-N 3Å; P277-A280 PolarHBondContact O-N 2.64Å; A280-V283 PolarHBondContact O-N 3.01Å; A280-C284 WeakPolarHBondContact O-CB 3.2Å; A280-C284 PolarHBondContact O-N 3.4Å; A280-C284 PolarHBondContact O-SG 3.44Å
281	D	98.4	Very high	97.8	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-67.5	-37.3	179.2	-82.3	19.7	0	0	0	112.7	Y262 R266 P277 K278 V279 C284 L285 V293 P295 H324	Y262-D281 PolarHBondContact OH-OD1 3.23Å; Y262-D281 VanDerWaalsContact OH-OD1 3.13Å; Y262-D281 PolarHBondContact OH-OD2 3.01Å; R266-D281 VanDerWaalsContact CD-OD1 3.31Å; R266-D281 WeakPolarHBondContact CD-OD1 3.44Å; R266-D281 WeakPolarHBondContact CG-OD1 3.4Å; P277-D281 WeakPolarHBondContact O-CB 3.49Å; P277-D281 PolarHBondContact O-N 3.45Å; K278-D281 PolarHBondContact O-N 2.79Å; V279-D281 VanDerWaalsContact C-N 3.32Å; V279-D281 PolarHBondContact O-N 2.97Å; D281-C284 PolarHBondContact O-N 2.74Å; D281-L285 WeakPolarHBondContact O-CB 3.38Å; D281-L285 PolarHBondContact O-N 3.48Å; D281-V293 HydrophobicContact CB-CG1 3.48Å; D281-V293 VanDerWaalsContact CB-CG1 3.48Å; D281-V293 VanDerWaalsContact CG-CG1 3.44Å; D281-V293 WeakPolarHBondContact O-CG1 3.4Å; D281-P295 HydrophobicContact CB-CB 3.88Å; D281-P295 HydrophobicContact CB-CG 4.14Å; D281-H324 IonicContact OD2-CE1 2.71Å; D281-H324 PolarHBondContact OD2-CE1 2.85Å; D281-H324 VanDerWaalsContact OD2-CE1 3.23Å
282	C	98.4	Very high	97.8	Very high	3 Å²	3	18.6 Å²	18.6	2%	0.02	11%	0.114	C	C	.	.	H	α-helix	trans	-59.3	-46.8	171.5	-75.6	0	0	0	0	111.5	F173 K278 V279 L285 M286 P295	F173-C282 HydrophobicContact CD1-CB 3.5Å; F173-C282 VanDerWaalsContact CD1-CB 3.5Å; F173-C282 HydrophobicContact CD2-CB 4.19Å; F173-C282 HydrophobicContact CE1-CB 3.7Å; F173-C282 HydrophobicContact CE2-CB 4.36Å; F173-C282 HydrophobicContact CG-CB 3.8Å; F173-C282 HydrophobicContact CZ-CB 4.16Å; K278-C282 VanDerWaalsContact CE-SG 3.54Å; K278-C282 PolarHBondContact NZ-SG 3.42Å; K278-C282 PolarHBondContact O-N 2.83Å; K278-C282 PolarHBondContact O-SG 3.05Å; K278-C282 VanDerWaalsContact O-SG 3.4Å; V279-C282 PolarHBondContact O-N 3.39Å; C282-L285 PolarHBondContact O-N 2.66Å; C282-M286 VanDerWaalsContact O-CB 3.29Å; C282-M286 WeakPolarHBondContact O-CB 3.47Å; C282-M286 VanDerWaalsContact O-CG 3.27Å; C282-M286 WeakPolarHBondContact O-CG 3.27Å; C282-M286 PolarHBondContact O-N 2.88Å; C282-P295 VanDerWaalsContact SG-CB 3.53Å
283	V	98.7	Very high	97.7	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.7	-44.2	179.1	177	0	0	0	0	110.7	L170 F173 L269 V279 A280 L285 M286 S287 L288	L170-V283 HydrophobicContact CB-CG2 4.26Å; L170-V283 HydrophobicContact CD1-CG2 4.07Å; F173-V283 HydrophobicContact CB-CG2 4.34Å; L269-V283 HydrophobicContact CD1-CB 3.85Å; L269-V283 HydrophobicContact CD1-CG1 3.72Å; L269-V283 HydrophobicContact CD2-CG1 4.11Å; V279-V283 WeakPolarHBondContact O-CG2 3.42Å; V279-V283 PolarHBondContact O-N 2.91Å; A280-V283 PolarHBondContact O-N 3.01Å; V283-L285 PolarHBondContact O-N 3.04Å; V283-M286 PolarHBondContact O-N 2.98Å; V283-S287 WeakPolarHBondContact CG1-OG 3.25Å; V283-S287 PolarHBondContact O-N 3.21Å; V283-S287 PolarHBondContact O-OG 2.9Å; V283-L288 HydrophobicContact CG1-CD1 4.06Å; V283-L288 HydrophobicContact CG1-CG 4.16Å; V283-L288 PolarHBondContact O-N 3.18Å
284	C	98.8	Very high	97.7	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-54.5	-49.4	174.6	-78.3	0	0	0	0	112.6	Y262 A280 D281 L288 E289 K290 V293	Y262-C284 HydrophobicContact CD2-CB 4.34Å; Y262-C284 HydrophobicContact CE2-CB 4.47Å; A280-C284 WeakPolarHBondContact O-CB 3.2Å; A280-C284 PolarHBondContact O-N 3.4Å; A280-C284 PolarHBondContact O-SG 3.44Å; D281-C284 PolarHBondContact O-N 2.74Å; C284-L288 CarbonylContact O-C 3.49Å; C284-L288 PolarHBondContact O-N 3.1Å; C284-E289 PolarHBondContact O-N 3.26Å; C284-K290 HydrophobicContact CB-CB 4.03Å; C284-K290 HydrophobicContact CB-CG 3.9Å; C284-K290 WeakPolarHBondContact O-CB 3.41Å; C284-K290 WeakPolarHBondContact O-CG 3.24Å; C284-K290 PolarHBondContact O-N 3.28Å; C284-V293 HydrophobicContact CB-CB 4.44Å; C284-V293 HydrophobicContact CB-CG1 4.18Å; C284-V293 HydrophobicContact CB-CG2 4.19Å
285	L	98.7	Very high	97.8	Very high	4 Å²	4	16 Å²	16	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-69	-46.9	-178.3	176.1	59.4	0	0	0	112.4	M161 D281 C282 V283 V293 P295	M161-L285 HydrophobicContact CE-CD1 4.09Å; M161-L285 HydrophobicContact CE-CD2 3.63Å; M161-L285 HydrophobicContact CE-CG 3.75Å; M161-L285 HydrophobicContact CG-CD1 4.4Å; M161-L285 HydrophobicContact SD-CD1 4.37Å; M161-L285 HydrophobicContact SD-CD2 4.34Å; M161-L285 HydrophobicContact SD-CG 3.89Å; D281-L285 WeakPolarHBondContact O-CB 3.38Å; D281-L285 PolarHBondContact O-N 3.48Å; C282-L285 PolarHBondContact O-N 2.66Å; V283-L285 PolarHBondContact O-N 3.04Å; L285-V293 HydrophobicContact CB-CB 4.33Å; L285-P295 HydrophobicContact CB-CG 4.37Å; L285-P295 HydrophobicContact CD2-CG 3.9Å
286	M	98.6	Very high	97.6	Very high	17 Å²	17	15.6 Å²	15.6	8%	0.084	9%	0.091	C	C	.	.	H	α-helix	trans	-96.8	-7.1	-164.2	-56.7	-177.6	-174.1	0	0	114.2	Q34 M161 Q164 F173 C282 V283	Q34-M286 HydrophobicContact CB-SD 4.17Å; Q34-M286 HydrophobicContact CG-CE 4.18Å; Q34-M286 HydrophobicContact CG-SD 4.29Å; M161-M286 HydrophobicContact SD-CB 4.23Å; M161-M286 HydrophobicContact SD-CG 3.65Å; Q164-M286 WeakPolarHBondContact CB-O 3.25Å; Q164-M286 PolarHBondContact N-O 2.83Å; F173-M286 HydrophobicContact CE1-CE 4.48Å; F173-M286 HydrophobicContact CE1-SD 4.25Å; F173-M286 HydrophobicContact CE2-SD 3.47Å; F173-M286 WeakPolarHBondContact CE2-SD 3.29Å; F173-M286 HydrophobicContact CZ-CE 3.93Å; F173-M286 HydrophobicContact CZ-SD 3.24Å; F173-M286 WeakPolarHBondContact CZ-SD 2.95Å; C282-M286 VanDerWaalsContact O-CB 3.29Å; C282-M286 WeakPolarHBondContact O-CB 3.47Å; C282-M286 VanDerWaalsContact O-CG 3.27Å; C282-M286 WeakPolarHBondContact O-CG 3.27Å; C282-M286 PolarHBondContact O-N 2.88Å; V283-M286 PolarHBondContact O-N 2.98Å
287	S	98.4	Very high	97.4	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.007	8%	0.084	C	C	.	.	H	α-helix	trans	-144.3	-21.4	-178.9	68.8	0	0	0	0	115.1	Q164 R258 V283	Q164-S287 WeakPolarHBondContact O-CB 3.38Å; R258-S287 PolarHBondContact NE-O 3.41Å; R258-S287 PolarHBondContact NH2-O 3.21Å; V283-S287 WeakPolarHBondContact CG1-OG 3.25Å; V283-S287 PolarHBondContact O-N 3.21Å; V283-S287 PolarHBondContact O-OG 2.9Å
288	L	98.6	Very high	97.2	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-108.3	16.7	-177	-49.3	179.6	0	0	0	114.6	P166 L257 R258 A265 L269 V283 C284 K290	P166-L288 HydrophobicContact CB-CD2 4.04Å; P166-L288 HydrophobicContact CG-CD2 4Å; L257-L288 HydrophobicContact CB-CD1 3.75Å; L257-L288 HydrophobicContact CB-CD2 4.06Å; L257-L288 HydrophobicContact CB-CG 4.47Å; L257-L288 HydrophobicContact CD1-CD1 4.19Å; R258-L288 HydrophobicContact CG-CB 4.44Å; R258-L288 HydrophobicContact CG-CD2 4.15Å; A265-L288 HydrophobicContact CB-CD1 4.34Å; L269-L288 HydrophobicContact CD1-CD1 3.78Å; L269-L288 HydrophobicContact CG-CD1 4.49Å; V283-L288 HydrophobicContact CG1-CD1 4.06Å; V283-L288 HydrophobicContact CG1-CG 4.16Å; V283-L288 PolarHBondContact O-N 3.18Å; C284-L288 CarbonylContact O-C 3.49Å; C284-L288 PolarHBondContact O-N 3.1Å; L288-K290 VanDerWaalsContact C-N 3.25Å; L288-K290 HydrophobicContact CB-CG 4.34Å; L288-K290 VanDerWaalsContact O-CD 3.27Å; L288-K290 WeakPolarHBondContact O-CD 3.35Å; L288-K290 WeakPolarHBondContact O-CE 3.5Å; L288-K290 WeakPolarHBondContact O-CG 3.33Å; L288-K290 PolarHBondContact O-N 3.46Å; L288-K290 PolarHBondContact O-NZ 3.43Å
289	E	97.6	Very high	96.9	Very high	91 Å²	91	19.6 Å²	19.6	43%	0.425	11%	0.107	S	C	.	.			trans	61.9	27	172.9	-59.8	166.8	-151.1	0	0	114.4	R163 R258 C284 A291	R163-E289 IonicContact CZ-OE1 3.3Å; R163-E289 IonicContact NE-OE1 3.54Å; R163-E289 PolarHBondContact NE-OE1 2.82Å; R163-E289 IonicContact NH2-OE1 3.41Å; R163-E289 PolarHBondContact NH2-OE1 3.34Å; R258-E289 WeakPolarHBondContact CD-OE1 3.26Å; R258-E289 IonicContact NE-OE1 3.81Å; C284-E289 PolarHBondContact O-N 3.26Å; E289-A291 PolarHBondContact O-N 3.39Å
290	K	98.3	Very high	96.7	Very high	25 Å²	25	19.3 Å²	19.3	11%	0.109	11%	0.105	C	C	.	.			trans	-93.3	70.3	177.7	-45.8	-50.7	177.6	-159.9	0	110	L257 R258 A260 C284 L288 C292 V293	L257-K290 PolarHBondContact O-NZ 2.89Å; R258-K290 PolarHBondContact O-NZ 2.95Å; A260-K290 WeakPolarHBondContact O-CE 3.33Å; A260-K290 PolarHBondContact O-NZ 3.47Å; C284-K290 HydrophobicContact CB-CB 4.03Å; C284-K290 HydrophobicContact CB-CG 3.9Å; C284-K290 WeakPolarHBondContact O-CB 3.41Å; C284-K290 WeakPolarHBondContact O-CG 3.24Å; C284-K290 PolarHBondContact O-N 3.28Å; L288-K290 VanDerWaalsContact C-N 3.25Å; L288-K290 HydrophobicContact CB-CG 4.34Å; L288-K290 VanDerWaalsContact O-CD 3.27Å; L288-K290 WeakPolarHBondContact O-CD 3.35Å; L288-K290 WeakPolarHBondContact O-CE 3.5Å; L288-K290 WeakPolarHBondContact O-CG 3.33Å; L288-K290 PolarHBondContact O-N 3.46Å; L288-K290 PolarHBondContact O-NZ 3.43Å; K290-C292 PolarHBondContact O-N 2.91Å; K290-V293 HydrophobicContact CB-CB 4.27Å; K290-V293 HydrophobicContact CB-CG2 3.41Å; K290-V293 VanDerWaalsContact CB-CG2 3.41Å; K290-V293 HydrophobicContact CG-CG2 4.46Å; K290-V293 WeakPolarHBondContact O-CB 3.26Å; K290-V293 WeakPolarHBondContact O-CG2 3Å; K290-V293 PolarHBondContact O-N 3.14Å
291	A	98.2	Very high	96.4	Very high	19 Å²	19	20.2 Å²	20.2	16%	0.157	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.8	-171.8	0	0	0	0	0	115.1	E289 V293 P337 Y338 G340	E289-A291 PolarHBondContact O-N 3.39Å; A291-V293 VanDerWaalsContact C-N 3.33Å; A291-P337 CarbonylContact C-O 3.51Å; A291-P337 VanDerWaalsContact C-O 3.32Å; A291-Y338 HydrophobicContact CB-CD1 3.62Å; A291-Y338 HydrophobicContact CB-CE1 3.88Å; A291-Y338 HydrophobicContact CB-CG 4.09Å; A291-Y338 CarbonylContact O-C 3.44Å; A291-Y338 WeakPolarHBondContact O-CA 3.31Å; A291-G340 WeakPolarHBondContact O-CA 3.39Å; A291-G340 PolarHBondContact O-N 3.38Å
292	C	97.4	Very high	96	Very high	38 Å²	38	25 Å²	25	26%	0.257	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-7	178.2	65.9	0	0	0	0	113.9	K290 R332 P337	K290-C292 PolarHBondContact O-N 2.91Å; C292-R332 HydrophobicContact CB-CG 4.49Å; C292-R332 WeakPolarHBondContact O-CD 3.35Å; C292-R332 WeakPolarHBondContact O-CG 3.4Å; C292-P337 VanDerWaalsContact CA-O 3.31Å; C292-P337 WeakPolarHBondContact CA-O 3.48Å; C292-P337 VanDerWaalsContact CB-O 3.28Å; C292-P337 WeakPolarHBondContact CB-O 3.28Å; C292-P337 PolarHBondContact N-O 3.23Å
293	V	97.8	Very high	95.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.131	C	C	.	.			trans	-78.3	130.6	-173.8	176.6	0	0	0	0	110.4	Y262 D281 C284 L285 K290 A291 P295 G340	Y262-V293 HydrophobicContact CD1-CG2 4.04Å; Y262-V293 HydrophobicContact CD2-CG2 3.26Å; Y262-V293 HydrophobicContact CE1-CG2 4.08Å; Y262-V293 HydrophobicContact CE2-CB 4.3Å; Y262-V293 HydrophobicContact CE2-CG1 3.9Å; Y262-V293 HydrophobicContact CE2-CG2 3.35Å; Y262-V293 HydrophobicContact CG-CG2 3.66Å; D281-V293 HydrophobicContact CB-CG1 3.48Å; D281-V293 VanDerWaalsContact CB-CG1 3.48Å; D281-V293 VanDerWaalsContact CG-CG1 3.44Å; D281-V293 WeakPolarHBondContact O-CG1 3.4Å; C284-V293 HydrophobicContact CB-CB 4.44Å; C284-V293 HydrophobicContact CB-CG1 4.18Å; C284-V293 HydrophobicContact CB-CG2 4.19Å; L285-V293 HydrophobicContact CB-CB 4.33Å; K290-V293 HydrophobicContact CB-CB 4.27Å; K290-V293 HydrophobicContact CB-CG2 3.41Å; K290-V293 VanDerWaalsContact CB-CG2 3.41Å; K290-V293 HydrophobicContact CG-CG2 4.46Å; K290-V293 WeakPolarHBondContact O-CB 3.26Å; K290-V293 WeakPolarHBondContact O-CG2 3Å; K290-V293 PolarHBondContact O-N 3.14Å; A291-V293 VanDerWaalsContact C-N 3.33Å; V293-P295 WeakPolarHBondContact O-CD 3.47Å; V293-G340 WeakPolarHBondContact O-CA 3.37Å
294	V	97.9	Very high	95.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.131	C	C	.	.			trans	-115	100.7	-179.7	179.1	0	0	0	0	107.8	V296 V300 F331 A339 H343	V294-V296 HydrophobicContact CG1-CG2 4.44Å; V294-V296 WeakPolarHBondContact O-CG2 3.34Å; V294-V296 PolarHBondContact O-N 3.17Å; V294-V300 HydrophobicContact CG1-CG1 4.37Å; V294-F331 HydrophobicContact CG1-CB 4.32Å; V294-F331 HydrophobicContact CG1-CD2 4.04Å; V294-F331 HydrophobicContact CG2-CB 3.98Å; V294-A339 HydrophobicContact CG2-CB 3.97Å; V294-H343 HydrophobicContact CG1-CB 4.03Å; V294-H343 HydrophobicContact CG2-CB 4.33Å
295	P	96.8	Very high	95.1	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.026	15%	0.145	C	C	.	.			trans	-70	112.4	179.3	-13.4	27.4	0	0	0	109.9	D281 C282 L285 V293 V300	D281-P295 HydrophobicContact CB-CB 3.88Å; D281-P295 HydrophobicContact CB-CG 4.14Å; C282-P295 VanDerWaalsContact SG-CB 3.53Å; L285-P295 HydrophobicContact CB-CG 4.37Å; L285-P295 HydrophobicContact CD2-CG 3.9Å; V293-P295 WeakPolarHBondContact O-CD 3.47Å; P295-V300 WeakPolarHBondContact O-CG2 3.29Å
296	V	95.1	Very high	94.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.168	C	C	.	.			trans	-93.7	113.5	-176.1	-172	0	0	0	0	109.8	V294 V300 L319 H324 I327	V294-V296 HydrophobicContact CG1-CG2 4.44Å; V294-V296 WeakPolarHBondContact O-CG2 3.34Å; V294-V296 PolarHBondContact O-N 3.17Å; V296-V300 HydrophobicContact CB-CG1 4.48Å; V296-V300 HydrophobicContact CG1-CB 4.18Å; V296-V300 HydrophobicContact CG1-CG1 4.16Å; V296-V300 HydrophobicContact CG2-CG1 4.36Å; V296-L319 HydrophobicContact CG1-CD1 4.01Å; V296-L319 HydrophobicContact CG1-CD2 4.1Å; V296-L319 WeakPolarHBondContact O-CD2 3.43Å; V296-H324 PolarHBondContact N-NE2 3.32Å; V296-H324 PolarHBondContact O-CD2 2.96Å; V296-I327 HydrophobicContact CG1-CB 4.1Å; V296-I327 HydrophobicContact CG1-CD1 3.94Å; V296-I327 HydrophobicContact CG1-CG2 3.84Å; V296-I327 HydrophobicContact CG2-CB 4.05Å; V296-I327 HydrophobicContact CG2-CG2 3.8Å
297	D	92.1	Very high	94.7	Very high	29 Å²	29	35.8 Å²	35.8	16%	0.155	18%	0.175	C	C	.	.			trans	-112.4	-167.3	167	71.2	12.8	0	0	0	111.1	K278 H299 V300 W301	K278-D297 HydrophobicContact CD-CB 4.48Å; K278-D297 HydrophobicContact CG-CB 3.98Å; D297-H299 VanDerWaalsContact C-N 3.33Å; D297-H299 PolarHBondContact O-N 3.39Å; D297-H299 WeakPolarHBondContact OD1-CA 3.42Å; D297-H299 VanDerWaalsContact OD1-CB 3.3Å; D297-H299 WeakPolarHBondContact OD1-CB 3.13Å; D297-H299 PolarHBondContact OD1-N 3.21Å; D297-V300 WeakPolarHBondContact OD1-CG2 3.39Å; D297-V300 PolarHBondContact OD1-N 3.48Å; D297-W301 WeakPolarHBondContact O-CB 3.45Å; D297-W301 PolarHBondContact O-N 3.42Å
298	T	89.3	Confident	94.4	Very high	90 Å²	90	37.5 Å²	37.5	55%	0.552	18%	0.182	S	C	*	.	H	α-helix	trans	-64.3	-35.6	177.2	50.8	0	0	0	0	112.8	W301 Q302	T298-W301 PolarHBondContact O-N 3.29Å; T298-Q302 VanDerWaalsContact O-CG 3.31Å; T298-Q302 WeakPolarHBondContact O-CG 3.39Å; T298-Q302 PolarHBondContact O-N 3.06Å
299	H	90.1	Very high	94	Very high	83 Å²	83	42.5 Å²	42.5	38%	0.384	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-48.4	177.1	-74	-88.5	0	0	0	110.8	D297 W301 Q302 I303 F347 D350	D297-H299 VanDerWaalsContact C-N 3.33Å; D297-H299 PolarHBondContact O-N 3.39Å; D297-H299 WeakPolarHBondContact OD1-CA 3.42Å; D297-H299 VanDerWaalsContact OD1-CB 3.3Å; D297-H299 WeakPolarHBondContact OD1-CB 3.13Å; D297-H299 PolarHBondContact OD1-N 3.21Å; H299-W301 PolarHBondContact O-N 3.14Å; H299-Q302 WeakPolarHBondContact O-CB 3.34Å; H299-Q302 PolarHBondContact O-N 3.28Å; H299-I303 WeakPolarHBondContact O-CG1 3.5Å; H299-I303 PolarHBondContact O-N 3.08Å; H299-F347 HydrophobicContact CB-CD2 4.29Å; H299-F347 HydrophobicContact CB-CE2 4.03Å; H299-D350 IonicContact ND1-OD2 2.67Å; H299-D350 PolarHBondContact ND1-OD2 3.3Å
300	V	92.8	Very high	93.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-37.9	178.2	-174.8	0	0	0	0	111.2	V294 P295 V296 D297 I303 A304 I327 F331 H343 F347	V294-V300 HydrophobicContact CG1-CG1 4.37Å; P295-V300 WeakPolarHBondContact O-CG2 3.29Å; V296-V300 HydrophobicContact CB-CG1 4.48Å; V296-V300 HydrophobicContact CG1-CB 4.18Å; V296-V300 HydrophobicContact CG1-CG1 4.16Å; V296-V300 HydrophobicContact CG2-CG1 4.36Å; D297-V300 WeakPolarHBondContact OD1-CG2 3.39Å; D297-V300 PolarHBondContact OD1-N 3.48Å; V300-I303 PolarHBondContact O-N 3.45Å; V300-A304 WeakPolarHBondContact O-CB 3.46Å; V300-A304 PolarHBondContact O-N 3.09Å; V300-I327 HydrophobicContact CG1-CG2 4.33Å; V300-F331 HydrophobicContact CG1-CE2 4.06Å; V300-H343 WeakPolarHBondContact CG2-NE2 3.33Å; V300-F347 HydrophobicContact CG2-CD2 4.4Å
301	W	92	Very high	92.4	Very high	19 Å²	19	41 Å²	41	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-39.4	174.1	-170.5	19.9	0	0	0	112.5	D297 T298 H299 K305 L319 I327	D297-W301 WeakPolarHBondContact O-CB 3.45Å; D297-W301 PolarHBondContact O-N 3.42Å; T298-W301 PolarHBondContact O-N 3.29Å; H299-W301 PolarHBondContact O-N 3.14Å; W301-K305 VanDerWaalsContact CE2-NZ 3.28Å; W301-K305 PolarHBondContact O-N 2.94Å; W301-K305 VanDerWaalsContact O-N 3.13Å; W301-L319 HydrophobicContact CB-CD1 4.39Å; W301-L319 HydrophobicContact CD2-CD1 4.07Å; W301-L319 HydrophobicContact CE3-CB 4.15Å; W301-L319 HydrophobicContact CE3-CD1 4.2Å; W301-L319 HydrophobicContact CG-CD1 4.19Å; W301-L319 HydrophobicContact CZ3-CB 4.25Å; W301-I327 HydrophobicContact CB-CD1 4.23Å; W301-I327 HydrophobicContact CG-CD1 3.89Å
302	Q	90.9	Very high	91.5	Very high	102 Å²	102	40.7 Å²	40.7	48%	0.477	22%	0.221	S	C	.	.	H	α-helix	trans	-66.4	-42.2	174.3	-67.2	-50.5	-37.9	0	0	112	T298 H299 K305 R306	T298-Q302 VanDerWaalsContact O-CG 3.31Å; T298-Q302 WeakPolarHBondContact O-CG 3.39Å; T298-Q302 PolarHBondContact O-N 3.06Å; H299-Q302 WeakPolarHBondContact O-CB 3.34Å; H299-Q302 PolarHBondContact O-N 3.28Å; Q302-K305 PolarHBondContact O-N 3.17Å; Q302-R306 WeakPolarHBondContact O-CB 3.48Å; Q302-R306 PolarHBondContact O-N 3.09Å
303	I	93.3	Very high	90.1	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-58.3	-50.1	174.8	-68.3	165.8	0	0	0	110.1	H299 V300 K305 R306 D307 Y308 L346 D350	H299-I303 WeakPolarHBondContact O-CG1 3.5Å; H299-I303 PolarHBondContact O-N 3.08Å; V300-I303 PolarHBondContact O-N 3.45Å; I303-K305 PolarHBondContact O-N 3.35Å; I303-R306 PolarHBondContact O-N 2.93Å; I303-D307 WeakPolarHBondContact O-CB 3.32Å; I303-D307 PolarHBondContact O-N 3.33Å; I303-Y308 HydrophobicContact CG2-CD2 4.33Å; I303-Y308 HydrophobicContact CG2-CE2 4.01Å; I303-L346 HydrophobicContact CD1-CB 4.49Å; I303-L346 HydrophobicContact CG2-CD1 4.09Å; I303-D350 HydrophobicContact CD1-CB 3.98Å; I303-D350 HydrophobicContact CG1-CB 4.42Å
304	A	93.4	Very high	88.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-57.7	-36.3	178.9	0	0	0	0	0	112.8	V300 Y308 S309 C310 I327 F331	V300-A304 WeakPolarHBondContact O-CB 3.46Å; V300-A304 PolarHBondContact O-N 3.09Å; A304-Y308 CarbonylContact O-C 3.5Å; A304-Y308 WeakPolarHBondContact O-CB 3.24Å; A304-S309 PolarHBondContact O-N 3.35Å; A304-C310 HydrophobicContact CB-CB 4Å; A304-C310 WeakPolarHBondContact O-CB 3.46Å; A304-C310 PolarHBondContact O-N 3.39Å; A304-I327 HydrophobicContact CB-CG2 4.02Å; A304-F331 HydrophobicContact CB-CE2 3.93Å; A304-F331 HydrophobicContact CB-CZ 3.96Å
305	K	91.1	Very high	87.7	Confident	65 Å²	65	48 Å²	48	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-77.1	-51.7	177.3	-78.3	177.4	163.4	172.8	0	112.7	W301 Q302 I303 S309	W301-K305 VanDerWaalsContact CE2-NZ 3.28Å; W301-K305 PolarHBondContact O-N 2.94Å; W301-K305 VanDerWaalsContact O-N 3.13Å; Q302-K305 PolarHBondContact O-N 3.17Å; I303-K305 PolarHBondContact O-N 3.35Å; K305-S309 WeakPolarHBondContact O-CA 3.39Å; K305-S309 PolarHBondContact O-N 2.72Å
306	R	93.1	Very high	86.8	Confident	135 Å²	135	52.4 Å²	52.4	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-67.6	-47	-173.3	-177	-172.6	66.4	-152.5	-6.4	111.7	Q302 I303 D350	Q302-R306 WeakPolarHBondContact O-CB 3.48Å; Q302-R306 PolarHBondContact O-N 3.09Å; I303-R306 PolarHBondContact O-N 2.93Å; R306-D350 IonicContact CZ-OD1 2.81Å; R306-D350 IonicContact NH1-OD1 3.91Å; R306-D350 PolarHBondContact NH1-OD1 3.3Å; R306-D350 IonicContact NH2-OD1 2.87Å; R306-D350 PolarHBondContact NH2-OD1 2.87Å
307	D	93.9	Very high	85.9	Confident	44 Å²	44	62.5 Å²	62.5	24%	0.235	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-23.4	-165.8	-55.1	-35.7	0	0	0	112.4	H148 I303	H148-D307 IonicContact CE1-OD1 3.45Å; H148-D307 IonicContact NE2-OD2 3.75Å; I303-D307 WeakPolarHBondContact O-CB 3.32Å; I303-D307 PolarHBondContact O-N 3.33Å
308	Y	93.9	Very high	85.5	Confident	37 Å²	37	64.4 Å²	64.4	15%	0.145	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-4.4	-175.3	-63.9	-88.3	0	0	0	114.4	D146 H148 I303 A304 C310 F330 F331 L334 W335 L346	D146-Y308 VanDerWaalsContact OD2-CE1 3.23Å; D146-Y308 WeakPolarHBondContact OD2-CE1 3.1Å; D146-Y308 VanDerWaalsContact OD2-CZ 3.3Å; D146-Y308 PolarHBondContact OD2-OH 3.49Å; H148-Y308 AromaticContact CD2-CZ 3.84Å; H148-Y308 PolarHBondContact CD2-OH 2.89Å; I303-Y308 HydrophobicContact CG2-CD2 4.33Å; I303-Y308 HydrophobicContact CG2-CE2 4.01Å; A304-Y308 CarbonylContact O-C 3.5Å; A304-Y308 WeakPolarHBondContact O-CB 3.24Å; Y308-C310 PolarHBondContact O-N 3.16Å; Y308-F330 AromaticContact CD1-CE1 3.95Å; Y308-F330 HydrophobicContact CD1-CE1 3.95Å; Y308-F330 AromaticContact CD1-CZ 3.97Å; Y308-F330 HydrophobicContact CD1-CZ 3.97Å; Y308-F330 AromaticContact CG-CE1 3.91Å; Y308-F330 HydrophobicContact CG-CE1 3.91Å; Y308-F330 HydrophobicContact CG-CZ 4.16Å; Y308-F331 HydrophobicContact CD1-CE1 4.43Å; Y308-F331 AromaticContact CD2-CE1 3.82Å; Y308-F331 HydrophobicContact CD2-CE1 3.82Å; Y308-F331 AromaticContact CD2-CZ 3.97Å; Y308-F331 HydrophobicContact CD2-CZ 3.97Å; Y308-F331 HydrophobicContact CE1-CE1 4.34Å; Y308-F331 AromaticContact CE2-CE1 3.73Å; Y308-F331 HydrophobicContact CE2-CE1 3.73Å; Y308-F331 HydrophobicContact CE2-CZ 4.12Å; Y308-F331 HydrophobicContact CG-CE1 4.19Å; Y308-L334 HydrophobicContact CD1-CD2 4.22Å; Y308-L334 HydrophobicContact CE1-CD2 3.72Å; Y308-W335 WeakPolarHBondContact OH-CZ2 3.36Å; Y308-L346 HydrophobicContact CE2-CD1 3.88Å; Y308-L346 WeakPolarHBondContact OH-CD1 3.28Å
309	S	89.3	Confident	85.4	Confident	105 Å²	105	62.7 Å²	62.7	73%	0.734	35%	0.345	S	S	*	.			trans	50	33.1	-173.8	-59.4	0	0	0	0	113	A304 K305 A311	A304-S309 PolarHBondContact O-N 3.35Å; K305-S309 WeakPolarHBondContact O-CA 3.39Å; K305-S309 PolarHBondContact O-N 2.72Å; S309-A311 PolarHBondContact O-N 3.45Å; S309-A311 VanDerWaalsContact O-N 3.15Å
310	C	83.6	Confident	85.4	Confident	13 Å²	13	61.1 Å²	61.1	9%	0.088	34%	0.342	C	S	.	.			trans	-63.1	119	-175	-172.8	0	0	0	0	110	A304 Y308 A312	A304-C310 HydrophobicContact CB-CB 4Å; A304-C310 WeakPolarHBondContact O-CB 3.46Å; A304-C310 PolarHBondContact O-N 3.39Å; Y308-C310 PolarHBondContact O-N 3.16Å; C310-A312 PolarHBondContact O-N 3.41Å; C310-A312 VanDerWaalsContact O-N 3.14Å; C310-A312 VanDerWaalsContact SG-CB 3.56Å
311	A	79.2	Confident	85.2	Confident	71 Å²	71	63.4 Å²	63.4	59%	0.587	35%	0.354	S	S	*	.			trans	-69.3	-9	-178.8	0	0	0	0	0	113.7	S309 G313 N314	S309-A311 PolarHBondContact O-N 3.45Å; S309-A311 VanDerWaalsContact O-N 3.15Å; A311-G313 PolarHBondContact O-N 3.41Å; A311-N314 WeakPolarHBondContact O-CB 3.15Å; A311-N314 PolarHBondContact O-N 3Å; A311-N314 VanDerWaalsContact O-N 3.09Å
312	A	77.8	Confident	85.1	Confident	13 Å²	13	69 Å²	69	11%	0.107	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	118.2	179.7	0	0	0	0	0	111.4	C310 Q326 I327	C310-A312 PolarHBondContact O-N 3.41Å; C310-A312 VanDerWaalsContact O-N 3.14Å; C310-A312 VanDerWaalsContact SG-CB 3.56Å; A312-Q326 HydrophobicContact CB-CB 3.7Å; A312-I327 HydrophobicContact CB-CG1 3.77Å
313	G	69	Low	85.1	Confident	7 Å²	7	64.3 Å²	64.3	7%	0.072	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	19.4	-177.8	0	0	0	0	0	114.9	A311 G315 Q316	A311-G313 PolarHBondContact O-N 3.41Å; G313-G315 PolarHBondContact O-N 3.03Å; G313-Q316 WeakPolarHBondContact O-CB 3.32Å; G313-Q316 PolarHBondContact O-N 2.97Å
314	N	73.6	Confident	85.1	Confident	106 Å²	106	64.7 Å²	64.7	57%	0.567	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	130.5	167.4	-82.5	-2.4	0	0	0	110.5	A311 Q316	A311-N314 WeakPolarHBondContact O-CB 3.15Å; A311-N314 PolarHBondContact O-N 3Å; A311-N314 VanDerWaalsContact O-N 3.09Å; N314-Q316 PolarHBondContact O-N 3.38Å
315	G	72.3	Confident	85	Confident	80 Å²	80	70.3 Å²	70.3	83%	0.825	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-3.5	-174.5	0	0	0	0	0	115.7	G313	G313-G315 PolarHBondContact O-N 3.03Å
316	Q	77	Confident	85.1	Confident	95 Å²	95	71 Å²	71	44%	0.444	38%	0.384	S	S	.	.			trans	-85.3	135.2	176.4	-62.8	-66.9	-60.4	0	0	111.2	G313 N314 V323	G313-Q316 WeakPolarHBondContact O-CB 3.32Å; G313-Q316 PolarHBondContact O-N 2.97Å; N314-Q316 PolarHBondContact O-N 3.38Å; Q316-V323 HydrophobicContact CB-CG2 4.45Å; Q316-V323 HydrophobicContact CG-CG2 4.08Å
317	K	77.5	Confident	85.2	Confident	212 Å²	212	64.5 Å²	64.5	92%	0.922	36%	0.36	S	S	*	.	S	Bend	trans	-84.8	-14	178.1	-64.4	-175.4	180	-179.3	0	113.8
318	S	82.4	Confident	85.3	Confident	69 Å²	69	62.5 Å²	62.5	48%	0.483	35%	0.349	S	S	.	.	S	Bend	trans	-143.1	157.8	-176.1	65.2	0	0	0	0	112.2	T320	S318-T320 PolarHBondContact O-N 2.93Å; S318-T320 VanDerWaalsContact O-N 3.14Å
319	L	87.6	Confident	85.4	Confident	54 Å²	54	64.1 Å²	64.1	28%	0.283	36%	0.36	S	S	.	.			trans	-82	87.4	177.9	-171.1	67.9	0	0	0	109.9	V296 W301 V323 I327	V296-L319 HydrophobicContact CG1-CD1 4.01Å; V296-L319 HydrophobicContact CG1-CD2 4.1Å; V296-L319 WeakPolarHBondContact O-CD2 3.43Å; W301-L319 HydrophobicContact CB-CD1 4.39Å; W301-L319 HydrophobicContact CD2-CD1 4.07Å; W301-L319 HydrophobicContact CE3-CB 4.15Å; W301-L319 HydrophobicContact CE3-CD1 4.2Å; W301-L319 HydrophobicContact CG-CD1 4.19Å; W301-L319 HydrophobicContact CZ3-CB 4.25Å; L319-V323 HydrophobicContact CD1-CB 4.23Å; L319-V323 HydrophobicContact CD1-CG1 3.75Å; L319-I327 HydrophobicContact CD1-CD1 4.21Å
320	T	89.6	Confident	85.7	Confident	51 Å²	51	62.1 Å²	62.1	31%	0.313	34%	0.338	S	S	.	.			trans	-75.9	162.4	176.2	67.4	0	0	0	0	111.4	S318 K322 V323 H324	S318-T320 PolarHBondContact O-N 2.93Å; S318-T320 VanDerWaalsContact O-N 3.14Å; T320-K322 PolarHBondContact O-N 3.24Å; T320-V323 PolarHBondContact O-N 3.5Å; T320-V323 WeakPolarHBondContact OG1-CG2 3.24Å; T320-V323 PolarHBondContact OG1-N 2.98Å; T320-H324 WeakPolarHBondContact O-CB 3.17Å; T320-H324 PolarHBondContact O-N 3.3Å
321	D	88.5	Confident	86.4	Confident	49 Å²	49	61.5 Å²	61.5	26%	0.262	33%	0.334	S	S	.	.	H	α-helix	trans	-55.8	-33.6	176	-177.1	97.7	0	0	0	112.4	R270 R325	R270-D321 IonicContact CZ-OD1 3.22Å; R270-D321 IonicContact NH1-OD1 2.86Å; R270-D321 PolarHBondContact NH1-OD1 3.08Å; R270-D321 IonicContact NH2-OD1 2.96Å; R270-D321 PolarHBondContact NH2-OD1 3.35Å; D321-R325 WeakPolarHBondContact O-CG 3.44Å; D321-R325 PolarHBondContact O-N 2.67Å; D321-R325 IonicContact OD2-CZ 2.98Å; D321-R325 VanDerWaalsContact OD2-CZ 3.28Å; D321-R325 IonicContact OD2-NE 2.66Å; D321-R325 PolarHBondContact OD2-NE 2.87Å; D321-R325 IonicContact OD2-NH2 3.28Å; D321-R325 PolarHBondContact OD2-NH2 2.97Å
322	K	90.1	Very high	87.3	Confident	137 Å²	137	60.2 Å²	60.2	60%	0.596	31%	0.314	S	S	*	.	H	α-helix	trans	-65.9	-49.2	174	-176.9	179.3	178.3	-179.7	0	111.8	T320 H324 R325 Q326	T320-K322 PolarHBondContact O-N 3.24Å; K322-H324 VanDerWaalsContact C-N 3.34Å; K322-R325 PolarHBondContact O-N 2.81Å; K322-Q326 WeakPolarHBondContact O-CG 3.34Å; K322-Q326 PolarHBondContact O-N 3.41Å
323	V	90.7	Very high	88.2	Confident	3 Å²	3	67.4 Å²	67.4	2%	0.018	35%	0.346	C	S	.	.	H	α-helix	trans	-64.8	-42.2	-180	177.5	0	0	0	0	110.5	Q316 L319 T320 R325 Q326 I327	Q316-V323 HydrophobicContact CB-CG2 4.45Å; Q316-V323 HydrophobicContact CG-CG2 4.08Å; L319-V323 HydrophobicContact CD1-CB 4.23Å; L319-V323 HydrophobicContact CD1-CG1 3.75Å; T320-V323 PolarHBondContact O-N 3.5Å; T320-V323 WeakPolarHBondContact OG1-CG2 3.24Å; T320-V323 PolarHBondContact OG1-N 2.98Å; V323-R325 VanDerWaalsContact C-N 3.34Å; V323-R325 PolarHBondContact O-N 2.87Å; V323-Q326 PolarHBondContact O-N 2.86Å; V323-I327 HydrophobicContact CG1-CD1 3.68Å; V323-I327 HydrophobicContact CG1-CG1 4.33Å; V323-I327 WeakPolarHBondContact O-CG1 3.17Å; V323-I327 PolarHBondContact O-N 2.77Å
324	H	92.8	Very high	89.6	Confident	12 Å²	12	69.3 Å²	69.3	6%	0.056	35%	0.354	C	S	.	.	H	α-helix	trans	-54.9	-48	174.1	-178.8	-72	0	0	0	111.6	D281 V296 T320 K322 G328	D281-H324 IonicContact OD2-CE1 2.71Å; D281-H324 PolarHBondContact OD2-CE1 2.85Å; D281-H324 VanDerWaalsContact OD2-CE1 3.23Å; V296-H324 PolarHBondContact N-NE2 3.32Å; V296-H324 PolarHBondContact O-CD2 2.96Å; T320-H324 WeakPolarHBondContact O-CB 3.17Å; T320-H324 PolarHBondContact O-N 3.3Å; K322-H324 VanDerWaalsContact C-N 3.34Å; H324-G328 PolarHBondContact O-N 3.12Å
325	R	92.1	Very high	90.7	Very high	118 Å²	118	64.9 Å²	64.9	45%	0.445	33%	0.329	S	S	.	.	H	α-helix	trans	-62.3	-48.1	176.3	-80.7	-173.2	-78.8	168.4	-7.4	112.6	D321 K322 V323 I327 G328 D329	D321-R325 WeakPolarHBondContact O-CG 3.44Å; D321-R325 PolarHBondContact O-N 2.67Å; D321-R325 IonicContact OD2-CZ 2.98Å; D321-R325 VanDerWaalsContact OD2-CZ 3.28Å; D321-R325 IonicContact OD2-NE 2.66Å; D321-R325 PolarHBondContact OD2-NE 2.87Å; D321-R325 IonicContact OD2-NH2 3.28Å; D321-R325 PolarHBondContact OD2-NH2 2.97Å; K322-R325 PolarHBondContact O-N 2.81Å; V323-R325 VanDerWaalsContact C-N 3.34Å; V323-R325 PolarHBondContact O-N 2.87Å; R325-I327 PolarHBondContact O-N 3.27Å; R325-G328 PolarHBondContact O-N 3.28Å; R325-D329 WeakPolarHBondContact O-CB 3.4Å; R325-D329 VanDerWaalsContact O-CG 3.31Å; R325-D329 PolarHBondContact O-N 3.01Å
326	Q	93.7	Very high	91.9	Very high	79 Å²	79	62.2 Å²	62.2	37%	0.369	30%	0.302	S	S	.	.	H	α-helix	trans	-59.5	-43.7	-178.9	-73.1	177.3	-34.8	0	0	112.7	A312 K322 V323 D329 F330	A312-Q326 HydrophobicContact CB-CB 3.7Å; K322-Q326 WeakPolarHBondContact O-CG 3.34Å; K322-Q326 PolarHBondContact O-N 3.41Å; V323-Q326 PolarHBondContact O-N 2.86Å; Q326-D329 PolarHBondContact O-N 3.5Å; Q326-F330 WeakPolarHBondContact O-CB 3.36Å; Q326-F330 PolarHBondContact O-N 3.44Å
327	I	95	Very high	92.9	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-43.3	177	-66.7	168.3	0	0	0	110.5	V296 V300 W301 A304 A312 L319 V323 R325 D329 F330 F331	V296-I327 HydrophobicContact CG1-CB 4.1Å; V296-I327 HydrophobicContact CG1-CD1 3.94Å; V296-I327 HydrophobicContact CG1-CG2 3.84Å; V296-I327 HydrophobicContact CG2-CB 4.05Å; V296-I327 HydrophobicContact CG2-CG2 3.8Å; V300-I327 HydrophobicContact CG1-CG2 4.33Å; W301-I327 HydrophobicContact CB-CD1 4.23Å; W301-I327 HydrophobicContact CG-CD1 3.89Å; A304-I327 HydrophobicContact CB-CG2 4.02Å; A312-I327 HydrophobicContact CB-CG1 3.77Å; L319-I327 HydrophobicContact CD1-CD1 4.21Å; V323-I327 HydrophobicContact CG1-CD1 3.68Å; V323-I327 HydrophobicContact CG1-CG1 4.33Å; V323-I327 WeakPolarHBondContact O-CG1 3.17Å; V323-I327 PolarHBondContact O-N 2.77Å; R325-I327 PolarHBondContact O-N 3.27Å; I327-D329 VanDerWaalsContact C-N 3.35Å; I327-D329 PolarHBondContact O-N 3.04Å; I327-F330 WeakPolarHBondContact O-CB 3.36Å; I327-F330 PolarHBondContact O-N 2.87Å; I327-F331 HydrophobicContact CG2-CD2 3.89Å; I327-F331 HydrophobicContact CG2-CE2 3.73Å; I327-F331 WeakPolarHBondContact O-CD2 3.33Å; I327-F331 PolarHBondContact O-N 3.41Å
328	G	95.8	Very high	93.9	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-41	176.5	0	0	0	0	0	112.7	H324 R325 R332	H324-G328 PolarHBondContact O-N 3.12Å; R325-G328 PolarHBondContact O-N 3.28Å; G328-R332 VanDerWaalsContact C-NH2 3.29Å; G328-R332 WeakPolarHBondContact O-CB 3.44Å; G328-R332 WeakPolarHBondContact O-CG 3.44Å; G328-R332 VanDerWaalsContact O-CZ 3.28Å; G328-R332 PolarHBondContact O-N 3.39Å; G328-R332 PolarHBondContact O-NE 2.92Å; G328-R332 PolarHBondContact O-NH1 3.38Å
329	D	95.4	Very high	94.7	Very high	71 Å²	71	53 Å²	53	38%	0.38	26%	0.26	S	S	.	.	H	α-helix	trans	-67.3	-40.3	178.1	-71.7	-27.6	0	0	0	111.5	R325 Q326 I327 F331 R332 Q333	R325-D329 WeakPolarHBondContact O-CB 3.4Å; R325-D329 VanDerWaalsContact O-CG 3.31Å; R325-D329 PolarHBondContact O-N 3.01Å; Q326-D329 PolarHBondContact O-N 3.5Å; I327-D329 VanDerWaalsContact C-N 3.35Å; I327-D329 PolarHBondContact O-N 3.04Å; D329-F331 PolarHBondContact O-N 3.42Å; D329-R332 PolarHBondContact O-N 3.17Å; D329-R332 IonicContact OD1-CZ 3.57Å; D329-R332 IonicContact OD1-NE 3.24Å; D329-R332 PolarHBondContact OD1-NE 3.23Å; D329-R332 IonicContact OD1-NH2 3.01Å; D329-R332 PolarHBondContact OD1-NH2 3.28Å; D329-Q333 WeakPolarHBondContact O-CB 3.48Å; D329-Q333 VanDerWaalsContact O-CG 3.29Å; D329-Q333 WeakPolarHBondContact O-CG 3.38Å; D329-Q333 PolarHBondContact O-N 2.95Å
330	F	96.6	Very high	95.2	Very high	63 Å²	63	50.4 Å²	50.4	28%	0.276	25%	0.247	S	C	.	.	H	α-helix	trans	-54.3	-52.8	173.6	170.5	-98.2	0	0	0	111.6	Y308 Q326 I327 R332 Q333 L334	Y308-F330 AromaticContact CD1-CE1 3.95Å; Y308-F330 HydrophobicContact CD1-CE1 3.95Å; Y308-F330 AromaticContact CD1-CZ 3.97Å; Y308-F330 HydrophobicContact CD1-CZ 3.97Å; Y308-F330 AromaticContact CG-CE1 3.91Å; Y308-F330 HydrophobicContact CG-CE1 3.91Å; Y308-F330 HydrophobicContact CG-CZ 4.16Å; Q326-F330 WeakPolarHBondContact O-CB 3.36Å; Q326-F330 PolarHBondContact O-N 3.44Å; I327-F330 WeakPolarHBondContact O-CB 3.36Å; I327-F330 PolarHBondContact O-N 2.87Å; F330-R332 PolarHBondContact O-N 2.93Å; F330-Q333 PolarHBondContact O-N 2.93Å; F330-L334 PolarHBondContact O-N 2.96Å; F330-L334 VanDerWaalsContact O-N 3.09Å
331	F	97.8	Very high	95.6	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-69.6	-31.8	179.6	-73.4	-56.2	0	0	0	113.3	V294 V300 A304 Y308 I327 D329 L334 W335 A339	V294-F331 HydrophobicContact CG1-CB 4.32Å; V294-F331 HydrophobicContact CG1-CD2 4.04Å; V294-F331 HydrophobicContact CG2-CB 3.98Å; V300-F331 HydrophobicContact CG1-CE2 4.06Å; A304-F331 HydrophobicContact CB-CE2 3.93Å; A304-F331 HydrophobicContact CB-CZ 3.96Å; Y308-F331 HydrophobicContact CD1-CE1 4.43Å; Y308-F331 AromaticContact CD2-CE1 3.82Å; Y308-F331 HydrophobicContact CD2-CE1 3.82Å; Y308-F331 AromaticContact CD2-CZ 3.97Å; Y308-F331 HydrophobicContact CD2-CZ 3.97Å; Y308-F331 HydrophobicContact CE1-CE1 4.34Å; Y308-F331 AromaticContact CE2-CE1 3.73Å; Y308-F331 HydrophobicContact CE2-CE1 3.73Å; Y308-F331 HydrophobicContact CE2-CZ 4.12Å; Y308-F331 HydrophobicContact CG-CE1 4.19Å; I327-F331 HydrophobicContact CG2-CD2 3.89Å; I327-F331 HydrophobicContact CG2-CE2 3.73Å; I327-F331 WeakPolarHBondContact O-CD2 3.33Å; I327-F331 PolarHBondContact O-N 3.41Å; D329-F331 PolarHBondContact O-N 3.42Å; F331-L334 HydrophobicContact CD1-CD2 4.44Å; F331-L334 PolarHBondContact O-N 2.96Å; F331-W335 HydrophobicContact CB-CE3 3.87Å; F331-W335 HydrophobicContact CB-CZ3 3.7Å; F331-W335 AromaticContact CD1-CE3 3.9Å; F331-W335 HydrophobicContact CD1-CE3 3.9Å; F331-W335 AromaticContact CD1-CH2 3.22Å; F331-W335 HydrophobicContact CD1-CH2 3.22Å; F331-W335 AromaticContact CD1-CZ2 3.99Å; F331-W335 HydrophobicContact CD1-CZ2 3.99Å; F331-W335 AromaticContact CD1-CZ3 3.18Å; F331-W335 HydrophobicContact CD1-CZ3 3.18Å; F331-W335 AromaticContact CE1-CH2 3.44Å; F331-W335 HydrophobicContact CE1-CH2 3.44Å; F331-W335 VanDerWaalsContact CE1-CH2 3.44Å; F331-W335 HydrophobicContact CE1-CZ2 4.19Å; F331-W335 AromaticContact CE1-CZ3 3.87Å; F331-W335 HydrophobicContact CE1-CZ3 3.87Å; F331-W335 HydrophobicContact CG-CE3 4.21Å; F331-W335 HydrophobicContact CG-CH2 4.06Å; F331-W335 AromaticContact CG-CZ3 3.57Å; F331-W335 HydrophobicContact CG-CZ3 3.57Å; F331-W335 HydrophobicContact CZ-CH2 4.41Å; F331-W335 PolarHBondContact O-N 3.48Å; F331-A339 WeakPolarHBondContact O-CB 3.4Å
332	R	97.5	Very high	96.1	Very high	43 Å²	43	46 Å²	46	16%	0.162	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-40.2	172.1	-82.4	-174.8	-71.7	-83.4	4.5	112.6	C292 G328 D329 F330 L334 G336 A339	C292-R332 HydrophobicContact CB-CG 4.49Å; C292-R332 WeakPolarHBondContact O-CD 3.35Å; C292-R332 WeakPolarHBondContact O-CG 3.4Å; G328-R332 VanDerWaalsContact C-NH2 3.29Å; G328-R332 WeakPolarHBondContact O-CB 3.44Å; G328-R332 WeakPolarHBondContact O-CG 3.44Å; G328-R332 VanDerWaalsContact O-CZ 3.28Å; G328-R332 PolarHBondContact O-N 3.39Å; G328-R332 PolarHBondContact O-NE 2.92Å; G328-R332 PolarHBondContact O-NH1 3.38Å; D329-R332 PolarHBondContact O-N 3.17Å; D329-R332 IonicContact OD1-CZ 3.57Å; D329-R332 IonicContact OD1-NE 3.24Å; D329-R332 PolarHBondContact OD1-NE 3.23Å; D329-R332 IonicContact OD1-NH2 3.01Å; D329-R332 PolarHBondContact OD1-NH2 3.28Å; F330-R332 PolarHBondContact O-N 2.93Å; R332-L334 VanDerWaalsContact C-N 3.3Å; R332-G336 VanDerWaalsContact O-CA 3.25Å; R332-G336 WeakPolarHBondContact O-CA 3.08Å; R332-G336 PolarHBondContact O-N 3.22Å; R332-A339 HydrophobicContact CG-CB 4.14Å
333	Q	97.3	Very high	96.4	Very high	165 Å²	165	40 Å²	40	77%	0.771	20%	0.195	S	C	*	.	H	α-helix	trans	-67.2	-34.3	175.8	-72.6	170.9	5.9	0	0	111.5	D329 F330	D329-Q333 WeakPolarHBondContact O-CB 3.48Å; D329-Q333 VanDerWaalsContact O-CG 3.29Å; D329-Q333 WeakPolarHBondContact O-CG 3.38Å; D329-Q333 PolarHBondContact O-N 2.95Å; F330-Q333 PolarHBondContact O-N 2.93Å
334	L	97.6	Very high	96.7	Very high	47 Å²	47	40.2 Å²	40.2	25%	0.246	20%	0.197	C	C	.	.	H	α-helix	trans	-73.9	-48.2	179.9	-175.3	60.4	0	0	0	113.4	D146 Y308 F330 F331 R332	D146-L334 HydrophobicContact CB-CD1 4.28Å; D146-L334 HydrophobicContact CB-CD2 4.14Å; D146-L334 HydrophobicContact CB-CG 4.3Å; Y308-L334 HydrophobicContact CD1-CD2 4.22Å; Y308-L334 HydrophobicContact CE1-CD2 3.72Å; F330-L334 PolarHBondContact O-N 2.96Å; F330-L334 VanDerWaalsContact O-N 3.09Å; F331-L334 HydrophobicContact CD1-CD2 4.44Å; F331-L334 PolarHBondContact O-N 2.96Å; R332-L334 VanDerWaalsContact C-N 3.3Å
335	W	98.3	Very high	97	Very high	12 Å²	12	39.6 Å²	39.6	5%	0.045	19%	0.194	C	C	.	.	H	α-helix	trans	-110.3	-2.3	-171.1	-62.6	-43.5	0	0	0	114.8	W142 D146 F149 Y308 F331 A339 A342 H343 L346	W142-W335 AromaticContact CD1-CD1 3.89Å; W142-W335 AromaticContact CD1-CG 3.98Å; W142-W335 HydrophobicContact CG-CG 4.43Å; W142-W335 PolarHBondContact NE1-O 3.05Å; D146-W335 WeakPolarHBondContact OD2-CZ2 3.47Å; D146-W335 PolarHBondContact OD2-NE1 3.03Å; F149-W335 HydrophobicContact CD2-CZ2 4.29Å; Y308-W335 WeakPolarHBondContact OH-CZ2 3.36Å; F331-W335 HydrophobicContact CB-CE3 3.87Å; F331-W335 HydrophobicContact CB-CZ3 3.7Å; F331-W335 AromaticContact CD1-CE3 3.9Å; F331-W335 HydrophobicContact CD1-CE3 3.9Å; F331-W335 AromaticContact CD1-CH2 3.22Å; F331-W335 HydrophobicContact CD1-CH2 3.22Å; F331-W335 AromaticContact CD1-CZ2 3.99Å; F331-W335 HydrophobicContact CD1-CZ2 3.99Å; F331-W335 AromaticContact CD1-CZ3 3.18Å; F331-W335 HydrophobicContact CD1-CZ3 3.18Å; F331-W335 AromaticContact CE1-CH2 3.44Å; F331-W335 HydrophobicContact CE1-CH2 3.44Å; F331-W335 VanDerWaalsContact CE1-CH2 3.44Å; F331-W335 HydrophobicContact CE1-CZ2 4.19Å; F331-W335 AromaticContact CE1-CZ3 3.87Å; F331-W335 HydrophobicContact CE1-CZ3 3.87Å; F331-W335 HydrophobicContact CG-CE3 4.21Å; F331-W335 HydrophobicContact CG-CH2 4.06Å; F331-W335 AromaticContact CG-CZ3 3.57Å; F331-W335 HydrophobicContact CG-CZ3 3.57Å; F331-W335 HydrophobicContact CZ-CH2 4.41Å; F331-W335 PolarHBondContact O-N 3.48Å; W335-A339 HydrophobicContact CB-CB 3.87Å; W335-A339 HydrophobicContact CE3-CB 4.29Å; W335-A342 HydrophobicContact CB-CB 3.98Å; W335-A342 HydrophobicContact CD2-CB 3.39Å; W335-A342 HydrophobicContact CE3-CB 3.55Å; W335-A342 HydrophobicContact CG-CB 3.61Å; W335-A342 HydrophobicContact CZ3-CB 4.19Å; W335-H343 HydrophobicContact CZ3-CB 3.97Å; W335-L346 HydrophobicContact CH2-CD1 3.41Å; W335-L346 VanDerWaalsContact CH2-CD1 3.41Å; W335-L346 HydrophobicContact CH2-CG 4.2Å; W335-L346 HydrophobicContact CZ2-CD1 3.68Å; W335-L346 HydrophobicContact CZ2-CG 4.4Å
336	G	97.4	Very high	97.2	Very high	25 Å²	25	34.1 Å²	34.1	26%	0.258	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	69.5	-144.3	171.5	0	0	0	0	0	114.7	R332 Y338 A339	R332-G336 VanDerWaalsContact O-CA 3.25Å; R332-G336 WeakPolarHBondContact O-CA 3.08Å; R332-G336 PolarHBondContact O-N 3.22Å; G336-Y338 PolarHBondContact O-N 3.22Å; G336-Y338 VanDerWaalsContact O-N 3.07Å; G336-A339 WeakPolarHBondContact O-CB 3.42Å; G336-A339 PolarHBondContact O-N 3.08Å; G336-A339 VanDerWaalsContact O-N 3.08Å
337	P	97.8	Very high	97.3	Very high	103 Å²	103	32.2 Å²	32.2	67%	0.669	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-62.1	-19.2	-168.4	-25.7	34.9	0	0	0	116	A291 C292	A291-P337 CarbonylContact C-O 3.51Å; A291-P337 VanDerWaalsContact C-O 3.32Å; C292-P337 VanDerWaalsContact CA-O 3.31Å; C292-P337 WeakPolarHBondContact CA-O 3.48Å; C292-P337 VanDerWaalsContact CB-O 3.28Å; C292-P337 WeakPolarHBondContact CB-O 3.28Å; C292-P337 PolarHBondContact N-O 3.23Å
338	Y	98.5	Very high	97.3	Very high	78 Å²	78	32.2 Å²	32.2	31%	0.306	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-115.3	26.7	177.7	-72.8	-101.6	0	0	0	112.7	V133 L138 W142 A291 G336 G340 W341 A342	V133-Y338 HydrophobicContact CG1-CE1 4.07Å; L138-Y338 HydrophobicContact CD1-CD1 3.86Å; L138-Y338 HydrophobicContact CD1-CE1 4.3Å; L138-Y338 HydrophobicContact CD1-CG 4.09Å; L138-Y338 HydrophobicContact CD2-CD2 3.91Å; L138-Y338 HydrophobicContact CD2-CE2 4.4Å; L138-Y338 HydrophobicContact CD2-CG 3.98Å; W142-Y338 WeakPolarHBondContact CZ2-O 3.45Å; A291-Y338 HydrophobicContact CB-CD1 3.62Å; A291-Y338 HydrophobicContact CB-CE1 3.88Å; A291-Y338 HydrophobicContact CB-CG 4.09Å; A291-Y338 CarbonylContact O-C 3.44Å; A291-Y338 WeakPolarHBondContact O-CA 3.31Å; G336-Y338 PolarHBondContact O-N 3.22Å; G336-Y338 VanDerWaalsContact O-N 3.07Å; Y338-G340 PolarHBondContact O-N 3.06Å; Y338-G340 VanDerWaalsContact O-N 3.1Å; Y338-W341 AromaticContact CD1-CD1 3.99Å; Y338-W341 AromaticContact CD1-CD2 3.8Å; Y338-W341 HydrophobicContact CD1-CD2 3.8Å; Y338-W341 AromaticContact CD1-CE2 3.76Å; Y338-W341 HydrophobicContact CD1-CE3 4.33Å; Y338-W341 AromaticContact CD1-CG 3.96Å; Y338-W341 HydrophobicContact CD1-CG 3.96Å; Y338-W341 HydrophobicContact CD1-CZ2 4.26Å; Y338-W341 AromaticContact CD1-NE1 3.89Å; Y338-W341 HydrophobicContact CE1-CD2 4.37Å; Y338-W341 AromaticContact CE1-CE2 3.98Å; Y338-W341 HydrophobicContact CE1-CH2 4.44Å; Y338-W341 HydrophobicContact CE1-CZ2 4.02Å; Y338-W341 WeakPolarHBondContact O-CB 3.43Å; Y338-W341 PolarHBondContact O-N 3.18Å; Y338-A342 PolarHBondContact O-N 2.88Å
339	A	98.6	Very high	97.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-54	-32.1	-179.3	0	0	0	0	0	114.7	V294 F331 R332 W335 G336 W341 A342 H343	V294-A339 HydrophobicContact CG2-CB 3.97Å; F331-A339 WeakPolarHBondContact O-CB 3.4Å; R332-A339 HydrophobicContact CG-CB 4.14Å; W335-A339 HydrophobicContact CB-CB 3.87Å; W335-A339 HydrophobicContact CE3-CB 4.29Å; G336-A339 WeakPolarHBondContact O-CB 3.42Å; G336-A339 PolarHBondContact O-N 3.08Å; G336-A339 VanDerWaalsContact O-N 3.08Å; A339-W341 VanDerWaalsContact C-N 3.29Å; A339-W341 PolarHBondContact O-N 3.07Å; A339-A342 PolarHBondContact O-N 3.03Å; A339-H343 VanDerWaalsContact O-CB 3.26Å; A339-H343 WeakPolarHBondContact O-CB 3.25Å; A339-H343 PolarHBondContact O-N 3.41Å
340	G	98.4	Very high	97.2	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-30.8	175.6	0	0	0	0	0	113.8	A291 V293 Y338 S344	A291-G340 WeakPolarHBondContact O-CA 3.39Å; A291-G340 PolarHBondContact O-N 3.38Å; V293-G340 WeakPolarHBondContact O-CA 3.37Å; Y338-G340 PolarHBondContact O-N 3.06Å; Y338-G340 VanDerWaalsContact O-N 3.1Å; G340-S344 PolarHBondContact O-N 3.04Å; G340-S344 PolarHBondContact O-OG 3.27Å
341	W	98.7	Very high	97	Very high	7 Å²	7	27.8 Å²	27.8	3%	0.027	14%	0.143	C	C	.	.	H	α-helix	trans	-74.7	-46.4	176.2	-68.2	41.9	0	0	0	110.6	Q130 V133 L135 L138 W142 R160 M161 Y338 A339 H343 S344 V345	Q130-W341 HydrophobicContact CB-CH2 3.84Å; Q130-W341 HydrophobicContact CB-CZ2 4.37Å; Q130-W341 HydrophobicContact CG-CH2 4.48Å; Q130-W341 VanDerWaalsContact NE2-CZ2 3.3Å; V133-W341 HydrophobicContact CB-CH2 3.88Å; V133-W341 HydrophobicContact CB-CZ3 4.12Å; V133-W341 HydrophobicContact CG1-CH2 3.94Å; V133-W341 HydrophobicContact CG1-CZ3 3.85Å; V133-W341 HydrophobicContact CG2-CH2 3.94Å; L135-W341 HydrophobicContact CD1-CE3 3.99Å; L135-W341 HydrophobicContact CD1-CZ3 4.24Å; L138-W341 HydrophobicContact CD1-CE3 3.89Å; L138-W341 HydrophobicContact CD1-CZ3 4.24Å; W142-W341 HydrophobicContact CH2-CB 3.47Å; W142-W341 VanDerWaalsContact CH2-CB 3.47Å; W142-W341 HydrophobicContact CZ2-CB 3.78Å; R160-W341 HydrophobicContact CG-CE3 4.32Å; R160-W341 HydrophobicContact CG-CZ3 3.8Å; M161-W341 HydrophobicContact CB-CD2 3.52Å; M161-W341 HydrophobicContact CB-CE3 4.08Å; M161-W341 HydrophobicContact CB-CG 3.84Å; M161-W341 HydrophobicContact CB-CH2 4.34Å; M161-W341 HydrophobicContact CB-CZ2 3.83Å; M161-W341 HydrophobicContact CB-CZ3 4.46Å; M161-W341 HydrophobicContact CG-CD2 4.46Å; M161-W341 HydrophobicContact CG-CZ2 4.46Å; Y338-W341 AromaticContact CD1-CD1 3.99Å; Y338-W341 AromaticContact CD1-CD2 3.8Å; Y338-W341 HydrophobicContact CD1-CD2 3.8Å; Y338-W341 AromaticContact CD1-CE2 3.76Å; Y338-W341 HydrophobicContact CD1-CE3 4.33Å; Y338-W341 AromaticContact CD1-CG 3.96Å; Y338-W341 HydrophobicContact CD1-CG 3.96Å; Y338-W341 HydrophobicContact CD1-CZ2 4.26Å; Y338-W341 AromaticContact CD1-NE1 3.89Å; Y338-W341 HydrophobicContact CE1-CD2 4.37Å; Y338-W341 AromaticContact CE1-CE2 3.98Å; Y338-W341 HydrophobicContact CE1-CH2 4.44Å; Y338-W341 HydrophobicContact CE1-CZ2 4.02Å; Y338-W341 WeakPolarHBondContact O-CB 3.43Å; Y338-W341 PolarHBondContact O-N 3.18Å; A339-W341 VanDerWaalsContact C-N 3.29Å; A339-W341 PolarHBondContact O-N 3.07Å; W341-H343 VanDerWaalsContact C-N 3.34Å; W341-H343 PolarHBondContact O-N 3.3Å; W341-S344 WeakPolarHBondContact O-CB 3.29Å; W341-S344 PolarHBondContact O-N 3.06Å; W341-V345 PolarHBondContact O-N 3.43Å
342	A	98.6	Very high	96.6	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-56.3	-48.7	174.2	0	0	0	0	0	111.7	W142 F149 W335 Y338 A339 S344 V345 L346	W142-A342 HydrophobicContact CD2-CB 3.58Å; W142-A342 HydrophobicContact CE3-CB 3.97Å; W142-A342 HydrophobicContact CG-CB 3.89Å; W142-A342 HydrophobicContact CH2-CB 4.38Å; W142-A342 HydrophobicContact CZ2-CB 4.03Å; W142-A342 HydrophobicContact CZ3-CB 4.35Å; F149-A342 HydrophobicContact CD2-CB 4.37Å; F149-A342 HydrophobicContact CE2-CB 3.96Å; F149-A342 WeakPolarHBondContact CE2-O 3.46Å; W335-A342 HydrophobicContact CB-CB 3.98Å; W335-A342 HydrophobicContact CD2-CB 3.39Å; W335-A342 HydrophobicContact CE3-CB 3.55Å; W335-A342 HydrophobicContact CG-CB 3.61Å; W335-A342 HydrophobicContact CZ3-CB 4.19Å; Y338-A342 PolarHBondContact O-N 2.88Å; A339-A342 PolarHBondContact O-N 3.03Å; A342-S344 PolarHBondContact O-N 2.98Å; A342-S344 VanDerWaalsContact O-N 3.17Å; A342-V345 WeakPolarHBondContact O-CB 3.36Å; A342-V345 PolarHBondContact O-N 2.81Å; A342-L346 PolarHBondContact O-N 3.48Å
343	H	96.6	Very high	96.1	Very high	12 Å²	12	41 Å²	41	6%	0.056	20%	0.202	C	C	.	.	H	α-helix	trans	-51	-40.4	173.7	157	-94	0	0	0	112.4	V294 V300 W335 A339 W341 V345 L346 F347	V294-H343 HydrophobicContact CG1-CB 4.03Å; V294-H343 HydrophobicContact CG2-CB 4.33Å; V300-H343 WeakPolarHBondContact CG2-NE2 3.33Å; W335-H343 HydrophobicContact CZ3-CB 3.97Å; A339-H343 VanDerWaalsContact O-CB 3.26Å; A339-H343 WeakPolarHBondContact O-CB 3.25Å; A339-H343 PolarHBondContact O-N 3.41Å; W341-H343 VanDerWaalsContact C-N 3.34Å; W341-H343 PolarHBondContact O-N 3.3Å; H343-V345 VanDerWaalsContact C-N 3.27Å; H343-V345 PolarHBondContact O-N 3.43Å; H343-L346 PolarHBondContact O-N 2.98Å; H343-F347 WeakPolarHBondContact O-CB 3.28Å; H343-F347 PolarHBondContact O-N 3.47Å
344	S	97.3	Very high	95.9	Very high	7 Å²	7	33.6 Å²	33.6	5%	0.049	17%	0.167	C	C	.	.	H	α-helix	trans	-68.2	-28.4	-176.6	-58.7	0	0	0	0	112.7	M161 G340 W341 A342 C348	M161-S344 WeakPolarHBondContact CE-OG 3.48Å; G340-S344 PolarHBondContact O-N 3.04Å; G340-S344 PolarHBondContact O-OG 3.27Å; W341-S344 WeakPolarHBondContact O-CB 3.29Å; W341-S344 PolarHBondContact O-N 3.06Å; A342-S344 PolarHBondContact O-N 2.98Å; A342-S344 VanDerWaalsContact O-N 3.17Å; S344-C348 WeakPolarHBondContact O-CB 3.25Å; S344-C348 PolarHBondContact O-N 2.91Å
345	V	98.1	Very high	95.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-48.2	171.3	-170.1	0	0	0	0	110.3	Y139 F149 I152 F156 V159 W341 A342 H343 C348 S349	Y139-V345 HydrophobicContact CE1-CG1 4.49Å; Y139-V345 HydrophobicContact CE2-CG2 4.1Å; Y139-V345 WeakPolarHBondContact OH-CG2 3.3Å; F149-V345 HydrophobicContact CE2-CB 3.76Å; F149-V345 HydrophobicContact CE2-CG1 4.2Å; F149-V345 HydrophobicContact CE2-CG2 3.88Å; F149-V345 HydrophobicContact CZ-CB 4.19Å; F149-V345 HydrophobicContact CZ-CG1 4.34Å; F149-V345 HydrophobicContact CZ-CG2 3.97Å; I152-V345 HydrophobicContact CG2-CG1 4.4Å; F156-V345 HydrophobicContact CB-CG1 3.9Å; F156-V345 WeakPolarHBondContact O-CG1 3.35Å; V159-V345 HydrophobicContact CB-CG2 4.21Å; V159-V345 HydrophobicContact CG2-CG1 4.38Å; W341-V345 PolarHBondContact O-N 3.43Å; A342-V345 WeakPolarHBondContact O-CB 3.36Å; A342-V345 PolarHBondContact O-N 2.81Å; H343-V345 VanDerWaalsContact C-N 3.27Å; H343-V345 PolarHBondContact O-N 3.43Å; V345-C348 WeakPolarHBondContact O-CB 3.33Å; V345-C348 PolarHBondContact O-N 2.98Å; V345-S349 PolarHBondContact O-N 3.29Å
346	L	96.8	Very high	94.8	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-64.4	-44.4	178.9	-61	-167.9	0	0	0	111.9	F149 I152 I303 Y308 W335 A342 H343 C348 S349 D350	F149-L346 HydrophobicContact CD2-CD2 3.93Å; F149-L346 HydrophobicContact CD2-CG 4.25Å; I152-L346 HydrophobicContact CB-CD2 4.13Å; I152-L346 HydrophobicContact CG1-CD2 4.11Å; I152-L346 HydrophobicContact CG2-CD2 4.08Å; I303-L346 HydrophobicContact CD1-CB 4.49Å; I303-L346 HydrophobicContact CG2-CD1 4.09Å; Y308-L346 HydrophobicContact CE2-CD1 3.88Å; Y308-L346 WeakPolarHBondContact OH-CD1 3.28Å; W335-L346 HydrophobicContact CH2-CD1 3.41Å; W335-L346 VanDerWaalsContact CH2-CD1 3.41Å; W335-L346 HydrophobicContact CH2-CG 4.2Å; W335-L346 HydrophobicContact CZ2-CD1 3.68Å; W335-L346 HydrophobicContact CZ2-CG 4.4Å; A342-L346 PolarHBondContact O-N 3.48Å; H343-L346 PolarHBondContact O-N 2.98Å; L346-C348 VanDerWaalsContact C-N 3.34Å; L346-C348 PolarHBondContact O-N 2.96Å; L346-S349 WeakPolarHBondContact O-CA 3.46Å; L346-S349 WeakPolarHBondContact O-CB 3.25Å; L346-S349 PolarHBondContact O-N 3.2Å; L346-S349 VanDerWaalsContact O-N 3.09Å; L346-S349 PolarHBondContact O-OG 3.41Å; L346-D350 PolarHBondContact O-N 2.83Å; L346-D350 VanDerWaalsContact O-N 3.07Å
347	F	95.5	Very high	94.3	Very high	39 Å²	39	42.9 Å²	42.9	17%	0.171	20%	0.202	C	C	.	.	H	α-helix	trans	-56.9	-48.8	175.4	-179.8	-92.9	0	0	0	110.7	C32 H299 V300 H343 S349 D350 L351	C32-F347 WeakPolarHBondContact O-CE1 3.39Å; H299-F347 HydrophobicContact CB-CD2 4.29Å; H299-F347 HydrophobicContact CB-CE2 4.03Å; V300-F347 HydrophobicContact CG2-CD2 4.4Å; H343-F347 WeakPolarHBondContact O-CB 3.28Å; H343-F347 PolarHBondContact O-N 3.47Å; F347-S349 VanDerWaalsContact C-N 3.26Å; F347-S349 PolarHBondContact O-N 3.28Å; F347-D350 PolarHBondContact O-N 2.85Å; F347-D350 VanDerWaalsContact O-N 3.08Å; F347-L351 HydrophobicContact CE1-CD1 4.17Å; F347-L351 HydrophobicContact CE1-CD2 3.87Å; F347-L351 HydrophobicContact CE1-CG 4.23Å; F347-L351 HydrophobicContact CZ-CD2 3.98Å; F347-L351 PolarHBondContact O-N 3.48Å
348	C	95.7	Very high	93.7	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.7	-43.1	175.1	-174.2	0	0	0	0	111.3	C32 V159 S344 V345 L346 D350 L351 F354	C32-C348 HydrophobicContact CB-CB 4.02Å; V159-C348 HydrophobicContact CG1-CB 4.03Å; V159-C348 HydrophobicContact CG2-CB 4.48Å; S344-C348 WeakPolarHBondContact O-CB 3.25Å; S344-C348 PolarHBondContact O-N 2.91Å; V345-C348 WeakPolarHBondContact O-CB 3.33Å; V345-C348 PolarHBondContact O-N 2.98Å; L346-C348 VanDerWaalsContact C-N 3.34Å; L346-C348 PolarHBondContact O-N 2.96Å; C348-D350 VanDerWaalsContact C-N 3.27Å; C348-D350 PolarHBondContact O-N 3.09Å; C348-L351 WeakPolarHBondContact O-CB 3.15Å; C348-L351 PolarHBondContact O-N 3.18Å; C348-F354 WeakPolarHBondContact O-CD2 3.39Å
349	S	94.8	Very high	93	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-24.2	178.7	92.9	0	0	0	0	114.8	V345 L346 F347 K358	V345-S349 PolarHBondContact O-N 3.29Å; L346-S349 WeakPolarHBondContact O-CA 3.46Å; L346-S349 WeakPolarHBondContact O-CB 3.25Å; L346-S349 PolarHBondContact O-N 3.2Å; L346-S349 VanDerWaalsContact O-N 3.09Å; L346-S349 PolarHBondContact O-OG 3.41Å; F347-S349 VanDerWaalsContact C-N 3.26Å; F347-S349 PolarHBondContact O-N 3.28Å; S349-K358 VanDerWaalsContact O-CE 3.24Å; S349-K358 WeakPolarHBondContact O-CE 3.45Å; S349-K358 PolarHBondContact O-NZ 2.88Å; S349-K358 PolarHBondContact OG-NZ 3.28Å
350	D	93.4	Very high	92.3	Very high	21 Å²	21	45.1 Å²	45.1	11%	0.112	21%	0.211	C	C	.	.	H	α-helix	trans	-85.3	-18.1	-179.3	-161.7	69.3	0	0	0	112.1	H299 I303 R306 L346 F347 C348 K352 Q355	H299-D350 IonicContact ND1-OD2 2.67Å; H299-D350 PolarHBondContact ND1-OD2 3.3Å; I303-D350 HydrophobicContact CD1-CB 3.98Å; I303-D350 HydrophobicContact CG1-CB 4.42Å; R306-D350 IonicContact CZ-OD1 2.81Å; R306-D350 IonicContact NH1-OD1 3.91Å; R306-D350 PolarHBondContact NH1-OD1 3.3Å; R306-D350 IonicContact NH2-OD1 2.87Å; R306-D350 PolarHBondContact NH2-OD1 2.87Å; L346-D350 PolarHBondContact O-N 2.83Å; L346-D350 VanDerWaalsContact O-N 3.07Å; F347-D350 PolarHBondContact O-N 2.85Å; F347-D350 VanDerWaalsContact O-N 3.08Å; C348-D350 VanDerWaalsContact C-N 3.27Å; C348-D350 PolarHBondContact O-N 3.09Å; D350-K352 PolarHBondContact O-N 3.1Å; D350-Q355 PolarHBondContact O-NE2 3.3Å
351	L	91.9	Very high	91.5	Very high	18 Å²	18	47.4 Å²	47.4	9%	0.094	22%	0.221	C	C	.	.	S	Bend	trans	-63.1	129.2	179.7	-64.7	178.4	0	0	0	111.6	C32 I181 F347 C348 K353 F354	C32-L351 HydrophobicContact CB-CD1 3.81Å; I181-L351 HydrophobicContact CD1-CD1 4.13Å; I181-L351 HydrophobicContact CD1-CD2 3.92Å; F347-L351 HydrophobicContact CE1-CD1 4.17Å; F347-L351 HydrophobicContact CE1-CD2 3.87Å; F347-L351 HydrophobicContact CE1-CG 4.23Å; F347-L351 HydrophobicContact CZ-CD2 3.98Å; F347-L351 PolarHBondContact O-N 3.48Å; C348-L351 WeakPolarHBondContact O-CB 3.15Å; C348-L351 PolarHBondContact O-N 3.18Å; L351-K353 PolarHBondContact O-N 3.36Å; L351-F354 HydrophobicContact CB-CD2 4Å; L351-F354 HydrophobicContact CD1-CD2 4.21Å; L351-F354 HydrophobicContact CD1-CE2 4.01Å; L351-F354 PolarHBondContact O-N 2.91Å
352	K	89.3	Confident	90.5	Very high	194 Å²	194	49.8 Å²	49.8	84%	0.843	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-51	-35.3	178.5	-67.8	-173.1	178.8	-176.5	0	113.6	D350 F354 Q355	D350-K352 PolarHBondContact O-N 3.1Å; K352-F354 PolarHBondContact O-N 3.45Å; K352-Q355 PolarHBondContact O-N 3.19Å
353	K	88.9	Confident	89.4	Confident	126 Å²	126	54.8 Å²	54.8	55%	0.548	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-57.8	-30.5	179.1	-175.4	178.4	177.8	-175.3	0	112.5	L351	L351-K353 PolarHBondContact O-N 3.36Å
354	F	91.1	Very high	88.4	Confident	11 Å²	11	60 Å²	60	5%	0.048	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-107.1	5.6	-172.9	-57	-53.9	0	0	0	114.2	D27 L28 C32 F156 C348 L351 K352 K356 L357	D27-F354 WeakPolarHBondContact O-CZ 3.49Å; L28-F354 HydrophobicContact CD2-CD1 3.77Å; L28-F354 HydrophobicContact CD2-CD2 4.38Å; L28-F354 HydrophobicContact CD2-CE1 3.8Å; L28-F354 HydrophobicContact CD2-CE2 4.4Å; L28-F354 HydrophobicContact CD2-CG 4.08Å; L28-F354 HydrophobicContact CD2-CZ 4.12Å; C32-F354 HydrophobicContact CB-CE2 4.32Å; F156-F354 HydrophobicContact CE1-CB 3.69Å; F156-F354 HydrophobicContact CE1-CG 4.35Å; F156-F354 HydrophobicContact CZ-CB 4.04Å; C348-F354 WeakPolarHBondContact O-CD2 3.39Å; L351-F354 HydrophobicContact CB-CD2 4Å; L351-F354 HydrophobicContact CD1-CD2 4.21Å; L351-F354 HydrophobicContact CD1-CE2 4.01Å; L351-F354 PolarHBondContact O-N 2.91Å; K352-F354 PolarHBondContact O-N 3.45Å; F354-K356 PolarHBondContact O-N 2.98Å; F354-L357 HydrophobicContact CB-CD1 4.23Å; F354-L357 HydrophobicContact CD1-CD1 4.21Å; F354-L357 WeakPolarHBondContact O-CB 3.27Å; F354-L357 PolarHBondContact O-N 3.33Å
355	Q	87.2	Confident	87.3	Confident	66 Å²	66	64.2 Å²	64.2	31%	0.308	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-34.1	179.1	-68.5	-69.2	-13.6	0	0	112.6	D350 K352 L357 K358 E359	D350-Q355 PolarHBondContact O-NE2 3.3Å; K352-Q355 PolarHBondContact O-N 3.19Å; Q355-L357 PolarHBondContact O-N 3.14Å; Q355-L357 VanDerWaalsContact O-N 3.15Å; Q355-K358 WeakPolarHBondContact O-CB 3.35Å; Q355-K358 PolarHBondContact O-N 2.81Å; Q355-E359 PolarHBondContact O-N 2.9Å
356	K	86.8	Confident	86.1	Confident	156 Å²	156	68.8 Å²	68.8	68%	0.678	33%	0.328	S	S	*	.	H	α-helix	trans	-58.1	-28.5	175.2	-66.6	-173.8	178.3	-175.2	0	113.9	F354 K358 E359 T360	F354-K356 PolarHBondContact O-N 2.98Å; K356-K358 VanDerWaalsContact C-N 3.34Å; K356-E359 PolarHBondContact O-N 3.25Å; K356-T360 WeakPolarHBondContact O-CB 3.3Å; K356-T360 PolarHBondContact O-N 2.93Å; K356-T360 PolarHBondContact O-OG1 2.62Å
357	L	87.4	Confident	84.9	Confident	57 Å²	57	74.8 Å²	74.8	30%	0.298	36%	0.356	S	S	.	.	H	α-helix	trans	-68	-36.9	176.6	-67.4	173.8	0	0	0	111.3	L28 I155 F156 F354 Q355 H361	L28-L357 HydrophobicContact CD2-CD1 3.72Å; I155-L357 HydrophobicContact CG2-CB 4.18Å; F156-L357 HydrophobicContact CE1-CD1 4.28Å; F156-L357 HydrophobicContact CZ-CB 4.35Å; F354-L357 HydrophobicContact CB-CD1 4.23Å; F354-L357 HydrophobicContact CD1-CD1 4.21Å; F354-L357 WeakPolarHBondContact O-CB 3.27Å; F354-L357 PolarHBondContact O-N 3.33Å; Q355-L357 PolarHBondContact O-N 3.14Å; Q355-L357 VanDerWaalsContact O-N 3.15Å; L357-H361 WeakPolarHBondContact O-CB 3.08Å; L357-H361 PolarHBondContact O-N 3.15Å; L357-H361 VanDerWaalsContact O-N 3.13Å
358	K	84.9	Confident	83.9	Confident	42 Å²	42	78.6 Å²	78.6	18%	0.183	37%	0.374	C	S	.	.	H	α-helix	trans	-65.9	-48.6	174.5	-66.8	-179.8	170.6	174.4	0	110.5	I155 F156 S349 Q355 K356 T360 H361 S362	I155-K358 HydrophobicContact CD1-CG 4.43Å; F156-K358 HydrophobicContact CE2-CD 4.25Å; F156-K358 HydrophobicContact CE2-CG 3.71Å; F156-K358 HydrophobicContact CZ-CG 4.15Å; S349-K358 VanDerWaalsContact O-CE 3.24Å; S349-K358 WeakPolarHBondContact O-CE 3.45Å; S349-K358 PolarHBondContact O-NZ 2.88Å; S349-K358 PolarHBondContact OG-NZ 3.28Å; Q355-K358 WeakPolarHBondContact O-CB 3.35Å; Q355-K358 PolarHBondContact O-N 2.81Å; K356-K358 VanDerWaalsContact C-N 3.34Å; K358-T360 PolarHBondContact O-N 3.36Å; K358-H361 PolarHBondContact O-N 3.34Å; K358-S362 PolarHBondContact O-N 2.98Å; K358-S362 PolarHBondContact O-OG 3.01Å
359	E	83.9	Confident	82.8	Confident	114 Å²	114	84.5 Å²	84.5	53%	0.533	40%	0.402	S	S	.	.	H	α-helix	trans	-57.3	-48.3	178.1	-65.7	167.4	-176.5	0	0	112	Q355 K356 H361 S362 L363	Q355-E359 PolarHBondContact O-N 2.9Å; K356-E359 PolarHBondContact O-N 3.25Å; E359-H361 VanDerWaalsContact C-N 3.31Å; E359-H361 PolarHBondContact O-N 2.96Å; E359-S362 PolarHBondContact O-N 3.45Å; E359-L363 WeakPolarHBondContact O-CG 3.28Å; E359-L363 PolarHBondContact O-N 2.73Å; E359-L363 VanDerWaalsContact O-N 3.1Å
360	T	82.8	Confident	81.7	Confident	71 Å²	71	89.9 Å²	89.9	44%	0.436	43%	0.425	S	S	.	.	H	α-helix	trans	-63.3	-38.5	-179.9	-53.9	0	0	0	0	111.7	K356 K358 K364	K356-T360 WeakPolarHBondContact O-CB 3.3Å; K356-T360 PolarHBondContact O-N 2.93Å; K356-T360 PolarHBondContact O-OG1 2.62Å; K358-T360 PolarHBondContact O-N 3.36Å; T360-K364 WeakPolarHBondContact O-CG 3.27Å; T360-K364 PolarHBondContact O-N 2.87Å; T360-K364 VanDerWaalsContact O-N 3.14Å
361	H	82.6	Confident	80.8	Confident	48 Å²	48	93.5 Å²	93.5	22%	0.222	45%	0.448	C	S	.	.	H	α-helix	trans	-69.5	-40.7	177.9	-172.8	-84.9	0	0	0	112.1	I155 L357 K358 E359 L363 K364 Q365	I155-H361 HydrophobicContact CD1-CB 3.91Å; I155-H361 HydrophobicContact CG1-CB 4.05Å; I155-H361 HydrophobicContact CG2-CB 4.3Å; L357-H361 WeakPolarHBondContact O-CB 3.08Å; L357-H361 PolarHBondContact O-N 3.15Å; L357-H361 VanDerWaalsContact O-N 3.13Å; K358-H361 PolarHBondContact O-N 3.34Å; E359-H361 VanDerWaalsContact C-N 3.31Å; E359-H361 PolarHBondContact O-N 2.96Å; H361-L363 VanDerWaalsContact C-N 3.33Å; H361-L363 PolarHBondContact O-N 3.15Å; H361-K364 PolarHBondContact O-N 3.23Å; H361-Q365 PolarHBondContact CE1-NE2 3.04Å; H361-Q365 PolarHBondContact ND1-OE1 3.13Å; H361-Q365 WeakPolarHBondContact O-CG 3.47Å; H361-Q365 PolarHBondContact O-N 3.44Å
362	S	77.9	Confident	79.8	Confident	58 Å²	58	99.1 Å²	99.1	41%	0.406	47%	0.471	S	S	.	.	H	α-helix	trans	-58.4	-44.7	174.5	-65.8	0	0	0	0	111.8	K358 E359 K364 Q365 E366	K358-S362 PolarHBondContact O-N 2.98Å; K358-S362 PolarHBondContact O-OG 3.01Å; E359-S362 PolarHBondContact O-N 3.45Å; S362-K364 PolarHBondContact O-N 3.36Å; S362-Q365 PolarHBondContact O-N 3.31Å; S362-E366 WeakPolarHBondContact O-CG 3.5Å; S362-E366 PolarHBondContact O-N 3.22Å
363	L	75.6	Confident	79.1	Confident	105 Å²	105	94.9 Å²	94.9	55%	0.55	46%	0.457	S	S	.	.	H	α-helix	trans	-61	-43.8	176.2	-68	170.5	0	0	0	112.3	E359 H361 E366 E367	E359-L363 WeakPolarHBondContact O-CG 3.28Å; E359-L363 PolarHBondContact O-N 2.73Å; E359-L363 VanDerWaalsContact O-N 3.1Å; H361-L363 VanDerWaalsContact C-N 3.33Å; H361-L363 PolarHBondContact O-N 3.15Å; L363-E366 PolarHBondContact O-N 3.32Å; L363-E367 PolarHBondContact O-N 2.86Å
364	K	74.8	Confident	78.2	Confident	122 Å²	122	96 Å²	96	53%	0.53	46%	0.462	S	S	.	.	H	α-helix	trans	-63.2	-41.5	176.7	-74.1	-179.7	177.9	-173	0	112.4	T360 H361 S362 E367 E368	T360-K364 WeakPolarHBondContact O-CG 3.27Å; T360-K364 PolarHBondContact O-N 2.87Å; T360-K364 VanDerWaalsContact O-N 3.14Å; H361-K364 PolarHBondContact O-N 3.23Å; S362-K364 PolarHBondContact O-N 3.36Å; K364-E367 PolarHBondContact O-N 2.98Å; K364-E368 WeakPolarHBondContact O-CG 3.39Å; K364-E368 PolarHBondContact O-N 3.4Å
365	Q	74.4	Confident	77	Confident	94 Å²	94	98.3 Å²	98.3	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-63.9	-42.6	176.5	-75.4	-171.2	-50.5	0	0	111.9	H361 S362 E367 E368 E369	H361-Q365 PolarHBondContact CE1-NE2 3.04Å; H361-Q365 PolarHBondContact ND1-OE1 3.13Å; H361-Q365 WeakPolarHBondContact O-CG 3.47Å; H361-Q365 PolarHBondContact O-N 3.44Å; S362-Q365 PolarHBondContact O-N 3.31Å; Q365-E367 VanDerWaalsContact C-N 3.32Å; Q365-E367 PolarHBondContact O-N 2.66Å; Q365-E368 PolarHBondContact O-N 2.88Å; Q365-E369 VanDerWaalsContact O-CB 3.3Å; Q365-E369 WeakPolarHBondContact O-CB 3.31Å; Q365-E369 PolarHBondContact O-N 2.87Å
366	E	72.5	Confident	76	Confident	96 Å²	96	101.6 Å²	101.6	45%	0.449	50%	0.498	S	S	.	.	H	α-helix	trans	-63	-37.8	175.5	-73.4	-179.3	-160	0	0	112.4	S362 L363 K370	S362-E366 WeakPolarHBondContact O-CG 3.5Å; S362-E366 PolarHBondContact O-N 3.22Å; L363-E366 PolarHBondContact O-N 3.32Å; E366-K370 WeakPolarHBondContact O-CB 3.14Å; E366-K370 WeakPolarHBondContact O-CD 3.47Å; E366-K370 WeakPolarHBondContact O-CG 3.26Å; E366-K370 PolarHBondContact O-N 2.96Å; E366-K370 IonicContact OE2-NZ 3.83Å
367	E	72.3	Confident	74.7	Confident	129 Å²	129	95.8 Å²	95.8	60%	0.603	48%	0.482	S	S	*	.	H	α-helix	trans	-66.6	-46.8	174.5	-76.5	-177	167.9	0	0	112	L363 K364 Q365 E369 K370 V371	L363-E367 PolarHBondContact O-N 2.86Å; K364-E367 PolarHBondContact O-N 2.98Å; Q365-E367 VanDerWaalsContact C-N 3.32Å; Q365-E367 PolarHBondContact O-N 2.66Å; E367-E369 VanDerWaalsContact C-N 3.3Å; E367-E369 PolarHBondContact O-N 3.24Å; E367-K370 PolarHBondContact O-N 3.13Å; E367-V371 VanDerWaalsContact O-CG2 3.27Å; E367-V371 WeakPolarHBondContact O-CG2 3.44Å; E367-V371 PolarHBondContact O-N 2.85Å
368	E	73	Confident	73.4	Confident	120 Å²	120	98.7 Å²	98.7	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-60.9	-39.3	176.4	-75.3	178.6	-171.3	0	0	112.1	K364 Q365 V371 K372	K364-E368 WeakPolarHBondContact O-CG 3.39Å; K364-E368 PolarHBondContact O-N 3.4Å; Q365-E368 PolarHBondContact O-N 2.88Å; E368-V371 PolarHBondContact O-N 3Å; E368-K372 WeakPolarHBondContact O-CG 3.2Å; E368-K372 PolarHBondContact O-N 3.18Å
369	E	72.4	Confident	72.1	Confident	124 Å²	124	98.3 Å²	98.3	58%	0.579	50%	0.502	S	S	*	.	H	α-helix	trans	-69.1	-41.9	176.9	-164.9	168.2	-157.4	0	0	111.4	Q365 E367 V371 K372 I373	Q365-E369 VanDerWaalsContact O-CB 3.3Å; Q365-E369 WeakPolarHBondContact O-CB 3.31Å; Q365-E369 PolarHBondContact O-N 2.87Å; E367-E369 VanDerWaalsContact C-N 3.3Å; E367-E369 PolarHBondContact O-N 3.24Å; E369-V371 VanDerWaalsContact C-N 3.3Å; E369-V371 PolarHBondContact O-N 3.12Å; E369-K372 PolarHBondContact O-N 3.21Å; E369-I373 HydrophobicContact CG-CD1 4.16Å; E369-I373 VanDerWaalsContact O-CG1 3.27Å; E369-I373 WeakPolarHBondContact O-CG1 3.38Å; E369-I373 PolarHBondContact O-N 3.38Å
370	K	71.7	Confident	70.9	Confident	116 Å²	116	97.8 Å²	97.8	50%	0.504	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-38.2	171.5	-75.5	165.8	-171.5	161.8	0	112.1	E366 E367 K374	E366-K370 WeakPolarHBondContact O-CB 3.14Å; E366-K370 WeakPolarHBondContact O-CD 3.47Å; E366-K370 WeakPolarHBondContact O-CG 3.26Å; E366-K370 PolarHBondContact O-N 2.96Å; E366-K370 IonicContact OE2-NZ 3.83Å; E367-K370 PolarHBondContact O-N 3.13Å; K370-K374 WeakPolarHBondContact O-CB 3.46Å; K370-K374 WeakPolarHBondContact O-CG 3.01Å; K370-K374 PolarHBondContact O-N 3.42Å
371	V	74.4	Confident	69.7	Low	97 Å²	97	99.6 Å²	99.6	59%	0.588	51%	0.509	S	S	*	.	H	α-helix	trans	-68.2	-42.9	176.1	171.6	0	0	0	0	110.9	E367 E368 E369 K374 A375	E367-V371 VanDerWaalsContact O-CG2 3.27Å; E367-V371 WeakPolarHBondContact O-CG2 3.44Å; E367-V371 PolarHBondContact O-N 2.85Å; E368-V371 PolarHBondContact O-N 3Å; E369-V371 VanDerWaalsContact C-N 3.3Å; E369-V371 PolarHBondContact O-N 3.12Å; V371-K374 PolarHBondContact O-N 3.37Å; V371-A375 WeakPolarHBondContact O-CB 3.39Å; V371-A375 PolarHBondContact O-N 3.17Å
372	K	71.8	Confident	68.5	Low	135 Å²	135	104.1 Å²	104.1	59%	0.587	53%	0.528	S	S	*	.	H	α-helix	trans	-62.1	-46.4	175.2	-77.6	177.7	-179	173.6	0	112.4	E368 E369 K374 A375 E376	E368-K372 WeakPolarHBondContact O-CG 3.2Å; E368-K372 PolarHBondContact O-N 3.18Å; E369-K372 PolarHBondContact O-N 3.21Å; K372-K374 VanDerWaalsContact C-N 3.31Å; K372-K374 PolarHBondContact O-N 3.29Å; K372-A375 PolarHBondContact O-N 2.88Å; K372-E376 WeakPolarHBondContact O-CG 3.35Å; K372-E376 PolarHBondContact O-N 3.44Å
373	I	74	Confident	67.4	Low	106 Å²	106	105.4 Å²	105.4	54%	0.544	53%	0.533	S	S	.	.	H	α-helix	trans	-61.5	-40.3	177.6	-67.2	165.8	0	0	0	110.9	E369 G377	E369-I373 HydrophobicContact CG-CD1 4.16Å; E369-I373 VanDerWaalsContact O-CG1 3.27Å; E369-I373 WeakPolarHBondContact O-CG1 3.38Å; E369-I373 PolarHBondContact O-N 3.38Å; I373-G377 PolarHBondContact O-N 3.31Å
374	K	70.2	Confident	66.6	Low	149 Å²	149	104 Å²	104	65%	0.648	53%	0.526	S	S	*	.	H	α-helix	trans	-64.7	-43.4	174.2	-77.6	179.7	178.9	-177.5	0	112.2	K370 V371 K372 G377 E378	K370-K374 WeakPolarHBondContact O-CB 3.46Å; K370-K374 WeakPolarHBondContact O-CG 3.01Å; K370-K374 PolarHBondContact O-N 3.42Å; V371-K374 PolarHBondContact O-N 3.37Å; K372-K374 VanDerWaalsContact C-N 3.31Å; K372-K374 PolarHBondContact O-N 3.29Å; K374-G377 PolarHBondContact O-N 3.3Å; K374-E378 WeakPolarHBondContact O-CB 3.45Å; K374-E378 WeakPolarHBondContact O-CG 3.48Å; K374-E378 PolarHBondContact O-N 3.26Å
375	A	65.4	Low	65.7	Low	60 Å²	60	104.3 Å²	104.3	50%	0.496	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-39.5	178.3	0	0	0	0	0	112.5	V371 K372 G379	V371-A375 WeakPolarHBondContact O-CB 3.39Å; V371-A375 PolarHBondContact O-N 3.17Å; K372-A375 PolarHBondContact O-N 2.88Å; A375-G379 PolarHBondContact O-N 3.21Å
376	E	66.9	Low	64.8	Low	135 Å²	135	107.8 Å²	107.8	63%	0.631	54%	0.543	S	S	*	.	H	α-helix	trans	-68.4	-41.4	174.3	-72.6	-179.1	174.8	0	0	111.8	K372 G379 I380	K372-E376 WeakPolarHBondContact O-CG 3.35Å; K372-E376 PolarHBondContact O-N 3.44Å; E376-G379 PolarHBondContact O-N 3.25Å; E376-I380 VanDerWaalsContact O-CG1 3.31Å; E376-I380 WeakPolarHBondContact O-CG1 3.44Å; E376-I380 PolarHBondContact O-N 3.47Å
377	G	59.8	Low	64	Low	33 Å²	33	108.5 Å²	108.5	34%	0.34	55%	0.548	S	S	.	.	H	α-helix	trans	-62.5	-40.3	174.5	0	0	0	0	0	113.5	I373 K374 I380 N381	I373-G377 PolarHBondContact O-N 3.31Å; K374-G377 PolarHBondContact O-N 3.3Å; G377-I380 PolarHBondContact O-N 3.18Å; G377-N381 PolarHBondContact O-N 3.21Å
378	E	60.7	Low	63.1	Low	119 Å²	119	105.8 Å²	105.8	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-68.6	-35.5	173.3	-74.9	-177.9	-173.9	0	0	112.6	K374 N381 K382	K374-E378 WeakPolarHBondContact O-CB 3.45Å; K374-E378 WeakPolarHBondContact O-CG 3.48Å; K374-E378 PolarHBondContact O-N 3.26Å; E378-N381 PolarHBondContact O-N 3.16Å; E378-K382 WeakPolarHBondContact O-CB 3.5Å; E378-K382 WeakPolarHBondContact O-CG 3.48Å; E378-K382 PolarHBondContact O-N 3.4Å
379	G	57.1	Low	62.3	Low	34 Å²	34	105 Å²	105	35%	0.351	54%	0.542	S	S	.	.	H	α-helix	trans	-64.5	-40.8	173.7	0	0	0	0	0	112.9	A375 E376 T383	A375-G379 PolarHBondContact O-N 3.21Å; E376-G379 PolarHBondContact O-N 3.25Å; G379-T383 WeakPolarHBondContact O-CB 3.2Å; G379-T383 PolarHBondContact O-N 3.31Å; G379-T383 VanDerWaalsContact O-N 3.09Å; G379-T383 PolarHBondContact O-OG1 2.98Å
380	I	58.7	Low	61.4	Low	103 Å²	103	108.5 Å²	108.5	53%	0.528	55%	0.55	S	S	.	.	H	α-helix	trans	-66.6	-45.1	174.5	-67.7	164.7	0	0	0	110.4	E376 G377 K382 T383 I384	E376-I380 VanDerWaalsContact O-CG1 3.31Å; E376-I380 WeakPolarHBondContact O-CG1 3.44Å; E376-I380 PolarHBondContact O-N 3.47Å; G377-I380 PolarHBondContact O-N 3.18Å; I380-K382 PolarHBondContact O-N 3.02Å; I380-T383 WeakPolarHBondContact O-CB 3.35Å; I380-T383 PolarHBondContact O-N 3.12Å; I380-T383 VanDerWaalsContact O-N 3.11Å; I380-I384 HydrophobicContact CG2-CD1 3.76Å; I380-I384 HydrophobicContact CG2-CG1 4.33Å; I380-I384 WeakPolarHBondContact O-CG1 3.45Å; I380-I384 PolarHBondContact O-N 3.49Å
381	N	57.3	Low	60.4	Low	108 Å²	108	110.5 Å²	110.5	58%	0.578	56%	0.558	S	S	*	*	H	α-helix	trans	-61.4	-42.5	176.9	-91.7	-20.7	0	0	0	112.8	G377 E378 T383 I384 Q385	G377-N381 PolarHBondContact O-N 3.21Å; E378-N381 PolarHBondContact O-N 3.16Å; N381-T383 VanDerWaalsContact C-N 3.27Å; N381-T383 PolarHBondContact O-N 2.68Å; N381-I384 PolarHBondContact O-N 3.38Å; N381-Q385 VanDerWaalsContact O-CB 3.31Å; N381-Q385 WeakPolarHBondContact O-CB 3.34Å; N381-Q385 PolarHBondContact O-N 3.37Å
382	K	57.8	Low	59.3	Low	144 Å²	144	110.2 Å²	110.2	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-63.5	-32.8	174.1	-76.2	174.9	-178.6	168.6	0	112.6	E378 I380 K386	E378-K382 WeakPolarHBondContact O-CB 3.5Å; E378-K382 WeakPolarHBondContact O-CG 3.48Å; E378-K382 PolarHBondContact O-N 3.4Å; I380-K382 PolarHBondContact O-N 3.02Å; K382-K386 WeakPolarHBondContact O-CB 3.48Å; K382-K386 PolarHBondContact O-N 3.2Å
383	T	55.5	Low	58.3	Low	84 Å²	84	109.5 Å²	109.5	52%	0.515	56%	0.559	S	S	.	*	H	α-helix	trans	-73	-44.2	177.1	-56.6	0	0	0	0	111.4	G379 I380 N381 Q385 K386 M387	G379-T383 WeakPolarHBondContact O-CB 3.2Å; G379-T383 PolarHBondContact O-N 3.31Å; G379-T383 VanDerWaalsContact O-N 3.09Å; G379-T383 PolarHBondContact O-OG1 2.98Å; I380-T383 WeakPolarHBondContact O-CB 3.35Å; I380-T383 PolarHBondContact O-N 3.12Å; I380-T383 VanDerWaalsContact O-N 3.11Å; N381-T383 VanDerWaalsContact C-N 3.27Å; N381-T383 PolarHBondContact O-N 2.68Å; T383-Q385 PolarHBondContact O-N 3.24Å; T383-K386 PolarHBondContact O-N 3.42Å; T383-M387 WeakPolarHBondContact O-CG 3.44Å; T383-M387 PolarHBondContact O-N 3.05Å
384	I	58	Low	57.2	Low	77 Å²	77	111 Å²	111	40%	0.395	57%	0.565	S	S	.	*	H	α-helix	trans	-62.2	-42.4	174.3	-67.3	171.7	0	0	0	110.7	I380 N381 K386 M387 C388	I380-I384 HydrophobicContact CG2-CD1 3.76Å; I380-I384 HydrophobicContact CG2-CG1 4.33Å; I380-I384 WeakPolarHBondContact O-CG1 3.45Å; I380-I384 PolarHBondContact O-N 3.49Å; N381-I384 PolarHBondContact O-N 3.38Å; I384-K386 PolarHBondContact O-N 3.37Å; I384-M387 HydrophobicContact CG1-CE 4.22Å; I384-M387 PolarHBondContact O-N 3.47Å; I384-M387 VanDerWaalsContact O-N 3.12Å; I384-C388 PolarHBondContact O-N 2.65Å
385	Q	55.5	Low	56	Low	128 Å²	128	107.8 Å²	107.8	60%	0.598	56%	0.562	S	S	*	*	H	α-helix	trans	-66.9	-36	178.4	-159.5	157.5	8.9	0	0	112.5	N381 T383 N389	N381-Q385 VanDerWaalsContact O-CB 3.31Å; N381-Q385 WeakPolarHBondContact O-CB 3.34Å; N381-Q385 PolarHBondContact O-N 3.37Å; T383-Q385 PolarHBondContact O-N 3.24Å; Q385-N389 WeakPolarHBondContact O-CB 3.49Å; Q385-N389 PolarHBondContact O-N 3.47Å
386	K	56.1	Low	55.2	Low	166 Å²	166	109.6 Å²	109.6	72%	0.722	57%	0.566	S	S	*	*	H	α-helix	trans	-64.5	-38.1	169	-92.5	-178.7	176.6	175.2	0	112.8	K382 T383 I384 R390	K382-K386 WeakPolarHBondContact O-CB 3.48Å; K382-K386 PolarHBondContact O-N 3.2Å; T383-K386 PolarHBondContact O-N 3.42Å; I384-K386 PolarHBondContact O-N 3.37Å; K386-R390 WeakPolarHBondContact O-CB 3.49Å; K386-R390 PolarHBondContact O-N 2.93Å; K386-R390 VanDerWaalsContact O-N 3.08Å
387	M	55.5	Low	54.2	Low	112 Å²	112	111.6 Å²	111.6	55%	0.552	57%	0.573	S	S	*	*	H	α-helix	trans	-70.9	-39.7	177	-70.8	-167.9	-51.5	0	0	112.7	T383 I384 R390 K391	T383-M387 WeakPolarHBondContact O-CG 3.44Å; T383-M387 PolarHBondContact O-N 3.05Å; I384-M387 HydrophobicContact CG1-CE 4.22Å; I384-M387 PolarHBondContact O-N 3.47Å; I384-M387 VanDerWaalsContact O-N 3.12Å; M387-R390 PolarHBondContact O-N 3.48Å; M387-K391 PolarHBondContact O-N 3.24Å
388	C	54.4	Low	53.5	Low	72 Å²	72	118.4 Å²	118.4	49%	0.486	60%	0.596	S	S	.	*	H	α-helix	trans	-62.9	-44.9	173.1	-82.8	0	0	0	0	111.5	I384 R390 K391 V392	I384-C388 PolarHBondContact O-N 2.65Å; C388-R390 VanDerWaalsContact C-N 3.26Å; C388-R390 PolarHBondContact O-N 2.86Å; C388-K391 PolarHBondContact O-N 3.48Å; C388-V392 WeakPolarHBondContact O-CG2 3.3Å; C388-V392 PolarHBondContact O-N 2.91Å
389	N	54.5	Low	52.7	Low	103 Å²	103	121.3 Å²	121.3	55%	0.551	61%	0.609	S	S	*	*	H	α-helix	trans	-64.8	-29.7	176.1	-74.5	-0.7	0	0	0	112.8	Q385 N393	Q385-N389 WeakPolarHBondContact O-CB 3.49Å; Q385-N389 PolarHBondContact O-N 3.47Å; N389-N393 PolarHBondContact O-N 3.42Å
390	R	53.8	Low	52.3	Low	198 Å²	198	125.6 Å²	125.6	75%	0.747	63%	0.629	S	S	*	*	H	α-helix	trans	-71.4	-37.7	174.1	-123.2	175	174.3	169.7	-3	112.7	K386 M387 C388 M394	K386-R390 WeakPolarHBondContact O-CB 3.49Å; K386-R390 PolarHBondContact O-N 2.93Å; K386-R390 VanDerWaalsContact O-N 3.08Å; M387-R390 PolarHBondContact O-N 3.48Å; C388-R390 VanDerWaalsContact C-N 3.26Å; C388-R390 PolarHBondContact O-N 2.86Å; R390-M394 WeakPolarHBondContact O-CG 3.32Å; R390-M394 PolarHBondContact O-N 3.32Å
391	K	51.6	Low	51.2	Low	158 Å²	158	133.5 Å²	133.5	69%	0.687	66%	0.663	S	S	*	*	H	α-helix	trans	-69.3	-39.6	175.4	-81.2	-175.5	174.1	-177.8	0	112.4	M387 C388 N393 M394 S395	M387-K391 PolarHBondContact O-N 3.24Å; C388-K391 PolarHBondContact O-N 3.48Å; K391-N393 VanDerWaalsContact C-N 3.34Å; K391-N393 PolarHBondContact O-N 2.93Å; K391-M394 PolarHBondContact O-N 3.33Å; K391-S395 PolarHBondContact O-N 3.04Å; K391-S395 VanDerWaalsContact O-N 3.14Å
392	V	51.8	Low	50.9	Low	90 Å²	90	134.8 Å²	134.8	55%	0.545	67%	0.668	S	S	.	*	H	α-helix	trans	-63.4	-39	175.9	176.1	0	0	0	0	111.5	C388 M394 S395 V396	C388-V392 WeakPolarHBondContact O-CG2 3.3Å; C388-V392 PolarHBondContact O-N 2.91Å; V392-M394 VanDerWaalsContact C-N 3.29Å; V392-M394 PolarHBondContact O-N 2.66Å; V392-S395 PolarHBondContact O-N 3.24Å; V392-V396 WeakPolarHBondContact O-CG2 3.49Å; V392-V396 PolarHBondContact O-N 3.29Å
393	N	49.9	Very low	50.6	Low	120 Å²	120	134.3 Å²	134.3	64%	0.642	67%	0.67	S	S	*	*	H	α-helix	trans	-73.3	-15	176.1	-85	-6.5	0	0	0	114.9	N389 K391	N389-N393 PolarHBondContact O-N 3.42Å; K391-N393 VanDerWaalsContact C-N 3.34Å; K391-N393 PolarHBondContact O-N 2.93Å
394	M	50.3	Low	50.3	Low	137 Å²	137	137.1 Å²	137.1	68%	0.675	68%	0.678	S	S	*	*	H	α-helix	trans	-87.1	-36	173.3	-75.3	-178.7	60.5	0	0	111.8	R390 K391 V392 V396 K397	R390-M394 WeakPolarHBondContact O-CG 3.32Å; R390-M394 PolarHBondContact O-N 3.32Å; K391-M394 PolarHBondContact O-N 3.33Å; V392-M394 VanDerWaalsContact C-N 3.29Å; V392-M394 PolarHBondContact O-N 2.66Å; M394-V396 PolarHBondContact O-N 3.5Å; M394-K397 PolarHBondContact O-N 2.92Å
395	S	45.6	Very low	49.8	Very low	82 Å²	82	140.6 Å²	140.6	57%	0.573	70%	0.695	S	S	*	*	H	α-helix	trans	-73.5	-21.8	177.4	-62.6	0	0	0	0	114.2	K391 V392 K397	K391-S395 PolarHBondContact O-N 3.04Å; K391-S395 VanDerWaalsContact O-N 3.14Å; V392-S395 PolarHBondContact O-N 3.24Å; S395-K397 VanDerWaalsContact C-N 3.29Å; S395-K397 PolarHBondContact O-N 2.92Å
396	V	48.3	Very low	49.5	Very low	98 Å²	98	141.4 Å²	141.4	59%	0.594	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-11.6	175.7	178.1	0	0	0	0	112.5	V392 M394	V392-V396 WeakPolarHBondContact O-CG2 3.49Å; V392-V396 PolarHBondContact O-N 3.29Å; M394-V396 PolarHBondContact O-N 3.5Å
397	K	46.4	Very low	49	Very low	178 Å²	178	139.7 Å²	139.7	77%	0.774	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-6.9	178.3	-85.1	-171.6	172.3	-170.7	0	115	M394 S395	M394-K397 PolarHBondContact O-N 2.92Å; S395-K397 VanDerWaalsContact C-N 3.29Å; S395-K397 PolarHBondContact O-N 2.92Å
398	E	45.6	Very low	48.6	Very low	176 Å²	176	141.7 Å²	141.7	82%	0.822	71%	0.71	S	S	*	*	S	Bend	trans	-101.1	0.7	178.2	-77.8	-178.3	161.1	0	0	113.9
399	E	42.8	Very low	48.1	Very low	179 Å²	179	147.1 Å²	147.1	84%	0.836	73%	0.727	S	S	*	*	S	Bend	trans	-107	9.7	174.2	-78.6	-170.7	160	0	0	114
400	V	48.6	Very low	47.6	Very low	125 Å²	125	150.8 Å²	150.8	76%	0.758	74%	0.742	S	S	*	*			trans	-133.6	69.9	173.3	-168.7	0	0	0	0	109.3
401	E	36.5	Very low	47	Very low	268 Å²	268	146.5 Å²	146.5	100%	1.252	74%	0.742	S	S	*	*			trans	-152.1	0	153.7	-128.7	175.1	-168.4	0	0	111.1

Retrieved 401 of 401 residues in 536 ms (Link to these results)

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