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Isoform 2 of Ran-binding protein 9 AlphaSync

Canonical isoform description: May act as scaffolding protein, and as adapter protein to couple membrane receptors to intracellular signaling pathways. Acts as a mediator of cell spreading and actin cytoskeleton rearrangement. Core component of the CTLH E3 ubiquitin-protein ligase complex that selectively accepts ubiquitin from UBE2H and mediates ubiquitination and subsequent proteasomal degradation of the transcription factor HBP1. May be involved in signaling of ITGB2/LFA-1 and other integrins. Enhances HGF-MET signaling by recruiting Sos and activating the Ras pathway. Enhances dihydrotestosterone-induced transactivation activity of AR, as well as dexamethasone-induced transactivation activity of NR3C1, but not affect estrogen-induced transactivation. Stabilizes TP73 isoform Alpha, probably by inhibiting its ubiquitination, and increases its proapoptotic activity. Inhibits the kinase activity of DYRK1A and DYRK1B. Inhibits FMR1 binding to RNA.

AlphaFold DB , UniProt , Accession P69566-2 (canonical: P69566), Species MOUSE (Mus musculus, Mouse), Gene Ranbp9, Length 546 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	33.7	Very low	56.2	Low	168 Å²	168	94.5 Å²	94.5	83%	0.828	47%	0.466	S	S	*	.				0	109.3	0	-164.2	177.8	-83.5	0	0	105.7
2	W	40.7	Very low	58.1	Low	103 Å²	103	100.3 Å²	100.3	39%	0.39	49%	0.487	S	S	.	.			trans	-109.3	114.4	170.3	-67.1	105.2	0	0	0	104.6	V20 R21	W2-V20 HydrophobicContact CD2-CG2 4.19Å; W2-V20 HydrophobicContact CE3-CG2 4.21Å; W2-V20 HydrophobicContact CH2-CG2 3.29Å; W2-V20 HydrophobicContact CZ2-CG2 3.21Å; W2-V20 HydrophobicContact CZ3-CG2 3.79Å; W2-R21 PolarHBondContact NE1-O 3.32Å
3	E	49.3	Very low	60.3	Low	156 Å²	156	97.2 Å²	97.2	73%	0.729	48%	0.477	S	S	*	.			trans	-85	-35.9	178.1	-79.7	-179.9	157.4	0	0	111.4
4	S	49.8	Very low	62	Low	43 Å²	43	96.1 Å²	96.1	30%	0.301	48%	0.481	S	S	.	.			trans	-158.9	149.1	173.1	-53.4	0	0	0	0	111.9	W6 D144	S4-W6 VanDerWaalsContact CB-CE2 3.41Å; S4-W6 WeakPolarHBondContact OG-CZ2 3.43Å; S4-D144 WeakPolarHBondContact CB-OD1 3.11Å; S4-D144 PolarHBondContact OG-OD1 3.2Å
5	S	60.9	Low	63.7	Low	22 Å²	22	101.9 Å²	101.9	15%	0.154	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.1	171.7	-64.5	0	0	0	0	111.3	V143	S5-V143 PolarHBondContact N-O 2.68Å
6	W	54.1	Low	65.4	Low	166 Å²	166	99.1 Å²	99.1	63%	0.629	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	143.7	-175.4	-32.6	82.7	0	0	0	110.2	S4 V142	S4-W6 VanDerWaalsContact CB-CE2 3.41Å; S4-W6 WeakPolarHBondContact OG-CZ2 3.43Å; W6-V142 HydrophobicContact CD2-CG1 4.16Å; W6-V142 HydrophobicContact CD2-CG2 4.4Å; W6-V142 HydrophobicContact CE3-CB 3.9Å; W6-V142 HydrophobicContact CE3-CG1 3.45Å; W6-V142 VanDerWaalsContact CE3-CG1 3.45Å; W6-V142 HydrophobicContact CE3-CG2 3.26Å; W6-V142 HydrophobicContact CH2-CG1 3.43Å; W6-V142 VanDerWaalsContact CH2-CG1 3.43Å; W6-V142 HydrophobicContact CZ2-CG1 4.2Å; W6-V142 HydrophobicContact CZ3-CB 3.78Å; W6-V142 HydrophobicContact CZ3-CG1 3.04Å; W6-V142 HydrophobicContact CZ3-CG2 3.34Å
7	V	60.4	Low	67.1	Low	23 Å²	23	93.4 Å²	93.4	14%	0.139	46%	0.462	C	S	.	.			trans	-89.9	126.9	173.1	177.8	0	0	0	0	110.7	L136	V7-L136 HydrophobicContact CG2-CB 3.13Å; V7-L136 HydrophobicContact CG2-CD1 3.99Å; V7-L136 HydrophobicContact CG2-CG 4.2Å
8	L	57.9	Low	68.7	Low	183 Å²	183	91.1 Å²	91.1	96%	0.958	46%	0.46	S	S	*	.			trans	-98.1	-2.3	172.5	-72.1	166	0	0	0	113.5
9	G	61.1	Low	70.1	Confident	32 Å²	32	87.3 Å²	87.3	33%	0.33	44%	0.443	S	S	.	.	S	Bend	trans	-88.3	165.6	-174.6	0	0	0	0	0	115	G11 P139	G9-G11 VanDerWaalsContact C-N 3.28Å; G9-G11 PolarHBondContact O-N 2.93Å; G9-P139 WeakPolarHBondContact O-CG 3.38Å
10	H	73.5	Confident	71.5	Confident	142 Å²	142	84.7 Å²	84.7	66%	0.657	43%	0.432	S	S	*	.			trans	-69.3	-23.1	180	-65.4	89.4	0	0	0	113.8	K12	H10-K12 HydrophobicContact CB-CG 4.23Å; H10-K12 PolarHBondContact O-N 3.42Å
11	G	77.1	Confident	72.8	Confident	1 Å²	1	83.3 Å²	83.3	1%	0.01	42%	0.421	C	S	.	.			trans	56.9	39.7	177.5	0	0	0	0	0	114.5	G9 R44 Q137	G9-G11 VanDerWaalsContact C-N 3.28Å; G9-G11 PolarHBondContact O-N 2.93Å; G11-R44 PolarHBondContact O-NH2 3.11Å; G11-Q137 WeakPolarHBondContact CA-O 3.48Å
12	K	78.2	Confident	75.8	Confident	165 Å²	165	76.1 Å²	76.1	72%	0.717	39%	0.388	S	S	*	.			trans	-88.5	-28.5	-176.8	-70.9	-176.1	179.4	179.5	0	112.7	H10 D16	H10-K12 HydrophobicContact CB-CG 4.23Å; H10-K12 PolarHBondContact O-N 3.42Å; K12-D16 PolarHBondContact N-OD2 3.46Å
13	T	87.3	Confident	78.5	Confident	59 Å²	59	75.5 Å²	75.5	36%	0.362	40%	0.396	S	S	.	.	S	Bend	trans	-135.9	161.2	-176.3	71	0	0	0	0	110.9	K15 D16 Q137	T13-K15 PolarHBondContact O-N 3.33Å; T13-K15 PolarHBondContact OG1-N 3.11Å; T13-D16 PolarHBondContact N-OD2 3.21Å; T13-D16 WeakPolarHBondContact O-CB 3.32Å; T13-D16 PolarHBondContact O-N 2.97Å; T13-D16 PolarHBondContact OG1-OD2 3.17Å; T13-Q137 VanDerWaalsContact C-NE2 3.33Å; T13-Q137 PolarHBondContact O-NE2 3.17Å; T13-Q137 VanDerWaalsContact O-NE2 3.14Å
14	P	84.1	Confident	80.8	Confident	82 Å²	82	74.5 Å²	74.5	53%	0.532	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-56.4	-16.6	172.4	-27.4	36.2	0	0	0	114.7	D16 W65	P14-D16 PolarHBondContact O-N 3.3Å; P14-W65 HydrophobicContact CB-CH2 3.98Å; P14-W65 HydrophobicContact CB-CZ3 4.12Å
15	K	87.5	Confident	83.1	Confident	184 Å²	184	74.3 Å²	74.3	80%	0.8	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-74.7	-12.6	175.1	-60.7	-178.2	177.8	178.9	0	113.2	T13 A17	T13-K15 PolarHBondContact O-N 3.33Å; T13-K15 PolarHBondContact OG1-N 3.11Å; K15-A17 VanDerWaalsContact C-N 3.31Å
16	D	90.1	Very high	84.8	Confident	57 Å²	57	73.6 Å²	73.6	31%	0.305	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-89.9	2.4	178.4	-58.1	-46.5	0	0	0	112.4	K12 T13 P14	K12-D16 PolarHBondContact N-OD2 3.46Å; T13-D16 PolarHBondContact N-OD2 3.21Å; T13-D16 WeakPolarHBondContact O-CB 3.32Å; T13-D16 PolarHBondContact O-N 2.97Å; T13-D16 PolarHBondContact OG1-OD2 3.17Å; P14-D16 PolarHBondContact O-N 3.3Å
17	A	94.2	Very high	86.7	Confident	2 Å²	2	69.2 Å²	69.2	2%	0.017	38%	0.376	C	S	.	.			trans	-66.1	141.6	176.1	0	0	0	0	0	111.3	K15 N60 L62 W65 Q137	K15-A17 VanDerWaalsContact C-N 3.31Å; A17-N60 CarbonylContact O-C 3.58Å; A17-N60 VanDerWaalsContact O-CA 3.23Å; A17-N60 WeakPolarHBondContact O-CA 3.46Å; A17-L62 HydrophobicContact CB-CD2 4.14Å; A17-L62 HydrophobicContact CB-CG 3.97Å; A17-W65 HydrophobicContact CB-CZ3 4.26Å; A17-Q137 HydrophobicContact CB-CB 4.13Å; A17-Q137 HydrophobicContact CB-CG 4.16Å
18	A	95.8	Very high	88	Confident	51 Å²	51	69.4 Å²	69.4	42%	0.421	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	131.2	177.1	0	0	0	0	0	110.3	M59 G135 L136	A18-M59 CarbonylContact C-O 3.47Å; A18-M59 WeakPolarHBondContact CA-O 3.36Å; A18-G135 CarbonylContact O-C 3.58Å; A18-G135 VanDerWaalsContact O-CA 3.29Å; A18-G135 WeakPolarHBondContact O-CA 3.41Å; A18-L136 PolarHBondContact N-O 3.2Å; A18-L136 PolarHBondContact O-N 3.27Å; A18-L136 VanDerWaalsContact O-O 3.11Å
19	S	96.9	Very high	89.5	Confident	20 Å²	20	63.1 Å²	63.1	14%	0.14	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	157.1	177.9	-74.4	0	0	0	0	112.4	M59 R61 P63 V134 G135	S19-M59 PolarHBondContact N-O 3.09Å; S19-M59 VanDerWaalsContact O-CE 3.25Å; S19-M59 WeakPolarHBondContact O-CE 3.33Å; S19-R61 WeakPolarHBondContact CB-O 3.36Å; S19-R61 PolarHBondContact OG-O 3.16Å; S19-P63 WeakPolarHBondContact OG-CD 3.5Å; S19-V134 CarbonylContact C-O 3.6Å; S19-V134 VanDerWaalsContact CA-O 3.24Å; S19-V134 WeakPolarHBondContact CA-O 3.31Å; S19-G135 VanDerWaalsContact OG-CA 3.25Å; S19-G135 WeakPolarHBondContact OG-CA 3.38Å
20	V	97.7	Very high	91	Very high	35 Å²	35	63.7 Å²	63.7	21%	0.212	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.2	174.7	66.1	0	0	0	0	110	W2 M59 T133 V134	W2-V20 HydrophobicContact CD2-CG2 4.19Å; W2-V20 HydrophobicContact CE3-CG2 4.21Å; W2-V20 HydrophobicContact CH2-CG2 3.29Å; W2-V20 HydrophobicContact CZ2-CG2 3.21Å; W2-V20 HydrophobicContact CZ3-CG2 3.79Å; V20-M59 VanDerWaalsContact C-CE 3.43Å; V20-T133 VanDerWaalsContact O-CA 3.28Å; V20-T133 WeakPolarHBondContact O-CA 3.48Å; V20-T133 VanDerWaalsContact O-CG2 3.28Å; V20-T133 WeakPolarHBondContact O-CG2 3.31Å; V20-V134 HydrophobicContact CG1-CB 4.42Å; V20-V134 PolarHBondContact N-O 3.46Å; V20-V134 PolarHBondContact O-N 2.91Å
21	R	98	Very high	92	Very high	56 Å²	56	56.9 Å²	56.9	21%	0.211	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	150.9	175	-84.9	-177	-69	-94.9	-5.4	109.8	W2 S53 A54 V57 M59 Y131 P132 T133	W2-R21 PolarHBondContact NE1-O 3.32Å; R21-S53 WeakPolarHBondContact CD-OG 3.47Å; R21-S53 WeakPolarHBondContact CG-OG 3.46Å; R21-A54 PolarHBondContact NH1-O 3.33Å; R21-V57 PolarHBondContact NH1-O 3.12Å; R21-M59 HydrophobicContact CB-CE 3.98Å; R21-M59 HydrophobicContact CG-CE 3.74Å; R21-M59 HydrophobicContact CG-SD 4.32Å; R21-M59 PolarHBondContact NH1-SD 2.88Å; R21-Y131 HydrophobicContact CB-CD1 4.37Å; R21-Y131 HydrophobicContact CB-CG 4.45Å; R21-Y131 HydrophobicContact CG-CG 4.35Å; R21-P132 CarbonylContact C-O 3.55Å; R21-P132 WeakPolarHBondContact CA-O 3.42Å; R21-T133 HydrophobicContact CG-CG2 4.2Å; R21-T133 WeakPolarHBondContact CG-OG1 3.38Å
22	A	97.9	Very high	93	Very high	16 Å²	16	57.2 Å²	57.2	13%	0.132	32%	0.323	C	S	.	.			trans	-58.8	166	165.3	0	0	0	0	0	111.6	H24 Y131 P132 F147	A22-H24 VanDerWaalsContact C-N 3.3Å; A22-H24 PolarHBondContact O-N 3.07Å; A22-Y131 WeakPolarHBondContact O-CD1 3.47Å; A22-P132 HydrophobicContact CB-CB 4.02Å; A22-P132 HydrophobicContact CB-CG 4.15Å; A22-P132 PolarHBondContact N-O 3.4Å; A22-F147 HydrophobicContact CB-CZ 4.3Å
23	T	97.5	Very high	94	Very high	90 Å²	90	51.8 Å²	51.8	55%	0.552	30%	0.298	S	S	*	.	S	Bend	trans	-70.8	-25.9	-176.3	50.7	0	0	0	0	113.5
24	H	97.7	Very high	94.5	Very high	136 Å²	136	49.6 Å²	49.6	63%	0.63	28%	0.283	S	S	*	.	S	Bend	trans	-137	152.8	-177.4	-61.8	91.5	0	0	0	110.5	A22 Y131	A22-H24 VanDerWaalsContact C-N 3.3Å; A22-H24 PolarHBondContact O-N 3.07Å; H24-Y131 WeakPolarHBondContact O-CD1 3.4Å
25	P	97.2	Very high	95.2	Very high	39 Å²	39	45.7 Å²	45.7	25%	0.253	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-71.5	162.4	170.7	31.1	-30.3	0	0	0	109.9	P27 N129 L130 Y131	P25-P27 WeakPolarHBondContact O-CD 3.39Å; P25-N129 HydrophobicContact CB-CB 4.37Å; P25-L130 CarbonylContact C-O 3.36Å; P25-L130 WeakPolarHBondContact CA-O 3.36Å; P25-Y131 HydrophobicContact CB-CD1 4.49Å; P25-Y131 HydrophobicContact CB-CD2 3.98Å; P25-Y131 HydrophobicContact CB-CE1 4.24Å; P25-Y131 HydrophobicContact CB-CE2 3.66Å; P25-Y131 HydrophobicContact CB-CG 4.38Å; P25-Y131 VanDerWaalsContact CD-CZ 3.49Å; P25-Y131 WeakPolarHBondContact CD-OH 3.45Å; P25-Y131 HydrophobicContact CG-CE1 4.43Å; P25-Y131 HydrophobicContact CG-CE2 4.2Å
26	I	96.8	Very high	95.7	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.036	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-64.4	121.6	174.6	-60.7	172.9	0	0	0	109	A28 Y33 L52 V103 L105 L130 P132	I26-A28 PolarHBondContact O-N 3.37Å; I26-Y33 HydrophobicContact CB-CG 4.38Å; I26-Y33 HydrophobicContact CD1-CD1 3.55Å; I26-Y33 HydrophobicContact CD1-CE1 4.07Å; I26-Y33 HydrophobicContact CD1-CG 4.13Å; I26-Y33 HydrophobicContact CG1-CD1 3.67Å; I26-Y33 HydrophobicContact CG1-CE1 3.9Å; I26-Y33 HydrophobicContact CG1-CG 4.01Å; I26-Y33 VanDerWaalsContact CG2-CB 3.43Å; I26-Y33 HydrophobicContact CG2-CD1 4.09Å; I26-Y33 HydrophobicContact CG2-CD2 3.91Å; I26-Y33 HydrophobicContact CG2-CG 3.54Å; I26-L52 HydrophobicContact CD1-CD2 3.77Å; I26-V103 HydrophobicContact CD1-CB 4.1Å; I26-V103 HydrophobicContact CD1-CG1 4.36Å; I26-V103 HydrophobicContact CD1-CG2 3.66Å; I26-L105 HydrophobicContact CG2-CD1 3.91Å; I26-L130 PolarHBondContact N-O 2.87Å; I26-P132 HydrophobicContact CD1-CG 4.44Å; I26-P132 HydrophobicContact CG1-CG 4.21Å
27	P	93.5	Very high	96.1	Very high	73 Å²	73	34.6 Å²	34.6	47%	0.474	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-65.4	129.5	176.6	-19.4	32	0	0	0	110.9	P25 A29 C30 L105	P25-P27 WeakPolarHBondContact O-CD 3.39Å; P27-A29 PolarHBondContact O-N 3.4Å; P27-A29 VanDerWaalsContact O-N 3.13Å; P27-C30 WeakPolarHBondContact O-CB 3.32Å; P27-C30 PolarHBondContact O-N 3.29Å; P27-C30 VanDerWaalsContact O-N 3.09Å; P27-C30 PolarHBondContact O-SG 2.81Å; P27-L105 WeakPolarHBondContact O-CD1 3.31Å
28	A	87.9	Confident	96.4	Very high	28 Å²	28	39.8 Å²	39.8	23%	0.231	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-62.5	-25.1	-178.9	0	0	0	0	0	113.3	I26 C30	I26-A28 PolarHBondContact O-N 3.37Å; A28-C30 PolarHBondContact O-N 3.47Å
29	A	88.8	Confident	96.5	Very high	51 Å²	51	37.4 Å²	37.4	42%	0.421	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-72.2	-5.3	177.8	0	0	0	0	0	114.4	P27 G31 A529 A537	P27-A29 PolarHBondContact O-N 3.4Å; P27-A29 VanDerWaalsContact O-N 3.13Å; A29-G31 VanDerWaalsContact C-N 3.3Å; A29-A529 HydrophobicContact CB-CB 4.03Å; A29-A537 VanDerWaalsContact O-CB 3.25Å; A29-A537 WeakPolarHBondContact O-CB 3.25Å
30	C	92.8	Very high	96.5	Very high	43 Å²	43	39.3 Å²	39.3	29%	0.291	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-70.9	-27.5	176.6	-69.1	0	0	0	0	112.4	P27 A28 I32 L105 A537	P27-C30 WeakPolarHBondContact O-CB 3.32Å; P27-C30 PolarHBondContact O-N 3.29Å; P27-C30 VanDerWaalsContact O-N 3.09Å; P27-C30 PolarHBondContact O-SG 2.81Å; A28-C30 PolarHBondContact O-N 3.47Å; C30-I32 PolarHBondContact O-N 2.82Å; C30-L105 HydrophobicContact CB-CD1 4.39Å; C30-A537 WeakPolarHBondContact O-CB 3.41Å
31	G	95.4	Very high	96.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	69.4	-56.6	-171.5	0	0	0	0	0	112.5	A29 L105 G534	A29-G31 VanDerWaalsContact C-N 3.3Å; G31-L105 WeakPolarHBondContact O-CA 3.29Å; G31-L105 WeakPolarHBondContact O-CB 3.31Å; G31-L105 PolarHBondContact O-N 3.39Å; G31-G534 VanDerWaalsContact CA-O 3.25Å; G31-G534 WeakPolarHBondContact CA-O 3.49Å
32	I	97.6	Very high	96.5	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.041	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.1	170.6	-64.9	167.7	0	0	0	108.3	C30 V103 I156 Y159 M160 W163 F538	C30-I32 PolarHBondContact O-N 2.82Å; I32-V103 WeakPolarHBondContact CA-O 3.44Å; I32-I156 HydrophobicContact CG2-CD1 3.92Å; I32-Y159 HydrophobicContact CD1-CD1 3.83Å; I32-Y159 HydrophobicContact CD1-CE1 3.58Å; I32-Y159 HydrophobicContact CG1-CE1 4.14Å; I32-Y159 HydrophobicContact CG2-CD1 4.04Å; I32-Y159 HydrophobicContact CG2-CE1 3.93Å; I32-M160 HydrophobicContact CB-CG 4.15Å; I32-M160 HydrophobicContact CD1-CG 4.05Å; I32-M160 HydrophobicContact CG2-CG 4.18Å; I32-W163 HydrophobicContact CD1-CB 3.78Å; I32-W163 VanDerWaalsContact CD1-CD1 3.49Å; I32-W163 HydrophobicContact CD1-CG 3.68Å; I32-F538 HydrophobicContact CB-CZ 4.34Å; I32-F538 HydrophobicContact CD1-CE2 4.2Å; I32-F538 HydrophobicContact CD1-CZ 3.7Å; I32-F538 HydrophobicContact CG1-CE2 4.17Å; I32-F538 HydrophobicContact CG1-CZ 3.97Å
33	Y	98.1	Very high	96.3	Very high	50 Å²	50	41.2 Å²	41.2	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.5	174.8	-177.6	-92.5	0	0	0	110.1	I26 F35 C102 V103 P132 F147	I26-Y33 HydrophobicContact CB-CG 4.38Å; I26-Y33 HydrophobicContact CD1-CD1 3.55Å; I26-Y33 HydrophobicContact CD1-CE1 4.07Å; I26-Y33 HydrophobicContact CD1-CG 4.13Å; I26-Y33 HydrophobicContact CG1-CD1 3.67Å; I26-Y33 HydrophobicContact CG1-CE1 3.9Å; I26-Y33 HydrophobicContact CG1-CG 4.01Å; I26-Y33 VanDerWaalsContact CG2-CB 3.43Å; I26-Y33 HydrophobicContact CG2-CD1 4.09Å; I26-Y33 HydrophobicContact CG2-CD2 3.91Å; I26-Y33 HydrophobicContact CG2-CG 3.54Å; Y33-F35 HydrophobicContact CD1-CD1 4.25Å; Y33-F35 HydrophobicContact CE1-CB 4.21Å; Y33-F35 AromaticContact CE1-CD1 3.76Å; Y33-F35 HydrophobicContact CE1-CD1 3.76Å; Y33-F35 HydrophobicContact CE1-CG 4.4Å; Y33-C102 CarbonylContact O-C 3.55Å; Y33-C102 WeakPolarHBondContact O-CA 3.46Å; Y33-V103 PolarHBondContact N-O 2.96Å; Y33-V103 PolarHBondContact O-N 2.72Å; Y33-P132 HydrophobicContact CE1-CG 3.84Å; Y33-F147 WeakPolarHBondContact OH-CD1 3.39Å
34	Y	98.7	Very high	96.2	Very high	13 Å²	13	42.5 Å²	42.5	5%	0.051	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	138.9	-178.3	-171	-111.3	0	0	0	111.1	E36 G100 C102 T113 F152 F154 I156	Y34-E36 HydrophobicContact CD1-CG 4.48Å; Y34-E36 HydrophobicContact CE1-CG 3.52Å; Y34-E36 WeakPolarHBondContact CE1-OE1 3.33Å; Y34-E36 WeakPolarHBondContact OH-CG 3.37Å; Y34-E36 PolarHBondContact OH-OE1 2.96Å; Y34-G100 WeakPolarHBondContact OH-CA 3.42Å; Y34-C102 HydrophobicContact CD2-CB 3.6Å; Y34-C102 HydrophobicContact CE2-CB 4.09Å; Y34-T113 HydrophobicContact CE2-CG2 4.01Å; Y34-T113 PolarHBondContact OH-OG1 2.96Å; Y34-F152 HydrophobicContact CD1-CB 4.24Å; Y34-F152 AromaticContact CD1-CD1 3.76Å; Y34-F152 HydrophobicContact CD1-CD1 3.76Å; Y34-F152 AromaticContact CD1-CD2 3.78Å; Y34-F152 HydrophobicContact CD1-CD2 3.78Å; Y34-F152 AromaticContact CD1-CE1 3.97Å; Y34-F152 HydrophobicContact CD1-CE1 3.97Å; Y34-F152 AromaticContact CD1-CE2 3.98Å; Y34-F152 HydrophobicContact CD1-CE2 3.98Å; Y34-F152 AromaticContact CD1-CG 3.65Å; Y34-F152 HydrophobicContact CD1-CG 3.65Å; Y34-F152 HydrophobicContact CD1-CZ 4.07Å; Y34-F152 HydrophobicContact CE1-CB 3.85Å; Y34-F152 AromaticContact CE1-CD1 3.72Å; Y34-F152 HydrophobicContact CE1-CD1 3.72Å; Y34-F152 HydrophobicContact CE1-CD2 4.25Å; Y34-F152 HydrophobicContact CE1-CE1 4.31Å; Y34-F152 AromaticContact CE1-CG 3.67Å; Y34-F152 HydrophobicContact CE1-CG 3.67Å; Y34-F154 HydrophobicContact CE1-CB 4.04Å; Y34-F154 HydrophobicContact CE1-CD1 4.37Å; Y34-F154 HydrophobicContact CE2-CD1 4.08Å; Y34-F154 AromaticContact CZ-CD1 3.95Å; Y34-F154 WeakPolarHBondContact OH-CB 3.4Å; Y34-I156 HydrophobicContact CD1-CB 4.09Å; Y34-I156 HydrophobicContact CD1-CD1 4.48Å; Y34-I156 HydrophobicContact CD1-CG1 4.24Å; Y34-I156 HydrophobicContact CD1-CG2 4.47Å; Y34-I156 HydrophobicContact CD2-CD1 4.17Å; Y34-I156 HydrophobicContact CG-CB 4.33Å; Y34-I156 HydrophobicContact CG-CD1 3.87Å; Y34-I156 HydrophobicContact CG-CG1 4.01Å
35	F	98.8	Very high	96.1	Very high	1 Å²	1	39 Å²	39	0%	0.004	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153.5	170.4	71.6	-83.9	0	0	0	109.6	Y33 V37 I50 L52 G100 C101 P132 N146 F147	Y33-F35 HydrophobicContact CD1-CD1 4.25Å; Y33-F35 HydrophobicContact CE1-CB 4.21Å; Y33-F35 AromaticContact CE1-CD1 3.76Å; Y33-F35 HydrophobicContact CE1-CD1 3.76Å; Y33-F35 HydrophobicContact CE1-CG 4.4Å; F35-V37 HydrophobicContact CD2-CG2 4.07Å; F35-V37 HydrophobicContact CE2-CG2 3.93Å; F35-I50 HydrophobicContact CE2-CG2 4.08Å; F35-I50 HydrophobicContact CZ-CG2 4.38Å; F35-L52 HydrophobicContact CE1-CD2 4.26Å; F35-G100 CarbonylContact O-C 3.43Å; F35-G100 VanDerWaalsContact O-CA 3.3Å; F35-G100 WeakPolarHBondContact O-CA 3.36Å; F35-C101 HydrophobicContact CD1-CB 3.97Å; F35-C101 HydrophobicContact CE1-CB 3.36Å; F35-C101 VanDerWaalsContact CE1-SG 3.54Å; F35-C101 HydrophobicContact CE2-CB 4.09Å; F35-C101 HydrophobicContact CZ-CB 3.43Å; F35-C101 VanDerWaalsContact CZ-CB 3.43Å; F35-C101 PolarHBondContact N-O 3.44Å; F35-C101 PolarHBondContact O-N 3.23Å; F35-P132 HydrophobicContact CD1-CB 4.06Å; F35-P132 HydrophobicContact CD1-CG 4.11Å; F35-P132 HydrophobicContact CD2-CB 4.41Å; F35-P132 HydrophobicContact CE1-CB 3.72Å; F35-P132 HydrophobicContact CE1-CG 4.04Å; F35-P132 HydrophobicContact CE2-CB 4.14Å; F35-P132 HydrophobicContact CG-CB 4.37Å; F35-P132 HydrophobicContact CZ-CB 3.78Å; F35-N146 WeakPolarHBondContact CA-O 3.47Å; F35-F147 HydrophobicContact CB-CD1 3.69Å; F35-F147 HydrophobicContact CB-CE1 3.93Å; F35-F147 HydrophobicContact CD2-CE1 4.08Å; F35-F147 HydrophobicContact CG-CD1 4.32Å; F35-F147 HydrophobicContact CG-CE1 4.05Å
36	E	98.9	Very high	96	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.028	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	151	177.6	-75.6	178.6	168.8	0	0	111.2	Y34 V98 I99 N146 F152 V153 F154	Y34-E36 HydrophobicContact CD1-CG 4.48Å; Y34-E36 HydrophobicContact CE1-CG 3.52Å; Y34-E36 WeakPolarHBondContact CE1-OE1 3.33Å; Y34-E36 WeakPolarHBondContact OH-CG 3.37Å; Y34-E36 PolarHBondContact OH-OE1 2.96Å; E36-V98 HydrophobicContact CB-CG1 3.89Å; E36-V98 HydrophobicContact CG-CG1 4.07Å; E36-I99 CarbonylContact C-O 3.02Å; E36-I99 WeakPolarHBondContact CA-O 3.48Å; E36-N146 HydrophobicContact CB-CB 4.24Å; E36-N146 PolarHBondContact N-O 3.04Å; E36-N146 PolarHBondContact O-N 3.3Å; E36-F152 HydrophobicContact CB-CD1 4.17Å; E36-F152 HydrophobicContact CB-CE1 4.47Å; E36-F152 HydrophobicContact CG-CD1 3.8Å; E36-F152 HydrophobicContact CG-CE1 4.41Å; E36-F152 WeakPolarHBondContact OE2-CA 3.28Å; E36-V153 PolarHBondContact OE1-N 3.38Å; E36-V153 PolarHBondContact OE2-N 3.45Å; E36-F154 PolarHBondContact OE1-N 2.95Å; E36-F154 VanDerWaalsContact OE1-N 3.11Å
37	V	98.7	Very high	96	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	118.7	175	179.4	0	0	0	0	107.8	F35 I39 I50 I99 V134 V143 D144	F35-V37 HydrophobicContact CD2-CG2 4.07Å; F35-V37 HydrophobicContact CE2-CG2 3.93Å; V37-I39 HydrophobicContact CG1-CD1 4.41Å; V37-I50 HydrophobicContact CB-CD1 3.86Å; V37-I50 HydrophobicContact CB-CG1 4.42Å; V37-I50 HydrophobicContact CG1-CD1 3.92Å; V37-I50 HydrophobicContact CG1-CG1 4.36Å; V37-I50 HydrophobicContact CG2-CD1 4.43Å; V37-I50 HydrophobicContact CG2-CG2 3.98Å; V37-I99 PolarHBondContact N-O 2.76Å; V37-I99 PolarHBondContact O-N 3.44Å; V37-V134 HydrophobicContact CG1-CG2 4.4Å; V37-V134 HydrophobicContact CG2-CG2 3.95Å; V37-V143 HydrophobicContact CG1-CB 3.6Å; V37-V143 HydrophobicContact CG1-CG1 4.14Å; V37-V143 HydrophobicContact CG1-CG2 3.78Å; V37-D144 CarbonylContact C-O 3.53Å; V37-D144 WeakPolarHBondContact CA-O 2.94Å
38	K	98.6	Very high	96.2	Very high	111 Å²	111	37.4 Å²	37.4	48%	0.483	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.4	174.5	-179.2	176.7	-178.7	178.4	0	109.5	V40 V98 V143 D144	K38-V40 PolarHBondContact O-N 3.44Å; K38-V98 HydrophobicContact CB-CG2 4.28Å; K38-V98 HydrophobicContact CG-CG2 4.21Å; K38-V143 VanDerWaalsContact O-CA 3.26Å; K38-V143 WeakPolarHBondContact O-CA 3.38Å; K38-V143 WeakPolarHBondContact O-CB 3.36Å; K38-D144 PolarHBondContact N-O 3.09Å; K38-D144 PolarHBondContact O-N 2.59Å
39	I	98.5	Very high	96.7	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	100.4	175.4	-47	-55	0	0	0	108.9	V37 M48 I50 F93 T94 G96 D97 V143	V37-I39 HydrophobicContact CG1-CD1 4.41Å; I39-M48 HydrophobicContact CD1-CE 4.41Å; I39-M48 HydrophobicContact CD1-SD 4.19Å; I39-M48 HydrophobicContact CG2-CE 3.78Å; I39-M48 HydrophobicContact CG2-SD 3.76Å; I39-I50 HydrophobicContact CD1-CD1 4.16Å; I39-F93 HydrophobicContact CD1-CD2 4.03Å; I39-F93 HydrophobicContact CD1-CE2 4.01Å; I39-F93 HydrophobicContact CG1-CD2 3.99Å; I39-F93 HydrophobicContact CG1-CE2 4.49Å; I39-T94 WeakPolarHBondContact CB-O 3.22Å; I39-G96 PolarHBondContact O-N 2.94Å; I39-D97 PolarHBondContact N-O 2.83Å; I39-V143 HydrophobicContact CD1-CG1 3.64Å
40	V	98.2	Very high	97.2	Very high	61 Å²	61	33.7 Å²	33.7	37%	0.37	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	-39	178.6	178.5	0	0	0	0	110.5	K38 T95 V142 D144	K38-V40 PolarHBondContact O-N 3.44Å; V40-T95 WeakPolarHBondContact O-CG2 3.5Å; V40-V142 HydrophobicContact CB-CB 3.9Å; V40-V142 HydrophobicContact CB-CG1 3.64Å; V40-V142 HydrophobicContact CG1-CB 4.26Å; V40-V142 HydrophobicContact CG1-CG1 3.9Å; V40-V142 HydrophobicContact CG2-CG1 4.14Å; V40-V142 PolarHBondContact N-O 3.29Å; V40-D144 HydrophobicContact CG2-CB 4.12Å; V40-D144 VanDerWaalsContact CG2-CG 3.41Å; V40-D144 WeakPolarHBondContact CG2-OD2 3.34Å
41	S	97.5	Very high	97.5	Very high	41 Å²	41	31.6 Å²	31.6	29%	0.287	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	128.7	175.2	167.9	0	0	0	0	109.5	G43 T95 G140 E141 V142	S41-G43 PolarHBondContact O-N 3.34Å; S41-G43 PolarHBondContact OG-N 2.74Å; S41-G43 VanDerWaalsContact OG-N 3.12Å; S41-T95 WeakPolarHBondContact CA-OG1 3.27Å; S41-G140 WeakPolarHBondContact CB-O 3.37Å; S41-G140 PolarHBondContact OG-O 2.83Å; S41-E141 CarbonylContact O-C 3.58Å; S41-E141 WeakPolarHBondContact O-CA 3.12Å; S41-V142 PolarHBondContact N-O 3.23Å; S41-V142 PolarHBondContact O-N 2.85Å
42	K	96.7	Very high	97.6	Very high	82 Å²	82	31.6 Å²	31.6	36%	0.357	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-5.3	171.9	69	141.4	-178.7	168.4	0	113.9	G46 M48 T94 T95 E141	K42-G46 WeakPolarHBondContact O-CA 3.15Å; K42-G46 PolarHBondContact O-N 3.47Å; K42-M48 HydrophobicContact CB-CE 3.9Å; K42-T94 WeakPolarHBondContact CD-OG1 3.47Å; K42-T94 WeakPolarHBondContact CG-OG1 3.33Å; K42-T95 WeakPolarHBondContact CG-OG1 3.26Å; K42-T95 PolarHBondContact N-OG1 3.11Å; K42-E141 WeakPolarHBondContact O-CG 3.41Å
43	G	95.3	Very high	97.7	Very high	23 Å²	23	31.3 Å²	31.3	24%	0.237	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	-141.5	-174.7	0	0	0	0	0	112.6	S41 P139 G140	S41-G43 PolarHBondContact O-N 3.34Å; S41-G43 PolarHBondContact OG-N 2.74Å; S41-G43 VanDerWaalsContact OG-N 3.12Å; G43-P139 WeakPolarHBondContact CA-O 3Å; G43-G140 WeakPolarHBondContact CA-O 3.37Å; G43-G140 PolarHBondContact N-O 3.19Å
44	R	94.7	Very high	97.7	Very high	118 Å²	118	29.9 Å²	29.9	45%	0.445	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-64.3	-176.8	-166.3	-176.9	71.6	-150.2	-3.1	111.7	G11 P139	G11-R44 PolarHBondContact O-NH2 3.11Å; R44-P139 PolarHBondContact N-O 3.46Å; R44-P139 VanDerWaalsContact N-O 3.08Å
45	D	95.1	Very high	97.7	Very high	62 Å²	62	36.7 Å²	36.7	33%	0.332	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-23	-170.3	-52	-45.3	0	0	0	112.9	Y47 T138	D45-Y47 HydrophobicContact CB-CD1 4.29Å; D45-Y47 HydrophobicContact CB-CD2 4.21Å; D45-Y47 HydrophobicContact CB-CE1 4.11Å; D45-Y47 HydrophobicContact CB-CE2 4.01Å; D45-Y47 HydrophobicContact CB-CG 4.34Å; D45-T138 HydrophobicContact CB-CG2 3.83Å; D45-T138 PolarHBondContact N-OG1 2.63Å; D45-T138 VanDerWaalsContact N-OG1 3.16Å; D45-T138 WeakPolarHBondContact OD2-CG2 3.42Å
46	G	95.7	Very high	97.6	Very high	3 Å²	3	39.9 Å²	39.9	3%	0.031	22%	0.215	C	C	.	.			trans	79.7	33.5	179.3	0	0	0	0	0	114.2	K42 M48 E141	K42-G46 WeakPolarHBondContact O-CA 3.15Å; K42-G46 PolarHBondContact O-N 3.47Å; G46-M48 PolarHBondContact O-N 2.94Å; G46-E141 PolarHBondContact N-OE1 3Å
47	Y	97	Very high	97.5	Very high	82 Å²	82	40.5 Å²	40.5	32%	0.322	22%	0.219	S	C	.	.			trans	-78.6	70.5	175.8	-64.6	-23.1	0	0	0	110.4	D45 D75 Q137 T138 E141	D45-Y47 HydrophobicContact CB-CD1 4.29Å; D45-Y47 HydrophobicContact CB-CD2 4.21Å; D45-Y47 HydrophobicContact CB-CE1 4.11Å; D45-Y47 HydrophobicContact CB-CE2 4.01Å; D45-Y47 HydrophobicContact CB-CG 4.34Å; Y47-D75 HydrophobicContact CD1-CB 3.64Å; Y47-D75 WeakPolarHBondContact CD1-OD2 3.37Å; Y47-D75 HydrophobicContact CE1-CB 3.88Å; Y47-D75 WeakPolarHBondContact CE1-OD2 3.37Å; Y47-Q137 HydrophobicContact CD2-CG 4.36Å; Y47-Q137 PolarHBondContact O-N 3.03Å; Y47-T138 HydrophobicContact CD2-CG2 3.41Å; Y47-T138 VanDerWaalsContact CD2-CG2 3.41Å; Y47-T138 HydrophobicContact CE2-CG2 4.13Å; Y47-T138 HydrophobicContact CG-CG2 3.96Å; Y47-E141 PolarHBondContact N-OE1 3.21Å
48	M	97.9	Very high	97.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.239	C	C	.	.			trans	-112.7	128.1	-176.9	-54.2	171.1	-71.3	0	0	109.3	I39 K42 G46 H73 G74 F93 G135 L136 E141 V143	I39-M48 HydrophobicContact CD1-CE 4.41Å; I39-M48 HydrophobicContact CD1-SD 4.19Å; I39-M48 HydrophobicContact CG2-CE 3.78Å; I39-M48 HydrophobicContact CG2-SD 3.76Å; K42-M48 HydrophobicContact CB-CE 3.9Å; G46-M48 PolarHBondContact O-N 2.94Å; M48-H73 WeakPolarHBondContact O-CA 3.36Å; M48-G74 PolarHBondContact O-N 3.22Å; M48-F93 HydrophobicContact CB-CE2 4.33Å; M48-F93 HydrophobicContact CE-CD2 4.34Å; M48-F93 HydrophobicContact CE-CE2 4.27Å; M48-G135 CarbonylContact C-O 3.57Å; M48-G135 WeakPolarHBondContact CA-O 3.47Å; M48-L136 HydrophobicContact CB-CD2 4.02Å; M48-L136 HydrophobicContact CG-CD2 3.69Å; M48-L136 HydrophobicContact SD-CD2 4.46Å; M48-E141 HydrophobicContact CG-CB 4.42Å; M48-E141 HydrophobicContact CG-CG 3.97Å; M48-E141 HydrophobicContact SD-CG 4.3Å; M48-V143 HydrophobicContact SD-CG1 4.12Å
49	G	98.4	Very high	97.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.6	175.5	0	0	0	0	0	111.4	Y72 V134 G135	G49-Y72 WeakPolarHBondContact CA-O 3.29Å; G49-V134 CarbonylContact O-C 3.54Å; G49-V134 WeakPolarHBondContact O-CA 3.21Å; G49-G135 PolarHBondContact N-O 3.37Å; G49-G135 PolarHBondContact O-N 3.02Å
50	I	98.8	Very high	97.2	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.7	179.8	-60.7	163.5	0	0	0	109.1	F35 V37 I39 G71 Y72 F93 I99 Y112	F35-I50 HydrophobicContact CE2-CG2 4.08Å; F35-I50 HydrophobicContact CZ-CG2 4.38Å; V37-I50 HydrophobicContact CB-CD1 3.86Å; V37-I50 HydrophobicContact CB-CG1 4.42Å; V37-I50 HydrophobicContact CG1-CD1 3.92Å; V37-I50 HydrophobicContact CG1-CG1 4.36Å; V37-I50 HydrophobicContact CG2-CD1 4.43Å; V37-I50 HydrophobicContact CG2-CG2 3.98Å; I39-I50 HydrophobicContact CD1-CD1 4.16Å; I50-G71 CarbonylContact O-C 3.51Å; I50-G71 WeakPolarHBondContact O-CA 3.22Å; I50-Y72 PolarHBondContact N-O 3.01Å; I50-Y72 PolarHBondContact O-N 3.28Å; I50-F93 HydrophobicContact CD1-CE2 3.98Å; I50-F93 HydrophobicContact CD1-CZ 3.95Å; I50-F93 HydrophobicContact CG1-CZ 4.48Å; I50-I99 HydrophobicContact CD1-CB 3.72Å; I50-I99 HydrophobicContact CD1-CG1 4.11Å; I50-I99 HydrophobicContact CD1-CG2 3.9Å; I50-Y112 HydrophobicContact CG2-CE1 4.44Å; I50-Y112 VanDerWaalsContact O-CE1 3.3Å; I50-Y112 WeakPolarHBondContact O-CE1 3.25Å; I50-Y112 PolarHBondContact O-OH 3.49Å
51	G	98.7	Very high	97	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.2	-131	174	0	0	0	0	0	114.3	Y70 Y112 P132 T133	G51-Y70 CarbonylContact C-O 3.53Å; G51-Y70 WeakPolarHBondContact CA-O 3.31Å; G51-Y112 VanDerWaalsContact CA-OH 3.23Å; G51-Y112 WeakPolarHBondContact CA-OH 3.4Å; G51-P132 CarbonylContact O-C 3.47Å; G51-P132 WeakPolarHBondContact O-CA 3.29Å; G51-T133 PolarHBondContact N-O 2.92Å; G51-T133 PolarHBondContact O-N 2.97Å
52	L	98.8	Very high	97	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	143.2	-167.1	-57.2	169.9	0	0	0	110.8	I26 F35 S69 Y70 V103 C110 L126 L130 Y131	I26-L52 HydrophobicContact CD1-CD2 3.77Å; F35-L52 HydrophobicContact CE1-CD2 4.26Å; L52-S69 CarbonylContact O-C 3.59Å; L52-S69 WeakPolarHBondContact O-CA 3.5Å; L52-S69 PolarHBondContact O-OG 3.4Å; L52-Y70 HydrophobicContact CB-CD2 4.38Å; L52-Y70 PolarHBondContact N-O 3Å; L52-Y70 PolarHBondContact O-N 3.48Å; L52-Y70 VanDerWaalsContact O-O 3.12Å; L52-V103 HydrophobicContact CD1-CG2 3.62Å; L52-V103 HydrophobicContact CD2-CG2 3.93Å; L52-V103 HydrophobicContact CG-CG2 4.34Å; L52-C110 HydrophobicContact CD1-CB 4.42Å; L52-L126 HydrophobicContact CD1-CD1 4.13Å; L52-L130 HydrophobicContact CB-CB 4.18Å; L52-L130 HydrophobicContact CB-CD1 4.09Å; L52-L130 HydrophobicContact CD1-CD1 3.89Å; L52-Y131 CarbonylContact C-O 3.57Å; L52-Y131 VanDerWaalsContact CA-O 3.3Å; L52-Y131 WeakPolarHBondContact CA-O 3.38Å
53	S	98.6	Very high	97.1	Very high	1 Å²	1	42 Å²	42	1%	0.007	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	143.7	169.2	69.1	0	0	0	0	111.6	R21 Y131 T133	R21-S53 WeakPolarHBondContact CD-OG 3.47Å; R21-S53 WeakPolarHBondContact CG-OG 3.46Å; S53-Y131 PolarHBondContact N-O 3.44Å; S53-Y131 WeakPolarHBondContact O-CB 2.95Å; S53-Y131 PolarHBondContact O-N 3.17Å; S53-T133 WeakPolarHBondContact CB-OG1 3.24Å; S53-T133 PolarHBondContact N-OG1 3.17Å; S53-T133 PolarHBondContact OG-OG1 2.86Å
54	A	98.3	Very high	97.3	Very high	20 Å²	20	41 Å²	41	17%	0.165	21%	0.212	C	C	.	.			trans	-69	162.7	170.8	0	0	0	0	0	111.1	R21 G56 V57 H68 L130	R21-A54 PolarHBondContact NH1-O 3.33Å; A54-G56 PolarHBondContact O-N 3.12Å; A54-V57 HydrophobicContact CB-CG2 4.24Å; A54-V57 WeakPolarHBondContact O-CG2 3.31Å; A54-V57 PolarHBondContact O-N 3.01Å; A54-H68 HydrophobicContact CB-CB 3.71Å; A54-H68 PolarHBondContact N-O 3.49Å; A54-L130 HydrophobicContact CB-CD2 4.19Å
55	Q	97.9	Very high	97.4	Very high	156 Å²	156	37 Å²	37	73%	0.729	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	136.7	169.8	-169.3	175.8	18.6	0	0	110.3	Y131	Q55-Y131 HydrophobicContact CB-CE2 4.07Å
56	G	97.2	Very high	97.6	Very high	68 Å²	68	35.9 Å²	35.9	70%	0.701	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.8	-6.6	178	0	0	0	0	0	115.4	A54	A54-G56 PolarHBondContact O-N 3.12Å
57	V	97.7	Very high	97.7	Very high	19 Å²	19	43.8 Å²	43.8	12%	0.115	23%	0.225	C	C	.	.			trans	-59	138.4	169	173.6	0	0	0	0	109.8	R21 A54 M59 D66	R21-V57 PolarHBondContact NH1-O 3.12Å; A54-V57 HydrophobicContact CB-CG2 4.24Å; A54-V57 WeakPolarHBondContact O-CG2 3.31Å; A54-V57 PolarHBondContact O-N 3.01Å; V57-M59 PolarHBondContact O-N 2.88Å; V57-D66 HydrophobicContact CG1-CB 4.24Å
58	N	96.6	Very high	97.7	Very high	82 Å²	82	44.7 Å²	44.7	44%	0.439	23%	0.232	S	C	.	.			trans	-63.1	127.5	-178.9	-177.9	5.2	0	0	0	110.9	N60 D66	N58-N60 PolarHBondContact OD1-N 3.11Å; N58-D66 WeakPolarHBondContact CB-OD2 3.37Å
59	M	96.1	Very high	97.7	Very high	44 Å²	44	44.8 Å²	44.8	22%	0.217	23%	0.232	C	C	.	.	S	Bend	trans	-88	-4.3	-176.1	-59.5	-57.5	-92.8	0	0	113.5	A18 S19 V20 R21 V57 R61	A18-M59 CarbonylContact C-O 3.47Å; A18-M59 WeakPolarHBondContact CA-O 3.36Å; S19-M59 PolarHBondContact N-O 3.09Å; S19-M59 VanDerWaalsContact O-CE 3.25Å; S19-M59 WeakPolarHBondContact O-CE 3.33Å; V20-M59 VanDerWaalsContact C-CE 3.43Å; R21-M59 HydrophobicContact CB-CE 3.98Å; R21-M59 HydrophobicContact CG-CE 3.74Å; R21-M59 HydrophobicContact CG-SD 4.32Å; R21-M59 PolarHBondContact NH1-SD 2.88Å; V57-M59 PolarHBondContact O-N 2.88Å; M59-R61 PolarHBondContact O-N 3.15Å
60	N	95	Very high	97.7	Very high	108 Å²	108	45.6 Å²	45.6	58%	0.578	24%	0.236	S	C	*	.	S	Bend	trans	-88.7	31.4	176.6	-66.1	-13.1	0	0	0	112.6	A17 N58	A17-N60 CarbonylContact O-C 3.58Å; A17-N60 VanDerWaalsContact O-CA 3.23Å; A17-N60 WeakPolarHBondContact O-CA 3.46Å; N58-N60 PolarHBondContact OD1-N 3.11Å
61	R	95.8	Very high	97.7	Very high	91 Å²	91	45.6 Å²	45.6	34%	0.343	24%	0.235	S	C	.	.	S	Bend	trans	-149.5	156.4	-174.8	-58.4	-155.4	86.3	166.6	-2.4	109.3	S19 M59 W65 D66	S19-R61 WeakPolarHBondContact CB-O 3.36Å; S19-R61 PolarHBondContact OG-O 3.16Å; M59-R61 PolarHBondContact O-N 3.15Å; R61-W65 HydrophobicContact CB-CE3 3.94Å; R61-W65 HydrophobicContact CG-CE3 4.47Å; R61-D66 VanDerWaalsContact CD-CG 3.46Å; R61-D66 VanDerWaalsContact CD-OD1 3.26Å; R61-D66 WeakPolarHBondContact CD-OD1 3.4Å; R61-D66 WeakPolarHBondContact CD-OD2 3.48Å; R61-D66 IonicContact CZ-OD1 3.72Å; R61-D66 IonicContact NE-OD1 3.6Å; R61-D66 IonicContact NH1-OD1 2.93Å; R61-D66 PolarHBondContact NH1-OD1 3.41Å
62	L	97.6	Very high	97.7	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	24%	0.235	C	C	.	.			trans	-74.5	152	171.7	-64.1	-177.9	0	0	0	111.2	A17 G64 W65 H73 G135	A17-L62 HydrophobicContact CB-CD2 4.14Å; A17-L62 HydrophobicContact CB-CG 3.97Å; L62-G64 PolarHBondContact O-N 2.63Å; L62-W65 HydrophobicContact CB-CD2 4.27Å; L62-W65 HydrophobicContact CB-CE3 4.41Å; L62-W65 HydrophobicContact CB-CH2 4.37Å; L62-W65 HydrophobicContact CB-CZ2 4.23Å; L62-W65 HydrophobicContact CB-CZ3 4.47Å; L62-W65 HydrophobicContact CD1-CH2 4.05Å; L62-W65 HydrophobicContact CD1-CZ2 3.93Å; L62-W65 HydrophobicContact CG-CH2 4.11Å; L62-W65 HydrophobicContact CG-CZ2 4.27Å; L62-W65 HydrophobicContact CG-CZ3 4.42Å; L62-W65 PolarHBondContact O-N 3.49Å; L62-H73 VanDerWaalsContact CB-CE1 3.45Å; L62-H73 WeakPolarHBondContact CB-CE1 3.44Å; L62-G135 WeakPolarHBondContact CD2-O 3.46Å
63	P	98.4	Very high	97.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	137.3	177.1	-26	35.5	0	0	0	111.7	S19 G71 H73 T133	S19-P63 WeakPolarHBondContact OG-CD 3.5Å; P63-G71 WeakPolarHBondContact O-CA 3.28Å; P63-H73 PolarHBondContact O-NE2 3.08Å; P63-T133 HydrophobicContact CG-CG2 3.88Å
64	G	98.6	Very high	97.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.4	-25	179.5	0	0	0	0	0	115.4	L62 D66 S69 F80 S82 S83	L62-G64 PolarHBondContact O-N 2.63Å; G64-D66 PolarHBondContact O-N 3.04Å; G64-S69 WeakPolarHBondContact CA-O 3.19Å; G64-S69 PolarHBondContact N-OG 2.82Å; G64-F80 VanDerWaalsContact CA-O 3.23Å; G64-F80 WeakPolarHBondContact CA-O 3.32Å; G64-S82 CarbonylContact O-C 3.53Å; G64-S82 WeakPolarHBondContact O-CA 3.42Å; G64-S82 PolarHBondContact O-N 2.9Å; G64-S83 CarbonylContact O-C 3.6Å; G64-S83 PolarHBondContact O-N 2.92Å
65	W	98	Very high	97.7	Very high	36 Å²	36	48 Å²	48	14%	0.136	25%	0.246	C	C	.	.	S	Bend	trans	-74.7	-25.3	-172	-72.7	-2.3	0	0	0	115.6	P14 A17 R61 L62 H73 F80 S83 G84	P14-W65 HydrophobicContact CB-CH2 3.98Å; P14-W65 HydrophobicContact CB-CZ3 4.12Å; A17-W65 HydrophobicContact CB-CZ3 4.26Å; R61-W65 HydrophobicContact CB-CE3 3.94Å; R61-W65 HydrophobicContact CG-CE3 4.47Å; L62-W65 HydrophobicContact CB-CD2 4.27Å; L62-W65 HydrophobicContact CB-CE3 4.41Å; L62-W65 HydrophobicContact CB-CH2 4.37Å; L62-W65 HydrophobicContact CB-CZ2 4.23Å; L62-W65 HydrophobicContact CB-CZ3 4.47Å; L62-W65 HydrophobicContact CD1-CH2 4.05Å; L62-W65 HydrophobicContact CD1-CZ2 3.93Å; L62-W65 HydrophobicContact CG-CH2 4.11Å; L62-W65 HydrophobicContact CG-CZ2 4.27Å; L62-W65 HydrophobicContact CG-CZ3 4.42Å; L62-W65 PolarHBondContact O-N 3.49Å; W65-H73 AromaticContact CD1-CE1 3.96Å; W65-H73 AromaticContact CE2-CE1 3.78Å; W65-H73 AromaticContact NE1-CE1 3.29Å; W65-H73 PolarHBondContact NE1-CE1 3.04Å; W65-H73 VanDerWaalsContact NE1-CE1 3.29Å; W65-F80 AromaticContact CD1-CD1 3.51Å; W65-F80 AromaticContact CD1-CE1 3.92Å; W65-F80 AromaticContact NE1-CD1 3.56Å; W65-F80 AromaticContact NE1-CE1 3.49Å; W65-S83 CarbonylContact O-C 3.56Å; W65-G84 PolarHBondContact O-N 3.45Å
66	D	97.8	Very high	97.7	Very high	37 Å²	37	43.2 Å²	43.2	20%	0.198	23%	0.225	C	C	.	.	S	Bend	trans	-113.4	162.4	-179.5	-71.2	-24.5	0	0	0	111.2	V57 N58 R61 G64 S69 S82	V57-D66 HydrophobicContact CG1-CB 4.24Å; N58-D66 WeakPolarHBondContact CB-OD2 3.37Å; R61-D66 VanDerWaalsContact CD-CG 3.46Å; R61-D66 VanDerWaalsContact CD-OD1 3.26Å; R61-D66 WeakPolarHBondContact CD-OD1 3.4Å; R61-D66 WeakPolarHBondContact CD-OD2 3.48Å; R61-D66 IonicContact CZ-OD1 3.72Å; R61-D66 IonicContact NE-OD1 3.6Å; R61-D66 IonicContact NH1-OD1 2.93Å; R61-D66 PolarHBondContact NH1-OD1 3.41Å; G64-D66 PolarHBondContact O-N 3.04Å; D66-S69 WeakPolarHBondContact O-CB 3.37Å; D66-S69 PolarHBondContact O-N 3.17Å; D66-S69 VanDerWaalsContact O-N 3.12Å; D66-S82 WeakPolarHBondContact O-CA 3.41Å
67	K	97.7	Very high	97.8	Very high	169 Å²	169	40 Å²	40	74%	0.735	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	139.6	179.4	-66.5	-175.1	178.5	-176.5	0	112.1	S69	K67-S69 PolarHBondContact O-N 2.99Å
68	H	97.6	Very high	97.8	Very high	102 Å²	102	41.8 Å²	41.8	47%	0.472	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	29.3	-176.3	-49.4	-61.5	0	0	0	113.4	A54 S82	A54-H68 HydrophobicContact CB-CB 3.71Å; A54-H68 PolarHBondContact N-O 3.49Å; H68-S82 PolarHBondContact N-OG 3.26Å
69	S	98.7	Very high	97.9	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.014	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145	169.3	-163.1	0	0	0	0	110	L52 G64 D66 K67 S82	L52-S69 CarbonylContact O-C 3.59Å; L52-S69 WeakPolarHBondContact O-CA 3.5Å; L52-S69 PolarHBondContact O-OG 3.4Å; G64-S69 WeakPolarHBondContact CA-O 3.19Å; G64-S69 PolarHBondContact N-OG 2.82Å; D66-S69 WeakPolarHBondContact O-CB 3.37Å; D66-S69 PolarHBondContact O-N 3.17Å; D66-S69 VanDerWaalsContact O-N 3.12Å; K67-S69 PolarHBondContact O-N 2.99Å; S69-S82 PolarHBondContact N-OG 3.5Å; S69-S82 WeakPolarHBondContact O-CA 3.32Å; S69-S82 PolarHBondContact O-N 3.38Å; S69-S82 PolarHBondContact O-OG 2.68Å
70	Y	98.8	Very high	98.1	Very high	17 Å²	17	37 Å²	37	7%	0.067	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	128.6	-173.4	-53.8	-90	0	0	0	107.7	G51 L52 F80 C81 F123 L126 P127 L130	G51-Y70 CarbonylContact C-O 3.53Å; G51-Y70 WeakPolarHBondContact CA-O 3.31Å; L52-Y70 HydrophobicContact CB-CD2 4.38Å; L52-Y70 PolarHBondContact N-O 3Å; L52-Y70 PolarHBondContact O-N 3.48Å; L52-Y70 VanDerWaalsContact O-O 3.12Å; Y70-F80 CarbonylContact C-O 3.57Å; Y70-F80 WeakPolarHBondContact CA-O 3.31Å; Y70-C81 VanDerWaalsContact CE1-SG 3.59Å; Y70-F123 HydrophobicContact CD1-CB 4.27Å; Y70-F123 AromaticContact CD1-CD1 3.99Å; Y70-F123 HydrophobicContact CD1-CD1 3.99Å; Y70-F123 HydrophobicContact CD1-CD2 4.2Å; Y70-F123 HydrophobicContact CD1-CE1 4.43Å; Y70-F123 AromaticContact CD1-CG 3.88Å; Y70-F123 HydrophobicContact CD1-CG 3.88Å; Y70-F123 HydrophobicContact CG-CD2 4.32Å; Y70-F123 HydrophobicContact CG-CG 4.46Å; Y70-L126 HydrophobicContact CD1-CD2 3.66Å; Y70-L126 HydrophobicContact CD2-CD2 3.82Å; Y70-L126 HydrophobicContact CE1-CD2 3.58Å; Y70-L126 HydrophobicContact CE2-CD2 3.77Å; Y70-L126 HydrophobicContact CG-CD2 3.79Å; Y70-P127 HydrophobicContact CE2-CG 4.1Å; Y70-P127 WeakPolarHBondContact OH-CD 3.33Å; Y70-L130 HydrophobicContact CD2-CD1 4.21Å; Y70-L130 HydrophobicContact CD2-CD2 4.34Å; Y70-L130 HydrophobicContact CE2-CD1 4.16Å; Y70-L130 HydrophobicContact CE2-CD2 4.15Å
71	G	98.8	Very high	98.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	152.1	-174.2	0	0	0	0	0	114.4	I50 P63 S79 F80 Y112	I50-G71 CarbonylContact O-C 3.51Å; I50-G71 WeakPolarHBondContact O-CA 3.22Å; P63-G71 WeakPolarHBondContact O-CA 3.28Å; G71-S79 CarbonylContact O-C 3.59Å; G71-S79 WeakPolarHBondContact O-CA 3.38Å; G71-F80 PolarHBondContact N-O 3.41Å; G71-F80 PolarHBondContact O-N 3.17Å; G71-Y112 WeakPolarHBondContact CA-OH 3.49Å
72	Y	98.9	Very high	98.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	121.8	171.6	175.2	-143.2	0	0	0	108.9	G49 I50 G77 Y89 P91 F93 I99 Y112 L119	G49-Y72 WeakPolarHBondContact CA-O 3.29Å; I50-Y72 PolarHBondContact N-O 3.01Å; I50-Y72 PolarHBondContact O-N 3.28Å; Y72-G77 WeakPolarHBondContact CE2-O 3.5Å; Y72-Y89 AromaticContact CD2-CD1 3.7Å; Y72-Y89 HydrophobicContact CD2-CD1 3.7Å; Y72-Y89 HydrophobicContact CD2-CE1 4.18Å; Y72-Y89 AromaticContact CE2-CD1 3.72Å; Y72-Y89 HydrophobicContact CE2-CD1 3.72Å; Y72-Y89 HydrophobicContact CE2-CE1 4.23Å; Y72-Y89 HydrophobicContact CG-CD1 4.27Å; Y72-Y89 HydrophobicContact CG-CE1 4.33Å; Y72-P91 WeakPolarHBondContact OH-CD 3.43Å; Y72-P91 PolarHBondContact OH-O 3Å; Y72-F93 HydrophobicContact CD1-CD1 4.16Å; Y72-F93 AromaticContact CD1-CE1 3.6Å; Y72-F93 HydrophobicContact CD1-CE1 3.6Å; Y72-F93 HydrophobicContact CD2-CE1 4.38Å; Y72-F93 AromaticContact CE1-CD1 3.63Å; Y72-F93 HydrophobicContact CE1-CD1 3.63Å; Y72-F93 AromaticContact CE1-CE1 3.57Å; Y72-F93 HydrophobicContact CE1-CE1 3.57Å; Y72-F93 HydrophobicContact CE2-CE1 4.37Å; Y72-F93 HydrophobicContact CG-CE1 4.04Å; Y72-F93 AromaticContact CZ-CD1 3.92Å; Y72-F93 AromaticContact CZ-CE1 4Å; Y72-I99 HydrophobicContact CD1-CG2 3.91Å; Y72-I99 HydrophobicContact CE1-CD1 4.4Å; Y72-I99 HydrophobicContact CE1-CG2 4.18Å; Y72-Y112 VanDerWaalsContact CB-CZ 3.48Å; Y72-Y112 AromaticContact CD1-CD1 3.94Å; Y72-Y112 HydrophobicContact CD1-CD1 3.94Å; Y72-Y112 HydrophobicContact CD1-CD2 4.39Å; Y72-Y112 HydrophobicContact CD1-CE1 4.48Å; Y72-Y112 AromaticContact CD1-CG 3.87Å; Y72-Y112 HydrophobicContact CD1-CG 3.87Å; Y72-Y112 HydrophobicContact CG-CD1 4.36Å; Y72-Y112 HydrophobicContact CG-CD2 4.3Å; Y72-Y112 HydrophobicContact CG-CE2 4.5Å; Y72-Y112 HydrophobicContact CG-CG 4.22Å; Y72-Y112 PolarHBondContact N-OH 3.39Å; Y72-L119 HydrophobicContact CE1-CD1 3.81Å; Y72-L119 WeakPolarHBondContact OH-CD1 3.43Å
73	H	98.7	Very high	98.3	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.019	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	136.8	-169.4	-70.5	-150	0	0	0	111.1	M48 L62 P63 W65 G77 H78 F80	M48-H73 WeakPolarHBondContact O-CA 3.36Å; L62-H73 VanDerWaalsContact CB-CE1 3.45Å; L62-H73 WeakPolarHBondContact CB-CE1 3.44Å; P63-H73 PolarHBondContact O-NE2 3.08Å; W65-H73 AromaticContact CD1-CE1 3.96Å; W65-H73 AromaticContact CE2-CE1 3.78Å; W65-H73 AromaticContact NE1-CE1 3.29Å; W65-H73 PolarHBondContact NE1-CE1 3.04Å; W65-H73 VanDerWaalsContact NE1-CE1 3.29Å; H73-G77 VanDerWaalsContact O-CA 3.29Å; H73-G77 WeakPolarHBondContact O-CA 3.46Å; H73-G77 PolarHBondContact O-N 2.87Å; H73-H78 PolarHBondContact N-O 3.35Å; H73-F80 HydrophobicContact CB-CD2 4.23Å; H73-F80 HydrophobicContact CB-CE2 3.78Å; H73-F80 AromaticContact CD2-CD2 3.49Å; H73-F80 VanDerWaalsContact CD2-CD2 3.49Å; H73-F80 WeakPolarHBondContact CD2-CD2 3.36Å; H73-F80 AromaticContact CD2-CE2 3.85Å; H73-F80 AromaticContact CE1-CD2 3.87Å; H73-F80 AromaticContact CE1-CE2 3.93Å; H73-F80 AromaticContact CG-CD2 3.61Å; H73-F80 AromaticContact CG-CE2 3.44Å; H73-F80 VanDerWaalsContact CG-CE2 3.44Å; H73-F80 AromaticContact ND1-CD2 3.86Å; H73-F80 AromaticContact ND1-CE2 3.52Å; H73-F80 AromaticContact ND1-CZ 3.95Å; H73-F80 AromaticContact NE2-CD2 3.66Å
74	G	98.3	Very high	98.1	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-26.3	-168.5	0	0	0	0	0	115.4	M48 T92 F93	M48-G74 PolarHBondContact O-N 3.22Å; G74-T92 CarbonylContact O-C 3.59Å; G74-T92 VanDerWaalsContact O-CA 3.29Å; G74-T92 WeakPolarHBondContact O-CA 3.19Å; G74-T92 WeakPolarHBondContact O-CB 3.46Å; G74-F93 VanDerWaalsContact CA-CE2 3.45Å; G74-F93 PolarHBondContact O-N 2.94Å
75	D	97.8	Very high	98	Very high	67 Å²	67	41.5 Å²	41.5	36%	0.358	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-34.5	-175.2	58.4	-59.4	0	0	0	113.5	Y47 T92	Y47-D75 HydrophobicContact CD1-CB 3.64Å; Y47-D75 WeakPolarHBondContact CD1-OD2 3.37Å; Y47-D75 HydrophobicContact CE1-CB 3.88Å; Y47-D75 WeakPolarHBondContact CE1-OD2 3.37Å; D75-T92 WeakPolarHBondContact O-CG2 3.44Å
76	D	98.2	Very high	98	Very high	54 Å²	54	40.5 Å²	40.5	29%	0.289	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-13.8	-179.5	66.3	1.6	0	0	0	114	H78	D76-H78 PolarHBondContact O-N 3.38Å; D76-H78 WeakPolarHBondContact OD1-CB 3.38Å; D76-H78 IonicContact OD1-CG 2.65Å; D76-H78 PolarHBondContact OD1-N 3.15Å; D76-H78 WeakPolarHBondContact OD2-CB 3.25Å; D76-H78 IonicContact OD2-CE1 3.59Å; D76-H78 IonicContact OD2-CG 3.55Å; D76-H78 IonicContact OD2-ND1 2.68Å; D76-H78 PolarHBondContact OD2-ND1 3.13Å
77	G	98.6	Very high	98	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.01	25%	0.249	C	C	.	.			trans	71.8	17.5	-176.4	0	0	0	0	0	113.2	Y72 H73 G90	Y72-G77 WeakPolarHBondContact CE2-O 3.5Å; H73-G77 VanDerWaalsContact O-CA 3.29Å; H73-G77 WeakPolarHBondContact O-CA 3.46Å; H73-G77 PolarHBondContact O-N 2.87Å; G77-G90 WeakPolarHBondContact CA-O 3.35Å; G77-G90 PolarHBondContact O-N 3.24Å; G77-G90 VanDerWaalsContact O-O 3.04Å
78	H	98.8	Very high	98.1	Very high	57 Å²	57	41.3 Å²	41.3	26%	0.264	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	152	-179.4	-67.6	163	0	0	0	113	H73 D76 F80 Q87	H73-H78 PolarHBondContact N-O 3.35Å; D76-H78 PolarHBondContact O-N 3.38Å; D76-H78 WeakPolarHBondContact OD1-CB 3.38Å; D76-H78 IonicContact OD1-CG 2.65Å; D76-H78 PolarHBondContact OD1-N 3.15Å; D76-H78 WeakPolarHBondContact OD2-CB 3.25Å; D76-H78 IonicContact OD2-CE1 3.59Å; D76-H78 IonicContact OD2-CG 3.55Å; D76-H78 IonicContact OD2-ND1 2.68Å; D76-H78 PolarHBondContact OD2-ND1 3.13Å; H78-F80 HydrophobicContact CB-CD2 4.42Å; H78-F80 HydrophobicContact CB-CE2 3.8Å; H78-F80 HydrophobicContact CB-CZ 4.4Å; H78-Q87 CarbonylContact C-O 3.51Å; H78-Q87 WeakPolarHBondContact CA-O 3.17Å; H78-Q87 VanDerWaalsContact CB-O 3.29Å; H78-Q87 WeakPolarHBondContact CB-O 3.38Å
79	S	98.7	Very high	98.1	Very high	13 Å²	13	38.7 Å²	38.7	9%	0.091	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	140	167.3	68.6	0	0	0	0	110.7	G71 G86 Q87	G71-S79 CarbonylContact O-C 3.59Å; G71-S79 WeakPolarHBondContact O-CA 3.38Å; S79-G86 CarbonylContact O-C 3.54Å; S79-G86 VanDerWaalsContact O-CA 3.3Å; S79-G86 WeakPolarHBondContact O-CA 3.34Å; S79-Q87 PolarHBondContact N-O 3.21Å; S79-Q87 PolarHBondContact O-N 2.99Å
80	F	98.7	Very high	98.1	Very high	13 Å²	13	39.7 Å²	39.7	6%	0.057	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	110.7	-179.2	-70.1	-101.7	0	0	0	108.4	G64 W65 Y70 G71 H73 H78 G86	G64-F80 VanDerWaalsContact CA-O 3.23Å; G64-F80 WeakPolarHBondContact CA-O 3.32Å; W65-F80 AromaticContact CD1-CD1 3.51Å; W65-F80 AromaticContact CD1-CE1 3.92Å; W65-F80 AromaticContact NE1-CD1 3.56Å; W65-F80 AromaticContact NE1-CE1 3.49Å; Y70-F80 CarbonylContact C-O 3.57Å; Y70-F80 WeakPolarHBondContact CA-O 3.31Å; G71-F80 PolarHBondContact N-O 3.41Å; G71-F80 PolarHBondContact O-N 3.17Å; H73-F80 HydrophobicContact CB-CD2 4.23Å; H73-F80 HydrophobicContact CB-CE2 3.78Å; H73-F80 AromaticContact CD2-CD2 3.49Å; H73-F80 VanDerWaalsContact CD2-CD2 3.49Å; H73-F80 WeakPolarHBondContact CD2-CD2 3.36Å; H73-F80 AromaticContact CD2-CE2 3.85Å; H73-F80 AromaticContact CE1-CD2 3.87Å; H73-F80 AromaticContact CE1-CE2 3.93Å; H73-F80 AromaticContact CG-CD2 3.61Å; H73-F80 AromaticContact CG-CE2 3.44Å; H73-F80 VanDerWaalsContact CG-CE2 3.44Å; H73-F80 AromaticContact ND1-CD2 3.86Å; H73-F80 AromaticContact ND1-CE2 3.52Å; H73-F80 AromaticContact ND1-CZ 3.95Å; H73-F80 AromaticContact NE2-CD2 3.66Å; H78-F80 HydrophobicContact CB-CD2 4.42Å; H78-F80 HydrophobicContact CB-CE2 3.8Å; H78-F80 HydrophobicContact CB-CZ 4.4Å; F80-G86 VanDerWaalsContact CE1-CA 3.47Å
81	C	98.3	Very high	98.1	Very high	68 Å²	68	41.9 Å²	41.9	46%	0.459	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	94.1	-176.9	-174.2	0	0	0	0	110.2	Y70 S83 F123	Y70-C81 VanDerWaalsContact CE1-SG 3.59Å; C81-S83 PolarHBondContact O-N 3.24Å; C81-F123 HydrophobicContact CB-CD1 3.84Å; C81-F123 HydrophobicContact CB-CE1 3.84Å
82	S	98	Very high	98.1	Very high	39 Å²	39	45.5 Å²	45.5	27%	0.273	28%	0.283	S	S	.	.	S	Bend	trans	50.3	34	178.7	-68.3	0	0	0	0	114.5	G64 D66 H68 S69	G64-S82 CarbonylContact O-C 3.53Å; G64-S82 WeakPolarHBondContact O-CA 3.42Å; G64-S82 PolarHBondContact O-N 2.9Å; D66-S82 WeakPolarHBondContact O-CA 3.41Å; H68-S82 PolarHBondContact N-OG 3.26Å; S69-S82 PolarHBondContact N-OG 3.5Å; S69-S82 WeakPolarHBondContact O-CA 3.32Å; S69-S82 PolarHBondContact O-N 3.38Å; S69-S82 PolarHBondContact O-OG 2.68Å
83	S	96.6	Very high	98.1	Very high	48 Å²	48	45.9 Å²	45.9	34%	0.336	28%	0.284	S	S	.	.	S	Bend	trans	-154.2	144.6	-172.8	-179.8	0	0	0	0	110.8	G64 W65 C81 T85	G64-S83 CarbonylContact O-C 3.6Å; G64-S83 PolarHBondContact O-N 2.92Å; W65-S83 CarbonylContact O-C 3.56Å; C81-S83 PolarHBondContact O-N 3.24Å; S83-T85 PolarHBondContact O-N 3.29Å; S83-T85 PolarHBondContact OG-N 3.31Å
84	G	94.8	Very high	98.1	Very high	45 Å²	45	48.5 Å²	48.5	46%	0.464	30%	0.301	S	S	.	.	S	Bend	trans	-73.3	-2.6	171.7	0	0	0	0	0	114.3	W65	W65-G84 PolarHBondContact O-N 3.45Å
85	T	97.3	Very high	98.1	Very high	97 Å²	97	51.8 Å²	51.8	60%	0.595	32%	0.321	S	S	*	.	S	Bend	trans	-104.9	116	177.2	-56.1	0	0	0	0	109.8	S83	S83-T85 PolarHBondContact O-N 3.29Å; S83-T85 PolarHBondContact OG-N 3.31Å
86	G	97.6	Very high	98.2	Very high	16 Å²	16	51 Å²	51	17%	0.165	33%	0.329	C	S	.	.			trans	-75	158.9	177.2	0	0	0	0	0	112.7	S79 F80	S79-G86 CarbonylContact O-C 3.54Å; S79-G86 VanDerWaalsContact O-CA 3.3Å; S79-G86 WeakPolarHBondContact O-CA 3.34Å; F80-G86 VanDerWaalsContact CE1-CA 3.47Å
87	Q	98.3	Very high	98.2	Very high	115 Å²	115	49.6 Å²	49.6	54%	0.537	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	143.7	170.1	-63.6	-59.8	-55.5	0	0	109.9	H78 S79 Y89	H78-Q87 CarbonylContact C-O 3.51Å; H78-Q87 WeakPolarHBondContact CA-O 3.17Å; H78-Q87 VanDerWaalsContact CB-O 3.29Å; H78-Q87 WeakPolarHBondContact CB-O 3.38Å; S79-Q87 PolarHBondContact N-O 3.21Å; S79-Q87 PolarHBondContact O-N 2.99Å; Q87-Y89 PolarHBondContact O-N 3.01Å
88	P	98.5	Very high	98.2	Very high	108 Å²	108	50.6 Å²	50.6	70%	0.701	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.9	126.7	171.2	-26.7	35.7	0	0	0	111.7
89	Y	98.7	Very high	98.2	Very high	46 Å²	46	47.9 Å²	47.9	18%	0.18	31%	0.314	C	S	.	.			trans	-137.8	-61.7	-177	170.2	-118.6	0	0	0	112.5	Y72 Q87 Y112 L119 G120 A122	Y72-Y89 AromaticContact CD2-CD1 3.7Å; Y72-Y89 HydrophobicContact CD2-CD1 3.7Å; Y72-Y89 HydrophobicContact CD2-CE1 4.18Å; Y72-Y89 AromaticContact CE2-CD1 3.72Å; Y72-Y89 HydrophobicContact CE2-CD1 3.72Å; Y72-Y89 HydrophobicContact CE2-CE1 4.23Å; Y72-Y89 HydrophobicContact CG-CD1 4.27Å; Y72-Y89 HydrophobicContact CG-CE1 4.33Å; Q87-Y89 PolarHBondContact O-N 3.01Å; Y89-Y112 AromaticContact CE1-CD2 3.58Å; Y89-Y112 HydrophobicContact CE1-CD2 3.58Å; Y89-Y112 HydrophobicContact CE1-CE2 4.5Å; Y89-Y112 HydrophobicContact CE1-CG 4.14Å; Y89-Y112 AromaticContact CZ-CD2 3.96Å; Y89-Y112 PolarHBondContact OH-N 3.39Å; Y89-L119 HydrophobicContact CE1-CB 4.2Å; Y89-L119 HydrophobicContact CE1-CD1 4.23Å; Y89-L119 HydrophobicContact CE2-CB 4.44Å; Y89-L119 WeakPolarHBondContact OH-CB 3.14Å; Y89-G120 VanDerWaalsContact CE2-O 3.32Å; Y89-G120 WeakPolarHBondContact CE2-O 3.37Å; Y89-G120 PolarHBondContact OH-O 3.09Å; Y89-A122 HydrophobicContact CD2-CB 4.16Å; Y89-A122 HydrophobicContact CE1-CB 4.08Å; Y89-A122 HydrophobicContact CE2-CB 3.7Å
90	G	98.3	Very high	98.2	Very high	23 Å²	23	47.2 Å²	47.2	24%	0.237	31%	0.31	C	S	.	.	S	Bend	trans	-140.8	-177.5	-170.8	0	0	0	0	0	113.3	G77	G77-G90 WeakPolarHBondContact CA-O 3.35Å; G77-G90 PolarHBondContact O-N 3.24Å; G77-G90 VanDerWaalsContact O-O 3.04Å
91	P	98.6	Very high	98.2	Very high	64 Å²	64	46.6 Å²	46.6	42%	0.416	31%	0.307	S	S	.	.			trans	-77.1	141.5	176.8	31.5	-34.8	0	0	0	112.1	Y72 K114 L119	Y72-P91 WeakPolarHBondContact OH-CD 3.43Å; Y72-P91 PolarHBondContact OH-O 3Å; P91-K114 HydrophobicContact CG-CD 3.85Å; P91-L119 HydrophobicContact CG-CD2 4.2Å
92	T	98.8	Very high	98.3	Very high	76 Å²	76	43.4 Å²	43.4	47%	0.466	29%	0.285	S	S	.	.			trans	-48.4	152.8	169.5	57.7	0	0	0	0	112.6	G74 D75 K114	G74-T92 CarbonylContact O-C 3.59Å; G74-T92 VanDerWaalsContact O-CA 3.29Å; G74-T92 WeakPolarHBondContact O-CA 3.19Å; G74-T92 WeakPolarHBondContact O-CB 3.46Å; D75-T92 WeakPolarHBondContact O-CG2 3.44Å; T92-K114 PolarHBondContact O-NZ 2.68Å
93	F	98.8	Very high	98.3	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.035	27%	0.273	C	S	.	.			trans	-134.7	151.2	178.4	58.9	-101.5	0	0	0	113	I39 M48 I50 Y72 G74 D97 I99	I39-F93 HydrophobicContact CD1-CD2 4.03Å; I39-F93 HydrophobicContact CD1-CE2 4.01Å; I39-F93 HydrophobicContact CG1-CD2 3.99Å; I39-F93 HydrophobicContact CG1-CE2 4.49Å; M48-F93 HydrophobicContact CB-CE2 4.33Å; M48-F93 HydrophobicContact CE-CD2 4.34Å; M48-F93 HydrophobicContact CE-CE2 4.27Å; I50-F93 HydrophobicContact CD1-CE2 3.98Å; I50-F93 HydrophobicContact CD1-CZ 3.95Å; I50-F93 HydrophobicContact CG1-CZ 4.48Å; Y72-F93 HydrophobicContact CD1-CD1 4.16Å; Y72-F93 AromaticContact CD1-CE1 3.6Å; Y72-F93 HydrophobicContact CD1-CE1 3.6Å; Y72-F93 HydrophobicContact CD2-CE1 4.38Å; Y72-F93 AromaticContact CE1-CD1 3.63Å; Y72-F93 HydrophobicContact CE1-CD1 3.63Å; Y72-F93 AromaticContact CE1-CE1 3.57Å; Y72-F93 HydrophobicContact CE1-CE1 3.57Å; Y72-F93 HydrophobicContact CE2-CE1 4.37Å; Y72-F93 HydrophobicContact CG-CE1 4.04Å; Y72-F93 AromaticContact CZ-CD1 3.92Å; Y72-F93 AromaticContact CZ-CE1 4Å; G74-F93 VanDerWaalsContact CA-CE2 3.45Å; G74-F93 PolarHBondContact O-N 2.94Å; F93-D97 VanDerWaalsContact CA-OD2 3.27Å; F93-D97 WeakPolarHBondContact CA-OD2 2.94Å; F93-D97 HydrophobicContact CB-CB 4.12Å; F93-I99 HydrophobicContact CB-CD1 3.65Å; F93-I99 HydrophobicContact CB-CG1 4.08Å; F93-I99 HydrophobicContact CD1-CD1 3.72Å; F93-I99 HydrophobicContact CD1-CG1 3.86Å; F93-I99 HydrophobicContact CD2-CD1 4.38Å; F93-I99 HydrophobicContact CD2-CG1 3.89Å; F93-I99 HydrophobicContact CE1-CD1 4.46Å; F93-I99 HydrophobicContact CE1-CG1 4.22Å; F93-I99 HydrophobicContact CE2-CG1 4.26Å; F93-I99 HydrophobicContact CG-CD1 3.67Å; F93-I99 HydrophobicContact CG-CG1 3.67Å; F93-I99 HydrophobicContact CZ-CG1 4.41Å
94	T	98.7	Very high	98.3	Very high	58 Å²	58	39.4 Å²	39.4	36%	0.356	26%	0.257	S	S	.	.			trans	-148.3	-175.6	-170.6	-172.8	0	0	0	0	111.6	I39 K42 G96 D97	I39-T94 WeakPolarHBondContact CB-O 3.22Å; K42-T94 WeakPolarHBondContact CD-OG1 3.47Å; K42-T94 WeakPolarHBondContact CG-OG1 3.33Å; T94-G96 PolarHBondContact O-N 3.25Å; T94-D97 PolarHBondContact N-OD2 3.39Å; T94-D97 VanDerWaalsContact O-CB 3.32Å; T94-D97 WeakPolarHBondContact O-CB 3.45Å; T94-D97 PolarHBondContact O-N 3.17Å
95	T	98.7	Very high	98.4	Very high	72 Å²	72	38.5 Å²	38.5	44%	0.442	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-41.8	125.5	174.3	-57.2	0	0	0	0	112.2	V40 S41 K42	V40-T95 WeakPolarHBondContact O-CG2 3.5Å; S41-T95 WeakPolarHBondContact CA-OG1 3.27Å; K42-T95 WeakPolarHBondContact CG-OG1 3.26Å; K42-T95 PolarHBondContact N-OG1 3.11Å
96	G	98.4	Very high	98.3	Very high	51 Å²	51	35.8 Å²	35.8	53%	0.526	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	-20.5	179.6	0	0	0	0	0	114.5	I39 T94	I39-G96 PolarHBondContact O-N 2.94Å; T94-G96 PolarHBondContact O-N 3.25Å
97	D	98.8	Very high	98.2	Very high	23 Å²	23	38.1 Å²	38.1	12%	0.123	23%	0.231	C	C	.	.			trans	-72.4	151	176.5	-71.9	-42.1	0	0	0	111.8	I39 F93 T94 K114 N115	I39-D97 PolarHBondContact N-O 2.83Å; F93-D97 VanDerWaalsContact CA-OD2 3.27Å; F93-D97 WeakPolarHBondContact CA-OD2 2.94Å; F93-D97 HydrophobicContact CB-CB 4.12Å; T94-D97 PolarHBondContact N-OD2 3.39Å; T94-D97 VanDerWaalsContact O-CB 3.32Å; T94-D97 WeakPolarHBondContact O-CB 3.45Å; T94-D97 PolarHBondContact O-N 3.17Å; D97-K114 WeakPolarHBondContact OD1-CE 3.41Å; D97-K114 IonicContact OD1-NZ 3.09Å; D97-K114 WeakPolarHBondContact OD2-CE 3.34Å; D97-K114 IonicContact OD2-NZ 3.81Å; D97-K114 PolarHBondContact OD2-NZ 3.38Å; D97-N115 WeakPolarHBondContact CA-OD1 3.35Å; D97-N115 PolarHBondContact OD1-ND2 3.27Å
98	V	98.8	Very high	98.1	Very high	22 Å²	22	36 Å²	36	13%	0.133	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123	170.3	180	0	0	0	0	108.7	E36 K38 K114 N115 V153	E36-V98 HydrophobicContact CB-CG1 3.89Å; E36-V98 HydrophobicContact CG-CG1 4.07Å; K38-V98 HydrophobicContact CB-CG2 4.28Å; K38-V98 HydrophobicContact CG-CG2 4.21Å; V98-K114 WeakPolarHBondContact O-CA 3.2Å; V98-N115 PolarHBondContact N-OD1 3.26Å; V98-N115 PolarHBondContact O-N 3.01Å; V98-V153 HydrophobicContact CB-CG2 4.26Å; V98-V153 HydrophobicContact CG1-CG2 3.99Å; V98-V153 HydrophobicContact CG2-CG2 4.25Å
99	I	98.9	Very high	98.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.5	-179.7	-55.9	-58	0	0	0	109.3	E36 V37 I50 Y72 F93 Y112 T113 K114	E36-I99 CarbonylContact C-O 3.02Å; E36-I99 WeakPolarHBondContact CA-O 3.48Å; V37-I99 PolarHBondContact N-O 2.76Å; V37-I99 PolarHBondContact O-N 3.44Å; I50-I99 HydrophobicContact CD1-CB 3.72Å; I50-I99 HydrophobicContact CD1-CG1 4.11Å; I50-I99 HydrophobicContact CD1-CG2 3.9Å; Y72-I99 HydrophobicContact CD1-CG2 3.91Å; Y72-I99 HydrophobicContact CE1-CD1 4.4Å; Y72-I99 HydrophobicContact CE1-CG2 4.18Å; F93-I99 HydrophobicContact CB-CD1 3.65Å; F93-I99 HydrophobicContact CB-CG1 4.08Å; F93-I99 HydrophobicContact CD1-CD1 3.72Å; F93-I99 HydrophobicContact CD1-CG1 3.86Å; F93-I99 HydrophobicContact CD2-CD1 4.38Å; F93-I99 HydrophobicContact CD2-CG1 3.89Å; F93-I99 HydrophobicContact CE1-CD1 4.46Å; F93-I99 HydrophobicContact CE1-CG1 4.22Å; F93-I99 HydrophobicContact CE2-CG1 4.26Å; F93-I99 HydrophobicContact CG-CD1 3.67Å; F93-I99 HydrophobicContact CG-CG1 3.67Å; F93-I99 HydrophobicContact CZ-CG1 4.41Å; I99-Y112 HydrophobicContact CG2-CD1 4.25Å; I99-T113 CarbonylContact C-O 3.55Å; I99-T113 WeakPolarHBondContact CA-O 3.41Å; I99-K114 HydrophobicContact CD1-CB 3.92Å; I99-K114 HydrophobicContact CD1-CD 4.26Å; I99-K114 HydrophobicContact CD1-CG 3.76Å
100	G	98.9	Very high	98.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	153.8	173.4	0	0	0	0	0	112.5	Y34 F35 Y112 T113	Y34-G100 WeakPolarHBondContact OH-CA 3.42Å; F35-G100 CarbonylContact O-C 3.43Å; F35-G100 VanDerWaalsContact O-CA 3.3Å; F35-G100 WeakPolarHBondContact O-CA 3.36Å; G100-Y112 CarbonylContact O-C 3.56Å; G100-Y112 WeakPolarHBondContact O-CA 3.47Å; G100-Y112 WeakPolarHBondContact O-CB 3.39Å; G100-Y112 WeakPolarHBondContact O-CD1 3.5Å; G100-T113 WeakPolarHBondContact CA-OG1 3.41Å; G100-T113 PolarHBondContact N-O 3.24Å; G100-T113 PolarHBondContact N-OG1 3Å; G100-T113 VanDerWaalsContact N-OG1 3.15Å; G100-T113 PolarHBondContact O-N 3.31Å
101	C	98.9	Very high	98.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	111.5	174.6	176.6	0	0	0	0	108.4	F35 C110 Y112	F35-C101 HydrophobicContact CD1-CB 3.97Å; F35-C101 HydrophobicContact CE1-CB 3.36Å; F35-C101 VanDerWaalsContact CE1-SG 3.54Å; F35-C101 HydrophobicContact CE2-CB 4.09Å; F35-C101 HydrophobicContact CZ-CB 3.43Å; F35-C101 VanDerWaalsContact CZ-CB 3.43Å; F35-C101 PolarHBondContact N-O 3.44Å; F35-C101 PolarHBondContact O-N 3.23Å; C101-C110 VanDerWaalsContact SG-SG 3.6Å; C101-Y112 HydrophobicContact CB-CD1 3.9Å; C101-Y112 HydrophobicContact CB-CE1 3.83Å
102	C	98.8	Very high	98.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.5	179.8	-169.3	0	0	0	0	110.3	Y33 Y34 C110 F111	Y33-C102 CarbonylContact O-C 3.55Å; Y33-C102 WeakPolarHBondContact O-CA 3.46Å; Y34-C102 HydrophobicContact CD2-CB 3.6Å; Y34-C102 HydrophobicContact CE2-CB 4.09Å; C102-C110 CarbonylContact O-C 3.53Å; C102-C110 WeakPolarHBondContact O-CA 3.34Å; C102-F111 HydrophobicContact CB-CD1 3.71Å; C102-F111 HydrophobicContact CB-CD2 4.03Å; C102-F111 HydrophobicContact CB-CE1 3.31Å; C102-F111 HydrophobicContact CB-CE2 3.66Å; C102-F111 HydrophobicContact CB-CG 4.06Å; C102-F111 HydrophobicContact CB-CZ 3.29Å; C102-F111 PolarHBondContact N-O 3.12Å; C102-F111 PolarHBondContact O-N 3.41Å; C102-F111 WeakPolarHBondContact SG-CE1 3.38Å; C102-F111 WeakPolarHBondContact SG-CZ 3.5Å
103	V	98.5	Very high	98.1	Very high	4 Å²	4	21.9 Å²	21.9	2%	0.024	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.5	178.3	-171.3	0	0	0	0	108.6	I26 I32 Y33 L52 L105 L126	I26-V103 HydrophobicContact CD1-CB 4.1Å; I26-V103 HydrophobicContact CD1-CG1 4.36Å; I26-V103 HydrophobicContact CD1-CG2 3.66Å; I32-V103 WeakPolarHBondContact CA-O 3.44Å; Y33-V103 PolarHBondContact N-O 2.96Å; Y33-V103 PolarHBondContact O-N 2.72Å; L52-V103 HydrophobicContact CD1-CG2 3.62Å; L52-V103 HydrophobicContact CD2-CG2 3.93Å; L52-V103 HydrophobicContact CG-CG2 4.34Å; V103-L105 HydrophobicContact CG1-CD2 3.96Å; V103-L105 HydrophobicContact CG1-CG 4.4Å; V103-L126 HydrophobicContact CG1-CD1 4.17Å
104	N	97.5	Very high	98.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	108.7	175.5	-171.8	-22.7	0	0	0	109.7	I106 N107 N108 T109 Y159 W163	N104-I106 VanDerWaalsContact C-N 3.32Å; N104-I106 VanDerWaalsContact OD1-CB 3.23Å; N104-I106 WeakPolarHBondContact OD1-CB 3.43Å; N104-I106 WeakPolarHBondContact OD1-CG1 3.43Å; N104-I106 PolarHBondContact OD1-N 3.01Å; N104-N107 WeakPolarHBondContact CB-OD1 3.3Å; N104-N107 PolarHBondContact ND2-OD1 3.13Å; N104-N107 PolarHBondContact OD1-OD1 2.85Å; N104-N108 CarbonylContact O-C 3.59Å; N104-N108 WeakPolarHBondContact O-CA 3.42Å; N104-N108 PolarHBondContact O-N 3.12Å; N104-T109 PolarHBondContact N-O 3.4Å; N104-T109 PolarHBondContact O-N 3.4Å; N104-Y159 PolarHBondContact ND2-OH 3.27Å; N104-W163 WeakPolarHBondContact ND2-CZ2 3.48Å; N104-W163 PolarHBondContact ND2-NE1 2.86Å
105	L	95.9	Very high	98.1	Very high	26 Å²	26	23.4 Å²	23.4	14%	0.136	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-2.5	-177.9	-58.2	165.9	0	0	0	112.6	I26 P27 C30 G31 V103	I26-L105 HydrophobicContact CG2-CD1 3.91Å; P27-L105 WeakPolarHBondContact O-CD1 3.31Å; C30-L105 HydrophobicContact CB-CD1 4.39Å; G31-L105 WeakPolarHBondContact O-CA 3.29Å; G31-L105 WeakPolarHBondContact O-CB 3.31Å; G31-L105 PolarHBondContact O-N 3.39Å; V103-L105 HydrophobicContact CG1-CD2 3.96Å; V103-L105 HydrophobicContact CG1-CG 4.4Å
106	I	95.2	Very high	98.1	Very high	39 Å²	39	21 Å²	21	20%	0.2	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-46	173.2	-54.3	168.8	0	0	0	109.6	N104 W163 I167 F538	N104-I106 VanDerWaalsContact C-N 3.32Å; N104-I106 VanDerWaalsContact OD1-CB 3.23Å; N104-I106 WeakPolarHBondContact OD1-CB 3.43Å; N104-I106 WeakPolarHBondContact OD1-CG1 3.43Å; N104-I106 PolarHBondContact OD1-N 3.01Å; I106-W163 HydrophobicContact CB-CE3 4.4Å; I106-W163 HydrophobicContact CB-CZ3 4.11Å; I106-W163 HydrophobicContact CD1-CB 4.28Å; I106-W163 HydrophobicContact CD1-CD2 3.86Å; I106-W163 HydrophobicContact CD1-CE3 3.36Å; I106-W163 HydrophobicContact CD1-CG 4.27Å; I106-W163 HydrophobicContact CD1-CZ3 3.94Å; I106-W163 HydrophobicContact CG1-CE3 4.49Å; I106-W163 HydrophobicContact CG2-CE3 4.29Å; I106-W163 HydrophobicContact CG2-CZ3 3.82Å; I106-I167 HydrophobicContact CD1-CG1 4.45Å; I106-I167 HydrophobicContact CG2-CD1 4.22Å; I106-F538 HydrophobicContact CD1-CD2 3.73Å; I106-F538 HydrophobicContact CD1-CE2 3.63Å; I106-F538 HydrophobicContact CG1-CE2 4.39Å
107	N	95.5	Very high	98.1	Very high	65 Å²	65	25.1 Å²	25.1	35%	0.348	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	10.1	-177.9	66.6	-4.4	0	0	0	113.6	N104 T109 W163	N104-N107 WeakPolarHBondContact CB-OD1 3.3Å; N104-N107 PolarHBondContact ND2-OD1 3.13Å; N104-N107 PolarHBondContact OD1-OD1 2.85Å; N107-T109 PolarHBondContact O-N 3.16Å; N107-T109 PolarHBondContact OD1-OG1 2.97Å; N107-W163 HydrophobicContact CB-CH2 4.35Å; N107-W163 WeakPolarHBondContact ND2-CH2 3.33Å
108	N	96.3	Very high	98.1	Very high	72 Å²	72	27.1 Å²	27.1	39%	0.385	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	41.4	176.7	-54.4	-44.9	0	0	0	114.1	N104 T124 D125 L126	N104-N108 CarbonylContact O-C 3.59Å; N104-N108 WeakPolarHBondContact O-CA 3.42Å; N104-N108 PolarHBondContact O-N 3.12Å; N108-T124 CarbonylContact O-C 3.6Å; N108-D125 PolarHBondContact O-N 2.95Å; N108-L126 PolarHBondContact O-N 3.46Å
109	T	98.4	Very high	98.1	Very high	9 Å²	9	28.3 Å²	28.3	6%	0.055	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	162.3	177.6	69.7	0	0	0	0	112.6	N104 N107 I121 F123 T124	N104-T109 PolarHBondContact N-O 3.4Å; N104-T109 PolarHBondContact O-N 3.4Å; N107-T109 PolarHBondContact O-N 3.16Å; N107-T109 PolarHBondContact OD1-OG1 2.97Å; T109-I121 HydrophobicContact CG2-CD1 4.36Å; T109-F123 CarbonylContact C-O 3.51Å; T109-F123 VanDerWaalsContact CA-O 3.23Å; T109-F123 WeakPolarHBondContact CA-O 3.36Å; T109-F123 WeakPolarHBondContact CB-O 3.39Å; T109-T124 HydrophobicContact CG2-CG2 4.14Å
110	C	98.8	Very high	98.1	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.1	170.2	170.5	0	0	0	0	110.4	L52 C101 C102 A122 F123 L126	L52-C110 HydrophobicContact CD1-CB 4.42Å; C101-C110 VanDerWaalsContact SG-SG 3.6Å; C102-C110 CarbonylContact O-C 3.53Å; C102-C110 WeakPolarHBondContact O-CA 3.34Å; C110-A122 PolarHBondContact O-N 2.89Å; C110-F123 HydrophobicContact CB-CB 4.45Å; C110-F123 HydrophobicContact CB-CD2 4.03Å; C110-F123 PolarHBondContact N-O 3.26Å; C110-F123 PolarHBondContact O-N 3.36Å; C110-F123 VanDerWaalsContact O-N 3.17Å; C110-L126 HydrophobicContact CB-CD1 3.51Å
111	F	98.8	Very high	98.1	Very high	9 Å²	9	34.8 Å²	34.8	4%	0.039	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.5	169.2	70.1	-90.9	0	0	0	110	C102 T113 S118 G120 F154 Y159	C102-F111 HydrophobicContact CB-CD1 3.71Å; C102-F111 HydrophobicContact CB-CD2 4.03Å; C102-F111 HydrophobicContact CB-CE1 3.31Å; C102-F111 HydrophobicContact CB-CE2 3.66Å; C102-F111 HydrophobicContact CB-CG 4.06Å; C102-F111 HydrophobicContact CB-CZ 3.29Å; C102-F111 PolarHBondContact N-O 3.12Å; C102-F111 PolarHBondContact O-N 3.41Å; C102-F111 WeakPolarHBondContact SG-CE1 3.38Å; C102-F111 WeakPolarHBondContact SG-CZ 3.5Å; F111-T113 HydrophobicContact CD2-CG2 4.1Å; F111-T113 HydrophobicContact CE2-CG2 3.7Å; F111-S118 VanDerWaalsContact CD2-OG 3.23Å; F111-S118 WeakPolarHBondContact CD2-OG 3.46Å; F111-S118 WeakPolarHBondContact CE2-OG 3.39Å; F111-G120 WeakPolarHBondContact CB-O 3.44Å; F111-F154 HydrophobicContact CE2-CE1 4.23Å; F111-F154 HydrophobicContact CE2-CZ 4.07Å; F111-F154 HydrophobicContact CZ-CE1 4.08Å; F111-F154 HydrophobicContact CZ-CZ 4.1Å; F111-Y159 HydrophobicContact CE1-CD1 4.41Å; F111-Y159 AromaticContact CE1-CE1 3.76Å; F111-Y159 HydrophobicContact CE1-CE1 3.76Å; F111-Y159 AromaticContact CE1-CE2 3.98Å; F111-Y159 HydrophobicContact CE1-CE2 3.98Å; F111-Y159 AromaticContact CE1-CZ 3.52Å; F111-Y159 HydrophobicContact CZ-CD1 4.34Å; F111-Y159 HydrophobicContact CZ-CD2 4.43Å; F111-Y159 HydrophobicContact CZ-CE1 4.15Å; F111-Y159 HydrophobicContact CZ-CE2 4.25Å; F111-Y159 HydrophobicContact CZ-CG 4.48Å
112	Y	98.9	Very high	98	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	158.5	173.1	-64.7	-92.5	0	0	0	110.9	I50 G51 G71 Y72 Y89 I99 G100 C101 L119 A122 F123	I50-Y112 HydrophobicContact CG2-CE1 4.44Å; I50-Y112 VanDerWaalsContact O-CE1 3.3Å; I50-Y112 WeakPolarHBondContact O-CE1 3.25Å; I50-Y112 PolarHBondContact O-OH 3.49Å; G51-Y112 VanDerWaalsContact CA-OH 3.23Å; G51-Y112 WeakPolarHBondContact CA-OH 3.4Å; G71-Y112 WeakPolarHBondContact CA-OH 3.49Å; Y72-Y112 VanDerWaalsContact CB-CZ 3.48Å; Y72-Y112 AromaticContact CD1-CD1 3.94Å; Y72-Y112 HydrophobicContact CD1-CD1 3.94Å; Y72-Y112 HydrophobicContact CD1-CD2 4.39Å; Y72-Y112 HydrophobicContact CD1-CE1 4.48Å; Y72-Y112 AromaticContact CD1-CG 3.87Å; Y72-Y112 HydrophobicContact CD1-CG 3.87Å; Y72-Y112 HydrophobicContact CG-CD1 4.36Å; Y72-Y112 HydrophobicContact CG-CD2 4.3Å; Y72-Y112 HydrophobicContact CG-CE2 4.5Å; Y72-Y112 HydrophobicContact CG-CG 4.22Å; Y72-Y112 PolarHBondContact N-OH 3.39Å; Y89-Y112 AromaticContact CE1-CD2 3.58Å; Y89-Y112 HydrophobicContact CE1-CD2 3.58Å; Y89-Y112 HydrophobicContact CE1-CE2 4.5Å; Y89-Y112 HydrophobicContact CE1-CG 4.14Å; Y89-Y112 AromaticContact CZ-CD2 3.96Å; Y89-Y112 PolarHBondContact OH-N 3.39Å; I99-Y112 HydrophobicContact CG2-CD1 4.25Å; G100-Y112 CarbonylContact O-C 3.56Å; G100-Y112 WeakPolarHBondContact O-CA 3.47Å; G100-Y112 WeakPolarHBondContact O-CB 3.39Å; G100-Y112 WeakPolarHBondContact O-CD1 3.5Å; C101-Y112 HydrophobicContact CB-CD1 3.9Å; C101-Y112 HydrophobicContact CB-CE1 3.83Å; Y112-L119 WeakPolarHBondContact O-CB 3.45Å; Y112-L119 PolarHBondContact O-N 3.4Å; Y112-A122 HydrophobicContact CD2-CB 3.8Å; Y112-A122 HydrophobicContact CE2-CB 3.83Å; Y112-F123 HydrophobicContact CE2-CD2 4.37Å; Y112-F123 AromaticContact CE2-CE2 3.54Å; Y112-F123 HydrophobicContact CE2-CE2 3.54Å; Y112-F123 HydrophobicContact CE2-CZ 4.13Å; Y112-F123 AromaticContact CZ-CE2 3.97Å
113	T	98.9	Very high	98	Very high	1 Å²	1	36 Å²	36	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.7	170.4	69.2	0	0	0	0	109	Y34 I99 G100 F111 H117 F154	Y34-T113 HydrophobicContact CE2-CG2 4.01Å; Y34-T113 PolarHBondContact OH-OG1 2.96Å; I99-T113 CarbonylContact C-O 3.55Å; I99-T113 WeakPolarHBondContact CA-O 3.41Å; G100-T113 WeakPolarHBondContact CA-OG1 3.41Å; G100-T113 PolarHBondContact N-O 3.24Å; G100-T113 PolarHBondContact N-OG1 3Å; G100-T113 VanDerWaalsContact N-OG1 3.15Å; G100-T113 PolarHBondContact O-N 3.31Å; F111-T113 HydrophobicContact CD2-CG2 4.1Å; F111-T113 HydrophobicContact CE2-CG2 3.7Å; T113-H117 CarbonylContact C-O 3.51Å; T113-H117 WeakPolarHBondContact CA-O 3.31Å; T113-H117 WeakPolarHBondContact CB-O 3.21Å; T113-F154 HydrophobicContact CG2-CB 4.17Å; T113-F154 HydrophobicContact CG2-CD1 4.13Å; T113-F154 HydrophobicContact CG2-CD2 3.76Å; T113-F154 HydrophobicContact CG2-CE1 4.49Å; T113-F154 HydrophobicContact CG2-CE2 4.16Å; T113-F154 HydrophobicContact CG2-CG 3.76Å
114	K	98.9	Very high	98	Very high	37 Å²	37	39.6 Å²	39.6	16%	0.161	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122.4	168.3	179.9	175.7	-174.4	179.1	0	108.8	P91 T92 D97 V98 I99 G116 H117 L119	P91-K114 HydrophobicContact CG-CD 3.85Å; T92-K114 PolarHBondContact O-NZ 2.68Å; D97-K114 WeakPolarHBondContact OD1-CE 3.41Å; D97-K114 IonicContact OD1-NZ 3.09Å; D97-K114 WeakPolarHBondContact OD2-CE 3.34Å; D97-K114 IonicContact OD2-NZ 3.81Å; D97-K114 PolarHBondContact OD2-NZ 3.38Å; V98-K114 WeakPolarHBondContact O-CA 3.2Å; I99-K114 HydrophobicContact CD1-CB 3.92Å; I99-K114 HydrophobicContact CD1-CD 4.26Å; I99-K114 HydrophobicContact CD1-CG 3.76Å; K114-G116 PolarHBondContact O-N 3.2Å; K114-H117 PolarHBondContact N-O 3.4Å; K114-H117 PolarHBondContact O-N 2.88Å; K114-L119 HydrophobicContact CB-CD1 4.2Å; K114-L119 HydrophobicContact CB-CD2 4.23Å; K114-L119 HydrophobicContact CB-CG 4.49Å
115	N	98.7	Very high	98	Very high	62 Å²	62	45.9 Å²	45.9	33%	0.332	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	43.6	177.5	-57	-30.9	0	0	0	112.6	D97 V98 H117	D97-N115 WeakPolarHBondContact CA-OD1 3.35Å; D97-N115 PolarHBondContact OD1-ND2 3.27Å; V98-N115 PolarHBondContact N-OD1 3.26Å; V98-N115 PolarHBondContact O-N 3.01Å; N115-H117 PolarHBondContact O-CD2 2.96Å
116	G	98.5	Very high	98.1	Very high	20 Å²	20	45.2 Å²	45.2	21%	0.206	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	3	179.4	0	0	0	0	0	116	K114 F154	K114-G116 PolarHBondContact O-N 3.2Å; G116-F154 WeakPolarHBondContact O-CD2 3.5Å
117	H	98.7	Very high	98.1	Very high	139 Å²	139	45.1 Å²	45.1	64%	0.644	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.6	177.7	-60.5	-72.5	0	0	0	111.7	T113 K114 N115	T113-H117 CarbonylContact C-O 3.51Å; T113-H117 WeakPolarHBondContact CA-O 3.31Å; T113-H117 WeakPolarHBondContact CB-O 3.21Å; K114-H117 PolarHBondContact N-O 3.4Å; K114-H117 PolarHBondContact O-N 2.88Å; N115-H117 PolarHBondContact O-CD2 2.96Å
118	S	98.4	Very high	98	Very high	65 Å²	65	46.5 Å²	46.5	46%	0.455	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	137	175.3	-178.5	0	0	0	0	111.8	F111 G120	F111-S118 VanDerWaalsContact CD2-OG 3.23Å; F111-S118 WeakPolarHBondContact CD2-OG 3.46Å; F111-S118 WeakPolarHBondContact CE2-OG 3.39Å; S118-G120 PolarHBondContact OG-N 3.49Å
119	L	98.7	Very high	97.9	Very high	46 Å²	46	48.1 Å²	48.1	24%	0.241	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	4.3	-179.3	-56.2	178.6	0	0	0	112.9	Y72 Y89 P91 Y112 K114	Y72-L119 HydrophobicContact CE1-CD1 3.81Å; Y72-L119 WeakPolarHBondContact OH-CD1 3.43Å; Y89-L119 HydrophobicContact CE1-CB 4.2Å; Y89-L119 HydrophobicContact CE1-CD1 4.23Å; Y89-L119 HydrophobicContact CE2-CB 4.44Å; Y89-L119 WeakPolarHBondContact OH-CB 3.14Å; P91-L119 HydrophobicContact CG-CD2 4.2Å; Y112-L119 WeakPolarHBondContact O-CB 3.45Å; Y112-L119 PolarHBondContact O-N 3.4Å; K114-L119 HydrophobicContact CB-CD1 4.2Å; K114-L119 HydrophobicContact CB-CD2 4.23Å; K114-L119 HydrophobicContact CB-CG 4.49Å
120	G	98.4	Very high	97.9	Very high	35 Å²	35	48 Å²	48	36%	0.361	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	82.6	170.9	-174.5	0	0	0	0	0	113.4	Y89 F111 S118 A122	Y89-G120 VanDerWaalsContact CE2-O 3.32Å; Y89-G120 WeakPolarHBondContact CE2-O 3.37Å; Y89-G120 PolarHBondContact OH-O 3.09Å; F111-G120 WeakPolarHBondContact CB-O 3.44Å; S118-G120 PolarHBondContact OG-N 3.49Å; G120-A122 PolarHBondContact O-N 2.98Å
121	I	98.6	Very high	97.9	Very high	101 Å²	101	49.7 Å²	49.7	52%	0.518	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	125.1	-174.7	-63.7	176.1	0	0	0	110.5	T109 F123 T124	T109-I121 HydrophobicContact CG2-CD1 4.36Å; I121-F123 WeakPolarHBondContact CG2-O 3.44Å; I121-T124 HydrophobicContact CG2-CG2 4.04Å
122	A	98.7	Very high	97.9	Very high	21 Å²	21	49.5 Å²	49.5	17%	0.174	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-40.7	173.9	0	0	0	0	0	112	Y89 C110 Y112 G120	Y89-A122 HydrophobicContact CD2-CB 4.16Å; Y89-A122 HydrophobicContact CE1-CB 4.08Å; Y89-A122 HydrophobicContact CE2-CB 3.7Å; C110-A122 PolarHBondContact O-N 2.89Å; Y112-A122 HydrophobicContact CD2-CB 3.8Å; Y112-A122 HydrophobicContact CE2-CB 3.83Å; G120-A122 PolarHBondContact O-N 2.98Å
123	F	98.6	Very high	97.9	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.4	-173.5	-45.2	-60.7	0	0	0	111.6	Y70 C81 T109 C110 Y112 I121 L126	Y70-F123 HydrophobicContact CD1-CB 4.27Å; Y70-F123 AromaticContact CD1-CD1 3.99Å; Y70-F123 HydrophobicContact CD1-CD1 3.99Å; Y70-F123 HydrophobicContact CD1-CD2 4.2Å; Y70-F123 HydrophobicContact CD1-CE1 4.43Å; Y70-F123 AromaticContact CD1-CG 3.88Å; Y70-F123 HydrophobicContact CD1-CG 3.88Å; Y70-F123 HydrophobicContact CG-CD2 4.32Å; Y70-F123 HydrophobicContact CG-CG 4.46Å; C81-F123 HydrophobicContact CB-CD1 3.84Å; C81-F123 HydrophobicContact CB-CE1 3.84Å; T109-F123 CarbonylContact C-O 3.51Å; T109-F123 VanDerWaalsContact CA-O 3.23Å; T109-F123 WeakPolarHBondContact CA-O 3.36Å; T109-F123 WeakPolarHBondContact CB-O 3.39Å; C110-F123 HydrophobicContact CB-CB 4.45Å; C110-F123 HydrophobicContact CB-CD2 4.03Å; C110-F123 PolarHBondContact N-O 3.26Å; C110-F123 PolarHBondContact O-N 3.36Å; C110-F123 VanDerWaalsContact O-N 3.17Å; Y112-F123 HydrophobicContact CE2-CD2 4.37Å; Y112-F123 AromaticContact CE2-CE2 3.54Å; Y112-F123 HydrophobicContact CE2-CE2 3.54Å; Y112-F123 HydrophobicContact CE2-CZ 4.13Å; Y112-F123 AromaticContact CZ-CE2 3.97Å; I121-F123 WeakPolarHBondContact CG2-O 3.44Å; F123-L126 HydrophobicContact CB-CD2 3.9Å; F123-L126 HydrophobicContact CB-CG 4.38Å
124	T	98.2	Very high	97.9	Very high	78 Å²	78	50.3 Å²	50.3	48%	0.479	29%	0.29	S	S	.	.			trans	-119.6	169	169.3	65.5	0	0	0	0	109.6	N108 T109 I121 L126	N108-T124 CarbonylContact O-C 3.6Å; T109-T124 HydrophobicContact CG2-CG2 4.14Å; I121-T124 HydrophobicContact CG2-CG2 4.04Å; T124-L126 PolarHBondContact O-N 3.5Å
125	D	97	Very high	97.8	Very high	133 Å²	133	48.5 Å²	48.5	71%	0.711	28%	0.283	S	S	*	.	S	Bend	trans	55.9	38.6	173.1	-51.3	-71	0	0	0	113.3	N108	N108-D125 PolarHBondContact O-N 2.95Å
126	L	97.3	Very high	97.8	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.063	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-63.7	138.2	179.1	-70.1	175.4	0	0	0	111.5	L52 Y70 V103 N108 C110 F123 T124 L130	L52-L126 HydrophobicContact CD1-CD1 4.13Å; Y70-L126 HydrophobicContact CD1-CD2 3.66Å; Y70-L126 HydrophobicContact CD2-CD2 3.82Å; Y70-L126 HydrophobicContact CE1-CD2 3.58Å; Y70-L126 HydrophobicContact CE2-CD2 3.77Å; Y70-L126 HydrophobicContact CG-CD2 3.79Å; V103-L126 HydrophobicContact CG1-CD1 4.17Å; N108-L126 PolarHBondContact O-N 3.46Å; C110-L126 HydrophobicContact CB-CD1 3.51Å; F123-L126 HydrophobicContact CB-CD2 3.9Å; F123-L126 HydrophobicContact CB-CG 4.38Å; T124-L126 PolarHBondContact O-N 3.5Å; L126-L130 HydrophobicContact CB-CD1 4.11Å; L126-L130 HydrophobicContact CD1-CD1 4.43Å; L126-L130 HydrophobicContact CD2-CD1 4.08Å; L126-L130 HydrophobicContact CG-CD1 4.45Å
127	P	95.7	Very high	97.6	Very high	37 Å²	37	45.4 Å²	45.4	24%	0.24	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-70.2	157	171.2	31	-36	0	0	0	110.8	Y70 L130	Y70-P127 HydrophobicContact CE2-CG 4.1Å; Y70-P127 WeakPolarHBondContact OH-CD 3.33Å; P127-L130 HydrophobicContact CG-CD1 4.32Å; P127-L130 HydrophobicContact CG-CD2 4.07Å; P127-L130 HydrophobicContact CG-CG 4.32Å; P127-L130 WeakPolarHBondContact O-CD1 3.43Å; P127-L130 WeakPolarHBondContact O-CG 3.41Å
128	P	93.9	Very high	97.3	Very high	94 Å²	94	38.8 Å²	38.8	61%	0.61	23%	0.23	S	C	*	.	S	Bend	trans	-71.3	169.9	175.6	31.9	-36.6	0	0	0	111.9	L130	P128-L130 PolarHBondContact O-N 2.9Å
129	N	95	Very high	97.1	Very high	105 Å²	105	38 Å²	38	56%	0.561	22%	0.223	S	C	*	.	S	Bend	trans	60.9	36.5	172.5	-50.6	-59.4	0	0	0	114.9	P25	P25-N129 HydrophobicContact CB-CB 4.37Å
130	L	98.1	Very high	96.9	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.037	23%	0.233	C	C	.	.			trans	-77.8	147.2	174.6	-70.6	173.2	0	0	0	111.9	P25 I26 L52 A54 Y70 L126 P127 P128	P25-L130 CarbonylContact C-O 3.36Å; P25-L130 WeakPolarHBondContact CA-O 3.36Å; I26-L130 PolarHBondContact N-O 2.87Å; L52-L130 HydrophobicContact CB-CB 4.18Å; L52-L130 HydrophobicContact CB-CD1 4.09Å; L52-L130 HydrophobicContact CD1-CD1 3.89Å; A54-L130 HydrophobicContact CB-CD2 4.19Å; Y70-L130 HydrophobicContact CD2-CD1 4.21Å; Y70-L130 HydrophobicContact CD2-CD2 4.34Å; Y70-L130 HydrophobicContact CE2-CD1 4.16Å; Y70-L130 HydrophobicContact CE2-CD2 4.15Å; L126-L130 HydrophobicContact CB-CD1 4.11Å; L126-L130 HydrophobicContact CD1-CD1 4.43Å; L126-L130 HydrophobicContact CD2-CD1 4.08Å; L126-L130 HydrophobicContact CG-CD1 4.45Å; P127-L130 HydrophobicContact CG-CD1 4.32Å; P127-L130 HydrophobicContact CG-CD2 4.07Å; P127-L130 HydrophobicContact CG-CG 4.32Å; P127-L130 WeakPolarHBondContact O-CD1 3.43Å; P127-L130 WeakPolarHBondContact O-CG 3.41Å; P128-L130 PolarHBondContact O-N 2.9Å
131	Y	98.7	Very high	96.7	Very high	36 Å²	36	36.1 Å²	36.1	14%	0.141	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.6	176	-70.5	-107	0	0	0	110.1	R21 A22 H24 P25 L52 S53 Q55 T133	R21-Y131 HydrophobicContact CB-CD1 4.37Å; R21-Y131 HydrophobicContact CB-CG 4.45Å; R21-Y131 HydrophobicContact CG-CG 4.35Å; A22-Y131 WeakPolarHBondContact O-CD1 3.47Å; H24-Y131 WeakPolarHBondContact O-CD1 3.4Å; P25-Y131 HydrophobicContact CB-CD1 4.49Å; P25-Y131 HydrophobicContact CB-CD2 3.98Å; P25-Y131 HydrophobicContact CB-CE1 4.24Å; P25-Y131 HydrophobicContact CB-CE2 3.66Å; P25-Y131 HydrophobicContact CB-CG 4.38Å; P25-Y131 VanDerWaalsContact CD-CZ 3.49Å; P25-Y131 WeakPolarHBondContact CD-OH 3.45Å; P25-Y131 HydrophobicContact CG-CE1 4.43Å; P25-Y131 HydrophobicContact CG-CE2 4.2Å; L52-Y131 CarbonylContact C-O 3.57Å; L52-Y131 VanDerWaalsContact CA-O 3.3Å; L52-Y131 WeakPolarHBondContact CA-O 3.38Å; S53-Y131 PolarHBondContact N-O 3.44Å; S53-Y131 WeakPolarHBondContact O-CB 2.95Å; S53-Y131 PolarHBondContact O-N 3.17Å; Q55-Y131 HydrophobicContact CB-CE2 4.07Å; Y131-T133 PolarHBondContact O-N 3.34Å; Y131-T133 PolarHBondContact O-OG1 2.93Å
132	P	98.7	Very high	96.6	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.4	129.6	162.7	-25.5	34.7	0	0	0	109.9	R21 A22 I26 Y33 F35 G51 F147	R21-P132 CarbonylContact C-O 3.55Å; R21-P132 WeakPolarHBondContact CA-O 3.42Å; A22-P132 HydrophobicContact CB-CB 4.02Å; A22-P132 HydrophobicContact CB-CG 4.15Å; A22-P132 PolarHBondContact N-O 3.4Å; I26-P132 HydrophobicContact CD1-CG 4.44Å; I26-P132 HydrophobicContact CG1-CG 4.21Å; Y33-P132 HydrophobicContact CE1-CG 3.84Å; F35-P132 HydrophobicContact CD1-CB 4.06Å; F35-P132 HydrophobicContact CD1-CG 4.11Å; F35-P132 HydrophobicContact CD2-CB 4.41Å; F35-P132 HydrophobicContact CE1-CB 3.72Å; F35-P132 HydrophobicContact CE1-CG 4.04Å; F35-P132 HydrophobicContact CE2-CB 4.14Å; F35-P132 HydrophobicContact CG-CB 4.37Å; F35-P132 HydrophobicContact CZ-CB 3.78Å; G51-P132 CarbonylContact O-C 3.47Å; G51-P132 WeakPolarHBondContact O-CA 3.29Å; P132-F147 HydrophobicContact CB-CE1 3.8Å; P132-F147 HydrophobicContact CB-CZ 4.35Å; P132-F147 HydrophobicContact CG-CE1 4.13Å
133	T	98.7	Very high	96.6	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	134	-172.7	-49.3	0	0	0	0	109.9	V20 R21 G51 S53 P63 Y131	V20-T133 VanDerWaalsContact O-CA 3.28Å; V20-T133 WeakPolarHBondContact O-CA 3.48Å; V20-T133 VanDerWaalsContact O-CG2 3.28Å; V20-T133 WeakPolarHBondContact O-CG2 3.31Å; R21-T133 HydrophobicContact CG-CG2 4.2Å; R21-T133 WeakPolarHBondContact CG-OG1 3.38Å; G51-T133 PolarHBondContact N-O 2.92Å; G51-T133 PolarHBondContact O-N 2.97Å; S53-T133 WeakPolarHBondContact CB-OG1 3.24Å; S53-T133 PolarHBondContact N-OG1 3.17Å; S53-T133 PolarHBondContact OG-OG1 2.86Å; P63-T133 HydrophobicContact CG-CG2 3.88Å; Y131-T133 PolarHBondContact O-N 3.34Å; Y131-T133 PolarHBondContact O-OG1 2.93Å
134	V	98.5	Very high	96.5	Very high	16 Å²	16	33.4 Å²	33.4	10%	0.097	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.9	170.3	171.5	0	0	0	0	107.6	S19 V20 V37 G49 L136 V143	S19-V134 CarbonylContact C-O 3.6Å; S19-V134 VanDerWaalsContact CA-O 3.24Å; S19-V134 WeakPolarHBondContact CA-O 3.31Å; V20-V134 HydrophobicContact CG1-CB 4.42Å; V20-V134 PolarHBondContact N-O 3.46Å; V20-V134 PolarHBondContact O-N 2.91Å; V37-V134 HydrophobicContact CG1-CG2 4.4Å; V37-V134 HydrophobicContact CG2-CG2 3.95Å; G49-V134 CarbonylContact O-C 3.54Å; G49-V134 WeakPolarHBondContact O-CA 3.21Å; V134-L136 HydrophobicContact CG1-CD2 4.05Å; V134-L136 HydrophobicContact CG1-CG 4.29Å; V134-V143 HydrophobicContact CG1-CG2 3.68Å
135	G	97.7	Very high	96.5	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.5	169	0	0	0	0	0	111.8	A18 S19 M48 G49 L62	A18-G135 CarbonylContact O-C 3.58Å; A18-G135 VanDerWaalsContact O-CA 3.29Å; A18-G135 WeakPolarHBondContact O-CA 3.41Å; S19-G135 VanDerWaalsContact OG-CA 3.25Å; S19-G135 WeakPolarHBondContact OG-CA 3.38Å; M48-G135 CarbonylContact C-O 3.57Å; M48-G135 WeakPolarHBondContact CA-O 3.47Å; G49-G135 PolarHBondContact N-O 3.37Å; G49-G135 PolarHBondContact O-N 3.02Å; L62-G135 WeakPolarHBondContact CD2-O 3.46Å
136	L	97.2	Very high	96.6	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.031	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.8	179.7	-53.4	177.7	0	0	0	108.1	V7 A18 M48 V134 E141 V143	V7-L136 HydrophobicContact CG2-CB 3.13Å; V7-L136 HydrophobicContact CG2-CD1 3.99Å; V7-L136 HydrophobicContact CG2-CG 4.2Å; A18-L136 PolarHBondContact N-O 3.2Å; A18-L136 PolarHBondContact O-N 3.27Å; A18-L136 VanDerWaalsContact O-O 3.11Å; M48-L136 HydrophobicContact CB-CD2 4.02Å; M48-L136 HydrophobicContact CG-CD2 3.69Å; M48-L136 HydrophobicContact SD-CD2 4.46Å; V134-L136 HydrophobicContact CG1-CD2 4.05Å; V134-L136 HydrophobicContact CG1-CG 4.29Å; L136-E141 WeakPolarHBondContact CA-OE2 3.47Å; L136-E141 HydrophobicContact CB-CB 4.34Å; L136-E141 WeakPolarHBondContact CB-OE2 3.4Å; L136-E141 HydrophobicContact CD1-CB 4.32Å; L136-E141 HydrophobicContact CD2-CB 4.22Å; L136-V143 HydrophobicContact CD2-CG1 4.12Å; L136-V143 HydrophobicContact CD2-CG2 4.48Å
137	Q	94.8	Very high	96.7	Very high	10 Å²	10	27.8 Å²	27.8	5%	0.047	17%	0.168	C	C	.	.			trans	-138.3	-31.6	-177.2	179.9	-174.2	-23.2	0	0	113.6	G11 T13 A17 Y47 E141	G11-Q137 WeakPolarHBondContact CA-O 3.48Å; T13-Q137 VanDerWaalsContact C-NE2 3.33Å; T13-Q137 PolarHBondContact O-NE2 3.17Å; T13-Q137 VanDerWaalsContact O-NE2 3.14Å; A17-Q137 HydrophobicContact CB-CB 4.13Å; A17-Q137 HydrophobicContact CB-CG 4.16Å; Y47-Q137 HydrophobicContact CD2-CG 4.36Å; Y47-Q137 PolarHBondContact O-N 3.03Å; Q137-E141 PolarHBondContact N-OE2 2.77Å
138	T	93.1	Very high	96.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-106.7	151.4	-174.2	80.2	0	0	0	0	113.9	D45 Y47 E141	D45-T138 HydrophobicContact CB-CG2 3.83Å; D45-T138 PolarHBondContact N-OG1 2.63Å; D45-T138 VanDerWaalsContact N-OG1 3.16Å; D45-T138 WeakPolarHBondContact OD2-CG2 3.42Å; Y47-T138 HydrophobicContact CD2-CG2 3.41Å; Y47-T138 VanDerWaalsContact CD2-CG2 3.41Å; Y47-T138 HydrophobicContact CE2-CG2 4.13Å; Y47-T138 HydrophobicContact CG-CG2 3.96Å; T138-E141 VanDerWaalsContact CB-OE1 3.3Å; T138-E141 WeakPolarHBondContact CB-OE1 3.46Å; T138-E141 VanDerWaalsContact N-CD 3.26Å; T138-E141 PolarHBondContact N-OE1 3.35Å; T138-E141 PolarHBondContact N-OE2 2.84Å; T138-E141 WeakPolarHBondContact O-CB 3.27Å; T138-E141 WeakPolarHBondContact O-CG 3.47Å; T138-E141 PolarHBondContact O-N 2.8Å; T138-E141 VanDerWaalsContact OG1-CD 3.27Å; T138-E141 PolarHBondContact OG1-OE1 3.04Å
139	P	93.4	Very high	96.9	Very high	48 Å²	48	28.5 Å²	28.5	31%	0.312	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	140.9	-179.6	-22.1	31.1	0	0	0	112.7	G9 G43 R44 E141	G9-P139 WeakPolarHBondContact O-CG 3.38Å; G43-P139 WeakPolarHBondContact CA-O 3Å; R44-P139 PolarHBondContact N-O 3.46Å; R44-P139 VanDerWaalsContact N-O 3.08Å; P139-E141 VanDerWaalsContact C-N 3.29Å
140	G	93.6	Very high	97.1	Very high	43 Å²	43	29.9 Å²	29.9	44%	0.443	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	4.2	176.8	0	0	0	0	0	114.8	S41 G43	S41-G140 WeakPolarHBondContact CB-O 3.37Å; S41-G140 PolarHBondContact OG-O 2.83Å; G43-G140 WeakPolarHBondContact CA-O 3.37Å; G43-G140 PolarHBondContact N-O 3.19Å
141	E	96	Very high	97.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	130.4	169.1	-76.1	167.1	-170.3	0	0	110.4	S41 K42 G46 Y47 M48 L136 Q137 T138 P139	S41-E141 CarbonylContact O-C 3.58Å; S41-E141 WeakPolarHBondContact O-CA 3.12Å; K42-E141 WeakPolarHBondContact O-CG 3.41Å; G46-E141 PolarHBondContact N-OE1 3Å; Y47-E141 PolarHBondContact N-OE1 3.21Å; M48-E141 HydrophobicContact CG-CB 4.42Å; M48-E141 HydrophobicContact CG-CG 3.97Å; M48-E141 HydrophobicContact SD-CG 4.3Å; L136-E141 WeakPolarHBondContact CA-OE2 3.47Å; L136-E141 HydrophobicContact CB-CB 4.34Å; L136-E141 WeakPolarHBondContact CB-OE2 3.4Å; L136-E141 HydrophobicContact CD1-CB 4.32Å; L136-E141 HydrophobicContact CD2-CB 4.22Å; Q137-E141 PolarHBondContact N-OE2 2.77Å; T138-E141 VanDerWaalsContact CB-OE1 3.3Å; T138-E141 WeakPolarHBondContact CB-OE1 3.46Å; T138-E141 VanDerWaalsContact N-CD 3.26Å; T138-E141 PolarHBondContact N-OE1 3.35Å; T138-E141 PolarHBondContact N-OE2 2.84Å; T138-E141 WeakPolarHBondContact O-CB 3.27Å; T138-E141 WeakPolarHBondContact O-CG 3.47Å; T138-E141 PolarHBondContact O-N 2.8Å; T138-E141 VanDerWaalsContact OG1-CD 3.27Å; T138-E141 PolarHBondContact OG1-OE1 3.04Å; P139-E141 VanDerWaalsContact C-N 3.29Å
142	V	96.6	Very high	97.1	Very high	11 Å²	11	36.5 Å²	36.5	7%	0.067	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	129.2	-176.3	-172.7	0	0	0	0	109.3	W6 V40 S41	W6-V142 HydrophobicContact CD2-CG1 4.16Å; W6-V142 HydrophobicContact CD2-CG2 4.4Å; W6-V142 HydrophobicContact CE3-CB 3.9Å; W6-V142 HydrophobicContact CE3-CG1 3.45Å; W6-V142 VanDerWaalsContact CE3-CG1 3.45Å; W6-V142 HydrophobicContact CE3-CG2 3.26Å; W6-V142 HydrophobicContact CH2-CG1 3.43Å; W6-V142 VanDerWaalsContact CH2-CG1 3.43Å; W6-V142 HydrophobicContact CZ2-CG1 4.2Å; W6-V142 HydrophobicContact CZ3-CB 3.78Å; W6-V142 HydrophobicContact CZ3-CG1 3.04Å; W6-V142 HydrophobicContact CZ3-CG2 3.34Å; V40-V142 HydrophobicContact CB-CB 3.9Å; V40-V142 HydrophobicContact CB-CG1 3.64Å; V40-V142 HydrophobicContact CG1-CB 4.26Å; V40-V142 HydrophobicContact CG1-CG1 3.9Å; V40-V142 HydrophobicContact CG2-CG1 4.14Å; V40-V142 PolarHBondContact N-O 3.29Å; S41-V142 PolarHBondContact N-O 3.23Å; S41-V142 PolarHBondContact O-N 2.85Å
143	V	97.9	Very high	97.1	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.03	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	150.3	172.7	-52.2	0	0	0	0	111.4	S5 V37 K38 I39 M48 V134 L136	S5-V143 PolarHBondContact N-O 2.68Å; V37-V143 HydrophobicContact CG1-CB 3.6Å; V37-V143 HydrophobicContact CG1-CG1 4.14Å; V37-V143 HydrophobicContact CG1-CG2 3.78Å; K38-V143 VanDerWaalsContact O-CA 3.26Å; K38-V143 WeakPolarHBondContact O-CA 3.38Å; K38-V143 WeakPolarHBondContact O-CB 3.36Å; I39-V143 HydrophobicContact CD1-CG1 3.64Å; M48-V143 HydrophobicContact SD-CG1 4.12Å; V134-V143 HydrophobicContact CG1-CG2 3.68Å; L136-V143 HydrophobicContact CD2-CG1 4.12Å; L136-V143 HydrophobicContact CD2-CG2 4.48Å
144	D	97.4	Very high	97.1	Very high	55 Å²	55	41.4 Å²	41.4	29%	0.294	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	135.4	174.1	-67	-18	0	0	0	109.1	S4 V37 K38 V40	S4-D144 WeakPolarHBondContact CB-OD1 3.11Å; S4-D144 PolarHBondContact OG-OD1 3.2Å; V37-D144 CarbonylContact C-O 3.53Å; V37-D144 WeakPolarHBondContact CA-O 2.94Å; K38-D144 PolarHBondContact N-O 3.09Å; K38-D144 PolarHBondContact O-N 2.59Å; V40-D144 HydrophobicContact CG2-CB 4.12Å; V40-D144 VanDerWaalsContact CG2-CG 3.41Å; V40-D144 WeakPolarHBondContact CG2-OD2 3.34Å
145	A	98.2	Very high	97	Very high	27 Å²	27	45.4 Å²	45.4	22%	0.223	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.9	-179.1	0	0	0	0	0	111.3	F147	A145-F147 HydrophobicContact CB-CD2 4.07Å; A145-F147 HydrophobicContact CB-CE2 3.48Å; A145-F147 VanDerWaalsContact CB-CE2 3.48Å; A145-F147 HydrophobicContact CB-CZ 3.94Å
146	N	98.5	Very high	97	Very high	17 Å²	17	46.1 Å²	46.1	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	109.6	169.5	-177.9	15.3	0	0	0	109.2	F35 E36 G148 Q149 H150 F152	F35-N146 WeakPolarHBondContact CA-O 3.47Å; E36-N146 HydrophobicContact CB-CB 4.24Å; E36-N146 PolarHBondContact N-O 3.04Å; E36-N146 PolarHBondContact O-N 3.3Å; N146-G148 PolarHBondContact OD1-N 2.74Å; N146-Q149 PolarHBondContact OD1-N 3.11Å; N146-Q149 VanDerWaalsContact OD1-N 3.08Å; N146-H150 PolarHBondContact ND2-O 2.88Å; N146-H150 PolarHBondContact OD1-N 3.46Å; N146-H150 VanDerWaalsContact OD1-N 3.1Å; N146-H150 PolarHBondContact OD1-O 3.2Å; N146-F152 HydrophobicContact CB-CE1 4.45Å; N146-F152 WeakPolarHBondContact ND2-CD1 3.44Å
147	F	98.2	Very high	97	Very high	61 Å²	61	51.6 Å²	51.6	27%	0.268	30%	0.296	S	S	.	.	S	Bend	trans	-104.2	23.7	174	-63.5	-70.5	0	0	0	111.8	A22 Y33 F35 P132 A145	A22-F147 HydrophobicContact CB-CZ 4.3Å; Y33-F147 WeakPolarHBondContact OH-CD1 3.39Å; F35-F147 HydrophobicContact CB-CD1 3.69Å; F35-F147 HydrophobicContact CB-CE1 3.93Å; F35-F147 HydrophobicContact CD2-CE1 4.08Å; F35-F147 HydrophobicContact CG-CD1 4.32Å; F35-F147 HydrophobicContact CG-CE1 4.05Å; P132-F147 HydrophobicContact CB-CE1 3.8Å; P132-F147 HydrophobicContact CB-CZ 4.35Å; P132-F147 HydrophobicContact CG-CE1 4.13Å; A145-F147 HydrophobicContact CB-CD2 4.07Å; A145-F147 HydrophobicContact CB-CE2 3.48Å; A145-F147 VanDerWaalsContact CB-CE2 3.48Å; A145-F147 HydrophobicContact CB-CZ 3.94Å
148	G	97.7	Very high	97.2	Very high	50 Å²	50	55.2 Å²	55.2	52%	0.515	32%	0.315	S	S	.	.	S	Bend	trans	107.4	7.8	-176.6	0	0	0	0	0	114.5	N146 H150	N146-G148 PolarHBondContact OD1-N 2.74Å; G148-H150 VanDerWaalsContact C-N 3.27Å
149	Q	97.8	Very high	97.4	Very high	95 Å²	95	56.9 Å²	56.9	44%	0.444	32%	0.322	S	S	.	.	S	Bend	trans	-69.7	-27	172.7	-63.4	86.1	-8.2	0	0	112.2	N146	N146-Q149 PolarHBondContact OD1-N 3.11Å; N146-Q149 VanDerWaalsContact OD1-N 3.08Å
150	H	97.3	Very high	97.5	Very high	135 Å²	135	56.8 Å²	56.8	63%	0.625	32%	0.318	S	S	*	.	S	Bend	trans	-129.6	154.9	177.9	-60.1	-54	0	0	0	110.4	N146 G148 F152	N146-H150 PolarHBondContact ND2-O 2.88Å; N146-H150 PolarHBondContact OD1-N 3.46Å; N146-H150 VanDerWaalsContact OD1-N 3.1Å; N146-H150 PolarHBondContact OD1-O 3.2Å; G148-H150 VanDerWaalsContact C-N 3.27Å; H150-F152 PolarHBondContact O-N 3.41Å
151	P	98.3	Very high	97.7	Very high	125 Å²	125	62 Å²	62	81%	0.812	32%	0.324	S	S	*	.			trans	-52.1	136.7	169.5	-24.6	34.3	0	0	0	110.8
152	F	98.7	Very high	97.7	Very high	56 Å²	56	66.4 Å²	66.4	25%	0.246	35%	0.345	C	S	.	.			trans	-73.4	151.3	175.9	-66.9	-58.2	0	0	0	111.2	Y34 E36 N146 H150 I156	Y34-F152 HydrophobicContact CD1-CB 4.24Å; Y34-F152 AromaticContact CD1-CD1 3.76Å; Y34-F152 HydrophobicContact CD1-CD1 3.76Å; Y34-F152 AromaticContact CD1-CD2 3.78Å; Y34-F152 HydrophobicContact CD1-CD2 3.78Å; Y34-F152 AromaticContact CD1-CE1 3.97Å; Y34-F152 HydrophobicContact CD1-CE1 3.97Å; Y34-F152 AromaticContact CD1-CE2 3.98Å; Y34-F152 HydrophobicContact CD1-CE2 3.98Å; Y34-F152 AromaticContact CD1-CG 3.65Å; Y34-F152 HydrophobicContact CD1-CG 3.65Å; Y34-F152 HydrophobicContact CD1-CZ 4.07Å; Y34-F152 HydrophobicContact CE1-CB 3.85Å; Y34-F152 AromaticContact CE1-CD1 3.72Å; Y34-F152 HydrophobicContact CE1-CD1 3.72Å; Y34-F152 HydrophobicContact CE1-CD2 4.25Å; Y34-F152 HydrophobicContact CE1-CE1 4.31Å; Y34-F152 AromaticContact CE1-CG 3.67Å; Y34-F152 HydrophobicContact CE1-CG 3.67Å; E36-F152 HydrophobicContact CB-CD1 4.17Å; E36-F152 HydrophobicContact CB-CE1 4.47Å; E36-F152 HydrophobicContact CG-CD1 3.8Å; E36-F152 HydrophobicContact CG-CE1 4.41Å; E36-F152 WeakPolarHBondContact OE2-CA 3.28Å; N146-F152 HydrophobicContact CB-CE1 4.45Å; N146-F152 WeakPolarHBondContact ND2-CD1 3.44Å; H150-F152 PolarHBondContact O-N 3.41Å; F152-I156 HydrophobicContact CD2-CG2 3.74Å; F152-I156 HydrophobicContact CE2-CG2 4.36Å
153	V	98.7	Very high	97.6	Very high	81 Å²	81	67.5 Å²	67.5	49%	0.491	35%	0.348	S	S	.	.	S	Bend	trans	-75.3	-37.3	174.1	-173.7	0	0	0	0	110.6	E36 V98	E36-V153 PolarHBondContact OE1-N 3.38Å; E36-V153 PolarHBondContact OE2-N 3.45Å; V98-V153 HydrophobicContact CB-CG2 4.26Å; V98-V153 HydrophobicContact CG1-CG2 3.99Å; V98-V153 HydrophobicContact CG2-CG2 4.25Å
154	F	98.7	Very high	97.5	Very high	28 Å²	28	72.2 Å²	72.2	12%	0.123	37%	0.365	C	S	.	.	S	Bend	trans	-79.2	137.7	171.4	-179.5	-110.1	0	0	0	111.1	Y34 E36 F111 T113 G116 I156	Y34-F154 HydrophobicContact CE1-CB 4.04Å; Y34-F154 HydrophobicContact CE1-CD1 4.37Å; Y34-F154 HydrophobicContact CE2-CD1 4.08Å; Y34-F154 AromaticContact CZ-CD1 3.95Å; Y34-F154 WeakPolarHBondContact OH-CB 3.4Å; E36-F154 PolarHBondContact OE1-N 2.95Å; E36-F154 VanDerWaalsContact OE1-N 3.11Å; F111-F154 HydrophobicContact CE2-CE1 4.23Å; F111-F154 HydrophobicContact CE2-CZ 4.07Å; F111-F154 HydrophobicContact CZ-CE1 4.08Å; F111-F154 HydrophobicContact CZ-CZ 4.1Å; T113-F154 HydrophobicContact CG2-CB 4.17Å; T113-F154 HydrophobicContact CG2-CD1 4.13Å; T113-F154 HydrophobicContact CG2-CD2 3.76Å; T113-F154 HydrophobicContact CG2-CE1 4.49Å; T113-F154 HydrophobicContact CG2-CE2 4.16Å; T113-F154 HydrophobicContact CG2-CG 3.76Å; G116-F154 WeakPolarHBondContact O-CD2 3.5Å; F154-I156 VanDerWaalsContact C-N 3.26Å; F154-I156 HydrophobicContact CD1-CB 4.19Å; F154-I156 HydrophobicContact CD1-CD1 4.32Å; F154-I156 HydrophobicContact CE1-CD1 4.13Å; F154-I156 PolarHBondContact O-N 3.41Å
155	D	98.1	Very high	97.4	Very high	101 Å²	101	74 Å²	74	54%	0.54	38%	0.378	S	S	.	.			trans	-74.8	79.5	173.6	-167.1	-15.1	0	0	0	110.7	E157 D158	D155-E157 PolarHBondContact O-N 3.47Å; D155-E157 PolarHBondContact OD1-N 2.9Å; D155-D158 HydrophobicContact CB-CB 4.4Å; D155-D158 PolarHBondContact OD1-N 2.99Å
156	I	98.1	Very high	97.3	Very high	14 Å²	14	76.7 Å²	76.7	7%	0.072	39%	0.385	C	S	.	.	H	α-helix	trans	-67.2	-27.8	178.3	-171.7	60.2	0	0	0	112.2	I32 Y34 F152 F154 Y159 M160	I32-I156 HydrophobicContact CG2-CD1 3.92Å; Y34-I156 HydrophobicContact CD1-CB 4.09Å; Y34-I156 HydrophobicContact CD1-CD1 4.48Å; Y34-I156 HydrophobicContact CD1-CG1 4.24Å; Y34-I156 HydrophobicContact CD1-CG2 4.47Å; Y34-I156 HydrophobicContact CD2-CD1 4.17Å; Y34-I156 HydrophobicContact CG-CB 4.33Å; Y34-I156 HydrophobicContact CG-CD1 3.87Å; Y34-I156 HydrophobicContact CG-CG1 4.01Å; F152-I156 HydrophobicContact CD2-CG2 3.74Å; F152-I156 HydrophobicContact CE2-CG2 4.36Å; F154-I156 VanDerWaalsContact C-N 3.26Å; F154-I156 HydrophobicContact CD1-CB 4.19Å; F154-I156 HydrophobicContact CD1-CD1 4.32Å; F154-I156 HydrophobicContact CE1-CD1 4.13Å; F154-I156 PolarHBondContact O-N 3.41Å; I156-Y159 HydrophobicContact CD1-CD1 4Å; I156-Y159 PolarHBondContact O-N 3.35Å; I156-M160 HydrophobicContact CG1-CG 4.35Å; I156-M160 HydrophobicContact CG1-SD 4.22Å; I156-M160 WeakPolarHBondContact O-CB 3.42Å; I156-M160 VanDerWaalsContact O-CG 3.3Å; I156-M160 WeakPolarHBondContact O-CG 3.41Å; I156-M160 PolarHBondContact O-N 3.42Å
157	E	97	Very high	97.1	Very high	122 Å²	122	76.2 Å²	76.2	57%	0.57	38%	0.382	S	S	*	.	H	α-helix	trans	-68.1	-41.5	-179	-67.8	-64.1	162.7	0	0	111.3	D155 M160 R161	D155-E157 PolarHBondContact O-N 3.47Å; D155-E157 PolarHBondContact OD1-N 2.9Å; E157-M160 PolarHBondContact O-N 3.23Å; E157-R161 WeakPolarHBondContact O-CB 3.43Å; E157-R161 PolarHBondContact O-N 3.47Å
158	D	97.6	Very high	96.8	Very high	85 Å²	85	75.9 Å²	75.9	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-42.4	174.1	-168.4	59.8	0	0	0	111.8	D155 M160 R161 E162	D155-D158 HydrophobicContact CB-CB 4.4Å; D155-D158 PolarHBondContact OD1-N 2.99Å; D158-M160 PolarHBondContact O-N 2.95Å; D158-R161 WeakPolarHBondContact O-CB 3.38Å; D158-R161 PolarHBondContact O-N 3.49Å; D158-R161 IonicContact OD1-NH1 3.34Å; D158-E162 PolarHBondContact O-N 3.25Å
159	Y	97.4	Very high	96.7	Very high	35 Å²	35	74.8 Å²	74.8	14%	0.137	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-40.9	174.7	-179.5	-105.8	0	0	0	112.5	I32 N104 F111 I156 R161 E162 W163	I32-Y159 HydrophobicContact CD1-CD1 3.83Å; I32-Y159 HydrophobicContact CD1-CE1 3.58Å; I32-Y159 HydrophobicContact CG1-CE1 4.14Å; I32-Y159 HydrophobicContact CG2-CD1 4.04Å; I32-Y159 HydrophobicContact CG2-CE1 3.93Å; N104-Y159 PolarHBondContact ND2-OH 3.27Å; F111-Y159 HydrophobicContact CE1-CD1 4.41Å; F111-Y159 AromaticContact CE1-CE1 3.76Å; F111-Y159 HydrophobicContact CE1-CE1 3.76Å; F111-Y159 AromaticContact CE1-CE2 3.98Å; F111-Y159 HydrophobicContact CE1-CE2 3.98Å; F111-Y159 AromaticContact CE1-CZ 3.52Å; F111-Y159 HydrophobicContact CZ-CD1 4.34Å; F111-Y159 HydrophobicContact CZ-CD2 4.43Å; F111-Y159 HydrophobicContact CZ-CE1 4.15Å; F111-Y159 HydrophobicContact CZ-CE2 4.25Å; F111-Y159 HydrophobicContact CZ-CG 4.48Å; I156-Y159 HydrophobicContact CD1-CD1 4Å; I156-Y159 PolarHBondContact O-N 3.35Å; Y159-R161 VanDerWaalsContact C-N 3.34Å; Y159-E162 PolarHBondContact O-N 2.97Å; Y159-W163 AromaticContact CE1-CD1 3.86Å; Y159-W163 AromaticContact CE1-NE1 3.87Å; Y159-W163 AromaticContact CE2-CD1 3.89Å; Y159-W163 AromaticContact CE2-NE1 3.54Å; Y159-W163 AromaticContact CZ-CD1 3.61Å; Y159-W163 AromaticContact CZ-NE1 3.2Å; Y159-W163 PolarHBondContact O-N 3.1Å; Y159-W163 PolarHBondContact OH-NE1 3.31Å
160	M	96.7	Very high	96.5	Very high	46 Å²	46	76.3 Å²	76.3	23%	0.227	37%	0.374	C	S	.	.	H	α-helix	trans	-65.7	-36.3	174.6	-74.2	179.5	69.5	0	0	112.1	I32 I156 E157 D158 W163 R164 F538	I32-M160 HydrophobicContact CB-CG 4.15Å; I32-M160 HydrophobicContact CD1-CG 4.05Å; I32-M160 HydrophobicContact CG2-CG 4.18Å; I156-M160 HydrophobicContact CG1-CG 4.35Å; I156-M160 HydrophobicContact CG1-SD 4.22Å; I156-M160 WeakPolarHBondContact O-CB 3.42Å; I156-M160 VanDerWaalsContact O-CG 3.3Å; I156-M160 WeakPolarHBondContact O-CG 3.41Å; I156-M160 PolarHBondContact O-N 3.42Å; E157-M160 PolarHBondContact O-N 3.23Å; D158-M160 PolarHBondContact O-N 2.95Å; M160-W163 PolarHBondContact O-N 2.8Å; M160-R164 PolarHBondContact O-N 2.84Å; M160-F538 HydrophobicContact CB-CE1 4.21Å; M160-F538 HydrophobicContact CE-CE1 4.23Å; M160-F538 HydrophobicContact CE-CZ 4.29Å; M160-F538 WeakPolarHBondContact O-CE1 3.5Å
161	R	96.1	Very high	96.3	Very high	152 Å²	152	73 Å²	73	57%	0.574	36%	0.361	S	S	*	.	H	α-helix	trans	-63.6	-41.8	175.2	-171.5	-173.2	-58.8	158.8	2.6	112	E157 D158 Y159 W163 R164 T165	E157-R161 WeakPolarHBondContact O-CB 3.43Å; E157-R161 PolarHBondContact O-N 3.47Å; D158-R161 WeakPolarHBondContact O-CB 3.38Å; D158-R161 PolarHBondContact O-N 3.49Å; D158-R161 IonicContact OD1-NH1 3.34Å; Y159-R161 VanDerWaalsContact C-N 3.34Å; R161-W163 VanDerWaalsContact C-N 3.3Å; R161-W163 PolarHBondContact O-N 3.46Å; R161-R164 WeakPolarHBondContact O-CB 3.5Å; R161-R164 PolarHBondContact O-N 3.01Å; R161-T165 PolarHBondContact O-N 3.18Å; R161-T165 PolarHBondContact O-OG1 3.4Å
162	E	96.5	Very high	95.9	Very high	94 Å²	94	72.3 Å²	72.3	44%	0.439	35%	0.35	S	S	.	.	H	α-helix	trans	-57.3	-45.7	175.4	-169.6	-166.3	159.4	0	0	111.2	D158 Y159 T165 K166	D158-E162 PolarHBondContact O-N 3.25Å; Y159-E162 PolarHBondContact O-N 2.97Å; E162-T165 PolarHBondContact O-N 3.04Å; E162-K166 WeakPolarHBondContact O-CG 3.46Å; E162-K166 PolarHBondContact O-N 3.01Å; E162-K166 WeakPolarHBondContact OE1-CE 3.14Å; E162-K166 IonicContact OE1-NZ 2.68Å; E162-K166 PolarHBondContact OE1-NZ 3.42Å
163	W	95.8	Very high	95.6	Very high	33 Å²	33	79.6 Å²	79.6	13%	0.125	38%	0.376	C	S	.	.	H	α-helix	trans	-68.4	-38.7	177.6	-83.2	95.9	0	0	0	113.2	I32 N104 I106 N107 Y159 M160 R161 T165 K166 I167 F538	I32-W163 HydrophobicContact CD1-CB 3.78Å; I32-W163 VanDerWaalsContact CD1-CD1 3.49Å; I32-W163 HydrophobicContact CD1-CG 3.68Å; N104-W163 WeakPolarHBondContact ND2-CZ2 3.48Å; N104-W163 PolarHBondContact ND2-NE1 2.86Å; I106-W163 HydrophobicContact CB-CE3 4.4Å; I106-W163 HydrophobicContact CB-CZ3 4.11Å; I106-W163 HydrophobicContact CD1-CB 4.28Å; I106-W163 HydrophobicContact CD1-CD2 3.86Å; I106-W163 HydrophobicContact CD1-CE3 3.36Å; I106-W163 HydrophobicContact CD1-CG 4.27Å; I106-W163 HydrophobicContact CD1-CZ3 3.94Å; I106-W163 HydrophobicContact CG1-CE3 4.49Å; I106-W163 HydrophobicContact CG2-CE3 4.29Å; I106-W163 HydrophobicContact CG2-CZ3 3.82Å; N107-W163 HydrophobicContact CB-CH2 4.35Å; N107-W163 WeakPolarHBondContact ND2-CH2 3.33Å; Y159-W163 AromaticContact CE1-CD1 3.86Å; Y159-W163 AromaticContact CE1-NE1 3.87Å; Y159-W163 AromaticContact CE2-CD1 3.89Å; Y159-W163 AromaticContact CE2-NE1 3.54Å; Y159-W163 AromaticContact CZ-CD1 3.61Å; Y159-W163 AromaticContact CZ-NE1 3.2Å; Y159-W163 PolarHBondContact O-N 3.1Å; Y159-W163 PolarHBondContact OH-NE1 3.31Å; M160-W163 PolarHBondContact O-N 2.8Å; R161-W163 VanDerWaalsContact C-N 3.3Å; R161-W163 PolarHBondContact O-N 3.46Å; W163-T165 VanDerWaalsContact C-N 3.33Å; W163-T165 PolarHBondContact O-N 3.45Å; W163-K166 HydrophobicContact CD2-CD 4.49Å; W163-K166 HydrophobicContact CE3-CD 4.39Å; W163-K166 PolarHBondContact O-N 2.65Å; W163-I167 WeakPolarHBondContact O-CG1 3.21Å; W163-I167 PolarHBondContact O-N 3.42Å; W163-F538 HydrophobicContact CB-CZ 4.43Å
164	R	94.7	Very high	95.1	Very high	105 Å²	105	82.6 Å²	82.6	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-55.2	-49.4	172.4	-171.8	178	-63.9	-82	-2.2	111.2	M160 R161 K166 I167 Q168 F538	M160-R164 PolarHBondContact O-N 2.84Å; R161-R164 WeakPolarHBondContact O-CB 3.5Å; R161-R164 PolarHBondContact O-N 3.01Å; R164-K166 VanDerWaalsContact C-N 3.33Å; R164-K166 PolarHBondContact O-N 2.76Å; R164-I167 PolarHBondContact O-N 3.07Å; R164-Q168 WeakPolarHBondContact O-CB 3.47Å; R164-Q168 PolarHBondContact O-N 2.88Å; R164-F538 HydrophobicContact CB-CD1 3.86Å; R164-F538 HydrophobicContact CG-CD1 4.4Å
165	T	95	Very high	94.6	Very high	91 Å²	91	86 Å²	86	56%	0.558	41%	0.407	S	S	*	.	H	α-helix	trans	-60.9	-40.1	177.5	-57.9	0	0	0	0	112.2	R161 E162 W163 A169	R161-T165 PolarHBondContact O-N 3.18Å; R161-T165 PolarHBondContact O-OG1 3.4Å; E162-T165 PolarHBondContact O-N 3.04Å; W163-T165 VanDerWaalsContact C-N 3.33Å; W163-T165 PolarHBondContact O-N 3.45Å; T165-A169 WeakPolarHBondContact O-CB 3.2Å; T165-A169 PolarHBondContact O-N 2.9Å
166	K	95.9	Very high	93.9	Very high	85 Å²	85	84.9 Å²	84.9	37%	0.37	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-45.6	176.4	-73.9	174.3	-175.4	167.7	0	112.3	E162 W163 R164 A169 Q170	E162-K166 WeakPolarHBondContact O-CG 3.46Å; E162-K166 PolarHBondContact O-N 3.01Å; E162-K166 WeakPolarHBondContact OE1-CE 3.14Å; E162-K166 IonicContact OE1-NZ 2.68Å; E162-K166 PolarHBondContact OE1-NZ 3.42Å; W163-K166 HydrophobicContact CD2-CD 4.49Å; W163-K166 HydrophobicContact CE3-CD 4.39Å; W163-K166 PolarHBondContact O-N 2.65Å; R164-K166 VanDerWaalsContact C-N 3.33Å; R164-K166 PolarHBondContact O-N 2.76Å; K166-A169 PolarHBondContact O-N 2.66Å; K166-Q170 WeakPolarHBondContact O-CG 3.5Å; K166-Q170 PolarHBondContact O-N 3.1Å
167	I	94.5	Very high	92.7	Very high	6 Å²	6	87.2 Å²	87.2	3%	0.031	43%	0.428	C	S	.	.	H	α-helix	trans	-66.4	-42.4	178.5	-63.9	-53.8	0	0	0	110.5	I106 W163 R164 A169 Q170 I171 F538	I106-I167 HydrophobicContact CD1-CG1 4.45Å; I106-I167 HydrophobicContact CG2-CD1 4.22Å; W163-I167 WeakPolarHBondContact O-CG1 3.21Å; W163-I167 PolarHBondContact O-N 3.42Å; R164-I167 PolarHBondContact O-N 3.07Å; I167-A169 PolarHBondContact O-N 3.41Å; I167-Q170 WeakPolarHBondContact O-CB 3.38Å; I167-Q170 PolarHBondContact O-N 3.25Å; I167-Q170 VanDerWaalsContact O-N 3.11Å; I167-I171 HydrophobicContact CG2-CD1 3.99Å; I167-I171 WeakPolarHBondContact O-CG1 3.5Å; I167-I171 PolarHBondContact O-N 3.28Å; I167-F538 HydrophobicContact CB-CB 4.08Å; I167-F538 HydrophobicContact CG1-CB 4.1Å; I167-F538 HydrophobicContact CG2-CB 4.18Å
168	Q	93.2	Very high	90.9	Very high	54 Å²	54	88.8 Å²	88.8	25%	0.252	44%	0.44	S	S	.	.	H	α-helix	trans	-56.4	-50.6	174.3	-172.4	58.5	48.6	0	0	111.4	R164 Q170 I171 D172 Y544	R164-Q168 WeakPolarHBondContact O-CB 3.47Å; R164-Q168 PolarHBondContact O-N 2.88Å; Q168-Q170 PolarHBondContact O-N 2.93Å; Q168-I171 WeakPolarHBondContact O-CB 3.49Å; Q168-I171 PolarHBondContact O-N 3.31Å; Q168-D172 PolarHBondContact NE2-OD1 3.43Å; Q168-D172 VanDerWaalsContact O-CG 3.24Å; Q168-D172 PolarHBondContact O-N 2.94Å; Q168-Y544 VanDerWaalsContact NE2-CZ 3.31Å; Q168-Y544 PolarHBondContact NE2-OH 3.39Å; Q168-Y544 PolarHBondContact OE1-OH 3.08Å
169	A	94.4	Very high	89.8	Confident	27 Å²	27	93 Å²	93	22%	0.223	45%	0.45	C	S	.	.	H	α-helix	trans	-62.5	-28.9	177.9	0	0	0	0	0	113.4	T165 K166 I167 R173	T165-A169 WeakPolarHBondContact O-CB 3.2Å; T165-A169 PolarHBondContact O-N 2.9Å; K166-A169 PolarHBondContact O-N 2.66Å; I167-A169 PolarHBondContact O-N 3.41Å; A169-R173 VanDerWaalsContact O-CB 3.31Å; A169-R173 WeakPolarHBondContact O-CB 3.17Å; A169-R173 WeakPolarHBondContact O-CD 3.29Å; A169-R173 WeakPolarHBondContact O-CG 3.31Å; A169-R173 PolarHBondContact O-N 2.94Å
170	Q	94	Very high	88.6	Confident	127 Å²	127	100.9 Å²	100.9	59%	0.593	49%	0.488	S	S	*	.	H	α-helix	trans	-70.7	-39.4	172.9	-75.9	179.4	-13.5	0	0	112	K166 I167 Q168 F174	K166-Q170 WeakPolarHBondContact O-CG 3.5Å; K166-Q170 PolarHBondContact O-N 3.1Å; I167-Q170 WeakPolarHBondContact O-CB 3.38Å; I167-Q170 PolarHBondContact O-N 3.25Å; I167-Q170 VanDerWaalsContact O-N 3.11Å; Q168-Q170 PolarHBondContact O-N 2.93Å; Q170-F174 PolarHBondContact O-N 3.21Å
171	I	92.2	Very high	88	Confident	67 Å²	67	100.7 Å²	100.7	34%	0.344	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-48.3	176.8	-66.1	166.3	0	0	0	109.9	I167 Q168 R173 F174 A539 Y544	I167-I171 HydrophobicContact CG2-CD1 3.99Å; I167-I171 WeakPolarHBondContact O-CG1 3.5Å; I167-I171 PolarHBondContact O-N 3.28Å; Q168-I171 WeakPolarHBondContact O-CB 3.49Å; Q168-I171 PolarHBondContact O-N 3.31Å; I171-R173 PolarHBondContact O-N 2.82Å; I171-F174 WeakPolarHBondContact O-CB 3.47Å; I171-F174 PolarHBondContact O-N 3.43Å; I171-A539 HydrophobicContact CD1-CB 3.8Å; I171-Y544 VanDerWaalsContact CD1-OH 3.25Å; I171-Y544 WeakPolarHBondContact CD1-OH 3.35Å; I171-Y544 HydrophobicContact CG2-CE1 4.24Å; I171-Y544 WeakPolarHBondContact CG2-OH 3.41Å
172	D	90.3	Very high	87.5	Confident	109 Å²	109	98.2 Å²	98.2	58%	0.583	49%	0.493	S	S	*	.	H	α-helix	trans	-63	-31.3	-178.5	-61.3	-22.3	0	0	0	112.9	Q168	Q168-D172 PolarHBondContact NE2-OD1 3.43Å; Q168-D172 VanDerWaalsContact O-CG 3.24Å; Q168-D172 PolarHBondContact O-N 2.94Å
173	R	91.9	Very high	87.2	Confident	209 Å²	209	98.8 Å²	98.8	79%	0.789	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	3.4	178.8	-65.9	173.9	-174.5	174	2.4	113.3	A169 I171	A169-R173 VanDerWaalsContact O-CB 3.31Å; A169-R173 WeakPolarHBondContact O-CB 3.17Å; A169-R173 WeakPolarHBondContact O-CD 3.29Å; A169-R173 WeakPolarHBondContact O-CG 3.31Å; A169-R173 PolarHBondContact O-N 2.94Å; I171-R173 PolarHBondContact O-N 2.82Å
174	F	90	Very high	86.9	Confident	145 Å²	145	102.4 Å²	102.4	64%	0.636	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-60.4	127.3	-178.5	-168.9	-92.6	0	0	0	109.4	Q170 I171 I176	Q170-F174 PolarHBondContact O-N 3.21Å; I171-F174 WeakPolarHBondContact O-CB 3.47Å; I171-F174 PolarHBondContact O-N 3.43Å; F174-I176 PolarHBondContact O-N 3.21Å; F174-I176 VanDerWaalsContact O-N 3.1Å
175	P	87.6	Confident	86.7	Confident	99 Å²	99	99.8 Å²	99.8	64%	0.643	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-66.6	116.9	-175.4	27	-33.8	0	0	0	109.5
176	I	82.5	Confident	86.6	Confident	78 Å²	78	100.1 Å²	100.1	40%	0.4	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-94.7	129.3	170.1	-66.1	157.6	0	0	0	106.3	F174 D178 W183	F174-I176 PolarHBondContact O-N 3.21Å; F174-I176 VanDerWaalsContact O-N 3.1Å; I176-D178 PolarHBondContact O-N 3.26Å; I176-W183 HydrophobicContact CB-CD2 4.48Å; I176-W183 HydrophobicContact CD1-CD2 4.36Å; I176-W183 HydrophobicContact CD1-CZ2 3.86Å; I176-W183 HydrophobicContact CG1-CZ2 4.35Å; I176-W183 HydrophobicContact CG2-CB 3.7Å; I176-W183 HydrophobicContact CG2-CD2 3.27Å; I176-W183 HydrophobicContact CG2-CE3 3.48Å; I176-W183 VanDerWaalsContact CG2-CE3 3.48Å; I176-W183 HydrophobicContact CG2-CG 3.38Å; I176-W183 HydrophobicContact CG2-CZ2 4.44Å; I176-W183 HydrophobicContact CG2-CZ3 4.17Å
177	G	72.9	Confident	86.4	Confident	62 Å²	62	99 Å²	99	64%	0.639	50%	0.499	S	S	*	.			trans	-44.2	130.4	-170	0	0	0	0	0	114.9	R179	G177-R179 PolarHBondContact O-N 3.21Å
178	D	60.3	Low	86.4	Confident	155 Å²	155	101.2 Å²	101.2	83%	0.829	51%	0.509	S	S	*	.			trans	-76.2	15.5	-160.5	-55.2	-38	0	0	0	116.5	I176 E180	I176-D178 PolarHBondContact O-N 3.26Å; D178-E180 PolarHBondContact O-N 2.9Å; D178-E180 VanDerWaalsContact O-N 3.17Å
179	R	74	Confident	86.4	Confident	175 Å²	175	104.3 Å²	104.3	66%	0.66	52%	0.522	S	S	*	.	S	Bend	trans	-78.9	109.9	176.9	-71.6	-173.4	177.9	-176.9	2.7	108.9	G177 G181 E182	G177-R179 PolarHBondContact O-N 3.21Å; R179-G181 PolarHBondContact O-N 3.48Å; R179-G181 VanDerWaalsContact O-N 3.12Å; R179-E182 HydrophobicContact CB-CB 4.14Å; R179-E182 HydrophobicContact CB-CG 3.71Å; R179-E182 WeakPolarHBondContact CB-OE2 3.49Å; R179-E182 WeakPolarHBondContact CD-OE1 3.48Å; R179-E182 WeakPolarHBondContact CD-OE2 3.42Å; R179-E182 IonicContact CZ-OE1 3.35Å; R179-E182 IonicContact NE-OE1 3.09Å; R179-E182 IonicContact NH1-OE1 2.76Å; R179-E182 PolarHBondContact NH1-OE1 2.93Å; R179-E182 VanDerWaalsContact NH1-OE1 3.11Å; R179-E182 PolarHBondContact O-N 3.38Å
180	E	73.3	Confident	86.4	Confident	199 Å²	199	104.9 Å²	104.9	93%	0.93	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.2	119.3	-179.3	-73.8	-174.9	163.6	0	0	111.1	D178 E182	D178-E180 PolarHBondContact O-N 2.9Å; D178-E180 VanDerWaalsContact O-N 3.17Å; E180-E182 VanDerWaalsContact C-N 3.35Å; E180-E182 PolarHBondContact O-N 2.87Å
181	G	82.3	Confident	86.4	Confident	42 Å²	42	101 Å²	101	43%	0.433	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	-22.7	176.6	0	0	0	0	0	116.6	R179 W183 Q184 T185	R179-G181 PolarHBondContact O-N 3.48Å; R179-G181 VanDerWaalsContact O-N 3.12Å; G181-W183 VanDerWaalsContact C-N 3.32Å; G181-W183 PolarHBondContact O-N 3.01Å; G181-Q184 PolarHBondContact O-N 3.4Å; G181-Q184 VanDerWaalsContact O-N 3.11Å; G181-T185 PolarHBondContact O-N 3.45Å; G181-T185 PolarHBondContact O-OG1 2.86Å; G181-T185 VanDerWaalsContact O-OG1 3.12Å
182	E	86.8	Confident	86.5	Confident	101 Å²	101	98.1 Å²	98.1	47%	0.472	49%	0.491	S	S	.	.	H	α-helix	trans	-59.9	-41	-175	-75.8	-170.9	179.3	0	0	112.4	R179 E180 T185 M186	R179-E182 HydrophobicContact CB-CB 4.14Å; R179-E182 HydrophobicContact CB-CG 3.71Å; R179-E182 WeakPolarHBondContact CB-OE2 3.49Å; R179-E182 WeakPolarHBondContact CD-OE1 3.48Å; R179-E182 WeakPolarHBondContact CD-OE2 3.42Å; R179-E182 IonicContact CZ-OE1 3.35Å; R179-E182 IonicContact NE-OE1 3.09Å; R179-E182 IonicContact NH1-OE1 2.76Å; R179-E182 PolarHBondContact NH1-OE1 2.93Å; R179-E182 VanDerWaalsContact NH1-OE1 3.11Å; R179-E182 PolarHBondContact O-N 3.38Å; E180-E182 VanDerWaalsContact C-N 3.35Å; E180-E182 PolarHBondContact O-N 2.87Å; E182-T185 PolarHBondContact O-N 3.3Å; E182-M186 WeakPolarHBondContact O-CB 3.36Å; E182-M186 PolarHBondContact O-N 3.38Å
183	W	88.9	Confident	86.7	Confident	105 Å²	105	94.7 Å²	94.7	40%	0.398	48%	0.476	S	S	.	.	H	α-helix	trans	-62.4	-45.5	175.7	178.9	-119.7	0	0	0	112.8	I176 G181 M186 I187	I176-W183 HydrophobicContact CB-CD2 4.48Å; I176-W183 HydrophobicContact CD1-CD2 4.36Å; I176-W183 HydrophobicContact CD1-CZ2 3.86Å; I176-W183 HydrophobicContact CG1-CZ2 4.35Å; I176-W183 HydrophobicContact CG2-CB 3.7Å; I176-W183 HydrophobicContact CG2-CD2 3.27Å; I176-W183 HydrophobicContact CG2-CE3 3.48Å; I176-W183 VanDerWaalsContact CG2-CE3 3.48Å; I176-W183 HydrophobicContact CG2-CG 3.38Å; I176-W183 HydrophobicContact CG2-CZ2 4.44Å; I176-W183 HydrophobicContact CG2-CZ3 4.17Å; G181-W183 VanDerWaalsContact C-N 3.32Å; G181-W183 PolarHBondContact O-N 3.01Å; W183-M186 HydrophobicContact CE3-SD 4.21Å; W183-M186 HydrophobicContact CZ3-SD 4.09Å; W183-M186 WeakPolarHBondContact O-CB 3.41Å; W183-M186 PolarHBondContact O-N 3.12Å; W183-I187 HydrophobicContact CD2-CD1 4.13Å; W183-I187 HydrophobicContact CD2-CG1 4.36Å; W183-I187 VanDerWaalsContact CE2-CD1 3.45Å; W183-I187 HydrophobicContact CG-CD1 4.41Å; W183-I187 HydrophobicContact CZ2-CD1 3.79Å; W183-I187 HydrophobicContact CZ2-CG1 4.24Å; W183-I187 PolarHBondContact O-N 3.44Å
184	Q	90.1	Very high	86.8	Confident	109 Å²	109	88.6 Å²	88.6	51%	0.509	45%	0.453	S	S	.	.	H	α-helix	trans	-65.6	-43.6	179.9	-62.1	-59.8	-13.4	0	0	110.7	G181 M186 I187 Q188	G181-Q184 PolarHBondContact O-N 3.4Å; G181-Q184 VanDerWaalsContact O-N 3.11Å; Q184-M186 VanDerWaalsContact C-N 3.3Å; Q184-M186 PolarHBondContact O-N 2.96Å; Q184-I187 PolarHBondContact O-N 3.32Å; Q184-Q188 WeakPolarHBondContact O-CB 3.37Å; Q184-Q188 WeakPolarHBondContact O-CG 3.31Å; Q184-Q188 PolarHBondContact O-N 3.35Å
185	T	91	Very high	87	Confident	51 Å²	51	82.7 Å²	82.7	31%	0.313	43%	0.428	S	S	.	.	H	α-helix	trans	-60.6	-39.1	173.4	-58.5	0	0	0	0	111.7	G181 E182 Q188 K189	G181-T185 PolarHBondContact O-N 3.45Å; G181-T185 PolarHBondContact O-OG1 2.86Å; G181-T185 VanDerWaalsContact O-OG1 3.12Å; E182-T185 PolarHBondContact O-N 3.3Å; T185-Q188 PolarHBondContact O-N 3.32Å; T185-K189 HydrophobicContact CG2-CD 4.2Å; T185-K189 WeakPolarHBondContact O-CB 3.43Å; T185-K189 VanDerWaalsContact O-CG 3.27Å; T185-K189 WeakPolarHBondContact O-CG 3.35Å; T185-K189 PolarHBondContact O-N 2.91Å
186	M	91.5	Very high	87.3	Confident	98 Å²	98	78.6 Å²	78.6	48%	0.483	40%	0.401	S	S	.	.	H	α-helix	trans	-63.1	-50	176.6	-173.4	-175.4	-56.9	0	0	111.5	E182 W183 Q184 Q188 K189 M190	E182-M186 WeakPolarHBondContact O-CB 3.36Å; E182-M186 PolarHBondContact O-N 3.38Å; W183-M186 HydrophobicContact CE3-SD 4.21Å; W183-M186 HydrophobicContact CZ3-SD 4.09Å; W183-M186 WeakPolarHBondContact O-CB 3.41Å; W183-M186 PolarHBondContact O-N 3.12Å; Q184-M186 VanDerWaalsContact C-N 3.3Å; Q184-M186 PolarHBondContact O-N 2.96Å; M186-Q188 VanDerWaalsContact C-N 3.35Å; M186-Q188 PolarHBondContact O-N 3.16Å; M186-K189 PolarHBondContact O-N 3.45Å; M186-M190 HydrophobicContact CG-SD 4.17Å; M186-M190 VanDerWaalsContact O-CG 3.29Å; M186-M190 WeakPolarHBondContact O-CG 3.3Å; M186-M190 PolarHBondContact O-N 3.34Å
187	I	92.4	Very high	87.8	Confident	62 Å²	62	75.4 Å²	75.4	32%	0.318	38%	0.384	S	S	.	.	H	α-helix	trans	-58.8	-47.5	176.6	-69.7	176.1	0	0	0	110.4	W183 Q184 K189 M190 V191	W183-I187 HydrophobicContact CD2-CD1 4.13Å; W183-I187 HydrophobicContact CD2-CG1 4.36Å; W183-I187 VanDerWaalsContact CE2-CD1 3.45Å; W183-I187 HydrophobicContact CG-CD1 4.41Å; W183-I187 HydrophobicContact CZ2-CD1 3.79Å; W183-I187 HydrophobicContact CZ2-CG1 4.24Å; W183-I187 PolarHBondContact O-N 3.44Å; Q184-I187 PolarHBondContact O-N 3.32Å; I187-K189 VanDerWaalsContact C-N 3.32Å; I187-K189 PolarHBondContact O-N 3.42Å; I187-M190 WeakPolarHBondContact O-CB 3.36Å; I187-M190 PolarHBondContact O-N 2.9Å; I187-M190 VanDerWaalsContact O-N 3.09Å; I187-V191 HydrophobicContact CG2-CG2 4.17Å; I187-V191 WeakPolarHBondContact O-CG2 3.43Å; I187-V191 PolarHBondContact O-N 2.99Å
188	Q	94.3	Very high	88.7	Confident	51 Å²	51	75.4 Å²	75.4	24%	0.238	37%	0.368	C	S	.	.	H	α-helix	trans	-58.3	-42.7	178.7	-71.8	166.4	-3.2	0	0	111.9	Q184 T185 M186 V191 S192 F207 T211 Q213	Q184-Q188 WeakPolarHBondContact O-CB 3.37Å; Q184-Q188 WeakPolarHBondContact O-CG 3.31Å; Q184-Q188 PolarHBondContact O-N 3.35Å; T185-Q188 PolarHBondContact O-N 3.32Å; M186-Q188 VanDerWaalsContact C-N 3.35Å; M186-Q188 PolarHBondContact O-N 3.16Å; Q188-V191 PolarHBondContact O-N 3.15Å; Q188-S192 VanDerWaalsContact O-CB 3.25Å; Q188-S192 WeakPolarHBondContact O-CB 3.45Å; Q188-S192 PolarHBondContact O-N 3.01Å; Q188-F207 HydrophobicContact CB-CE1 4.26Å; Q188-F207 HydrophobicContact CB-CZ 4.26Å; Q188-F207 HydrophobicContact CG-CZ 4.17Å; Q188-F207 WeakPolarHBondContact O-CE1 3.31Å; Q188-T211 HydrophobicContact CG-CG2 4.07Å; Q188-Q213 HydrophobicContact CB-CG 4.06Å
189	K	93.6	Very high	90.1	Very high	120 Å²	120	68.3 Å²	68.3	52%	0.522	33%	0.332	S	S	.	.	H	α-helix	trans	-61.6	-43.4	173.9	-75.5	174.8	179.5	175.6	0	112.3	T185 M186 I187 S193	T185-K189 HydrophobicContact CG2-CD 4.2Å; T185-K189 WeakPolarHBondContact O-CB 3.43Å; T185-K189 VanDerWaalsContact O-CG 3.27Å; T185-K189 WeakPolarHBondContact O-CG 3.35Å; T185-K189 PolarHBondContact O-N 2.91Å; M186-K189 PolarHBondContact O-N 3.45Å; I187-K189 VanDerWaalsContact C-N 3.32Å; I187-K189 PolarHBondContact O-N 3.42Å; K189-S193 VanDerWaalsContact O-CB 3.31Å; K189-S193 WeakPolarHBondContact O-CB 3.39Å; K189-S193 PolarHBondContact O-N 2.83Å
190	M	94.2	Very high	91	Very high	38 Å²	38	65.6 Å²	65.6	19%	0.187	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-44.4	179.3	-68.6	175.3	65	0	0	111.6	M186 I187 Y194 P513 L514 A517	M186-M190 HydrophobicContact CG-SD 4.17Å; M186-M190 VanDerWaalsContact O-CG 3.29Å; M186-M190 WeakPolarHBondContact O-CG 3.3Å; M186-M190 PolarHBondContact O-N 3.34Å; I187-M190 WeakPolarHBondContact O-CB 3.36Å; I187-M190 PolarHBondContact O-N 2.9Å; I187-M190 VanDerWaalsContact O-N 3.09Å; M190-Y194 WeakPolarHBondContact O-CB 3.46Å; M190-Y194 PolarHBondContact O-N 2.82Å; M190-P513 HydrophobicContact CG-CB 4.17Å; M190-L514 HydrophobicContact CB-CB 4.37Å; M190-L514 HydrophobicContact CE-CB 4.22Å; M190-L514 HydrophobicContact CE-CD1 4.04Å; M190-A517 HydrophobicContact CE-CB 3.83Å
191	V	94.8	Very high	91.7	Very high	45 Å²	45	56.6 Å²	56.6	27%	0.273	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-47.5	176.6	173.5	0	0	0	0	110.8	I187 Q188 S193 Y194 L195 F207	I187-V191 HydrophobicContact CG2-CG2 4.17Å; I187-V191 WeakPolarHBondContact O-CG2 3.43Å; I187-V191 PolarHBondContact O-N 2.99Å; Q188-V191 PolarHBondContact O-N 3.15Å; V191-S193 VanDerWaalsContact C-N 3.34Å; V191-S193 PolarHBondContact O-N 3.4Å; V191-Y194 WeakPolarHBondContact O-CB 3.4Å; V191-Y194 PolarHBondContact O-N 3.35Å; V191-Y194 VanDerWaalsContact O-N 3.13Å; V191-L195 HydrophobicContact CG1-CD1 4.06Å; V191-L195 HydrophobicContact CG1-CG 4.38Å; V191-L195 WeakPolarHBondContact O-CG 3.44Å; V191-L195 PolarHBondContact O-N 2.82Å; V191-F207 HydrophobicContact CB-CE1 4.21Å; V191-F207 HydrophobicContact CB-CZ 4.02Å; V191-F207 HydrophobicContact CG1-CE1 4.07Å; V191-F207 HydrophobicContact CG1-CE2 4.08Å; V191-F207 HydrophobicContact CG1-CZ 3.79Å
192	S	94.5	Very high	92.1	Very high	7 Å²	7	58 Å²	58	5%	0.049	29%	0.289	C	S	.	.	H	α-helix	trans	-57.5	-46.6	176.6	-179.2	0	0	0	0	111.5	Q188 Y194 L195 V196	Q188-S192 VanDerWaalsContact O-CB 3.25Å; Q188-S192 WeakPolarHBondContact O-CB 3.45Å; Q188-S192 PolarHBondContact O-N 3.01Å; S192-Y194 VanDerWaalsContact C-N 3.32Å; S192-Y194 PolarHBondContact O-N 3.23Å; S192-L195 PolarHBondContact O-N 3.41Å; S192-V196 WeakPolarHBondContact O-CG2 3.44Å; S192-V196 PolarHBondContact O-N 3.36Å
193	S	93.6	Very high	92.5	Very high	38 Å²	38	57 Å²	57	27%	0.266	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-37.9	176.3	177.4	0	0	0	0	112.7	K189 V191 H197 P513	K189-S193 VanDerWaalsContact O-CB 3.31Å; K189-S193 WeakPolarHBondContact O-CB 3.39Å; K189-S193 PolarHBondContact O-N 2.83Å; V191-S193 VanDerWaalsContact C-N 3.34Å; V191-S193 PolarHBondContact O-N 3.4Å; S193-H197 VanDerWaalsContact O-CB 3.22Å; S193-H197 WeakPolarHBondContact O-CB 3.37Å; S193-H197 PolarHBondContact O-N 3.44Å; S193-P513 VanDerWaalsContact OG-CD 3.31Å; S193-P513 WeakPolarHBondContact OG-CD 3.44Å
194	Y	94.7	Very high	92.7	Very high	80 Å²	80	52 Å²	52	31%	0.314	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-47.7	175.3	175.9	-92.3	0	0	0	111.7	M190 V191 S192 V196 H197 H198 Y200 P512 L514	M190-Y194 WeakPolarHBondContact O-CB 3.46Å; M190-Y194 PolarHBondContact O-N 2.82Å; V191-Y194 WeakPolarHBondContact O-CB 3.4Å; V191-Y194 PolarHBondContact O-N 3.35Å; V191-Y194 VanDerWaalsContact O-N 3.13Å; S192-Y194 VanDerWaalsContact C-N 3.32Å; S192-Y194 PolarHBondContact O-N 3.23Å; Y194-V196 VanDerWaalsContact C-N 3.34Å; Y194-V196 PolarHBondContact O-N 3.13Å; Y194-H197 PolarHBondContact O-N 2.87Å; Y194-H198 AromaticContact CD2-CD2 3.61Å; Y194-H198 AromaticContact CD2-NE2 3.84Å; Y194-H198 AromaticContact CE2-CD2 3.31Å; Y194-H198 WeakPolarHBondContact CE2-CD2 3.41Å; Y194-H198 AromaticContact CE2-NE2 3.31Å; Y194-H198 VanDerWaalsContact CE2-NE2 3.31Å; Y194-H198 WeakPolarHBondContact CE2-NE2 3.42Å; Y194-H198 AromaticContact CZ-CD2 3.61Å; Y194-H198 AromaticContact CZ-NE2 3.89Å; Y194-H198 PolarHBondContact O-CD2 3.24Å; Y194-H198 PolarHBondContact O-N 3.3Å; Y194-Y200 HydrophobicContact CE1-CE2 4.41Å; Y194-P512 HydrophobicContact CD2-CB 4.23Å; Y194-P512 HydrophobicContact CD2-CG 3.72Å; Y194-L514 HydrophobicContact CD2-CD2 4.37Å; Y194-L514 HydrophobicContact CG-CD2 4.27Å
195	L	93.9	Very high	92.7	Very high	21 Å²	21	49.8 Å²	49.8	11%	0.11	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-44.7	179.1	-66.7	171.2	0	0	0	111.6	V191 S192 G199 Y200 T203 A204 F207	V191-L195 HydrophobicContact CG1-CD1 4.06Å; V191-L195 HydrophobicContact CG1-CG 4.38Å; V191-L195 WeakPolarHBondContact O-CG 3.44Å; V191-L195 PolarHBondContact O-N 2.82Å; S192-L195 PolarHBondContact O-N 3.41Å; L195-G199 PolarHBondContact O-N 3.36Å; L195-G199 VanDerWaalsContact O-N 3.16Å; L195-Y200 HydrophobicContact CD2-CD2 4.13Å; L195-Y200 HydrophobicContact CD2-CG 4.25Å; L195-Y200 PolarHBondContact O-N 2.93Å; L195-T203 HydrophobicContact CD1-CG2 4.12Å; L195-T203 HydrophobicContact CD2-CG2 4.03Å; L195-A204 HydrophobicContact CB-CB 3.82Å; L195-F207 HydrophobicContact CD1-CB 4.04Å; L195-F207 HydrophobicContact CD1-CD1 4.4Å; L195-F207 HydrophobicContact CD1-CG 4.14Å
196	V	93.4	Very high	92.9	Very high	14 Å²	14	49.6 Å²	49.6	9%	0.085	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-44.5	177.2	173.6	0	0	0	0	111.4	S192 Y194 H198 G199 A204 V215 E217 I222 R225	S192-V196 WeakPolarHBondContact O-CG2 3.44Å; S192-V196 PolarHBondContact O-N 3.36Å; Y194-V196 VanDerWaalsContact C-N 3.34Å; Y194-V196 PolarHBondContact O-N 3.13Å; V196-H198 VanDerWaalsContact C-N 3.34Å; V196-H198 PolarHBondContact O-N 2.86Å; V196-G199 PolarHBondContact O-N 3.42Å; V196-G199 VanDerWaalsContact O-N 3.12Å; V196-A204 HydrophobicContact CG2-CB 3.94Å; V196-V215 HydrophobicContact CG1-CG1 4.42Å; V196-V215 HydrophobicContact CG2-CG1 3.76Å; V196-V215 HydrophobicContact CG2-CG2 4.2Å; V196-E217 HydrophobicContact CG1-CB 4.13Å; V196-I222 HydrophobicContact CG1-CD1 3.86Å; V196-I222 HydrophobicContact CG1-CG1 4.21Å; V196-R225 PolarHBondContact O-NH2 3.01Å
197	H	93.2	Very high	93.1	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.046	25%	0.251	C	S	.	.	H	α-helix	trans	-57.5	-46.8	-179.9	177.4	-80.5	0	0	0	111.7	S193 Y194 G199 R225 N499 L503 K510 P512	S193-H197 VanDerWaalsContact O-CB 3.22Å; S193-H197 WeakPolarHBondContact O-CB 3.37Å; S193-H197 PolarHBondContact O-N 3.44Å; Y194-H197 PolarHBondContact O-N 2.87Å; H197-G199 VanDerWaalsContact C-N 3.27Å; H197-G199 PolarHBondContact O-N 3.34Å; H197-R225 PolarHBondContact O-NH1 3.22Å; H197-N499 PolarHBondContact CE1-ND2 2.9Å; H197-N499 PolarHBondContact O-ND2 2.83Å; H197-L503 WeakPolarHBondContact CD2-CD1 3.49Å; H197-K510 PolarHBondContact NE2-O 2.76Å; H197-P512 HydrophobicContact CB-CB 4.24Å; H197-P512 HydrophobicContact CB-CG 4.39Å
198	H	92.2	Very high	93.1	Very high	62 Å²	62	44.9 Å²	44.9	29%	0.287	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	3.2	-179.8	-72.5	-81.3	0	0	0	114.3	Y194 V196 Y200	Y194-H198 AromaticContact CD2-CD2 3.61Å; Y194-H198 AromaticContact CD2-NE2 3.84Å; Y194-H198 AromaticContact CE2-CD2 3.31Å; Y194-H198 WeakPolarHBondContact CE2-CD2 3.41Å; Y194-H198 AromaticContact CE2-NE2 3.31Å; Y194-H198 VanDerWaalsContact CE2-NE2 3.31Å; Y194-H198 WeakPolarHBondContact CE2-NE2 3.42Å; Y194-H198 AromaticContact CZ-CD2 3.61Å; Y194-H198 AromaticContact CZ-NE2 3.89Å; Y194-H198 PolarHBondContact O-CD2 3.24Å; Y194-H198 PolarHBondContact O-N 3.3Å; V196-H198 VanDerWaalsContact C-N 3.34Å; V196-H198 PolarHBondContact O-N 2.86Å; H198-Y200 HydrophobicContact CB-CD2 3.58Å; H198-Y200 HydrophobicContact CB-CE2 3.31Å
199	G	90.5	Very high	93	Very high	7 Å²	7	50.6 Å²	50.6	7%	0.072	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	31.6	175.6	0	0	0	0	0	113.2	L195 V196 H197 C201 Q226	L195-G199 PolarHBondContact O-N 3.36Å; L195-G199 VanDerWaalsContact O-N 3.16Å; V196-G199 PolarHBondContact O-N 3.42Å; V196-G199 VanDerWaalsContact O-N 3.12Å; H197-G199 VanDerWaalsContact C-N 3.27Å; H197-G199 PolarHBondContact O-N 3.34Å; G199-C201 PolarHBondContact O-N 3.43Å; G199-Q226 WeakPolarHBondContact O-CG 3.34Å; G199-Q226 PolarHBondContact O-NE2 3.49Å
200	Y	91.3	Very high	93.1	Very high	117 Å²	117	49.2 Å²	49.2	46%	0.459	27%	0.266	S	S	.	.			trans	-82.4	58.8	170.9	-62.9	-76.4	0	0	0	110.6	Y194 L195 H198 A202 T203 A204	Y194-Y200 HydrophobicContact CE1-CE2 4.41Å; L195-Y200 HydrophobicContact CD2-CD2 4.13Å; L195-Y200 HydrophobicContact CD2-CG 4.25Å; L195-Y200 PolarHBondContact O-N 2.93Å; H198-Y200 HydrophobicContact CB-CD2 3.58Å; H198-Y200 HydrophobicContact CB-CE2 3.31Å; Y200-A202 PolarHBondContact O-N 2.86Å; Y200-T203 PolarHBondContact O-N 3.27Å; Y200-A204 WeakPolarHBondContact O-CB 3.48Å; Y200-A204 PolarHBondContact O-N 2.92Å
201	C	89.1	Confident	93.1	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-53.9	-52	-166.8	-164.8	0	0	0	0	113.6	G199 T203 A204 E205 I222 Q226	G199-C201 PolarHBondContact O-N 3.43Å; C201-T203 VanDerWaalsContact C-N 3.33Å; C201-T203 PolarHBondContact O-N 3Å; C201-A204 PolarHBondContact O-N 3.26Å; C201-E205 WeakPolarHBondContact O-CB 3.28Å; C201-E205 WeakPolarHBondContact O-CG 3.12Å; C201-E205 PolarHBondContact O-N 3.04Å; C201-I222 HydrophobicContact CB-CG2 4Å; C201-Q226 VanDerWaalsContact CB-NE2 3.31Å
202	A	91.1	Very high	92.9	Very high	73 Å²	73	53.7 Å²	53.7	60%	0.603	29%	0.29	S	S	*	.	H	α-helix	trans	-60.3	-43	-179.6	0	0	0	0	0	112.1	Y200 A206	Y200-A202 PolarHBondContact O-N 2.86Å; A202-A206 WeakPolarHBondContact O-CB 3.31Å; A202-A206 PolarHBondContact O-N 3.29Å
203	T	93.9	Very high	92.6	Very high	78 Å²	78	54.6 Å²	54.6	48%	0.479	29%	0.293	S	S	.	.	H	α-helix	trans	-67.3	-42.7	176.3	-45.6	0	0	0	0	111.5	L195 Y200 C201 A206 F207	L195-T203 HydrophobicContact CD1-CG2 4.12Å; L195-T203 HydrophobicContact CD2-CG2 4.03Å; Y200-T203 PolarHBondContact O-N 3.27Å; C201-T203 VanDerWaalsContact C-N 3.33Å; C201-T203 PolarHBondContact O-N 3Å; T203-A206 PolarHBondContact O-N 3.43Å; T203-F207 WeakPolarHBondContact O-CB 3.31Å; T203-F207 PolarHBondContact O-N 2.98Å
204	A	92.9	Very high	92.2	Very high	2 Å²	2	58.2 Å²	58.2	2%	0.017	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-43.3	178.2	0	0	0	0	0	111.4	L195 V196 Y200 C201 A208	L195-A204 HydrophobicContact CB-CB 3.82Å; V196-A204 HydrophobicContact CG2-CB 3.94Å; Y200-A204 WeakPolarHBondContact O-CB 3.48Å; Y200-A204 PolarHBondContact O-N 2.92Å; C201-A204 PolarHBondContact O-N 3.26Å; A204-A208 WeakPolarHBondContact O-CB 3.48Å; A204-A208 PolarHBondContact O-N 2.97Å
205	E	91.1	Very high	91.6	Very high	62 Å²	62	56.9 Å²	56.9	29%	0.29	31%	0.314	S	S	.	.	H	α-helix	trans	-65.9	-46.2	175.7	-74.6	179.3	-170.3	0	0	112.2	C201 F207 A208 R209 L219	C201-E205 WeakPolarHBondContact O-CB 3.28Å; C201-E205 WeakPolarHBondContact O-CG 3.12Å; C201-E205 PolarHBondContact O-N 3.04Å; E205-F207 VanDerWaalsContact C-N 3.32Å; E205-F207 PolarHBondContact O-N 2.94Å; E205-A208 PolarHBondContact O-N 3.41Å; E205-R209 WeakPolarHBondContact O-CG 3.34Å; E205-R209 PolarHBondContact O-N 3.02Å; E205-R209 IonicContact OE2-NH1 3.87Å; E205-L219 HydrophobicContact CG-CD2 4.23Å; E205-L219 WeakPolarHBondContact OE1-CD2 3.37Å
206	A	94.4	Very high	91	Very high	46 Å²	46	63.3 Å²	63.3	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-42.1	177.5	0	0	0	0	0	111.5	A202 T203 R209 S210	A202-A206 WeakPolarHBondContact O-CB 3.31Å; A202-A206 PolarHBondContact O-N 3.29Å; T203-A206 PolarHBondContact O-N 3.43Å; A206-R209 PolarHBondContact O-N 3.2Å; A206-S210 PolarHBondContact O-N 2.93Å; A206-S210 VanDerWaalsContact O-N 3.13Å; A206-S210 PolarHBondContact O-OG 3.24Å
207	F	95.1	Very high	90.5	Very high	50 Å²	50	63.5 Å²	63.5	22%	0.219	35%	0.348	C	S	.	.	H	α-helix	trans	-66.8	-44.4	176.7	-173.5	-94.9	0	0	0	111.9	Q188 V191 L195 T203 E205 R209 S210 T211	Q188-F207 HydrophobicContact CB-CE1 4.26Å; Q188-F207 HydrophobicContact CB-CZ 4.26Å; Q188-F207 HydrophobicContact CG-CZ 4.17Å; Q188-F207 WeakPolarHBondContact O-CE1 3.31Å; V191-F207 HydrophobicContact CB-CE1 4.21Å; V191-F207 HydrophobicContact CB-CZ 4.02Å; V191-F207 HydrophobicContact CG1-CE1 4.07Å; V191-F207 HydrophobicContact CG1-CE2 4.08Å; V191-F207 HydrophobicContact CG1-CZ 3.79Å; L195-F207 HydrophobicContact CD1-CB 4.04Å; L195-F207 HydrophobicContact CD1-CD1 4.4Å; L195-F207 HydrophobicContact CD1-CG 4.14Å; T203-F207 WeakPolarHBondContact O-CB 3.31Å; T203-F207 PolarHBondContact O-N 2.98Å; E205-F207 VanDerWaalsContact C-N 3.32Å; E205-F207 PolarHBondContact O-N 2.94Å; F207-R209 VanDerWaalsContact C-N 3.31Å; F207-R209 PolarHBondContact O-N 2.95Å; F207-S210 PolarHBondContact O-N 3.38Å; F207-S210 PolarHBondContact O-OG 3.13Å; F207-T211 HydrophobicContact CD1-CG2 4.47Å; F207-T211 HydrophobicContact CD2-CG2 4.34Å; F207-T211 HydrophobicContact CE1-CG2 4.1Å; F207-T211 HydrophobicContact CE2-CG2 3.98Å; F207-T211 HydrophobicContact CZ-CG2 3.85Å; F207-T211 WeakPolarHBondContact O-CB 3.39Å; F207-T211 PolarHBondContact O-N 3.31Å; F207-T211 PolarHBondContact O-OG1 2.96Å
208	A	92.4	Very high	90.2	Very high	12 Å²	12	70.3 Å²	70.3	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-59.3	-42.3	176.5	0	0	0	0	0	111.8	A204 E205 S210 D212 Q213 V215	A204-A208 WeakPolarHBondContact O-CB 3.48Å; A204-A208 PolarHBondContact O-N 2.97Å; E205-A208 PolarHBondContact O-N 3.41Å; A208-S210 PolarHBondContact O-N 3.08Å; A208-D212 PolarHBondContact O-N 3.36Å; A208-D212 VanDerWaalsContact O-N 3.08Å; A208-Q213 WeakPolarHBondContact CB-O 3.41Å; A208-Q213 PolarHBondContact O-N 3.01Å; A208-Q213 VanDerWaalsContact O-N 3.16Å; A208-V215 HydrophobicContact CB-CG2 3.95Å
209	R	93.4	Very high	89.8	Confident	171 Å²	171	71.3 Å²	71.3	65%	0.645	39%	0.387	S	S	*	.	H	α-helix	trans	-64.9	-34.2	175.2	-73.7	-170.4	-61.5	-94.4	1.8	113.6	E205 A206 F207	E205-R209 WeakPolarHBondContact O-CG 3.34Å; E205-R209 PolarHBondContact O-N 3.02Å; E205-R209 IonicContact OE2-NH1 3.87Å; A206-R209 PolarHBondContact O-N 3.2Å; F207-R209 VanDerWaalsContact C-N 3.31Å; F207-R209 PolarHBondContact O-N 2.95Å
210	S	94.9	Very high	89.8	Confident	91 Å²	91	73.8 Å²	73.8	64%	0.636	41%	0.406	S	S	*	.	H	α-helix	trans	-85.8	-15.7	-178.2	65.3	0	0	0	0	114.2	A206 F207 A208	A206-S210 PolarHBondContact O-N 2.93Å; A206-S210 VanDerWaalsContact O-N 3.13Å; A206-S210 PolarHBondContact O-OG 3.24Å; F207-S210 PolarHBondContact O-N 3.38Å; F207-S210 PolarHBondContact O-OG 3.13Å; A208-S210 PolarHBondContact O-N 3.08Å
211	T	93.5	Very high	89.8	Confident	24 Å²	24	69.3 Å²	69.3	15%	0.147	39%	0.392	C	S	.	.	H	α-helix	trans	-122.5	9.2	-174.1	58.4	0	0	0	0	113.8	Q188 F207 Q213	Q188-T211 HydrophobicContact CG-CG2 4.07Å; F207-T211 HydrophobicContact CD1-CG2 4.47Å; F207-T211 HydrophobicContact CD2-CG2 4.34Å; F207-T211 HydrophobicContact CE1-CG2 4.1Å; F207-T211 HydrophobicContact CE2-CG2 3.98Å; F207-T211 HydrophobicContact CZ-CG2 3.85Å; F207-T211 WeakPolarHBondContact O-CB 3.39Å; F207-T211 PolarHBondContact O-N 3.31Å; F207-T211 PolarHBondContact O-OG1 2.96Å; T211-Q213 PolarHBondContact O-N 3.01Å; T211-Q213 VanDerWaalsContact O-N 3.15Å; T211-Q213 PolarHBondContact O-NE2 3.03Å; T211-Q213 VanDerWaalsContact O-NE2 3.09Å; T211-Q213 VanDerWaalsContact OG1-CG 3.26Å; T211-Q213 WeakPolarHBondContact OG1-CG 3.25Å
212	D	91.1	Very high	89.9	Confident	152 Å²	152	68.9 Å²	68.9	81%	0.813	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	34.8	-176.1	-65.7	-44.7	0	0	0	113.5	A208	A208-D212 PolarHBondContact O-N 3.36Å; A208-D212 VanDerWaalsContact O-N 3.08Å
213	Q	89	Confident	89.9	Confident	26 Å²	26	71.3 Å²	71.3	12%	0.121	39%	0.386	C	S	.	.			trans	-88.5	143.8	177.3	-62.6	-54.8	-49.9	0	0	111.6	Q188 A208 T211	Q188-Q213 HydrophobicContact CB-CG 4.06Å; A208-Q213 WeakPolarHBondContact CB-O 3.41Å; A208-Q213 PolarHBondContact O-N 3.01Å; A208-Q213 VanDerWaalsContact O-N 3.16Å; T211-Q213 PolarHBondContact O-N 3.01Å; T211-Q213 VanDerWaalsContact O-N 3.15Å; T211-Q213 PolarHBondContact O-NE2 3.03Å; T211-Q213 VanDerWaalsContact O-NE2 3.09Å; T211-Q213 VanDerWaalsContact OG1-CG 3.26Å; T211-Q213 WeakPolarHBondContact OG1-CG 3.25Å
214	T	85.8	Confident	89.9	Confident	114 Å²	114	70.2 Å²	70.2	70%	0.699	38%	0.377	S	S	*	.			trans	-93.9	122.6	176.2	57.3	0	0	0	0	110.9
215	V	82.1	Confident	90	Very high	52 Å²	52	70.1 Å²	70.1	32%	0.315	38%	0.376	S	S	.	.			trans	-82.7	115.5	169.5	179.1	0	0	0	0	108.6	V196 A208 I222	V196-V215 HydrophobicContact CG1-CG1 4.42Å; V196-V215 HydrophobicContact CG2-CG1 3.76Å; V196-V215 HydrophobicContact CG2-CG2 4.2Å; A208-V215 HydrophobicContact CB-CG2 3.95Å; V215-I222 HydrophobicContact CG1-CD1 4.13Å
216	L	79.9	Confident	90.2	Very high	157 Å²	157	69.3 Å²	69.3	82%	0.822	37%	0.373	S	S	*	.			trans	-77.2	-27.6	-176.9	-66.7	176	0	0	0	113.6
217	E	84.5	Confident	90.3	Very high	18 Å²	18	74.1 Å²	74.1	8%	0.084	38%	0.381	C	S	.	.	S	Bend	trans	-87.3	136.6	-177	-170.5	-179.2	165.7	0	0	111	V196 S221 I222 R225 L508	V196-E217 HydrophobicContact CG1-CB 4.13Å; E217-S221 VanDerWaalsContact OE1-CB 3.25Å; E217-S221 WeakPolarHBondContact OE1-CB 3.41Å; E217-S221 PolarHBondContact OE1-OG 3.31Å; E217-I222 HydrophobicContact CB-CD1 4.38Å; E217-I222 HydrophobicContact CB-CG1 4.23Å; E217-I222 HydrophobicContact CG-CG1 3.94Å; E217-I222 PolarHBondContact OE1-N 3.35Å; E217-R225 IonicContact OE1-CZ 2.66Å; E217-R225 IonicContact OE1-NE 2.76Å; E217-R225 PolarHBondContact OE1-NE 3.44Å; E217-R225 IonicContact OE1-NH2 3.87Å; E217-R225 PolarHBondContact OE1-NH2 2.85Å; E217-R225 VanDerWaalsContact OE1-NH2 3.09Å; E217-R225 IonicContact OE2-CZ 3.63Å; E217-R225 IonicContact OE2-NE 3.11Å; E217-R225 IonicContact OE2-NH2 3.32Å; E217-R225 PolarHBondContact OE2-NH2 3.2Å; E217-L508 HydrophobicContact CB-CD1 4.34Å; E217-L508 HydrophobicContact CG-CD1 3.89Å
218	E	85.7	Confident	90.3	Very high	152 Å²	152	71.9 Å²	71.9	71%	0.71	37%	0.371	S	S	*	.			trans	-64.8	139.9	176.7	-65.5	-175.2	172.2	0	0	111.8	A220 S221 I222	E218-A220 PolarHBondContact O-N 3.11Å; E218-A220 VanDerWaalsContact O-N 3.11Å; E218-S221 WeakPolarHBondContact O-CB 3.35Å; E218-S221 PolarHBondContact O-N 3.35Å; E218-I222 PolarHBondContact O-N 3.09Å
219	L	84.6	Confident	90.5	Very high	84 Å²	84	72.3 Å²	72.3	44%	0.44	37%	0.371	S	S	.	.	H	α-helix	trans	-53.4	-35.8	179.6	-68	174.3	0	0	0	113	E205 S221 I222 K223	E205-L219 HydrophobicContact CG-CD2 4.23Å; E205-L219 WeakPolarHBondContact OE1-CD2 3.37Å; L219-S221 PolarHBondContact O-N 3.37Å; L219-I222 PolarHBondContact O-N 3.37Å; L219-K223 WeakPolarHBondContact O-CB 3.32Å; L219-K223 WeakPolarHBondContact O-CG 3.14Å; L219-K223 PolarHBondContact O-N 2.87Å
220	A	88.9	Confident	90.6	Very high	59 Å²	59	71 Å²	71	49%	0.488	37%	0.37	S	S	.	.	H	α-helix	trans	-63.1	-40.4	177.2	0	0	0	0	0	112.2	E218 K223 N224	E218-A220 PolarHBondContact O-N 3.11Å; E218-A220 VanDerWaalsContact O-N 3.11Å; A220-K223 PolarHBondContact O-N 3.3Å; A220-N224 WeakPolarHBondContact O-CB 3.39Å; A220-N224 PolarHBondContact O-N 3.11Å; A220-N224 PolarHBondContact O-ND2 2.95Å
221	S	91.5	Very high	90.7	Very high	22 Å²	22	67.7 Å²	67.7	15%	0.154	35%	0.345	C	S	.	.	H	α-helix	trans	-65	-44.8	176.3	179.2	0	0	0	0	111.1	E217 E218 L219 K223 N224 R225	E217-S221 VanDerWaalsContact OE1-CB 3.25Å; E217-S221 WeakPolarHBondContact OE1-CB 3.41Å; E217-S221 PolarHBondContact OE1-OG 3.31Å; E218-S221 WeakPolarHBondContact O-CB 3.35Å; E218-S221 PolarHBondContact O-N 3.35Å; L219-S221 PolarHBondContact O-N 3.37Å; S221-K223 PolarHBondContact O-N 2.98Å; S221-N224 PolarHBondContact O-N 2.84Å; S221-R225 WeakPolarHBondContact O-CG 3.46Å; S221-R225 PolarHBondContact O-N 3.34Å
222	I	91.1	Very high	90.9	Very high	2 Å²	2	66.5 Å²	66.5	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-60	-47.8	176.8	-56.4	173.7	0	0	0	110.5	V196 C201 V215 E217 E218 L219 N224 R225 Q226	V196-I222 HydrophobicContact CG1-CD1 3.86Å; V196-I222 HydrophobicContact CG1-CG1 4.21Å; C201-I222 HydrophobicContact CB-CG2 4Å; V215-I222 HydrophobicContact CG1-CD1 4.13Å; E217-I222 HydrophobicContact CB-CD1 4.38Å; E217-I222 HydrophobicContact CB-CG1 4.23Å; E217-I222 HydrophobicContact CG-CG1 3.94Å; E217-I222 PolarHBondContact OE1-N 3.35Å; E218-I222 PolarHBondContact O-N 3.09Å; L219-I222 PolarHBondContact O-N 3.37Å; I222-N224 PolarHBondContact O-N 3.06Å; I222-R225 PolarHBondContact O-N 3.35Å; I222-Q226 HydrophobicContact CG2-CG 4.47Å; I222-Q226 WeakPolarHBondContact O-CG 3.19Å; I222-Q226 PolarHBondContact O-N 3.36Å
223	K	91.9	Very high	91.1	Very high	124 Å²	124	63.2 Å²	63.2	54%	0.539	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-40.2	178.1	-74.1	-176.2	178.8	-170.2	0	112.7	L219 A220 S221 Q226 R227	L219-K223 WeakPolarHBondContact O-CB 3.32Å; L219-K223 WeakPolarHBondContact O-CG 3.14Å; L219-K223 PolarHBondContact O-N 2.87Å; A220-K223 PolarHBondContact O-N 3.3Å; S221-K223 PolarHBondContact O-N 2.98Å; K223-Q226 PolarHBondContact O-N 3.12Å; K223-R227 PolarHBondContact O-N 3.42Å
224	N	94.6	Very high	91.4	Very high	54 Å²	54	64.3 Å²	64.3	29%	0.289	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-44.4	175.3	-76.5	-18.1	0	0	0	111.8	A220 S221 I222 R227 I228 L247 Y248	A220-N224 WeakPolarHBondContact O-CB 3.39Å; A220-N224 PolarHBondContact O-N 3.11Å; A220-N224 PolarHBondContact O-ND2 2.95Å; S221-N224 PolarHBondContact O-N 2.84Å; I222-N224 PolarHBondContact O-N 3.06Å; N224-R227 PolarHBondContact O-N 3.36Å; N224-I228 PolarHBondContact O-N 3.26Å; N224-L247 HydrophobicContact CB-CD1 3.93Å; N224-Y248 WeakPolarHBondContact CB-OH 3.49Å
225	R	95.4	Very high	91.8	Very high	1 Å²	1	58.9 Å²	58.9	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-46	175.5	-69.1	-176.1	-57.2	94.3	-5.4	111.6	V196 H197 E217 S221 I222 R227 I228 Q229 N499 I502	V196-R225 PolarHBondContact O-NH2 3.01Å; H197-R225 PolarHBondContact O-NH1 3.22Å; E217-R225 IonicContact OE1-CZ 2.66Å; E217-R225 IonicContact OE1-NE 2.76Å; E217-R225 PolarHBondContact OE1-NE 3.44Å; E217-R225 IonicContact OE1-NH2 3.87Å; E217-R225 PolarHBondContact OE1-NH2 2.85Å; E217-R225 VanDerWaalsContact OE1-NH2 3.09Å; E217-R225 IonicContact OE2-CZ 3.63Å; E217-R225 IonicContact OE2-NE 3.11Å; E217-R225 IonicContact OE2-NH2 3.32Å; E217-R225 PolarHBondContact OE2-NH2 3.2Å; S221-R225 WeakPolarHBondContact O-CG 3.46Å; S221-R225 PolarHBondContact O-N 3.34Å; I222-R225 PolarHBondContact O-N 3.35Å; R225-R227 VanDerWaalsContact C-N 3.29Å; R225-R227 PolarHBondContact O-N 3.34Å; R225-I228 PolarHBondContact O-N 2.86Å; R225-I228 VanDerWaalsContact O-N 3.12Å; R225-Q229 WeakPolarHBondContact O-CB 3.48Å; R225-Q229 VanDerWaalsContact O-CG 3.28Å; R225-Q229 WeakPolarHBondContact O-CG 3.41Å; R225-Q229 PolarHBondContact O-N 2.86Å; R225-N499 WeakPolarHBondContact CD-OD1 3.23Å; R225-N499 PolarHBondContact NH1-OD1 2.78Å; R225-I502 HydrophobicContact CG-CG2 3.77Å
226	Q	94.5	Very high	92.5	Very high	45 Å²	45	60.1 Å²	60.1	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-53.8	-45.3	174.8	-75.8	176.7	-34.4	0	0	111.8	G199 C201 I222 K223 I228 Q229 K230	G199-Q226 WeakPolarHBondContact O-CG 3.34Å; G199-Q226 PolarHBondContact O-NE2 3.49Å; C201-Q226 VanDerWaalsContact CB-NE2 3.31Å; I222-Q226 HydrophobicContact CG2-CG 4.47Å; I222-Q226 WeakPolarHBondContact O-CG 3.19Å; I222-Q226 PolarHBondContact O-N 3.36Å; K223-Q226 PolarHBondContact O-N 3.12Å; Q226-I228 VanDerWaalsContact C-N 3.34Å; Q226-I228 PolarHBondContact O-N 3.46Å; Q226-Q229 PolarHBondContact O-N 3.24Å; Q226-K230 WeakPolarHBondContact O-CB 3.38Å; Q226-K230 WeakPolarHBondContact O-CG 3.4Å; Q226-K230 PolarHBondContact O-N 3.18Å
227	R	95.7	Very high	93.3	Very high	147 Å²	147	52.6 Å²	52.6	56%	0.555	26%	0.26	S	S	*	.	H	α-helix	trans	-57.8	-46.7	177.7	-178.2	179	177.2	172.5	1.2	111.6	K223 N224 R225 L231 T243	K223-R227 PolarHBondContact O-N 3.42Å; N224-R227 PolarHBondContact O-N 3.36Å; R225-R227 VanDerWaalsContact C-N 3.29Å; R225-R227 PolarHBondContact O-N 3.34Å; R227-L231 WeakPolarHBondContact O-CG 3.48Å; R227-L231 PolarHBondContact O-N 2.92Å; R227-T243 HydrophobicContact CG-CG2 4.44Å
228	I	96.8	Very high	93.7	Very high	2 Å²	2	52 Å²	52	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-45.7	178.1	-67.5	165.8	0	0	0	110.9	N224 R225 Q226 K230 L231 V232 T243 L247 Y248 L498 I502	N224-I228 PolarHBondContact O-N 3.26Å; R225-I228 PolarHBondContact O-N 2.86Å; R225-I228 VanDerWaalsContact O-N 3.12Å; Q226-I228 VanDerWaalsContact C-N 3.34Å; Q226-I228 PolarHBondContact O-N 3.46Å; I228-K230 PolarHBondContact O-N 3.37Å; I228-L231 WeakPolarHBondContact O-CB 3.45Å; I228-L231 PolarHBondContact O-N 3.11Å; I228-V232 HydrophobicContact CG2-CG2 4.48Å; I228-V232 WeakPolarHBondContact O-CG2 3.41Å; I228-V232 PolarHBondContact O-N 3.39Å; I228-T243 HydrophobicContact CG1-CG2 3.82Å; I228-L247 HydrophobicContact CD1-CD1 4.26Å; I228-Y248 HydrophobicContact CD1-CD2 3.99Å; I228-Y248 HydrophobicContact CD1-CE2 3.6Å; I228-L498 HydrophobicContact CG2-CD2 3.45Å; I228-L498 VanDerWaalsContact CG2-CD2 3.45Å; I228-L498 HydrophobicContact CG2-CG 4.2Å; I228-I502 HydrophobicContact CD1-CD1 3.84Å; I228-I502 HydrophobicContact CG2-CD1 4.49Å
229	Q	96.2	Very high	94.2	Very high	22 Å²	22	47.3 Å²	47.3	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-60.5	-43.6	179.7	-69.9	174.9	-53	0	0	111.6	R225 Q226 L231 V232 L233 N499	R225-Q229 WeakPolarHBondContact O-CB 3.48Å; R225-Q229 VanDerWaalsContact O-CG 3.28Å; R225-Q229 WeakPolarHBondContact O-CG 3.41Å; R225-Q229 PolarHBondContact O-N 2.86Å; Q226-Q229 PolarHBondContact O-N 3.24Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; Q229-L231 PolarHBondContact O-N 3.39Å; Q229-V232 PolarHBondContact O-N 3.25Å; Q229-L233 WeakPolarHBondContact O-CB 3.49Å; Q229-L233 VanDerWaalsContact O-CG 3.3Å; Q229-L233 WeakPolarHBondContact O-CG 3.24Å; Q229-L233 PolarHBondContact O-N 3.32Å; Q229-N499 VanDerWaalsContact NE2-CG 3.33Å; Q229-N499 PolarHBondContact NE2-OD1 2.88Å
230	K	95.7	Very high	94.8	Very high	144 Å²	144	43.3 Å²	43.3	63%	0.626	22%	0.216	S	C	*	.	H	α-helix	trans	-57.1	-44.3	174.4	-76.5	-177.1	179.5	-173.3	0	111.6	Q226 I228 A234	Q226-K230 WeakPolarHBondContact O-CB 3.38Å; Q226-K230 WeakPolarHBondContact O-CG 3.4Å; Q226-K230 PolarHBondContact O-N 3.18Å; I228-K230 PolarHBondContact O-N 3.37Å; K230-A234 VanDerWaalsContact O-CB 3.24Å; K230-A234 WeakPolarHBondContact O-CB 3.23Å; K230-A234 PolarHBondContact O-N 2.95Å
231	L	96.9	Very high	95.2	Very high	20 Å²	20	40.6 Å²	40.6	11%	0.105	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-44.8	177.3	-69.5	167.8	0	0	0	112.2	R227 I228 Q229 A234 G235 R236 E239 A240 T243	R227-L231 WeakPolarHBondContact O-CG 3.48Å; R227-L231 PolarHBondContact O-N 2.92Å; I228-L231 WeakPolarHBondContact O-CB 3.45Å; I228-L231 PolarHBondContact O-N 3.11Å; Q229-L231 VanDerWaalsContact C-N 3.33Å; Q229-L231 PolarHBondContact O-N 3.39Å; L231-A234 PolarHBondContact O-N 2.87Å; L231-G235 PolarHBondContact O-N 3.04Å; L231-R236 HydrophobicContact CD2-CB 4.17Å; L231-R236 PolarHBondContact O-N 3.3Å; L231-E239 HydrophobicContact CD1-CB 4.27Å; L231-E239 HydrophobicContact CD2-CB 4.14Å; L231-A240 HydrophobicContact CB-CB 3.79Å; L231-T243 HydrophobicContact CD1-CG2 4.46Å; L231-T243 WeakPolarHBondContact CD1-OG1 3.28Å
232	V	97.2	Very high	95.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-47.6	177.8	176	0	0	0	0	111.1	I228 Q229 A234 G235 M237 A240 R491 C495 L498	I228-V232 HydrophobicContact CG2-CG2 4.48Å; I228-V232 WeakPolarHBondContact O-CG2 3.41Å; I228-V232 PolarHBondContact O-N 3.39Å; Q229-V232 PolarHBondContact O-N 3.25Å; V232-A234 VanDerWaalsContact C-N 3.3Å; V232-A234 PolarHBondContact O-N 3.2Å; V232-G235 PolarHBondContact O-N 3.16Å; V232-M237 HydrophobicContact CB-SD 4.32Å; V232-M237 HydrophobicContact CG1-CE 4.29Å; V232-M237 HydrophobicContact CG1-SD 3.85Å; V232-M237 HydrophobicContact CG2-CE 4.46Å; V232-M237 HydrophobicContact CG2-SD 4.4Å; V232-A240 HydrophobicContact CG2-CB 3.58Å; V232-R491 WeakPolarHBondContact O-CD 3.37Å; V232-C495 HydrophobicContact CB-CB 4.25Å; V232-C495 HydrophobicContact CG1-CB 3.64Å; V232-L498 HydrophobicContact CG2-CD2 4.05Å
233	L	95.5	Very high	95.7	Very high	82 Å²	82	44 Å²	44	43%	0.429	21%	0.207	S	C	.	.	H	α-helix	trans	-68.3	-29.4	-178.6	-66.8	174.6	0	0	0	112.5	Q229 G235 R491 E492 C495	Q229-L233 WeakPolarHBondContact O-CB 3.49Å; Q229-L233 VanDerWaalsContact O-CG 3.3Å; Q229-L233 WeakPolarHBondContact O-CG 3.24Å; Q229-L233 PolarHBondContact O-N 3.32Å; L233-G235 PolarHBondContact O-N 3.43Å; L233-R491 HydrophobicContact CD2-CB 4.35Å; L233-R491 WeakPolarHBondContact O-CD 3.29Å; L233-R491 PolarHBondContact O-NH1 2.83Å; L233-E492 HydrophobicContact CD2-CG 4.17Å; L233-C495 HydrophobicContact CD2-CB 4.18Å
234	A	95.1	Very high	96	Very high	49 Å²	49	38 Å²	38	41%	0.405	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-8.5	170.6	0	0	0	0	0	113.7	K230 L231 V232 R236	K230-A234 VanDerWaalsContact O-CB 3.24Å; K230-A234 WeakPolarHBondContact O-CB 3.23Å; K230-A234 PolarHBondContact O-N 2.95Å; L231-A234 PolarHBondContact O-N 2.87Å; V232-A234 VanDerWaalsContact C-N 3.3Å; V232-A234 PolarHBondContact O-N 3.2Å; A234-R236 VanDerWaalsContact C-N 3.34Å; A234-R236 HydrophobicContact CB-CG 4.47Å
235	G	95	Very high	96	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	7.5	-176.8	0	0	0	0	0	114.5	L231 V232 L233 M237 E269	L231-G235 PolarHBondContact O-N 3.04Å; V232-G235 PolarHBondContact O-N 3.16Å; L233-G235 PolarHBondContact O-N 3.43Å; G235-M237 PolarHBondContact O-N 3.03Å; G235-E269 WeakPolarHBondContact O-CB 3.25Å; G235-E269 WeakPolarHBondContact O-CG 3.39Å
236	R	95.5	Very high	96.1	Very high	78 Å²	78	46.3 Å²	46.3	29%	0.294	22%	0.218	S	C	.	.			trans	-84.8	62.7	178.3	-66.1	169.5	66	175.1	4.6	110.5	L231 A234 G238 E239 A240	L231-R236 HydrophobicContact CD2-CB 4.17Å; L231-R236 PolarHBondContact O-N 3.3Å; A234-R236 VanDerWaalsContact C-N 3.34Å; A234-R236 HydrophobicContact CB-CG 4.47Å; R236-G238 VanDerWaalsContact C-N 3.34Å; R236-G238 PolarHBondContact O-N 3.49Å; R236-E239 IonicContact CZ-OE1 3.57Å; R236-E239 IonicContact CZ-OE2 2.79Å; R236-E239 IonicContact NE-OE1 3.61Å; R236-E239 PolarHBondContact NE-OE1 3.09Å; R236-E239 IonicContact NE-OE2 2.74Å; R236-E239 IonicContact NH2-OE1 2.78Å; R236-E239 PolarHBondContact NH2-OE1 2.97Å; R236-E239 IonicContact NH2-OE2 3.05Å; R236-E239 PolarHBondContact NH2-OE2 2.79Å; R236-E239 PolarHBondContact O-N 3.11Å; R236-A240 PolarHBondContact O-N 2.74Å
237	M	96	Very high	96.2	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-35.5	-170.7	-63	-60.5	-56.2	0	0	113	V232 G235 A240 I241 L262 R265 Q266 E269 D275 V494	V232-M237 HydrophobicContact CB-SD 4.32Å; V232-M237 HydrophobicContact CG1-CE 4.29Å; V232-M237 HydrophobicContact CG1-SD 3.85Å; V232-M237 HydrophobicContact CG2-CE 4.46Å; V232-M237 HydrophobicContact CG2-SD 4.4Å; G235-M237 PolarHBondContact O-N 3.03Å; M237-A240 PolarHBondContact O-N 3.16Å; M237-I241 WeakPolarHBondContact O-CD1 3.48Å; M237-I241 WeakPolarHBondContact O-CG1 3.43Å; M237-I241 PolarHBondContact O-N 2.57Å; M237-L262 HydrophobicContact CE-CB 4.31Å; M237-L262 HydrophobicContact CE-CD2 3.48Å; M237-L262 VanDerWaalsContact CE-CD2 3.48Å; M237-R265 HydrophobicContact CE-CB 4.01Å; M237-R265 HydrophobicContact CE-CG 3.97Å; M237-R265 HydrophobicContact CG-CB 4.5Å; M237-R265 HydrophobicContact CG-CG 3.99Å; M237-R265 HydrophobicContact SD-CB 4.46Å; M237-R265 HydrophobicContact SD-CG 3.8Å; M237-Q266 HydrophobicContact CB-CB 3.62Å; M237-Q266 HydrophobicContact CB-CG 4.17Å; M237-Q266 HydrophobicContact CG-CB 4.35Å; M237-E269 HydrophobicContact CG-CG 3.8Å; M237-D275 WeakPolarHBondContact CB-OD2 3.18Å; M237-D275 PolarHBondContact N-OD2 3.38Å; M237-D275 VanDerWaalsContact N-OD2 3.13Å; M237-V494 HydrophobicContact CE-CG1 3.96Å
238	G	94.6	Very high	96.2	Very high	6 Å²	6	40.8 Å²	40.8	6%	0.062	20%	0.199	C	C	.	.	H	α-helix	trans	-58.1	-51.5	176.5	0	0	0	0	0	112.4	R236 A240 I241 E242 Q266 D275	R236-G238 VanDerWaalsContact C-N 3.34Å; R236-G238 PolarHBondContact O-N 3.49Å; G238-A240 VanDerWaalsContact C-N 3.35Å; G238-A240 PolarHBondContact O-N 3.26Å; G238-I241 PolarHBondContact O-N 3.07Å; G238-E242 WeakPolarHBondContact O-CG 3.39Å; G238-E242 PolarHBondContact O-N 2.65Å; G238-Q266 VanDerWaalsContact N-NE2 3.18Å; G238-D275 PolarHBondContact N-OD2 2.98Å
239	E	95.6	Very high	96	Very high	53 Å²	53	45.2 Å²	45.2	25%	0.248	23%	0.228	C	C	.	.	H	α-helix	trans	-68.2	-34.9	178.4	-67.2	-179.9	-96.3	0	0	112.4	L231 R236 I241 E242 T243	L231-E239 HydrophobicContact CD1-CB 4.27Å; L231-E239 HydrophobicContact CD2-CB 4.14Å; R236-E239 IonicContact CZ-OE1 3.57Å; R236-E239 IonicContact CZ-OE2 2.79Å; R236-E239 IonicContact NE-OE1 3.61Å; R236-E239 PolarHBondContact NE-OE1 3.09Å; R236-E239 IonicContact NE-OE2 2.74Å; R236-E239 IonicContact NH2-OE1 2.78Å; R236-E239 PolarHBondContact NH2-OE1 2.97Å; R236-E239 IonicContact NH2-OE2 3.05Å; R236-E239 PolarHBondContact NH2-OE2 2.79Å; R236-E239 PolarHBondContact O-N 3.11Å; E239-I241 VanDerWaalsContact C-N 3.32Å; E239-I241 PolarHBondContact O-N 2.78Å; E239-E242 PolarHBondContact O-N 3.42Å; E239-T243 WeakPolarHBondContact O-CB 3.24Å; E239-T243 PolarHBondContact O-N 3.01Å; E239-T243 PolarHBondContact O-OG1 2.83Å
240	A	97.3	Very high	95.9	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-43.5	172.8	0	0	0	0	0	111.5	L231 V232 R236 M237 G238 T244	L231-A240 HydrophobicContact CB-CB 3.79Å; V232-A240 HydrophobicContact CG2-CB 3.58Å; R236-A240 PolarHBondContact O-N 2.74Å; M237-A240 PolarHBondContact O-N 3.16Å; G238-A240 VanDerWaalsContact C-N 3.35Å; G238-A240 PolarHBondContact O-N 3.26Å; A240-T244 WeakPolarHBondContact O-CB 3.23Å; A240-T244 PolarHBondContact O-N 3.3Å; A240-T244 PolarHBondContact O-OG1 3.26Å
241	I	97	Very high	95.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-48.1	177.4	-68.1	164.1	0	0	0	110.5	M237 G238 E239 T244 Q245 L252 L259 L262 K263	M237-I241 WeakPolarHBondContact O-CD1 3.48Å; M237-I241 WeakPolarHBondContact O-CG1 3.43Å; M237-I241 PolarHBondContact O-N 2.57Å; G238-I241 PolarHBondContact O-N 3.07Å; E239-I241 VanDerWaalsContact C-N 3.32Å; E239-I241 PolarHBondContact O-N 2.78Å; I241-T244 WeakPolarHBondContact O-CB 3.37Å; I241-T244 PolarHBondContact O-N 2.82Å; I241-Q245 WeakPolarHBondContact O-CG 3.25Å; I241-Q245 PolarHBondContact O-N 3.06Å; I241-L252 HydrophobicContact CG2-CD1 3.89Å; I241-L259 HydrophobicContact CG2-CD1 4.23Å; I241-L262 HydrophobicContact CD1-CB 3.86Å; I241-L262 HydrophobicContact CG1-CB 4Å; I241-L262 HydrophobicContact CG1-CD1 4.24Å; I241-K263 HydrophobicContact CD1-CD 3.79Å; I241-K263 HydrophobicContact CD1-CG 4.37Å
242	E	96.3	Very high	95.8	Very high	83 Å²	83	38.5 Å²	38.5	39%	0.388	20%	0.203	S	C	.	.	H	α-helix	trans	-61.3	-46.8	178.8	-71.7	-178	-172	0	0	111.7	G238 E239 T244 Q245 Q246	G238-E242 WeakPolarHBondContact O-CG 3.39Å; G238-E242 PolarHBondContact O-N 2.65Å; E239-E242 PolarHBondContact O-N 3.42Å; E242-T244 VanDerWaalsContact C-N 3.29Å; E242-T244 PolarHBondContact O-N 3.24Å; E242-Q245 PolarHBondContact O-N 3.01Å; E242-Q246 VanDerWaalsContact O-CG 3.32Å; E242-Q246 WeakPolarHBondContact O-CG 3.48Å; E242-Q246 PolarHBondContact O-N 3.04Å
243	T	97	Very high	95.6	Very high	11 Å²	11	45.6 Å²	45.6	7%	0.067	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-40.5	176.8	-56.9	0	0	0	0	110.8	R227 I228 L231 E239 Q246 L247	R227-T243 HydrophobicContact CG-CG2 4.44Å; I228-T243 HydrophobicContact CG1-CG2 3.82Å; L231-T243 HydrophobicContact CD1-CG2 4.46Å; L231-T243 WeakPolarHBondContact CD1-OG1 3.28Å; E239-T243 WeakPolarHBondContact O-CB 3.24Å; E239-T243 PolarHBondContact O-N 3.01Å; E239-T243 PolarHBondContact O-OG1 2.83Å; T243-Q246 PolarHBondContact O-N 3.07Å; T243-L247 HydrophobicContact CG2-CD1 3.67Å; T243-L247 HydrophobicContact CG2-CG 4.29Å; T243-L247 WeakPolarHBondContact O-CB 3.36Å; T243-L247 WeakPolarHBondContact O-CG 3.47Å; T243-L247 PolarHBondContact O-N 2.87Å
244	T	97.3	Very high	95.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-44.5	175.2	-58.7	0	0	0	0	111.5	A240 I241 E242 Q246 Y248 L251 L252 L498	A240-T244 WeakPolarHBondContact O-CB 3.23Å; A240-T244 PolarHBondContact O-N 3.3Å; A240-T244 PolarHBondContact O-OG1 3.26Å; I241-T244 WeakPolarHBondContact O-CB 3.37Å; I241-T244 PolarHBondContact O-N 2.82Å; E242-T244 VanDerWaalsContact C-N 3.29Å; E242-T244 PolarHBondContact O-N 3.24Å; T244-Q246 VanDerWaalsContact C-N 3.31Å; T244-Q246 PolarHBondContact O-N 3.25Å; T244-Y248 HydrophobicContact CG2-CD2 4.44Å; T244-Y248 CarbonylContact O-C 3.59Å; T244-Y248 WeakPolarHBondContact O-CA 3.16Å; T244-Y248 WeakPolarHBondContact O-CB 3.33Å; T244-Y248 PolarHBondContact O-N 2.91Å; T244-L251 HydrophobicContact CG2-CD2 4.15Å; T244-L252 HydrophobicContact CG2-CD1 3.97Å; T244-L252 HydrophobicContact CG2-CD2 4.41Å; T244-L252 HydrophobicContact CG2-CG 3.99Å; T244-L498 HydrophobicContact CG2-CD1 3.94Å
245	Q	96.4	Very high	95.4	Very high	90 Å²	90	51.1 Å²	51.1	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-33.4	179.3	-69.8	175.4	-44.4	0	0	112.5	I241 E242 L252	I241-Q245 WeakPolarHBondContact O-CG 3.25Å; I241-Q245 PolarHBondContact O-N 3.06Å; E242-Q245 PolarHBondContact O-N 3.01Å; Q245-L252 HydrophobicContact CG-CD1 3.93Å
246	Q	96.5	Very high	95.4	Very high	139 Å²	139	53 Å²	53	65%	0.65	26%	0.257	S	S	*	.	H	α-helix	trans	-70.9	-47.8	176.2	-72.1	175.4	13.5	0	0	112.1	E242 T243 T244	E242-Q246 VanDerWaalsContact O-CG 3.32Å; E242-Q246 WeakPolarHBondContact O-CG 3.48Å; E242-Q246 PolarHBondContact O-N 3.04Å; T243-Q246 PolarHBondContact O-N 3.07Å; T244-Q246 VanDerWaalsContact C-N 3.31Å; T244-Q246 PolarHBondContact O-N 3.25Å
247	L	96	Very high	95.3	Very high	58 Å²	58	52 Å²	52	30%	0.304	26%	0.258	S	S	.	.	H	α-helix	trans	-81	-31.3	-175.6	-63.9	176.1	0	0	0	113	N224 I228 T243	N224-L247 HydrophobicContact CB-CD1 3.93Å; I228-L247 HydrophobicContact CD1-CD1 4.26Å; T243-L247 HydrophobicContact CG2-CD1 3.67Å; T243-L247 HydrophobicContact CG2-CG 4.29Å; T243-L247 WeakPolarHBondContact O-CB 3.36Å; T243-L247 WeakPolarHBondContact O-CG 3.47Å; T243-L247 PolarHBondContact O-N 2.87Å
248	Y	95.6	Very high	95.3	Very high	17 Å²	17	53 Å²	53	7%	0.067	26%	0.263	C	S	.	.	S	Bend	trans	-129.1	72.5	-178	-52.5	-69.7	0	0	0	111.1	N224 I228 T244 S250 L251 I502 H506	N224-Y248 WeakPolarHBondContact CB-OH 3.49Å; I228-Y248 HydrophobicContact CD1-CD2 3.99Å; I228-Y248 HydrophobicContact CD1-CE2 3.6Å; T244-Y248 HydrophobicContact CG2-CD2 4.44Å; T244-Y248 CarbonylContact O-C 3.59Å; T244-Y248 WeakPolarHBondContact O-CA 3.16Å; T244-Y248 WeakPolarHBondContact O-CB 3.33Å; T244-Y248 PolarHBondContact O-N 2.91Å; Y248-S250 PolarHBondContact O-N 2.91Å; Y248-L251 HydrophobicContact CG-CD1 4.31Å; Y248-L251 WeakPolarHBondContact O-CB 3.49Å; Y248-L251 PolarHBondContact O-N 3.18Å; Y248-I502 HydrophobicContact CD1-CG2 4.2Å; Y248-I502 HydrophobicContact CD2-CD1 4.11Å; Y248-I502 HydrophobicContact CD2-CG1 3.94Å; Y248-I502 HydrophobicContact CD2-CG2 4.08Å; Y248-I502 HydrophobicContact CE1-CG2 3.72Å; Y248-I502 HydrophobicContact CE2-CB 4.45Å; Y248-I502 HydrophobicContact CE2-CD1 3.86Å; Y248-I502 HydrophobicContact CE2-CG1 3.99Å; Y248-I502 HydrophobicContact CE2-CG2 3.57Å; Y248-I502 HydrophobicContact CG-CG2 4.36Å; Y248-H506 AromaticContact CD1-CE1 3.56Å; Y248-H506 AromaticContact CE1-CE1 3.38Å; Y248-H506 WeakPolarHBondContact CE1-CE1 3.21Å
249	P	94.3	Very high	95.4	Very high	95 Å²	95	54.2 Å²	54.2	62%	0.617	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	141.1	179.5	-25	34.3	0	0	0	111.5	L251	P249-L251 PolarHBondContact O-N 2.94Å
250	S	92.6	Very high	95.4	Very high	39 Å²	39	51.7 Å²	51.7	27%	0.273	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-9.5	-176.4	79.7	0	0	0	0	117.8	Y248 L252 E253 R254	Y248-S250 PolarHBondContact O-N 2.91Å; S250-L252 PolarHBondContact O-N 3.22Å; S250-E253 PolarHBondContact O-N 3.17Å; S250-R254 WeakPolarHBondContact O-CB 3.48Å; S250-R254 VanDerWaalsContact O-CG 3.29Å; S250-R254 WeakPolarHBondContact O-CG 3.49Å; S250-R254 PolarHBondContact O-N 3.48Å; S250-R254 PolarHBondContact OG-NE 2.87Å
251	L	96	Very high	95.3	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-57.5	-49.8	-177.4	-178.7	154.4	0	0	0	112.2	T244 Y248 P249 N255 L258 L498 A501 I502 T505	T244-L251 HydrophobicContact CG2-CD2 4.15Å; Y248-L251 HydrophobicContact CG-CD1 4.31Å; Y248-L251 WeakPolarHBondContact O-CB 3.49Å; Y248-L251 PolarHBondContact O-N 3.18Å; P249-L251 PolarHBondContact O-N 2.94Å; L251-N255 WeakPolarHBondContact O-CB 3.49Å; L251-N255 PolarHBondContact O-N 3.2Å; L251-N255 PolarHBondContact O-ND2 3.02Å; L251-L258 HydrophobicContact CD2-CD2 4.25Å; L251-L498 HydrophobicContact CD2-CD1 4.32Å; L251-A501 HydrophobicContact CD2-CB 4.34Å; L251-I502 HydrophobicContact CD1-CB 4.18Å; L251-I502 HydrophobicContact CD1-CG1 3.62Å; L251-T505 HydrophobicContact CB-CG2 4.39Å; L251-T505 HydrophobicContact CD1-CG2 3.77Å; L251-T505 HydrophobicContact CG-CG2 4.01Å
252	L	95.8	Very high	95.3	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-76.7	-26.9	-178.7	-66.4	-179.7	0	0	0	112.8	I241 T244 Q245 S250 N255 L258 L259 L262 L498	I241-L252 HydrophobicContact CG2-CD1 3.89Å; T244-L252 HydrophobicContact CG2-CD1 3.97Å; T244-L252 HydrophobicContact CG2-CD2 4.41Å; T244-L252 HydrophobicContact CG2-CG 3.99Å; Q245-L252 HydrophobicContact CG-CD1 3.93Å; S250-L252 PolarHBondContact O-N 3.22Å; L252-N255 CarbonylContact O-C 3.6Å; L252-N255 PolarHBondContact O-N 2.94Å; L252-L258 HydrophobicContact CD2-CD2 4.09Å; L252-L258 HydrophobicContact CD2-CG 4.21Å; L252-L259 HydrophobicContact CB-CB 4.32Å; L252-L259 HydrophobicContact CB-CD1 4.24Å; L252-L259 HydrophobicContact CD1-CD1 4.05Å; L252-L262 HydrophobicContact CD1-CD1 4.26Å; L252-L262 HydrophobicContact CD2-CD1 3.55Å; L252-L498 HydrophobicContact CD2-CD1 4.36Å
253	E	92.4	Very high	95.4	Very high	148 Å²	148	50.2 Å²	50.2	69%	0.692	25%	0.251	S	S	*	.	H	α-helix	trans	-68.8	-39.4	173.7	-64	175	173.3	0	0	111.2	S250 N255	S250-E253 PolarHBondContact O-N 3.17Å; E253-N255 VanDerWaalsContact C-N 3.3Å
254	R	93.2	Very high	95.4	Very high	190 Å²	190	49.8 Å²	49.8	72%	0.717	25%	0.249	S	C	*	.	H	α-helix	trans	-74.8	-19.9	175.8	-69	175.9	-177.1	-174.9	3.6	113.2	S250 P256	S250-R254 WeakPolarHBondContact O-CB 3.48Å; S250-R254 VanDerWaalsContact O-CG 3.29Å; S250-R254 WeakPolarHBondContact O-CG 3.49Å; S250-R254 PolarHBondContact O-N 3.48Å; S250-R254 PolarHBondContact OG-NE 2.87Å; R254-P256 VanDerWaalsContact O-CD 3.25Å; R254-P256 WeakPolarHBondContact O-CD 2.95Å
255	N	94.1	Very high	95.3	Very high	58 Å²	58	50.3 Å²	50.3	31%	0.31	25%	0.251	S	S	.	.			trans	-119.4	67.5	-179.4	-67.3	-69.9	0	0	0	111.6	L251 L252 E253 N257 L258 L259	L251-N255 WeakPolarHBondContact O-CB 3.49Å; L251-N255 PolarHBondContact O-N 3.2Å; L251-N255 PolarHBondContact O-ND2 3.02Å; L252-N255 CarbonylContact O-C 3.6Å; L252-N255 PolarHBondContact O-N 2.94Å; E253-N255 VanDerWaalsContact C-N 3.3Å; N255-N257 VanDerWaalsContact C-N 3.26Å; N255-N257 PolarHBondContact O-N 3.1Å; N255-L258 HydrophobicContact CB-CB 3.92Å; N255-L258 HydrophobicContact CB-CD2 4.41Å; N255-L258 WeakPolarHBondContact O-CB 3.38Å; N255-L258 PolarHBondContact O-N 3.37Å; N255-L259 PolarHBondContact O-N 3.43Å
256	P	93.8	Very high	95.3	Very high	38 Å²	38	46 Å²	46	25%	0.247	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-27.7	-171.9	27.8	-37.6	0	0	0	113.4	R254 F260 L451	R254-P256 VanDerWaalsContact O-CD 3.25Å; R254-P256 WeakPolarHBondContact O-CD 2.95Å; P256-F260 WeakPolarHBondContact O-CB 3.43Å; P256-F260 PolarHBondContact O-N 3.5Å; P256-L451 HydrophobicContact CB-CD2 3.63Å; P256-L451 HydrophobicContact CG-CD2 4.34Å
257	N	93.4	Very high	95.2	Very high	59 Å²	59	39.5 Å²	39.5	32%	0.316	20%	0.2	S	C	.	.	H	α-helix	trans	-68.6	-39.3	171.8	-75.2	-66	0	0	0	112.4	N255 F260 T261 N458 N461	N255-N257 VanDerWaalsContact C-N 3.26Å; N255-N257 PolarHBondContact O-N 3.1Å; N257-F260 WeakPolarHBondContact O-CB 3.44Å; N257-F260 PolarHBondContact O-N 3.12Å; N257-T261 PolarHBondContact O-N 3.46Å; N257-T261 PolarHBondContact O-OG1 2.94Å; N257-T261 VanDerWaalsContact O-OG1 3.12Å; N257-N458 PolarHBondContact OD1-ND2 3.33Å; N257-N461 PolarHBondContact OD1-ND2 2.98Å
258	L	95.6	Very high	95.2	Very high	21 Å²	21	37.2 Å²	37.2	11%	0.11	19%	0.188	C	C	.	.	H	α-helix	trans	-66.8	-44.9	176.3	174.9	62.3	0	0	0	110.6	L251 L252 N255 F260 T261 L262 A497 L498 A501	L251-L258 HydrophobicContact CD2-CD2 4.25Å; L252-L258 HydrophobicContact CD2-CD2 4.09Å; L252-L258 HydrophobicContact CD2-CG 4.21Å; N255-L258 HydrophobicContact CB-CB 3.92Å; N255-L258 HydrophobicContact CB-CD2 4.41Å; N255-L258 WeakPolarHBondContact O-CB 3.38Å; N255-L258 PolarHBondContact O-N 3.37Å; L258-F260 PolarHBondContact O-N 3.35Å; L258-T261 PolarHBondContact O-N 2.93Å; L258-T261 VanDerWaalsContact O-N 3.15Å; L258-L262 HydrophobicContact CD1-CD1 4.42Å; L258-L262 HydrophobicContact CD1-CG 4.38Å; L258-L262 HydrophobicContact CG-CD1 4.13Å; L258-L262 WeakPolarHBondContact O-CG 3.48Å; L258-L262 PolarHBondContact O-N 3.38Å; L258-A497 HydrophobicContact CD1-CB 4.09Å; L258-L498 HydrophobicContact CD2-CD1 4.11Å; L258-A501 HydrophobicContact CD2-CB 3.48Å; L258-A501 VanDerWaalsContact CD2-CB 3.48Å
259	L	96.5	Very high	95.1	Very high	31 Å²	31	36.4 Å²	36.4	16%	0.162	19%	0.185	C	C	.	.	H	α-helix	trans	-56.6	-42.9	173.9	179.9	60	0	0	0	110.8	I241 L252 N255 L262 K263 M447	I241-L259 HydrophobicContact CG2-CD1 4.23Å; L252-L259 HydrophobicContact CB-CB 4.32Å; L252-L259 HydrophobicContact CB-CD1 4.24Å; L252-L259 HydrophobicContact CD1-CD1 4.05Å; N255-L259 PolarHBondContact O-N 3.43Å; L259-L262 PolarHBondContact O-N 3.21Å; L259-K263 HydrophobicContact CD1-CG 4.12Å; L259-K263 HydrophobicContact CG-CG 4.4Å; L259-K263 WeakPolarHBondContact O-CB 3.05Å; L259-K263 WeakPolarHBondContact O-CG 3.42Å; L259-K263 PolarHBondContact O-N 3.32Å; L259-M447 HydrophobicContact CB-CE 4.08Å; L259-M447 HydrophobicContact CD2-CE 3.85Å; L259-M447 HydrophobicContact CG-CE 3.72Å
260	F	96.1	Very high	95	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60	-47.9	175.3	-175.4	-103.3	0	0	0	112.2	P256 N257 L258 L262 K263 V264 L444 M447 L451 N461 L465	P256-F260 WeakPolarHBondContact O-CB 3.43Å; P256-F260 PolarHBondContact O-N 3.5Å; N257-F260 WeakPolarHBondContact O-CB 3.44Å; N257-F260 PolarHBondContact O-N 3.12Å; L258-F260 PolarHBondContact O-N 3.35Å; F260-L262 VanDerWaalsContact C-N 3.34Å; F260-L262 PolarHBondContact O-N 2.96Å; F260-K263 PolarHBondContact O-N 2.82Å; F260-K263 VanDerWaalsContact O-N 3.16Å; F260-V264 HydrophobicContact CD1-CG2 4.03Å; F260-V264 HydrophobicContact CE1-CG2 3.62Å; F260-V264 HydrophobicContact CE2-CG2 4.2Å; F260-V264 HydrophobicContact CG-CG2 4.48Å; F260-V264 HydrophobicContact CZ-CG2 3.72Å; F260-V264 WeakPolarHBondContact O-CG2 3.36Å; F260-V264 PolarHBondContact O-N 2.89Å; F260-L444 HydrophobicContact CD2-CD1 3.96Å; F260-L444 HydrophobicContact CE2-CD1 3.72Å; F260-L444 HydrophobicContact CE2-CG 4.29Å; F260-M447 HydrophobicContact CB-CE 3.99Å; F260-M447 HydrophobicContact CB-SD 4.41Å; F260-M447 HydrophobicContact CD2-CE 4.47Å; F260-M447 HydrophobicContact CD2-CG 4.11Å; F260-M447 HydrophobicContact CD2-SD 3.9Å; F260-L451 HydrophobicContact CB-CD1 3.52Å; F260-L451 HydrophobicContact CD1-CD1 4.4Å; F260-L451 HydrophobicContact CD2-CD1 3.58Å; F260-L451 HydrophobicContact CE2-CD1 4.42Å; F260-L451 HydrophobicContact CG-CD1 3.56Å; F260-N461 HydrophobicContact CD1-CB 3.93Å; F260-N461 HydrophobicContact CE1-CB 3.57Å; F260-N461 HydrophobicContact CZ-CB 4.44Å; F260-L465 HydrophobicContact CZ-CB 4.2Å; F260-L465 HydrophobicContact CZ-CD1 4.21Å; F260-L465 HydrophobicContact CZ-CD2 4.4Å
261	T	96.4	Very high	94.9	Very high	33 Å²	33	30.8 Å²	30.8	20%	0.202	15%	0.146	C	C	.	.	H	α-helix	trans	-58.1	-44.9	176.3	-59.2	0	0	0	0	112.2	N257 L258 K263 V264 R265 M464 V494	N257-T261 PolarHBondContact O-N 3.46Å; N257-T261 PolarHBondContact O-OG1 2.94Å; N257-T261 VanDerWaalsContact O-OG1 3.12Å; L258-T261 PolarHBondContact O-N 2.93Å; L258-T261 VanDerWaalsContact O-N 3.15Å; T261-K263 VanDerWaalsContact C-N 3.32Å; T261-K263 PolarHBondContact O-N 2.87Å; T261-V264 PolarHBondContact O-N 3.49Å; T261-R265 PolarHBondContact O-N 3.07Å; T261-M464 HydrophobicContact CG2-CE 4.2Å; T261-M464 HydrophobicContact CG2-SD 4.08Å; T261-V494 HydrophobicContact CG2-CG1 4.41Å; T261-V494 HydrophobicContact CG2-CG2 4.03Å
262	L	97.1	Very high	94.6	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-42.1	176.1	-69.6	166	0	0	0	111.5	M237 I241 L252 L258 L259 F260 R265 Q266 V494 L498	M237-L262 HydrophobicContact CE-CB 4.31Å; M237-L262 HydrophobicContact CE-CD2 3.48Å; M237-L262 VanDerWaalsContact CE-CD2 3.48Å; I241-L262 HydrophobicContact CD1-CB 3.86Å; I241-L262 HydrophobicContact CG1-CB 4Å; I241-L262 HydrophobicContact CG1-CD1 4.24Å; L252-L262 HydrophobicContact CD1-CD1 4.26Å; L252-L262 HydrophobicContact CD2-CD1 3.55Å; L258-L262 HydrophobicContact CD1-CD1 4.42Å; L258-L262 HydrophobicContact CD1-CG 4.38Å; L258-L262 HydrophobicContact CG-CD1 4.13Å; L258-L262 WeakPolarHBondContact O-CG 3.48Å; L258-L262 PolarHBondContact O-N 3.38Å; L259-L262 PolarHBondContact O-N 3.21Å; F260-L262 VanDerWaalsContact C-N 3.34Å; F260-L262 PolarHBondContact O-N 2.96Å; L262-R265 PolarHBondContact O-N 3.31Å; L262-Q266 WeakPolarHBondContact O-CB 3.43Å; L262-Q266 PolarHBondContact O-N 2.73Å; L262-V494 HydrophobicContact CD2-CG1 3.45Å; L262-V494 VanDerWaalsContact CD2-CG1 3.45Å; L262-V494 HydrophobicContact CG-CG1 4.28Å; L262-L498 HydrophobicContact CD1-CD1 4.28Å; L262-L498 HydrophobicContact CD1-CD2 4.43Å; L262-L498 HydrophobicContact CD2-CD2 4.05Å
263	K	96.6	Very high	94.1	Very high	21 Å²	21	33 Å²	33	9%	0.091	17%	0.165	C	C	.	.	H	α-helix	trans	-70.1	-35.6	178.3	-67.6	-67	177.9	-172.4	0	112.7	I241 L259 F260 T261 Q266 F267 L281 F440 L444 M447	I241-K263 HydrophobicContact CD1-CD 3.79Å; I241-K263 HydrophobicContact CD1-CG 4.37Å; L259-K263 HydrophobicContact CD1-CG 4.12Å; L259-K263 HydrophobicContact CG-CG 4.4Å; L259-K263 WeakPolarHBondContact O-CB 3.05Å; L259-K263 WeakPolarHBondContact O-CG 3.42Å; L259-K263 PolarHBondContact O-N 3.32Å; F260-K263 PolarHBondContact O-N 2.82Å; F260-K263 VanDerWaalsContact O-N 3.16Å; T261-K263 VanDerWaalsContact C-N 3.32Å; T261-K263 PolarHBondContact O-N 2.87Å; K263-Q266 VanDerWaalsContact CD-OE1 3.25Å; K263-Q266 WeakPolarHBondContact O-CB 3.37Å; K263-Q266 PolarHBondContact O-N 3.26Å; K263-F267 PolarHBondContact O-N 3.06Å; K263-L281 HydrophobicContact CD-CD2 3.63Å; K263-F440 HydrophobicContact CB-CZ 4.15Å; K263-F440 HydrophobicContact CD-CE2 4.1Å; K263-F440 HydrophobicContact CD-CZ 3.69Å; K263-F440 VanDerWaalsContact O-CE1 3.27Å; K263-F440 WeakPolarHBondContact O-CE1 3.34Å; K263-L444 HydrophobicContact CB-CD1 3.76Å; K263-M447 HydrophobicContact CG-SD 4.47Å
264	V	96.8	Very high	93.7	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-64.7	-43.5	170.9	178.7	0	0	0	0	110.6	F260 T261 Q266 F267 I268 L444 M464 L465 A468	F260-V264 HydrophobicContact CD1-CG2 4.03Å; F260-V264 HydrophobicContact CE1-CG2 3.62Å; F260-V264 HydrophobicContact CE2-CG2 4.2Å; F260-V264 HydrophobicContact CG-CG2 4.48Å; F260-V264 HydrophobicContact CZ-CG2 3.72Å; F260-V264 WeakPolarHBondContact O-CG2 3.36Å; F260-V264 PolarHBondContact O-N 2.89Å; T261-V264 PolarHBondContact O-N 3.49Å; V264-Q266 PolarHBondContact O-N 2.9Å; V264-F267 WeakPolarHBondContact O-CB 3.3Å; V264-F267 PolarHBondContact O-N 3.28Å; V264-I268 HydrophobicContact CG1-CD1 4.34Å; V264-I268 WeakPolarHBondContact O-CG1 3.43Å; V264-I268 PolarHBondContact O-N 3.46Å; V264-I268 VanDerWaalsContact O-N 3.12Å; V264-L444 HydrophobicContact CB-CD2 4.44Å; V264-L444 HydrophobicContact CG2-CD1 4.02Å; V264-L444 HydrophobicContact CG2-CD2 3.99Å; V264-L444 HydrophobicContact CG2-CG 4.38Å; V264-M464 HydrophobicContact CB-CG 4.25Å; V264-M464 HydrophobicContact CB-SD 3.77Å; V264-M464 HydrophobicContact CG1-CG 3.7Å; V264-M464 HydrophobicContact CG1-SD 3.92Å; V264-M464 HydrophobicContact CG2-CG 4.46Å; V264-M464 HydrophobicContact CG2-SD 3.94Å; V264-L465 HydrophobicContact CG2-CD1 4.45Å; V264-A468 HydrophobicContact CG1-CB 3.69Å
265	R	96.5	Very high	93.1	Very high	12 Å²	12	19.5 Å²	19.5	5%	0.045	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-41.9	175.5	-177.4	66.4	-165.1	-173.9	6.2	111.7	M237 T261 L262 F267 I268 E269 Q485 D487 V494	M237-R265 HydrophobicContact CE-CB 4.01Å; M237-R265 HydrophobicContact CE-CG 3.97Å; M237-R265 HydrophobicContact CG-CB 4.5Å; M237-R265 HydrophobicContact CG-CG 3.99Å; M237-R265 HydrophobicContact SD-CB 4.46Å; M237-R265 HydrophobicContact SD-CG 3.8Å; T261-R265 PolarHBondContact O-N 3.07Å; L262-R265 PolarHBondContact O-N 3.31Å; R265-F267 VanDerWaalsContact C-N 3.28Å; R265-F267 PolarHBondContact O-N 3.2Å; R265-I268 WeakPolarHBondContact O-CA 3.23Å; R265-I268 WeakPolarHBondContact O-CB 3.2Å; R265-I268 PolarHBondContact O-N 2.94Å; R265-E269 HydrophobicContact CG-CG 4.43Å; R265-E269 IonicContact CZ-OE1 3.91Å; R265-E269 IonicContact NE-OE1 3.7Å; R265-E269 PolarHBondContact NE-OE1 3.27Å; R265-E269 IonicContact NH2-OE1 3.76Å; R265-E269 PolarHBondContact NH2-OE1 3.08Å; R265-E269 WeakPolarHBondContact O-CG 3.41Å; R265-E269 PolarHBondContact O-N 3.02Å; R265-Q485 PolarHBondContact NH1-O 3.32Å; R265-D487 PolarHBondContact NH2-O 3.45Å; R265-V494 HydrophobicContact CB-CG1 4.49Å; R265-V494 HydrophobicContact CB-CG2 4.28Å; R265-V494 HydrophobicContact CG-CG2 4.41Å
266	Q	95.9	Very high	91.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-53.5	-46.2	172.7	174.9	163	45.3	0	0	111.6	M237 G238 L262 K263 V264 I268 E269 M270 D275 V278 F440	M237-Q266 HydrophobicContact CB-CB 3.62Å; M237-Q266 HydrophobicContact CB-CG 4.17Å; M237-Q266 HydrophobicContact CG-CB 4.35Å; G238-Q266 VanDerWaalsContact N-NE2 3.18Å; L262-Q266 WeakPolarHBondContact O-CB 3.43Å; L262-Q266 PolarHBondContact O-N 2.73Å; K263-Q266 VanDerWaalsContact CD-OE1 3.25Å; K263-Q266 WeakPolarHBondContact O-CB 3.37Å; K263-Q266 PolarHBondContact O-N 3.26Å; V264-Q266 PolarHBondContact O-N 2.9Å; Q266-I268 VanDerWaalsContact C-N 3.32Å; Q266-I268 PolarHBondContact O-N 2.96Å; Q266-E269 PolarHBondContact O-N 3.3Å; Q266-M270 HydrophobicContact CG-SD 4.29Å; Q266-M270 VanDerWaalsContact O-CG 3.28Å; Q266-M270 WeakPolarHBondContact O-CG 3.31Å; Q266-M270 PolarHBondContact O-N 3.47Å; Q266-D275 WeakPolarHBondContact CG-OD2 3.48Å; Q266-D275 PolarHBondContact NE2-OD2 2.89Å; Q266-V278 HydrophobicContact CG-CG2 4.35Å; Q266-F440 HydrophobicContact CB-CZ 4.02Å; Q266-F440 HydrophobicContact CG-CE1 4.34Å; Q266-F440 HydrophobicContact CG-CE2 4.06Å; Q266-F440 HydrophobicContact CG-CZ 3.69Å; Q266-F440 VanDerWaalsContact OE1-CE2 3.28Å; Q266-F440 VanDerWaalsContact OE1-CZ 3.27Å
267	F	95.3	Very high	90.1	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.009	14%	0.144	C	C	.	.	H	α-helix	trans	-59.1	-41.9	175.3	178.4	-95.1	0	0	0	112.6	K263 V264 R265 E269 M270 V271 M437 F440 L444 A468 F469 L472	K263-F267 PolarHBondContact O-N 3.06Å; V264-F267 WeakPolarHBondContact O-CB 3.3Å; V264-F267 PolarHBondContact O-N 3.28Å; R265-F267 VanDerWaalsContact C-N 3.28Å; R265-F267 PolarHBondContact O-N 3.2Å; F267-E269 VanDerWaalsContact C-N 3.35Å; F267-M270 WeakPolarHBondContact O-CB 3.36Å; F267-M270 PolarHBondContact O-N 3.48Å; F267-V271 HydrophobicContact CD1-CG2 4.24Å; F267-V271 HydrophobicContact CE1-CG2 3.85Å; F267-V271 HydrophobicContact CZ-CG2 4.18Å; F267-V271 WeakPolarHBondContact O-CG2 3.48Å; F267-V271 PolarHBondContact O-N 2.96Å; F267-M437 HydrophobicContact CD2-CG 4.08Å; F267-M437 HydrophobicContact CE2-CG 3.61Å; F267-M437 HydrophobicContact CE2-SD 4.43Å; F267-M437 HydrophobicContact CZ-CG 4.24Å; F267-F440 HydrophobicContact CB-CD1 3.99Å; F267-F440 HydrophobicContact CB-CE1 3.81Å; F267-F440 AromaticContact CD2-CD1 3.95Å; F267-F440 HydrophobicContact CD2-CD1 3.95Å; F267-F440 HydrophobicContact CG-CD1 4.47Å; F267-L444 HydrophobicContact CB-CD2 4Å; F267-L444 HydrophobicContact CG-CD2 4.36Å; F267-A468 HydrophobicContact CD1-CB 4.11Å; F267-A468 HydrophobicContact CE1-CB 4.48Å; F267-F469 HydrophobicContact CD1-CD1 4.23Å; F267-F469 HydrophobicContact CD1-CE1 4.37Å; F267-F469 AromaticContact CE1-CD1 3.63Å; F267-F469 HydrophobicContact CE1-CD1 3.63Å; F267-F469 HydrophobicContact CE1-CE1 4.06Å; F267-F469 HydrophobicContact CE2-CD1 4.44Å; F267-F469 HydrophobicContact CE2-CE1 4.2Å; F267-F469 AromaticContact CZ-CD1 3.73Å; F267-F469 HydrophobicContact CZ-CD1 3.73Å; F267-F469 AromaticContact CZ-CE1 3.95Å; F267-F469 HydrophobicContact CZ-CE1 3.95Å; F267-L472 HydrophobicContact CZ-CD1 3.87Å; F267-L472 HydrophobicContact CZ-CD2 4.23Å; F267-L472 HydrophobicContact CZ-CG 4.09Å
268	I	94.9	Very high	88.3	Confident	9 Å²	9	23.9 Å²	23.9	5%	0.046	14%	0.136	C	C	.	.	H	α-helix	trans	-63.9	-40.1	176.6	-63.9	167.4	0	0	0	111	V264 R265 Q266 M270 V271 N272 A468 L471 Q485 L486	V264-I268 HydrophobicContact CG1-CD1 4.34Å; V264-I268 WeakPolarHBondContact O-CG1 3.43Å; V264-I268 PolarHBondContact O-N 3.46Å; V264-I268 VanDerWaalsContact O-N 3.12Å; R265-I268 WeakPolarHBondContact O-CA 3.23Å; R265-I268 WeakPolarHBondContact O-CB 3.2Å; R265-I268 PolarHBondContact O-N 2.94Å; Q266-I268 VanDerWaalsContact C-N 3.32Å; Q266-I268 PolarHBondContact O-N 2.96Å; I268-M270 VanDerWaalsContact C-N 3.35Å; I268-V271 WeakPolarHBondContact O-CB 3.37Å; I268-V271 PolarHBondContact O-N 3.21Å; I268-N272 WeakPolarHBondContact O-CB 3.46Å; I268-N272 PolarHBondContact O-N 3.39Å; I268-A468 HydrophobicContact CD1-CB 4.06Å; I268-A468 HydrophobicContact CG1-CB 3.87Å; I268-L471 HydrophobicContact CG1-CD1 4.16Å; I268-L471 HydrophobicContact CG2-CD1 4.18Å; I268-Q485 HydrophobicContact CD1-CB 4.47Å; I268-L486 HydrophobicContact CG2-CD2 3.88Å
269	E	94.1	Very high	86.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.8	-32.1	175.2	-61	-62.7	167.8	0	0	112.3	G235 M237 R265 Q266 F267 N272 G273 T274 D275 R491	G235-E269 WeakPolarHBondContact O-CB 3.25Å; G235-E269 WeakPolarHBondContact O-CG 3.39Å; M237-E269 HydrophobicContact CG-CG 3.8Å; R265-E269 HydrophobicContact CG-CG 4.43Å; R265-E269 IonicContact CZ-OE1 3.91Å; R265-E269 IonicContact NE-OE1 3.7Å; R265-E269 PolarHBondContact NE-OE1 3.27Å; R265-E269 IonicContact NH2-OE1 3.76Å; R265-E269 PolarHBondContact NH2-OE1 3.08Å; R265-E269 WeakPolarHBondContact O-CG 3.41Å; R265-E269 PolarHBondContact O-N 3.02Å; Q266-E269 PolarHBondContact O-N 3.3Å; F267-E269 VanDerWaalsContact C-N 3.35Å; E269-N272 CarbonylContact O-C 3.54Å; E269-N272 WeakPolarHBondContact O-CB 3.38Å; E269-N272 PolarHBondContact O-N 3.49Å; E269-G273 PolarHBondContact O-N 3.35Å; E269-T274 WeakPolarHBondContact CA-OG1 3.38Å; E269-T274 WeakPolarHBondContact CB-OG1 3.45Å; E269-T274 PolarHBondContact O-N 3.26Å; E269-T274 PolarHBondContact O-OG1 2.86Å; E269-T274 VanDerWaalsContact O-OG1 3.07Å; E269-T274 PolarHBondContact OE2-OG1 2.99Å; E269-D275 HydrophobicContact CB-CB 3.71Å; E269-D275 PolarHBondContact O-N 3.14Å; E269-R491 WeakPolarHBondContact OE1-CG 3.48Å; E269-R491 IonicContact OE1-CZ 2.86Å; E269-R491 IonicContact OE1-NE 3.95Å; E269-R491 PolarHBondContact OE1-NE 3.48Å; E269-R491 IonicContact OE1-NH2 3.83Å; E269-R491 IonicContact OE2-CZ 3.72Å; E269-R491 IonicContact OE2-NE 2.74Å; E269-R491 IonicContact OE2-NH2 3.67Å; E269-R491 PolarHBondContact OE2-NH2 3.01Å
270	M	92.2	Very high	84.1	Confident	12 Å²	12	34.7 Å²	34.7	6%	0.059	18%	0.184	C	C	.	.	H	α-helix	trans	-65.4	-40.4	170.6	-67	172.8	80.2	0	0	111.6	Q266 F267 I268 N272 G273 D275 V278 C427 R436 M437 F440	Q266-M270 HydrophobicContact CG-SD 4.29Å; Q266-M270 VanDerWaalsContact O-CG 3.28Å; Q266-M270 WeakPolarHBondContact O-CG 3.31Å; Q266-M270 PolarHBondContact O-N 3.47Å; F267-M270 WeakPolarHBondContact O-CB 3.36Å; F267-M270 PolarHBondContact O-N 3.48Å; I268-M270 VanDerWaalsContact C-N 3.35Å; M270-N272 VanDerWaalsContact C-N 3.3Å; M270-G273 PolarHBondContact O-N 3.14Å; M270-D275 HydrophobicContact CG-CB 4.41Å; M270-D275 WeakPolarHBondContact CG-O 3.4Å; M270-V278 HydrophobicContact CG-CG2 4.43Å; M270-V278 HydrophobicContact SD-CG2 4.28Å; M270-C427 PolarHBondContact O-SG 3.07Å; M270-R436 HydrophobicContact CE-CB 4.4Å; M270-M437 HydrophobicContact CB-CB 4.47Å; M270-M437 HydrophobicContact CB-CG 4.28Å; M270-M437 HydrophobicContact CE-CB 4.13Å; M270-F440 HydrophobicContact CE-CB 3.95Å; M270-F440 HydrophobicContact CE-CG 4.29Å; M270-F440 HydrophobicContact SD-CB 3.98Å; M270-F440 HydrophobicContact SD-CD1 3.94Å; M270-F440 HydrophobicContact SD-CD2 4.04Å; M270-F440 HydrophobicContact SD-CE1 4.42Å; M270-F440 HydrophobicContact SD-CE2 4.5Å; M270-F440 HydrophobicContact SD-CG 3.71Å
271	V	91.2	Very high	82.2	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-44.1	172.5	171.4	0	0	0	0	110.2	F267 I268 G273 L426 C427 M437 L471 L472 P477 L486	F267-V271 HydrophobicContact CD1-CG2 4.24Å; F267-V271 HydrophobicContact CE1-CG2 3.85Å; F267-V271 HydrophobicContact CZ-CG2 4.18Å; F267-V271 WeakPolarHBondContact O-CG2 3.48Å; F267-V271 PolarHBondContact O-N 2.96Å; I268-V271 WeakPolarHBondContact O-CB 3.37Å; I268-V271 PolarHBondContact O-N 3.21Å; V271-G273 VanDerWaalsContact C-N 3.3Å; V271-G273 PolarHBondContact O-N 3.33Å; V271-L426 HydrophobicContact CG1-CD2 3.95Å; V271-C427 PolarHBondContact O-N 3.15Å; V271-M437 HydrophobicContact CB-SD 4.22Å; V271-M437 HydrophobicContact CG2-CG 4.48Å; V271-M437 HydrophobicContact CG2-SD 3.43Å; V271-M437 WeakPolarHBondContact CG2-SD 3.48Å; V271-L471 HydrophobicContact CG1-CB 4.17Å; V271-L471 HydrophobicContact CG1-CD1 4.38Å; V271-L472 HydrophobicContact CG2-CD2 4.1Å; V271-P477 HydrophobicContact CG1-CB 4.35Å; V271-P477 HydrophobicContact CG1-CG 4.25Å; V271-L486 HydrophobicContact CG1-CD2 4.18Å
272	N	88.3	Confident	79.7	Confident	28 Å²	28	39.1 Å²	39.1	15%	0.15	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-27.7	178.5	-162	21.5	0	0	0	113.2	I268 E269 M270 W478 L486	I268-N272 WeakPolarHBondContact O-CB 3.46Å; I268-N272 PolarHBondContact O-N 3.39Å; E269-N272 CarbonylContact O-C 3.54Å; E269-N272 WeakPolarHBondContact O-CB 3.38Å; E269-N272 PolarHBondContact O-N 3.49Å; M270-N272 VanDerWaalsContact C-N 3.3Å; N272-W478 WeakPolarHBondContact OD1-CZ2 3.21Å; N272-L486 HydrophobicContact CB-CD2 3.93Å
273	G	85.9	Confident	76.8	Confident	27 Å²	27	42.6 Å²	42.6	28%	0.278	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	7.9	-177.5	0	0	0	0	0	114.7	E269 M270 V271	E269-G273 PolarHBondContact O-N 3.35Å; M270-G273 PolarHBondContact O-N 3.14Å; V271-G273 VanDerWaalsContact C-N 3.3Å; V271-G273 PolarHBondContact O-N 3.33Å
274	T	83.3	Confident	73.8	Confident	44 Å²	44	53.5 Å²	53.5	27%	0.27	30%	0.297	S	S	.	.	S	Bend	trans	-85.3	-24.5	-179.4	40.1	0	0	0	0	113.2	E269	E269-T274 WeakPolarHBondContact CA-OG1 3.38Å; E269-T274 WeakPolarHBondContact CB-OG1 3.45Å; E269-T274 PolarHBondContact O-N 3.26Å; E269-T274 PolarHBondContact O-OG1 2.86Å; E269-T274 VanDerWaalsContact O-OG1 3.07Å; E269-T274 PolarHBondContact OE2-OG1 2.99Å
275	D	81.7	Confident	70.6	Confident	9 Å²	9	57.7 Å²	57.7	5%	0.048	33%	0.326	C	S	.	.			trans	-114.4	92.3	176.7	-164.6	-12.9	0	0	0	110.6	M237 G238 Q266 E269 M270 V278	M237-D275 WeakPolarHBondContact CB-OD2 3.18Å; M237-D275 PolarHBondContact N-OD2 3.38Å; M237-D275 VanDerWaalsContact N-OD2 3.13Å; G238-D275 PolarHBondContact N-OD2 2.98Å; Q266-D275 WeakPolarHBondContact CG-OD2 3.48Å; Q266-D275 PolarHBondContact NE2-OD2 2.89Å; E269-D275 HydrophobicContact CB-CB 3.71Å; E269-D275 PolarHBondContact O-N 3.14Å; M270-D275 HydrophobicContact CG-CB 4.41Å; M270-D275 WeakPolarHBondContact CG-O 3.4Å; D275-V278 WeakPolarHBondContact OD1-CG2 3.44Å
276	S	66.4	Low	67.9	Low	73 Å²	73	63 Å²	63	51%	0.51	36%	0.362	S	S	.	.			trans	-104.5	-12.9	-167.5	59	0	0	0	0	115.6	R436	S276-R436 PolarHBondContact O-NH2 3.45Å
277	E	58.9	Low	64.8	Low	151 Å²	151	72.2 Å²	72.2	71%	0.706	40%	0.403	S	S	*	.			trans	-102.2	14.6	-167.1	-64.2	-155.5	149	0	0	116.2	R279	E277-R279 PolarHBondContact O-N 3.11Å
278	V	55.7	Low	62.2	Low	23 Å²	23	76.9 Å²	76.9	14%	0.139	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-71.6	122.4	-166.9	-167.8	0	0	0	0	114	Q266 M270 D275 F440	Q266-V278 HydrophobicContact CG-CG2 4.35Å; M270-V278 HydrophobicContact CG-CG2 4.43Å; M270-V278 HydrophobicContact SD-CG2 4.28Å; D275-V278 WeakPolarHBondContact OD1-CG2 3.44Å; V278-F440 HydrophobicContact CG1-CD2 4.13Å; V278-F440 HydrophobicContact CG1-CE2 4.09Å
279	R	55	Low	59.4	Low	200 Å²	200	84.7 Å²	84.7	76%	0.755	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-79.1	141.7	164.1	-69.4	177.4	-179.7	159.9	3.1	110.5	E277	E277-R279 PolarHBondContact O-N 3.11Å
280	C	47.7	Very low	56.5	Low	79 Å²	79	91.5 Å²	91.5	53%	0.534	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-53	153.1	-177.4	-56.7	0	0	0	0	113.2	G282	C280-G282 PolarHBondContact O-N 3.11Å
281	L	55.8	Low	53.9	Low	68 Å²	68	96.2 Å²	96.2	36%	0.356	54%	0.542	S	S	.	.	S	Bend	trans	-68	9.3	-168.7	-70	170.9	0	0	0	116.1	K263 F440 E443	K263-L281 HydrophobicContact CD-CD2 3.63Å; L281-F440 HydrophobicContact CD1-CD2 4.35Å; L281-F440 HydrophobicContact CD1-CE2 4.09Å; L281-F440 HydrophobicContact CD1-CZ 4.49Å; L281-F440 HydrophobicContact CD2-CE2 4.12Å; L281-F440 HydrophobicContact CG-CD2 4.45Å; L281-F440 HydrophobicContact CG-CE2 4.19Å; L281-E443 HydrophobicContact CD1-CB 3.53Å; L281-E443 HydrophobicContact CD1-CG 4.42Å; L281-E443 HydrophobicContact CG-CB 4.39Å; L281-E443 WeakPolarHBondContact CG-OE2 3.49Å; L281-E443 PolarHBondContact N-OE1 2.78Å; L281-E443 PolarHBondContact N-OE2 2.85Å
282	G	44.2	Very low	51	Low	58 Å²	58	107 Å²	107	60%	0.598	58%	0.584	S	S	*	*	S	Bend	trans	-140.9	112.5	179.4	0	0	0	0	0	113.7	C280	C280-G282 PolarHBondContact O-N 3.11Å
283	G	36.1	Very low	48.7	Very low	74 Å²	74	111 Å²	111	76%	0.763	61%	0.612	S	S	*	*			trans	63.5	109.3	135.5	0	0	0	0	0	120.4
284	R	33.1	Very low	46.5	Very low	249 Å²	249	116.2 Å²	116.2	94%	0.94	64%	0.638	S	S	*	*			trans	72.6	109.7	149.1	-57.8	-175	178.8	-152.5	-1.3	117.5
285	S	30.6	Very low	44.3	Very low	89 Å²	89	119.3 Å²	119.3	62%	0.622	66%	0.661	S	S	*	*			trans	-27.4	131.5	162.7	179.8	0	0	0	0	115.5	K287	S285-K287 PolarHBondContact O-N 2.99Å; S285-K287 PolarHBondContact OG-N 3.36Å
286	P	39.3	Very low	42.4	Very low	123 Å²	123	124.1 Å²	124.1	80%	0.799	69%	0.693	S	S	*	*			trans	-86.5	93.7	147.7	13.3	4.6	0	0	0	108.1	S288	P286-S288 PolarHBondContact O-N 3.23Å
287	K	31.8	Very low	41.4	Very low	195 Å²	195	131.8 Å²	131.8	85%	0.848	71%	0.71	S	S	*	*			trans	-74.8	96.4	152.7	-89.7	-176.9	172.3	178.9	0	106.7	S285	S285-K287 PolarHBondContact O-N 2.99Å; S285-K287 PolarHBondContact OG-N 3.36Å
288	S	40.4	Very low	40.4	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	71%	0.71	S	S	*	*			trans	166.9	141.9	147.3	55	0	0	0	0	111.3	P286	P286-S288 PolarHBondContact O-N 3.23Å
289	Q	35.4	Very low	39.7	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	75%	0.745	S	S	*	*			trans	100.2	77.6	162.7	-60.2	-172.2	-26.3	0	0	117.5
290	D	34.2	Very low	38.9	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	74%	0.741	S	S	*	*				46.2	111.3	109.1	-60.3	-43.4	0	0	0	119.3
291	S	36.9	Very low	38.8	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	76%	0.755	S	S	*	*				52.3	99.8	123.4	-51.1	0	0	0	0	118.8
292	Y	31.4	Very low	38.2	Very low	229 Å²	229	137.6 Å²	137.6	90%	0.898	78%	0.776	S	S	*	*			trans	-77.5	143.3	155.5	-68.9	-81.9	0	0	0	110.3
293	P	39.5	Very low	38	Very low	114 Å²	114	139.9 Å²	139.9	74%	0.74	78%	0.783	S	S	*	*				-139.2	138.9	107.4	32	-16.2	0	0	0	114.3
294	V	38.4	Very low	38.3	Very low	136 Å²	136	144.1 Å²	144.1	82%	0.824	78%	0.784	S	S	*	*			trans	54	105.1	140.2	-171.1	0	0	0	0	118
295	S	38.1	Very low	38.8	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	77%	0.774	S	S	*	*			trans	-71.1	154.5	156.4	-119.3	0	0	0	0	110.5
296	P	41.5	Very low	39.4	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	78%	0.781	S	S	*	*				-155	155.6	71.4	41.7	-21.4	0	0	0	119
297	R	45.2	Very low	39.5	Very low	234 Å²	234	137.3 Å²	137.3	88%	0.883	78%	0.775	S	S	*	*			trans	112.7	144.3	144	-61.5	-161.1	-175.4	-149.3	-0.3	118.7
298	P	38.7	Very low	40	Very low	106 Å²	106	137 Å²	137	69%	0.688	78%	0.776	S	S	*	*			trans	-115.9	146	-156.9	37	-21.4	0	0	0	113.4
299	F	40.6	Very low	39.9	Very low	203 Å²	203	135.2 Å²	135.2	89%	0.89	77%	0.774	S	S	*	*			trans	-154	114.4	157.2	-96.8	-78.7	0	0	0	112.1
300	S	39.2	Very low	40.4	Very low	95 Å²	95	136.1 Å²	136.1	66%	0.664	78%	0.781	S	S	*	*			trans	60.3	105.9	132.2	-53.6	0	0	0	0	123.5
301	S	44.3	Very low	40.5	Very low	119 Å²	119	133.5 Å²	133.5	83%	0.832	77%	0.774	S	S	*	*				87.6	150.2	115	-66.7	0	0	0	0	122.6
302	P	44.4	Very low	40.6	Very low	121 Å²	121	134.8 Å²	134.8	79%	0.786	77%	0.77	S	S	*	*			trans	-124.7	170.1	-141.5	40.9	-25.3	0	0	0	115.2
303	S	38.8	Very low	41.1	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	77%	0.77	S	S	*	*			trans	-174	110.2	160.5	-173.8	0	0	0	0	112.3
304	M	42.7	Very low	40.8	Very low	162 Å²	162	132.2 Å²	132.2	80%	0.798	77%	0.766	S	S	*	*				90	97.6	105.3	-64.7	-66.7	153.6	0	0	118.1
305	S	43.1	Very low	40.9	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	77%	0.772	S	S	*	*				61.3	169.9	116	-42	0	0	0	0	121.5
306	P	44.7	Very low	41	Very low	117 Å²	117	133.2 Å²	133.2	76%	0.76	77%	0.77	S	S	*	*				-134.9	-168.3	-101.2	33.4	-8.5	0	0	0	113.8
307	S	40	Very low	41.1	Very low	98 Å²	98	134.2 Å²	134.2	69%	0.685	78%	0.777	S	S	*	*			trans	129.7	154	140.5	69.4	0	0	0	0	119.3
308	H	42.1	Very low	40.7	Very low	187 Å²	187	127 Å²	127	87%	0.866	78%	0.775	S	S	*	*			trans	92.6	125.3	177.1	-61.6	-73.3	0	0	0	116.7
309	G	39	Very low	40.5	Very low	63 Å²	63	132 Å²	132	65%	0.649	79%	0.786	S	S	*	*			cis	139.2	133.5	1.9	0	0	0	0	0	111.6
310	M	45.2	Very low	40.4	Very low	193 Å²	193	127.5 Å²	127.5	95%	0.951	78%	0.779	S	S	*	*			trans	78.7	149.7	158.9	-46.6	-116.2	112.2	0	0	117.3
311	S	37.8	Very low	40.5	Very low	88 Å²	88	127.7 Å²	127.7	62%	0.615	78%	0.781	S	S	*	*			cis	-174.5	133.4	-20.2	-171.4	0	0	0	0	107.8
312	I	38.9	Very low	40.2	Very low	138 Å²	138	128.8 Å²	128.8	71%	0.708	78%	0.783	S	S	*	*			trans	37.2	128.7	137.8	-55.6	172.9	0	0	0	120.9
313	H	41.4	Very low	39.8	Very low	193 Å²	193	127.2 Å²	127.2	89%	0.894	78%	0.78	S	S	*	*				-163.6	135	119.9	-96.1	-66.4	0	0	0	113.2
314	S	33.6	Very low	39.6	Very low	95 Å²	95	130.8 Å²	130.8	66%	0.664	79%	0.785	S	S	*	*			trans	-95.3	154	-179.8	152.8	0	0	0	0	110.7
315	L	39	Very low	39.1	Very low	178 Å²	178	133 Å²	133	93%	0.932	79%	0.79	S	S	*	*			trans	-170.3	143.6	139.5	-96.2	140.6	0	0	0	111.5
316	A	41.4	Very low	38.4	Very low	87 Å²	87	133.1 Å²	133.1	72%	0.719	79%	0.791	S	S	*	*			trans	-111.9	-156.6	-159.3	0	0	0	0	0	112.9
317	P	42.9	Very low	37.9	Very low	132 Å²	132	131 Å²	131	86%	0.857	79%	0.79	S	S	*	*				-120.1	174.7	-119.4	29.3	-5.7	0	0	0	115.6
318	G	37.9	Very low	37.4	Very low	82 Å²	82	135.1 Å²	135.1	85%	0.845	80%	0.796	S	S	*	*			trans	-129	137	177.3	0	0	0	0	0	114.3
319	K	33.7	Very low	36.8	Very low	210 Å²	210	134.4 Å²	134.4	91%	0.913	79%	0.793	S	S	*	*			trans	-101.5	150	-179.3	-70.2	172.8	172	175.9	0	112.2
320	S	38.8	Very low	36.3	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	79%	0.793	S	S	*	*			trans	177.2	109.9	144.6	57.6	0	0	0	0	109.2
321	S	40	Very low	35.6	Very low	99 Å²	99	132.4 Å²	132.4	69%	0.692	79%	0.787	S	S	*	*				89.1	125.9	70	61.2	0	0	0	0	116.4
322	T	38	Very low	35	Very low	142 Å²	142	133.1 Å²	133.1	87%	0.871	79%	0.792	S	S	*	*			trans	70.4	143	148.6	50.4	0	0	0	0	119
323	A	37.4	Very low	34.8	Very low	88 Å²	88	134.7 Å²	134.7	73%	0.727	80%	0.802	S	S	*	*			cis	-162.7	155.4	18.9	0	0	0	0	0	113.6
324	H	33.2	Very low	34.3	Very low	181 Å²	181	128.9 Å²	128.9	84%	0.838	79%	0.794	S	S	*	*			trans	4.9	138.5	150.7	-65	-89.1	0	0	0	124.1
325	F	32.8	Very low	34.4	Very low	209 Å²	209	130.7 Å²	130.7	92%	0.917	80%	0.801	S	S	*	*				-155.6	142.4	126.3	-139.9	-95.3	0	0	0	112
326	S	29.7	Very low	34.3	Very low	106 Å²	106	129.3 Å²	129.3	74%	0.741	79%	0.793	S	S	*	*			trans	-133.8	142.1	-179.1	53.2	0	0	0	0	110.1
327	G	32.8	Very low	33.7	Very low	72 Å²	72	129.7 Å²	129.7	74%	0.742	79%	0.79	S	S	*	*			trans	177.1	101.8	167.3	0	0	0	0	0	108.6
328	F	29.8	Very low	33.5	Very low	185 Å²	185	131.5 Å²	131.5	81%	0.811	79%	0.792	S	S	*	*				52.2	113.6	91.3	-159.3	-95.7	0	0	0	113.5
329	E	30.5	Very low	33.2	Very low	172 Å²	172	137.1 Å²	137.1	80%	0.804	79%	0.794	S	S	*	*				-171.6	128	122	-99.8	176.4	-169.1	0	0	111.3
330	S	27.8	Very low	33.2	Very low	94 Å²	94	131.5 Å²	131.5	66%	0.657	79%	0.787	S	S	*	*			trans	-109.9	130.3	169.9	173.6	0	0	0	0	106.8
331	C	29.9	Very low	33.1	Very low	120 Å²	120	135.8 Å²	135.8	81%	0.811	79%	0.794	S	S	*	*			trans	-122.8	115.6	172.6	-69.9	0	0	0	0	109.8
332	S	26.7	Very low	32.7	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	80%	0.8	S	S	*	*			trans	-109.8	139.2	165.1	-56.1	0	0	0	0	108.2
333	N	34.6	Very low	32.5	Very low	171 Å²	171	138.3 Å²	138.3	91%	0.914	80%	0.798	S	S	*	*			trans	-156.8	115.8	158.7	-86.1	-29.8	0	0	0	105.5
334	G	29.4	Very low	32.1	Very low	71 Å²	71	142.9 Å²	142.9	73%	0.732	80%	0.798	S	S	*	*				87.6	115.7	75.5	0	0	0	0	0	108.5
335	V	35.8	Very low	31.8	Very low	132 Å²	132	140.2 Å²	140.2	80%	0.8	80%	0.798	S	S	*	*				-179.6	123.2	93.1	155.9	0	0	0	0	111.4
336	I	36.4	Very low	31.5	Very low	150 Å²	150	137.9 Å²	137.9	77%	0.769	79%	0.79	S	S	*	*			trans	62.7	102.3	131.8	-48.7	176.4	0	0	0	123
337	S	30.5	Very low	31.5	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	79%	0.786	S	S	*	*				18.4	130.5	126.6	-154	0	0	0	0	123.4
338	N	37.2	Very low	31.2	Very low	170 Å²	170	143.6 Å²	143.6	91%	0.909	79%	0.793	S	S	*	*				-158.3	137.2	124.1	-100.6	-17	0	0	0	113.2
339	K	32	Very low	31.1	Very low	201 Å²	201	142.8 Å²	142.8	87%	0.874	79%	0.791	S	S	*	*			trans	-85.9	144.9	-177.3	-76.5	172.1	170.1	173.6	0	112.1
340	A	34.3	Very low	30.9	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	79%	0.794	S	S	*	*				-178.5	135.5	125.2	0	0	0	0	0	114.3
341	H	35.4	Very low	30.7	Very low	198 Å²	198	147.7 Å²	147.7	92%	0.917	81%	0.808	S	S	*	*			trans	72.8	116.7	160.3	-77.4	-65.6	0	0	0	123.3
342	Q	32.8	Very low	30.5	Very low	175 Å²	175	146.1 Å²	146.1	82%	0.818	80%	0.799	S	S	*	*			trans	-87.1	139.4	179.2	-67.8	165.7	-13.9	0	0	111.9
343	S	33.3	Very low	30.4	Very low	120 Å²	120	146.7 Å²	146.7	84%	0.839	80%	0.803	S	S	*	*			trans	-142.8	122.6	141.9	55.7	0	0	0	0	108.6
344	Y	28.7	Very low	30.1	Very low	184 Å²	184	144.3 Å²	144.3	72%	0.722	79%	0.789	S	S	*	*			trans	-74.2	123.9	-168.3	-117.8	-106	0	0	0	112.6	H346	Y344-H346 AromaticContact CD1-CD2 4Å; Y344-H346 AromaticContact CE1-CD2 3.47Å; Y344-H346 VanDerWaalsContact CE1-CD2 3.47Å; Y344-H346 WeakPolarHBondContact CE1-CD2 3.35Å; Y344-H346 AromaticContact CE1-NE2 3.29Å; Y344-H346 VanDerWaalsContact CE1-NE2 3.29Å; Y344-H346 WeakPolarHBondContact CE1-NE2 3.36Å; Y344-H346 AromaticContact CZ-NE2 3.82Å
345	C	27.7	Very low	30.2	Very low	125 Å²	125	145.3 Å²	145.3	85%	0.845	78%	0.782	S	S	*	*			trans	-143.5	113.4	146.9	59.8	0	0	0	0	109.3
346	H	26.8	Very low	30.3	Very low	160 Å²	160	141.8 Å²	141.8	74%	0.741	76%	0.76	S	S	*	*			trans	-86.7	111.2	177.8	-86.9	-37.7	0	0	0	110.1	Y344	Y344-H346 AromaticContact CD1-CD2 4Å; Y344-H346 AromaticContact CE1-CD2 3.47Å; Y344-H346 VanDerWaalsContact CE1-CD2 3.47Å; Y344-H346 WeakPolarHBondContact CE1-CD2 3.35Å; Y344-H346 AromaticContact CE1-NE2 3.29Å; Y344-H346 VanDerWaalsContact CE1-NE2 3.29Å; Y344-H346 WeakPolarHBondContact CE1-NE2 3.36Å; Y344-H346 AromaticContact CZ-NE2 3.82Å
347	S	30.1	Very low	30.2	Very low	93 Å²	93	138.6 Å²	138.6	65%	0.65	75%	0.749	S	S	*	*			trans	-133.2	112.8	148.9	-179.9	0	0	0	0	107.9	H349	S347-H349 PolarHBondContact O-N 3.47Å
348	K	25.2	Very low	30.3	Very low	205 Å²	205	138.9 Å²	138.9	89%	0.891	74%	0.74	S	S	*	*			trans	-73.7	102.5	173.1	-82	-178	174.9	178	0	108.1
349	H	28.3	Very low	30.2	Very low	167 Å²	167	134.9 Å²	134.9	77%	0.773	72%	0.718	S	S	*	*			trans	-108.6	116.9	155.2	-86.1	-81.2	0	0	0	108.9	S347 L351	S347-H349 PolarHBondContact O-N 3.47Å; H349-L351 PolarHBondContact O-N 2.82Å
350	Q	26	Very low	30.3	Very low	187 Å²	187	128.7 Å²	128.7	87%	0.874	70%	0.695	S	S	*	*			trans	-61.3	124.8	169.4	-78.1	174.2	-33.5	0	0	108.6	S352	Q350-S352 PolarHBondContact O-N 2.99Å; Q350-S352 VanDerWaalsContact O-N 3.08Å
351	L	22.9	Very low	30.3	Very low	182 Å²	182	127.7 Å²	127.7	95%	0.953	68%	0.682	S	S	*	*			trans	-65.7	100.5	163.3	-81.3	118.5	0	0	0	108.3	H349	H349-L351 PolarHBondContact O-N 2.82Å
352	S	26.6	Very low	30.3	Very low	88 Å²	88	123.5 Å²	123.5	62%	0.615	67%	0.666	S	S	*	*			trans	-91.9	124.8	161.4	53.1	0	0	0	0	108.3	Q350 L354	Q350-S352 PolarHBondContact O-N 2.99Å; Q350-S352 VanDerWaalsContact O-N 3.08Å; S352-L354 PolarHBondContact O-N 3.06Å
353	S	25.1	Very low	30.2	Very low	115 Å²	115	121.5 Å²	121.5	80%	0.804	66%	0.661	S	S	*	*			trans	-52.5	107	168.6	55	0	0	0	0	109.7	T355	S353-T355 PolarHBondContact O-N 3Å
354	L	27.6	Very low	30.3	Very low	121 Å²	121	119.3 Å²	119.3	63%	0.634	64%	0.642	S	S	*	*			trans	-71	126.6	178.9	-62.6	166.8	0	0	0	108.8	S352 E358	S352-L354 PolarHBondContact O-N 3.06Å; L354-E358 WeakPolarHBondContact CD2-OE2 3.35Å
355	T	30.8	Very low	30.4	Very low	93 Å²	93	115.3 Å²	115.3	57%	0.571	64%	0.641	S	S	*	*			trans	-78.9	150.1	176.1	49.9	0	0	0	0	110.4	S353 P357 E358	S353-T355 PolarHBondContact O-N 3Å; T355-P357 WeakPolarHBondContact O-CD 3.33Å; T355-E358 PolarHBondContact O-N 3.45Å
356	V	38.2	Very low	30.6	Very low	57 Å²	57	118.3 Å²	118.3	35%	0.345	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-42.9	-26.9	-176.6	-173.8	0	0	0	0	116.9	E358	V356-E358 VanDerWaalsContact C-N 3.32Å; V356-E358 PolarHBondContact O-N 2.96Å
357	P	34	Very low	30.8	Very low	83 Å²	83	115 Å²	115	54%	0.539	63%	0.63	S	S	.	*	H	α-helix	trans	-67.2	-22.1	174.9	-22.3	35.4	0	0	0	115.7	T355 S361	T355-P357 WeakPolarHBondContact O-CD 3.33Å; P357-S361 PolarHBondContact O-OG 3.22Å
358	E	34.4	Very low	30.8	Very low	100 Å²	100	118.5 Å²	118.5	47%	0.467	64%	0.636	S	S	.	*	H	α-helix	trans	-80.9	-22.4	-178.4	-82.9	170.8	132.2	0	0	113.5	L354 T355 V356	L354-E358 WeakPolarHBondContact CD2-OE2 3.35Å; T355-E358 PolarHBondContact O-N 3.45Å; V356-E358 VanDerWaalsContact C-N 3.32Å; V356-E358 PolarHBondContact O-N 2.96Å
359	L	33.2	Very low	31.1	Very low	86 Å²	86	117.5 Å²	117.5	45%	0.45	63%	0.634	S	S	.	*	H	α-helix	trans	-75.2	-31	175.8	-79	156.9	0	0	0	112.2
360	N	35.6	Very low	31.2	Very low	72 Å²	72	115.4 Å²	115.4	39%	0.385	63%	0.633	S	S	.	*	H	α-helix	trans	-85.2	-13.6	178	-70.3	-2.5	0	0	0	113.4	L362	N360-L362 VanDerWaalsContact C-N 3.32Å
361	S	34.2	Very low	31.2	Very low	70 Å²	70	113.8 Å²	113.8	49%	0.49	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.4	-12.1	179.6	-60.2	0	0	0	0	113.4	P357	P357-S361 PolarHBondContact O-OG 3.22Å
362	L	34.1	Very low	31.3	Very low	111 Å²	111	112.3 Å²	112.3	58%	0.581	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-20.8	175.3	-72.2	165.2	0	0	0	112.8	N360	N360-L362 VanDerWaalsContact C-N 3.32Å
363	N	32.5	Very low	31.5	Very low	133 Å²	133	118.3 Å²	118.3	71%	0.711	64%	0.639	S	S	*	*	S	Bend	trans	-82.7	-13	178.8	-95.4	13.4	0	0	0	114.9
364	V	34.3	Very low	31.5	Very low	73 Å²	73	119.7 Å²	119.7	44%	0.442	64%	0.642	S	S	.	*	S	Bend	trans	-97.4	-11.6	-175.3	-174.8	0	0	0	0	112.5
365	S	31.6	Very low	31.7	Very low	101 Å²	101	119.4 Å²	119.4	71%	0.706	65%	0.651	S	S	*	*	S	Bend	trans	-92	-2.6	-172.6	-53.2	0	0	0	0	114.6
366	R	32.2	Very low	31.6	Very low	188 Å²	188	122.2 Å²	122.2	71%	0.709	66%	0.662	S	S	*	*	S	Bend	trans	-114.7	-13.2	-178.7	-144.9	175.6	-172.7	-170.9	-0.2	114.4	Q368	R366-Q368 VanDerWaalsContact C-N 3.34Å; R366-Q368 PolarHBondContact O-N 2.88Å
367	S	30	Very low	31.3	Very low	91 Å²	91	127.1 Å²	127.1	64%	0.636	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	1.9	179.3	48.8	0	0	0	0	114.7
368	Q	31	Very low	31.5	Very low	165 Å²	165	130 Å²	130	77%	0.771	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	12.2	176.1	-72.7	-173.7	-15.7	0	0	114.6	R366	R366-Q368 VanDerWaalsContact C-N 3.34Å; R366-Q368 PolarHBondContact O-N 2.88Å
369	Q	30.1	Very low	31.2	Very low	185 Å²	185	132.9 Å²	132.9	86%	0.864	72%	0.721	S	S	*	*	S	Bend	trans	-129.5	11.3	177.3	-87.9	-172.6	-23.1	0	0	115.8
370	V	30.8	Very low	31.6	Very low	123 Å²	123	137.5 Å²	137.5	75%	0.745	74%	0.742	S	S	*	*			trans	-115.2	72.1	175.5	-165.3	0	0	0	0	109.5
371	N	26.2	Very low	31.2	Very low	153 Å²	153	142.9 Å²	142.9	82%	0.818	77%	0.765	S	S	*	*			trans	-141.7	86.5	165.9	-92.1	-15.7	0	0	0	106.7
372	N	25.9	Very low	31.4	Very low	150 Å²	150	146 Å²	146	80%	0.802	78%	0.781	S	S	*	*			trans	166.8	69.4	155.4	-87.2	-12	0	0	0	110.3
373	F	29.7	Very low	31.3	Very low	214 Å²	214	147.2 Å²	147.2	94%	0.939	79%	0.789	S	S	*	*			trans	-146	104.6	152.5	-82	-71.5	0	0	0	108.9
374	T	25.1	Very low	31.2	Very low	144 Å²	144	149.8 Å²	149.8	88%	0.883	80%	0.796	S	S	*	*			trans	-70.5	118.4	166	47.7	0	0	0	0	108.4
375	S	30.9	Very low	31.3	Very low	116 Å²	116	157.1 Å²	157.1	81%	0.811	82%	0.817	S	S	*	*			trans	-132.7	134	164.4	-172.1	0	0	0	0	109
376	N	30.3	Very low	31.2	Very low	151 Å²	151	157.6 Å²	157.6	81%	0.807	82%	0.821	S	S	*	*			trans	-70.8	133.8	-164.9	-58.7	-50.1	0	0	0	112.4
377	D	30.9	Very low	31.5	Very low	161 Å²	161	156.8 Å²	156.8	86%	0.861	83%	0.83	S	S	*	*			trans	-63.6	132.7	165	-82	-49.3	0	0	0	110.6
378	V	38.9	Very low	31.8	Very low	143 Å²	143	155.7 Å²	155.7	87%	0.867	83%	0.833	S	S	*	*			trans	-123.9	110.1	162.1	-102.6	0	0	0	0	106.9
379	D	28.6	Very low	32	Very low	160 Å²	160	154.5 Å²	154.5	86%	0.856	84%	0.837	S	S	*	*			trans	-56.3	134.8	174.6	-73.5	-54.6	0	0	0	111.7
380	M	39.9	Very low	32.4	Very low	183 Å²	183	149.5 Å²	149.5	90%	0.901	84%	0.835	S	S	*	*			trans	-130	107.5	160.7	-114.4	-172.4	-165.8	0	0	109.8
381	E	28.7	Very low	32.5	Very low	185 Å²	185	152 Å²	152	86%	0.864	84%	0.838	S	S	*	*			trans	-59.5	136.4	165.8	-62.9	-175.5	144.3	0	0	110
382	T	37.2	Very low	33.1	Very low	135 Å²	135	151.7 Å²	151.7	83%	0.828	84%	0.842	S	S	*	*			trans	-121.1	108.9	169.6	-47.1	0	0	0	0	109.4
383	D	31.7	Very low	33.6	Very low	138 Å²	138	149.9 Å²	149.9	74%	0.738	84%	0.842	S	S	*	*			trans	-67.8	139.6	173.4	-84.2	-45.3	0	0	0	112.5
384	H	30.7	Very low	34.1	Very low	186 Å²	186	144.8 Å²	144.8	86%	0.861	83%	0.833	S	S	*	*			trans	-66.3	130.9	172	-73.9	-76.1	0	0	0	112.4
385	Y	36.5	Very low	34.7	Very low	227 Å²	227	145.7 Å²	145.7	89%	0.89	83%	0.832	S	S	*	*			trans	-126.5	114.8	155.4	-85.2	-87.2	0	0	0	110.9
386	S	30.9	Very low	34.9	Very low	112 Å²	112	143.1 Å²	143.1	78%	0.783	82%	0.824	S	S	*	*			trans	-85.8	140.5	170.9	179.5	0	0	0	0	109.7
387	N	38.1	Very low	35.3	Very low	170 Å²	170	144.9 Å²	144.9	91%	0.909	83%	0.825	S	S	*	*			trans	-147.9	116.8	165.3	-107.2	-12.8	0	0	0	111.7
388	G	36.4	Very low	35.6	Very low	68 Å²	68	144.5 Å²	144.5	70%	0.701	82%	0.822	S	S	*	*				93.6	79	119.9	0	0	0	0	0	119.8
389	V	35	Very low	35.3	Very low	141 Å²	141	145.2 Å²	145.2	86%	0.855	82%	0.821	S	S	*	*			trans	4.5	136	138.8	-167.5	0	0	0	0	119.6	E391	V389-E391 HydrophobicContact CG1-CG 4.5Å
390	G	37.7	Very low	35.6	Very low	79 Å²	79	141.4 Å²	141.4	81%	0.814	82%	0.819	S	S	*	*			trans	-159.3	92.5	153.8	0	0	0	0	0	111.8
391	E	34	Very low	35.2	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	81%	0.814	S	S	*	*			trans	-73.1	135.1	173.3	-65.6	-179.9	154	0	0	111.7	V389	V389-E391 HydrophobicContact CG1-CG 4.5Å
392	T	38.4	Very low	35.7	Very low	147 Å²	147	134.6 Å²	134.6	90%	0.902	81%	0.81	S	S	*	*			trans	-147.8	125.6	145.3	50.2	0	0	0	0	111
393	S	36.6	Very low	35.7	Very low	112 Å²	112	137.6 Å²	137.6	78%	0.783	81%	0.811	S	S	*	*			trans	-78.3	150.5	-178	-13.2	0	0	0	0	113.1
394	S	40.3	Very low	35.6	Very low	108 Å²	108	139 Å²	139	76%	0.755	81%	0.813	S	S	*	*				170.2	119.7	122	50.8	0	0	0	0	114.9
395	N	37.5	Very low	35.7	Very low	163 Å²	163	136.6 Å²	136.6	87%	0.872	81%	0.806	S	S	*	*			trans	43.7	125.7	136.1	-62.7	-9.5	0	0	0	123.2
396	G	35	Very low	35.7	Very low	61 Å²	61	134.1 Å²	134.1	63%	0.629	80%	0.803	S	S	*	*				132.8	109.1	107.8	0	0	0	0	0	120.1
397	F	39.2	Very low	35.6	Very low	189 Å²	189	138.1 Å²	138.1	83%	0.829	81%	0.809	S	S	*	*			trans	79.5	107.5	136	-57.1	-72.3	0	0	0	123.3
398	L	36.4	Very low	35.7	Very low	153 Å²	153	138.6 Å²	138.6	80%	0.801	81%	0.808	S	S	*	*				53.1	110.5	119.7	-68.3	168.8	0	0	0	121.8
399	N	32	Very low	35.9	Very low	158 Å²	158	144.6 Å²	144.6	85%	0.845	82%	0.818	S	S	*	*				61.6	111.7	119.9	-144.3	18.5	0	0	0	119.8
400	G	36.4	Very low	36	Very low	79 Å²	79	144.9 Å²	144.9	81%	0.814	82%	0.815	S	S	*	*			trans	-147.3	113.5	163.4	0	0	0	0	0	110.6
401	S	31.1	Very low	35.8	Very low	115 Å²	115	145.6 Å²	145.6	80%	0.804	81%	0.806	S	S	*	*			trans	-97.3	134.5	175.1	72.4	0	0	0	0	111.3
402	S	38.7	Very low	36.2	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	80%	0.802	S	S	*	*			trans	-167.6	100.8	152.6	58.6	0	0	0	0	108.1
403	K	36.6	Very low	36.3	Very low	199 Å²	199	141.2 Å²	141.2	87%	0.865	79%	0.786	S	S	*	*				64.9	115	100.6	-77.7	-168.2	177	-177.6	0	115.6
404	H	30.8	Very low	36.5	Very low	167 Å²	167	144.9 Å²	144.9	77%	0.773	79%	0.791	S	S	*	*			trans	73.2	101.9	147	-112.2	-80.8	0	0	0	118
405	D	32.7	Very low	36.7	Very low	135 Å²	135	146 Å²	146	72%	0.722	79%	0.786	S	S	*	*				179.7	137.1	103.2	-92	-19.9	0	0	0	113.7
406	H	36	Very low	36.7	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.815	79%	0.785	S	S	*	*			trans	52.8	103.6	163.1	-81.5	-70.5	0	0	0	121.4	M408	H406-M408 PolarHBondContact O-N 3.23Å
407	E	29.5	Very low	37.2	Very low	195 Å²	195	150.1 Å²	150.1	91%	0.911	79%	0.792	S	S	*	*			trans	-48.5	119.5	158.1	-61.5	169.5	155.7	0	0	112
408	M	40	Very low	37	Very low	180 Å²	180	147 Å²	147	89%	0.887	78%	0.784	S	S	*	*			trans	-133.5	109.2	158	-84.1	-84.3	-90.4	0	0	105.9	H406 D410	H406-M408 PolarHBondContact O-N 3.23Å; M408-D410 PolarHBondContact O-N 3.39Å
409	E	39.2	Very low	37.1	Very low	195 Å²	195	145.6 Å²	145.6	91%	0.911	79%	0.785	S	S	*	*			trans	-47.9	122.2	-177.2	-84.1	173.3	134.3	0	0	112.3	C411	E409-C411 PolarHBondContact O-N 2.65Å; E409-C411 VanDerWaalsContact O-N 3.17Å
410	D	37	Very low	37.3	Very low	147 Å²	147	141.2 Å²	141.2	79%	0.786	77%	0.767	S	S	*	*			trans	-71.5	98.2	167.2	-151.3	10.9	0	0	0	107.7	M408 D412	M408-D410 PolarHBondContact O-N 3.39Å; D410-D412 PolarHBondContact O-N 2.86Å; D410-D412 VanDerWaalsContact O-N 3.15Å
411	C	35.1	Very low	37.5	Very low	93 Å²	93	146.8 Å²	146.8	63%	0.628	77%	0.772	S	S	*	*			trans	-88.2	64.9	177.4	-168	0	0	0	0	110	E409 T413	E409-C411 PolarHBondContact O-N 2.65Å; E409-C411 VanDerWaalsContact O-N 3.17Å; C411-T413 PolarHBondContact O-N 2.66Å
412	D	40.9	Very low	38.3	Very low	138 Å²	138	147.6 Å²	147.6	74%	0.738	77%	0.766	S	S	*	*			trans	-80.8	74.9	157.2	-85.5	-20.4	0	0	0	107.7	D410	D410-D412 PolarHBondContact O-N 2.86Å; D410-D412 VanDerWaalsContact O-N 3.15Å
413	T	40.5	Very low	39	Very low	93 Å²	93	151.2 Å²	151.2	57%	0.571	76%	0.763	S	S	*	*			trans	-102.9	99.5	162.4	-44.3	0	0	0	0	107.2	C411 M415	C411-T413 PolarHBondContact O-N 2.66Å; T413-M415 VanDerWaalsContact C-N 3.33Å; T413-M415 PolarHBondContact O-N 3.46Å
414	E	40.8	Very low	40.2	Very low	189 Å²	189	149.4 Å²	149.4	88%	0.883	75%	0.751	S	S	*	*			trans	-56.9	98.5	163.1	-63.5	-173.2	154.7	0	0	107.5	E416	E414-E416 PolarHBondContact O-N 2.94Å
415	M	44.2	Very low	41.8	Very low	131 Å²	131	146 Å²	146	65%	0.645	74%	0.735	S	S	*	*			trans	-81.7	95	170.4	-64.9	-163.6	-147.8	0	0	107	T413 V417	T413-M415 VanDerWaalsContact C-N 3.33Å; T413-M415 PolarHBondContact O-N 3.46Å; M415-V417 PolarHBondContact O-N 2.66Å; M415-V417 VanDerWaalsContact O-N 3.13Å
416	E	38.2	Very low	43.8	Very low	182 Å²	182	141.6 Å²	141.6	85%	0.85	71%	0.711	S	S	*	*			trans	-51.9	118.5	163.3	-77.3	-170.3	144.8	0	0	108.5	E414 D418	E414-E416 PolarHBondContact O-N 2.94Å; E416-D418 PolarHBondContact O-N 2.91Å
417	V	45.8	Very low	45.5	Very low	128 Å²	128	133.6 Å²	133.6	78%	0.776	68%	0.676	S	S	*	*			trans	-73.8	88.3	168.9	179	0	0	0	0	106	M415 C419	M415-V417 PolarHBondContact O-N 2.66Å; M415-V417 VanDerWaalsContact O-N 3.13Å; V417-C419 PolarHBondContact O-N 3.1Å
418	D	34.2	Very low	47.4	Very low	125 Å²	125	126.2 Å²	126.2	67%	0.668	65%	0.651	S	S	*	*			trans	-68.3	88.2	175.4	-162.4	-0.7	0	0	0	108.8	E416 S420	E416-D418 PolarHBondContact O-N 2.91Å; D418-S420 PolarHBondContact O-N 3.23Å; D418-S420 WeakPolarHBondContact OD1-CB 3.34Å; D418-S420 PolarHBondContact OD1-OG 3.27Å; D418-S420 PolarHBondContact OD2-OG 3.29Å
419	C	38.7	Very low	48.8	Very low	122 Å²	122	119.6 Å²	119.6	82%	0.824	63%	0.629	S	S	*	*			trans	-77.3	53	171.1	-99.9	0	0	0	0	109.7	V417	V417-C419 PolarHBondContact O-N 3.1Å
420	S	36.3	Very low	50.7	Low	66 Å²	66	113 Å²	113	46%	0.462	61%	0.605	S	S	.	*			trans	-112.3	99.8	176.8	64.5	0	0	0	0	111.3	D418 L422	D418-S420 PolarHBondContact O-N 3.23Å; D418-S420 WeakPolarHBondContact OD1-CB 3.34Å; D418-S420 PolarHBondContact OD1-OG 3.27Å; D418-S420 PolarHBondContact OD2-OG 3.29Å; S420-L422 PolarHBondContact O-N 3.25Å
421	Q	41	Very low	52.9	Low	196 Å²	196	112.6 Å²	112.6	92%	0.916	60%	0.598	S	S	*	*			trans	46.4	42.1	151.7	-57.1	-173.5	-2	0	0	118.3	R423	Q421-R423 PolarHBondContact O-N 3.37Å
422	L	48.7	Very low	55.3	Low	132 Å²	132	110.4 Å²	110.4	69%	0.691	59%	0.586	S	S	*	*			trans	-55.8	116.6	161.6	-84.4	157.3	0	0	0	108.5	S420 R424	S420-L422 PolarHBondContact O-N 3.25Å; L422-R424 PolarHBondContact O-N 3.35Å; L422-R424 VanDerWaalsContact O-N 3.11Å
423	R	52.2	Low	57.4	Low	187 Å²	187	104.6 Å²	104.6	71%	0.706	56%	0.558	S	S	*	*			trans	-38.4	120.3	176.2	-100.7	178.5	169.3	172.9	-1.2	109	Q421 Q425	Q421-R423 PolarHBondContact O-N 3.37Å; R423-Q425 HydrophobicContact CB-CG 4.38Å; R423-Q425 PolarHBondContact O-N 3.08Å
424	R	62.1	Low	59.6	Low	160 Å²	160	102.8 Å²	102.8	60%	0.604	54%	0.544	S	S	*	.	S	Bend	trans	-65	65.5	173.7	-63	-176.9	-175	-170	0.4	110.6	L422	L422-R424 PolarHBondContact O-N 3.35Å; L422-R424 VanDerWaalsContact O-N 3.11Å
425	Q	65.1	Low	61.9	Low	95 Å²	95	99.1 Å²	99.1	44%	0.444	53%	0.527	S	S	.	.	S	Bend	trans	-133.1	140.1	-179.6	-71	-175.4	-18.3	0	0	107.3	R423 C427 G428	R423-Q425 HydrophobicContact CB-CG 4.38Å; R423-Q425 PolarHBondContact O-N 3.08Å; Q425-C427 PolarHBondContact O-N 3.41Å; Q425-G428 PolarHBondContact O-N 3.34Å
426	L	73.6	Confident	64	Low	43 Å²	43	98 Å²	98	23%	0.225	52%	0.515	C	S	.	.	G	3₁₀ helix	trans	-47.5	123.3	175.7	-75.2	159.8	0	0	0	110.8	V271 G428 G429 L472 P477	V271-L426 HydrophobicContact CG1-CD2 3.95Å; L426-G428 PolarHBondContact O-N 3.46Å; L426-G429 PolarHBondContact O-N 3.12Å; L426-L472 HydrophobicContact CD2-CD2 4.23Å; L426-P477 HydrophobicContact CD2-CG 3.47Å; L426-P477 VanDerWaalsContact CD2-CG 3.47Å; L426-P477 HydrophobicContact CG-CG 3.98Å
427	C	71.5	Confident	66.5	Low	9 Å²	9	89.5 Å²	89.5	6%	0.061	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	54.2	33.1	179.8	-50.3	0	0	0	0	114.2	M270 V271 Q425 G429 S430 A433 I434 M437	M270-C427 PolarHBondContact O-SG 3.07Å; V271-C427 PolarHBondContact O-N 3.15Å; Q425-C427 PolarHBondContact O-N 3.41Å; C427-G429 PolarHBondContact O-N 3.28Å; C427-G429 VanDerWaalsContact O-N 3.14Å; C427-S430 PolarHBondContact O-N 3.18Å; C427-A433 HydrophobicContact CB-CB 3.68Å; C427-I434 HydrophobicContact CB-CG1 4.02Å; C427-M437 PolarHBondContact SG-SD 3.15Å
428	G	69.3	Low	68.7	Low	39 Å²	39	87 Å²	87	40%	0.402	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	65.7	11.9	-176.3	0	0	0	0	0	114.7	Q425 L426	Q425-G428 PolarHBondContact O-N 3.34Å; L426-G428 PolarHBondContact O-N 3.46Å
429	G	70.6	Confident	71.4	Confident	41 Å²	41	85.1 Å²	85.1	42%	0.423	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	84.3	6.3	-179.5	0	0	0	0	0	115.4	L426 C427 Q431	L426-G429 PolarHBondContact O-N 3.12Å; C427-G429 PolarHBondContact O-N 3.28Å; C427-G429 VanDerWaalsContact O-N 3.14Å; G429-Q431 PolarHBondContact O-N 3.28Å
430	S	78.6	Confident	74.1	Confident	56 Å²	56	79.5 Å²	79.5	39%	0.392	41%	0.406	S	S	.	.			trans	-81.5	116.7	178.9	174	0	0	0	0	111.7	C427 A432 A433 I434	C427-S430 PolarHBondContact O-N 3.18Å; S430-A432 VanDerWaalsContact C-N 3.27Å; S430-A432 PolarHBondContact O-N 3.31Å; S430-A433 WeakPolarHBondContact O-CB 3.44Å; S430-A433 PolarHBondContact O-N 2.96Å; S430-A433 PolarHBondContact OG-N 3.18Å; S430-I434 WeakPolarHBondContact O-CG1 3.47Å; S430-I434 PolarHBondContact O-N 3.29Å
431	Q	83.6	Confident	76.9	Confident	140 Å²	140	76.8 Å²	76.8	65%	0.654	39%	0.389	S	S	*	.	H	α-helix	trans	-56.2	-42.2	177.1	-177.4	179.5	-24.1	0	0	112	G429 A433 I434 E435	G429-Q431 PolarHBondContact O-N 3.28Å; Q431-A433 VanDerWaalsContact C-N 3.29Å; Q431-A433 PolarHBondContact O-N 3.2Å; Q431-I434 PolarHBondContact O-N 3.07Å; Q431-E435 PolarHBondContact NE2-OE1 3.22Å; Q431-E435 WeakPolarHBondContact O-CG 3.32Å; Q431-E435 PolarHBondContact O-N 2.96Å
432	A	86.3	Confident	79.4	Confident	46 Å²	46	76.1 Å²	76.1	38%	0.38	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-35	177.7	0	0	0	0	0	112.1	S430 R436	S430-A432 VanDerWaalsContact C-N 3.27Å; S430-A432 PolarHBondContact O-N 3.31Å; A432-R436 WeakPolarHBondContact O-CG 3.15Å; A432-R436 PolarHBondContact O-N 3.1Å; A432-R436 VanDerWaalsContact O-N 3.11Å; A432-R436 PolarHBondContact O-NH1 2.67Å
433	A	85.1	Confident	81.6	Confident	17 Å²	17	72 Å²	72	14%	0.14	36%	0.355	C	S	.	.	H	α-helix	trans	-70.1	-39	175.5	0	0	0	0	0	111.5	C427 S430 Q431 R436 M437	C427-A433 HydrophobicContact CB-CB 3.68Å; S430-A433 WeakPolarHBondContact O-CB 3.44Å; S430-A433 PolarHBondContact O-N 2.96Å; S430-A433 PolarHBondContact OG-N 3.18Å; Q431-A433 VanDerWaalsContact C-N 3.29Å; Q431-A433 PolarHBondContact O-N 3.2Å; A433-R436 PolarHBondContact O-N 3.34Å; A433-M437 WeakPolarHBondContact O-CB 3.48Å; A433-M437 PolarHBondContact O-N 3.1Å
434	I	85.4	Confident	83.7	Confident	55 Å²	55	63.1 Å²	63.1	28%	0.282	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-46.1	174.6	-65.6	167.7	0	0	0	110.8	C427 S430 Q431 R436 M437 I438	C427-I434 HydrophobicContact CB-CG1 4.02Å; S430-I434 WeakPolarHBondContact O-CG1 3.47Å; S430-I434 PolarHBondContact O-N 3.29Å; Q431-I434 PolarHBondContact O-N 3.07Å; I434-R436 PolarHBondContact O-N 3Å; I434-M437 HydrophobicContact CG2-CE 4.37Å; I434-M437 PolarHBondContact O-N 3.26Å; I434-I438 HydrophobicContact CG2-CD1 3.85Å; I434-I438 HydrophobicContact CG2-CG1 4.44Å; I434-I438 VanDerWaalsContact O-CG1 3.31Å; I434-I438 WeakPolarHBondContact O-CG1 3.23Å; I434-I438 PolarHBondContact O-N 3.23Å
435	E	89	Confident	85.2	Confident	112 Å²	112	58.8 Å²	58.8	52%	0.523	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-43.5	177.5	-73.7	173.5	-167.3	0	0	111.8	Q431 I438 H439	Q431-E435 PolarHBondContact NE2-OE1 3.22Å; Q431-E435 WeakPolarHBondContact O-CG 3.32Å; Q431-E435 PolarHBondContact O-N 2.96Å; E435-I438 PolarHBondContact O-N 3.12Å; E435-H439 PolarHBondContact O-N 3.25Å
436	R	88.1	Confident	86.7	Confident	106 Å²	106	56.7 Å²	56.7	40%	0.4	31%	0.307	S	S	.	.	H	α-helix	trans	-62.6	-43.6	174.2	-73.6	-167.3	-58.6	-86.4	13.2	112.3	M270 S276 A432 A433 I434 H439 F440	M270-R436 HydrophobicContact CE-CB 4.4Å; S276-R436 PolarHBondContact O-NH2 3.45Å; A432-R436 WeakPolarHBondContact O-CG 3.15Å; A432-R436 PolarHBondContact O-N 3.1Å; A432-R436 VanDerWaalsContact O-N 3.11Å; A432-R436 PolarHBondContact O-NH1 2.67Å; A433-R436 PolarHBondContact O-N 3.34Å; I434-R436 PolarHBondContact O-N 3Å; R436-H439 PolarHBondContact O-N 3.4Å; R436-F440 WeakPolarHBondContact O-CB 3.41Å; R436-F440 PolarHBondContact O-N 3.11Å
437	M	90.9	Very high	87.6	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.02	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-43.5	176.7	178.3	-167.2	62.7	0	0	111.6	F267 M270 V271 C427 A433 I434 F440 G441 L472	F267-M437 HydrophobicContact CD2-CG 4.08Å; F267-M437 HydrophobicContact CE2-CG 3.61Å; F267-M437 HydrophobicContact CE2-SD 4.43Å; F267-M437 HydrophobicContact CZ-CG 4.24Å; M270-M437 HydrophobicContact CB-CB 4.47Å; M270-M437 HydrophobicContact CB-CG 4.28Å; M270-M437 HydrophobicContact CE-CB 4.13Å; V271-M437 HydrophobicContact CB-SD 4.22Å; V271-M437 HydrophobicContact CG2-CG 4.48Å; V271-M437 HydrophobicContact CG2-SD 3.43Å; V271-M437 WeakPolarHBondContact CG2-SD 3.48Å; C427-M437 PolarHBondContact SG-SD 3.15Å; A433-M437 WeakPolarHBondContact O-CB 3.48Å; A433-M437 PolarHBondContact O-N 3.1Å; I434-M437 HydrophobicContact CG2-CE 4.37Å; I434-M437 PolarHBondContact O-N 3.26Å; M437-F440 PolarHBondContact O-N 3.03Å; M437-G441 PolarHBondContact O-N 2.67Å; M437-L472 HydrophobicContact CE-CD2 3.42Å; M437-L472 VanDerWaalsContact CE-CD2 3.42Å; M437-L472 HydrophobicContact SD-CD2 3.77Å
438	I	91.4	Very high	88.7	Confident	75 Å²	75	57 Å²	57	39%	0.385	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-43.5	176.8	-68.6	168.2	0	0	0	110.6	I434 E435 G441 R442	I434-I438 HydrophobicContact CG2-CD1 3.85Å; I434-I438 HydrophobicContact CG2-CG1 4.44Å; I434-I438 VanDerWaalsContact O-CG1 3.31Å; I434-I438 WeakPolarHBondContact O-CG1 3.23Å; I434-I438 PolarHBondContact O-N 3.23Å; E435-I438 PolarHBondContact O-N 3.12Å; I438-G441 PolarHBondContact O-N 3.31Å; I438-R442 WeakPolarHBondContact O-CG 3.4Å; I438-R442 PolarHBondContact O-N 2.93Å; I438-R442 VanDerWaalsContact O-N 3.11Å
439	H	92.6	Very high	89.9	Confident	87 Å²	87	58.8 Å²	58.8	40%	0.403	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-49.8	175.5	-175.5	-82.3	0	0	0	111.3	E435 R436 G441 R442 E443	E435-H439 PolarHBondContact O-N 3.25Å; R436-H439 PolarHBondContact O-N 3.4Å; H439-G441 VanDerWaalsContact C-N 3.31Å; H439-G441 PolarHBondContact O-N 3.29Å; H439-R442 WeakPolarHBondContact O-CB 3.1Å; H439-R442 PolarHBondContact O-N 3.07Å; H439-R442 VanDerWaalsContact O-N 3.09Å; H439-E443 VanDerWaalsContact CE1-CD 3.44Å; H439-E443 IonicContact CE1-OE1 2.66Å; H439-E443 PolarHBondContact CE1-OE1 3.43Å; H439-E443 VanDerWaalsContact CE1-OE1 3.32Å; H439-E443 IonicContact CE1-OE2 3.55Å; H439-E443 IonicContact ND1-OE1 2.62Å; H439-E443 IonicContact ND1-OE2 2.65Å; H439-E443 PolarHBondContact O-N 3.18Å; H439-E443 VanDerWaalsContact O-N 3.11Å
440	F	94.1	Very high	90.9	Very high	4 Å²	4	61 Å²	61	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-41.8	177.1	-173.4	-83.1	0	0	0	112	K263 Q266 F267 M270 V278 L281 R436 M437 R442 E443 L444	K263-F440 HydrophobicContact CB-CZ 4.15Å; K263-F440 HydrophobicContact CD-CE2 4.1Å; K263-F440 HydrophobicContact CD-CZ 3.69Å; K263-F440 VanDerWaalsContact O-CE1 3.27Å; K263-F440 WeakPolarHBondContact O-CE1 3.34Å; Q266-F440 HydrophobicContact CB-CZ 4.02Å; Q266-F440 HydrophobicContact CG-CE1 4.34Å; Q266-F440 HydrophobicContact CG-CE2 4.06Å; Q266-F440 HydrophobicContact CG-CZ 3.69Å; Q266-F440 VanDerWaalsContact OE1-CE2 3.28Å; Q266-F440 VanDerWaalsContact OE1-CZ 3.27Å; F267-F440 HydrophobicContact CB-CD1 3.99Å; F267-F440 HydrophobicContact CB-CE1 3.81Å; F267-F440 AromaticContact CD2-CD1 3.95Å; F267-F440 HydrophobicContact CD2-CD1 3.95Å; F267-F440 HydrophobicContact CG-CD1 4.47Å; M270-F440 HydrophobicContact CE-CB 3.95Å; M270-F440 HydrophobicContact CE-CG 4.29Å; M270-F440 HydrophobicContact SD-CB 3.98Å; M270-F440 HydrophobicContact SD-CD1 3.94Å; M270-F440 HydrophobicContact SD-CD2 4.04Å; M270-F440 HydrophobicContact SD-CE1 4.42Å; M270-F440 HydrophobicContact SD-CE2 4.5Å; M270-F440 HydrophobicContact SD-CG 3.71Å; V278-F440 HydrophobicContact CG1-CD2 4.13Å; V278-F440 HydrophobicContact CG1-CE2 4.09Å; L281-F440 HydrophobicContact CD1-CD2 4.35Å; L281-F440 HydrophobicContact CD1-CE2 4.09Å; L281-F440 HydrophobicContact CD1-CZ 4.49Å; L281-F440 HydrophobicContact CD2-CE2 4.12Å; L281-F440 HydrophobicContact CG-CD2 4.45Å; L281-F440 HydrophobicContact CG-CE2 4.19Å; R436-F440 WeakPolarHBondContact O-CB 3.41Å; R436-F440 PolarHBondContact O-N 3.11Å; M437-F440 PolarHBondContact O-N 3.03Å; F440-R442 VanDerWaalsContact C-N 3.29Å; F440-R442 PolarHBondContact O-N 3.4Å; F440-E443 PolarHBondContact O-N 3.42Å; F440-L444 HydrophobicContact CE1-CB 4.5Å; F440-L444 HydrophobicContact CE1-CD2 4.38Å; F440-L444 WeakPolarHBondContact O-CB 3.33Å; F440-L444 PolarHBondContact O-N 3.01Å
441	G	95	Very high	91.6	Very high	9 Å²	9	58.8 Å²	58.8	9%	0.093	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-37.4	175.5	0	0	0	0	0	112.9	M437 I438 H439 L444 Q445 F469	M437-G441 PolarHBondContact O-N 2.67Å; I438-G441 PolarHBondContact O-N 3.31Å; H439-G441 VanDerWaalsContact C-N 3.31Å; H439-G441 PolarHBondContact O-N 3.29Å; G441-L444 PolarHBondContact O-N 3.06Å; G441-Q445 WeakPolarHBondContact O-CB 3.23Å; G441-Q445 PolarHBondContact O-N 3.4Å; G441-F469 WeakPolarHBondContact O-CZ 3.26Å
442	R	94.8	Very high	92	Very high	182 Å²	182	59.1 Å²	59.1	69%	0.687	29%	0.285	S	S	*	.	H	α-helix	trans	-67.4	-43.1	174.4	-68.8	175.3	178.4	175.9	0.9	112.1	I438 H439 F440 L444 Q445 A446	I438-R442 WeakPolarHBondContact O-CG 3.4Å; I438-R442 PolarHBondContact O-N 2.93Å; I438-R442 VanDerWaalsContact O-N 3.11Å; H439-R442 WeakPolarHBondContact O-CB 3.1Å; H439-R442 PolarHBondContact O-N 3.07Å; H439-R442 VanDerWaalsContact O-N 3.09Å; F440-R442 VanDerWaalsContact C-N 3.29Å; F440-R442 PolarHBondContact O-N 3.4Å; R442-L444 VanDerWaalsContact C-N 3.32Å; R442-Q445 PolarHBondContact O-N 3.34Å; R442-A446 PolarHBondContact O-N 2.99Å
443	E	95.1	Very high	92.3	Very high	45 Å²	45	65.5 Å²	65.5	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-40.1	175.2	-65.2	-178	133.5	0	0	111.2	L281 H439 F440 A446 M447	L281-E443 HydrophobicContact CD1-CB 3.53Å; L281-E443 HydrophobicContact CD1-CG 4.42Å; L281-E443 HydrophobicContact CG-CB 4.39Å; L281-E443 WeakPolarHBondContact CG-OE2 3.49Å; L281-E443 PolarHBondContact N-OE1 2.78Å; L281-E443 PolarHBondContact N-OE2 2.85Å; H439-E443 VanDerWaalsContact CE1-CD 3.44Å; H439-E443 IonicContact CE1-OE1 2.66Å; H439-E443 PolarHBondContact CE1-OE1 3.43Å; H439-E443 VanDerWaalsContact CE1-OE1 3.32Å; H439-E443 IonicContact CE1-OE2 3.55Å; H439-E443 IonicContact ND1-OE1 2.62Å; H439-E443 IonicContact ND1-OE2 2.65Å; H439-E443 PolarHBondContact O-N 3.18Å; H439-E443 VanDerWaalsContact O-N 3.11Å; F440-E443 PolarHBondContact O-N 3.42Å; E443-A446 WeakPolarHBondContact O-CB 3.47Å; E443-A446 PolarHBondContact O-N 3.06Å; E443-M447 PolarHBondContact O-N 3.34Å
444	L	94.7	Very high	92.5	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.2	-39	176.8	-174.2	62.6	0	0	0	112.4	F260 K263 V264 F267 F440 G441 R442 M447 S448 L465 F469	F260-L444 HydrophobicContact CD2-CD1 3.96Å; F260-L444 HydrophobicContact CE2-CD1 3.72Å; F260-L444 HydrophobicContact CE2-CG 4.29Å; K263-L444 HydrophobicContact CB-CD1 3.76Å; V264-L444 HydrophobicContact CB-CD2 4.44Å; V264-L444 HydrophobicContact CG2-CD1 4.02Å; V264-L444 HydrophobicContact CG2-CD2 3.99Å; V264-L444 HydrophobicContact CG2-CG 4.38Å; F267-L444 HydrophobicContact CB-CD2 4Å; F267-L444 HydrophobicContact CG-CD2 4.36Å; F440-L444 HydrophobicContact CE1-CB 4.5Å; F440-L444 HydrophobicContact CE1-CD2 4.38Å; F440-L444 WeakPolarHBondContact O-CB 3.33Å; F440-L444 PolarHBondContact O-N 3.01Å; G441-L444 PolarHBondContact O-N 3.06Å; R442-L444 VanDerWaalsContact C-N 3.32Å; L444-M447 PolarHBondContact O-N 2.69Å; L444-S448 PolarHBondContact O-N 3.31Å; L444-L465 HydrophobicContact CD2-CD1 3.62Å; L444-L465 HydrophobicContact CG-CD1 3.66Å; L444-F469 HydrophobicContact CD2-CE1 4.21Å
445	Q	94.9	Very high	92.6	Very high	70 Å²	70	71.4 Å²	71.4	33%	0.327	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-45.6	171.8	177.1	64.2	26.9	0	0	111.1	G441 R442 M447 S448 E449 F469	G441-Q445 WeakPolarHBondContact O-CB 3.23Å; G441-Q445 PolarHBondContact O-N 3.4Å; R442-Q445 PolarHBondContact O-N 3.34Å; Q445-M447 VanDerWaalsContact C-N 3.33Å; Q445-M447 PolarHBondContact O-N 3.22Å; Q445-S448 WeakPolarHBondContact O-CB 3.28Å; Q445-S448 PolarHBondContact O-N 3.27Å; Q445-E449 PolarHBondContact NE2-OE1 3.21Å; Q445-E449 WeakPolarHBondContact O-CG 3.28Å; Q445-E449 PolarHBondContact O-N 3.3Å; Q445-F469 HydrophobicContact CB-CE2 4.36Å; Q445-F469 HydrophobicContact CB-CZ 4.43Å
446	A	95.3	Very high	92.6	Very high	51 Å²	51	67.6 Å²	67.6	42%	0.421	32%	0.322	S	S	.	.	H	α-helix	trans	-61.6	-40.9	176.3	0	0	0	0	0	111.9	R442 E443 E449 Q450	R442-A446 PolarHBondContact O-N 2.99Å; E443-A446 WeakPolarHBondContact O-CB 3.47Å; E443-A446 PolarHBondContact O-N 3.06Å; A446-E449 PolarHBondContact O-N 2.96Å; A446-Q450 WeakPolarHBondContact O-CB 3.45Å; A446-Q450 PolarHBondContact O-N 3.04Å
447	M	94.2	Very high	92.6	Very high	36 Å²	36	72.1 Å²	72.1	18%	0.177	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-44.6	173.7	-171.6	-175.1	-177.5	0	0	111.4	L259 F260 K263 E443 L444 Q445 E449 Q450 L451	L259-M447 HydrophobicContact CB-CE 4.08Å; L259-M447 HydrophobicContact CD2-CE 3.85Å; L259-M447 HydrophobicContact CG-CE 3.72Å; F260-M447 HydrophobicContact CB-CE 3.99Å; F260-M447 HydrophobicContact CB-SD 4.41Å; F260-M447 HydrophobicContact CD2-CE 4.47Å; F260-M447 HydrophobicContact CD2-CG 4.11Å; F260-M447 HydrophobicContact CD2-SD 3.9Å; K263-M447 HydrophobicContact CG-SD 4.47Å; E443-M447 PolarHBondContact O-N 3.34Å; L444-M447 PolarHBondContact O-N 2.69Å; Q445-M447 VanDerWaalsContact C-N 3.33Å; Q445-M447 PolarHBondContact O-N 3.22Å; M447-E449 VanDerWaalsContact C-N 3.32Å; M447-E449 PolarHBondContact O-N 3.49Å; M447-Q450 PolarHBondContact O-N 3.01Å; M447-L451 HydrophobicContact CE-CD1 4.35Å; M447-L451 HydrophobicContact CG-CD1 4.28Å; M447-L451 VanDerWaalsContact O-CG 3.31Å; M447-L451 WeakPolarHBondContact O-CG 3.3Å; M447-L451 PolarHBondContact O-N 3.09Å
448	S	93.8	Very high	92.5	Very high	22 Å²	22	74.9 Å²	74.9	15%	0.154	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-42.2	176.1	-168.3	0	0	0	0	112.4	L444 Q445 L451 R452	L444-S448 PolarHBondContact O-N 3.31Å; Q445-S448 WeakPolarHBondContact O-CB 3.28Å; Q445-S448 PolarHBondContact O-N 3.27Å; S448-L451 PolarHBondContact O-N 3.13Å; S448-R452 WeakPolarHBondContact O-CB 3.37Å; S448-R452 PolarHBondContact O-N 3.18Å
449	E	93.6	Very high	92.6	Very high	76 Å²	76	77.1 Å²	77.1	36%	0.355	38%	0.377	S	S	.	.	H	α-helix	trans	-68.4	-34.7	177.3	-71.5	175.2	-172.8	0	0	112.8	Q445 A446 M447 R453	Q445-E449 PolarHBondContact NE2-OE1 3.21Å; Q445-E449 WeakPolarHBondContact O-CG 3.28Å; Q445-E449 PolarHBondContact O-N 3.3Å; A446-E449 PolarHBondContact O-N 2.96Å; M447-E449 VanDerWaalsContact C-N 3.32Å; M447-E449 PolarHBondContact O-N 3.49Å; E449-R453 WeakPolarHBondContact O-CG 3.42Å; E449-R453 PolarHBondContact O-N 2.7Å; E449-R453 PolarHBondContact O-NE 3.02Å
450	Q	93.3	Very high	92.5	Very high	88 Å²	88	75.4 Å²	75.4	41%	0.411	38%	0.378	S	S	.	.	H	α-helix	trans	-65.8	-50.2	172.5	-178.4	171.3	-9.6	0	0	111.4	A446 M447 R452 R453 E454	A446-Q450 WeakPolarHBondContact O-CB 3.45Å; A446-Q450 PolarHBondContact O-N 3.04Å; M447-Q450 PolarHBondContact O-N 3.01Å; Q450-R452 PolarHBondContact O-N 3.27Å; Q450-R453 WeakPolarHBondContact O-CA 3.5Å; Q450-R453 WeakPolarHBondContact O-CB 3.48Å; Q450-R453 PolarHBondContact O-N 3.4Å; Q450-E454 HydrophobicContact CG-CG 4.39Å; Q450-E454 WeakPolarHBondContact CG-OE1 3.4Å; Q450-E454 PolarHBondContact NE2-OE1 3.32Å; Q450-E454 PolarHBondContact O-N 2.91Å
451	L	92.7	Very high	92.4	Very high	10 Å²	10	75.8 Å²	75.8	5%	0.052	38%	0.38	C	S	.	.	H	α-helix	trans	-58.7	-37.5	176.6	-67.4	171.4	0	0	0	112.3	P256 F260 M447 S448 R453 E454 C455	P256-L451 HydrophobicContact CB-CD2 3.63Å; P256-L451 HydrophobicContact CG-CD2 4.34Å; F260-L451 HydrophobicContact CB-CD1 3.52Å; F260-L451 HydrophobicContact CD1-CD1 4.4Å; F260-L451 HydrophobicContact CD2-CD1 3.58Å; F260-L451 HydrophobicContact CE2-CD1 4.42Å; F260-L451 HydrophobicContact CG-CD1 3.56Å; M447-L451 HydrophobicContact CE-CD1 4.35Å; M447-L451 HydrophobicContact CG-CD1 4.28Å; M447-L451 VanDerWaalsContact O-CG 3.31Å; M447-L451 WeakPolarHBondContact O-CG 3.3Å; M447-L451 PolarHBondContact O-N 3.09Å; S448-L451 PolarHBondContact O-N 3.13Å; L451-R453 VanDerWaalsContact C-N 3.28Å; L451-R453 PolarHBondContact O-N 3.49Å; L451-E454 PolarHBondContact O-N 3.04Å; L451-C455 WeakPolarHBondContact O-CA 3.47Å; L451-C455 WeakPolarHBondContact O-CB 3.3Å; L451-C455 PolarHBondContact O-N 3.35Å
452	R	92.5	Very high	92.3	Very high	147 Å²	147	82.8 Å²	82.8	56%	0.555	41%	0.408	S	S	*	.	H	α-helix	trans	-64.2	-33.8	175.5	-171.3	-178.7	68.8	-165.6	-0.7	112.4	S448 Q450 G456	S448-R452 WeakPolarHBondContact O-CB 3.37Å; S448-R452 PolarHBondContact O-N 3.18Å; Q450-R452 PolarHBondContact O-N 3.27Å; R452-G456 WeakPolarHBondContact CA-O 3.3Å; R452-G456 CarbonylContact O-C 3.57Å; R452-G456 VanDerWaalsContact O-CA 3.31Å; R452-G456 WeakPolarHBondContact O-CA 3.23Å; R452-G456 PolarHBondContact O-N 2.93Å
453	R	91.9	Very high	92.2	Very high	179 Å²	179	80.4 Å²	80.4	68%	0.675	40%	0.402	S	S	*	.	H	α-helix	trans	-74.7	-41.7	176.8	-75.8	179.8	-75.2	136.9	-7.9	111.8	E449 Q450 L451	E449-R453 WeakPolarHBondContact O-CG 3.42Å; E449-R453 PolarHBondContact O-N 2.7Å; E449-R453 PolarHBondContact O-NE 3.02Å; Q450-R453 WeakPolarHBondContact O-CA 3.5Å; Q450-R453 WeakPolarHBondContact O-CB 3.48Å; Q450-R453 PolarHBondContact O-N 3.4Å; L451-R453 VanDerWaalsContact C-N 3.28Å; L451-R453 PolarHBondContact O-N 3.49Å
454	E	90.1	Very high	92.2	Very high	118 Å²	118	80.7 Å²	80.7	55%	0.551	40%	0.404	S	S	*	.	H	α-helix	trans	-83	-43.3	-174.2	-68.4	172.1	-175.1	0	0	113	Q450 L451	Q450-E454 HydrophobicContact CG-CG 4.39Å; Q450-E454 WeakPolarHBondContact CG-OE1 3.4Å; Q450-E454 PolarHBondContact NE2-OE1 3.32Å; Q450-E454 PolarHBondContact O-N 2.91Å; L451-E454 PolarHBondContact O-N 3.04Å
455	C	86.9	Confident	92.2	Very high	78 Å²	78	81 Å²	81	53%	0.527	41%	0.406	S	S	.	.	S	Bend	trans	-110.3	-2.2	-172.2	-58.4	0	0	0	0	113.7	L451	L451-C455 WeakPolarHBondContact O-CA 3.47Å; L451-C455 WeakPolarHBondContact O-CB 3.3Å; L451-C455 PolarHBondContact O-N 3.35Å
456	G	89.6	Confident	92.1	Very high	33 Å²	33	84.6 Å²	84.6	34%	0.34	42%	0.42	S	S	.	.			trans	82.1	-169.8	-176.7	0	0	0	0	0	114.4	R452 N458	R452-G456 WeakPolarHBondContact CA-O 3.3Å; R452-G456 CarbonylContact O-C 3.57Å; R452-G456 VanDerWaalsContact O-CA 3.31Å; R452-G456 WeakPolarHBondContact O-CA 3.23Å; R452-G456 PolarHBondContact O-N 2.93Å; G456-N458 PolarHBondContact O-N 2.78Å
457	K	87.1	Confident	92.1	Very high	201 Å²	201	83.7 Å²	83.7	87%	0.874	41%	0.409	S	S	*	.			trans	-73.3	117.8	-175.8	-68.4	-179.7	-177.8	174.3	0	110.8
458	N	89.3	Confident	92.1	Very high	61 Å²	61	82 Å²	82	33%	0.326	40%	0.4	S	S	.	.			trans	-111.8	109.4	170	-176.1	-28.3	0	0	0	109.8	N257 G456 A460 N461 K462	N257-N458 PolarHBondContact OD1-ND2 3.33Å; G456-N458 PolarHBondContact O-N 2.78Å; N458-A460 WeakPolarHBondContact OD1-CB 3.29Å; N458-A460 PolarHBondContact OD1-N 3.24Å; N458-N461 HydrophobicContact CB-CB 4.06Å; N458-N461 VanDerWaalsContact CG-CG 3.49Å; N458-N461 PolarHBondContact ND2-ND2 3.28Å; N458-N461 PolarHBondContact ND2-OD1 3.03Å; N458-N461 PolarHBondContact OD1-N 2.62Å; N458-K462 PolarHBondContact O-N 2.76Å
459	T	92.2	Very high	92.2	Very high	123 Å²	123	83.7 Å²	83.7	76%	0.755	41%	0.405	S	S	*	.	H	α-helix	trans	-67.1	-35.4	-178.4	48.6	0	0	0	0	112.2	K462 K463	T459-K462 PolarHBondContact O-N 3.41Å; T459-K463 WeakPolarHBondContact O-CB 3.3Å; T459-K463 PolarHBondContact O-N 3.26Å
460	A	91.5	Very high	92.2	Very high	51 Å²	51	81.8 Å²	81.8	42%	0.421	40%	0.4	S	S	.	.	H	α-helix	trans	-64.8	-48.3	177.3	0	0	0	0	0	111.1	N458 K462 K463 M464	N458-A460 WeakPolarHBondContact OD1-CB 3.29Å; N458-A460 PolarHBondContact OD1-N 3.24Å; A460-K462 VanDerWaalsContact C-N 3.32Å; A460-K462 PolarHBondContact O-N 3.35Å; A460-K463 PolarHBondContact O-N 2.92Å; A460-M464 WeakPolarHBondContact O-CB 3.21Å; A460-M464 PolarHBondContact O-N 3.15Å
461	N	91.8	Very high	92.2	Very high	11 Å²	11	77.6 Å²	77.6	6%	0.059	38%	0.38	C	S	.	.	H	α-helix	trans	-59.9	-42.7	176.6	-71.5	4.7	0	0	0	111.7	N257 F260 N458 M464 L465	N257-N461 PolarHBondContact OD1-ND2 2.98Å; F260-N461 HydrophobicContact CD1-CB 3.93Å; F260-N461 HydrophobicContact CE1-CB 3.57Å; F260-N461 HydrophobicContact CZ-CB 4.44Å; N458-N461 HydrophobicContact CB-CB 4.06Å; N458-N461 VanDerWaalsContact CG-CG 3.49Å; N458-N461 PolarHBondContact ND2-ND2 3.28Å; N458-N461 PolarHBondContact ND2-OD1 3.03Å; N458-N461 PolarHBondContact OD1-N 2.62Å; N461-M464 PolarHBondContact O-N 3.17Å; N461-L465 WeakPolarHBondContact O-CB 3.33Å; N461-L465 PolarHBondContact O-N 3.34Å
462	K	92.6	Very high	92.1	Very high	157 Å²	157	80.4 Å²	80.4	68%	0.683	40%	0.395	S	S	*	.	H	α-helix	trans	-62.5	-43.2	177.5	-175.4	-178.7	178.2	-175.5	0	111.8	N458 T459 A460 K466	N458-K462 PolarHBondContact O-N 2.76Å; T459-K462 PolarHBondContact O-N 3.41Å; A460-K462 VanDerWaalsContact C-N 3.32Å; A460-K462 PolarHBondContact O-N 3.35Å; K462-K466 WeakPolarHBondContact O-CB 3.41Å; K462-K466 PolarHBondContact O-N 3.42Å; K462-K466 VanDerWaalsContact O-N 3.1Å
463	K	93.8	Very high	91.9	Very high	132 Å²	132	77.2 Å²	77.2	57%	0.574	40%	0.4	S	S	*	.	H	α-helix	trans	-64.1	-50.9	177.6	-178.2	-178.7	-178.7	-61.4	0	110.6	T459 A460 L465 K466 D467	T459-K463 WeakPolarHBondContact O-CB 3.3Å; T459-K463 PolarHBondContact O-N 3.26Å; A460-K463 PolarHBondContact O-N 2.92Å; K463-L465 VanDerWaalsContact C-N 3.32Å; K463-L465 PolarHBondContact O-N 3.41Å; K463-K466 PolarHBondContact O-N 2.82Å; K463-K466 VanDerWaalsContact O-N 3.12Å; K463-D467 WeakPolarHBondContact CG-OD2 3.5Å; K463-D467 IonicContact NZ-OD2 2.83Å; K463-D467 PolarHBondContact NZ-OD2 3.02Å; K463-D467 WeakPolarHBondContact O-CB 3.49Å; K463-D467 PolarHBondContact O-N 3.02Å
464	M	93.4	Very high	91.8	Very high	50 Å²	50	73.2 Å²	73.2	25%	0.246	39%	0.386	C	S	.	.	H	α-helix	trans	-55.4	-45.6	-179.8	-162.2	-165	-50.7	0	0	112.1	T261 V264 A460 N461 D467 A468	T261-M464 HydrophobicContact CG2-CE 4.2Å; T261-M464 HydrophobicContact CG2-SD 4.08Å; V264-M464 HydrophobicContact CB-CG 4.25Å; V264-M464 HydrophobicContact CB-SD 3.77Å; V264-M464 HydrophobicContact CG1-CG 3.7Å; V264-M464 HydrophobicContact CG1-SD 3.92Å; V264-M464 HydrophobicContact CG2-CG 4.46Å; V264-M464 HydrophobicContact CG2-SD 3.94Å; A460-M464 WeakPolarHBondContact O-CB 3.21Å; A460-M464 PolarHBondContact O-N 3.15Å; N461-M464 PolarHBondContact O-N 3.17Å; M464-D467 PolarHBondContact O-N 2.9Å; M464-A468 VanDerWaalsContact O-CB 3.31Å; M464-A468 WeakPolarHBondContact O-CB 3.15Å; M464-A468 PolarHBondContact O-N 3.41Å
465	L	94.7	Very high	91.5	Very high	8 Å²	8	73.3 Å²	73.3	4%	0.042	40%	0.4	C	S	.	.	H	α-helix	trans	-65.2	-44.2	177.3	-170.5	66.1	0	0	0	112.4	F260 V264 L444 N461 K463 A468 F469	F260-L465 HydrophobicContact CZ-CB 4.2Å; F260-L465 HydrophobicContact CZ-CD1 4.21Å; F260-L465 HydrophobicContact CZ-CD2 4.4Å; V264-L465 HydrophobicContact CG2-CD1 4.45Å; L444-L465 HydrophobicContact CD2-CD1 3.62Å; L444-L465 HydrophobicContact CG-CD1 3.66Å; N461-L465 WeakPolarHBondContact O-CB 3.33Å; N461-L465 PolarHBondContact O-N 3.34Å; K463-L465 VanDerWaalsContact C-N 3.32Å; K463-L465 PolarHBondContact O-N 3.41Å; L465-A468 PolarHBondContact O-N 3.49Å; L465-F469 HydrophobicContact CD1-CD1 4.34Å; L465-F469 HydrophobicContact CD1-CD2 4.35Å; L465-F469 HydrophobicContact CD1-CE1 3.76Å; L465-F469 HydrophobicContact CD1-CE2 3.75Å; L465-F469 HydrophobicContact CD1-CZ 3.43Å; L465-F469 VanDerWaalsContact CD1-CZ 3.43Å; L465-F469 HydrophobicContact CD2-CE2 4.13Å; L465-F469 HydrophobicContact CG-CD2 4.1Å; L465-F469 HydrophobicContact CG-CE2 3.75Å; L465-F469 HydrophobicContact CG-CZ 3.98Å; L465-F469 WeakPolarHBondContact O-CB 3.33Å; L465-F469 WeakPolarHBondContact O-CG 3.12Å; L465-F469 PolarHBondContact O-N 2.93Å
466	K	94.4	Very high	91.5	Very high	144 Å²	144	71.6 Å²	71.6	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-61.7	-45.5	178.3	-176.8	-172.2	173.9	-167.9	0	111	K462 K463 F469 S470	K462-K466 WeakPolarHBondContact O-CB 3.41Å; K462-K466 PolarHBondContact O-N 3.42Å; K462-K466 VanDerWaalsContact O-N 3.1Å; K463-K466 PolarHBondContact O-N 2.82Å; K463-K466 VanDerWaalsContact O-N 3.12Å; K466-F469 PolarHBondContact O-N 2.89Å; K466-S470 WeakPolarHBondContact O-CB 3.42Å; K466-S470 PolarHBondContact O-N 3.43Å; K466-S470 PolarHBondContact O-OG 3.32Å
467	D	93.7	Very high	91.5	Very high	33 Å²	33	70.2 Å²	70.2	18%	0.176	37%	0.37	C	S	.	.	H	α-helix	trans	-66.4	-42.8	-178.7	-64.6	-10.9	0	0	0	110.3	K463 M464 S470 Q485	K463-D467 WeakPolarHBondContact CG-OD2 3.5Å; K463-D467 IonicContact NZ-OD2 2.83Å; K463-D467 PolarHBondContact NZ-OD2 3.02Å; K463-D467 WeakPolarHBondContact O-CB 3.49Å; K463-D467 PolarHBondContact O-N 3.02Å; M464-D467 PolarHBondContact O-N 2.9Å; D467-S470 WeakPolarHBondContact O-CB 3.4Å; D467-S470 PolarHBondContact O-N 2.9Å; D467-Q485 VanDerWaalsContact C-NE2 3.27Å; D467-Q485 PolarHBondContact O-NE2 3.38Å
468	A	94.9	Very high	91.5	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-47.2	175.2	0	0	0	0	0	112.1	V264 F267 I268 M464 L465 S470 L471	V264-A468 HydrophobicContact CG1-CB 3.69Å; F267-A468 HydrophobicContact CD1-CB 4.11Å; F267-A468 HydrophobicContact CE1-CB 4.48Å; I268-A468 HydrophobicContact CD1-CB 4.06Å; I268-A468 HydrophobicContact CG1-CB 3.87Å; M464-A468 VanDerWaalsContact O-CB 3.31Å; M464-A468 WeakPolarHBondContact O-CB 3.15Å; M464-A468 PolarHBondContact O-N 3.41Å; L465-A468 PolarHBondContact O-N 3.49Å; A468-S470 VanDerWaalsContact C-N 3.27Å; A468-S470 PolarHBondContact O-N 3.44Å; A468-L471 WeakPolarHBondContact O-CB 3.17Å; A468-L471 PolarHBondContact O-N 3.38Å
469	F	95.6	Very high	91.6	Very high	57 Å²	57	68.5 Å²	68.5	25%	0.25	36%	0.363	C	S	.	.	H	α-helix	trans	-68	-26.3	178	-71.6	-6.8	0	0	0	113.3	F267 G441 L444 Q445 L465 K466 L471 L472	F267-F469 HydrophobicContact CD1-CD1 4.23Å; F267-F469 HydrophobicContact CD1-CE1 4.37Å; F267-F469 AromaticContact CE1-CD1 3.63Å; F267-F469 HydrophobicContact CE1-CD1 3.63Å; F267-F469 HydrophobicContact CE1-CE1 4.06Å; F267-F469 HydrophobicContact CE2-CD1 4.44Å; F267-F469 HydrophobicContact CE2-CE1 4.2Å; F267-F469 AromaticContact CZ-CD1 3.73Å; F267-F469 HydrophobicContact CZ-CD1 3.73Å; F267-F469 AromaticContact CZ-CE1 3.95Å; F267-F469 HydrophobicContact CZ-CE1 3.95Å; G441-F469 WeakPolarHBondContact O-CZ 3.26Å; L444-F469 HydrophobicContact CD2-CE1 4.21Å; Q445-F469 HydrophobicContact CB-CE2 4.36Å; Q445-F469 HydrophobicContact CB-CZ 4.43Å; L465-F469 HydrophobicContact CD1-CD1 4.34Å; L465-F469 HydrophobicContact CD1-CD2 4.35Å; L465-F469 HydrophobicContact CD1-CE1 3.76Å; L465-F469 HydrophobicContact CD1-CE2 3.75Å; L465-F469 HydrophobicContact CD1-CZ 3.43Å; L465-F469 VanDerWaalsContact CD1-CZ 3.43Å; L465-F469 HydrophobicContact CD2-CE2 4.13Å; L465-F469 HydrophobicContact CG-CD2 4.1Å; L465-F469 HydrophobicContact CG-CE2 3.75Å; L465-F469 HydrophobicContact CG-CZ 3.98Å; L465-F469 WeakPolarHBondContact O-CB 3.33Å; L465-F469 WeakPolarHBondContact O-CG 3.12Å; L465-F469 PolarHBondContact O-N 2.93Å; K466-F469 PolarHBondContact O-N 2.89Å; F469-L471 PolarHBondContact O-N 3.46Å; F469-L472 WeakPolarHBondContact O-CB 3.44Å; F469-L472 PolarHBondContact O-N 2.82Å; F469-L472 VanDerWaalsContact O-N 3.1Å
470	S	94.6	Very high	91.5	Very high	36 Å²	36	63.2 Å²	63.2	25%	0.252	33%	0.331	S	S	.	.	H	α-helix	trans	-63.7	-23.9	177.1	-61.5	0	0	0	0	112.3	K466 D467 A468 L472 A473 Y474	K466-S470 WeakPolarHBondContact O-CB 3.42Å; K466-S470 PolarHBondContact O-N 3.43Å; K466-S470 PolarHBondContact O-OG 3.32Å; D467-S470 WeakPolarHBondContact O-CB 3.4Å; D467-S470 PolarHBondContact O-N 2.9Å; A468-S470 VanDerWaalsContact C-N 3.27Å; A468-S470 PolarHBondContact O-N 3.44Å; S470-L472 PolarHBondContact O-N 3.06Å; S470-A473 WeakPolarHBondContact O-CB 3.08Å; S470-A473 PolarHBondContact O-N 3.38Å; S470-Y474 VanDerWaalsContact O-CD2 3.24Å; S470-Y474 WeakPolarHBondContact O-CD2 3.37Å; S470-Y474 WeakPolarHBondContact O-CE2 3.43Å
471	L	92.4	Very high	91.6	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-58	-31.6	173.7	-68.2	165.8	0	0	0	112.3	I268 V271 A468 F469 A473 P477 V482 L486	I268-L471 HydrophobicContact CG1-CD1 4.16Å; I268-L471 HydrophobicContact CG2-CD1 4.18Å; V271-L471 HydrophobicContact CG1-CB 4.17Å; V271-L471 HydrophobicContact CG1-CD1 4.38Å; A468-L471 WeakPolarHBondContact O-CB 3.17Å; A468-L471 PolarHBondContact O-N 3.38Å; F469-L471 PolarHBondContact O-N 3.46Å; L471-A473 PolarHBondContact O-N 3.28Å; L471-P477 HydrophobicContact CB-CB 4.41Å; L471-P477 HydrophobicContact CD2-CB 4.08Å; L471-V482 HydrophobicContact CD2-CG2 3.88Å; L471-V482 HydrophobicContact CG-CG2 4.19Å; L471-L486 HydrophobicContact CD1-CD2 4.21Å; L471-L486 HydrophobicContact CD2-CD1 4.14Å; L471-L486 HydrophobicContact CD2-CG 4.17Å
472	L	90.4	Very high	91.6	Very high	69 Å²	69	66.6 Å²	66.6	36%	0.361	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-71.9	-15.7	179.1	-59.7	-175.3	0	0	0	113.7	F267 V271 L426 M437 F469 S470 Y474	F267-L472 HydrophobicContact CZ-CD1 3.87Å; F267-L472 HydrophobicContact CZ-CD2 4.23Å; F267-L472 HydrophobicContact CZ-CG 4.09Å; V271-L472 HydrophobicContact CG2-CD2 4.1Å; L426-L472 HydrophobicContact CD2-CD2 4.23Å; M437-L472 HydrophobicContact CE-CD2 3.42Å; M437-L472 VanDerWaalsContact CE-CD2 3.42Å; M437-L472 HydrophobicContact SD-CD2 3.77Å; F469-L472 WeakPolarHBondContact O-CB 3.44Å; F469-L472 PolarHBondContact O-N 2.82Å; F469-L472 VanDerWaalsContact O-N 3.1Å; S470-L472 PolarHBondContact O-N 3.06Å; L472-Y474 PolarHBondContact O-N 3.49Å
473	A	89.8	Confident	91.6	Very high	81 Å²	81	59.4 Å²	59.4	67%	0.669	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-79.1	-5.7	-177.7	0	0	0	0	0	113.2	S470 L471	S470-A473 WeakPolarHBondContact O-CB 3.08Å; S470-A473 PolarHBondContact O-N 3.38Å; L471-A473 PolarHBondContact O-N 3.28Å
474	Y	89.3	Confident	91.6	Very high	94 Å²	94	57.2 Å²	57.2	37%	0.369	31%	0.314	S	S	.	.	S	Bend	trans	-121.2	134.4	-174.3	-59.8	-88.7	0	0	0	110.6	S470 L472 D476 S480 P481	S470-Y474 VanDerWaalsContact O-CD2 3.24Å; S470-Y474 WeakPolarHBondContact O-CD2 3.37Å; S470-Y474 WeakPolarHBondContact O-CE2 3.43Å; L472-Y474 PolarHBondContact O-N 3.49Å; Y474-D476 PolarHBondContact O-N 2.94Å; Y474-S480 VanDerWaalsContact CG-CB 3.46Å; Y474-P481 HydrophobicContact CE1-CG 4.43Å; Y474-P481 VanDerWaalsContact CZ-CD 3.45Å; Y474-P481 WeakPolarHBondContact OH-CD 3.39Å
475	S	83.9	Confident	91.6	Very high	121 Å²	121	56 Å²	56	85%	0.846	31%	0.308	S	S	*	.	S	Bend	trans	-60.6	-33	176.6	-47.3	0	0	0	0	112.4
476	D	86.5	Confident	91.5	Very high	41 Å²	41	55.7 Å²	55.7	22%	0.219	31%	0.306	C	S	.	.	S	Bend	trans	-122.2	98.5	170.7	-178.1	3	0	0	0	109.4	Y474 W478 N479	Y474-D476 PolarHBondContact O-N 2.94Å; D476-W478 PolarHBondContact O-N 3.19Å; D476-W478 WeakPolarHBondContact OD1-CB 3.4Å; D476-W478 PolarHBondContact OD1-N 2.94Å; D476-N479 PolarHBondContact O-N 2.85Å; D476-N479 PolarHBondContact OD2-ND2 3.12Å
477	P	88.9	Confident	91.5	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.026	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-59.9	-28.4	-179.4	-28.1	37	0	0	0	114.5	V271 L426 L471 N479 S480 G483 L486	V271-P477 HydrophobicContact CG1-CB 4.35Å; V271-P477 HydrophobicContact CG1-CG 4.25Å; L426-P477 HydrophobicContact CD2-CG 3.47Å; L426-P477 VanDerWaalsContact CD2-CG 3.47Å; L426-P477 HydrophobicContact CG-CG 3.98Å; L471-P477 HydrophobicContact CB-CB 4.41Å; L471-P477 HydrophobicContact CD2-CB 4.08Å; P477-N479 VanDerWaalsContact C-N 3.33Å; P477-N479 PolarHBondContact O-N 2.83Å; P477-S480 VanDerWaalsContact O-CB 3.28Å; P477-S480 WeakPolarHBondContact O-CB 3.25Å; P477-S480 PolarHBondContact O-N 2.87Å; P477-S480 PolarHBondContact O-OG 3.25Å; P477-G483 VanDerWaalsContact O-CA 3.23Å; P477-G483 WeakPolarHBondContact O-CA 3.33Å; P477-L486 HydrophobicContact CB-CD1 3.75Å
478	W	88.6	Confident	91.5	Very high	105 Å²	105	53.8 Å²	53.8	40%	0.398	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-68.5	-34	-178.9	-72.9	91.9	0	0	0	112.6	N272 D476 S480 L486	N272-W478 WeakPolarHBondContact OD1-CZ2 3.21Å; D476-W478 PolarHBondContact O-N 3.19Å; D476-W478 WeakPolarHBondContact OD1-CB 3.4Å; D476-W478 PolarHBondContact OD1-N 2.94Å; W478-S480 VanDerWaalsContact C-N 3.29Å; W478-L486 HydrophobicContact CD2-CB 4.27Å; W478-L486 HydrophobicContact CD2-CD1 3.91Å; W478-L486 HydrophobicContact CE3-CB 4.13Å; W478-L486 HydrophobicContact CE3-CD1 4.44Å; W478-L486 HydrophobicContact CG-CD1 3.97Å; W478-L486 HydrophobicContact CH2-CB 3.99Å; W478-L486 HydrophobicContact CZ2-CB 4.14Å; W478-L486 HydrophobicContact CZ3-CB 3.98Å
479	N	89.9	Confident	91.5	Very high	122 Å²	122	58 Å²	58	65%	0.652	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-90.7	9.7	177	-75.7	-37.9	0	0	0	112.8	D476 P477	D476-N479 PolarHBondContact O-N 2.85Å; D476-N479 PolarHBondContact OD2-ND2 3.12Å; P477-N479 VanDerWaalsContact C-N 3.33Å; P477-N479 PolarHBondContact O-N 2.83Å
480	S	91	Very high	91.5	Very high	12 Å²	12	58.4 Å²	58.4	8%	0.084	33%	0.33	C	S	.	.	S	Bend	trans	-79.7	160	177.5	76.8	0	0	0	0	112	Y474 P477 W478 V482 G483	Y474-S480 VanDerWaalsContact CG-CB 3.46Å; P477-S480 VanDerWaalsContact O-CB 3.28Å; P477-S480 WeakPolarHBondContact O-CB 3.25Å; P477-S480 PolarHBondContact O-N 2.87Å; P477-S480 PolarHBondContact O-OG 3.25Å; W478-S480 VanDerWaalsContact C-N 3.29Å; S480-V482 PolarHBondContact O-N 2.96Å; S480-V482 WeakPolarHBondContact OG-CG2 3.42Å; S480-V482 PolarHBondContact OG-N 2.87Å; S480-G483 PolarHBondContact O-N 3.17Å; S480-G483 PolarHBondContact OG-N 2.83Å
481	P	93.3	Very high	91.6	Very high	104 Å²	104	57.7 Å²	57.7	68%	0.675	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-14.2	172.2	-24.8	35.4	0	0	0	114.6	Y474	Y474-P481 HydrophobicContact CE1-CG 4.43Å; Y474-P481 VanDerWaalsContact CZ-CD 3.45Å; Y474-P481 WeakPolarHBondContact OH-CD 3.39Å
482	V	92.1	Very high	91.8	Very high	28 Å²	28	63 Å²	63	17%	0.17	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	16	179.9	-60.9	0	0	0	0	112.4	L471 S480 N484 Q485	L471-V482 HydrophobicContact CD2-CG2 3.88Å; L471-V482 HydrophobicContact CG-CG2 4.19Å; S480-V482 PolarHBondContact O-N 2.96Å; S480-V482 WeakPolarHBondContact OG-CG2 3.42Å; S480-V482 PolarHBondContact OG-N 2.87Å; V482-N484 PolarHBondContact O-N 3.41Å; V482-N484 PolarHBondContact O-OD1 2.99Å; V482-Q485 WeakPolarHBondContact O-CB 3.45Å; V482-Q485 WeakPolarHBondContact O-CG 3.37Å; V482-Q485 PolarHBondContact O-N 2.81Å; V482-Q485 PolarHBondContact O-NE2 3.33Å
483	G	92.3	Very high	92	Very high	6 Å²	6	62.1 Å²	62.1	6%	0.062	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-65.7	-23.5	-176.9	0	0	0	0	0	113.6	P477 S480 Q485 L486	P477-G483 VanDerWaalsContact O-CA 3.23Å; P477-G483 WeakPolarHBondContact O-CA 3.33Å; S480-G483 PolarHBondContact O-N 3.17Å; S480-G483 PolarHBondContact OG-N 2.83Å; G483-Q485 PolarHBondContact O-N 2.83Å; G483-L486 WeakPolarHBondContact O-CB 3.46Å; G483-L486 PolarHBondContact O-N 2.65Å
484	N	94.1	Very high	92.3	Very high	87 Å²	87	58.9 Å²	58.9	47%	0.465	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-56.5	-21.7	172.4	66.5	-16.6	0	0	0	113.8	V482 L486 D487 Q490	V482-N484 PolarHBondContact O-N 3.41Å; V482-N484 PolarHBondContact O-OD1 2.99Å; N484-L486 PolarHBondContact O-N 2.93Å; N484-D487 VanDerWaalsContact O-CB 3.24Å; N484-D487 WeakPolarHBondContact O-CB 3.25Å; N484-D487 PolarHBondContact O-N 3.48Å; N484-Q490 VanDerWaalsContact O-CG 3.28Å; N484-Q490 WeakPolarHBondContact O-CG 3.45Å
485	Q	93.1	Very high	92.7	Very high	25 Å²	25	54.8 Å²	54.8	12%	0.117	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-64.3	-26.5	174.9	-70.2	-177.3	96.4	0	0	113.2	R265 I268 D467 V482 G483 D487	R265-Q485 PolarHBondContact NH1-O 3.32Å; I268-Q485 HydrophobicContact CD1-CB 4.47Å; D467-Q485 VanDerWaalsContact C-NE2 3.27Å; D467-Q485 PolarHBondContact O-NE2 3.38Å; V482-Q485 WeakPolarHBondContact O-CB 3.45Å; V482-Q485 WeakPolarHBondContact O-CG 3.37Å; V482-Q485 PolarHBondContact O-N 2.81Å; V482-Q485 PolarHBondContact O-NE2 3.33Å; G483-Q485 PolarHBondContact O-N 2.83Å; Q485-D487 VanDerWaalsContact C-N 3.27Å
486	L	92.8	Very high	93.2	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-79.2	-12.6	180	-62.5	166.9	0	0	0	112.6	I268 V271 N272 L471 P477 W478 G483 N484	I268-L486 HydrophobicContact CG2-CD2 3.88Å; V271-L486 HydrophobicContact CG1-CD2 4.18Å; N272-L486 HydrophobicContact CB-CD2 3.93Å; L471-L486 HydrophobicContact CD1-CD2 4.21Å; L471-L486 HydrophobicContact CD2-CD1 4.14Å; L471-L486 HydrophobicContact CD2-CG 4.17Å; P477-L486 HydrophobicContact CB-CD1 3.75Å; W478-L486 HydrophobicContact CD2-CB 4.27Å; W478-L486 HydrophobicContact CD2-CD1 3.91Å; W478-L486 HydrophobicContact CE3-CB 4.13Å; W478-L486 HydrophobicContact CE3-CD1 4.44Å; W478-L486 HydrophobicContact CG-CD1 3.97Å; W478-L486 HydrophobicContact CH2-CB 3.99Å; W478-L486 HydrophobicContact CZ2-CB 4.14Å; W478-L486 HydrophobicContact CZ3-CB 3.98Å; G483-L486 WeakPolarHBondContact O-CB 3.46Å; G483-L486 PolarHBondContact O-N 2.65Å; N484-L486 PolarHBondContact O-N 2.93Å
487	D	94.2	Very high	93.6	Very high	72 Å²	72	50.3 Å²	50.3	39%	0.385	28%	0.276	S	S	.	.	S	Bend	trans	-58.8	130.5	176.5	-168.4	-38.4	0	0	0	110.1	R265 N484 Q485 I489 Q490	R265-D487 PolarHBondContact NH2-O 3.45Å; N484-D487 VanDerWaalsContact O-CB 3.24Å; N484-D487 WeakPolarHBondContact O-CB 3.25Å; N484-D487 PolarHBondContact O-N 3.48Å; Q485-D487 VanDerWaalsContact C-N 3.27Å; D487-I489 HydrophobicContact CB-CG2 4.05Å; D487-I489 VanDerWaalsContact CG-CG2 3.47Å; D487-I489 PolarHBondContact O-N 3.34Å; D487-I489 VanDerWaalsContact O-N 3.15Å; D487-I489 WeakPolarHBondContact OD1-CB 3.29Å; D487-I489 VanDerWaalsContact OD1-CG2 3.31Å; D487-I489 WeakPolarHBondContact OD1-CG2 3.24Å; D487-I489 PolarHBondContact OD1-N 2.88Å; D487-Q490 HydrophobicContact CB-CG 4.27Å; D487-Q490 WeakPolarHBondContact O-CB 3.49Å; D487-Q490 PolarHBondContact O-N 2.86Å; D487-Q490 VanDerWaalsContact O-N 3.07Å
488	P	94.1	Very high	94	Very high	65 Å²	65	50.2 Å²	50.2	42%	0.422	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-51	-31	173.5	-29	36.3	0	0	0	114.4	Q490 R491	P488-Q490 PolarHBondContact O-N 2.9Å; P488-Q490 VanDerWaalsContact O-N 3.14Å; P488-R491 WeakPolarHBondContact O-CB 3.42Å; P488-R491 WeakPolarHBondContact O-CD 3.4Å; P488-R491 WeakPolarHBondContact O-CG 3.36Å; P488-R491 PolarHBondContact O-N 3.43Å
489	I	94.7	Very high	94.4	Very high	87 Å²	87	45.3 Å²	45.3	45%	0.446	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-59.8	-27.8	179.2	-158.1	170.7	0	0	0	112.4	D487 R491 E492	D487-I489 HydrophobicContact CB-CG2 4.05Å; D487-I489 VanDerWaalsContact CG-CG2 3.47Å; D487-I489 PolarHBondContact O-N 3.34Å; D487-I489 VanDerWaalsContact O-N 3.15Å; D487-I489 WeakPolarHBondContact OD1-CB 3.29Å; D487-I489 VanDerWaalsContact OD1-CG2 3.31Å; D487-I489 WeakPolarHBondContact OD1-CG2 3.24Å; D487-I489 PolarHBondContact OD1-N 2.88Å; I489-R491 PolarHBondContact O-N 3.1Å; I489-R491 VanDerWaalsContact O-N 3.09Å; I489-E492 WeakPolarHBondContact O-CB 3.36Å; I489-E492 PolarHBondContact O-N 3.2Å; I489-E492 VanDerWaalsContact O-N 3.11Å
490	Q	95.3	Very high	94.7	Very high	67 Å²	67	39.7 Å²	39.7	31%	0.313	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-70.2	-4.8	178.2	-60.8	-63.1	-44.4	0	0	112.9	N484 D487 P488	N484-Q490 VanDerWaalsContact O-CG 3.28Å; N484-Q490 WeakPolarHBondContact O-CG 3.45Å; D487-Q490 HydrophobicContact CB-CG 4.27Å; D487-Q490 WeakPolarHBondContact O-CB 3.49Å; D487-Q490 PolarHBondContact O-N 2.86Å; D487-Q490 VanDerWaalsContact O-N 3.07Å; P488-Q490 PolarHBondContact O-N 2.9Å; P488-Q490 VanDerWaalsContact O-N 3.14Å
491	R	97	Very high	94.9	Very high	20 Å²	20	39.5 Å²	39.5	8%	0.075	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-77.1	-30.1	170.7	-60.8	169.1	179.8	161.8	2.8	112	V232 L233 E269 P488 I489 V494 C495	V232-R491 WeakPolarHBondContact O-CD 3.37Å; L233-R491 HydrophobicContact CD2-CB 4.35Å; L233-R491 WeakPolarHBondContact O-CD 3.29Å; L233-R491 PolarHBondContact O-NH1 2.83Å; E269-R491 WeakPolarHBondContact OE1-CG 3.48Å; E269-R491 IonicContact OE1-CZ 2.86Å; E269-R491 IonicContact OE1-NE 3.95Å; E269-R491 PolarHBondContact OE1-NE 3.48Å; E269-R491 IonicContact OE1-NH2 3.83Å; E269-R491 IonicContact OE2-CZ 3.72Å; E269-R491 IonicContact OE2-NE 2.74Å; E269-R491 IonicContact OE2-NH2 3.67Å; E269-R491 PolarHBondContact OE2-NH2 3.01Å; P488-R491 WeakPolarHBondContact O-CB 3.42Å; P488-R491 WeakPolarHBondContact O-CD 3.4Å; P488-R491 WeakPolarHBondContact O-CG 3.36Å; P488-R491 PolarHBondContact O-N 3.43Å; I489-R491 PolarHBondContact O-N 3.1Å; I489-R491 VanDerWaalsContact O-N 3.09Å; R491-V494 PolarHBondContact O-N 3.29Å; R491-C495 WeakPolarHBondContact O-CB 3.42Å; R491-C495 PolarHBondContact O-N 3.43Å
492	E	95.6	Very high	95.1	Very high	112 Å²	112	34.6 Å²	34.6	52%	0.523	19%	0.194	S	C	.	.	H	α-helix	trans	-61.2	-44.3	-173.4	-60.9	-179.8	172.1	0	0	113.9	L233 I489 V494 C495 S496	L233-E492 HydrophobicContact CD2-CG 4.17Å; I489-E492 WeakPolarHBondContact O-CB 3.36Å; I489-E492 PolarHBondContact O-N 3.2Å; I489-E492 VanDerWaalsContact O-N 3.11Å; E492-V494 VanDerWaalsContact C-N 3.27Å; E492-V494 PolarHBondContact O-N 3.48Å; E492-C495 WeakPolarHBondContact O-CB 3.42Å; E492-C495 PolarHBondContact O-N 2.87Å; E492-S496 WeakPolarHBondContact O-CB 3.45Å; E492-S496 PolarHBondContact O-N 3.3Å
493	P	95.1	Very high	95.1	Very high	50 Å²	50	33.5 Å²	33.5	33%	0.325	19%	0.187	S	C	.	.	H	α-helix	trans	-62.1	-36.9	178.4	-24.1	35.9	0	0	0	112.5	A497	P493-A497 WeakPolarHBondContact O-CB 3.47Å; P493-A497 PolarHBondContact O-N 2.84Å
494	V	96.1	Very high	95.1	Very high	14 Å²	14	36.5 Å²	36.5	9%	0.085	20%	0.199	C	C	.	.	H	α-helix	trans	-71.2	-42.9	178.7	-177.1	0	0	0	0	110.5	M237 T261 L262 R265 R491 E492 A497 L498	M237-V494 HydrophobicContact CE-CG1 3.96Å; T261-V494 HydrophobicContact CG2-CG1 4.41Å; T261-V494 HydrophobicContact CG2-CG2 4.03Å; L262-V494 HydrophobicContact CD2-CG1 3.45Å; L262-V494 VanDerWaalsContact CD2-CG1 3.45Å; L262-V494 HydrophobicContact CG-CG1 4.28Å; R265-V494 HydrophobicContact CB-CG1 4.49Å; R265-V494 HydrophobicContact CB-CG2 4.28Å; R265-V494 HydrophobicContact CG-CG2 4.41Å; R491-V494 PolarHBondContact O-N 3.29Å; E492-V494 VanDerWaalsContact C-N 3.27Å; E492-V494 PolarHBondContact O-N 3.48Å; V494-A497 PolarHBondContact O-N 2.82Å; V494-L498 WeakPolarHBondContact O-CB 3.12Å; V494-L498 PolarHBondContact O-N 3.28Å
495	C	97.3	Very high	94.9	Very high	8 Å²	8	35.3 Å²	35.3	5%	0.054	20%	0.196	C	C	.	.	H	α-helix	trans	-58.7	-47.9	174.7	-171.3	0	0	0	0	111.6	V232 L233 R491 E492 L498 N499	V232-C495 HydrophobicContact CB-CB 4.25Å; V232-C495 HydrophobicContact CG1-CB 3.64Å; L233-C495 HydrophobicContact CD2-CB 4.18Å; R491-C495 WeakPolarHBondContact O-CB 3.42Å; R491-C495 PolarHBondContact O-N 3.43Å; E492-C495 WeakPolarHBondContact O-CB 3.42Å; E492-C495 PolarHBondContact O-N 2.87Å; C495-L498 PolarHBondContact O-N 2.96Å; C495-N499 WeakPolarHBondContact O-CB 3.16Å; C495-N499 PolarHBondContact O-N 2.78Å
496	S	95.2	Very high	94.7	Very high	37 Å²	37	38.5 Å²	38.5	26%	0.259	21%	0.21	S	C	.	.	H	α-helix	trans	-63.9	-43.3	178.3	-177.7	0	0	0	0	112.3	E492 L498 N499 S500	E492-S496 WeakPolarHBondContact O-CB 3.45Å; E492-S496 PolarHBondContact O-N 3.3Å; S496-L498 PolarHBondContact O-N 3.45Å; S496-N499 PolarHBondContact O-N 2.72Å; S496-S500 WeakPolarHBondContact O-CB 3.49Å; S496-S500 PolarHBondContact O-N 2.79Å; S496-S500 PolarHBondContact O-OG 2.84Å
497	A	95.9	Very high	94.6	Very high	30 Å²	30	45.9 Å²	45.9	25%	0.248	25%	0.25	C	C	.	.	H	α-helix	trans	-62.7	-40.7	176.3	0	0	0	0	0	112.3	L258 P493 V494 A501	L258-A497 HydrophobicContact CD1-CB 4.09Å; P493-A497 WeakPolarHBondContact O-CB 3.47Å; P493-A497 PolarHBondContact O-N 2.84Å; V494-A497 PolarHBondContact O-N 2.82Å; A497-A501 PolarHBondContact O-N 2.9Å
498	L	97.3	Very high	94.5	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-66.4	-47.5	175.8	178.9	55.2	0	0	0	111.9	I228 V232 T244 L251 L252 L258 L262 V494 C495 S496 S500 A501 I502	I228-L498 HydrophobicContact CG2-CD2 3.45Å; I228-L498 VanDerWaalsContact CG2-CD2 3.45Å; I228-L498 HydrophobicContact CG2-CG 4.2Å; V232-L498 HydrophobicContact CG2-CD2 4.05Å; T244-L498 HydrophobicContact CG2-CD1 3.94Å; L251-L498 HydrophobicContact CD2-CD1 4.32Å; L252-L498 HydrophobicContact CD2-CD1 4.36Å; L258-L498 HydrophobicContact CD2-CD1 4.11Å; L262-L498 HydrophobicContact CD1-CD1 4.28Å; L262-L498 HydrophobicContact CD1-CD2 4.43Å; L262-L498 HydrophobicContact CD2-CD2 4.05Å; V494-L498 WeakPolarHBondContact O-CB 3.12Å; V494-L498 PolarHBondContact O-N 3.28Å; C495-L498 PolarHBondContact O-N 2.96Å; S496-L498 PolarHBondContact O-N 3.45Å; L498-S500 VanDerWaalsContact C-N 3.31Å; L498-S500 PolarHBondContact O-N 2.8Å; L498-A501 PolarHBondContact O-N 3.27Å; L498-I502 HydrophobicContact CD1-CD1 4.17Å; L498-I502 HydrophobicContact CD1-CG1 4.36Å; L498-I502 HydrophobicContact CG-CD1 4.09Å; L498-I502 WeakPolarHBondContact O-CG1 3.36Å; L498-I502 PolarHBondContact O-N 3.34Å
499	N	96.5	Very high	94.3	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-43.7	176.5	-173.8	60.4	0	0	0	111.4	H197 R225 Q229 C495 S496 A501 I502 L503	H197-N499 PolarHBondContact CE1-ND2 2.9Å; H197-N499 PolarHBondContact O-ND2 2.83Å; R225-N499 WeakPolarHBondContact CD-OD1 3.23Å; R225-N499 PolarHBondContact NH1-OD1 2.78Å; Q229-N499 VanDerWaalsContact NE2-CG 3.33Å; Q229-N499 PolarHBondContact NE2-OD1 2.88Å; C495-N499 WeakPolarHBondContact O-CB 3.16Å; C495-N499 PolarHBondContact O-N 2.78Å; S496-N499 PolarHBondContact O-N 2.72Å; N499-A501 PolarHBondContact O-N 3.06Å; N499-I502 PolarHBondContact O-N 2.89Å; N499-L503 WeakPolarHBondContact O-CG 3.37Å; N499-L503 PolarHBondContact O-N 2.94Å
500	S	95.6	Very high	94.2	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.028	25%	0.249	C	C	.	.	H	α-helix	trans	-58.1	-47.8	175.5	-57.1	0	0	0	0	111.2	S496 L498 I502 L503 E504 K510	S496-S500 WeakPolarHBondContact O-CB 3.49Å; S496-S500 PolarHBondContact O-N 2.79Å; S496-S500 PolarHBondContact O-OG 2.84Å; L498-S500 VanDerWaalsContact C-N 3.31Å; L498-S500 PolarHBondContact O-N 2.8Å; S500-I502 VanDerWaalsContact C-N 3.32Å; S500-I502 PolarHBondContact O-N 2.95Å; S500-L503 PolarHBondContact O-N 2.94Å; S500-E504 VanDerWaalsContact O-CG 3.31Å; S500-E504 WeakPolarHBondContact O-CG 3.26Å; S500-E504 PolarHBondContact O-N 2.89Å; S500-K510 PolarHBondContact OG-O 2.85Å; S500-K510 VanDerWaalsContact OG-O 3.11Å
501	A	96.3	Very high	94.1	Very high	7 Å²	7	46 Å²	46	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-35.3	178.7	0	0	0	0	0	113.1	L251 L258 A497 L498 N499 E504 T505	L251-A501 HydrophobicContact CD2-CB 4.34Å; L258-A501 HydrophobicContact CD2-CB 3.48Å; L258-A501 VanDerWaalsContact CD2-CB 3.48Å; A497-A501 PolarHBondContact O-N 2.9Å; L498-A501 PolarHBondContact O-N 3.27Å; N499-A501 PolarHBondContact O-N 3.06Å; A501-E504 PolarHBondContact O-N 2.9Å; A501-T505 PolarHBondContact O-N 3.11Å
502	I	95.7	Very high	93.9	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-42.6	174.4	-66.4	163.6	0	0	0	111.2	R225 I228 Y248 L251 L498 N499 S500 E504 T505 H506	R225-I502 HydrophobicContact CG-CG2 3.77Å; I228-I502 HydrophobicContact CD1-CD1 3.84Å; I228-I502 HydrophobicContact CG2-CD1 4.49Å; Y248-I502 HydrophobicContact CD1-CG2 4.2Å; Y248-I502 HydrophobicContact CD2-CD1 4.11Å; Y248-I502 HydrophobicContact CD2-CG1 3.94Å; Y248-I502 HydrophobicContact CD2-CG2 4.08Å; Y248-I502 HydrophobicContact CE1-CG2 3.72Å; Y248-I502 HydrophobicContact CE2-CB 4.45Å; Y248-I502 HydrophobicContact CE2-CD1 3.86Å; Y248-I502 HydrophobicContact CE2-CG1 3.99Å; Y248-I502 HydrophobicContact CE2-CG2 3.57Å; Y248-I502 HydrophobicContact CG-CG2 4.36Å; L251-I502 HydrophobicContact CD1-CB 4.18Å; L251-I502 HydrophobicContact CD1-CG1 3.62Å; L498-I502 HydrophobicContact CD1-CD1 4.17Å; L498-I502 HydrophobicContact CD1-CG1 4.36Å; L498-I502 HydrophobicContact CG-CD1 4.09Å; L498-I502 WeakPolarHBondContact O-CG1 3.36Å; L498-I502 PolarHBondContact O-N 3.34Å; N499-I502 PolarHBondContact O-N 2.89Å; S500-I502 VanDerWaalsContact C-N 3.32Å; S500-I502 PolarHBondContact O-N 2.95Å; I502-E504 VanDerWaalsContact C-N 3.31Å; I502-E504 PolarHBondContact O-N 3.08Å; I502-T505 PolarHBondContact O-N 3.03Å; I502-T505 PolarHBondContact O-OG1 2.98Å; I502-H506 PolarHBondContact O-ND1 2.87Å
503	L	93.7	Very high	93.9	Very high	5 Å²	5	42.6 Å²	42.6	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-39.7	177	-69.2	170.2	0	0	0	111	H197 N499 S500 T505 H506 N507 L508 P509	H197-L503 WeakPolarHBondContact CD2-CD1 3.49Å; N499-L503 WeakPolarHBondContact O-CG 3.37Å; N499-L503 PolarHBondContact O-N 2.94Å; S500-L503 PolarHBondContact O-N 2.94Å; L503-T505 VanDerWaalsContact C-N 3.35Å; L503-T505 PolarHBondContact O-N 3.39Å; L503-H506 CarbonylContact O-C 3.59Å; L503-H506 PolarHBondContact O-N 2.85Å; L503-N507 PolarHBondContact O-N 2.99Å; L503-L508 HydrophobicContact CB-CB 3.98Å; L503-L508 HydrophobicContact CD2-CB 3.92Å; L503-L508 HydrophobicContact CD2-CD1 3.75Å; L503-L508 WeakPolarHBondContact O-CB 3.38Å; L503-L508 PolarHBondContact O-N 3.2Å; L503-P509 WeakPolarHBondContact CD1-O 3.27Å
504	E	92	Very high	93.8	Very high	68 Å²	68	42.8 Å²	42.8	32%	0.318	24%	0.235	S	C	.	.	H	α-helix	trans	-59.8	-39.8	177.2	-71.5	174.7	-147.3	0	0	114	S500 A501 I502 H506 N507 K510	S500-E504 VanDerWaalsContact O-CG 3.31Å; S500-E504 WeakPolarHBondContact O-CG 3.26Å; S500-E504 PolarHBondContact O-N 2.89Å; A501-E504 PolarHBondContact O-N 2.9Å; I502-E504 VanDerWaalsContact C-N 3.31Å; I502-E504 PolarHBondContact O-N 3.08Å; E504-H506 PolarHBondContact O-N 3.15Å; E504-H506 VanDerWaalsContact O-N 3.11Å; E504-N507 PolarHBondContact O-N 2.72Å; E504-K510 HydrophobicContact CG-CD 3.84Å; E504-K510 VanDerWaalsContact CG-CE 3.46Å; E504-K510 HydrophobicContact CG-CG 3.37Å; E504-K510 WeakPolarHBondContact OE1-CD 3.38Å; E504-K510 WeakPolarHBondContact OE1-CE 3.29Å; E504-K510 WeakPolarHBondContact OE1-CG 3.18Å; E504-K510 IonicContact OE1-NZ 3.52Å; E504-K510 PolarHBondContact OE1-NZ 3.29Å; E504-K510 VanDerWaalsContact OE2-CE 3.29Å; E504-K510 WeakPolarHBondContact OE2-CE 3.32Å; E504-K510 IonicContact OE2-NZ 3.53Å; E504-K510 PolarHBondContact OE2-NZ 2.73Å
505	T	90.2	Very high	93.6	Very high	63 Å²	63	44.1 Å²	44.1	39%	0.387	25%	0.248	S	C	.	.	H	α-helix	trans	-63.9	-17.8	179.4	55.1	0	0	0	0	112.5	L251 A501 I502 L503	L251-T505 HydrophobicContact CB-CG2 4.39Å; L251-T505 HydrophobicContact CD1-CG2 3.77Å; L251-T505 HydrophobicContact CG-CG2 4.01Å; A501-T505 PolarHBondContact O-N 3.11Å; I502-T505 PolarHBondContact O-N 3.03Å; I502-T505 PolarHBondContact O-OG1 2.98Å; L503-T505 VanDerWaalsContact C-N 3.35Å; L503-T505 PolarHBondContact O-N 3.39Å
506	H	88.8	Confident	93.4	Very high	91 Å²	91	48.1 Å²	48.1	42%	0.421	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	12.5	176.2	-58	87.9	0	0	0	112.6	Y248 I502 L503 E504 L508	Y248-H506 AromaticContact CD1-CE1 3.56Å; Y248-H506 AromaticContact CE1-CE1 3.38Å; Y248-H506 WeakPolarHBondContact CE1-CE1 3.21Å; I502-H506 PolarHBondContact O-ND1 2.87Å; L503-H506 CarbonylContact O-C 3.59Å; L503-H506 PolarHBondContact O-N 2.85Å; E504-H506 PolarHBondContact O-N 3.15Å; E504-H506 VanDerWaalsContact O-N 3.11Å; H506-L508 HydrophobicContact CB-CD1 4.13Å; H506-L508 HydrophobicContact CB-CG 4.12Å; H506-L508 PolarHBondContact O-N 3.45Å
507	N	90.4	Very high	93.3	Very high	157 Å²	157	48.3 Å²	48.3	84%	0.84	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	27.5	-174.5	-57.4	-61.1	0	0	0	113.8	L503 E504	L503-N507 PolarHBondContact O-N 2.99Å; E504-N507 PolarHBondContact O-N 2.72Å
508	L	91.5	Very high	93.2	Very high	47 Å²	47	49.8 Å²	49.8	25%	0.246	28%	0.275	C	S	.	.			trans	-89.4	154.4	174.2	-64	173.9	0	0	0	110.4	E217 L503 H506 K510	E217-L508 HydrophobicContact CB-CD1 4.34Å; E217-L508 HydrophobicContact CG-CD1 3.89Å; L503-L508 HydrophobicContact CB-CB 3.98Å; L503-L508 HydrophobicContact CD2-CB 3.92Å; L503-L508 HydrophobicContact CD2-CD1 3.75Å; L503-L508 WeakPolarHBondContact O-CB 3.38Å; L503-L508 PolarHBondContact O-N 3.2Å; H506-L508 HydrophobicContact CB-CD1 4.13Å; H506-L508 HydrophobicContact CB-CG 4.12Å; H506-L508 PolarHBondContact O-N 3.45Å; L508-K510 PolarHBondContact O-N 3.24Å
509	P	91.2	Very high	93	Very high	82 Å²	82	51.1 Å²	51.1	53%	0.532	29%	0.289	S	S	.	.			trans	-59	127.1	-179.9	-24.7	34.6	0	0	0	112.8	L503 Q511	L503-P509 WeakPolarHBondContact CD1-O 3.27Å; P509-Q511 PolarHBondContact O-N 3.04Å
510	K	92.4	Very high	92.9	Very high	105 Å²	105	57.9 Å²	57.9	46%	0.457	32%	0.32	S	S	.	.	S	Bend	trans	-57.5	-34.4	176.2	-60.5	-178.3	-173.7	-133.3	0	113.1	H197 S500 E504 L508	H197-K510 PolarHBondContact NE2-O 2.76Å; S500-K510 PolarHBondContact OG-O 2.85Å; S500-K510 VanDerWaalsContact OG-O 3.11Å; E504-K510 HydrophobicContact CG-CD 3.84Å; E504-K510 VanDerWaalsContact CG-CE 3.46Å; E504-K510 HydrophobicContact CG-CG 3.37Å; E504-K510 WeakPolarHBondContact OE1-CD 3.38Å; E504-K510 WeakPolarHBondContact OE1-CE 3.29Å; E504-K510 WeakPolarHBondContact OE1-CG 3.18Å; E504-K510 IonicContact OE1-NZ 3.52Å; E504-K510 PolarHBondContact OE1-NZ 3.29Å; E504-K510 VanDerWaalsContact OE2-CE 3.29Å; E504-K510 WeakPolarHBondContact OE2-CE 3.32Å; E504-K510 IonicContact OE2-NZ 3.53Å; E504-K510 PolarHBondContact OE2-NZ 2.73Å; L508-K510 PolarHBondContact O-N 3.24Å
511	Q	92.2	Very high	92.8	Very high	60 Å²	60	59.7 Å²	59.7	28%	0.28	34%	0.335	S	S	.	.	S	Bend	trans	-135.7	143.9	-174.4	-68.5	-178.9	-36.4	0	0	108.8	P509 L516	P509-Q511 PolarHBondContact O-N 3.04Å; Q511-L516 HydrophobicContact CB-CD2 4.37Å; Q511-L516 HydrophobicContact CB-CG 4.24Å; Q511-L516 VanDerWaalsContact OE1-CD2 3.22Å
512	P	93.7	Very high	92.7	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.019	35%	0.354	C	S	.	.			trans	-70.7	143.7	176.4	28.5	-30.8	0	0	0	109.9	Y194 H197 L514 A515 L516	Y194-P512 HydrophobicContact CD2-CB 4.23Å; Y194-P512 HydrophobicContact CD2-CG 3.72Å; H197-P512 HydrophobicContact CB-CB 4.24Å; H197-P512 HydrophobicContact CB-CG 4.39Å; P512-L514 PolarHBondContact O-N 2.58Å; P512-L514 VanDerWaalsContact O-N 3.1Å; P512-A515 HydrophobicContact CG-CB 3.85Å; P512-A515 PolarHBondContact O-N 2.82Å; P512-L516 PolarHBondContact O-N 3.07Å
513	P	94.3	Very high	92.6	Very high	57 Å²	57	67 Å²	67	37%	0.37	37%	0.374	S	S	.	.	H	α-helix	trans	-54.3	-31.3	179.1	-28.4	35.8	0	0	0	114.1	M190 S193 L516 A517	M190-P513 HydrophobicContact CG-CB 4.17Å; S193-P513 VanDerWaalsContact OG-CD 3.31Å; S193-P513 WeakPolarHBondContact OG-CD 3.44Å; P513-L516 PolarHBondContact O-N 2.85Å; P513-A517 WeakPolarHBondContact O-CB 3.35Å; P513-A517 PolarHBondContact O-N 2.83Å
514	L	93.2	Very high	92.7	Very high	53 Å²	53	69.9 Å²	69.9	28%	0.277	39%	0.393	S	S	.	.	H	α-helix	trans	-59.7	-48.5	175	-177.2	59.6	0	0	0	112.3	M190 Y194 P512 L516 A517 M518	M190-L514 HydrophobicContact CB-CB 4.37Å; M190-L514 HydrophobicContact CE-CB 4.22Å; M190-L514 HydrophobicContact CE-CD1 4.04Å; Y194-L514 HydrophobicContact CD2-CD2 4.37Å; Y194-L514 HydrophobicContact CG-CD2 4.27Å; P512-L514 PolarHBondContact O-N 2.58Å; P512-L514 VanDerWaalsContact O-N 3.1Å; L514-L516 VanDerWaalsContact C-N 3.31Å; L514-L516 PolarHBondContact O-N 2.8Å; L514-A517 PolarHBondContact O-N 2.91Å; L514-M518 HydrophobicContact CD1-SD 4.49Å; L514-M518 HydrophobicContact CG-SD 4.23Å; L514-M518 VanDerWaalsContact O-CG 3.31Å; L514-M518 WeakPolarHBondContact O-CG 3.1Å; L514-M518 PolarHBondContact O-N 3.03Å
515	A	92	Very high	92.7	Very high	42 Å²	42	68.5 Å²	68.5	35%	0.347	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-36.6	178.2	0	0	0	0	0	111.9	P512 G519	P512-A515 HydrophobicContact CG-CB 3.85Å; P512-A515 PolarHBondContact O-N 2.82Å; A515-G519 PolarHBondContact O-N 3.19Å
516	L	94.2	Very high	92.8	Very high	92 Å²	92	66.6 Å²	66.6	48%	0.482	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-44.6	174	-71	173.4	0	0	0	111.7	Q511 P512 P513 L514 G519 Q520	Q511-L516 HydrophobicContact CB-CD2 4.37Å; Q511-L516 HydrophobicContact CB-CG 4.24Å; Q511-L516 VanDerWaalsContact OE1-CD2 3.22Å; P512-L516 PolarHBondContact O-N 3.07Å; P513-L516 PolarHBondContact O-N 2.85Å; L514-L516 VanDerWaalsContact C-N 3.31Å; L514-L516 PolarHBondContact O-N 2.8Å; L516-G519 PolarHBondContact O-N 2.94Å; L516-Q520 WeakPolarHBondContact O-CB 3.45Å; L516-Q520 PolarHBondContact O-N 2.79Å
517	A	93.3	Very high	93	Very high	41 Å²	41	66.6 Å²	66.6	34%	0.339	38%	0.384	S	S	.	.	H	α-helix	trans	-62.9	-43.5	177.9	0	0	0	0	0	111.7	M190 P513 L514 Q520 A521	M190-A517 HydrophobicContact CE-CB 3.83Å; P513-A517 WeakPolarHBondContact O-CB 3.35Å; P513-A517 PolarHBondContact O-N 2.83Å; L514-A517 PolarHBondContact O-N 2.91Å; A517-Q520 PolarHBondContact O-N 2.76Å; A517-A521 WeakPolarHBondContact O-CB 3.36Å; A517-A521 PolarHBondContact O-N 3.45Å
518	M	92.6	Very high	93.2	Very high	62 Å²	62	61.7 Å²	61.7	31%	0.305	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175	-67.9	172.3	63.3	0	0	111.7	L514 Q520 A521 T522 L545	L514-M518 HydrophobicContact CD1-SD 4.49Å; L514-M518 HydrophobicContact CG-SD 4.23Å; L514-M518 VanDerWaalsContact O-CG 3.31Å; L514-M518 WeakPolarHBondContact O-CG 3.1Å; L514-M518 PolarHBondContact O-N 3.03Å; M518-Q520 VanDerWaalsContact C-N 3.33Å; M518-Q520 PolarHBondContact O-N 3.1Å; M518-A521 PolarHBondContact O-N 2.62Å; M518-T522 PolarHBondContact O-N 2.98Å; M518-T522 PolarHBondContact O-OG1 2.99Å; M518-L545 HydrophobicContact CE-CD1 3.28Å; M518-L545 HydrophobicContact CE-CD2 3.46Å; M518-L545 VanDerWaalsContact CE-CD2 3.46Å; M518-L545 HydrophobicContact CE-CG 3.99Å; M518-L545 HydrophobicContact SD-CD2 4.13Å
519	G	92.7	Very high	93.1	Very high	30 Å²	30	60.8 Å²	60.8	31%	0.309	36%	0.355	S	S	.	.	H	α-helix	trans	-60.3	-42.7	176.1	0	0	0	0	0	112.3	A515 L516 T522 Q523	A515-G519 PolarHBondContact O-N 3.19Å; L516-G519 PolarHBondContact O-N 2.94Å; G519-T522 PolarHBondContact O-N 3.36Å; G519-Q523 WeakPolarHBondContact O-CG 3.3Å; G519-Q523 PolarHBondContact O-N 3.45Å
520	Q	95	Very high	93	Very high	145 Å²	145	65 Å²	65	68%	0.678	36%	0.361	S	S	*	.	H	α-helix	trans	-63.6	-43.7	175.4	-176.1	179.9	-5	0	0	111.9	L516 A517 M518 Q523 C524	L516-Q520 WeakPolarHBondContact O-CB 3.45Å; L516-Q520 PolarHBondContact O-N 2.79Å; A517-Q520 PolarHBondContact O-N 2.76Å; M518-Q520 VanDerWaalsContact C-N 3.33Å; M518-Q520 PolarHBondContact O-N 3.1Å; Q520-Q523 PolarHBondContact O-N 3.3Å; Q520-C524 WeakPolarHBondContact O-CB 3.5Å; Q520-C524 PolarHBondContact O-N 2.88Å
521	A	94	Very high	93	Very high	41 Å²	41	64.3 Å²	64.3	34%	0.339	37%	0.37	S	S	.	.	H	α-helix	trans	-60.3	-46.7	177.5	0	0	0	0	0	111.5	A517 M518 Q523 C524 L525 V541	A517-A521 WeakPolarHBondContact O-CB 3.36Å; A517-A521 PolarHBondContact O-N 3.45Å; M518-A521 PolarHBondContact O-N 2.62Å; A521-Q523 PolarHBondContact O-N 2.88Å; A521-C524 WeakPolarHBondContact O-CB 3.41Å; A521-C524 PolarHBondContact O-N 2.91Å; A521-C524 VanDerWaalsContact O-N 3.16Å; A521-L525 PolarHBondContact O-N 2.83Å; A521-V541 HydrophobicContact CB-CG2 3.87Å
522	T	93.8	Very high	92.8	Very high	75 Å²	75	63 Å²	63	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-43.7	175.7	-60.4	0	0	0	0	112	M518 G519 C524 L525 G526 V541	M518-T522 PolarHBondContact O-N 2.98Å; M518-T522 PolarHBondContact O-OG1 2.99Å; G519-T522 PolarHBondContact O-N 3.36Å; T522-C524 VanDerWaalsContact C-N 3.35Å; T522-L525 PolarHBondContact O-N 3.26Å; T522-G526 PolarHBondContact O-N 3.23Å; T522-G526 VanDerWaalsContact O-N 3.08Å; T522-V541 WeakPolarHBondContact OG1-CG2 3.48Å
523	Q	94.4	Very high	92.7	Very high	89 Å²	89	65.7 Å²	65.7	42%	0.416	39%	0.388	S	S	.	.	H	α-helix	trans	-66.6	-36.3	175.9	-68.9	-57.2	-40	0	0	112.5	G519 Q520 A521 G526 L527	G519-Q523 WeakPolarHBondContact O-CG 3.3Å; G519-Q523 PolarHBondContact O-N 3.45Å; Q520-Q523 PolarHBondContact O-N 3.3Å; A521-Q523 PolarHBondContact O-N 2.88Å; Q523-G526 PolarHBondContact O-N 2.84Å; Q523-L527 WeakPolarHBondContact O-CG 3.46Å; Q523-L527 PolarHBondContact O-N 2.81Å
524	C	94.5	Very high	92.4	Very high	64 Å²	64	63.1 Å²	63.1	43%	0.432	37%	0.372	S	S	.	.	H	α-helix	trans	-62.6	-48.1	176	-167.7	0	0	0	0	111.1	Q520 A521 T522 G526 L527 M528	Q520-C524 WeakPolarHBondContact O-CB 3.5Å; Q520-C524 PolarHBondContact O-N 2.88Å; A521-C524 WeakPolarHBondContact O-CB 3.41Å; A521-C524 PolarHBondContact O-N 2.91Å; A521-C524 VanDerWaalsContact O-N 3.16Å; T522-C524 VanDerWaalsContact C-N 3.35Å; C524-G526 VanDerWaalsContact C-N 3.29Å; C524-G526 PolarHBondContact O-N 2.95Å; C524-L527 CarbonylContact O-C 3.56Å; C524-L527 WeakPolarHBondContact O-CB 3.19Å; C524-L527 PolarHBondContact O-N 3Å; C524-M528 VanDerWaalsContact O-CG 3.31Å; C524-M528 WeakPolarHBondContact O-CG 3.46Å; C524-M528 PolarHBondContact O-N 2.82Å
525	L	92.7	Very high	92.4	Very high	39 Å²	39	62 Å²	62	20%	0.204	37%	0.369	C	S	.	.	H	α-helix	trans	-58.2	-41.6	174.3	-70.4	170.8	0	0	0	111.7	A521 T522 L527 M528 A529 C536 A539 V541	A521-L525 PolarHBondContact O-N 2.83Å; T522-L525 PolarHBondContact O-N 3.26Å; L525-L527 VanDerWaalsContact C-N 3.35Å; L525-L527 PolarHBondContact O-N 2.74Å; L525-M528 HydrophobicContact CD2-SD 4.18Å; L525-M528 WeakPolarHBondContact O-CB 3.36Å; L525-M528 PolarHBondContact O-N 2.9Å; L525-A529 PolarHBondContact O-N 2.95Å; L525-C536 HydrophobicContact CD2-CB 4.16Å; L525-A539 HydrophobicContact CD2-CB 4.04Å; L525-V541 HydrophobicContact CD1-CG2 3.84Å
526	G	92	Very high	92.4	Very high	24 Å²	24	60.7 Å²	60.7	25%	0.247	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-37.1	174.3	0	0	0	0	0	113.6	T522 Q523 C524 R530	T522-G526 PolarHBondContact O-N 3.23Å; T522-G526 VanDerWaalsContact O-N 3.08Å; Q523-G526 PolarHBondContact O-N 2.84Å; C524-G526 VanDerWaalsContact C-N 3.29Å; C524-G526 PolarHBondContact O-N 2.95Å; G526-R530 WeakPolarHBondContact O-CG 3.46Å; G526-R530 PolarHBondContact O-N 2.93Å; G526-R530 PolarHBondContact O-NH1 3.4Å
527	L	93.8	Very high	92.3	Very high	91 Å²	91	57.8 Å²	57.8	48%	0.476	35%	0.346	S	S	.	.	H	α-helix	trans	-70	-40.8	174.2	-76	166	0	0	0	112	Q523 C524 L525 A529 R530 S531	Q523-L527 WeakPolarHBondContact O-CG 3.46Å; Q523-L527 PolarHBondContact O-N 2.81Å; C524-L527 CarbonylContact O-C 3.56Å; C524-L527 WeakPolarHBondContact O-CB 3.19Å; C524-L527 PolarHBondContact O-N 3Å; L525-L527 VanDerWaalsContact C-N 3.35Å; L525-L527 PolarHBondContact O-N 2.74Å; L527-A529 VanDerWaalsContact C-N 3.34Å; L527-A529 PolarHBondContact O-N 3.27Å; L527-R530 PolarHBondContact O-N 3.02Å; L527-S531 VanDerWaalsContact O-CB 3.3Å; L527-S531 WeakPolarHBondContact O-CB 3.16Å; L527-S531 PolarHBondContact O-N 2.94Å; L527-S531 PolarHBondContact O-OG 2.92Å
528	M	92.9	Very high	92.3	Very high	53 Å²	53	55.9 Å²	55.9	26%	0.261	33%	0.33	S	S	.	.	H	α-helix	trans	-57.7	-47	175.1	-74	171.3	72.7	0	0	111	C524 L525 R530 S531 G532 V533 C536	C524-M528 VanDerWaalsContact O-CG 3.31Å; C524-M528 WeakPolarHBondContact O-CG 3.46Å; C524-M528 PolarHBondContact O-N 2.82Å; L525-M528 HydrophobicContact CD2-SD 4.18Å; L525-M528 WeakPolarHBondContact O-CB 3.36Å; L525-M528 PolarHBondContact O-N 2.9Å; M528-R530 PolarHBondContact O-N 2.83Å; M528-S531 CarbonylContact O-C 3.55Å; M528-S531 PolarHBondContact O-N 2.79Å; M528-S531 VanDerWaalsContact O-N 3.12Å; M528-G532 PolarHBondContact O-N 3.14Å; M528-G532 VanDerWaalsContact O-N 3.08Å; M528-V533 HydrophobicContact CB-CB 4Å; M528-V533 HydrophobicContact CB-CG2 4.45Å; M528-V533 HydrophobicContact CE-CB 4.4Å; M528-V533 HydrophobicContact CE-CG1 3.68Å; M528-V533 HydrophobicContact CG-CB 4.47Å; M528-V533 PolarHBondContact O-N 2.99Å; M528-C536 HydrophobicContact CB-CB 3.8Å; M528-C536 HydrophobicContact CE-CB 4.14Å
529	A	90.5	Very high	92.2	Very high	28 Å²	28	53.6 Å²	53.6	23%	0.231	32%	0.321	C	S	.	.	H	α-helix	trans	-58	-45.5	176	0	0	0	0	0	112.4	A29 L525 L527 S531 G532 C536	A29-A529 HydrophobicContact CB-CB 4.03Å; L525-A529 PolarHBondContact O-N 2.95Å; L527-A529 VanDerWaalsContact C-N 3.34Å; L527-A529 PolarHBondContact O-N 3.27Å; A529-S531 VanDerWaalsContact C-N 3.3Å; A529-S531 PolarHBondContact O-N 2.85Å; A529-G532 PolarHBondContact O-N 3.18Å; A529-C536 WeakPolarHBondContact CA-SG 3.48Å
530	R	89.9	Confident	91.9	Very high	170 Å²	170	54.5 Å²	54.5	64%	0.642	32%	0.32	S	S	*	.	H	α-helix	trans	-69.5	-26.3	177	-70.6	-171.2	-63.8	-87.3	5.9	113.6	G526 L527 M528 G532	G526-R530 WeakPolarHBondContact O-CG 3.46Å; G526-R530 PolarHBondContact O-N 2.93Å; G526-R530 PolarHBondContact O-NH1 3.4Å; L527-R530 PolarHBondContact O-N 3.02Å; M528-R530 PolarHBondContact O-N 2.83Å; R530-G532 VanDerWaalsContact C-N 3.31Å
531	S	91	Very high	91.6	Very high	92 Å²	92	49 Å²	49	64%	0.643	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-0.6	179.4	-52.4	0	0	0	0	112.8	L527 M528 A529	L527-S531 VanDerWaalsContact O-CB 3.3Å; L527-S531 WeakPolarHBondContact O-CB 3.16Å; L527-S531 PolarHBondContact O-N 2.94Å; L527-S531 PolarHBondContact O-OG 2.92Å; M528-S531 CarbonylContact O-C 3.55Å; M528-S531 PolarHBondContact O-N 2.79Å; M528-S531 VanDerWaalsContact O-N 3.12Å; A529-S531 VanDerWaalsContact C-N 3.3Å; A529-S531 PolarHBondContact O-N 2.85Å
532	G	88.5	Confident	91.3	Very high	33 Å²	33	52.9 Å²	52.9	34%	0.34	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	22.7	176.5	0	0	0	0	0	115.3	M528 A529 R530 G534	M528-G532 PolarHBondContact O-N 3.14Å; M528-G532 VanDerWaalsContact O-N 3.08Å; A529-G532 PolarHBondContact O-N 3.18Å; R530-G532 VanDerWaalsContact C-N 3.31Å; G532-G534 PolarHBondContact O-N 2.53Å
533	V	90.8	Very high	90.8	Very high	59 Å²	59	52.5 Å²	52.5	36%	0.358	30%	0.303	S	S	.	.			trans	-85.7	94.8	178.2	-177.6	0	0	0	0	109.4	M528 S535 C536	M528-V533 HydrophobicContact CB-CB 4Å; M528-V533 HydrophobicContact CB-CG2 4.45Å; M528-V533 HydrophobicContact CE-CB 4.4Å; M528-V533 HydrophobicContact CE-CG1 3.68Å; M528-V533 HydrophobicContact CG-CB 4.47Å; M528-V533 PolarHBondContact O-N 2.99Å; V533-S535 WeakPolarHBondContact CG1-OG 3.37Å; V533-S535 PolarHBondContact O-N 3.28Å; V533-S535 VanDerWaalsContact O-N 3.1Å; V533-C536 PolarHBondContact O-N 2.76Å; V533-C536 PolarHBondContact O-SG 3.16Å
534	G	89.6	Confident	90	Very high	2 Å²	2	52.9 Å²	52.9	2%	0.021	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-60.8	-22.1	-171.3	0	0	0	0	0	115.8	G31 G532 C536 A537	G31-G534 VanDerWaalsContact CA-O 3.25Å; G31-G534 WeakPolarHBondContact CA-O 3.49Å; G532-G534 PolarHBondContact O-N 2.53Å; G534-C536 PolarHBondContact O-N 2.82Å; G534-A537 WeakPolarHBondContact O-CB 3.46Å; G534-A537 PolarHBondContact O-N 3.41Å
535	S	92.2	Very high	89.1	Confident	30 Å²	30	54.3 Å²	54.3	21%	0.21	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-64.1	-23.8	178.5	55.3	0	0	0	0	113.5	V533 A537 F538	V533-S535 WeakPolarHBondContact CG1-OG 3.37Å; V533-S535 PolarHBondContact O-N 3.28Å; V533-S535 VanDerWaalsContact O-N 3.1Å; S535-A537 PolarHBondContact O-N 2.83Å; S535-A537 VanDerWaalsContact O-N 3.15Å; S535-F538 PolarHBondContact O-N 2.82Å; S535-F538 VanDerWaalsContact O-N 3.1Å
536	C	92.3	Very high	87.5	Confident	14 Å²	14	63.4 Å²	63.4	10%	0.095	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-64.1	-19.3	178	72.6	0	0	0	0	113.1	L525 M528 A529 V533 G534 F538 A539	L525-C536 HydrophobicContact CD2-CB 4.16Å; M528-C536 HydrophobicContact CB-CB 3.8Å; M528-C536 HydrophobicContact CE-CB 4.14Å; A529-C536 WeakPolarHBondContact CA-SG 3.48Å; V533-C536 PolarHBondContact O-N 2.76Å; V533-C536 PolarHBondContact O-SG 3.16Å; G534-C536 PolarHBondContact O-N 2.82Å; C536-F538 PolarHBondContact O-N 3.07Å; C536-A539 PolarHBondContact O-N 3.39Å; C536-A539 VanDerWaalsContact O-O 3.12Å
537	A	92.7	Very high	87.3	Confident	31 Å²	31	65.4 Å²	65.4	26%	0.256	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-64.6	-21.3	175.9	0	0	0	0	0	113	A29 C30 G534 S535	A29-A537 VanDerWaalsContact O-CB 3.25Å; A29-A537 WeakPolarHBondContact O-CB 3.25Å; C30-A537 WeakPolarHBondContact O-CB 3.41Å; G534-A537 WeakPolarHBondContact O-CB 3.46Å; G534-A537 PolarHBondContact O-N 3.41Å; S535-A537 PolarHBondContact O-N 2.83Å; S535-A537 VanDerWaalsContact O-N 3.15Å
538	F	92.9	Very high	86.9	Confident	2 Å²	2	64 Å²	64	1%	0.009	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-111.2	12	-176	-61.8	-78.3	0	0	0	113.1	I32 I106 M160 W163 R164 I167 S535 C536	I32-F538 HydrophobicContact CB-CZ 4.34Å; I32-F538 HydrophobicContact CD1-CE2 4.2Å; I32-F538 HydrophobicContact CD1-CZ 3.7Å; I32-F538 HydrophobicContact CG1-CE2 4.17Å; I32-F538 HydrophobicContact CG1-CZ 3.97Å; I106-F538 HydrophobicContact CD1-CD2 3.73Å; I106-F538 HydrophobicContact CD1-CE2 3.63Å; I106-F538 HydrophobicContact CG1-CE2 4.39Å; M160-F538 HydrophobicContact CB-CE1 4.21Å; M160-F538 HydrophobicContact CE-CE1 4.23Å; M160-F538 HydrophobicContact CE-CZ 4.29Å; M160-F538 WeakPolarHBondContact O-CE1 3.5Å; W163-F538 HydrophobicContact CB-CZ 4.43Å; R164-F538 HydrophobicContact CB-CD1 3.86Å; R164-F538 HydrophobicContact CG-CD1 4.4Å; I167-F538 HydrophobicContact CB-CB 4.08Å; I167-F538 HydrophobicContact CG1-CB 4.1Å; I167-F538 HydrophobicContact CG2-CB 4.18Å; S535-F538 PolarHBondContact O-N 2.82Å; S535-F538 VanDerWaalsContact O-N 3.1Å; C536-F538 PolarHBondContact O-N 3.07Å
539	A	90.3	Very high	86.6	Confident	14 Å²	14	64.6 Å²	64.6	12%	0.116	35%	0.348	C	S	.	.			trans	-132.3	122.3	176.5	0	0	0	0	0	109.6	I171 L525 C536	I171-A539 HydrophobicContact CD1-CB 3.8Å; L525-A539 HydrophobicContact CD2-CB 4.04Å; C536-A539 PolarHBondContact O-N 3.39Å; C536-A539 VanDerWaalsContact O-O 3.12Å
540	T	86.9	Confident	86.4	Confident	48 Å²	48	66.8 Å²	66.8	29%	0.294	36%	0.355	S	S	.	.			trans	-126.5	148.5	168.6	79.4	0	0	0	0	109	E542 D543 Y544	T540-E542 PolarHBondContact O-N 2.88Å; T540-D543 PolarHBondContact OG1-N 3.26Å; T540-D543 PolarHBondContact OG1-OD1 2.93Å; T540-D543 PolarHBondContact OG1-OD2 2.85Å; T540-Y544 WeakPolarHBondContact O-CD2 3.18Å; T540-Y544 WeakPolarHBondContact O-CE2 3.42Å
541	V	88.8	Confident	86.2	Confident	29 Å²	29	60.3 Å²	60.3	18%	0.176	34%	0.337	C	S	.	.	S	Bend	trans	-66.5	-33.6	176.4	-174.9	0	0	0	0	110.3	A521 T522 L525 D543 Y544 L545	A521-V541 HydrophobicContact CB-CG2 3.87Å; T522-V541 WeakPolarHBondContact OG1-CG2 3.48Å; L525-V541 HydrophobicContact CD1-CG2 3.84Å; V541-D543 VanDerWaalsContact C-N 3.31Å; V541-D543 PolarHBondContact O-N 3.03Å; V541-Y544 PolarHBondContact O-N 3.35Å; V541-Y544 VanDerWaalsContact O-N 3.11Å; V541-L545 HydrophobicContact CG1-CD1 4.05Å; V541-L545 HydrophobicContact CG1-CG 4.38Å; V541-L545 WeakPolarHBondContact O-CG 3.4Å
542	E	87.1	Confident	85.8	Confident	123 Å²	123	58.2 Å²	58.2	58%	0.575	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-60.3	-35.8	-179.4	-69.7	167.9	-165.9	0	0	113	T540 Y544 L545	T540-E542 PolarHBondContact O-N 2.88Å; E542-Y544 PolarHBondContact O-N 2.74Å; E542-L545 PolarHBondContact O-N 3.28Å
543	D	83.4	Confident	85.6	Confident	68 Å²	68	60 Å²	60	36%	0.364	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-61.2	-12.3	177.1	-62.5	-35.5	0	0	0	113.4	T540 V541 H546	T540-D543 PolarHBondContact OG1-N 3.26Å; T540-D543 PolarHBondContact OG1-OD1 2.93Å; T540-D543 PolarHBondContact OG1-OD2 2.85Å; V541-D543 VanDerWaalsContact C-N 3.31Å; V541-D543 PolarHBondContact O-N 3.03Å; D543-H546 PolarHBondContact O-CD2 2.77Å; D543-H546 PolarHBondContact O-NE2 3.12Å
544	Y	77.8	Confident	85.3	Confident	96 Å²	96	60.1 Å²	60.1	38%	0.376	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-112.4	1.5	-179.6	-59.4	-98.9	0	0	0	113.3	Q168 I171 T540 V541 E542	Q168-Y544 VanDerWaalsContact NE2-CZ 3.31Å; Q168-Y544 PolarHBondContact NE2-OH 3.39Å; Q168-Y544 PolarHBondContact OE1-OH 3.08Å; I171-Y544 VanDerWaalsContact CD1-OH 3.25Å; I171-Y544 WeakPolarHBondContact CD1-OH 3.35Å; I171-Y544 HydrophobicContact CG2-CE1 4.24Å; I171-Y544 WeakPolarHBondContact CG2-OH 3.41Å; T540-Y544 WeakPolarHBondContact O-CD2 3.18Å; T540-Y544 WeakPolarHBondContact O-CE2 3.42Å; V541-Y544 PolarHBondContact O-N 3.35Å; V541-Y544 VanDerWaalsContact O-N 3.11Å; E542-Y544 PolarHBondContact O-N 2.74Å
545	L	75.2	Confident	84.9	Confident	94 Å²	94	64.9 Å²	64.9	49%	0.492	34%	0.336	S	S	.	.			trans	-107.6	29.5	-174.8	-63.3	172.6	0	0	0	113.4	M518 V541 E542	M518-L545 HydrophobicContact CE-CD1 3.28Å; M518-L545 HydrophobicContact CE-CD2 3.46Å; M518-L545 VanDerWaalsContact CE-CD2 3.46Å; M518-L545 HydrophobicContact CE-CG 3.99Å; M518-L545 HydrophobicContact SD-CD2 4.13Å; V541-L545 HydrophobicContact CG1-CD1 4.05Å; V541-L545 HydrophobicContact CG1-CG 4.38Å; V541-L545 WeakPolarHBondContact O-CG 3.4Å; E542-L545 PolarHBondContact O-N 3.28Å
546	H	59.1	Low	84.2	Confident	230 Å²	230	68.1 Å²	68.1	100%	1.065	35%	0.347	S	S	*	.			trans	-57.6	0	-178.1	-71.3	-57.2	0	0	0	114.6	D543	D543-H546 PolarHBondContact O-CD2 2.77Å; D543-H546 PolarHBondContact O-NE2 3.12Å

Retrieved 546 of 546 residues in 97.9 ms (Link to these results)

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