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Pituitary adenylate cyclase-activating polypeptide type I receptor

G protein-coupled receptor activated by the neuropeptide pituitary adenylate cyclase-activating polypeptide (ADCYAP1/PACAP)^1,2,3,4. Binds both PACAP27 and PACAP38 bioactive peptides^5,6,7. Ligand binding causes a conformation change that triggers signaling via guanine nucleotide-binding proteins (G proteins) and modulates the activity of downstream effectors. Activates cAMP-dependent pathway^8,9,10,11. May regulate the release of adrenocorticotropin, luteinizing hormone, growth hormone, prolactin, epinephrine, and catecholamine. May play a role in spermatogenesis and sperm motility. Causes smooth muscle relaxation and secretion in the gastrointestinal tract^12,13.

AlphaFold DB , UniProt , Accession P41586, Species HUMAN (Homo sapiens, Human), Gene ADCYAP1R1, Length 468 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	49.6	Very low	106 Å²	106	62.6 Å²	62.6	52%	0.522	40%	0.402	S	S	.	.				0	-81.1	0	-49.5	-146.9	-52.5	0	0	109.3	G3 V4 V5 M190	M1-G3 VanDerWaalsContact C-N 3.35Å; M1-G3 PolarHBondContact O-N 3.03Å; M1-G3 VanDerWaalsContact O-N 3.1Å; M1-V4 PolarHBondContact O-N 2.95Å; M1-V5 PolarHBondContact O-N 2.85Å; M1-M190 HydrophobicContact CE-CE 4.03Å
2	A	38.1	Very low	50	Low	65 Å²	65	58.8 Å²	58.8	54%	0.537	38%	0.376	S	S	.	.	H	α-helix	trans	-41.9	-51.7	-178.6	0	0	0	0	0	115.2	V4 V5 H6	A2-V4 VanDerWaalsContact C-N 3.3Å; A2-V4 PolarHBondContact O-N 3.29Å; A2-V5 PolarHBondContact O-N 3.05Å; A2-H6 PolarHBondContact O-CD2 3.17Å; A2-H6 PolarHBondContact O-N 3.13Å
3	G	39.6	Very low	50.3	Low	49 Å²	49	64.5 Å²	64.5	51%	0.505	40%	0.401	S	S	.	.	H	α-helix	trans	-58.6	-31.5	-178.9	0	0	0	0	0	115.8	M1 V7	M1-G3 VanDerWaalsContact C-N 3.35Å; M1-G3 PolarHBondContact O-N 3.03Å; M1-G3 VanDerWaalsContact O-N 3.1Å; G3-V7 WeakPolarHBondContact O-CB 3.21Å; G3-V7 WeakPolarHBondContact O-CG2 3.39Å; G3-V7 PolarHBondContact O-N 3.29Å; G3-V7 VanDerWaalsContact O-N 3.08Å
4	V	51.1	Low	50.3	Low	58 Å²	58	70.3 Å²	70.3	35%	0.352	43%	0.426	S	S	.	.	H	α-helix	trans	-74	-45.9	177.7	179.9	0	0	0	0	110.1	M1 A2 H6 V7 S8 W274	M1-V4 PolarHBondContact O-N 2.95Å; A2-V4 VanDerWaalsContact C-N 3.3Å; A2-V4 PolarHBondContact O-N 3.29Å; V4-H6 PolarHBondContact O-N 3.34Å; V4-V7 PolarHBondContact O-N 3.47Å; V4-S8 PolarHBondContact O-N 3.11Å; V4-W274 HydrophobicContact CG1-CB 4.43Å
5	V	51.5	Low	50.4	Low	25 Å²	25	68.7 Å²	68.7	15%	0.152	41%	0.414	C	S	.	.	H	α-helix	trans	-62.6	-42.6	178.2	179.2	0	0	0	0	110.9	M1 A2 L9 W274	M1-V5 PolarHBondContact O-N 2.85Å; A2-V5 PolarHBondContact O-N 3.05Å; V5-L9 HydrophobicContact CG1-CD1 3.87Å; V5-L9 WeakPolarHBondContact O-CB 3.4Å; V5-L9 VanDerWaalsContact O-CG 3.31Å; V5-L9 WeakPolarHBondContact O-CG 3.41Å; V5-L9 PolarHBondContact O-N 3.4Å; V5-W274 HydrophobicContact CG2-CZ2 4.41Å
6	H	51.2	Low	49.9	Very low	131 Å²	131	72.1 Å²	72.1	61%	0.606	44%	0.438	S	S	*	.	H	α-helix	trans	-66.3	-36.9	175.4	-75.3	-61.8	0	0	0	113.2	A2 V4 A10	A2-H6 PolarHBondContact O-CD2 3.17Å; A2-H6 PolarHBondContact O-N 3.13Å; V4-H6 PolarHBondContact O-N 3.34Å; H6-A10 WeakPolarHBondContact O-CB 3.5Å; H6-A10 PolarHBondContact O-N 3.29Å
7	V	52.6	Low	49.9	Very low	102 Å²	102	69.4 Å²	69.4	62%	0.618	42%	0.42	S	S	*	.	H	α-helix	trans	-69.7	-44.1	177.9	167	0	0	0	0	111.6	G3 V4 L9 A10 A11	G3-V7 WeakPolarHBondContact O-CB 3.21Å; G3-V7 WeakPolarHBondContact O-CG2 3.39Å; G3-V7 PolarHBondContact O-N 3.29Å; G3-V7 VanDerWaalsContact O-N 3.08Å; V4-V7 PolarHBondContact O-N 3.47Å; V7-L9 PolarHBondContact O-N 3.15Å; V7-A10 PolarHBondContact O-N 3.28Å; V7-A11 WeakPolarHBondContact O-CB 3.45Å; V7-A11 PolarHBondContact O-N 3.29Å
8	S	53.1	Low	49.6	Very low	15 Å²	15	68.1 Å²	68.1	11%	0.105	42%	0.417	C	S	.	.	H	α-helix	trans	-60.6	-45.1	174.3	-77	0	0	0	0	112.1	V4 A11 L12 T278	V4-S8 PolarHBondContact O-N 3.11Å; S8-A11 PolarHBondContact O-N 3.23Å; S8-L12 WeakPolarHBondContact O-CG 3.48Å; S8-L12 PolarHBondContact O-N 3.21Å; S8-L12 VanDerWaalsContact O-N 3.11Å; S8-T278 PolarHBondContact OG-OG1 3.14Å
9	L	55.7	Low	49.3	Very low	38 Å²	38	69.9 Å²	69.9	20%	0.199	43%	0.431	C	S	.	.	H	α-helix	trans	-68.4	-40.6	179.1	-70.1	171.5	0	0	0	112.5	V5 V7 A11 L12 L13 F232 Y235	V5-L9 HydrophobicContact CG1-CD1 3.87Å; V5-L9 WeakPolarHBondContact O-CB 3.4Å; V5-L9 VanDerWaalsContact O-CG 3.31Å; V5-L9 WeakPolarHBondContact O-CG 3.41Å; V5-L9 PolarHBondContact O-N 3.4Å; V7-L9 PolarHBondContact O-N 3.15Å; L9-A11 VanDerWaalsContact C-N 3.33Å; L9-A11 PolarHBondContact O-N 3.19Å; L9-L12 PolarHBondContact O-N 3.45Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 VanDerWaalsContact O-CG 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 3.26Å; L9-F232 HydrophobicContact CD2-CD2 3.64Å; L9-F232 HydrophobicContact CD2-CE2 3.67Å; L9-Y235 HydrophobicContact CD2-CD1 4.12Å; L9-Y235 HydrophobicContact CD2-CE1 4.05Å
10	A	53.7	Low	49.1	Very low	49 Å²	49	67.9 Å²	67.9	41%	0.405	42%	0.422	S	S	.	.	H	α-helix	trans	-65.9	-35.4	176	0	0	0	0	0	112.3	H6 V7 L13 L14	H6-A10 WeakPolarHBondContact O-CB 3.5Å; H6-A10 PolarHBondContact O-N 3.29Å; V7-A10 PolarHBondContact O-N 3.28Å; A10-L13 PolarHBondContact O-N 2.97Å; A10-L14 WeakPolarHBondContact O-CD1 3.37Å; A10-L14 VanDerWaalsContact O-CG 3.27Å; A10-L14 WeakPolarHBondContact O-CG 3.43Å; A10-L14 PolarHBondContact O-N 3.4Å
11	A	51.8	Low	48.9	Very low	51 Å²	51	68.5 Å²	68.5	42%	0.421	42%	0.42	S	S	.	.	H	α-helix	trans	-66.6	-41.1	175.2	0	0	0	0	0	112.2	V7 S8 L9 L13 L14	V7-A11 WeakPolarHBondContact O-CB 3.45Å; V7-A11 PolarHBondContact O-N 3.29Å; S8-A11 PolarHBondContact O-N 3.23Å; L9-A11 VanDerWaalsContact C-N 3.33Å; L9-A11 PolarHBondContact O-N 3.19Å; A11-L13 VanDerWaalsContact C-N 3.34Å; A11-L14 PolarHBondContact O-N 3.25Å
12	L	54.2	Low	48.8	Very low	16 Å²	16	65.2 Å²	65.2	8%	0.084	40%	0.404	C	S	.	.	H	α-helix	trans	-64.6	-37.1	174.8	-75.5	160.5	0	0	0	112.2	S8 L9 L14 V231 Y235 V281 T282	S8-L12 WeakPolarHBondContact O-CG 3.48Å; S8-L12 PolarHBondContact O-N 3.21Å; S8-L12 VanDerWaalsContact O-N 3.11Å; L9-L12 PolarHBondContact O-N 3.45Å; L12-L14 PolarHBondContact O-N 3.01Å; L12-V231 HydrophobicContact CD2-CG1 3.82Å; L12-Y235 HydrophobicContact CD1-CD1 4.3Å; L12-Y235 HydrophobicContact CD1-CD2 3.93Å; L12-Y235 HydrophobicContact CD1-CE2 4.4Å; L12-Y235 HydrophobicContact CD1-CG 3.86Å; L12-V281 HydrophobicContact CD2-CG1 4.33Å; L12-T282 HydrophobicContact CD2-CG2 3.63Å
13	L	54.7	Low	49.2	Very low	134 Å²	134	64 Å²	64	70%	0.702	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-5	176.8	-71.7	168	0	0	0	114.7	L9 A10 A11	L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 VanDerWaalsContact O-CG 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 3.26Å; A10-L13 PolarHBondContact O-N 2.97Å; A11-L13 VanDerWaalsContact C-N 3.34Å
14	L	50	Low	49.7	Very low	145 Å²	145	67.1 Å²	67.1	76%	0.759	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	4.1	179.7	-75.4	169.2	0	0	0	113.8	A10 A11 L12	A10-L14 WeakPolarHBondContact O-CD1 3.37Å; A10-L14 VanDerWaalsContact O-CG 3.27Å; A10-L14 WeakPolarHBondContact O-CG 3.43Å; A10-L14 PolarHBondContact O-N 3.4Å; A11-L14 PolarHBondContact O-N 3.25Å; L12-L14 PolarHBondContact O-N 3.01Å
15	L	51	Low	50.1	Low	46 Å²	46	64.5 Å²	64.5	24%	0.241	38%	0.381	C	S	.	.	S	Bend	trans	-71.6	124.9	171	-76.5	165.8	0	0	0	110.2	M17 T282 T286	L15-M17 HydrophobicContact CB-CG 4.05Å; L15-M17 HydrophobicContact CB-SD 4.39Å; L15-M17 VanDerWaalsContact O-CG 3.31Å; L15-M17 WeakPolarHBondContact O-CG 3.33Å; L15-M17 PolarHBondContact O-N 3.07Å; L15-T282 HydrophobicContact CD1-CG2 4.46Å; L15-T286 HydrophobicContact CD2-CG2 4.27Å
16	P	43	Very low	50.6	Low	123 Å²	123	65.5 Å²	65.5	80%	0.799	39%	0.385	S	S	*	.			trans	-76.1	94	177.6	30.6	-33.3	0	0	0	109.9
17	M	49.6	Very low	51.3	Low	26 Å²	26	62.3 Å²	62.3	13%	0.128	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-96.3	137.1	-174.5	-48.7	-140	-58.4	0	0	111.7	L15 V224 K227 A228 V231 L289 W297	L15-M17 HydrophobicContact CB-CG 4.05Å; L15-M17 HydrophobicContact CB-SD 4.39Å; L15-M17 VanDerWaalsContact O-CG 3.31Å; L15-M17 WeakPolarHBondContact O-CG 3.33Å; L15-M17 PolarHBondContact O-N 3.07Å; M17-V224 HydrophobicContact CB-CG1 4.35Å; M17-V224 WeakPolarHBondContact O-CG2 3.37Å; M17-K227 HydrophobicContact CE-CB 3.6Å; M17-A228 HydrophobicContact CE-CB 4.3Å; M17-V231 HydrophobicContact CE-CG2 4.2Å; M17-V231 HydrophobicContact SD-CG2 4.49Å; M17-L289 HydrophobicContact CB-CD2 4.04Å; M17-L289 HydrophobicContact CG-CD1 4.15Å; M17-L289 HydrophobicContact CG-CD2 4.42Å; M17-L289 HydrophobicContact SD-CD1 4.08Å; M17-W297 HydrophobicContact CE-CH2 4.02Å; M17-W297 HydrophobicContact CE-CZ3 4.2Å; M17-W297 HydrophobicContact SD-CH2 3.55Å; M17-W297 VanDerWaalsContact SD-CH2 3.55Å; M17-W297 HydrophobicContact SD-CZ3 4.04Å
18	A	44.2	Very low	52	Low	46 Å²	46	64.5 Å²	64.5	38%	0.38	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-90.8	157.9	-175	0	0	0	0	0	113.2	K227	A18-K227 PolarHBondContact O-NZ 3.44Å
19	P	43.8	Very low	52.9	Low	103 Å²	103	68 Å²	68	67%	0.669	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-92.9	158.7	-176.9	36	-36.1	0	0	0	115.3
20	A	45.4	Very low	53.8	Low	30 Å²	30	68.8 Å²	68.8	25%	0.248	39%	0.386	C	S	.	.			trans	-134.2	-172.2	167.5	0	0	0	0	0	108.7	S222	A20-S222 VanDerWaalsContact CA-CB 3.47Å; A20-S222 WeakPolarHBondContact CB-OG 3.46Å; A20-S222 PolarHBondContact N-O 2.82Å; A20-S222 WeakPolarHBondContact O-CB 3.33Å
21	M	45.2	Very low	55.2	Low	80 Å²	80	70 Å²	70	39%	0.394	38%	0.384	S	S	.	.			cis	88.7	71.5	9.6	-40	-86.7	55.5	0	0	118	C25 K29 S222	M21-C25 HydrophobicContact CE-CB 4.03Å; M21-K29 HydrophobicContact CE-CB 4.25Å; M21-K29 HydrophobicContact CE-CD 4.19Å; M21-K29 HydrophobicContact CE-CG 4.28Å; M21-K29 HydrophobicContact SD-CD 3.41Å; M21-K29 WeakPolarHBondContact SD-CD 3.15Å; M21-K29 WeakPolarHBondContact SD-CE 3.21Å; M21-K29 HydrophobicContact SD-CG 3.96Å; M21-K29 PolarHBondContact SD-NZ 3.35Å; M21-K29 VanDerWaalsContact SD-NZ 3.38Å; M21-S222 PolarHBondContact O-OG 2.89Å
22	H	45.8	Very low	56.7	Low	38 Å²	38	70.3 Å²	70.3	18%	0.176	39%	0.386	C	S	.	.			trans	-70.3	167.9	163.5	-176.5	-134.4	0	0	0	113	D24 C25 I26 I221	H22-D24 IonicContact CE1-OD2 2.83Å; H22-D24 PolarHBondContact CE1-OD2 2.99Å; H22-D24 VanDerWaalsContact CE1-OD2 3.23Å; H22-D24 IonicContact ND1-OD2 3.02Å; H22-C25 HydrophobicContact CB-CB 4.22Å; H22-C25 VanDerWaalsContact O-CB 3.31Å; H22-C25 WeakPolarHBondContact O-CB 3.26Å; H22-C25 PolarHBondContact O-N 3.46Å; H22-I26 PolarHBondContact O-N 3.45Å; H22-I221 HydrophobicContact CB-CB 3.95Å; H22-I221 HydrophobicContact CB-CG2 3.68Å; H22-I221 WeakPolarHBondContact CD2-CG2 3.27Å
23	S	46.1	Very low	58	Low	40 Å²	40	73 Å²	73	28%	0.28	40%	0.399	S	S	.	.	S	Bend	trans	-60.9	-52.1	176.3	49.4	0	0	0	0	113.5	C25 I26	S23-C25 PolarHBondContact O-N 3.44Å; S23-I26 WeakPolarHBondContact O-CA 3.46Å; S23-I26 WeakPolarHBondContact O-CB 3.35Å; S23-I26 VanDerWaalsContact O-CG1 3.32Å; S23-I26 WeakPolarHBondContact O-CG1 3.24Å; S23-I26 PolarHBondContact O-N 3.32Å
24	D	50.9	Low	59.5	Low	113 Å²	113	66.7 Å²	66.7	60%	0.604	37%	0.366	S	S	*	.	H	α-helix	trans	-66.3	-23	177.4	-61.9	-51.4	0	0	0	112.5	H22 I26	H22-D24 IonicContact CE1-OD2 2.83Å; H22-D24 PolarHBondContact CE1-OD2 2.99Å; H22-D24 VanDerWaalsContact CE1-OD2 3.23Å; H22-D24 IonicContact ND1-OD2 3.02Å; D24-I26 PolarHBondContact O-N 2.85Å
25	C	59.5	Low	61.3	Low	4 Å²	4	64.1 Å²	64.1	3%	0.027	35%	0.353	C	S	.	.	H	α-helix	trans	-71.6	-17.1	169.8	-62.4	0	0	0	0	112.8	M21 H22 S23 K28 K29 C219	M21-C25 HydrophobicContact CE-CB 4.03Å; H22-C25 HydrophobicContact CB-CB 4.22Å; H22-C25 VanDerWaalsContact O-CB 3.31Å; H22-C25 WeakPolarHBondContact O-CB 3.26Å; H22-C25 PolarHBondContact O-N 3.46Å; S23-C25 PolarHBondContact O-N 3.44Å; C25-K28 PolarHBondContact O-N 3.43Å; C25-K29 WeakPolarHBondContact O-CB 3.48Å; C25-K29 PolarHBondContact O-N 2.96Å; C25-C219 HydrophobicContact CB-CB 4.5Å; C25-C219 WeakPolarHBondContact CB-SG 3.49Å; C25-C219 VanDerWaalsContact SG-C 3.51Å; C25-C219 WeakPolarHBondContact SG-CA 3.17Å; C25-C219 WeakPolarHBondContact SG-CB 3.35Å; C25-C219 CovalentContact SG-SG 2.03Å; C25-C219 PolarHBondContact SG-SG 3.11Å
26	I	61.1	Low	63	Low	46 Å²	46	66.1 Å²	66.1	24%	0.236	36%	0.361	C	S	.	.	H	α-helix	trans	-61.5	-55.6	175.4	-61.8	173.9	0	0	0	108.8	H22 S23 D24 K28 K29 E30 L80	H22-I26 PolarHBondContact O-N 3.45Å; S23-I26 WeakPolarHBondContact O-CA 3.46Å; S23-I26 WeakPolarHBondContact O-CB 3.35Å; S23-I26 VanDerWaalsContact O-CG1 3.32Å; S23-I26 WeakPolarHBondContact O-CG1 3.24Å; S23-I26 PolarHBondContact O-N 3.32Å; D24-I26 PolarHBondContact O-N 2.85Å; I26-K28 VanDerWaalsContact C-N 3.28Å; I26-K28 PolarHBondContact O-N 3.36Å; I26-K29 CarbonylContact O-C 3.54Å; I26-K29 WeakPolarHBondContact O-CB 3.25Å; I26-K29 PolarHBondContact O-N 2.88Å; I26-E30 VanDerWaalsContact CG2-CD 3.41Å; I26-E30 HydrophobicContact CG2-CG 3.86Å; I26-E30 WeakPolarHBondContact O-CB 3.39Å; I26-E30 WeakPolarHBondContact O-CG 3.46Å; I26-E30 PolarHBondContact O-N 3.39Å; I26-L80 HydrophobicContact CD1-CD1 4.34Å
27	F	65.3	Low	65.1	Low	64 Å²	64	66.6 Å²	66.6	28%	0.281	35%	0.351	S	S	.	.	H	α-helix	trans	-52	-45.3	178	-74.9	-58.8	0	0	0	112.8	E30 Q31 W58 L80	F27-E30 PolarHBondContact O-N 3.08Å; F27-Q31 VanDerWaalsContact O-CB 3.25Å; F27-Q31 WeakPolarHBondContact O-CB 3.35Å; F27-Q31 PolarHBondContact O-N 2.93Å; F27-W58 HydrophobicContact CD1-CZ2 4.43Å; F27-L80 HydrophobicContact CD2-CD2 4.15Å; F27-L80 HydrophobicContact CE1-CD2 4.32Å; F27-L80 HydrophobicContact CE2-CD2 3.26Å; F27-L80 HydrophobicContact CZ-CD2 3.37Å
28	K	68.8	Low	66.8	Low	147 Å²	147	66 Å²	66	64%	0.639	35%	0.348	S	S	*	.	H	α-helix	trans	-70.4	-33.4	-180	-166.7	169.7	-173.9	170.6	0	113.1	C25 I26 A32	C25-K28 PolarHBondContact O-N 3.43Å; I26-K28 VanDerWaalsContact C-N 3.28Å; I26-K28 PolarHBondContact O-N 3.36Å; K28-A32 PolarHBondContact O-N 3.1Å; K28-A32 VanDerWaalsContact O-N 3.17Å
29	K	70.6	Confident	68.7	Low	89 Å²	89	70 Å²	70	39%	0.387	36%	0.358	S	S	.	.	H	α-helix	trans	-71.5	-43.8	174	-172.3	-154.4	-168	167.7	0	111	M21 C25 I26 A32 M33	M21-K29 HydrophobicContact CE-CB 4.25Å; M21-K29 HydrophobicContact CE-CD 4.19Å; M21-K29 HydrophobicContact CE-CG 4.28Å; M21-K29 HydrophobicContact SD-CD 3.41Å; M21-K29 WeakPolarHBondContact SD-CD 3.15Å; M21-K29 WeakPolarHBondContact SD-CE 3.21Å; M21-K29 HydrophobicContact SD-CG 3.96Å; M21-K29 PolarHBondContact SD-NZ 3.35Å; M21-K29 VanDerWaalsContact SD-NZ 3.38Å; C25-K29 WeakPolarHBondContact O-CB 3.48Å; C25-K29 PolarHBondContact O-N 2.96Å; I26-K29 CarbonylContact O-C 3.54Å; I26-K29 WeakPolarHBondContact O-CB 3.25Å; I26-K29 PolarHBondContact O-N 2.88Å; K29-A32 PolarHBondContact O-N 2.87Å; K29-M33 HydrophobicContact CD-CE 3.82Å; K29-M33 HydrophobicContact CD-SD 4.21Å; K29-M33 HydrophobicContact CG-CE 3.9Å; K29-M33 HydrophobicContact CG-CG 4.47Å; K29-M33 HydrophobicContact CG-SD 4.17Å; K29-M33 WeakPolarHBondContact O-CB 3.47Å; K29-M33 VanDerWaalsContact O-CG 3.28Å; K29-M33 WeakPolarHBondContact O-CG 3.48Å; K29-M33 PolarHBondContact O-N 3.49Å
30	E	75.8	Confident	70.6	Confident	54 Å²	54	71.5 Å²	71.5	25%	0.252	35%	0.351	S	S	.	.	H	α-helix	trans	-66.8	-40.3	178.4	-72.2	-173.4	157.8	0	0	111.3	I26 F27 A32 M33 C34 W58	I26-E30 VanDerWaalsContact CG2-CD 3.41Å; I26-E30 HydrophobicContact CG2-CG 3.86Å; I26-E30 WeakPolarHBondContact O-CB 3.39Å; I26-E30 WeakPolarHBondContact O-CG 3.46Å; I26-E30 PolarHBondContact O-N 3.39Å; F27-E30 PolarHBondContact O-N 3.08Å; E30-A32 PolarHBondContact O-N 2.65Å; E30-M33 HydrophobicContact CB-CE 4.41Å; E30-M33 HydrophobicContact CG-CE 3.79Å; E30-M33 PolarHBondContact O-N 2.81Å; E30-C34 WeakPolarHBondContact O-CA 3.38Å; E30-C34 WeakPolarHBondContact O-CB 3.49Å; E30-C34 PolarHBondContact O-N 3.5Å; E30-W58 HydrophobicContact CB-CH2 3.71Å; E30-W58 HydrophobicContact CB-CZ3 4.01Å
31	Q	82.1	Confident	72.3	Confident	75 Å²	75	70.9 Å²	70.9	35%	0.35	35%	0.346	S	S	.	.	H	α-helix	trans	-55.8	-47.7	167.8	-176	178.2	50.4	0	0	111.7	F27 C34 L35 W58	F27-Q31 VanDerWaalsContact O-CB 3.25Å; F27-Q31 WeakPolarHBondContact O-CB 3.35Å; F27-Q31 PolarHBondContact O-N 2.93Å; Q31-C34 WeakPolarHBondContact O-CB 3.34Å; Q31-C34 PolarHBondContact O-N 2.87Å; Q31-L35 HydrophobicContact CG-CD1 4.24Å; Q31-L35 VanDerWaalsContact O-CG 3.3Å; Q31-L35 WeakPolarHBondContact O-CG 3.23Å; Q31-L35 PolarHBondContact O-N 3.26Å; Q31-W58 HydrophobicContact CB-CD2 4Å; Q31-W58 HydrophobicContact CB-CG 4.36Å; Q31-W58 HydrophobicContact CB-CZ2 4.01Å; Q31-W58 HydrophobicContact CG-CD2 4.16Å; Q31-W58 HydrophobicContact CG-CG 3.98Å
32	A	82.9	Confident	73.8	Confident	58 Å²	58	70.5 Å²	70.5	48%	0.479	35%	0.346	S	S	.	.	H	α-helix	trans	-64.7	-47.8	178.9	0	0	0	0	0	112.5	K28 K29 E30 C34 L35 E36	K28-A32 PolarHBondContact O-N 3.1Å; K28-A32 VanDerWaalsContact O-N 3.17Å; K29-A32 PolarHBondContact O-N 2.87Å; E30-A32 PolarHBondContact O-N 2.65Å; A32-C34 PolarHBondContact O-N 3.31Å; A32-L35 PolarHBondContact O-N 2.82Å; A32-E36 PolarHBondContact O-N 3.21Å; A32-E36 VanDerWaalsContact O-N 3.09Å
33	M	83	Confident	75.1	Confident	72 Å²	72	76.3 Å²	76.3	36%	0.355	37%	0.373	S	S	.	.	H	α-helix	trans	-63.1	-30.6	174.9	-67.8	-176.5	-55.6	0	0	111.9	K29 E30 K37	K29-M33 HydrophobicContact CD-CE 3.82Å; K29-M33 HydrophobicContact CD-SD 4.21Å; K29-M33 HydrophobicContact CG-CE 3.9Å; K29-M33 HydrophobicContact CG-CG 4.47Å; K29-M33 HydrophobicContact CG-SD 4.17Å; K29-M33 WeakPolarHBondContact O-CB 3.47Å; K29-M33 VanDerWaalsContact O-CG 3.28Å; K29-M33 WeakPolarHBondContact O-CG 3.48Å; K29-M33 PolarHBondContact O-N 3.49Å; E30-M33 HydrophobicContact CB-CE 4.41Å; E30-M33 HydrophobicContact CG-CE 3.79Å; E30-M33 PolarHBondContact O-N 2.81Å; M33-K37 WeakPolarHBondContact O-CB 3.37Å; M33-K37 VanDerWaalsContact O-CG 3.24Å; M33-K37 WeakPolarHBondContact O-CG 3.27Å; M33-K37 PolarHBondContact O-N 2.91Å
34	C	86.5	Confident	76.4	Confident	1 Å²	1	81.5 Å²	81.5	1%	0.007	40%	0.397	C	S	.	.	H	α-helix	trans	-69.1	-49.5	175.7	-178.5	0	0	0	0	111.3	E30 Q31 A32 E36 K37 I38 W58 C63	E30-C34 WeakPolarHBondContact O-CA 3.38Å; E30-C34 WeakPolarHBondContact O-CB 3.49Å; E30-C34 PolarHBondContact O-N 3.5Å; Q31-C34 WeakPolarHBondContact O-CB 3.34Å; Q31-C34 PolarHBondContact O-N 2.87Å; A32-C34 PolarHBondContact O-N 3.31Å; C34-E36 VanDerWaalsContact C-N 3.25Å; C34-E36 PolarHBondContact O-N 3.11Å; C34-K37 CarbonylContact O-C 3.51Å; C34-K37 WeakPolarHBondContact O-CA 3.44Å; C34-K37 WeakPolarHBondContact O-CB 3.44Å; C34-K37 PolarHBondContact O-N 3.49Å; C34-I38 VanDerWaalsContact O-CG1 3.3Å; C34-I38 WeakPolarHBondContact O-CG1 3.36Å; C34-I38 PolarHBondContact O-N 2.98Å; C34-I38 WeakPolarHBondContact SG-CD1 3.4Å; C34-W58 HydrophobicContact CB-CE3 3.73Å; C34-W58 HydrophobicContact CB-CZ3 4.29Å; C34-C63 WeakPolarHBondContact CA-SG 3.3Å; C34-C63 HydrophobicContact CB-CB 3.57Å; C34-C63 WeakPolarHBondContact CB-SG 3.5Å; C34-C63 WeakPolarHBondContact SG-CA 3.34Å; C34-C63 WeakPolarHBondContact SG-CB 3.34Å; C34-C63 CovalentContact SG-SG 2.03Å; C34-C63 PolarHBondContact SG-SG 2.82Å
35	L	86.8	Confident	77.1	Confident	91 Å²	91	79.5 Å²	79.5	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-59.6	-38.4	177.3	-68.3	168.1	0	0	0	111.3	Q31 A32 I38 Q39	Q31-L35 HydrophobicContact CG-CD1 4.24Å; Q31-L35 VanDerWaalsContact O-CG 3.3Å; Q31-L35 WeakPolarHBondContact O-CG 3.23Å; Q31-L35 PolarHBondContact O-N 3.26Å; A32-L35 PolarHBondContact O-N 2.82Å; L35-I38 PolarHBondContact O-N 2.85Å; L35-Q39 WeakPolarHBondContact O-CG 3.26Å; L35-Q39 PolarHBondContact O-N 3Å
36	E	86.8	Confident	77.2	Confident	88 Å²	88	81.4 Å²	81.4	41%	0.411	41%	0.405	S	S	.	.	H	α-helix	trans	-65.4	-40.2	173	-163.5	-168.3	149.1	0	0	112.7	A32 C34 R40	A32-E36 PolarHBondContact O-N 3.21Å; A32-E36 VanDerWaalsContact O-N 3.09Å; C34-E36 VanDerWaalsContact C-N 3.25Å; C34-E36 PolarHBondContact O-N 3.11Å; E36-R40 PolarHBondContact O-N 3.15Å; E36-R40 IonicContact OE1-CZ 2.69Å; E36-R40 IonicContact OE1-NH1 3.25Å; E36-R40 PolarHBondContact OE1-NH1 2.93Å; E36-R40 IonicContact OE1-NH2 2.7Å; E36-R40 PolarHBondContact OE1-NH2 3.29Å
37	K	86.1	Confident	77	Confident	134 Å²	134	82.7 Å²	82.7	58%	0.583	41%	0.409	S	S	*	.	H	α-helix	trans	-65.4	-42.3	173.2	-76.7	169.9	-179.7	179.7	0	112.1	M33 C34 R40 A41	M33-K37 WeakPolarHBondContact O-CB 3.37Å; M33-K37 VanDerWaalsContact O-CG 3.24Å; M33-K37 WeakPolarHBondContact O-CG 3.27Å; M33-K37 PolarHBondContact O-N 2.91Å; C34-K37 CarbonylContact O-C 3.51Å; C34-K37 WeakPolarHBondContact O-CA 3.44Å; C34-K37 WeakPolarHBondContact O-CB 3.44Å; C34-K37 PolarHBondContact O-N 3.49Å; K37-R40 PolarHBondContact O-N 2.86Å; K37-A41 WeakPolarHBondContact O-CB 3.17Å; K37-A41 PolarHBondContact O-N 3.06Å
38	I	85.9	Confident	76.5	Confident	13 Å²	13	85.3 Å²	85.3	7%	0.067	43%	0.426	C	S	.	.	H	α-helix	trans	-64.1	-42.7	178.5	-69	162.7	0	0	0	110.4	C34 L35 A41 N42	C34-I38 VanDerWaalsContact O-CG1 3.3Å; C34-I38 WeakPolarHBondContact O-CG1 3.36Å; C34-I38 PolarHBondContact O-N 2.98Å; C34-I38 WeakPolarHBondContact SG-CD1 3.4Å; L35-I38 PolarHBondContact O-N 2.85Å; I38-A41 PolarHBondContact O-N 2.87Å; I38-N42 WeakPolarHBondContact O-CB 3.4Å; I38-N42 VanDerWaalsContact O-CG 3.26Å; I38-N42 PolarHBondContact O-N 3.2Å
39	Q	84.4	Confident	75.8	Confident	129 Å²	129	87 Å²	87	60%	0.603	44%	0.442	S	S	*	.	H	α-helix	trans	-57.1	-51.9	174.6	-76.6	174.2	-8.9	0	0	111.6	L35 A41 N42 E43	L35-Q39 WeakPolarHBondContact O-CG 3.26Å; L35-Q39 PolarHBondContact O-N 3Å; Q39-A41 VanDerWaalsContact C-N 3.32Å; Q39-A41 PolarHBondContact O-N 2.98Å; Q39-N42 PolarHBondContact O-N 3.22Å; Q39-E43 WeakPolarHBondContact O-CG 3.39Å; Q39-E43 PolarHBondContact O-N 3.03Å; Q39-E43 VanDerWaalsContact O-N 3.09Å
40	R	83.3	Confident	75.3	Confident	135 Å²	135	87.6 Å²	87.6	51%	0.509	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-37.4	175.8	-70	-173.6	-179.5	108.2	7.8	113.3	E36 K37 E43 L44	E36-R40 PolarHBondContact O-N 3.15Å; E36-R40 IonicContact OE1-CZ 2.69Å; E36-R40 IonicContact OE1-NH1 3.25Å; E36-R40 PolarHBondContact OE1-NH1 2.93Å; E36-R40 IonicContact OE1-NH2 2.7Å; E36-R40 PolarHBondContact OE1-NH2 3.29Å; K37-R40 PolarHBondContact O-N 2.86Å; R40-E43 PolarHBondContact O-N 3.24Å; R40-L44 WeakPolarHBondContact O-CB 3.31Å; R40-L44 WeakPolarHBondContact O-CG 3.34Å; R40-L44 PolarHBondContact O-N 3.04Å; R40-L44 VanDerWaalsContact O-N 3.07Å
41	A	81.8	Confident	74.5	Confident	18 Å²	18	87.7 Å²	87.7	15%	0.149	46%	0.464	C	S	.	.	H	α-helix	trans	-68.2	-39.5	178.9	0	0	0	0	0	112	K37 I38 Q39 L44 M45 P66	K37-A41 WeakPolarHBondContact O-CB 3.17Å; K37-A41 PolarHBondContact O-N 3.06Å; I38-A41 PolarHBondContact O-N 2.87Å; Q39-A41 VanDerWaalsContact C-N 3.32Å; Q39-A41 PolarHBondContact O-N 2.98Å; A41-L44 PolarHBondContact O-N 3.32Å; A41-M45 WeakPolarHBondContact O-CB 3.26Å; A41-M45 WeakPolarHBondContact O-CG 3.5Å; A41-M45 PolarHBondContact O-N 3.08Å; A41-P66 HydrophobicContact CB-CG 3.78Å
42	N	75.7	Confident	73.9	Confident	72 Å²	72	88.7 Å²	88.7	39%	0.385	48%	0.477	S	S	.	.	H	α-helix	trans	-65.4	-40.7	175.2	-69.6	-11.1	0	0	0	111.7	I38 Q39 L44 G46 P66	I38-N42 WeakPolarHBondContact O-CB 3.4Å; I38-N42 VanDerWaalsContact O-CG 3.26Å; I38-N42 PolarHBondContact O-N 3.2Å; Q39-N42 PolarHBondContact O-N 3.22Å; N42-L44 VanDerWaalsContact C-N 3.31Å; N42-L44 PolarHBondContact O-N 2.92Å; N42-G46 PolarHBondContact O-N 2.87Å; N42-P66 WeakPolarHBondContact OD1-CG 3.48Å
43	E	74.7	Confident	73.9	Confident	159 Å²	159	87.3 Å²	87.3	74%	0.743	47%	0.468	S	S	*	.	H	α-helix	trans	-60.5	-38	172.9	-71	176.1	163.2	0	0	112.4	Q39 R40	Q39-E43 WeakPolarHBondContact O-CG 3.39Å; Q39-E43 PolarHBondContact O-N 3.03Å; Q39-E43 VanDerWaalsContact O-N 3.09Å; R40-E43 PolarHBondContact O-N 3.24Å
44	L	73	Confident	74.1	Confident	150 Å²	150	84 Å²	84	79%	0.785	45%	0.452	S	S	*	.	H	α-helix	trans	-76.7	-37.4	179.8	-81.5	164.5	0	0	0	114	R40 A41 N42	R40-L44 WeakPolarHBondContact O-CB 3.31Å; R40-L44 WeakPolarHBondContact O-CG 3.34Å; R40-L44 PolarHBondContact O-N 3.04Å; R40-L44 VanDerWaalsContact O-N 3.07Å; A41-L44 PolarHBondContact O-N 3.32Å; N42-L44 VanDerWaalsContact C-N 3.31Å; N42-L44 PolarHBondContact O-N 2.92Å
45	M	65.7	Low	74.2	Confident	71 Å²	71	88.2 Å²	88.2	35%	0.35	48%	0.479	S	S	.	.	H	α-helix	trans	-82.4	-19.3	-175.7	-68.4	-176.9	-168.2	0	0	113.6	A41 F47 P66	A41-M45 WeakPolarHBondContact O-CB 3.26Å; A41-M45 WeakPolarHBondContact O-CG 3.5Å; A41-M45 PolarHBondContact O-N 3.08Å; M45-F47 VanDerWaalsContact C-N 3.33Å; M45-F47 HydrophobicContact CB-CD2 3.79Å; M45-F47 HydrophobicContact CB-CE2 3.65Å; M45-F47 HydrophobicContact CG-CE2 4.35Å; M45-F47 PolarHBondContact O-N 3.25Å; M45-F47 HydrophobicContact SD-CE2 3.8Å; M45-F47 HydrophobicContact SD-CZ 4.36Å; M45-P66 HydrophobicContact CE-CB 4.39Å; M45-P66 WeakPolarHBondContact CE-O 3.36Å; M45-P66 HydrophobicContact SD-CB 3.77Å; M45-P66 HydrophobicContact SD-CG 4.27Å
46	G	60.7	Low	74.2	Confident	44 Å²	44	84.5 Å²	84.5	45%	0.454	46%	0.463	S	S	.	.			trans	57.6	42.8	169.4	0	0	0	0	0	113.8	N42 N48	N42-G46 PolarHBondContact O-N 2.87Å; G46-N48 PolarHBondContact O-N 3Å
47	F	56.9	Low	74.4	Confident	73 Å²	73	83.4 Å²	83.4	32%	0.32	46%	0.459	S	S	.	.			trans	-58.8	94.7	-179.8	-81.4	-80.5	0	0	0	111.8	M45 S51 P66	M45-F47 VanDerWaalsContact C-N 3.33Å; M45-F47 HydrophobicContact CB-CD2 3.79Å; M45-F47 HydrophobicContact CB-CE2 3.65Å; M45-F47 HydrophobicContact CG-CE2 4.35Å; M45-F47 PolarHBondContact O-N 3.25Å; M45-F47 HydrophobicContact SD-CE2 3.8Å; M45-F47 HydrophobicContact SD-CZ 4.36Å; F47-S51 WeakPolarHBondContact CD1-O 3.34Å; F47-P66 HydrophobicContact CE2-CB 4.11Å
48	N	55.4	Low	74.5	Confident	118 Å²	118	78.8 Å²	78.8	63%	0.631	44%	0.438	S	S	*	.			trans	-75.9	154.3	158.2	-65.7	-61.4	0	0	0	109.3	G46 S50 S51	G46-N48 PolarHBondContact O-N 3Å; N48-S50 PolarHBondContact O-N 3.46Å; N48-S51 PolarHBondContact O-N 3.39Å
49	D	54.6	Low	74.5	Confident	183 Å²	183	79.4 Å²	79.4	98%	0.979	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-9.7	-178.3	-62	-51	0	0	0	115.4
50	S	58.3	Low	74.4	Confident	101 Å²	101	79 Å²	79	71%	0.706	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-5	177.3	56.3	0	0	0	0	115.1	N48	N48-S50 PolarHBondContact O-N 3.46Å
51	S	60.7	Low	74.3	Confident	56 Å²	56	74.9 Å²	74.9	39%	0.392	43%	0.431	S	S	.	.			trans	-118.7	95.8	-171	-60.5	0	0	0	0	111.6	F47 N48	F47-S51 WeakPolarHBondContact CD1-O 3.34Å; N48-S51 PolarHBondContact O-N 3.39Å
52	P	68.3	Low	74.5	Confident	96 Å²	96	74.4 Å²	74.4	62%	0.623	43%	0.426	S	S	*	.			trans	-66.2	138.8	175.1	28.6	-34.4	0	0	0	111	V69	P52-V69 HydrophobicContact CB-CG2 4.06Å
53	G	82.6	Confident	75.1	Confident	30 Å²	30	72.7 Å²	72.7	31%	0.309	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	165.2	-177.7	0	0	0	0	0	111.1	A67	G53-A67 CarbonylContact C-O 3.49Å; G53-A67 VanDerWaalsContact CA-O 3.31Å; G53-A67 WeakPolarHBondContact CA-O 3.49Å
54	C	88.5	Confident	75.9	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.007	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	128.7	-174.8	-56.3	0	0	0	0	110.1	P66 A67 C118 W123	C54-P66 VanDerWaalsContact O-CA 3.27Å; C54-P66 WeakPolarHBondContact O-CA 3.23Å; C54-A67 PolarHBondContact N-O 2.92Å; C54-A67 PolarHBondContact O-N 3.37Å; C54-A67 VanDerWaalsContact O-N 3.08Å; C54-C118 HydrophobicContact CB-CB 3.87Å; C54-C118 WeakPolarHBondContact CB-SG 3.5Å; C54-C118 PolarHBondContact N-SG 3.34Å; C54-C118 WeakPolarHBondContact SG-CA 3.4Å; C54-C118 WeakPolarHBondContact SG-CB 3.41Å; C54-C118 CovalentContact SG-SG 2.04Å; C54-C118 PolarHBondContact SG-SG 3.14Å; C54-W123 HydrophobicContact CB-CD2 3.83Å; C54-W123 VanDerWaalsContact CB-CE2 3.44Å; C54-W123 HydrophobicContact CB-CE3 4.46Å; C54-W123 HydrophobicContact CB-CG 4.14Å; C54-W123 HydrophobicContact CB-CH2 4.44Å; C54-W123 HydrophobicContact CB-CZ2 3.78Å
55	P	88.1	Confident	76.7	Confident	90 Å²	90	62.3 Å²	62.3	58%	0.584	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-67.5	146.5	179.2	29.1	-34.9	0	0	0	110.5	W123	P55-W123 PolarHBondContact O-NE1 3.37Å
56	G	87.6	Confident	77.7	Confident	13 Å²	13	58.9 Å²	58.9	13%	0.134	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-63.8	136.3	171.9	0	0	0	0	0	110.8	W64	G56-W64 CarbonylContact C-O 3.57Å; G56-W64 WeakPolarHBondContact CA-O 3.49Å
57	M	90.1	Very high	79.1	Confident	65 Å²	65	56.8 Å²	56.8	32%	0.32	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	160.2	-173.2	66.9	174.9	-71.4	0	0	113.1	D59 W64 W123	M57-D59 HydrophobicContact CE-CB 4.01Å; M57-W64 HydrophobicContact CG-CB 3.96Å; M57-W64 HydrophobicContact CG-CG 4.39Å; M57-W64 PolarHBondContact N-O 3.5Å; M57-W64 PolarHBondContact O-N 3.37Å; M57-W123 HydrophobicContact SD-CG 4.14Å
58	W	88	Confident	80.5	Confident	37 Å²	37	58.2 Å²	58.2	14%	0.14	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	120.5	168.2	175.3	-99.2	0	0	0	107.5	F27 E30 Q31 C34 N60 T62 C63	F27-W58 HydrophobicContact CD1-CZ2 4.43Å; E30-W58 HydrophobicContact CB-CH2 3.71Å; E30-W58 HydrophobicContact CB-CZ3 4.01Å; Q31-W58 HydrophobicContact CB-CD2 4Å; Q31-W58 HydrophobicContact CB-CG 4.36Å; Q31-W58 HydrophobicContact CB-CZ2 4.01Å; Q31-W58 HydrophobicContact CG-CD2 4.16Å; Q31-W58 HydrophobicContact CG-CG 3.98Å; C34-W58 HydrophobicContact CB-CE3 3.73Å; C34-W58 HydrophobicContact CB-CZ3 4.29Å; W58-N60 VanDerWaalsContact C-N 3.3Å; W58-N60 PolarHBondContact O-N 2.86Å; W58-T62 VanDerWaalsContact CE3-C 3.48Å; W58-C63 HydrophobicContact CE3-CB 4.17Å; W58-C63 HydrophobicContact CZ3-CB 4.31Å
59	D	86.2	Confident	82.1	Confident	26 Å²	26	55.1 Å²	55.1	14%	0.139	32%	0.32	C	S	.	.			trans	-95.1	21.1	-175.5	71.8	-2.4	0	0	0	113.6	M57 I61 T62 W64 R116 Y130	M57-D59 HydrophobicContact CE-CB 4.01Å; D59-I61 PolarHBondContact O-N 2.68Å; D59-I61 PolarHBondContact OD1-N 3.4Å; D59-T62 PolarHBondContact N-O 2.79Å; D59-T62 PolarHBondContact OD1-N 2.72Å; D59-W64 PolarHBondContact OD2-NE1 2.87Å; D59-R116 IonicContact OD2-NH1 3.45Å; D59-R116 PolarHBondContact OD2-NH1 3.05Å; D59-Y130 PolarHBondContact OD1-OH 3.5Å; D59-Y130 PolarHBondContact OD2-OH 2.88Å
60	N	83.4	Confident	83.8	Confident	122 Å²	122	49.8 Å²	49.8	65%	0.652	31%	0.308	S	S	*	.	S	Bend	trans	74	-11.4	-168.9	-54.1	-48.5	0	0	0	115.8	W58	W58-N60 VanDerWaalsContact C-N 3.3Å; W58-N60 PolarHBondContact O-N 2.86Å
61	I	80.8	Confident	85.3	Confident	48 Å²	48	47.7 Å²	47.7	25%	0.246	29%	0.287	C	S	.	.	S	Bend	trans	-121.2	-45.8	-179.5	-53.3	178.2	0	0	0	111.4	D59 P78 F81 Y130	D59-I61 PolarHBondContact O-N 2.68Å; D59-I61 PolarHBondContact OD1-N 3.4Å; I61-P78 HydrophobicContact CG2-CG 4.18Å; I61-F81 HydrophobicContact CG2-CE2 3.86Å; I61-F81 HydrophobicContact CG2-CZ 4.12Å; I61-Y130 HydrophobicContact CB-CE1 4.32Å; I61-Y130 HydrophobicContact CB-CE2 4.34Å; I61-Y130 HydrophobicContact CD1-CD2 3.65Å; I61-Y130 HydrophobicContact CD1-CE2 3.93Å; I61-Y130 HydrophobicContact CD1-CG 3.97Å; I61-Y130 HydrophobicContact CG2-CD1 3.99Å; I61-Y130 HydrophobicContact CG2-CE1 3.89Å; I61-Y130 HydrophobicContact CG2-CG 4.44Å
62	T	85.7	Confident	86.7	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.043	29%	0.291	C	S	.	.	S	Bend	trans	-134.3	170	-177.5	70.6	0	0	0	0	113.7	W58 D59 W64 V75 P78 Y130	W58-T62 VanDerWaalsContact CE3-C 3.48Å; D59-T62 PolarHBondContact N-O 2.79Å; D59-T62 PolarHBondContact OD1-N 2.72Å; T62-W64 PolarHBondContact OG1-NE1 3.3Å; T62-V75 HydrophobicContact CG2-CG1 4.15Å; T62-P78 HydrophobicContact CG2-CG 3.83Å; T62-Y130 HydrophobicContact CG2-CE1 3.64Å; T62-Y130 PolarHBondContact OG1-OH 3.01Å
63	C	89.2	Confident	87.8	Confident	36 Å²	36	45.5 Å²	45.5	24%	0.243	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	110	-178.9	-169.6	0	0	0	0	112.1	C34 W58	C34-C63 WeakPolarHBondContact CA-SG 3.3Å; C34-C63 HydrophobicContact CB-CB 3.57Å; C34-C63 WeakPolarHBondContact CB-SG 3.5Å; C34-C63 WeakPolarHBondContact SG-CA 3.34Å; C34-C63 WeakPolarHBondContact SG-CB 3.34Å; C34-C63 CovalentContact SG-SG 2.03Å; C34-C63 PolarHBondContact SG-SG 2.82Å; W58-C63 HydrophobicContact CE3-CB 4.17Å; W58-C63 HydrophobicContact CZ3-CB 4.31Å
64	W	90.4	Very high	88.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	115.8	175.3	-61.1	92.6	0	0	0	109.7	G56 M57 D59 T62 V73 V75 V114 R116 W123	G56-W64 CarbonylContact C-O 3.57Å; G56-W64 WeakPolarHBondContact CA-O 3.49Å; M57-W64 HydrophobicContact CG-CB 3.96Å; M57-W64 HydrophobicContact CG-CG 4.39Å; M57-W64 PolarHBondContact N-O 3.5Å; M57-W64 PolarHBondContact O-N 3.37Å; D59-W64 PolarHBondContact OD2-NE1 2.87Å; T62-W64 PolarHBondContact OG1-NE1 3.3Å; W64-V73 HydrophobicContact CE3-CB 4.09Å; W64-V73 HydrophobicContact CE3-CG1 3.82Å; W64-V73 HydrophobicContact CZ3-CB 4.01Å; W64-V73 HydrophobicContact CZ3-CG1 3.86Å; W64-V75 HydrophobicContact CD2-CG2 4.33Å; W64-V75 HydrophobicContact CE3-CG2 3.9Å; W64-V75 HydrophobicContact CH2-CB 4Å; W64-V75 HydrophobicContact CH2-CG2 3.69Å; W64-V75 HydrophobicContact CZ2-CB 4.35Å; W64-V75 HydrophobicContact CZ2-CG2 4.16Å; W64-V75 HydrophobicContact CZ3-CB 4.37Å; W64-V75 HydrophobicContact CZ3-CG2 3.57Å; W64-V114 HydrophobicContact CH2-CG1 4.32Å; W64-V114 HydrophobicContact CZ2-CG1 4.29Å; W64-R116 HydrophobicContact CD2-CG 4.37Å; W64-R116 HydrophobicContact CE3-CB 4.01Å; W64-R116 HydrophobicContact CE3-CG 4.21Å; W64-R116 HydrophobicContact CH2-CB 3.93Å; W64-R116 HydrophobicContact CH2-CG 3.53Å; W64-R116 HydrophobicContact CZ2-CB 4.45Å; W64-R116 HydrophobicContact CZ2-CG 3.67Å; W64-R116 HydrophobicContact CZ3-CB 3.66Å; W64-R116 HydrophobicContact CZ3-CG 3.79Å; W64-W123 HydrophobicContact CB-CZ2 4.17Å; W64-W123 HydrophobicContact CE3-CZ3 4.35Å
65	K	89.2	Confident	88.1	Confident	91 Å²	91	50 Å²	50	40%	0.396	28%	0.282	S	S	.	.			trans	-60.8	152.6	167	57.2	155.6	-169.4	158.9	0	109.9	E71 V73 W123	K65-E71 IonicContact NZ-OE1 2.57Å; K65-E71 PolarHBondContact NZ-OE1 2.87Å; K65-V73 HydrophobicContact CG-CG1 4.08Å; K65-W123 WeakPolarHBondContact O-CH2 3.45Å; K65-W123 WeakPolarHBondContact O-CZ2 3.48Å
66	P	88.4	Confident	88	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.28	C	S	.	.			trans	-59.5	153.9	167.1	-9.4	22.5	0	0	0	110.6	A41 N42 M45 F47 C54	A41-P66 HydrophobicContact CB-CG 3.78Å; N42-P66 WeakPolarHBondContact OD1-CG 3.48Å; M45-P66 HydrophobicContact CE-CB 4.39Å; M45-P66 WeakPolarHBondContact CE-O 3.36Å; M45-P66 HydrophobicContact SD-CB 3.77Å; M45-P66 HydrophobicContact SD-CG 4.27Å; F47-P66 HydrophobicContact CE2-CB 4.11Å; C54-P66 VanDerWaalsContact O-CA 3.27Å; C54-P66 WeakPolarHBondContact O-CA 3.23Å
67	A	88.3	Confident	87.7	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157.3	-173.3	0	0	0	0	0	112.2	G53 C54 E71 V73 C118 W123	G53-A67 CarbonylContact C-O 3.49Å; G53-A67 VanDerWaalsContact CA-O 3.31Å; G53-A67 WeakPolarHBondContact CA-O 3.49Å; C54-A67 PolarHBondContact N-O 2.92Å; C54-A67 PolarHBondContact O-N 3.37Å; C54-A67 VanDerWaalsContact O-N 3.08Å; A67-E71 WeakPolarHBondContact CA-OE2 3.43Å; A67-E71 HydrophobicContact CB-CB 4.27Å; A67-E71 HydrophobicContact CB-CG 4.44Å; A67-E71 WeakPolarHBondContact CB-OE2 3.25Å; A67-V73 HydrophobicContact CB-CG2 3.86Å; A67-C118 HydrophobicContact CB-CB 4.02Å; A67-W123 HydrophobicContact CB-CH2 3.51Å; A67-W123 HydrophobicContact CB-CZ2 4.07Å; A67-W123 HydrophobicContact CB-CZ3 4.25Å
68	H	87.3	Confident	87.1	Confident	103 Å²	103	47.5 Å²	47.5	48%	0.477	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	152.4	174.3	-66.4	-69	0	0	0	111.7	G70 E71 C118	H68-G70 PolarHBondContact O-N 2.96Å; H68-E71 PolarHBondContact N-OE2 3.38Å; H68-E71 WeakPolarHBondContact O-CB 3.4Å; H68-E71 PolarHBondContact O-N 3.27Å; H68-C118 VanDerWaalsContact C-SG 3.59Å; H68-C118 VanDerWaalsContact O-CB 3.31Å; H68-C118 WeakPolarHBondContact O-CB 3.4Å; H68-C118 PolarHBondContact O-SG 3.22Å
69	V	89.6	Confident	86.2	Confident	53 Å²	53	51.1 Å²	51.1	32%	0.321	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	129.6	173.2	174.4	0	0	0	0	110.1	P52 E120	P52-V69 HydrophobicContact CB-CG2 4.06Å; V69-E120 HydrophobicContact CG1-CG 3.7Å
70	G	89.1	Confident	85.2	Confident	71 Å²	71	50.5 Å²	50.5	73%	0.732	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	-5	-174	0	0	0	0	0	114.7	H68 C118	H68-G70 PolarHBondContact O-N 2.96Å; G70-C118 PolarHBondContact N-O 3.25Å
71	E	90	Very high	84.3	Confident	56 Å²	56	45.9 Å²	45.9	26%	0.262	26%	0.259	S	S	.	.			trans	-81.3	129.4	173.7	-170.2	178.6	176.7	0	0	111.3	K65 A67 H68 V73 C118	K65-E71 IonicContact NZ-OE1 2.57Å; K65-E71 PolarHBondContact NZ-OE1 2.87Å; A67-E71 WeakPolarHBondContact CA-OE2 3.43Å; A67-E71 HydrophobicContact CB-CB 4.27Å; A67-E71 HydrophobicContact CB-CG 4.44Å; A67-E71 WeakPolarHBondContact CB-OE2 3.25Å; H68-E71 PolarHBondContact N-OE2 3.38Å; H68-E71 WeakPolarHBondContact O-CB 3.4Å; H68-E71 PolarHBondContact O-N 3.27Å; E71-V73 HydrophobicContact CG-CG2 4.35Å; E71-C118 PolarHBondContact O-N 3.35Å
72	M	90.3	Very high	83.4	Confident	99 Å²	99	50.2 Å²	50.2	49%	0.488	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	126.7	165.7	-178.4	-178.5	-75.4	0	0	109	L74 N117	M72-L74 HydrophobicContact CG-CD1 3.9Å; M72-L74 HydrophobicContact SD-CD1 4.09Å; M72-N117 VanDerWaalsContact CB-OD1 3.29Å; M72-N117 WeakPolarHBondContact CB-OD1 3.29Å; M72-N117 VanDerWaalsContact CE-OD1 3.28Å; M72-N117 WeakPolarHBondContact CE-OD1 3.36Å; M72-N117 WeakPolarHBondContact CG-OD1 3.11Å
73	V	90.6	Very high	81.9	Confident	7 Å²	7	54.2 Å²	54.2	4%	0.042	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.9	173.2	-178.6	0	0	0	0	108.9	W64 K65 A67 E71 V75 S115 R116 W123	W64-V73 HydrophobicContact CE3-CB 4.09Å; W64-V73 HydrophobicContact CE3-CG1 3.82Å; W64-V73 HydrophobicContact CZ3-CB 4.01Å; W64-V73 HydrophobicContact CZ3-CG1 3.86Å; K65-V73 HydrophobicContact CG-CG1 4.08Å; A67-V73 HydrophobicContact CB-CG2 3.86Å; E71-V73 HydrophobicContact CG-CG2 4.35Å; V73-V75 HydrophobicContact CG1-CG2 4.28Å; V73-S115 CarbonylContact O-C 3.44Å; V73-S115 VanDerWaalsContact O-CA 3.29Å; V73-S115 WeakPolarHBondContact O-CA 3.38Å; V73-R116 PolarHBondContact N-O 3.28Å; V73-R116 PolarHBondContact O-N 3.41Å; V73-W123 HydrophobicContact CB-CH2 4.24Å; V73-W123 HydrophobicContact CB-CZ3 4.17Å; V73-W123 HydrophobicContact CG2-CH2 3.78Å; V73-W123 HydrophobicContact CG2-CZ3 3.99Å
74	L	90.3	Very high	80.3	Confident	93 Å²	93	58.7 Å²	58.7	49%	0.487	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.1	177.5	-64.5	90.5	0	0	0	109.2	M72 L108 V113 V114	M72-L74 HydrophobicContact CG-CD1 3.9Å; M72-L74 HydrophobicContact SD-CD1 4.09Å; L74-L108 HydrophobicContact CD2-CD1 4.05Å; L74-L108 HydrophobicContact CD2-CD2 4.43Å; L74-V113 HydrophobicContact CB-CG1 3.86Å; L74-V113 HydrophobicContact CD2-CG1 3.99Å; L74-V113 HydrophobicContact CG-CG1 4.42Å; L74-V114 WeakPolarHBondContact CA-O 3.49Å
75	V	87.7	Confident	78.4	Confident	34 Å²	34	60.5 Å²	60.5	21%	0.206	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	128	-178.6	-177.4	0	0	0	0	108.7	T62 W64 V73 V114	T62-V75 HydrophobicContact CG2-CG1 4.15Å; W64-V75 HydrophobicContact CD2-CG2 4.33Å; W64-V75 HydrophobicContact CE3-CG2 3.9Å; W64-V75 HydrophobicContact CH2-CB 4Å; W64-V75 HydrophobicContact CH2-CG2 3.69Å; W64-V75 HydrophobicContact CZ2-CB 4.35Å; W64-V75 HydrophobicContact CZ2-CG2 4.16Å; W64-V75 HydrophobicContact CZ3-CB 4.37Å; W64-V75 HydrophobicContact CZ3-CG2 3.57Å; V73-V75 HydrophobicContact CG1-CG2 4.28Å; V75-V114 PolarHBondContact N-O 2.86Å; V75-V114 PolarHBondContact O-N 3Å
76	S	85.2	Confident	76.5	Confident	79 Å²	79	59.8 Å²	59.8	55%	0.552	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	149.8	174.3	-55.7	0	0	0	0	111.7	G112	S76-G112 CarbonylContact C-O 3.29Å; S76-G112 WeakPolarHBondContact CA-O 3.09Å
77	C	82.4	Confident	74.5	Confident	22 Å²	22	64.8 Å²	64.8	15%	0.149	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-52.7	135.9	172.2	-68.2	0	0	0	0	111.5	G112 A133 C134	C77-G112 PolarHBondContact N-O 3.38Å; C77-G112 PolarHBondContact SG-O 3.45Å; C77-G112 VanDerWaalsContact SG-O 3.35Å; C77-A133 PolarHBondContact SG-O 2.78Å; C77-A133 VanDerWaalsContact SG-O 3.37Å; C77-C134 HydrophobicContact CB-CB 3.79Å; C77-C134 WeakPolarHBondContact CB-SG 3.41Å; C77-C134 WeakPolarHBondContact SG-CA 3.31Å; C77-C134 WeakPolarHBondContact SG-CB 3.26Å; C77-C134 CovalentContact SG-SG 2.04Å; C77-C134 PolarHBondContact SG-SG 3.23Å
78	P	78.1	Confident	72.4	Confident	13 Å²	13	68.8 Å²	68.8	8%	0.084	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-55.2	145.1	172.9	-27.4	34.4	0	0	0	112.8	I61 T62 L80 F81	I61-P78 HydrophobicContact CG2-CG 4.18Å; T62-P78 HydrophobicContact CG2-CG 3.83Å; P78-L80 PolarHBondContact O-N 3.11Å; P78-F81 HydrophobicContact CB-CD2 4.05Å; P78-F81 HydrophobicContact CB-CE2 4.3Å; P78-F81 HydrophobicContact CG-CD2 4.15Å; P78-F81 HydrophobicContact CG-CE2 4.03Å; P78-F81 PolarHBondContact O-N 3.01Å
79	E	68.2	Low	70.2	Confident	113 Å²	113	67.3 Å²	67.3	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-54.5	-25.5	-179.9	-64.5	-64.2	159.6	0	0	113.3	F81 R82	E79-F81 VanDerWaalsContact C-N 3.25Å; E79-F81 PolarHBondContact O-N 3.09Å; E79-R82 WeakPolarHBondContact O-CB 3.29Å; E79-R82 PolarHBondContact O-N 3.28Å; E79-R82 VanDerWaalsContact O-N 3.16Å; E79-R82 IonicContact OE1-CZ 3.53Å; E79-R82 IonicContact OE1-NH1 2.77Å; E79-R82 PolarHBondContact OE1-NH1 3.16Å; E79-R82 IonicContact OE2-CZ 3.37Å; E79-R82 IonicContact OE2-NE 3.98Å; E79-R82 IonicContact OE2-NH1 2.85Å; E79-R82 PolarHBondContact OE2-NH1 2.95Å
80	L	64.2	Low	67.5	Low	13 Å²	13	72.7 Å²	72.7	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-57.1	-35.3	175.1	-161.9	77.9	0	0	0	112.9	I26 F27 P78 R82 I83 F84	I26-L80 HydrophobicContact CD1-CD1 4.34Å; F27-L80 HydrophobicContact CD2-CD2 4.15Å; F27-L80 HydrophobicContact CE1-CD2 4.32Å; F27-L80 HydrophobicContact CE2-CD2 3.26Å; F27-L80 HydrophobicContact CZ-CD2 3.37Å; P78-L80 PolarHBondContact O-N 3.11Å; L80-R82 VanDerWaalsContact C-N 3.31Å; L80-R82 PolarHBondContact O-N 2.8Å; L80-I83 HydrophobicContact CD1-CD1 4.07Å; L80-I83 WeakPolarHBondContact O-CB 3.19Å; L80-I83 PolarHBondContact O-N 2.92Å; L80-I83 VanDerWaalsContact O-N 3.1Å; L80-F84 HydrophobicContact CD2-CE2 4.03Å; L80-F84 HydrophobicContact CG-CE2 3.97Å; L80-F84 WeakPolarHBondContact O-CD2 3.42Å
81	F	65.5	Low	64.9	Low	25 Å²	25	74.7 Å²	74.7	11%	0.11	37%	0.371	C	S	.	.	H	α-helix	trans	-68.5	-29.5	179.9	-70.9	-85.5	0	0	0	112.4	I61 P78 E79 I83 F84 N85 C134 F136	I61-F81 HydrophobicContact CG2-CE2 3.86Å; I61-F81 HydrophobicContact CG2-CZ 4.12Å; P78-F81 HydrophobicContact CB-CD2 4.05Å; P78-F81 HydrophobicContact CB-CE2 4.3Å; P78-F81 HydrophobicContact CG-CD2 4.15Å; P78-F81 HydrophobicContact CG-CE2 4.03Å; P78-F81 PolarHBondContact O-N 3.01Å; E79-F81 VanDerWaalsContact C-N 3.25Å; E79-F81 PolarHBondContact O-N 3.09Å; F81-I83 PolarHBondContact O-N 3.45Å; F81-F84 PolarHBondContact O-N 2.82Å; F81-N85 PolarHBondContact O-N 3.04Å; F81-C134 HydrophobicContact CB-CB 3.85Å; F81-C134 HydrophobicContact CD1-CB 3.65Å; F81-C134 HydrophobicContact CD2-CB 4.16Å; F81-C134 HydrophobicContact CE1-CB 4.24Å; F81-C134 HydrophobicContact CG-CB 3.61Å; F81-F136 HydrophobicContact CD1-CB 4.22Å; F81-F136 HydrophobicContact CD1-CD2 4.01Å; F81-F136 HydrophobicContact CE1-CB 4.02Å; F81-F136 AromaticContact CE1-CD2 3.81Å; F81-F136 HydrophobicContact CE1-CD2 3.81Å; F81-F136 HydrophobicContact CE1-CG 4.12Å
82	R	61.8	Low	62.3	Low	139 Å²	139	77.1 Å²	77.1	53%	0.525	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-23.4	171.7	-65.9	-173.9	174.7	136.2	0	113.2	E79 L80 N85	E79-R82 WeakPolarHBondContact O-CB 3.29Å; E79-R82 PolarHBondContact O-N 3.28Å; E79-R82 VanDerWaalsContact O-N 3.16Å; E79-R82 IonicContact OE1-CZ 3.53Å; E79-R82 IonicContact OE1-NH1 2.77Å; E79-R82 PolarHBondContact OE1-NH1 3.16Å; E79-R82 IonicContact OE2-CZ 3.37Å; E79-R82 IonicContact OE2-NE 3.98Å; E79-R82 IonicContact OE2-NH1 2.85Å; E79-R82 PolarHBondContact OE2-NH1 2.95Å; L80-R82 VanDerWaalsContact C-N 3.31Å; L80-R82 PolarHBondContact O-N 2.8Å; R82-N85 CarbonylContact O-C 3.01Å
83	I	55.2	Low	59.7	Low	91 Å²	91	80.5 Å²	80.5	47%	0.467	40%	0.404	S	S	.	.	H	α-helix	trans	-73.6	-35.6	175.3	-50.8	179.1	0	0	0	110.4	L80 F81 M299	L80-I83 HydrophobicContact CD1-CD1 4.07Å; L80-I83 WeakPolarHBondContact O-CB 3.19Å; L80-I83 PolarHBondContact O-N 2.92Å; L80-I83 VanDerWaalsContact O-N 3.1Å; F81-I83 PolarHBondContact O-N 3.45Å; I83-M299 HydrophobicContact CG2-CE 4.41Å
84	F	54.3	Low	57	Low	130 Å²	130	84.4 Å²	84.4	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-76.8	-34.2	175.9	-68.1	-68.9	0	0	0	112.8	L80 F81 P86 F136	L80-F84 HydrophobicContact CD2-CE2 4.03Å; L80-F84 HydrophobicContact CG-CE2 3.97Å; L80-F84 WeakPolarHBondContact O-CD2 3.42Å; F81-F84 PolarHBondContact O-N 2.82Å; F84-P86 VanDerWaalsContact C-CD 3.47Å; F84-P86 VanDerWaalsContact O-CD 3.3Å; F84-P86 WeakPolarHBondContact O-CD 3.48Å; F84-F136 HydrophobicContact CD2-CD2 4.45Å; F84-F136 HydrophobicContact CD2-CE2 4.17Å; F84-F136 HydrophobicContact CE2-CE2 4.31Å; F84-F136 HydrophobicContact CG-CE2 4.3Å
85	N	50.6	Low	54.4	Low	38 Å²	38	86.1 Å²	86.1	20%	0.203	44%	0.436	C	S	.	.			trans	-120.5	73.1	-178.6	-163	-11.8	0	0	0	112.3	F81 R82 D87	F81-N85 PolarHBondContact O-N 3.04Å; R82-N85 CarbonylContact O-C 3.01Å; N85-D87 PolarHBondContact O-N 3.43Å
86	P	50	Low	51.8	Low	76 Å²	76	88.1 Å²	88.1	49%	0.494	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-19.9	-178.4	29.2	-36.6	0	0	0	113.3	F84 Q88 V89	F84-P86 VanDerWaalsContact C-CD 3.47Å; F84-P86 VanDerWaalsContact O-CD 3.3Å; F84-P86 WeakPolarHBondContact O-CD 3.48Å; P86-Q88 VanDerWaalsContact C-N 3.34Å; P86-Q88 PolarHBondContact O-N 3.31Å; P86-V89 WeakPolarHBondContact O-CB 3.23Å; P86-V89 PolarHBondContact O-N 2.84Å
87	D	46.2	Very low	49.2	Very low	105 Å²	105	93.4 Å²	93.4	56%	0.561	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-26.6	-175	-68.1	-34	0	0	0	112.2	N85 V89 W90	N85-D87 PolarHBondContact O-N 3.43Å; D87-V89 PolarHBondContact O-N 3.42Å; D87-V89 VanDerWaalsContact O-N 3.15Å; D87-W90 VanDerWaalsContact O-CD1 3.28Å; D87-W90 PolarHBondContact O-N 2.96Å
88	Q	44.1	Very low	46.5	Very low	84 Å²	84	97.7 Å²	97.7	39%	0.393	51%	0.511	S	S	.	.	H	α-helix	trans	-60.4	-24	172	-75.6	-170.3	-23.4	0	0	113.9	P86 W90 T92	P86-Q88 VanDerWaalsContact C-N 3.34Å; P86-Q88 PolarHBondContact O-N 3.31Å; Q88-W90 VanDerWaalsContact C-N 3.34Å; Q88-W90 PolarHBondContact O-N 3.29Å; Q88-T92 PolarHBondContact O-OG1 3.01Å
89	V	40.7	Very low	44.1	Very low	73 Å²	73	104.8 Å²	104.8	44%	0.442	55%	0.548	S	S	.	.	H	α-helix	trans	-70	-32.5	-178.4	-175.8	0	0	0	0	111.3	P86 D87	P86-V89 WeakPolarHBondContact O-CB 3.23Å; P86-V89 PolarHBondContact O-N 2.84Å; D87-V89 PolarHBondContact O-N 3.42Å; D87-V89 VanDerWaalsContact O-N 3.15Å
90	W	32.5	Very low	42.2	Very low	165 Å²	165	109.5 Å²	109.5	63%	0.625	57%	0.567	S	S	*	*	H	α-helix	trans	-80.5	-31.6	-173.7	110	-87.5	0	0	0	113.4	D87 Q88 T94	D87-W90 VanDerWaalsContact O-CD1 3.28Å; D87-W90 PolarHBondContact O-N 2.96Å; Q88-W90 VanDerWaalsContact C-N 3.34Å; Q88-W90 PolarHBondContact O-N 3.29Å; W90-T94 HydrophobicContact CE3-CG2 4.15Å; W90-T94 HydrophobicContact CZ3-CG2 4.21Å; W90-T94 WeakPolarHBondContact O-CG2 3.38Å; W90-T94 PolarHBondContact O-OG1 3.19Å
91	E	35.2	Very low	40.6	Very low	113 Å²	113	112.2 Å²	112.2	53%	0.528	60%	0.598	S	S	.	*	H	α-helix	trans	-76.8	-37.8	178.7	-61.3	-171.7	146.9	0	0	111.3	E93 T94 I95	E91-E93 PolarHBondContact O-N 3.15Å; E91-T94 PolarHBondContact O-N 3.4Å; E91-T94 PolarHBondContact O-OG1 3.4Å; E91-I95 WeakPolarHBondContact O-CG1 3.42Å; E91-I95 PolarHBondContact O-N 3.22Å
92	T	35.3	Very low	38.9	Very low	108 Å²	108	118.4 Å²	118.4	66%	0.663	63%	0.632	S	S	*	*	H	α-helix	trans	-63.8	-38.4	178.7	-43.8	0	0	0	0	112.8	Q88	Q88-T92 PolarHBondContact O-OG1 3.01Å
93	E	35	Very low	37.4	Very low	169 Å²	169	116.2 Å²	116.2	79%	0.79	64%	0.638	S	S	*	*	H	α-helix	trans	-78.6	-14.3	179.3	-70.6	-161.3	135.3	0	0	114	E91	E91-E93 PolarHBondContact O-N 3.15Å
94	T	34.5	Very low	36.2	Very low	90 Å²	90	119.7 Å²	119.7	55%	0.552	66%	0.658	S	S	*	*	H	α-helix	trans	-102.7	-12	-175.3	49.9	0	0	0	0	114.9	W90 E91	W90-T94 HydrophobicContact CE3-CG2 4.15Å; W90-T94 HydrophobicContact CZ3-CG2 4.21Å; W90-T94 WeakPolarHBondContact O-CG2 3.38Å; W90-T94 PolarHBondContact O-OG1 3.19Å; E91-T94 PolarHBondContact O-N 3.4Å; E91-T94 PolarHBondContact O-OG1 3.4Å
95	I	36.3	Very low	35.1	Very low	128 Å²	128	118.1 Å²	118.1	66%	0.656	66%	0.663	S	S	*	*	H	α-helix	trans	-95.1	-15.1	-179.8	-66.4	171.2	0	0	0	112.6	E91 E97	E91-I95 WeakPolarHBondContact O-CG1 3.42Å; E91-I95 PolarHBondContact O-N 3.22Å; I95-E97 PolarHBondContact O-N 2.82Å
96	G	31.9	Very low	34.6	Very low	77 Å²	77	123.9 Å²	123.9	79%	0.794	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	1.5	-171.7	0	0	0	0	0	118.4
97	E	31	Very low	34.3	Very low	190 Å²	190	125.5 Å²	125.5	89%	0.888	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.2	16.5	-173.3	-141.2	177.4	148.5	0	0	115.9	I95	I95-E97 PolarHBondContact O-N 2.82Å
98	S	25.7	Very low	34.4	Very low	112 Å²	112	122.6 Å²	122.6	78%	0.783	68%	0.682	S	S	*	*			trans	-174	102.6	154.9	32.6	0	0	0	0	116.4
99	D	29.1	Very low	34.6	Very low	162 Å²	162	121.4 Å²	121.4	87%	0.866	68%	0.682	S	S	*	*				-157.6	167.7	115.2	-146.6	-19.4	0	0	0	110.9
100	F	27.7	Very low	35.3	Very low	211 Å²	211	125 Å²	125	93%	0.925	70%	0.699	S	S	*	*			trans	-136.2	69.6	-176.1	-159.7	-85.5	0	0	0	109.9
101	G	30.7	Very low	36.4	Very low	70 Å²	70	122.5 Å²	122.5	72%	0.722	70%	0.696	S	S	*	*			trans	-132.8	116.6	-168.2	0	0	0	0	0	116.3
102	D	30	Very low	38.3	Very low	155 Å²	155	117.8 Å²	117.8	83%	0.829	68%	0.678	S	S	*	*			trans	7.7	99.3	157.6	-66.4	-22.3	0	0	0	122
103	S	30.2	Very low	40.6	Very low	93 Å²	93	113.4 Å²	113.4	65%	0.65	65%	0.651	S	S	*	*				69.4	131.1	122.9	75.5	0	0	0	0	122.9
104	N	28.5	Very low	43.1	Very low	165 Å²	165	105.5 Å²	105.5	88%	0.882	61%	0.614	S	S	*	*			trans	77	29.3	142.7	-60.1	-17	0	0	0	121.1
105	S	32.5	Very low	45.7	Very low	96 Å²	96	101.6 Å²	101.6	67%	0.671	59%	0.591	S	S	*	*			trans	-151.1	106.1	148	52.6	0	0	0	0	111.5	D107	S105-D107 PolarHBondContact O-N 2.89Å
106	L	38.8	Very low	48.4	Very low	159 Å²	159	96.5 Å²	96.5	83%	0.832	56%	0.563	S	S	*	*			trans	-87.6	93.5	165.3	-86.8	164.9	0	0	0	107.8	L108 M111	L106-L108 PolarHBondContact O-N 3.47Å; L106-M111 HydrophobicContact CD2-CE 4.41Å
107	D	44.9	Very low	51.3	Low	111 Å²	111	96 Å²	96	59%	0.594	54%	0.543	S	S	*	.			trans	-70	117.6	174.4	-85.2	-40.4	0	0	0	110	S105 S109 D110	S105-D107 PolarHBondContact O-N 2.89Å; D107-S109 PolarHBondContact O-N 3.14Å; D107-D110 PolarHBondContact O-N 3Å
108	L	47.8	Very low	54.2	Low	44 Å²	44	87.1 Å²	87.1	23%	0.23	50%	0.501	C	S	.	.	G	3₁₀ helix	trans	-68.1	-18.5	-169.9	-164.2	64	0	0	0	113.2	L74 L106 D110 M111 V113	L74-L108 HydrophobicContact CD2-CD1 4.05Å; L74-L108 HydrophobicContact CD2-CD2 4.43Å; L106-L108 PolarHBondContact O-N 3.47Å; L108-D110 VanDerWaalsContact C-N 3.34Å; L108-M111 HydrophobicContact CD1-CE 4.12Å; L108-V113 HydrophobicContact CD1-CB 3.95Å; L108-V113 HydrophobicContact CD1-CG1 4.02Å; L108-V113 HydrophobicContact CD2-CG1 4.47Å; L108-V113 HydrophobicContact CG-CB 4.09Å; L108-V113 HydrophobicContact CG-CG1 4.31Å
109	S	48.4	Very low	57.3	Low	58 Å²	58	84.5 Å²	84.5	41%	0.406	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-61.4	-38.1	173.8	46.3	0	0	0	0	113	D107 M111 G112	D107-S109 PolarHBondContact O-N 3.14Å; S109-M111 PolarHBondContact O-N 3.24Å; S109-M111 VanDerWaalsContact O-N 3.17Å; S109-G112 PolarHBondContact O-N 3.3Å; S109-G112 VanDerWaalsContact O-N 3.09Å
110	D	55	Low	60	Low	150 Å²	150	85.1 Å²	85.1	80%	0.802	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-71.3	-13.8	-172.1	-150.3	48.2	0	0	0	113.1	D107 L108	D107-D110 PolarHBondContact O-N 3Å; L108-D110 VanDerWaalsContact C-N 3.34Å
111	M	56.4	Low	62.9	Low	111 Å²	111	83.2 Å²	83.2	55%	0.547	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-102.7	-2.5	175.6	-68.7	-176.7	-76.1	0	0	113.7	L106 L108 S109 V113	L106-M111 HydrophobicContact CD2-CE 4.41Å; L108-M111 HydrophobicContact CD1-CE 4.12Å; S109-M111 PolarHBondContact O-N 3.24Å; S109-M111 VanDerWaalsContact O-N 3.17Å; M111-V113 HydrophobicContact CB-CG2 3.95Å
112	G	74.1	Confident	65.6	Low	15 Å²	15	80.8 Å²	80.8	16%	0.155	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	52.3	-175	0	0	0	0	0	112.9	S76 C77 S109 A133	S76-G112 CarbonylContact C-O 3.29Å; S76-G112 WeakPolarHBondContact CA-O 3.09Å; C77-G112 PolarHBondContact N-O 3.38Å; C77-G112 PolarHBondContact SG-O 3.45Å; C77-G112 VanDerWaalsContact SG-O 3.35Å; S109-G112 PolarHBondContact O-N 3.3Å; S109-G112 VanDerWaalsContact O-N 3.09Å; G112-A133 WeakPolarHBondContact CA-O 3.28Å
113	V	83.7	Confident	68.5	Low	16 Å²	16	75.2 Å²	75.2	10%	0.097	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.4	-174.8	178.1	0	0	0	0	111.8	L74 L108 M111	L74-V113 HydrophobicContact CB-CG1 3.86Å; L74-V113 HydrophobicContact CD2-CG1 3.99Å; L74-V113 HydrophobicContact CG-CG1 4.42Å; L108-V113 HydrophobicContact CD1-CB 3.95Å; L108-V113 HydrophobicContact CD1-CG1 4.02Å; L108-V113 HydrophobicContact CD2-CG1 4.47Å; L108-V113 HydrophobicContact CG-CB 4.09Å; L108-V113 HydrophobicContact CG-CG1 4.31Å; M111-V113 HydrophobicContact CB-CG2 3.95Å
114	V	87.7	Confident	71.5	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.012	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	138.9	173.2	175.2	0	0	0	0	109.5	W64 L74 V75 P126 Y130 A133	W64-V114 HydrophobicContact CH2-CG1 4.32Å; W64-V114 HydrophobicContact CZ2-CG1 4.29Å; L74-V114 WeakPolarHBondContact CA-O 3.49Å; V75-V114 PolarHBondContact N-O 2.86Å; V75-V114 PolarHBondContact O-N 3Å; V114-P126 HydrophobicContact CG1-CB 3.46Å; V114-P126 VanDerWaalsContact CG1-CB 3.46Å; V114-Y130 HydrophobicContact CB-CE1 4.16Å; V114-Y130 HydrophobicContact CG1-CE1 4.13Å; V114-Y130 HydrophobicContact CG2-CD1 3.7Å; V114-Y130 HydrophobicContact CG2-CE1 3.83Å; V114-Y130 HydrophobicContact CG2-CG 4.4Å; V114-A133 HydrophobicContact CG2-CB 3.44Å; V114-A133 VanDerWaalsContact CG2-CB 3.44Å
115	S	90.4	Very high	74.4	Confident	9 Å²	9	71.5 Å²	71.5	6%	0.063	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.9	176.6	73.6	0	0	0	0	112.5	V73 P126 F127	V73-S115 CarbonylContact O-C 3.44Å; V73-S115 VanDerWaalsContact O-CA 3.29Å; V73-S115 WeakPolarHBondContact O-CA 3.38Å; S115-P126 WeakPolarHBondContact O-CA 3.4Å; S115-F127 WeakPolarHBondContact CB-O 3.3Å; S115-F127 PolarHBondContact N-O 3.46Å; S115-F127 PolarHBondContact O-N 3.5Å; S115-F127 PolarHBondContact OG-O 2.93Å
116	R	92.3	Very high	77	Confident	21 Å²	21	67.7 Å²	67.7	8%	0.079	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138	167.7	-65.2	-179.6	91.1	133.3	10.4	109.3	D59 W64 V73 W123 S124 E125 P126	D59-R116 IonicContact OD2-NH1 3.45Å; D59-R116 PolarHBondContact OD2-NH1 3.05Å; W64-R116 HydrophobicContact CD2-CG 4.37Å; W64-R116 HydrophobicContact CE3-CB 4.01Å; W64-R116 HydrophobicContact CE3-CG 4.21Å; W64-R116 HydrophobicContact CH2-CB 3.93Å; W64-R116 HydrophobicContact CH2-CG 3.53Å; W64-R116 HydrophobicContact CZ2-CB 4.45Å; W64-R116 HydrophobicContact CZ2-CG 3.67Å; W64-R116 HydrophobicContact CZ3-CB 3.66Å; W64-R116 HydrophobicContact CZ3-CG 3.79Å; V73-R116 PolarHBondContact N-O 3.28Å; V73-R116 PolarHBondContact O-N 3.41Å; R116-W123 HydrophobicContact CB-CE3 3.88Å; R116-W123 HydrophobicContact CB-CZ3 4.22Å; R116-S124 VanDerWaalsContact CZ-O 3.23Å; R116-S124 PolarHBondContact NE-O 2.9Å; R116-S124 PolarHBondContact NH2-O 2.94Å; R116-E125 IonicContact NH2-OE2 3.11Å; R116-P126 HydrophobicContact CG-CB 4.22Å
117	N	92.1	Very high	79.3	Confident	67 Å²	67	67.5 Å²	67.5	36%	0.358	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	140.5	173.9	-69.4	-36.3	0	0	0	110.2	M72 S124	M72-N117 VanDerWaalsContact CB-OD1 3.29Å; M72-N117 WeakPolarHBondContact CB-OD1 3.29Å; M72-N117 VanDerWaalsContact CE-OD1 3.28Å; M72-N117 WeakPolarHBondContact CE-OD1 3.36Å; M72-N117 WeakPolarHBondContact CG-OD1 3.11Å; N117-S124 PolarHBondContact N-OG 2.94Å; N117-S124 PolarHBondContact O-N 3.29Å
118	C	92.1	Very high	81.3	Confident	3 Å²	3	63 Å²	63	2%	0.02	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	122.3	165.5	179.4	0	0	0	0	110.5	C54 A67 H68 G70 E71 W123	C54-C118 HydrophobicContact CB-CB 3.87Å; C54-C118 WeakPolarHBondContact CB-SG 3.5Å; C54-C118 PolarHBondContact N-SG 3.34Å; C54-C118 WeakPolarHBondContact SG-CA 3.4Å; C54-C118 WeakPolarHBondContact SG-CB 3.41Å; C54-C118 CovalentContact SG-SG 2.04Å; C54-C118 PolarHBondContact SG-SG 3.14Å; A67-C118 HydrophobicContact CB-CB 4.02Å; H68-C118 VanDerWaalsContact C-SG 3.59Å; H68-C118 VanDerWaalsContact O-CB 3.31Å; H68-C118 WeakPolarHBondContact O-CB 3.4Å; H68-C118 PolarHBondContact O-SG 3.22Å; G70-C118 PolarHBondContact N-O 3.25Å; E71-C118 PolarHBondContact O-N 3.35Å; C118-W123 HydrophobicContact CB-CE3 4.43Å; C118-W123 HydrophobicContact CB-CZ3 4.26Å
119	T	90.5	Very high	83.1	Confident	56 Å²	56	66 Å²	66	34%	0.344	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	171.2	-178.9	74.4	0	0	0	0	110.8	D121 G122	T119-D121 PolarHBondContact O-N 2.99Å; T119-D121 PolarHBondContact OG1-N 2.78Å; T119-G122 WeakPolarHBondContact CA-O 3.12Å; T119-G122 WeakPolarHBondContact CB-O 3.41Å; T119-G122 PolarHBondContact N-O 3.08Å; T119-G122 PolarHBondContact O-N 3.29Å; T119-G122 PolarHBondContact OG1-N 3.47Å; T119-G122 PolarHBondContact OG1-O 3.17Å
120	E	87.4	Confident	84.6	Confident	176 Å²	176	64 Å²	64	82%	0.822	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-29.1	176.3	-66.6	-175.5	173.7	0	0	112.7	V69	V69-E120 HydrophobicContact CG1-CG 3.7Å
121	D	87	Confident	85.7	Confident	170 Å²	170	59.5 Å²	59.5	91%	0.909	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-5.8	175.3	-63.9	-59.2	0	0	0	113.5	T119	T119-D121 PolarHBondContact O-N 2.99Å; T119-D121 PolarHBondContact OG1-N 2.78Å
122	G	88.2	Confident	86.7	Confident	20 Å²	20	59 Å²	59	21%	0.206	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	117.7	-154.8	-177.2	0	0	0	0	0	114.1	T119	T119-G122 WeakPolarHBondContact CA-O 3.12Å; T119-G122 WeakPolarHBondContact CB-O 3.41Å; T119-G122 PolarHBondContact N-O 3.08Å; T119-G122 PolarHBondContact O-N 3.29Å; T119-G122 PolarHBondContact OG1-N 3.47Å; T119-G122 PolarHBondContact OG1-O 3.17Å
123	W	91.1	Very high	86.9	Confident	38 Å²	38	58.4 Å²	58.4	14%	0.144	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	136.1	-179	-71.7	110.6	0	0	0	112.6	C54 P55 M57 W64 K65 A67 V73 R116 C118	C54-W123 HydrophobicContact CB-CD2 3.83Å; C54-W123 VanDerWaalsContact CB-CE2 3.44Å; C54-W123 HydrophobicContact CB-CE3 4.46Å; C54-W123 HydrophobicContact CB-CG 4.14Å; C54-W123 HydrophobicContact CB-CH2 4.44Å; C54-W123 HydrophobicContact CB-CZ2 3.78Å; P55-W123 PolarHBondContact O-NE1 3.37Å; M57-W123 HydrophobicContact SD-CG 4.14Å; W64-W123 HydrophobicContact CB-CZ2 4.17Å; W64-W123 HydrophobicContact CE3-CZ3 4.35Å; K65-W123 WeakPolarHBondContact O-CH2 3.45Å; K65-W123 WeakPolarHBondContact O-CZ2 3.48Å; A67-W123 HydrophobicContact CB-CH2 3.51Å; A67-W123 HydrophobicContact CB-CZ2 4.07Å; A67-W123 HydrophobicContact CB-CZ3 4.25Å; V73-W123 HydrophobicContact CB-CH2 4.24Å; V73-W123 HydrophobicContact CB-CZ3 4.17Å; V73-W123 HydrophobicContact CG2-CH2 3.78Å; V73-W123 HydrophobicContact CG2-CZ3 3.99Å; R116-W123 HydrophobicContact CB-CE3 3.88Å; R116-W123 HydrophobicContact CB-CZ3 4.22Å; C118-W123 HydrophobicContact CB-CE3 4.43Å; C118-W123 HydrophobicContact CB-CZ3 4.26Å
124	S	92.1	Very high	86.6	Confident	34 Å²	34	57.8 Å²	57.8	24%	0.238	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-65.6	168	165.2	76.8	0	0	0	0	111.7	R116 N117	R116-S124 VanDerWaalsContact CZ-O 3.23Å; R116-S124 PolarHBondContact NE-O 2.9Å; R116-S124 PolarHBondContact NH2-O 2.94Å; N117-S124 PolarHBondContact N-OG 2.94Å; N117-S124 PolarHBondContact O-N 3.29Å
125	E	89.7	Confident	85.6	Confident	145 Å²	145	58.7 Å²	58.7	68%	0.678	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-62.1	156.4	161.2	-67	-49.9	144.6	0	0	112	R116	R116-E125 IonicContact NH2-OE2 3.11Å
126	P	87.6	Confident	84.2	Confident	17 Å²	17	62.4 Å²	62.4	11%	0.11	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-70.1	136.1	176.2	29.2	-33.3	0	0	0	111.7	V114 S115 R116 Y130	V114-P126 HydrophobicContact CG1-CB 3.46Å; V114-P126 VanDerWaalsContact CG1-CB 3.46Å; S115-P126 WeakPolarHBondContact O-CA 3.4Å; R116-P126 HydrophobicContact CG-CB 4.22Å; P126-Y130 HydrophobicContact CB-CD2 4.48Å; P126-Y130 HydrophobicContact CB-CE2 4.09Å; P126-Y130 HydrophobicContact CG-CD2 4.28Å; P126-Y130 HydrophobicContact CG-CE2 4.05Å
127	F	88	Confident	82.5	Confident	154 Å²	154	66.7 Å²	66.7	68%	0.675	34%	0.342	S	S	*	.	B	Isolated β-bridge	trans	-140	130.2	177.3	-174.1	-95.5	0	0	0	111.9	S115	S115-F127 WeakPolarHBondContact CB-O 3.3Å; S115-F127 PolarHBondContact N-O 3.46Å; S115-F127 PolarHBondContact O-N 3.5Å; S115-F127 PolarHBondContact OG-O 2.93Å
128	P	87	Confident	80.6	Confident	18 Å²	18	71.2 Å²	71.2	12%	0.117	36%	0.361	C	S	.	.	S	Bend	cis	-57.2	166.9	-14.9	21.9	-28.7	0	0	0	112.2	D132 A133	P128-D132 HydrophobicContact CB-CB 4.34Å; P128-A133 HydrophobicContact CB-CB 4.41Å; P128-A133 HydrophobicContact CG-CB 3.91Å
129	H	84.2	Confident	78.5	Confident	106 Å²	106	80.4 Å²	80.4	49%	0.491	40%	0.397	S	S	.	.			trans	-69.3	152	179.7	-174	-112.8	0	0	0	109.8	F131 D132 A133	H129-F131 WeakPolarHBondContact ND1-CB 3.41Å; H129-F131 PolarHBondContact O-N 3.3Å; H129-D132 WeakPolarHBondContact CB-OD2 3.35Å; H129-D132 PolarHBondContact N-OD2 3.17Å; H129-D132 PolarHBondContact O-N 3.1Å; H129-A133 VanDerWaalsContact O-CB 3.32Å; H129-A133 WeakPolarHBondContact O-CB 3.46Å; H129-A133 PolarHBondContact O-N 3.3Å
130	Y	80.4	Confident	76.5	Confident	15 Å²	15	82.4 Å²	82.4	6%	0.059	40%	0.402	C	S	.	.	H	α-helix	trans	-55.1	-30.3	-178.1	-71	-75.4	0	0	0	113.5	D59 I61 T62 V114 P126 C134	D59-Y130 PolarHBondContact OD1-OH 3.5Å; D59-Y130 PolarHBondContact OD2-OH 2.88Å; I61-Y130 HydrophobicContact CB-CE1 4.32Å; I61-Y130 HydrophobicContact CB-CE2 4.34Å; I61-Y130 HydrophobicContact CD1-CD2 3.65Å; I61-Y130 HydrophobicContact CD1-CE2 3.93Å; I61-Y130 HydrophobicContact CD1-CG 3.97Å; I61-Y130 HydrophobicContact CG2-CD1 3.99Å; I61-Y130 HydrophobicContact CG2-CE1 3.89Å; I61-Y130 HydrophobicContact CG2-CG 4.44Å; T62-Y130 HydrophobicContact CG2-CE1 3.64Å; T62-Y130 PolarHBondContact OG1-OH 3.01Å; V114-Y130 HydrophobicContact CB-CE1 4.16Å; V114-Y130 HydrophobicContact CG1-CE1 4.13Å; V114-Y130 HydrophobicContact CG2-CD1 3.7Å; V114-Y130 HydrophobicContact CG2-CE1 3.83Å; V114-Y130 HydrophobicContact CG2-CG 4.4Å; P126-Y130 HydrophobicContact CB-CD2 4.48Å; P126-Y130 HydrophobicContact CB-CE2 4.09Å; P126-Y130 HydrophobicContact CG-CD2 4.28Å; P126-Y130 HydrophobicContact CG-CE2 4.05Å; Y130-C134 VanDerWaalsContact O-CB 3.22Å; Y130-C134 WeakPolarHBondContact O-CB 3.39Å; Y130-C134 PolarHBondContact O-N 3.36Å
131	F	77.2	Confident	74.5	Confident	57 Å²	57	79.6 Å²	79.6	25%	0.25	40%	0.402	C	S	.	.	H	α-helix	trans	-56.4	-58	171.5	-172.6	-73.9	0	0	0	111.4	H129 G135 F136 D137 E138 Y139	H129-F131 WeakPolarHBondContact ND1-CB 3.41Å; H129-F131 PolarHBondContact O-N 3.3Å; F131-G135 WeakPolarHBondContact O-CA 3.3Å; F131-G135 PolarHBondContact O-N 3.48Å; F131-F136 WeakPolarHBondContact CD2-O 3.2Å; F131-F136 WeakPolarHBondContact CE2-O 3.19Å; F131-F136 PolarHBondContact O-N 2.83Å; F131-D137 WeakPolarHBondContact CZ-OD1 3.41Å; F131-E138 HydrophobicContact CE2-CB 3.89Å; F131-Y139 HydrophobicContact CZ-CD2 4.19Å
132	D	77.4	Confident	72.8	Confident	101 Å²	101	77 Å²	77	54%	0.54	38%	0.384	S	S	.	.	H	α-helix	trans	-73.1	-34	-176	-32.6	-56.4	0	0	0	111.9	P128 H129	P128-D132 HydrophobicContact CB-CB 4.34Å; H129-D132 WeakPolarHBondContact CB-OD2 3.35Å; H129-D132 PolarHBondContact N-OD2 3.17Å; H129-D132 PolarHBondContact O-N 3.1Å
133	A	78.9	Confident	71.3	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.008	40%	0.398	C	S	.	.	H	α-helix	trans	-77.3	-35.5	-176.1	0	0	0	0	0	113.1	C77 G112 V114 P128 H129	C77-A133 PolarHBondContact SG-O 2.78Å; C77-A133 VanDerWaalsContact SG-O 3.37Å; G112-A133 WeakPolarHBondContact CA-O 3.28Å; V114-A133 HydrophobicContact CG2-CB 3.44Å; V114-A133 VanDerWaalsContact CG2-CB 3.44Å; P128-A133 HydrophobicContact CB-CB 4.41Å; P128-A133 HydrophobicContact CG-CB 3.91Å; H129-A133 VanDerWaalsContact O-CB 3.32Å; H129-A133 WeakPolarHBondContact O-CB 3.46Å; H129-A133 PolarHBondContact O-N 3.3Å
134	C	78	Confident	69.8	Low	3 Å²	3	80.5 Å²	80.5	2%	0.02	42%	0.417	C	S	.	.	H	α-helix	trans	-117.7	5.6	-171.5	-46.4	0	0	0	0	113.3	C77 F81 Y130	C77-C134 HydrophobicContact CB-CB 3.79Å; C77-C134 WeakPolarHBondContact CB-SG 3.41Å; C77-C134 WeakPolarHBondContact SG-CA 3.31Å; C77-C134 WeakPolarHBondContact SG-CB 3.26Å; C77-C134 CovalentContact SG-SG 2.04Å; C77-C134 PolarHBondContact SG-SG 3.23Å; F81-C134 HydrophobicContact CB-CB 3.85Å; F81-C134 HydrophobicContact CD1-CB 3.65Å; F81-C134 HydrophobicContact CD2-CB 4.16Å; F81-C134 HydrophobicContact CE1-CB 4.24Å; F81-C134 HydrophobicContact CG-CB 3.61Å; Y130-C134 VanDerWaalsContact O-CB 3.22Å; Y130-C134 WeakPolarHBondContact O-CB 3.39Å; Y130-C134 PolarHBondContact O-N 3.36Å
135	G	66.3	Low	68.5	Low	21 Å²	21	82.5 Å²	82.5	22%	0.216	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	44.6	172.7	0	0	0	0	0	114.5	F131 D137	F131-G135 WeakPolarHBondContact O-CA 3.3Å; F131-G135 PolarHBondContact O-N 3.48Å; G135-D137 PolarHBondContact O-N 3.47Å
136	F	61.2	Low	67.6	Low	87 Å²	87	78.2 Å²	78.2	38%	0.382	41%	0.405	S	S	.	.			trans	-95.1	73.1	-179.6	-164.1	-93.6	0	0	0	111.5	F81 F84 F131 E138	F81-F136 HydrophobicContact CD1-CB 4.22Å; F81-F136 HydrophobicContact CD1-CD2 4.01Å; F81-F136 HydrophobicContact CE1-CB 4.02Å; F81-F136 AromaticContact CE1-CD2 3.81Å; F81-F136 HydrophobicContact CE1-CD2 3.81Å; F81-F136 HydrophobicContact CE1-CG 4.12Å; F84-F136 HydrophobicContact CD2-CD2 4.45Å; F84-F136 HydrophobicContact CD2-CE2 4.17Å; F84-F136 HydrophobicContact CE2-CE2 4.31Å; F84-F136 HydrophobicContact CG-CE2 4.3Å; F131-F136 WeakPolarHBondContact CD2-O 3.2Å; F131-F136 WeakPolarHBondContact CE2-O 3.19Å; F131-F136 PolarHBondContact O-N 2.83Å; F136-E138 PolarHBondContact O-N 2.88Å
137	D	55.9	Low	66.8	Low	112 Å²	112	83.1 Å²	83.1	60%	0.599	43%	0.43	S	S	*	.			trans	-71.8	88.2	-172.3	-111.4	-41.6	0	0	0	113.5	F131 G135 Y139 E140	F131-D137 WeakPolarHBondContact CZ-OD1 3.41Å; G135-D137 PolarHBondContact O-N 3.47Å; D137-Y139 PolarHBondContact O-N 3.35Å; D137-E140 PolarHBondContact O-N 2.81Å
138	E	52.1	Low	66.5	Low	161 Å²	161	83.3 Å²	83.3	75%	0.752	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	1.7	176	-155.5	176.9	-156.2	0	0	113.5	F131 F136	F131-E138 HydrophobicContact CE2-CB 3.89Å; F136-E138 PolarHBondContact O-N 2.88Å
139	Y	48.2	Very low	66.2	Low	196 Å²	196	83.9 Å²	83.9	77%	0.769	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	5.1	177.6	-78.9	-76.9	0	0	0	115.2	F131 D137 S141	F131-Y139 HydrophobicContact CZ-CD2 4.19Å; D137-Y139 PolarHBondContact O-N 3.35Å; Y139-S141 PolarHBondContact O-N 2.99Å
140	E	47.9	Very low	66.1	Low	98 Å²	98	84.5 Å²	84.5	46%	0.458	43%	0.426	S	S	.	.			trans	-66.8	77.3	163.4	-88.3	-138.7	141.9	0	0	111.9	D137 E142 T143 Q146	D137-E140 PolarHBondContact O-N 2.81Å; E140-E142 PolarHBondContact O-N 2.68Å; E140-E142 VanDerWaalsContact O-N 3.08Å; E140-T143 HydrophobicContact CB-CG2 4.06Å; E140-T143 WeakPolarHBondContact O-CG2 3.42Å; E140-T143 PolarHBondContact O-N 3.13Å; E140-T143 VanDerWaalsContact O-N 3.13Å; E140-T143 PolarHBondContact O-OG1 3.48Å; E140-Q146 PolarHBondContact OE1-NE2 3.37Å; E140-Q146 PolarHBondContact OE2-NE2 3.04Å
141	S	45.7	Very low	66.3	Low	118 Å²	118	88.9 Å²	88.9	83%	0.825	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-1.3	165.1	56	0	0	0	0	113.8	Y139	Y139-S141 PolarHBondContact O-N 2.99Å
142	E	52.4	Low	66.8	Low	114 Å²	114	88.5 Å²	88.5	53%	0.533	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.8	170	-63.7	-155.5	177	0	0	114.4	E140 G144 D145 Q146	E140-E142 PolarHBondContact O-N 2.68Å; E140-E142 VanDerWaalsContact O-N 3.08Å; E142-G144 PolarHBondContact O-N 3.26Å; E142-G144 VanDerWaalsContact O-N 3.09Å; E142-D145 WeakPolarHBondContact O-CA 3.38Å; E142-D145 PolarHBondContact O-N 3.01Å; E142-Q146 PolarHBondContact O-N 3.49Å
143	T	55.3	Low	67.3	Low	81 Å²	81	84 Å²	84	50%	0.497	43%	0.43	S	S	.	.	H	α-helix	trans	-46.8	-42.6	179.4	39.6	0	0	0	0	113.2	E140 D145 Q146 D147	E140-T143 HydrophobicContact CB-CG2 4.06Å; E140-T143 WeakPolarHBondContact O-CG2 3.42Å; E140-T143 PolarHBondContact O-N 3.13Å; E140-T143 VanDerWaalsContact O-N 3.13Å; E140-T143 PolarHBondContact O-OG1 3.48Å; T143-D145 PolarHBondContact O-N 3.34Å; T143-Q146 PolarHBondContact O-N 2.87Å; T143-D147 PolarHBondContact O-N 2.95Å
144	G	59.3	Low	67.7	Low	52 Å²	52	86.2 Å²	86.2	54%	0.536	44%	0.44	S	S	.	.	H	α-helix	trans	-66.8	-27	177.1	0	0	0	0	0	115.6	E142 Y148	E142-G144 PolarHBondContact O-N 3.26Å; E142-G144 VanDerWaalsContact O-N 3.09Å; G144-Y148 VanDerWaalsContact O-CB 3.32Å; G144-Y148 WeakPolarHBondContact O-CB 3.3Å; G144-Y148 PolarHBondContact O-N 3.44Å
145	D	66.3	Low	68.2	Low	75 Å²	75	88.7 Å²	88.7	40%	0.401	46%	0.461	S	S	.	.	H	α-helix	trans	-79.1	-37.6	170.9	-179.1	68.2	0	0	0	110.9	E142 T143 Y148 Y149 R379	E142-D145 WeakPolarHBondContact O-CA 3.38Å; E142-D145 PolarHBondContact O-N 3.01Å; T143-D145 PolarHBondContact O-N 3.34Å; D145-Y148 PolarHBondContact O-N 2.81Å; D145-Y149 WeakPolarHBondContact O-CB 3.5Å; D145-Y149 PolarHBondContact O-N 3.11Å; D145-R379 IonicContact OD1-NH1 2.68Å; D145-R379 IonicContact OD2-CZ 3.55Å; D145-R379 IonicContact OD2-NH1 2.71Å; D145-R379 PolarHBondContact OD2-NH1 3.35Å; D145-R379 IonicContact OD2-NH2 3.63Å; D145-R379 PolarHBondContact OD2-NH2 2.98Å
146	Q	69.3	Low	69.4	Low	56 Å²	56	90.9 Å²	90.9	26%	0.262	47%	0.467	S	S	.	.	H	α-helix	trans	-61.7	-49.6	175.8	-62.4	-161.2	41.3	0	0	111.8	E140 E142 T143 Y148 Y149 Y150	E140-Q146 PolarHBondContact OE1-NE2 3.37Å; E140-Q146 PolarHBondContact OE2-NE2 3.04Å; E142-Q146 PolarHBondContact O-N 3.49Å; T143-Q146 PolarHBondContact O-N 2.87Å; Q146-Y148 PolarHBondContact O-N 2.92Å; Q146-Y149 WeakPolarHBondContact O-CB 3.28Å; Q146-Y149 PolarHBondContact O-N 3.41Å; Q146-Y150 HydrophobicContact CB-CE2 4.34Å; Q146-Y150 WeakPolarHBondContact O-CD2 3.32Å; Q146-Y150 PolarHBondContact O-N 3.41Å
147	D	71.2	Confident	70.9	Confident	119 Å²	119	87.6 Å²	87.6	64%	0.636	45%	0.452	S	S	*	.	H	α-helix	trans	-60.2	-46.4	176.6	-92	-17.2	0	0	0	112.1	T143 Y149 Y150 L151	T143-D147 PolarHBondContact O-N 2.95Å; D147-Y149 VanDerWaalsContact C-N 3.29Å; D147-Y149 PolarHBondContact O-N 3.34Å; D147-Y150 PolarHBondContact O-N 3.48Å; D147-L151 VanDerWaalsContact O-CB 3.27Å; D147-L151 WeakPolarHBondContact O-CB 3.48Å; D147-L151 PolarHBondContact O-N 3.42Å
148	Y	81.1	Confident	72.7	Confident	159 Å²	159	84.5 Å²	84.5	62%	0.624	44%	0.437	S	S	*	.	H	α-helix	trans	-62.1	-38.2	177.1	-178.6	-99.9	0	0	0	111.9	G144 D145 Q146 S152	G144-Y148 VanDerWaalsContact O-CB 3.32Å; G144-Y148 WeakPolarHBondContact O-CB 3.3Å; G144-Y148 PolarHBondContact O-N 3.44Å; D145-Y148 PolarHBondContact O-N 2.81Å; Q146-Y148 PolarHBondContact O-N 2.92Å; Y148-S152 WeakPolarHBondContact O-CB 3.23Å; Y148-S152 PolarHBondContact O-N 3.38Å; Y148-S152 PolarHBondContact O-OG 3.47Å
149	Y	82.1	Confident	74.7	Confident	29 Å²	29	80.9 Å²	80.9	11%	0.114	43%	0.426	C	S	.	.	H	α-helix	trans	-64.1	-51.5	175.2	167.6	-95.6	0	0	0	111.8	D145 Q146 D147 L151 S152 V153 R379 L382 V383	D145-Y149 WeakPolarHBondContact O-CB 3.5Å; D145-Y149 PolarHBondContact O-N 3.11Å; Q146-Y149 WeakPolarHBondContact O-CB 3.28Å; Q146-Y149 PolarHBondContact O-N 3.41Å; D147-Y149 VanDerWaalsContact C-N 3.29Å; D147-Y149 PolarHBondContact O-N 3.34Å; Y149-L151 VanDerWaalsContact C-N 3.34Å; Y149-L151 PolarHBondContact O-N 2.93Å; Y149-S152 PolarHBondContact O-N 3.46Å; Y149-V153 HydrophobicContact CD2-CG2 4.29Å; Y149-V153 HydrophobicContact CE1-CG2 4.2Å; Y149-V153 HydrophobicContact CE2-CG2 3.72Å; Y149-V153 WeakPolarHBondContact O-CG2 3.29Å; Y149-V153 PolarHBondContact O-N 3.25Å; Y149-R379 HydrophobicContact CD2-CG 3.83Å; Y149-R379 HydrophobicContact CE1-CG 4.14Å; Y149-R379 HydrophobicContact CE2-CB 4.47Å; Y149-R379 HydrophobicContact CE2-CG 3.33Å; Y149-R379 HydrophobicContact CG-CG 4.4Å; Y149-R379 WeakPolarHBondContact OH-CA 3.47Å; Y149-R379 PolarHBondContact OH-O 2.87Å; Y149-L382 HydrophobicContact CE1-CD2 4.02Å; Y149-L382 WeakPolarHBondContact OH-CB 3.45Å; Y149-V383 HydrophobicContact CE2-CG2 3.71Å
150	Y	81.7	Confident	77	Confident	120 Å²	120	71.5 Å²	71.5	47%	0.471	39%	0.389	S	S	.	.	H	α-helix	trans	-62.7	-40.9	179	-72.8	-61.1	0	0	0	111.7	Q146 D147 S152 V153 K154 L382	Q146-Y150 HydrophobicContact CB-CE2 4.34Å; Q146-Y150 WeakPolarHBondContact O-CD2 3.32Å; Q146-Y150 PolarHBondContact O-N 3.41Å; D147-Y150 PolarHBondContact O-N 3.48Å; Y150-S152 VanDerWaalsContact C-N 3.35Å; Y150-S152 PolarHBondContact O-N 3.04Å; Y150-V153 PolarHBondContact O-N 3.49Å; Y150-K154 VanDerWaalsContact O-CB 3.29Å; Y150-K154 WeakPolarHBondContact O-CB 3.49Å; Y150-K154 PolarHBondContact O-N 3.4Å; Y150-L382 HydrophobicContact CD1-CD2 4.4Å; Y150-L382 HydrophobicContact CE1-CD2 4.34Å
151	L	84.1	Confident	79.3	Confident	107 Å²	107	67.6 Å²	67.6	56%	0.56	37%	0.371	S	S	*	.	H	α-helix	trans	-63.5	-38.8	174.6	-177.3	60.4	0	0	0	112.2	D147 Y149 K154 A155	D147-L151 VanDerWaalsContact O-CB 3.27Å; D147-L151 WeakPolarHBondContact O-CB 3.48Å; D147-L151 PolarHBondContact O-N 3.42Å; Y149-L151 VanDerWaalsContact C-N 3.34Å; Y149-L151 PolarHBondContact O-N 2.93Å; L151-K154 WeakPolarHBondContact O-CB 3.21Å; L151-K154 PolarHBondContact O-N 3.42Å; L151-A155 PolarHBondContact O-N 3.21Å
152	S	87.4	Confident	81.7	Confident	48 Å²	48	64.3 Å²	64.3	34%	0.336	35%	0.347	S	S	.	.	H	α-helix	trans	-67.5	-42.6	176.9	-65.4	0	0	0	0	112.3	Y148 Y149 Y150 A155 L156	Y148-S152 WeakPolarHBondContact O-CB 3.23Å; Y148-S152 PolarHBondContact O-N 3.38Å; Y148-S152 PolarHBondContact O-OG 3.47Å; Y149-S152 PolarHBondContact O-N 3.46Å; Y150-S152 VanDerWaalsContact C-N 3.35Å; Y150-S152 PolarHBondContact O-N 3.04Å; S152-A155 PolarHBondContact O-N 3.36Å; S152-L156 WeakPolarHBondContact O-CB 3.36Å; S152-L156 PolarHBondContact O-N 2.95Å
153	V	88.1	Confident	83.8	Confident	6 Å²	6	61.2 Å²	61.2	4%	0.036	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-39.5	174.5	173.3	0	0	0	0	111.1	Y149 Y150 L156 Y157 L382 V383 L386	Y149-V153 HydrophobicContact CD2-CG2 4.29Å; Y149-V153 HydrophobicContact CE1-CG2 4.2Å; Y149-V153 HydrophobicContact CE2-CG2 3.72Å; Y149-V153 WeakPolarHBondContact O-CG2 3.29Å; Y149-V153 PolarHBondContact O-N 3.25Å; Y150-V153 PolarHBondContact O-N 3.49Å; V153-L156 WeakPolarHBondContact O-CB 3.18Å; V153-L156 PolarHBondContact O-N 2.85Å; V153-Y157 HydrophobicContact CG1-CD1 4.04Å; V153-Y157 HydrophobicContact CG1-CE1 4.35Å; V153-Y157 WeakPolarHBondContact O-CD1 3.45Å; V153-Y157 PolarHBondContact O-N 3.12Å; V153-L382 HydrophobicContact CB-CD2 4.46Å; V153-L382 HydrophobicContact CG1-CD2 3.89Å; V153-L382 HydrophobicContact CG1-CG 4.08Å; V153-L382 HydrophobicContact CG2-CD2 4.44Å; V153-V383 HydrophobicContact CG2-CG2 3.82Å; V153-L386 HydrophobicContact CG1-CD2 4.34Å
154	K	88	Confident	85.8	Confident	48 Å²	48	57.5 Å²	57.5	21%	0.209	31%	0.314	C	S	.	.	H	α-helix	trans	-56.9	-53.3	172.2	178.6	177.5	177.8	-178	0	111.6	Y150 L151 L156 Y157 T158 Y211	Y150-K154 VanDerWaalsContact O-CB 3.29Å; Y150-K154 WeakPolarHBondContact O-CB 3.49Å; Y150-K154 PolarHBondContact O-N 3.4Å; L151-K154 WeakPolarHBondContact O-CB 3.21Å; L151-K154 PolarHBondContact O-N 3.42Å; K154-L156 VanDerWaalsContact C-N 3.3Å; K154-L156 PolarHBondContact O-N 3.17Å; K154-Y157 VanDerWaalsContact CA-CE1 3.46Å; K154-Y157 HydrophobicContact CB-CE1 4.2Å; K154-Y157 HydrophobicContact CG-CE2 4.41Å; K154-Y157 PolarHBondContact O-N 3.36Å; K154-T158 WeakPolarHBondContact O-CB 3.48Å; K154-T158 PolarHBondContact O-N 3.42Å; K154-T158 PolarHBondContact O-OG1 3Å; K154-Y211 HydrophobicContact CD-CD2 4.25Å; K154-Y211 HydrophobicContact CD-CE1 4.32Å; K154-Y211 HydrophobicContact CD-CE2 3.75Å; K154-Y211 VanDerWaalsContact CE-CD2 3.47Å; K154-Y211 VanDerWaalsContact CE-CE2 3.48Å
155	A	89.3	Confident	87.6	Confident	56 Å²	56	56.7 Å²	56.7	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-56.6	-43.2	176.5	0	0	0	0	0	112.3	L151 S152 T158 V159	L151-A155 PolarHBondContact O-N 3.21Å; S152-A155 PolarHBondContact O-N 3.36Å; A155-T158 PolarHBondContact O-N 2.99Å; A155-V159 WeakPolarHBondContact O-CG2 3.43Å; A155-V159 PolarHBondContact O-N 2.94Å
156	L	91.1	Very high	89	Confident	66 Å²	66	57.8 Å²	57.8	35%	0.346	31%	0.306	S	S	.	.	H	α-helix	trans	-59.7	-53.6	178.2	179	63	0	0	0	112.3	S152 V153 K154 V159 G160 F391	S152-L156 WeakPolarHBondContact O-CB 3.36Å; S152-L156 PolarHBondContact O-N 2.95Å; V153-L156 WeakPolarHBondContact O-CB 3.18Å; V153-L156 PolarHBondContact O-N 2.85Å; K154-L156 VanDerWaalsContact C-N 3.3Å; K154-L156 PolarHBondContact O-N 3.17Å; L156-V159 PolarHBondContact O-N 3.46Å; L156-G160 PolarHBondContact O-N 3.09Å; L156-F391 HydrophobicContact CD1-CE2 4.19Å
157	Y	93.2	Very high	90.4	Very high	18 Å²	18	56.4 Å²	56.4	7%	0.071	30%	0.301	C	S	.	.	H	α-helix	trans	-71	-31.1	-179.4	70	-119.4	0	0	0	112.5	V153 K154 G160 Y161 V203 D207 L386	V153-Y157 HydrophobicContact CG1-CD1 4.04Å; V153-Y157 HydrophobicContact CG1-CE1 4.35Å; V153-Y157 WeakPolarHBondContact O-CD1 3.45Å; V153-Y157 PolarHBondContact O-N 3.12Å; K154-Y157 VanDerWaalsContact CA-CE1 3.46Å; K154-Y157 HydrophobicContact CB-CE1 4.2Å; K154-Y157 HydrophobicContact CG-CE2 4.41Å; K154-Y157 PolarHBondContact O-N 3.36Å; Y157-G160 PolarHBondContact O-N 3.02Å; Y157-Y161 HydrophobicContact CD2-CD2 4.07Å; Y157-Y161 HydrophobicContact CD2-CE2 4.17Å; Y157-Y161 HydrophobicContact CG-CE2 4.36Å; Y157-Y161 WeakPolarHBondContact O-CB 3.32Å; Y157-Y161 WeakPolarHBondContact O-CD2 3.38Å; Y157-Y161 PolarHBondContact O-N 2.83Å; Y157-V203 HydrophobicContact CD2-CG1 4.1Å; Y157-V203 HydrophobicContact CE2-CG1 3.94Å; Y157-D207 WeakPolarHBondContact CE2-OD2 3.08Å; Y157-D207 PolarHBondContact OH-OD1 2.72Å; Y157-L386 HydrophobicContact CD1-CB 4.23Å; Y157-L386 HydrophobicContact CD1-CD2 3.71Å; Y157-L386 HydrophobicContact CD1-CG 4.5Å; Y157-L386 HydrophobicContact CE1-CD2 3.94Å
158	T	92.7	Very high	91.6	Very high	47 Å²	47	50.8 Å²	50.8	29%	0.288	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-44.7	174.9	-62.4	0	0	0	0	111.1	K154 A155 S162 F204	K154-T158 WeakPolarHBondContact O-CB 3.48Å; K154-T158 PolarHBondContact O-N 3.42Å; K154-T158 PolarHBondContact O-OG1 3Å; A155-T158 PolarHBondContact O-N 2.99Å; T158-S162 VanDerWaalsContact O-CB 3.24Å; T158-S162 WeakPolarHBondContact O-CB 3.3Å; T158-S162 PolarHBondContact O-N 3.29Å; T158-S162 PolarHBondContact O-OG 3.47Å; T158-F204 HydrophobicContact CG2-CE1 4.15Å
159	V	95.1	Very high	92.3	Very high	85 Å²	85	45.9 Å²	45.9	52%	0.515	26%	0.258	S	S	.	.	H	α-helix	trans	-65.8	-41.7	175	172.5	0	0	0	0	111.4	A155 L156 S162 T163 F391	A155-V159 WeakPolarHBondContact O-CG2 3.43Å; A155-V159 PolarHBondContact O-N 2.94Å; L156-V159 PolarHBondContact O-N 3.46Å; V159-S162 PolarHBondContact O-N 3.46Å; V159-T163 WeakPolarHBondContact O-CB 3.18Å; V159-T163 PolarHBondContact O-N 3.27Å; V159-T163 PolarHBondContact O-OG1 3.35Å; V159-F391 HydrophobicContact CG1-CZ 4.27Å
160	G	95.6	Very high	93	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-53.7	178.4	0	0	0	0	0	113.1	L156 Y157 S162 T163 S164 S390	L156-G160 PolarHBondContact O-N 3.09Å; Y157-G160 PolarHBondContact O-N 3.02Å; G160-S162 VanDerWaalsContact C-N 3.31Å; G160-S162 PolarHBondContact O-N 3.35Å; G160-T163 PolarHBondContact O-N 3.45Å; G160-S164 WeakPolarHBondContact O-CB 3.24Å; G160-S164 PolarHBondContact O-N 3.01Å; G160-S164 PolarHBondContact O-OG 3.01Å; G160-S390 CarbonylContact C-O 3.55Å; G160-S390 VanDerWaalsContact C-O 3.29Å
161	Y	95.9	Very high	93.7	Very high	16 Å²	16	42 Å²	42	6%	0.063	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-35	177.4	-73.1	-56	0	0	0	112.2	Y157 S164 L165 R199 A200 V203	Y157-Y161 HydrophobicContact CD2-CD2 4.07Å; Y157-Y161 HydrophobicContact CD2-CE2 4.17Å; Y157-Y161 HydrophobicContact CG-CE2 4.36Å; Y157-Y161 WeakPolarHBondContact O-CB 3.32Å; Y157-Y161 WeakPolarHBondContact O-CD2 3.38Å; Y157-Y161 PolarHBondContact O-N 2.83Å; Y161-S164 PolarHBondContact O-N 3Å; Y161-L165 VanDerWaalsContact O-CB 3.24Å; Y161-L165 WeakPolarHBondContact O-CB 3.48Å; Y161-L165 PolarHBondContact O-N 3.02Å; Y161-R199 HydrophobicContact CE1-CG 4.16Å; Y161-R199 PolarHBondContact OH-NE 2.91Å; Y161-R199 VanDerWaalsContact OH-NE 3.07Å; Y161-R199 PolarHBondContact OH-NH2 2.92Å; Y161-A200 HydrophobicContact CD1-CB 3.98Å; Y161-A200 HydrophobicContact CG-CB 4.26Å; Y161-V203 HydrophobicContact CD2-CB 4.3Å; Y161-V203 HydrophobicContact CD2-CG1 3.87Å; Y161-V203 HydrophobicContact CD2-CG2 4.36Å; Y161-V203 HydrophobicContact CE2-CB 4.22Å; Y161-V203 HydrophobicContact CE2-CG1 3.89Å; Y161-V203 HydrophobicContact CE2-CG2 3.8Å
162	S	96.5	Very high	94.2	Very high	48 Å²	48	38 Å²	38	34%	0.336	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-47	174.8	-63.8	0	0	0	0	111.6	T158 V159 G160 L165 V166 F204	T158-S162 VanDerWaalsContact O-CB 3.24Å; T158-S162 WeakPolarHBondContact O-CB 3.3Å; T158-S162 PolarHBondContact O-N 3.29Å; T158-S162 PolarHBondContact O-OG 3.47Å; V159-S162 PolarHBondContact O-N 3.46Å; G160-S162 VanDerWaalsContact C-N 3.31Å; G160-S162 PolarHBondContact O-N 3.35Å; S162-L165 PolarHBondContact O-N 3.15Å; S162-V166 WeakPolarHBondContact O-CG2 3.42Å; S162-V166 PolarHBondContact O-N 3.42Å; S162-V166 VanDerWaalsContact O-N 3.1Å; S162-F204 WeakPolarHBondContact OG-CZ 3.41Å
163	T	96.3	Very high	94.5	Very high	49 Å²	49	40 Å²	40	30%	0.301	24%	0.239	S	C	.	.	H	α-helix	trans	-63.2	-43.7	178	-56.1	0	0	0	0	111.2	V159 G160 T167 F394	V159-T163 WeakPolarHBondContact O-CB 3.18Å; V159-T163 PolarHBondContact O-N 3.27Å; V159-T163 PolarHBondContact O-OG1 3.35Å; G160-T163 PolarHBondContact O-N 3.45Å; T163-T167 WeakPolarHBondContact O-CG2 3.43Å; T163-T167 PolarHBondContact O-N 2.9Å; T163-T167 PolarHBondContact O-OG1 2.84Å; T163-F394 HydrophobicContact CG2-CB 4.37Å; T163-F394 HydrophobicContact CG2-CD2 3.82Å; T163-F394 HydrophobicContact CG2-CE2 4.29Å; T163-F394 HydrophobicContact CG2-CG 4.07Å
164	S	96.8	Very high	94.8	Very high	4 Å²	4	40.8 Å²	40.8	3%	0.028	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-47.9	172.9	-71	0	0	0	0	111.9	G160 Y161 V166 T167 L168 S390 F394	G160-S164 WeakPolarHBondContact O-CB 3.24Å; G160-S164 PolarHBondContact O-N 3.01Å; G160-S164 PolarHBondContact O-OG 3.01Å; Y161-S164 PolarHBondContact O-N 3Å; S164-V166 PolarHBondContact O-N 3.06Å; S164-T167 PolarHBondContact O-N 3.36Å; S164-T167 PolarHBondContact O-OG1 3.39Å; S164-L168 WeakPolarHBondContact O-CB 3.43Å; S164-L168 WeakPolarHBondContact O-CD1 3.29Å; S164-L168 WeakPolarHBondContact O-CG 3.45Å; S164-L168 PolarHBondContact O-N 3.24Å; S164-S390 PolarHBondContact OG-O 3.17Å; S164-F394 PolarHBondContact OG-N 3.21Å
165	L	97	Very high	95	Very high	35 Å²	35	38.7 Å²	38.7	18%	0.183	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-44.7	-176.6	-177.4	59.3	0	0	0	112.5	Y161 S162 T169 M197 A200 I201 F204	Y161-L165 VanDerWaalsContact O-CB 3.24Å; Y161-L165 WeakPolarHBondContact O-CB 3.48Å; Y161-L165 PolarHBondContact O-N 3.02Å; S162-L165 PolarHBondContact O-N 3.15Å; L165-T169 VanDerWaalsContact O-CB 3.26Å; L165-T169 WeakPolarHBondContact O-CB 3.4Å; L165-T169 PolarHBondContact O-N 3.43Å; L165-T169 PolarHBondContact O-OG1 3.3Å; L165-M197 HydrophobicContact CD1-CB 4.02Å; L165-M197 HydrophobicContact CD1-CE 4.13Å; L165-M197 HydrophobicContact CD1-CG 3.93Å; L165-A200 HydrophobicContact CB-CB 4.39Å; L165-I201 HydrophobicContact CD1-CD1 4.3Å; L165-I201 HydrophobicContact CD1-CG1 4.29Å; L165-I201 HydrophobicContact CD2-CG1 4.22Å; L165-F204 HydrophobicContact CD2-CE2 4.04Å
166	V	97.3	Very high	95.2	Very high	97 Å²	97	39 Å²	39	59%	0.588	23%	0.232	S	C	*	.	H	α-helix	trans	-64	-42.8	178.3	172.9	0	0	0	0	111.5	S162 S164 T170	S162-V166 WeakPolarHBondContact O-CG2 3.42Å; S162-V166 PolarHBondContact O-N 3.42Å; S162-V166 VanDerWaalsContact O-N 3.1Å; S164-V166 PolarHBondContact O-N 3.06Å; V166-T170 WeakPolarHBondContact O-CB 3.29Å; V166-T170 PolarHBondContact O-N 3.46Å; V166-T170 VanDerWaalsContact O-N 3.13Å; V166-T170 PolarHBondContact O-OG1 3.38Å
167	T	97.2	Very high	95.2	Very high	27 Å²	27	43.9 Å²	43.9	17%	0.166	25%	0.246	C	C	.	.	H	α-helix	trans	-76.2	-39.4	-177.8	53.3	0	0	0	0	112.8	T163 S164 T170 A171 F394	T163-T167 WeakPolarHBondContact O-CG2 3.43Å; T163-T167 PolarHBondContact O-N 2.9Å; T163-T167 PolarHBondContact O-OG1 2.84Å; S164-T167 PolarHBondContact O-N 3.36Å; S164-T167 PolarHBondContact O-OG1 3.39Å; T167-T170 PolarHBondContact O-N 3.03Å; T167-A171 WeakPolarHBondContact O-CB 3.15Å; T167-A171 PolarHBondContact O-N 3.32Å; T167-F394 HydrophobicContact CG2-CD2 3.79Å; T167-F394 HydrophobicContact CG2-CE2 4.13Å
168	L	96.9	Very high	95.1	Very high	1 Å²	1	44 Å²	44	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-43.1	171.8	-75	165.7	0	0	0	112.1	S164 T170 A171 M172 F193 F196 M197 A397	S164-L168 WeakPolarHBondContact O-CB 3.43Å; S164-L168 WeakPolarHBondContact O-CD1 3.29Å; S164-L168 WeakPolarHBondContact O-CG 3.45Å; S164-L168 PolarHBondContact O-N 3.24Å; L168-T170 VanDerWaalsContact C-N 3.33Å; L168-T170 PolarHBondContact O-N 2.67Å; L168-A171 PolarHBondContact O-N 2.69Å; L168-M172 WeakPolarHBondContact O-CB 3.46Å; L168-M172 PolarHBondContact O-N 3.26Å; L168-F193 HydrophobicContact CD2-CB 3.81Å; L168-F193 HydrophobicContact CD2-CD1 3.83Å; L168-F193 HydrophobicContact CD2-CD2 4.27Å; L168-F193 HydrophobicContact CD2-CG 3.69Å; L168-F196 HydrophobicContact CD1-CB 3.4Å; L168-F196 VanDerWaalsContact CD1-CB 3.4Å; L168-F196 HydrophobicContact CD1-CG 4.31Å; L168-M197 HydrophobicContact CB-CG 3.78Å; L168-M197 HydrophobicContact CB-SD 4.18Å; L168-M197 HydrophobicContact CD1-CG 4.21Å; L168-A397 HydrophobicContact CD2-CB 3.91Å; L168-A397 HydrophobicContact CG-CB 4.2Å
169	T	96.3	Very high	95	Very high	57 Å²	57	52 Å²	52	35%	0.35	27%	0.272	S	S	.	.	H	α-helix	trans	-59.4	-46.2	175.4	-58.9	0	0	0	0	110.7	L165 A171 M172 V173 M197	L165-T169 VanDerWaalsContact O-CB 3.26Å; L165-T169 WeakPolarHBondContact O-CB 3.4Å; L165-T169 PolarHBondContact O-N 3.43Å; L165-T169 PolarHBondContact O-OG1 3.3Å; T169-A171 PolarHBondContact O-N 3.04Å; T169-M172 PolarHBondContact O-N 2.89Å; T169-V173 WeakPolarHBondContact O-CG2 3.24Å; T169-V173 PolarHBondContact O-N 3.21Å; T169-M197 VanDerWaalsContact OG1-CE 3.31Å; T169-M197 WeakPolarHBondContact OG1-CE 3.24Å
170	T	95.9	Very high	94.7	Very high	66 Å²	66	54.6 Å²	54.6	41%	0.405	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-42.3	177.5	-57.7	0	0	0	0	111.8	V166 T167 L168 V173 I174 F402	V166-T170 WeakPolarHBondContact O-CB 3.29Å; V166-T170 PolarHBondContact O-N 3.46Å; V166-T170 VanDerWaalsContact O-N 3.13Å; V166-T170 PolarHBondContact O-OG1 3.38Å; T167-T170 PolarHBondContact O-N 3.03Å; L168-T170 VanDerWaalsContact C-N 3.33Å; L168-T170 PolarHBondContact O-N 2.67Å; T170-V173 PolarHBondContact O-N 3.35Å; T170-I174 HydrophobicContact CG2-CD1 4.38Å; T170-I174 WeakPolarHBondContact O-CG1 3.03Å; T170-I174 PolarHBondContact O-N 2.7Å; T170-I174 VanDerWaalsContact O-N 3.15Å; T170-F402 HydrophobicContact CG2-CE1 4.02Å; T170-F402 HydrophobicContact CG2-CZ 3.76Å
171	A	96.1	Very high	94.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-42.6	175.8	0	0	0	0	0	112.7	T167 L168 T169 V173 I174 L175 F193 A397 C401 F402	T167-A171 WeakPolarHBondContact O-CB 3.15Å; T167-A171 PolarHBondContact O-N 3.32Å; L168-A171 PolarHBondContact O-N 2.69Å; T169-A171 PolarHBondContact O-N 3.04Å; A171-V173 PolarHBondContact O-N 2.95Å; A171-I174 WeakPolarHBondContact O-CB 3.39Å; A171-I174 PolarHBondContact O-N 3.48Å; A171-L175 PolarHBondContact O-N 2.83Å; A171-F193 HydrophobicContact CB-CD2 4.15Å; A171-F193 HydrophobicContact CB-CE2 3.77Å; A171-A397 HydrophobicContact CB-CB 4.24Å; A171-C401 HydrophobicContact CB-CB 3.57Å; A171-F402 HydrophobicContact CB-CE2 4.06Å; A171-F402 HydrophobicContact CB-CZ 4.31Å
172	M	94.8	Very high	94.2	Very high	25 Å²	25	57 Å²	57	12%	0.123	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-43	174.8	-91	-56.6	-55.4	0	0	112.3	L168 T169 I174 L175 C176 M190 F193 M197	L168-M172 WeakPolarHBondContact O-CB 3.46Å; L168-M172 PolarHBondContact O-N 3.26Å; T169-M172 PolarHBondContact O-N 2.89Å; M172-I174 VanDerWaalsContact C-N 3.29Å; M172-I174 PolarHBondContact O-N 3.41Å; M172-L175 PolarHBondContact O-N 3.48Å; M172-C176 VanDerWaalsContact O-CB 3.3Å; M172-C176 WeakPolarHBondContact O-CB 3.18Å; M172-C176 PolarHBondContact O-N 2.82Å; M172-M190 HydrophobicContact CE-CB 4.28Å; M172-M190 HydrophobicContact CE-CE 3.78Å; M172-M190 HydrophobicContact CE-CG 4.21Å; M172-M190 HydrophobicContact SD-CB 3.79Å; M172-M190 HydrophobicContact SD-CG 3.73Å; M172-F193 HydrophobicContact CG-CB 4Å; M172-F193 HydrophobicContact CG-CD2 4.14Å; M172-F193 HydrophobicContact SD-CB 4.11Å; M172-F193 HydrophobicContact SD-CD2 4.17Å; M172-M197 HydrophobicContact CG-SD 4.17Å
173	V	94.6	Very high	93.9	Very high	90 Å²	90	57.4 Å²	57.4	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-61.1	-38.2	175.1	170	0	0	0	0	111.4	T169 T170 A171 R177	T169-V173 WeakPolarHBondContact O-CG2 3.24Å; T169-V173 PolarHBondContact O-N 3.21Å; T170-V173 PolarHBondContact O-N 3.35Å; A171-V173 PolarHBondContact O-N 2.95Å; V173-R177 WeakPolarHBondContact O-CB 3.45Å; V173-R177 PolarHBondContact O-N 3.32Å; V173-R177 VanDerWaalsContact O-N 3.14Å
174	I	94.3	Very high	93.6	Very high	22 Å²	22	55.5 Å²	55.5	11%	0.113	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-53.3	175.2	-70.3	166	0	0	0	110.8	T170 A171 M172 R177 F178 F402 V407	T170-I174 HydrophobicContact CG2-CD1 4.38Å; T170-I174 WeakPolarHBondContact O-CG1 3.03Å; T170-I174 PolarHBondContact O-N 2.7Å; T170-I174 VanDerWaalsContact O-N 3.15Å; A171-I174 WeakPolarHBondContact O-CB 3.39Å; A171-I174 PolarHBondContact O-N 3.48Å; M172-I174 VanDerWaalsContact C-N 3.29Å; M172-I174 PolarHBondContact O-N 3.41Å; I174-R177 PolarHBondContact O-N 3.24Å; I174-F178 HydrophobicContact CG2-CD2 3.89Å; I174-F178 HydrophobicContact CG2-CE2 4.07Å; I174-F178 VanDerWaalsContact O-CD2 3.25Å; I174-F178 WeakPolarHBondContact O-CD2 3.1Å; I174-F178 PolarHBondContact O-N 3.05Å; I174-F402 HydrophobicContact CD1-CD1 4.36Å; I174-F402 HydrophobicContact CD1-CE1 3.72Å; I174-F402 HydrophobicContact CD1-CZ 4.37Å; I174-V407 HydrophobicContact CG2-CG1 3.64Å
175	L	93	Very high	93.3	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-65.3	-43	-177.7	-65	-176.9	0	0	0	112.6	A171 M172 R177 L181 H182 M190 F193 V407	A171-L175 PolarHBondContact O-N 2.83Å; M172-L175 PolarHBondContact O-N 3.48Å; L175-R177 PolarHBondContact O-N 3.32Å; L175-L181 HydrophobicContact CD2-CD1 3.97Å; L175-H182 PolarHBondContact O-CD2 3.1Å; L175-H182 PolarHBondContact O-NE2 3.13Å; L175-M190 HydrophobicContact CB-CG 4.06Å; L175-M190 HydrophobicContact CB-SD 4.12Å; L175-M190 HydrophobicContact CD1-CG 3.84Å; L175-F193 HydrophobicContact CD1-CD2 4.21Å; L175-F193 HydrophobicContact CD1-CE2 3.61Å; L175-F193 HydrophobicContact CD1-CZ 4.31Å; L175-V407 HydrophobicContact CD2-CG2 4.45Å
176	C	92.9	Very high	93.1	Very high	64 Å²	64	58.3 Å²	58.3	43%	0.432	29%	0.286	S	S	.	.	H	α-helix	trans	-58.7	-48.1	174.7	-87	0	0	0	0	112.2	M172 H182 M190	M172-C176 VanDerWaalsContact O-CB 3.3Å; M172-C176 WeakPolarHBondContact O-CB 3.18Å; M172-C176 PolarHBondContact O-N 2.82Å; C176-H182 PolarHBondContact O-CE1 3.28Å; C176-H182 PolarHBondContact O-NE2 3.16Å; C176-H182 VanDerWaalsContact O-NE2 3.11Å; C176-M190 WeakPolarHBondContact SG-CE 3.45Å
177	R	91.5	Very high	92.9	Very high	167 Å²	167	55.8 Å²	55.8	63%	0.63	27%	0.267	S	S	*	.	H	α-helix	trans	-72.9	-35.6	-170.5	-169.4	-177	68.4	152.7	-3.1	113.4	V173 I174 L175 R179	V173-R177 WeakPolarHBondContact O-CB 3.45Å; V173-R177 PolarHBondContact O-N 3.32Å; V173-R177 VanDerWaalsContact O-N 3.14Å; I174-R177 PolarHBondContact O-N 3.24Å; L175-R177 PolarHBondContact O-N 3.32Å; R177-R179 PolarHBondContact O-N 2.87Å
178	F	91.3	Very high	92.8	Very high	21 Å²	21	54.5 Å²	54.5	9%	0.092	26%	0.259	C	S	.	.			trans	-89.1	85.3	-176.8	-70.2	-62.4	0	0	0	111.7	I174 K180 L181 I411 K414	I174-F178 HydrophobicContact CG2-CD2 3.89Å; I174-F178 HydrophobicContact CG2-CE2 4.07Å; I174-F178 VanDerWaalsContact O-CD2 3.25Å; I174-F178 WeakPolarHBondContact O-CD2 3.1Å; I174-F178 PolarHBondContact O-N 3.05Å; F178-K180 PolarHBondContact O-N 3.49Å; F178-L181 HydrophobicContact CB-CD1 3.8Å; F178-L181 HydrophobicContact CB-CG 3.96Å; F178-L181 HydrophobicContact CD2-CD1 4.31Å; F178-L181 HydrophobicContact CG-CD1 4.46Å; F178-L181 WeakPolarHBondContact O-CB 3.39Å; F178-L181 PolarHBondContact O-N 3Å; F178-I411 HydrophobicContact CE2-CG1 3.86Å; F178-I411 HydrophobicContact CZ-CG1 4.14Å; F178-K414 HydrophobicContact CE1-CB 4.01Å; F178-K414 HydrophobicContact CE1-CG 4.16Å; F178-K414 HydrophobicContact CZ-CB 4.45Å
179	R	90.5	Very high	92.6	Very high	216 Å²	216	54.7 Å²	54.7	82%	0.815	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-49.3	-23	179.8	-65.1	-175.1	72.1	174.2	3.2	116.3	R177 L181 H182	R177-R179 PolarHBondContact O-N 2.87Å; R179-L181 VanDerWaalsContact C-N 3.26Å; R179-L181 PolarHBondContact O-N 2.97Å; R179-H182 WeakPolarHBondContact O-CB 3.22Å; R179-H182 PolarHBondContact O-N 3.07Å
180	K	88.9	Confident	92.5	Very high	138 Å²	138	52.2 Å²	52.2	60%	0.6	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-70.4	-21.5	174.8	-177.8	175.2	160.4	-157.2	0	112.9	F178 H182 E410	F178-K180 PolarHBondContact O-N 3.49Å; K180-H182 VanDerWaalsContact C-N 3.29Å; K180-E410 WeakPolarHBondContact CD-OE1 3.03Å; K180-E410 WeakPolarHBondContact CE-OE1 3.19Å; K180-E410 IonicContact NZ-OE1 3.05Å; K180-E410 PolarHBondContact NZ-OE1 2.69Å
181	L	89.7	Confident	92.5	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.026	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-86	6.7	176.1	-55.7	179.1	0	0	0	112.9	L175 F178 R179 C183 N186 E406 V407 E410	L175-L181 HydrophobicContact CD2-CD1 3.97Å; F178-L181 HydrophobicContact CB-CD1 3.8Å; F178-L181 HydrophobicContact CB-CG 3.96Å; F178-L181 HydrophobicContact CD2-CD1 4.31Å; F178-L181 HydrophobicContact CG-CD1 4.46Å; F178-L181 WeakPolarHBondContact O-CB 3.39Å; F178-L181 PolarHBondContact O-N 3Å; R179-L181 VanDerWaalsContact C-N 3.26Å; R179-L181 PolarHBondContact O-N 2.97Å; L181-C183 PolarHBondContact O-N 3.36Å; L181-N186 VanDerWaalsContact O-CB 3.28Å; L181-N186 WeakPolarHBondContact O-CB 3.32Å; L181-N186 PolarHBondContact O-ND2 3.29Å; L181-E406 HydrophobicContact CD2-CB 4.39Å; L181-V407 HydrophobicContact CD1-CG1 4.43Å; L181-V407 HydrophobicContact CD1-CG2 4.01Å; L181-E410 HydrophobicContact CD2-CG 4.2Å
182	H	90.5	Very high	92.4	Very high	62 Å²	62	49.2 Å²	49.2	29%	0.287	23%	0.226	S	C	.	.			trans	-82.2	61.1	-175.3	-69.4	-172	0	0	0	112.4	L175 C176 R179 K180 F187	L175-H182 PolarHBondContact O-CD2 3.1Å; L175-H182 PolarHBondContact O-NE2 3.13Å; C176-H182 PolarHBondContact O-CE1 3.28Å; C176-H182 PolarHBondContact O-NE2 3.16Å; C176-H182 VanDerWaalsContact O-NE2 3.11Å; R179-H182 WeakPolarHBondContact O-CB 3.22Å; R179-H182 PolarHBondContact O-N 3.07Å; K180-H182 VanDerWaalsContact C-N 3.29Å; H182-F187 HydrophobicContact CB-CE2 4.07Å; H182-F187 HydrophobicContact CB-CZ 3.8Å
183	C	90.1	Very high	92.5	Very high	57 Å²	57	48 Å²	48	39%	0.385	22%	0.22	S	C	.	.			trans	-97.4	157.2	176.6	-58	0	0	0	0	111.3	L181 R185 N186 F187	L181-C183 PolarHBondContact O-N 3.36Å; C183-R185 VanDerWaalsContact C-N 3.33Å; C183-R185 PolarHBondContact O-N 3.37Å; C183-N186 PolarHBondContact O-N 3.14Å; C183-F187 VanDerWaalsContact O-CD2 3.22Å; C183-F187 WeakPolarHBondContact O-CD2 3.11Å; C183-F187 PolarHBondContact O-N 2.57Å; C183-F187 VanDerWaalsContact O-N 3.08Å
184	T	90.4	Very high	92.6	Very high	8 Å²	8	45.6 Å²	45.6	5%	0.049	21%	0.206	C	C	.	.	H	α-helix	trans	-52.3	-47.9	-178.9	-46.1	0	0	0	0	112.6	N186 F187 I188 E262 F266	T184-N186 VanDerWaalsContact C-N 3.34Å; T184-N186 PolarHBondContact O-N 3.08Å; T184-F187 PolarHBondContact O-N 2.77Å; T184-F187 VanDerWaalsContact O-N 3.14Å; T184-I188 PolarHBondContact O-N 2.95Å; T184-I188 VanDerWaalsContact O-N 3.16Å; T184-E262 WeakPolarHBondContact CB-OE2 3.27Å; T184-E262 HydrophobicContact CG2-CB 4.39Å; T184-E262 PolarHBondContact OG1-OE2 2.91Å; T184-F266 HydrophobicContact CG2-CB 3.88Å; T184-F266 HydrophobicContact CG2-CD2 3.92Å; T184-F266 HydrophobicContact CG2-CG 4.1Å
185	R	90.9	Very high	92.7	Very high	97 Å²	97	44.6 Å²	44.6	37%	0.366	20%	0.2	S	C	.	.	H	α-helix	trans	-50.5	-49.8	172.7	-178.3	-166.8	-56.2	130.2	2.3	112.7	C183 F187 I188 H189 Y250 E406	C183-R185 VanDerWaalsContact C-N 3.33Å; C183-R185 PolarHBondContact O-N 3.37Å; R185-F187 VanDerWaalsContact C-N 3.28Å; R185-F187 PolarHBondContact O-N 2.68Å; R185-I188 WeakPolarHBondContact O-CB 3.47Å; R185-I188 PolarHBondContact O-N 3.36Å; R185-I188 VanDerWaalsContact O-N 3.07Å; R185-H189 VanDerWaalsContact CG-NE2 3.3Å; R185-H189 WeakPolarHBondContact CG-NE2 3.45Å; R185-H189 PolarHBondContact O-N 3.31Å; R185-Y250 HydrophobicContact CB-CE1 3.96Å; R185-Y250 HydrophobicContact CG-CE1 4.12Å; R185-Y250 PolarHBondContact N-OH 2.93Å; R185-E406 IonicContact NH1-OE1 3.23Å
186	N	92.9	Very high	92.8	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.011	20%	0.201	C	C	.	.	H	α-helix	trans	-71.1	-26.2	-176.1	-65.3	-8.1	0	0	0	111.7	L181 C183 T184 H189 M190	L181-N186 VanDerWaalsContact O-CB 3.28Å; L181-N186 WeakPolarHBondContact O-CB 3.32Å; L181-N186 PolarHBondContact O-ND2 3.29Å; C183-N186 PolarHBondContact O-N 3.14Å; T184-N186 VanDerWaalsContact C-N 3.34Å; T184-N186 PolarHBondContact O-N 3.08Å; N186-H189 PolarHBondContact O-N 2.89Å; N186-M190 WeakPolarHBondContact O-CB 3.47Å; N186-M190 WeakPolarHBondContact O-CG 3.37Å; N186-M190 PolarHBondContact O-N 3.3Å
187	F	93.3	Very high	93	Very high	43 Å²	43	43.4 Å²	43.4	19%	0.189	19%	0.189	C	C	.	.	H	α-helix	trans	-69.4	-33.1	168.8	-69.6	-66.3	0	0	0	113	H182 C183 T184 R185 M190 N191 F266	H182-F187 HydrophobicContact CB-CE2 4.07Å; H182-F187 HydrophobicContact CB-CZ 3.8Å; C183-F187 VanDerWaalsContact O-CD2 3.22Å; C183-F187 WeakPolarHBondContact O-CD2 3.11Å; C183-F187 PolarHBondContact O-N 2.57Å; C183-F187 VanDerWaalsContact O-N 3.08Å; T184-F187 PolarHBondContact O-N 2.77Å; T184-F187 VanDerWaalsContact O-N 3.14Å; R185-F187 VanDerWaalsContact C-N 3.28Å; R185-F187 PolarHBondContact O-N 2.68Å; F187-M190 HydrophobicContact CD1-SD 4.03Å; F187-M190 HydrophobicContact CE1-SD 4.41Å; F187-N191 PolarHBondContact O-N 3Å; F187-N191 VanDerWaalsContact O-N 3.13Å; F187-N191 PolarHBondContact O-ND2 3.45Å; F187-F266 HydrophobicContact CB-CD2 4.45Å; F187-F266 HydrophobicContact CB-CE2 3.46Å; F187-F266 VanDerWaalsContact CB-CE2 3.46Å; F187-F266 HydrophobicContact CB-CZ 3.61Å; F187-F266 HydrophobicContact CG-CZ 4.4Å
188	I	93.4	Very high	93.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-51.4	169.6	-63	-66.9	0	0	0	109.7	T184 R185 M190 N191 L192 W243 I246 E247 Y250 F266	T184-I188 PolarHBondContact O-N 2.95Å; T184-I188 VanDerWaalsContact O-N 3.16Å; R185-I188 WeakPolarHBondContact O-CB 3.47Å; R185-I188 PolarHBondContact O-N 3.36Å; R185-I188 VanDerWaalsContact O-N 3.07Å; I188-M190 VanDerWaalsContact C-N 3.29Å; I188-M190 PolarHBondContact O-N 3.28Å; I188-N191 PolarHBondContact O-N 3.4Å; I188-N191 VanDerWaalsContact O-N 3.1Å; I188-L192 PolarHBondContact O-N 3.34Å; I188-W243 HydrophobicContact CD1-CZ3 4.1Å; I188-W243 HydrophobicContact CG2-CZ3 4.46Å; I188-I246 HydrophobicContact CD1-CG2 4.4Å; I188-E247 HydrophobicContact CG2-CB 4.41Å; I188-Y250 HydrophobicContact CG1-CD1 4.18Å; I188-Y250 HydrophobicContact CG1-CE1 4.42Å; I188-Y250 HydrophobicContact CG1-CG 4.27Å; I188-Y250 HydrophobicContact CG2-CD1 4.48Å; I188-F266 HydrophobicContact CD1-CD2 3.65Å; I188-F266 HydrophobicContact CD1-CE2 3.85Å; I188-F266 HydrophobicContact CG1-CD2 4.06Å; I188-F266 HydrophobicContact CG1-CE2 4.23Å
189	H	93.9	Very high	93.4	Very high	5 Å²	5	36.2 Å²	36.2	2%	0.023	16%	0.163	C	C	.	.	H	α-helix	trans	-57.1	-39.6	176.2	-59	-33.5	0	0	0	112.3	R185 N186 L192 F193 E247 Y400	R185-H189 VanDerWaalsContact CG-NE2 3.3Å; R185-H189 WeakPolarHBondContact CG-NE2 3.45Å; R185-H189 PolarHBondContact O-N 3.31Å; N186-H189 PolarHBondContact O-N 2.89Å; H189-L192 PolarHBondContact O-N 3.02Å; H189-F193 HydrophobicContact CB-CE1 4.2Å; H189-F193 HydrophobicContact CB-CZ 4.36Å; H189-F193 WeakPolarHBondContact O-CB 3.15Å; H189-F193 WeakPolarHBondContact O-CD1 3.3Å; H189-F193 WeakPolarHBondContact O-CG 3.42Å; H189-F193 PolarHBondContact O-N 3.22Å; H189-E247 IonicContact CE1-OE1 3.7Å; H189-E247 PolarHBondContact CE1-OE1 3.03Å; H189-E247 IonicContact CG-OE1 3.83Å; H189-E247 IonicContact ND1-OE1 3.06Å; H189-E247 PolarHBondContact ND1-OE1 2.96Å; H189-Y400 AromaticContact CE1-CD2 3.45Å; H189-Y400 VanDerWaalsContact CE1-CD2 3.45Å; H189-Y400 WeakPolarHBondContact CE1-CD2 3.13Å; H189-Y400 AromaticContact CE1-CE1 3.86Å; H189-Y400 AromaticContact CE1-CE2 3.12Å; H189-Y400 WeakPolarHBondContact CE1-CE2 3.3Å; H189-Y400 AromaticContact CE1-CG 3.91Å; H189-Y400 AromaticContact CE1-CZ 3.35Å; H189-Y400 AromaticContact CG-CD2 3.94Å; H189-Y400 AromaticContact ND1-CD2 3.48Å; H189-Y400 WeakPolarHBondContact ND1-CD2 3.4Å; H189-Y400 AromaticContact ND1-CE2 3.41Å; H189-Y400 WeakPolarHBondContact ND1-CE2 3.43Å; H189-Y400 AromaticContact NE2-CD1 3.9Å; H189-Y400 AromaticContact NE2-CD2 3.89Å; H189-Y400 AromaticContact NE2-CE1 3.94Å; H189-Y400 AromaticContact NE2-CE2 3.89Å; H189-Y400 AromaticContact NE2-CG 3.88Å; H189-Y400 AromaticContact NE2-CZ 3.91Å
190	M	94	Very high	93.7	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-63.9	-39.6	176.6	-73.1	165	79.2	0	0	112.6	M1 M172 L175 C176 N186 F187 I188 V194	M1-M190 HydrophobicContact CE-CE 4.03Å; M172-M190 HydrophobicContact CE-CB 4.28Å; M172-M190 HydrophobicContact CE-CE 3.78Å; M172-M190 HydrophobicContact CE-CG 4.21Å; M172-M190 HydrophobicContact SD-CB 3.79Å; M172-M190 HydrophobicContact SD-CG 3.73Å; L175-M190 HydrophobicContact CB-CG 4.06Å; L175-M190 HydrophobicContact CB-SD 4.12Å; L175-M190 HydrophobicContact CD1-CG 3.84Å; C176-M190 WeakPolarHBondContact SG-CE 3.45Å; N186-M190 WeakPolarHBondContact O-CB 3.47Å; N186-M190 WeakPolarHBondContact O-CG 3.37Å; N186-M190 PolarHBondContact O-N 3.3Å; F187-M190 HydrophobicContact CD1-SD 4.03Å; F187-M190 HydrophobicContact CE1-SD 4.41Å; I188-M190 VanDerWaalsContact C-N 3.29Å; I188-M190 PolarHBondContact O-N 3.28Å; M190-V194 VanDerWaalsContact O-CG2 3.32Å; M190-V194 WeakPolarHBondContact O-CG2 3.43Å; M190-V194 PolarHBondContact O-N 2.83Å
191	N	95.6	Very high	94	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-66.8	-42.7	173.7	-74.7	-38.1	0	0	0	111.4	F187 I188 F193 V194 S195 W243	F187-N191 PolarHBondContact O-N 3Å; F187-N191 VanDerWaalsContact O-N 3.13Å; F187-N191 PolarHBondContact O-ND2 3.45Å; I188-N191 PolarHBondContact O-N 3.4Å; I188-N191 VanDerWaalsContact O-N 3.1Å; N191-F193 PolarHBondContact O-N 3.45Å; N191-V194 PolarHBondContact O-N 3.22Å; N191-S195 PolarHBondContact O-N 3.46Å; N191-W243 HydrophobicContact CB-CD2 3.86Å; N191-W243 HydrophobicContact CB-CE3 3.67Å; N191-W243 HydrophobicContact CB-CH2 3.48Å; N191-W243 VanDerWaalsContact CB-CH2 3.48Å; N191-W243 HydrophobicContact CB-CZ2 3.65Å; N191-W243 HydrophobicContact CB-CZ3 3.47Å; N191-W243 VanDerWaalsContact CB-CZ3 3.47Å; N191-W243 WeakPolarHBondContact ND2-CH2 3.08Å
192	L	94.5	Very high	94.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.3	-45.6	174.5	177.6	66.7	0	0	0	111.5	I188 H189 V194 S195 F196 W243 L244 E247 V396	I188-L192 PolarHBondContact O-N 3.34Å; H189-L192 PolarHBondContact O-N 3.02Å; L192-V194 VanDerWaalsContact C-N 3.31Å; L192-V194 PolarHBondContact O-N 3.4Å; L192-S195 WeakPolarHBondContact O-CB 3.48Å; L192-S195 PolarHBondContact O-N 2.69Å; L192-S195 PolarHBondContact O-OG 3.44Å; L192-F196 HydrophobicContact CD1-CD2 4.05Å; L192-F196 HydrophobicContact CD1-CE2 3.7Å; L192-F196 HydrophobicContact CD2-CE2 4.24Å; L192-F196 HydrophobicContact CG-CD2 4Å; L192-F196 HydrophobicContact CG-CE2 3.84Å; L192-F196 WeakPolarHBondContact O-CD2 3.33Å; L192-F196 PolarHBondContact O-N 3.28Å; L192-W243 HydrophobicContact CD1-CB 3.78Å; L192-L244 HydrophobicContact CD1-CD2 3.87Å; L192-L244 HydrophobicContact CD1-CG 4.07Å; L192-E247 VanDerWaalsContact CD2-CD 3.47Å; L192-E247 WeakPolarHBondContact CD2-OE1 3.47Å; L192-E247 WeakPolarHBondContact CD2-OE2 3.32Å; L192-V396 HydrophobicContact CD2-CG1 4.04Å
193	F	96.2	Very high	94.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.2	-42.9	177.4	-68.4	7.3	0	0	0	110.8	L168 A171 M172 L175 H189 N191 S195 F196 M197 V396 C401	L168-F193 HydrophobicContact CD2-CB 3.81Å; L168-F193 HydrophobicContact CD2-CD1 3.83Å; L168-F193 HydrophobicContact CD2-CD2 4.27Å; L168-F193 HydrophobicContact CD2-CG 3.69Å; A171-F193 HydrophobicContact CB-CD2 4.15Å; A171-F193 HydrophobicContact CB-CE2 3.77Å; M172-F193 HydrophobicContact CG-CB 4Å; M172-F193 HydrophobicContact CG-CD2 4.14Å; M172-F193 HydrophobicContact SD-CB 4.11Å; M172-F193 HydrophobicContact SD-CD2 4.17Å; L175-F193 HydrophobicContact CD1-CD2 4.21Å; L175-F193 HydrophobicContact CD1-CE2 3.61Å; L175-F193 HydrophobicContact CD1-CZ 4.31Å; H189-F193 HydrophobicContact CB-CE1 4.2Å; H189-F193 HydrophobicContact CB-CZ 4.36Å; H189-F193 WeakPolarHBondContact O-CB 3.15Å; H189-F193 WeakPolarHBondContact O-CD1 3.3Å; H189-F193 WeakPolarHBondContact O-CG 3.42Å; H189-F193 PolarHBondContact O-N 3.22Å; N191-F193 PolarHBondContact O-N 3.45Å; F193-S195 VanDerWaalsContact C-N 3.34Å; F193-S195 PolarHBondContact O-N 3.01Å; F193-F196 PolarHBondContact O-N 3.25Å; F193-M197 VanDerWaalsContact O-CG 3.29Å; F193-M197 WeakPolarHBondContact O-CG 3.48Å; F193-M197 PolarHBondContact O-N 3.35Å; F193-V396 HydrophobicContact CD1-CG1 4Å; F193-V396 HydrophobicContact CE1-CG1 3.63Å; F193-C401 HydrophobicContact CE2-CB 4.43Å
194	V	96.4	Very high	94.5	Very high	39 Å²	39	19.5 Å²	19.5	24%	0.236	9%	0.092	C	C	.	.	H	α-helix	trans	-62.4	-38.5	173.8	170	0	0	0	0	111.6	M190 N191 L192 F196 M197 L198 W274	M190-V194 VanDerWaalsContact O-CG2 3.32Å; M190-V194 WeakPolarHBondContact O-CG2 3.43Å; M190-V194 PolarHBondContact O-N 2.83Å; N191-V194 PolarHBondContact O-N 3.22Å; L192-V194 VanDerWaalsContact C-N 3.31Å; L192-V194 PolarHBondContact O-N 3.4Å; V194-F196 PolarHBondContact O-N 3.02Å; V194-M197 PolarHBondContact O-N 3Å; V194-L198 HydrophobicContact CG1-CD1 3.98Å; V194-L198 HydrophobicContact CG1-CG 4.33Å; V194-L198 WeakPolarHBondContact O-CB 3.38Å; V194-L198 WeakPolarHBondContact O-CG 3.16Å; V194-L198 PolarHBondContact O-N 2.99Å; V194-W274 HydrophobicContact CG1-CH2 4.06Å; V194-W274 HydrophobicContact CG1-CZ2 4.19Å
195	S	96.3	Very high	94.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.8	-39.9	176	82.5	0	0	0	0	112.7	N191 L192 F193 L198 R199 N240	N191-S195 PolarHBondContact O-N 3.46Å; L192-S195 WeakPolarHBondContact O-CB 3.48Å; L192-S195 PolarHBondContact O-N 2.69Å; L192-S195 PolarHBondContact O-OG 3.44Å; F193-S195 VanDerWaalsContact C-N 3.34Å; F193-S195 PolarHBondContact O-N 3.01Å; S195-L198 PolarHBondContact O-N 2.81Å; S195-R199 WeakPolarHBondContact O-CB 3.35Å; S195-R199 PolarHBondContact O-N 2.88Å; S195-N240 PolarHBondContact OG-ND2 3.17Å
196	F	96.1	Very high	94.3	Very high	7 Å²	7	19.1 Å²	19.1	3%	0.031	9%	0.094	C	C	.	.	H	α-helix	trans	-68.6	-39.8	174.1	-81.9	-67.1	0	0	0	112.3	L168 L192 F193 V194 L198 R199 A200 N240 L244 Q392 V396	L168-F196 HydrophobicContact CD1-CB 3.4Å; L168-F196 VanDerWaalsContact CD1-CB 3.4Å; L168-F196 HydrophobicContact CD1-CG 4.31Å; L192-F196 HydrophobicContact CD1-CD2 4.05Å; L192-F196 HydrophobicContact CD1-CE2 3.7Å; L192-F196 HydrophobicContact CD2-CE2 4.24Å; L192-F196 HydrophobicContact CG-CD2 4Å; L192-F196 HydrophobicContact CG-CE2 3.84Å; L192-F196 WeakPolarHBondContact O-CD2 3.33Å; L192-F196 PolarHBondContact O-N 3.28Å; F193-F196 PolarHBondContact O-N 3.25Å; V194-F196 PolarHBondContact O-N 3.02Å; F196-L198 VanDerWaalsContact C-N 3.34Å; F196-R199 PolarHBondContact O-N 2.93Å; F196-A200 WeakPolarHBondContact O-CB 3.29Å; F196-A200 PolarHBondContact O-N 3.38Å; F196-N240 VanDerWaalsContact CD1-ND2 3.26Å; F196-N240 WeakPolarHBondContact CD1-ND2 3.38Å; F196-N240 WeakPolarHBondContact CE1-ND2 3.4Å; F196-N240 WeakPolarHBondContact CG-ND2 3.18Å; F196-L244 HydrophobicContact CE2-CD2 4.15Å; F196-L244 HydrophobicContact CZ-CD1 4.47Å; F196-L244 HydrophobicContact CZ-CD2 3.87Å; F196-L244 HydrophobicContact CZ-CG 4.49Å; F196-Q392 HydrophobicContact CE1-CB 4Å; F196-Q392 HydrophobicContact CE1-CG 4.01Å; F196-Q392 HydrophobicContact CZ-CB 4.22Å; F196-Q392 HydrophobicContact CZ-CG 3.76Å; F196-V396 HydrophobicContact CE2-CB 4.36Å; F196-V396 HydrophobicContact CE2-CG1 4.31Å; F196-V396 HydrophobicContact CE2-CG2 4.1Å; F196-V396 HydrophobicContact CZ-CG2 4.41Å
197	M	96.4	Very high	94	Very high	36 Å²	36	19.8 Å²	19.8	18%	0.177	10%	0.098	C	C	.	.	H	α-helix	trans	-62.2	-42.6	174.6	-70	176.7	62.6	0	0	111.1	L165 L168 T169 M172 F193 V194 A200 I201	L165-M197 HydrophobicContact CD1-CB 4.02Å; L165-M197 HydrophobicContact CD1-CE 4.13Å; L165-M197 HydrophobicContact CD1-CG 3.93Å; L168-M197 HydrophobicContact CB-CG 3.78Å; L168-M197 HydrophobicContact CB-SD 4.18Å; L168-M197 HydrophobicContact CD1-CG 4.21Å; T169-M197 VanDerWaalsContact OG1-CE 3.31Å; T169-M197 WeakPolarHBondContact OG1-CE 3.24Å; M172-M197 HydrophobicContact CG-SD 4.17Å; F193-M197 VanDerWaalsContact O-CG 3.29Å; F193-M197 WeakPolarHBondContact O-CG 3.48Å; F193-M197 PolarHBondContact O-N 3.35Å; V194-M197 PolarHBondContact O-N 3Å; M197-A200 PolarHBondContact O-N 3.42Å; M197-I201 WeakPolarHBondContact O-CB 3.09Å; M197-I201 WeakPolarHBondContact O-CD1 3.45Å; M197-I201 VanDerWaalsContact O-CG1 3.23Å; M197-I201 WeakPolarHBondContact O-CG1 3.2Å; M197-I201 PolarHBondContact O-N 3.17Å
198	L	96.3	Very high	93.6	Very high	25 Å²	25	27 Å²	27	13%	0.131	12%	0.124	C	C	.	.	H	α-helix	trans	-63.4	-45.8	175	-75.5	172.4	0	0	0	111.9	V194 S195 F196 A200 I201 S202 F232 C236 W274	V194-L198 HydrophobicContact CG1-CD1 3.98Å; V194-L198 HydrophobicContact CG1-CG 4.33Å; V194-L198 WeakPolarHBondContact O-CB 3.38Å; V194-L198 WeakPolarHBondContact O-CG 3.16Å; V194-L198 PolarHBondContact O-N 2.99Å; S195-L198 PolarHBondContact O-N 2.81Å; F196-L198 VanDerWaalsContact C-N 3.34Å; L198-A200 PolarHBondContact O-N 2.91Å; L198-I201 PolarHBondContact O-N 2.9Å; L198-S202 WeakPolarHBondContact O-CB 3.39Å; L198-S202 PolarHBondContact O-N 3.09Å; L198-S202 PolarHBondContact O-OG 2.88Å; L198-F232 HydrophobicContact CD2-CZ 4.4Å; L198-C236 HydrophobicContact CB-CB 4.26Å; L198-W274 HydrophobicContact CD1-CH2 3.82Å; L198-W274 HydrophobicContact CD1-CZ3 3.85Å
199	R	96.1	Very high	92.8	Very high	11 Å²	11	28.2 Å²	28.2	4%	0.042	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-42.6	174.9	176.8	176.9	167.9	178.2	-1.7	112.4	Y161 S195 F196 S202 V203 V237 N240 Y366	Y161-R199 HydrophobicContact CE1-CG 4.16Å; Y161-R199 PolarHBondContact OH-NE 2.91Å; Y161-R199 VanDerWaalsContact OH-NE 3.07Å; Y161-R199 PolarHBondContact OH-NH2 2.92Å; S195-R199 WeakPolarHBondContact O-CB 3.35Å; S195-R199 PolarHBondContact O-N 2.88Å; F196-R199 PolarHBondContact O-N 2.93Å; R199-S202 PolarHBondContact O-OG 3.02Å; R199-S202 VanDerWaalsContact O-OG 3.1Å; R199-V203 WeakPolarHBondContact O-CB 3.49Å; R199-V203 VanDerWaalsContact O-CG2 3.22Å; R199-V203 WeakPolarHBondContact O-CG2 3.39Å; R199-V203 PolarHBondContact O-N 3.34Å; R199-V237 HydrophobicContact CG-CG2 4.39Å; R199-N240 HydrophobicContact CB-CB 4.26Å; R199-N240 WeakPolarHBondContact CD-OD1 3.27Å; R199-N240 PolarHBondContact NH1-OD1 3.49Å; R199-Y366 PolarHBondContact NH1-OH 3.4Å; R199-Y366 PolarHBondContact NH2-OH 2.94Å
200	A	95.6	Very high	91.8	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.4	-46.1	176.1	0	0	0	0	0	111.9	Y161 L165 F196 M197 L198 V203 F204	Y161-A200 HydrophobicContact CD1-CB 3.98Å; Y161-A200 HydrophobicContact CG-CB 4.26Å; L165-A200 HydrophobicContact CB-CB 4.39Å; F196-A200 WeakPolarHBondContact O-CB 3.29Å; F196-A200 PolarHBondContact O-N 3.38Å; M197-A200 PolarHBondContact O-N 3.42Å; L198-A200 PolarHBondContact O-N 2.91Å; A200-V203 PolarHBondContact O-N 3.49Å; A200-F204 WeakPolarHBondContact O-CD2 3.48Å; A200-F204 WeakPolarHBondContact O-CG 3.47Å; A200-F204 PolarHBondContact O-N 2.98Å; A200-F204 VanDerWaalsContact O-N 3.13Å
201	I	95.6	Very high	90.6	Very high	63 Å²	63	34.3 Å²	34.3	32%	0.323	16%	0.156	S	C	.	.	H	α-helix	trans	-65.4	-41.8	178.8	-69.5	164.8	0	0	0	111.2	L165 M197 L198 F204 I205	L165-I201 HydrophobicContact CD1-CD1 4.3Å; L165-I201 HydrophobicContact CD1-CG1 4.29Å; L165-I201 HydrophobicContact CD2-CG1 4.22Å; M197-I201 WeakPolarHBondContact O-CB 3.09Å; M197-I201 WeakPolarHBondContact O-CD1 3.45Å; M197-I201 VanDerWaalsContact O-CG1 3.23Å; M197-I201 WeakPolarHBondContact O-CG1 3.2Å; M197-I201 PolarHBondContact O-N 3.17Å; L198-I201 PolarHBondContact O-N 2.9Å; I201-F204 PolarHBondContact O-N 3.29Å; I201-I205 HydrophobicContact CG2-CD1 3.7Å; I201-I205 HydrophobicContact CG2-CG1 4.41Å; I201-I205 WeakPolarHBondContact O-CG1 3.1Å; I201-I205 PolarHBondContact O-N 3.43Å
202	S	94	Very high	88.9	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.1	-33.4	179.7	69.9	0	0	0	0	112.8	L198 R199 K206 C236	L198-S202 WeakPolarHBondContact O-CB 3.39Å; L198-S202 PolarHBondContact O-N 3.09Å; L198-S202 PolarHBondContact O-OG 2.88Å; R199-S202 PolarHBondContact O-OG 3.02Å; R199-S202 VanDerWaalsContact O-OG 3.1Å; S202-K206 VanDerWaalsContact O-CB 3.31Å; S202-K206 WeakPolarHBondContact O-CB 3.42Å; S202-K206 PolarHBondContact O-N 2.9Å; S202-C236 VanDerWaalsContact OG-CB 3.27Å; S202-C236 WeakPolarHBondContact OG-CB 3.29Å
203	V	92.5	Very high	86.9	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.055	19%	0.19	C	C	.	.	H	α-helix	trans	-60.6	-52.6	169.3	166.8	0	0	0	0	109.7	Y157 Y161 R199 A200 I205 K206 D207 F233	Y157-V203 HydrophobicContact CD2-CG1 4.1Å; Y157-V203 HydrophobicContact CE2-CG1 3.94Å; Y161-V203 HydrophobicContact CD2-CB 4.3Å; Y161-V203 HydrophobicContact CD2-CG1 3.87Å; Y161-V203 HydrophobicContact CD2-CG2 4.36Å; Y161-V203 HydrophobicContact CE2-CB 4.22Å; Y161-V203 HydrophobicContact CE2-CG1 3.89Å; Y161-V203 HydrophobicContact CE2-CG2 3.8Å; R199-V203 WeakPolarHBondContact O-CB 3.49Å; R199-V203 VanDerWaalsContact O-CG2 3.22Å; R199-V203 WeakPolarHBondContact O-CG2 3.39Å; R199-V203 PolarHBondContact O-N 3.34Å; A200-V203 PolarHBondContact O-N 3.49Å; V203-I205 VanDerWaalsContact C-N 3.32Å; V203-I205 PolarHBondContact O-N 2.9Å; V203-K206 WeakPolarHBondContact O-CB 3.41Å; V203-K206 PolarHBondContact O-N 3.43Å; V203-K206 VanDerWaalsContact O-N 3.16Å; V203-D207 WeakPolarHBondContact CG1-OD2 3.14Å; V203-D207 WeakPolarHBondContact O-CB 3.32Å; V203-D207 PolarHBondContact O-N 2.99Å; V203-F233 HydrophobicContact CG2-CD2 4.47Å; V203-F233 HydrophobicContact CG2-CE2 3.91Å
204	F	93.2	Very high	84.8	Confident	56 Å²	56	47.3 Å²	47.3	25%	0.246	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-35.5	180	-61.4	-36.9	0	0	0	114.1	T158 S162 L165 A200 I201 W208	T158-F204 HydrophobicContact CG2-CE1 4.15Å; S162-F204 WeakPolarHBondContact OG-CZ 3.41Å; L165-F204 HydrophobicContact CD2-CE2 4.04Å; A200-F204 WeakPolarHBondContact O-CD2 3.48Å; A200-F204 WeakPolarHBondContact O-CG 3.47Å; A200-F204 PolarHBondContact O-N 2.98Å; A200-F204 VanDerWaalsContact O-N 3.13Å; I201-F204 PolarHBondContact O-N 3.29Å; F204-W208 VanDerWaalsContact O-CB 3.25Å; F204-W208 WeakPolarHBondContact O-CB 3.43Å; F204-W208 PolarHBondContact O-N 2.78Å
205	I	89.8	Confident	82.4	Confident	67 Å²	67	51.9 Å²	51.9	34%	0.344	25%	0.25	S	S	.	.	H	α-helix	trans	-71.3	-41.6	176	-63.7	166.8	0	0	0	110.7	I201 V203 W208 I209 V229 F232	I201-I205 HydrophobicContact CG2-CD1 3.7Å; I201-I205 HydrophobicContact CG2-CG1 4.41Å; I201-I205 WeakPolarHBondContact O-CG1 3.1Å; I201-I205 PolarHBondContact O-N 3.43Å; V203-I205 VanDerWaalsContact C-N 3.32Å; V203-I205 PolarHBondContact O-N 2.9Å; I205-W208 PolarHBondContact O-N 3.25Å; I205-I209 PolarHBondContact O-N 3.05Å; I205-I209 VanDerWaalsContact O-N 3.14Å; I205-V229 HydrophobicContact CG2-CB 4.47Å; I205-V229 HydrophobicContact CG2-CG1 3.78Å; I205-V229 HydrophobicContact CG2-CG2 3.78Å; I205-F232 HydrophobicContact CD1-CE1 4.15Å
206	K	87.9	Confident	80.1	Confident	30 Å²	30	57.1 Å²	57.1	13%	0.13	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-45.8	173.7	-172.6	-155.3	62.7	60	0	111.3	S202 V203 I209 L210 V229 M230 F233	S202-K206 VanDerWaalsContact O-CB 3.31Å; S202-K206 WeakPolarHBondContact O-CB 3.42Å; S202-K206 PolarHBondContact O-N 2.9Å; V203-K206 WeakPolarHBondContact O-CB 3.41Å; V203-K206 PolarHBondContact O-N 3.43Å; V203-K206 VanDerWaalsContact O-N 3.16Å; K206-I209 PolarHBondContact O-N 2.85Å; K206-L210 HydrophobicContact CD-CD1 4.11Å; K206-L210 HydrophobicContact CG-CD1 3.83Å; K206-L210 HydrophobicContact CG-CG 4.4Å; K206-L210 WeakPolarHBondContact O-CB 3.48Å; K206-L210 WeakPolarHBondContact O-CG 3.37Å; K206-L210 PolarHBondContact O-N 3.29Å; K206-V229 HydrophobicContact CB-CG1 4.47Å; K206-M230 HydrophobicContact CD-CE 4.48Å; K206-M230 HydrophobicContact CD-SD 4Å; K206-M230 HydrophobicContact CG-SD 3.69Å; K206-F233 HydrophobicContact CB-CD2 4.23Å; K206-F233 HydrophobicContact CD-CD1 4.21Å; K206-F233 HydrophobicContact CD-CD2 3.93Å; K206-F233 HydrophobicContact CD-CE1 4.22Å; K206-F233 HydrophobicContact CD-CE2 3.96Å; K206-F233 HydrophobicContact CD-CG 4.07Å; K206-F233 HydrophobicContact CD-CZ 4.1Å; K206-F233 HydrophobicContact CG-CD2 4.5Å
207	D	86.4	Confident	77.9	Confident	15 Å²	15	62.9 Å²	62.9	8%	0.08	32%	0.318	C	S	.	.	H	α-helix	trans	-69.1	-35.6	179.6	-62.7	-29.6	0	0	0	112	Y157 V203 Y211	Y157-D207 WeakPolarHBondContact CE2-OD2 3.08Å; Y157-D207 PolarHBondContact OH-OD1 2.72Å; V203-D207 WeakPolarHBondContact CG1-OD2 3.14Å; V203-D207 WeakPolarHBondContact O-CB 3.32Å; V203-D207 PolarHBondContact O-N 2.99Å; D207-Y211 HydrophobicContact CB-CD2 3.97Å; D207-Y211 HydrophobicContact CB-CE2 4.28Å; D207-Y211 WeakPolarHBondContact O-CB 3.26Å; D207-Y211 VanDerWaalsContact O-CD2 3.3Å; D207-Y211 WeakPolarHBondContact O-CD2 3.25Å; D207-Y211 PolarHBondContact O-N 3.03Å; D207-Y211 VanDerWaalsContact O-N 3.1Å
208	W	84.4	Confident	75.6	Confident	195 Å²	195	67.3 Å²	67.3	74%	0.739	34%	0.338	S	S	*	.	H	α-helix	trans	-59.8	-45.7	173.8	175.8	-94.7	0	0	0	111.6	F204 I205 A212	F204-W208 VanDerWaalsContact O-CB 3.25Å; F204-W208 WeakPolarHBondContact O-CB 3.43Å; F204-W208 PolarHBondContact O-N 2.78Å; I205-W208 PolarHBondContact O-N 3.25Å; W208-A212 WeakPolarHBondContact O-CB 3.24Å; W208-A212 PolarHBondContact O-N 3.25Å
209	I	78.5	Confident	73.6	Confident	25 Å²	25	69 Å²	69	13%	0.128	35%	0.352	C	S	.	.	H	α-helix	trans	-70.8	-58	179.2	-66.2	-176.4	0	0	0	110.9	I205 K206 Y211 A212 E225 C226 V229	I205-I209 PolarHBondContact O-N 3.05Å; I205-I209 VanDerWaalsContact O-N 3.14Å; K206-I209 PolarHBondContact O-N 2.85Å; I209-Y211 PolarHBondContact O-N 3.47Å; I209-Y211 VanDerWaalsContact O-N 3.15Å; I209-A212 PolarHBondContact O-N 3.25Å; I209-E225 HydrophobicContact CD1-CG 4.31Å; I209-C226 HydrophobicContact CG2-CB 4.31Å; I209-V229 HydrophobicContact CD1-CB 4.01Å; I209-V229 HydrophobicContact CD1-CG1 4.14Å; I209-V229 HydrophobicContact CD1-CG2 3.67Å
210	L	71.5	Confident	71.4	Confident	43 Å²	43	74.9 Å²	74.9	23%	0.225	38%	0.378	C	S	.	.	H	α-helix	trans	-64.7	-24.2	-172.2	-65.1	179.2	0	0	0	114.2	K206	K206-L210 HydrophobicContact CD-CD1 4.11Å; K206-L210 HydrophobicContact CG-CD1 3.83Å; K206-L210 HydrophobicContact CG-CG 4.4Å; K206-L210 WeakPolarHBondContact O-CB 3.48Å; K206-L210 WeakPolarHBondContact O-CG 3.37Å; K206-L210 PolarHBondContact O-N 3.29Å
211	Y	69.4	Low	69.3	Low	96 Å²	96	75.5 Å²	75.5	38%	0.376	38%	0.381	S	S	.	.	H	α-helix	trans	-106.8	-4.3	179.4	-62.3	-72.4	0	0	0	114.9	K154 D207 I209	K154-Y211 HydrophobicContact CD-CD2 4.25Å; K154-Y211 HydrophobicContact CD-CE1 4.32Å; K154-Y211 HydrophobicContact CD-CE2 3.75Å; K154-Y211 VanDerWaalsContact CE-CD2 3.47Å; K154-Y211 VanDerWaalsContact CE-CE2 3.48Å; D207-Y211 HydrophobicContact CB-CD2 3.97Å; D207-Y211 HydrophobicContact CB-CE2 4.28Å; D207-Y211 WeakPolarHBondContact O-CB 3.26Å; D207-Y211 VanDerWaalsContact O-CD2 3.3Å; D207-Y211 WeakPolarHBondContact O-CD2 3.25Å; D207-Y211 PolarHBondContact O-N 3.03Å; D207-Y211 VanDerWaalsContact O-N 3.1Å; I209-Y211 PolarHBondContact O-N 3.47Å; I209-Y211 VanDerWaalsContact O-N 3.15Å
212	A	59.4	Low	67.4	Low	60 Å²	60	72.6 Å²	72.6	50%	0.496	37%	0.366	S	S	.	.	H	α-helix	trans	-79.7	-21.1	168.7	0	0	0	0	0	112.4	W208 I209 Q214	W208-A212 WeakPolarHBondContact O-CB 3.24Å; W208-A212 PolarHBondContact O-N 3.25Å; I209-A212 PolarHBondContact O-N 3.25Å; A212-Q214 VanDerWaalsContact C-N 3.33Å; A212-Q214 PolarHBondContact O-N 3.43Å
213	E	52.4	Low	66.2	Low	51 Å²	51	75.2 Å²	75.2	24%	0.238	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	0.5	-173.1	-148	151.1	146.2	0	0	114	D215 H218 I221	E213-D215 PolarHBondContact O-N 2.87Å; E213-H218 VanDerWaalsContact OE1-O 3.09Å; E213-I221 HydrophobicContact CB-CD1 4.27Å; E213-I221 HydrophobicContact CG-CD1 4.33Å; E213-I221 VanDerWaalsContact OE1-CA 3.26Å; E213-I221 WeakPolarHBondContact OE1-CA 3.46Å; E213-I221 WeakPolarHBondContact OE1-CB 3.22Å; E213-I221 PolarHBondContact OE1-N 3.3Å
214	Q	51.7	Low	65.6	Low	165 Å²	165	78.1 Å²	78.1	77%	0.771	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13	178.3	-149.7	164.8	15.3	0	0	113.2	A212 S216	A212-Q214 VanDerWaalsContact C-N 3.33Å; A212-Q214 PolarHBondContact O-N 3.43Å; Q214-S216 PolarHBondContact O-N 3.37Å
215	D	47	Very low	65	Low	136 Å²	136	81.9 Å²	81.9	73%	0.727	42%	0.418	S	S	*	.	S	Bend	trans	-80.4	44.6	173.8	-87.5	-25.6	0	0	0	113.8	E213 N217	E213-D215 PolarHBondContact O-N 2.87Å; D215-N217 PolarHBondContact O-N 2.92Å; D215-N217 PolarHBondContact O-ND2 3.38Å
216	S	47.7	Very low	64.6	Low	109 Å²	109	78.8 Å²	78.8	76%	0.762	40%	0.402	S	S	*	.	S	Bend	trans	48.2	-2.4	156.2	61.3	0	0	0	0	122.4	Q214	Q214-S216 PolarHBondContact O-N 3.37Å
217	N	50.5	Low	64.6	Low	129 Å²	129	77.3 Å²	77.3	69%	0.69	40%	0.396	S	S	*	.			trans	-117.8	-8.8	-163.6	-72.2	-83.3	0	0	0	115.5	D215	D215-N217 PolarHBondContact O-N 2.92Å; D215-N217 PolarHBondContact O-ND2 3.38Å
218	H	47.5	Very low	64.7	Low	128 Å²	128	78 Å²	78	59%	0.593	40%	0.404	S	S	*	.			trans	-116	102.9	-175.3	-74.1	-68.3	0	0	0	111.7	E213 F220	E213-H218 VanDerWaalsContact OE1-O 3.09Å; H218-F220 HydrophobicContact CB-CD2 4.04Å; H218-F220 AromaticContact ND1-CD2 3.84Å; H218-F220 PolarHBondContact O-N 2.91Å
219	C	53.8	Low	64.9	Low	62 Å²	62	69.7 Å²	69.7	42%	0.419	37%	0.374	S	S	.	.			trans	-80.5	62.5	173.2	175.1	0	0	0	0	110.3	C25	C25-C219 HydrophobicContact CB-CB 4.5Å; C25-C219 WeakPolarHBondContact CB-SG 3.49Å; C25-C219 VanDerWaalsContact SG-C 3.51Å; C25-C219 WeakPolarHBondContact SG-CA 3.17Å; C25-C219 WeakPolarHBondContact SG-CB 3.35Å; C25-C219 CovalentContact SG-SG 2.03Å; C25-C219 PolarHBondContact SG-SG 3.11Å
220	F	50	Low	65.5	Low	134 Å²	134	68.9 Å²	68.9	59%	0.588	37%	0.37	S	S	*	.			trans	-136.7	-3.8	-165.4	-76.8	-73.3	0	0	0	116.6	H218 S222 T223	H218-F220 HydrophobicContact CB-CD2 4.04Å; H218-F220 AromaticContact ND1-CD2 3.84Å; H218-F220 PolarHBondContact O-N 2.91Å; F220-S222 PolarHBondContact O-N 2.9Å; F220-T223 WeakPolarHBondContact O-CG2 3.21Å; F220-T223 PolarHBondContact O-N 2.89Å
221	I	53.3	Low	66.6	Low	13 Å²	13	67.2 Å²	67.2	7%	0.067	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-42.7	-173.3	-123.8	153.2	0	0	0	114.1	H22 E213 T223 C226 C296	H22-I221 HydrophobicContact CB-CB 3.95Å; H22-I221 HydrophobicContact CB-CG2 3.68Å; H22-I221 WeakPolarHBondContact CD2-CG2 3.27Å; E213-I221 HydrophobicContact CB-CD1 4.27Å; E213-I221 HydrophobicContact CG-CD1 4.33Å; E213-I221 VanDerWaalsContact OE1-CA 3.26Å; E213-I221 WeakPolarHBondContact OE1-CA 3.46Å; E213-I221 WeakPolarHBondContact OE1-CB 3.22Å; E213-I221 PolarHBondContact OE1-N 3.3Å; I221-T223 PolarHBondContact O-N 2.83Å; I221-T223 PolarHBondContact O-OG1 2.92Å; I221-C226 WeakPolarHBondContact O-CB 3.46Å; I221-C296 HydrophobicContact CG2-CB 4.27Å
222	S	54.5	Low	67.7	Low	1 Å²	1	64.7 Å²	64.7	1%	0.007	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	32.6	-178.1	-61.1	0	0	0	0	114.4	A20 M21 F220 G295	A20-S222 VanDerWaalsContact CA-CB 3.47Å; A20-S222 WeakPolarHBondContact CB-OG 3.46Å; A20-S222 PolarHBondContact N-O 2.82Å; A20-S222 WeakPolarHBondContact O-CB 3.33Å; M21-S222 PolarHBondContact O-OG 2.89Å; F220-S222 PolarHBondContact O-N 2.9Å; S222-G295 WeakPolarHBondContact CB-O 3.43Å; S222-G295 WeakPolarHBondContact OG-CA 3.44Å; S222-G295 PolarHBondContact OG-O 3.38Å
223	T	68.9	Low	69.4	Low	56 Å²	56	63.7 Å²	63.7	34%	0.344	34%	0.337	S	S	.	.	S	Bend	trans	-51.7	151.6	155	47.5	0	0	0	0	110.7	F220 I221 E225 C226 K227	F220-T223 WeakPolarHBondContact O-CG2 3.21Å; F220-T223 PolarHBondContact O-N 2.89Å; I221-T223 PolarHBondContact O-N 2.83Å; I221-T223 PolarHBondContact O-OG1 2.92Å; T223-E225 PolarHBondContact O-N 3.07Å; T223-C226 PolarHBondContact O-N 3.07Å; T223-C226 PolarHBondContact OG1-N 3.33Å; T223-K227 PolarHBondContact O-N 3.01Å
224	V	80.1	Confident	71.4	Confident	70 Å²	70	61.8 Å²	61.8	42%	0.424	33%	0.328	S	S	.	.	H	α-helix	trans	-57.8	-27.1	167.9	175.8	0	0	0	0	111.1	M17 A228	M17-V224 HydrophobicContact CB-CG1 4.35Å; M17-V224 WeakPolarHBondContact O-CG2 3.37Å; V224-A228 WeakPolarHBondContact O-CB 3.32Å; V224-A228 PolarHBondContact O-N 3.28Å
225	E	79.8	Confident	73.5	Confident	134 Å²	134	54 Å²	54	63%	0.626	29%	0.292	S	S	*	.	H	α-helix	trans	-62.3	-50.7	175.3	-176.8	167.5	-170.4	0	0	113	I209 T223 K227 A228 V229	I209-E225 HydrophobicContact CD1-CG 4.31Å; T223-E225 PolarHBondContact O-N 3.07Å; E225-K227 PolarHBondContact O-N 3.01Å; E225-A228 PolarHBondContact O-N 3.46Å; E225-V229 WeakPolarHBondContact O-CG2 3.41Å; E225-V229 PolarHBondContact O-N 2.95Å
226	C	82.5	Confident	75.9	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.014	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-48.3	179.6	-163.5	0	0	0	0	111.4	I209 I221 T223 A228 V229 M230 C296	I209-C226 HydrophobicContact CG2-CB 4.31Å; I221-C226 WeakPolarHBondContact O-CB 3.46Å; T223-C226 PolarHBondContact O-N 3.07Å; T223-C226 PolarHBondContact OG1-N 3.33Å; C226-A228 VanDerWaalsContact C-N 3.33Å; C226-A228 PolarHBondContact O-N 3.44Å; C226-V229 PolarHBondContact O-N 3.43Å; C226-V229 VanDerWaalsContact O-N 3.1Å; C226-M230 PolarHBondContact O-N 3.39Å; C226-C296 HydrophobicContact CB-CB 4.08Å; C226-C296 WeakPolarHBondContact CB-SG 3.45Å; C226-C296 PolarHBondContact O-SG 3.46Å; C226-C296 VanDerWaalsContact O-SG 3.39Å; C226-C296 WeakPolarHBondContact SG-CB 3.39Å; C226-C296 CovalentContact SG-SG 2.03Å; C226-C296 PolarHBondContact SG-SG 2.8Å
227	K	86.5	Confident	78.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-42.6	175.9	-63.8	-177.8	-178.8	-178	0	111.6	M17 A18 T223 E225 V229 M230 V231 D293 G295 W297	M17-K227 HydrophobicContact CE-CB 3.6Å; A18-K227 PolarHBondContact O-NZ 3.44Å; T223-K227 PolarHBondContact O-N 3.01Å; E225-K227 PolarHBondContact O-N 3.01Å; K227-V229 VanDerWaalsContact C-N 3.34Å; K227-V229 PolarHBondContact O-N 3.1Å; K227-M230 PolarHBondContact O-N 2.92Å; K227-V231 WeakPolarHBondContact O-CG2 3.21Å; K227-V231 PolarHBondContact O-N 2.8Å; K227-D293 WeakPolarHBondContact CE-OD1 3.3Å; K227-D293 IonicContact NZ-OD1 2.68Å; K227-D293 PolarHBondContact NZ-OD1 2.87Å; K227-D293 IonicContact NZ-OD2 2.77Å; K227-D293 PolarHBondContact NZ-OD2 3.13Å; K227-G295 WeakPolarHBondContact CE-O 3.24Å; K227-W297 HydrophobicContact CD-CZ2 3.97Å; K227-W297 HydrophobicContact CG-CD2 4.45Å
228	A	89	Confident	80.2	Confident	30 Å²	30	37.6 Å²	37.6	25%	0.248	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-35	176.4	0	0	0	0	0	112.8	M17 V224 E225 C226 F232	M17-A228 HydrophobicContact CE-CB 4.3Å; V224-A228 WeakPolarHBondContact O-CB 3.32Å; V224-A228 PolarHBondContact O-N 3.28Å; E225-A228 PolarHBondContact O-N 3.46Å; C226-A228 VanDerWaalsContact C-N 3.33Å; C226-A228 PolarHBondContact O-N 3.44Å; A228-F232 WeakPolarHBondContact O-CB 3.43Å; A228-F232 PolarHBondContact O-N 3.32Å
229	V	90.1	Very high	82.6	Confident	20 Å²	20	31.5 Å²	31.5	12%	0.121	17%	0.169	C	C	.	.	H	α-helix	trans	-69.5	-38.8	173.3	165	0	0	0	0	111.7	I205 K206 I209 E225 C226 K227 F232 F233	I205-V229 HydrophobicContact CG2-CB 4.47Å; I205-V229 HydrophobicContact CG2-CG1 3.78Å; I205-V229 HydrophobicContact CG2-CG2 3.78Å; K206-V229 HydrophobicContact CB-CG1 4.47Å; I209-V229 HydrophobicContact CD1-CB 4.01Å; I209-V229 HydrophobicContact CD1-CG1 4.14Å; I209-V229 HydrophobicContact CD1-CG2 3.67Å; E225-V229 WeakPolarHBondContact O-CG2 3.41Å; E225-V229 PolarHBondContact O-N 2.95Å; C226-V229 PolarHBondContact O-N 3.43Å; C226-V229 VanDerWaalsContact O-N 3.1Å; K227-V229 VanDerWaalsContact C-N 3.34Å; K227-V229 PolarHBondContact O-N 3.1Å; V229-F232 PolarHBondContact O-N 3.07Å; V229-F233 WeakPolarHBondContact O-CB 3.41Å; V229-F233 PolarHBondContact O-N 3.45Å
230	M	90.3	Very high	84.6	Confident	8 Å²	8	28.6 Å²	28.6	4%	0.039	15%	0.149	C	C	.	.	H	α-helix	trans	-66.2	-37.5	174	-70.7	-56.5	-61.3	0	0	112.3	K206 C226 K227 F233 H234 C296 D298	K206-M230 HydrophobicContact CD-CE 4.48Å; K206-M230 HydrophobicContact CD-SD 4Å; K206-M230 HydrophobicContact CG-SD 3.69Å; C226-M230 PolarHBondContact O-N 3.39Å; K227-M230 PolarHBondContact O-N 2.92Å; M230-F233 HydrophobicContact CE-CD1 4.17Å; M230-F233 PolarHBondContact O-N 2.69Å; M230-H234 PolarHBondContact O-N 2.78Å; M230-H234 PolarHBondContact O-ND1 3.22Å; M230-C296 WeakPolarHBondContact CB-O 3.36Å; M230-C296 VanDerWaalsContact CG-O 3.29Å; M230-C296 WeakPolarHBondContact CG-O 3.32Å; M230-C296 WeakPolarHBondContact CG-SG 3.4Å; M230-D298 HydrophobicContact CE-CB 4.18Å
231	V	93.6	Very high	86.7	Confident	7 Å²	7	23.6 Å²	23.6	4%	0.042	13%	0.126	C	C	.	.	H	α-helix	trans	-60.6	-47.2	169.3	168.7	0	0	0	0	111.4	L12 M17 K227 F233 H234 Y235 V281 W284 A285 W297	L12-V231 HydrophobicContact CD2-CG1 3.82Å; M17-V231 HydrophobicContact CE-CG2 4.2Å; M17-V231 HydrophobicContact SD-CG2 4.49Å; K227-V231 WeakPolarHBondContact O-CG2 3.21Å; K227-V231 PolarHBondContact O-N 2.8Å; V231-F233 PolarHBondContact O-N 3.07Å; V231-H234 PolarHBondContact O-N 2.83Å; V231-Y235 WeakPolarHBondContact O-CB 3.23Å; V231-Y235 PolarHBondContact O-N 3.28Å; V231-V281 HydrophobicContact CG1-CG1 3.92Å; V231-W284 HydrophobicContact CG2-CZ3 4.2Å; V231-A285 HydrophobicContact CG2-CB 3.96Å; V231-W297 HydrophobicContact CG2-CE3 4.01Å; V231-W297 HydrophobicContact CG2-CZ3 3.49Å; V231-W297 VanDerWaalsContact CG2-CZ3 3.49Å
232	F	94	Very high	88.7	Confident	44 Å²	44	23.7 Å²	23.7	19%	0.193	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-39.8	178	175.3	-107.5	0	0	0	112.7	L9 L198 I205 A228 V229 Y235 C236	L9-F232 HydrophobicContact CD2-CD2 3.64Å; L9-F232 HydrophobicContact CD2-CE2 3.67Å; L198-F232 HydrophobicContact CD2-CZ 4.4Å; I205-F232 HydrophobicContact CD1-CE1 4.15Å; A228-F232 WeakPolarHBondContact O-CB 3.43Å; A228-F232 PolarHBondContact O-N 3.32Å; V229-F232 PolarHBondContact O-N 3.07Å; F232-Y235 PolarHBondContact O-N 3.5Å; F232-C236 WeakPolarHBondContact CE2-SG 3.33Å; F232-C236 VanDerWaalsContact CZ-SG 3.55Å; F232-C236 WeakPolarHBondContact O-CB 3.32Å; F232-C236 PolarHBondContact O-N 3.4Å; F232-C236 PolarHBondContact O-SG 3.02Å
233	F	93.9	Very high	90.7	Very high	39 Å²	39	23.7 Å²	23.7	17%	0.171	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-53.2	174.8	169.1	-100.2	0	0	0	111.6	V203 K206 V229 M230 V231 Y235 C236 V237	V203-F233 HydrophobicContact CG2-CD2 4.47Å; V203-F233 HydrophobicContact CG2-CE2 3.91Å; K206-F233 HydrophobicContact CB-CD2 4.23Å; K206-F233 HydrophobicContact CD-CD1 4.21Å; K206-F233 HydrophobicContact CD-CD2 3.93Å; K206-F233 HydrophobicContact CD-CE1 4.22Å; K206-F233 HydrophobicContact CD-CE2 3.96Å; K206-F233 HydrophobicContact CD-CG 4.07Å; K206-F233 HydrophobicContact CD-CZ 4.1Å; K206-F233 HydrophobicContact CG-CD2 4.5Å; V229-F233 WeakPolarHBondContact O-CB 3.41Å; V229-F233 PolarHBondContact O-N 3.45Å; M230-F233 HydrophobicContact CE-CD1 4.17Å; M230-F233 PolarHBondContact O-N 2.69Å; V231-F233 PolarHBondContact O-N 3.07Å; F233-Y235 VanDerWaalsContact C-N 3.32Å; F233-Y235 PolarHBondContact O-N 2.89Å; F233-C236 PolarHBondContact O-N 2.94Å; F233-V237 HydrophobicContact CD2-CG2 4.2Å; F233-V237 HydrophobicContact CE1-CG2 4.4Å; F233-V237 HydrophobicContact CE2-CG2 3.81Å; F233-V237 HydrophobicContact CZ-CG2 3.93Å; F233-V237 WeakPolarHBondContact O-CG2 3.28Å; F233-V237 PolarHBondContact O-N 2.98Å
234	H	94.5	Very high	91.9	Very high	11 Å²	11	21.2 Å²	21.2	5%	0.051	11%	0.111	C	C	.	.	H	α-helix	trans	-58.9	-42.9	176.3	-73.4	103.2	0	0	0	111.6	M230 V231 C236 V237 V238 V281 W284 W306	M230-H234 PolarHBondContact O-N 2.78Å; M230-H234 PolarHBondContact O-ND1 3.22Å; V231-H234 PolarHBondContact O-N 2.83Å; H234-C236 PolarHBondContact O-N 3.32Å; H234-V237 PolarHBondContact O-N 3.34Å; H234-V238 WeakPolarHBondContact O-CB 3.28Å; H234-V238 VanDerWaalsContact O-CG2 3.24Å; H234-V238 WeakPolarHBondContact O-CG2 3.39Å; H234-V238 PolarHBondContact O-N 3.36Å; H234-V281 HydrophobicContact CB-CG1 4.41Å; H234-V281 HydrophobicContact CB-CG2 4.13Å; H234-W284 AromaticContact CE1-CH2 3.52Å; H234-W284 AromaticContact CE1-CZ2 3.75Å; H234-W284 AromaticContact ND1-CH2 3.42Å; H234-W284 WeakPolarHBondContact ND1-CH2 2.97Å; H234-W284 AromaticContact ND1-CZ3 3.68Å; H234-W306 AromaticContact NE2-CZ3 3.81Å
235	Y	96.4	Very high	92.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.3	-44.8	175.6	173.6	-104	0	0	0	113	L9 L12 V231 F232 F233 S239 P277 T278	L9-Y235 HydrophobicContact CD2-CD1 4.12Å; L9-Y235 HydrophobicContact CD2-CE1 4.05Å; L12-Y235 HydrophobicContact CD1-CD1 4.3Å; L12-Y235 HydrophobicContact CD1-CD2 3.93Å; L12-Y235 HydrophobicContact CD1-CE2 4.4Å; L12-Y235 HydrophobicContact CD1-CG 3.86Å; V231-Y235 WeakPolarHBondContact O-CB 3.23Å; V231-Y235 PolarHBondContact O-N 3.28Å; F232-Y235 PolarHBondContact O-N 3.5Å; F233-Y235 VanDerWaalsContact C-N 3.32Å; F233-Y235 PolarHBondContact O-N 2.89Å; Y235-S239 WeakPolarHBondContact CE2-OG 3.38Å; Y235-S239 WeakPolarHBondContact O-CB 3.42Å; Y235-S239 PolarHBondContact O-N 2.97Å; Y235-S239 PolarHBondContact O-OG 2.86Å; Y235-P277 HydrophobicContact CD2-CB 4.08Å; Y235-P277 HydrophobicContact CE2-CB 4.01Å; Y235-T278 WeakPolarHBondContact CE2-OG1 3.16Å
236	C	96.6	Very high	93.3	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-70.4	-37.9	-179.1	-67.4	0	0	0	0	112.6	L198 S202 F232 F233 H234 N240	L198-C236 HydrophobicContact CB-CB 4.26Å; S202-C236 VanDerWaalsContact OG-CB 3.27Å; S202-C236 WeakPolarHBondContact OG-CB 3.29Å; F232-C236 WeakPolarHBondContact CE2-SG 3.33Å; F232-C236 VanDerWaalsContact CZ-SG 3.55Å; F232-C236 WeakPolarHBondContact O-CB 3.32Å; F232-C236 PolarHBondContact O-N 3.4Å; F232-C236 PolarHBondContact O-SG 3.02Å; F233-C236 PolarHBondContact O-N 2.94Å; H234-C236 PolarHBondContact O-N 3.32Å; C236-N240 PolarHBondContact O-N 2.6Å; C236-N240 VanDerWaalsContact O-N 3.11Å
237	V	94.6	Very high	93.8	Very high	29 Å²	29	13.1 Å²	13.1	18%	0.176	7%	0.068	C	C	.	.	H	α-helix	trans	-66.5	-51.6	175.2	172.7	0	0	0	0	111.1	R199 F233 H234 S239 N240 Y241	R199-V237 HydrophobicContact CG-CG2 4.39Å; F233-V237 HydrophobicContact CD2-CG2 4.2Å; F233-V237 HydrophobicContact CE1-CG2 4.4Å; F233-V237 HydrophobicContact CE2-CG2 3.81Å; F233-V237 HydrophobicContact CZ-CG2 3.93Å; F233-V237 WeakPolarHBondContact O-CG2 3.28Å; F233-V237 PolarHBondContact O-N 2.98Å; H234-V237 PolarHBondContact O-N 3.34Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 2.97Å; V237-N240 PolarHBondContact O-N 3.08Å; V237-N240 VanDerWaalsContact O-N 3.13Å; V237-Y241 HydrophobicContact CG1-CD2 4.07Å; V237-Y241 HydrophobicContact CG1-CE2 3.76Å; V237-Y241 VanDerWaalsContact O-CD2 3.32Å; V237-Y241 WeakPolarHBondContact O-CD2 3.27Å; V237-Y241 PolarHBondContact O-N 3.21Å
238	V	95.6	Very high	94.1	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.006	7%	0.068	C	C	.	.	H	α-helix	trans	-62.3	-41.4	178.8	178	0	0	0	0	110.7	H234 N240 Y241 F242 P277 V281 I309 V313	H234-V238 WeakPolarHBondContact O-CB 3.28Å; H234-V238 VanDerWaalsContact O-CG2 3.24Å; H234-V238 WeakPolarHBondContact O-CG2 3.39Å; H234-V238 PolarHBondContact O-N 3.36Å; V238-N240 VanDerWaalsContact C-N 3.29Å; V238-N240 PolarHBondContact O-N 3.47Å; V238-Y241 PolarHBondContact O-N 2.86Å; V238-F242 HydrophobicContact CG1-CD2 3.74Å; V238-F242 HydrophobicContact CG1-CE2 3.87Å; V238-F242 WeakPolarHBondContact O-CD2 3.38Å; V238-F242 PolarHBondContact O-N 3.48Å; V238-P277 HydrophobicContact CB-CB 4.28Å; V238-P277 HydrophobicContact CG1-CB 3.87Å; V238-P277 HydrophobicContact CG1-CG 4.17Å; V238-V281 HydrophobicContact CG2-CG2 4.41Å; V238-I309 HydrophobicContact CG2-CG2 3.78Å; V238-V313 HydrophobicContact CG1-CG2 4.37Å; V238-V313 HydrophobicContact CG2-CG2 3.95Å
239	S	96.5	Very high	94.3	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.007	7%	0.066	C	C	.	.	H	α-helix	trans	-59	-38.4	175	-62.7	0	0	0	0	112.7	Y235 V237 F242 W243 P277	Y235-S239 WeakPolarHBondContact CE2-OG 3.38Å; Y235-S239 WeakPolarHBondContact O-CB 3.42Å; Y235-S239 PolarHBondContact O-N 2.97Å; Y235-S239 PolarHBondContact O-OG 2.86Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 2.97Å; S239-F242 PolarHBondContact O-N 3.23Å; S239-W243 VanDerWaalsContact O-CD1 3.24Å; S239-W243 PolarHBondContact O-N 3.19Å; S239-P277 VanDerWaalsContact OG-CB 3.29Å; S239-P277 WeakPolarHBondContact OG-CB 3.31Å
240	N	95.4	Very high	94.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-66	-42.7	177.7	-178.3	-125.3	0	0	0	112.1	S195 F196 R199 C236 V237 V238 W243 L244	S195-N240 PolarHBondContact OG-ND2 3.17Å; F196-N240 VanDerWaalsContact CD1-ND2 3.26Å; F196-N240 WeakPolarHBondContact CD1-ND2 3.38Å; F196-N240 WeakPolarHBondContact CE1-ND2 3.4Å; F196-N240 WeakPolarHBondContact CG-ND2 3.18Å; R199-N240 HydrophobicContact CB-CB 4.26Å; R199-N240 WeakPolarHBondContact CD-OD1 3.27Å; R199-N240 PolarHBondContact NH1-OD1 3.49Å; C236-N240 PolarHBondContact O-N 2.6Å; C236-N240 VanDerWaalsContact O-N 3.11Å; V237-N240 PolarHBondContact O-N 3.08Å; V237-N240 VanDerWaalsContact O-N 3.13Å; V238-N240 VanDerWaalsContact C-N 3.29Å; V238-N240 PolarHBondContact O-N 3.47Å; N240-W243 PolarHBondContact O-N 3.1Å; N240-L244 VanDerWaalsContact O-CG 3.29Å; N240-L244 WeakPolarHBondContact O-CG 3.39Å; N240-L244 PolarHBondContact O-N 3.32Å; N240-L244 VanDerWaalsContact O-N 3.07Å
241	Y	94.8	Very high	94.4	Very high	29 Å²	29	15 Å²	15	11%	0.114	7%	0.071	C	C	.	.	H	α-helix	trans	-60.8	-44.3	172.1	-74.6	-70	0	0	0	112.6	V237 V238 W243 L244 F245 V313 I317 Y366	V237-Y241 HydrophobicContact CG1-CD2 4.07Å; V237-Y241 HydrophobicContact CG1-CE2 3.76Å; V237-Y241 VanDerWaalsContact O-CD2 3.32Å; V237-Y241 WeakPolarHBondContact O-CD2 3.27Å; V237-Y241 PolarHBondContact O-N 3.21Å; V238-Y241 PolarHBondContact O-N 2.86Å; Y241-W243 VanDerWaalsContact C-N 3.35Å; Y241-W243 PolarHBondContact O-N 2.91Å; Y241-L244 WeakPolarHBondContact O-CB 3.32Å; Y241-L244 PolarHBondContact O-N 3.07Å; Y241-F245 PolarHBondContact O-N 3.48Å; Y241-V313 HydrophobicContact CD1-CG1 4.09Å; Y241-V313 HydrophobicContact CD2-CB 4.48Å; Y241-V313 HydrophobicContact CD2-CG1 3.6Å; Y241-V313 HydrophobicContact CD2-CG2 4.03Å; Y241-V313 HydrophobicContact CE1-CG1 4.24Å; Y241-V313 HydrophobicContact CE2-CG1 3.75Å; Y241-V313 HydrophobicContact CG-CG1 3.78Å; Y241-V313 HydrophobicContact CG-CG2 4.48Å; Y241-I317 HydrophobicContact CD1-CD1 4Å; Y241-I317 HydrophobicContact CD1-CG1 4.05Å; Y241-I317 HydrophobicContact CE1-CD1 3.81Å; Y241-I317 HydrophobicContact CE1-CG1 4.27Å; Y241-Y366 HydrophobicContact CD1-CD2 4.45Å; Y241-Y366 HydrophobicContact CE1-CD1 4.18Å; Y241-Y366 AromaticContact CE1-CD2 3.68Å; Y241-Y366 HydrophobicContact CE1-CD2 3.68Å; Y241-Y366 HydrophobicContact CE1-CE1 4.26Å; Y241-Y366 AromaticContact CE1-CE2 3.78Å; Y241-Y366 HydrophobicContact CE1-CE2 3.78Å; Y241-Y366 AromaticContact CE1-CG 3.91Å; Y241-Y366 HydrophobicContact CE1-CG 3.91Å
242	F	95.8	Very high	94.3	Very high	16 Å²	16	17.4 Å²	17.4	7%	0.07	8%	0.081	C	C	.	.	H	α-helix	trans	-64.8	-34.6	177.1	-90.2	-95.6	0	0	0	113.1	V238 S239 F245 I246 I272 T276 P277 P312	V238-F242 HydrophobicContact CG1-CD2 3.74Å; V238-F242 HydrophobicContact CG1-CE2 3.87Å; V238-F242 WeakPolarHBondContact O-CD2 3.38Å; V238-F242 PolarHBondContact O-N 3.48Å; S239-F242 PolarHBondContact O-N 3.23Å; F242-F245 HydrophobicContact CD1-CD1 4.42Å; F242-F245 PolarHBondContact O-N 3.09Å; F242-I246 WeakPolarHBondContact O-CB 3.26Å; F242-I246 VanDerWaalsContact O-CG1 3.26Å; F242-I246 WeakPolarHBondContact O-CG1 3.3Å; F242-I246 PolarHBondContact O-N 3.04Å; F242-I272 HydrophobicContact CD1-CG2 4.36Å; F242-T276 HydrophobicContact CD1-CG2 4.32Å; F242-T276 HydrophobicContact CE1-CG2 3.46Å; F242-T276 VanDerWaalsContact CE1-CG2 3.46Å; F242-T276 HydrophobicContact CE2-CG2 4.39Å; F242-T276 HydrophobicContact CZ-CG2 3.5Å; F242-P277 HydrophobicContact CB-CG 3.84Å; F242-P277 HydrophobicContact CD2-CG 3.98Å; F242-P277 HydrophobicContact CG-CG 3.9Å; F242-P312 HydrophobicContact CE2-CB 4.13Å; F242-P312 HydrophobicContact CZ-CB 4.22Å
243	W	96.1	Very high	94.3	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-71.1	-32.6	173.8	-84.7	101.8	0	0	0	113.6	I188 N191 L192 S239 N240 Y241 I246 E247 G273 W274	I188-W243 HydrophobicContact CD1-CZ3 4.1Å; I188-W243 HydrophobicContact CG2-CZ3 4.46Å; N191-W243 HydrophobicContact CB-CD2 3.86Å; N191-W243 HydrophobicContact CB-CE3 3.67Å; N191-W243 HydrophobicContact CB-CH2 3.48Å; N191-W243 VanDerWaalsContact CB-CH2 3.48Å; N191-W243 HydrophobicContact CB-CZ2 3.65Å; N191-W243 HydrophobicContact CB-CZ3 3.47Å; N191-W243 VanDerWaalsContact CB-CZ3 3.47Å; N191-W243 WeakPolarHBondContact ND2-CH2 3.08Å; L192-W243 HydrophobicContact CD1-CB 3.78Å; S239-W243 VanDerWaalsContact O-CD1 3.24Å; S239-W243 PolarHBondContact O-N 3.19Å; N240-W243 PolarHBondContact O-N 3.1Å; Y241-W243 VanDerWaalsContact C-N 3.35Å; Y241-W243 PolarHBondContact O-N 2.91Å; W243-I246 HydrophobicContact CE3-CB 4.3Å; W243-I246 HydrophobicContact CE3-CG2 3.89Å; W243-I246 HydrophobicContact CH2-CG2 4.38Å; W243-I246 HydrophobicContact CZ3-CB 4.49Å; W243-I246 HydrophobicContact CZ3-CG2 3.64Å; W243-I246 PolarHBondContact O-N 3.23Å; W243-E247 PolarHBondContact O-N 3.42Å; W243-G273 PolarHBondContact NE1-O 3.18Å; W243-W274 AromaticContact CE2-CE2 3.77Å; W243-W274 AromaticContact CE2-NE1 3.72Å; W243-W274 AromaticContact CZ2-CD1 3.7Å; W243-W274 AromaticContact CZ2-CE2 3.97Å; W243-W274 HydrophobicContact CZ2-CG 4.39Å; W243-W274 AromaticContact CZ2-NE1 3.41Å; W243-W274 AromaticContact NE1-CD1 3.99Å; W243-W274 AromaticContact NE1-CD2 3.38Å; W243-W274 AromaticContact NE1-CE2 3.19Å; W243-W274 AromaticContact NE1-CE3 3.75Å; W243-W274 AromaticContact NE1-CG 3.91Å; W243-W274 AromaticContact NE1-CH2 3.79Å; W243-W274 AromaticContact NE1-CZ2 3.42Å; W243-W274 AromaticContact NE1-CZ3 3.95Å; W243-W274 AromaticContact NE1-NE1 3.59Å
244	L	93.5	Very high	94.1	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-65.3	-41.1	171.8	-68.5	166	0	0	0	111.9	L192 F196 N240 Y241 G248 N320 L361 Y366	L192-L244 HydrophobicContact CD1-CD2 3.87Å; L192-L244 HydrophobicContact CD1-CG 4.07Å; F196-L244 HydrophobicContact CE2-CD2 4.15Å; F196-L244 HydrophobicContact CZ-CD1 4.47Å; F196-L244 HydrophobicContact CZ-CD2 3.87Å; F196-L244 HydrophobicContact CZ-CG 4.49Å; N240-L244 VanDerWaalsContact O-CG 3.29Å; N240-L244 WeakPolarHBondContact O-CG 3.39Å; N240-L244 PolarHBondContact O-N 3.32Å; N240-L244 VanDerWaalsContact O-N 3.07Å; Y241-L244 WeakPolarHBondContact O-CB 3.32Å; Y241-L244 PolarHBondContact O-N 3.07Å; L244-G248 PolarHBondContact O-N 3.37Å; L244-N320 PolarHBondContact O-ND2 2.88Å; L244-L361 WeakPolarHBondContact CD2-O 3.44Å; L244-Y366 HydrophobicContact CD1-CE2 4.31Å
245	F	94.5	Very high	93.8	Very high	33 Å²	33	19 Å²	19	15%	0.145	9%	0.094	C	C	.	.	H	α-helix	trans	-64.6	-45.3	172.3	159	-112.1	0	0	0	112.2	Y241 F242 E247 G248 L249 V319 L323	Y241-F245 PolarHBondContact O-N 3.48Å; F242-F245 HydrophobicContact CD1-CD1 4.42Å; F242-F245 PolarHBondContact O-N 3.09Å; F245-E247 VanDerWaalsContact C-N 3.29Å; F245-E247 PolarHBondContact O-N 3.13Å; F245-G248 PolarHBondContact O-N 2.85Å; F245-L249 HydrophobicContact CE1-CD2 4.41Å; F245-L249 HydrophobicContact CE2-CB 4.32Å; F245-L249 HydrophobicContact CE2-CD2 4.39Å; F245-L249 HydrophobicContact CZ-CD2 3.87Å; F245-L249 WeakPolarHBondContact O-CB 3.42Å; F245-L249 PolarHBondContact O-N 3.24Å; F245-V319 HydrophobicContact CD2-CB 4.45Å; F245-V319 HydrophobicContact CD2-CG1 4.26Å; F245-V319 HydrophobicContact CE2-CB 4.2Å; F245-V319 HydrophobicContact CE2-CG1 3.65Å; F245-L323 HydrophobicContact CD2-CD1 4.3Å; F245-L323 HydrophobicContact CE2-CD1 4.11Å
246	I	95.2	Very high	93.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.6	-33.5	178.8	-75.1	-67.3	0	0	0	112.2	I188 F242 W243 L249 Y250 Y269 I272	I188-I246 HydrophobicContact CD1-CG2 4.4Å; F242-I246 WeakPolarHBondContact O-CB 3.26Å; F242-I246 VanDerWaalsContact O-CG1 3.26Å; F242-I246 WeakPolarHBondContact O-CG1 3.3Å; F242-I246 PolarHBondContact O-N 3.04Å; W243-I246 HydrophobicContact CE3-CB 4.3Å; W243-I246 HydrophobicContact CE3-CG2 3.89Å; W243-I246 HydrophobicContact CH2-CG2 4.38Å; W243-I246 HydrophobicContact CZ3-CB 4.49Å; W243-I246 HydrophobicContact CZ3-CG2 3.64Å; W243-I246 PolarHBondContact O-N 3.23Å; I246-L249 HydrophobicContact CD1-CD2 4.43Å; I246-Y250 VanDerWaalsContact O-CB 3.25Å; I246-Y250 WeakPolarHBondContact O-CB 3.4Å; I246-Y250 PolarHBondContact O-N 3.36Å; I246-Y269 HydrophobicContact CD1-CD1 3.83Å; I246-Y269 HydrophobicContact CD1-CG 4.29Å; I246-Y269 HydrophobicContact CG2-CG 4.33Å; I246-I272 HydrophobicContact CD1-CB 4.13Å; I246-I272 HydrophobicContact CD1-CG2 3.96Å
247	E	92.8	Very high	93.1	Very high	3 Å²	3	27.3 Å²	27.3	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-68.3	-43	174.1	-175.6	161.3	-96.1	0	0	112.6	I188 H189 L192 W243 F245 Y250 L251 L361 Y400	I188-E247 HydrophobicContact CG2-CB 4.41Å; H189-E247 IonicContact CE1-OE1 3.7Å; H189-E247 PolarHBondContact CE1-OE1 3.03Å; H189-E247 IonicContact CG-OE1 3.83Å; H189-E247 IonicContact ND1-OE1 3.06Å; H189-E247 PolarHBondContact ND1-OE1 2.96Å; L192-E247 VanDerWaalsContact CD2-CD 3.47Å; L192-E247 WeakPolarHBondContact CD2-OE1 3.47Å; L192-E247 WeakPolarHBondContact CD2-OE2 3.32Å; W243-E247 PolarHBondContact O-N 3.42Å; F245-E247 VanDerWaalsContact C-N 3.29Å; F245-E247 PolarHBondContact O-N 3.13Å; E247-Y250 PolarHBondContact O-N 2.85Å; E247-L251 PolarHBondContact O-N 2.95Å; E247-L361 HydrophobicContact CG-CD2 4.48Å; E247-L361 WeakPolarHBondContact OE2-CD2 3.04Å; E247-L361 WeakPolarHBondContact OE2-CG 3.03Å; E247-Y400 WeakPolarHBondContact OE2-CE2 2.94Å
248	G	92.3	Very high	92.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.1	-44	173.5	0	0	0	0	0	113	L244 F245 L251 F252 N320 F362	L244-G248 PolarHBondContact O-N 3.37Å; F245-G248 PolarHBondContact O-N 2.85Å; G248-L251 PolarHBondContact O-N 3.25Å; G248-F252 WeakPolarHBondContact O-CB 3.47Å; G248-F252 PolarHBondContact O-N 2.99Å; G248-N320 WeakPolarHBondContact CA-OD1 3.29Å; G248-F362 VanDerWaalsContact CA-CE1 3.44Å
249	L	93.8	Very high	91.5	Very high	40 Å²	40	40.3 Å²	40.3	21%	0.209	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-45.4	175.4	-177.3	61.4	0	0	0	111.5	F245 I246 L251 F252 T253 Y269 L323	F245-L249 HydrophobicContact CE1-CD2 4.41Å; F245-L249 HydrophobicContact CE2-CB 4.32Å; F245-L249 HydrophobicContact CE2-CD2 4.39Å; F245-L249 HydrophobicContact CZ-CD2 3.87Å; F245-L249 WeakPolarHBondContact O-CB 3.42Å; F245-L249 PolarHBondContact O-N 3.24Å; I246-L249 HydrophobicContact CD1-CD2 4.43Å; L249-L251 PolarHBondContact O-N 3.47Å; L249-F252 PolarHBondContact O-N 3.38Å; L249-T253 WeakPolarHBondContact O-CB 3.33Å; L249-T253 PolarHBondContact O-N 2.77Å; L249-T253 PolarHBondContact O-OG1 3.25Å; L249-T253 VanDerWaalsContact O-OG1 3.11Å; L249-Y269 HydrophobicContact CD2-CD1 4.25Å; L249-Y269 HydrophobicContact CD2-CE1 3.63Å; L249-Y269 HydrophobicContact CG-CE1 4Å; L249-L323 HydrophobicContact CB-CD1 4.13Å; L249-L323 HydrophobicContact CD1-CD1 4.32Å; L249-L323 HydrophobicContact CD1-CD2 4.44Å
250	Y	92.7	Very high	90.6	Very high	15 Å²	15	41.8 Å²	41.8	6%	0.059	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-43	177	174.3	-113.2	0	0	0	112.1	R185 I188 I246 E247 L254 F260 Y269	R185-Y250 HydrophobicContact CB-CE1 3.96Å; R185-Y250 HydrophobicContact CG-CE1 4.12Å; R185-Y250 PolarHBondContact N-OH 2.93Å; I188-Y250 HydrophobicContact CG1-CD1 4.18Å; I188-Y250 HydrophobicContact CG1-CE1 4.42Å; I188-Y250 HydrophobicContact CG1-CG 4.27Å; I188-Y250 HydrophobicContact CG2-CD1 4.48Å; I246-Y250 VanDerWaalsContact O-CB 3.25Å; I246-Y250 WeakPolarHBondContact O-CB 3.4Å; I246-Y250 PolarHBondContact O-N 3.36Å; E247-Y250 PolarHBondContact O-N 2.85Å; Y250-L254 HydrophobicContact CE1-CD1 4.47Å; Y250-L254 HydrophobicContact CE2-CD1 4.44Å; Y250-L254 VanDerWaalsContact O-CB 3.24Å; Y250-L254 WeakPolarHBondContact O-CB 3.48Å; Y250-L254 PolarHBondContact O-N 3.46Å; Y250-F260 HydrophobicContact CE2-CE2 4.3Å; Y250-F260 HydrophobicContact CE2-CZ 4.45Å; Y250-Y269 HydrophobicContact CD2-CD2 4.44Å; Y250-Y269 AromaticContact CD2-CE2 4Å; Y250-Y269 HydrophobicContact CD2-CE2 4Å
251	L	90.2	Very high	90	Very high	42 Å²	42	45.5 Å²	45.5	22%	0.22	23%	0.232	C	C	.	.	H	α-helix	trans	-69.7	-39.5	178.5	-166.3	69.6	0	0	0	112.3	E247 G248 L249 L254 L255 I327 L358 F362	E247-L251 PolarHBondContact O-N 2.95Å; G248-L251 PolarHBondContact O-N 3.25Å; L249-L251 PolarHBondContact O-N 3.47Å; L251-L254 PolarHBondContact O-N 3.26Å; L251-L255 HydrophobicContact CG-CD1 4.32Å; L251-L255 WeakPolarHBondContact O-CG 3.48Å; L251-L255 PolarHBondContact O-N 3.04Å; L251-L255 VanDerWaalsContact O-N 3.15Å; L251-I327 HydrophobicContact CB-CD1 4.34Å; L251-I327 HydrophobicContact CD2-CD1 4.29Å; L251-I327 HydrophobicContact CD2-CG2 4.39Å; L251-L358 HydrophobicContact CD2-CD2 4.42Å; L251-F362 HydrophobicContact CD2-CZ 3.86Å
252	F	92	Very high	89.4	Confident	58 Å²	58	48.2 Å²	48.2	25%	0.254	25%	0.246	S	C	.	.	H	α-helix	trans	-64.3	-49.3	176	-179.5	-100	0	0	0	111.6	G248 L249 L254 L255 V256 L323 I327 I330	G248-F252 WeakPolarHBondContact O-CB 3.47Å; G248-F252 PolarHBondContact O-N 2.99Å; L249-F252 PolarHBondContact O-N 3.38Å; F252-L254 VanDerWaalsContact C-N 3.29Å; F252-L254 PolarHBondContact O-N 3.04Å; F252-L255 PolarHBondContact O-N 2.71Å; F252-V256 HydrophobicContact CD1-CG2 4.41Å; F252-V256 HydrophobicContact CD2-CG2 4.31Å; F252-V256 HydrophobicContact CE1-CG2 4.03Å; F252-V256 HydrophobicContact CE2-CG2 3.93Å; F252-V256 HydrophobicContact CZ-CG2 3.78Å; F252-V256 PolarHBondContact O-N 3.24Å; F252-V256 VanDerWaalsContact O-N 3.09Å; F252-L323 HydrophobicContact CB-CD2 3.79Å; F252-L323 HydrophobicContact CD1-CD2 3.49Å; F252-L323 VanDerWaalsContact CD1-CD2 3.49Å; F252-L323 HydrophobicContact CD2-CD2 4.14Å; F252-L323 HydrophobicContact CE1-CD2 4.06Å; F252-L323 HydrophobicContact CG-CD2 3.53Å; F252-I327 HydrophobicContact CB-CD1 4.21Å; F252-I327 HydrophobicContact CB-CG1 4.12Å; F252-I327 HydrophobicContact CD2-CG1 4.12Å; F252-I330 HydrophobicContact CD2-CD1 4.48Å; F252-I330 HydrophobicContact CE2-CD1 4.15Å
253	T	92.1	Very high	88.9	Confident	19 Å²	19	55.2 Å²	55.2	12%	0.117	27%	0.272	C	S	.	.	H	α-helix	trans	-56.8	-43.3	175	-62.1	0	0	0	0	111.1	L249 L255 V256 E257 F260 Y269	L249-T253 WeakPolarHBondContact O-CB 3.33Å; L249-T253 PolarHBondContact O-N 2.77Å; L249-T253 PolarHBondContact O-OG1 3.25Å; L249-T253 VanDerWaalsContact O-OG1 3.11Å; T253-L255 PolarHBondContact O-N 3.22Å; T253-V256 PolarHBondContact O-N 3.13Å; T253-E257 HydrophobicContact CG2-CB 4.14Å; T253-E257 HydrophobicContact CG2-CG 4.27Å; T253-E257 WeakPolarHBondContact O-CB 3.44Å; T253-E257 PolarHBondContact O-N 3.42Å; T253-F260 HydrophobicContact CG2-CG 4.47Å; T253-Y269 PolarHBondContact OG1-OH 3.24Å
254	L	90.2	Very high	88.6	Confident	59 Å²	59	63.5 Å²	63.5	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-66.3	-18.3	177.7	-176.3	141.8	0	0	0	114.3	Y250 L251 F252 F260	Y250-L254 HydrophobicContact CE1-CD1 4.47Å; Y250-L254 HydrophobicContact CE2-CD1 4.44Å; Y250-L254 VanDerWaalsContact O-CB 3.24Å; Y250-L254 WeakPolarHBondContact O-CB 3.48Å; Y250-L254 PolarHBondContact O-N 3.46Å; L251-L254 PolarHBondContact O-N 3.26Å; F252-L254 VanDerWaalsContact C-N 3.29Å; F252-L254 PolarHBondContact O-N 3.04Å; L254-F260 HydrophobicContact CB-CE1 4.47Å; L254-F260 HydrophobicContact CB-CZ 4.39Å; L254-F260 HydrophobicContact CD1-CZ 4.18Å; L254-F260 HydrophobicContact CG-CE1 4.49Å; L254-F260 HydrophobicContact CG-CZ 4.47Å
255	L	88.8	Confident	88.4	Confident	50 Å²	50	68 Å²	68	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-95	-24	178.1	-76.7	172.1	0	0	0	114.3	L251 F252 T253 I327 I330 K334	L251-L255 HydrophobicContact CG-CD1 4.32Å; L251-L255 WeakPolarHBondContact O-CG 3.48Å; L251-L255 PolarHBondContact O-N 3.04Å; L251-L255 VanDerWaalsContact O-N 3.15Å; F252-L255 PolarHBondContact O-N 2.71Å; T253-L255 PolarHBondContact O-N 3.22Å; L255-I327 HydrophobicContact CD1-CB 4.46Å; L255-I327 HydrophobicContact CD1-CG1 4.2Å; L255-I327 HydrophobicContact CD1-CG2 3.95Å; L255-I330 HydrophobicContact CB-CD1 4.44Å; L255-I330 HydrophobicContact CB-CG2 4.31Å; L255-K334 PolarHBondContact O-NZ 2.94Å
256	V	90.8	Very high	88.3	Confident	68 Å²	68	68.3 Å²	68.3	41%	0.412	32%	0.322	S	S	.	.	H	α-helix	trans	-99.4	-51.6	-179.5	176.8	0	0	0	0	111.4	F252 T253 I330	F252-V256 HydrophobicContact CD1-CG2 4.41Å; F252-V256 HydrophobicContact CD2-CG2 4.31Å; F252-V256 HydrophobicContact CE1-CG2 4.03Å; F252-V256 HydrophobicContact CE2-CG2 3.93Å; F252-V256 HydrophobicContact CZ-CG2 3.78Å; F252-V256 PolarHBondContact O-N 3.24Å; F252-V256 VanDerWaalsContact O-N 3.09Å; T253-V256 PolarHBondContact O-N 3.13Å; V256-I330 HydrophobicContact CG2-CD1 3.61Å
257	E	87.4	Confident	88.1	Confident	107 Å²	107	75 Å²	75	50%	0.5	35%	0.348	S	S	.	.			trans	-92.2	107.1	-176	-67.4	-62.9	157.5	0	0	110.7	T253 F259 F260	T253-E257 HydrophobicContact CG2-CB 4.14Å; T253-E257 HydrophobicContact CG2-CG 4.27Å; T253-E257 WeakPolarHBondContact O-CB 3.44Å; T253-E257 PolarHBondContact O-N 3.42Å; E257-F259 VanDerWaalsContact C-N 3.35Å; E257-F260 HydrophobicContact CB-CB 4.37Å; E257-F260 VanDerWaalsContact O-CD1 3.3Å; E257-F260 WeakPolarHBondContact O-CD1 3.31Å
258	T	76.8	Confident	88.1	Confident	113 Å²	113	81.6 Å²	81.6	69%	0.693	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-15.9	178.9	50.7	0	0	0	0	113.8
259	F	78.9	Confident	88.3	Confident	189 Å²	189	82.1 Å²	82.1	83%	0.829	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	45.3	-171.3	-63.7	-65.8	0	0	0	113.7	E257	E257-F259 VanDerWaalsContact C-N 3.35Å
260	F	77.9	Confident	88.2	Confident	32 Å²	32	81.2 Å²	81.2	14%	0.14	37%	0.371	C	S	.	.			trans	-90.1	135.1	178.4	73.1	-72.9	0	0	0	112.8	Y250 T253 L254 E257 E262 Y265	Y250-F260 HydrophobicContact CE2-CE2 4.3Å; Y250-F260 HydrophobicContact CE2-CZ 4.45Å; T253-F260 HydrophobicContact CG2-CG 4.47Å; L254-F260 HydrophobicContact CB-CE1 4.47Å; L254-F260 HydrophobicContact CB-CZ 4.39Å; L254-F260 HydrophobicContact CD1-CZ 4.18Å; L254-F260 HydrophobicContact CG-CE1 4.49Å; L254-F260 HydrophobicContact CG-CZ 4.47Å; E257-F260 HydrophobicContact CB-CB 4.37Å; E257-F260 VanDerWaalsContact O-CD1 3.3Å; E257-F260 WeakPolarHBondContact O-CD1 3.31Å; F260-E262 VanDerWaalsContact C-N 3.34Å; F260-E262 HydrophobicContact CD2-CG 4.32Å; F260-E262 HydrophobicContact CE2-CB 4.13Å; F260-E262 HydrophobicContact CE2-CG 3.67Å; F260-E262 HydrophobicContact CZ-CG 3.78Å; F260-E262 PolarHBondContact O-N 3.11Å; F260-Y265 HydrophobicContact CB-CD2 4.24Å; F260-Y265 HydrophobicContact CB-CE2 4.17Å; F260-Y265 HydrophobicContact CD2-CD2 4.26Å; F260-Y265 HydrophobicContact CD2-CG 4.4Å
261	P	83.1	Confident	88.3	Confident	78 Å²	78	83.7 Å²	83.7	51%	0.506	39%	0.385	S	S	.	.			trans	-71.9	83.3	174.1	27.7	-36.4	0	0	0	111.8	R263 R264 Y265	P261-R263 VanDerWaalsContact C-N 3.26Å; P261-R263 PolarHBondContact O-N 2.92Å; P261-R264 HydrophobicContact CB-CB 4.49Å; P261-R264 HydrophobicContact CG-CB 4.47Å; P261-R264 PolarHBondContact O-N 2.97Å; P261-Y265 HydrophobicContact CG-CD2 4.08Å; P261-Y265 HydrophobicContact CG-CE2 3.98Å; P261-Y265 PolarHBondContact O-N 3.33Å
262	E	83	Confident	88.5	Confident	86 Å²	86	84.3 Å²	84.3	40%	0.402	39%	0.388	S	S	.	.	H	α-helix	trans	-38.5	-48.8	-172.2	-65.5	-169.2	-143.8	0	0	114.8	T184 F260 R264 Y265 F266	T184-E262 WeakPolarHBondContact CB-OE2 3.27Å; T184-E262 HydrophobicContact CG2-CB 4.39Å; T184-E262 PolarHBondContact OG1-OE2 2.91Å; F260-E262 VanDerWaalsContact C-N 3.34Å; F260-E262 HydrophobicContact CD2-CG 4.32Å; F260-E262 HydrophobicContact CE2-CB 4.13Å; F260-E262 HydrophobicContact CE2-CG 3.67Å; F260-E262 HydrophobicContact CZ-CG 3.78Å; F260-E262 PolarHBondContact O-N 3.11Å; E262-R264 VanDerWaalsContact C-N 3.33Å; E262-R264 PolarHBondContact O-N 2.9Å; E262-Y265 PolarHBondContact O-N 3.42Å; E262-F266 VanDerWaalsContact O-CB 3.3Å; E262-F266 WeakPolarHBondContact O-CB 3.46Å; E262-F266 PolarHBondContact O-N 3.15Å
263	R	84.5	Confident	88.7	Confident	163 Å²	163	81.6 Å²	81.6	62%	0.615	38%	0.376	S	S	*	.	H	α-helix	trans	-66.4	-32.4	-173.8	-64.1	-62.7	-174.7	173.5	-1.8	113.1	P261 Y267	P261-R263 VanDerWaalsContact C-N 3.26Å; P261-R263 PolarHBondContact O-N 2.92Å; R263-Y267 PolarHBondContact O-N 3.38Å
264	R	90.1	Very high	88.9	Confident	175 Å²	175	80.9 Å²	80.9	66%	0.66	37%	0.371	S	S	*	.	H	α-helix	trans	-73.2	-46	175.9	-179.3	173.3	174.5	158.3	-0.9	110.1	P261 E262 Y267 W268	P261-R264 HydrophobicContact CB-CB 4.49Å; P261-R264 HydrophobicContact CG-CB 4.47Å; P261-R264 PolarHBondContact O-N 2.97Å; E262-R264 VanDerWaalsContact C-N 3.33Å; E262-R264 PolarHBondContact O-N 2.9Å; R264-Y267 PolarHBondContact O-N 3.1Å; R264-W268 VanDerWaalsContact O-CD1 3.29Å; R264-W268 PolarHBondContact O-N 2.99Å
265	Y	89.9	Confident	89.1	Confident	98 Å²	98	79.3 Å²	79.3	38%	0.384	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-45.9	176.8	-82.2	-89.4	0	0	0	111.8	F260 P261 E262 Y267 W268 Y269	F260-Y265 HydrophobicContact CB-CD2 4.24Å; F260-Y265 HydrophobicContact CB-CE2 4.17Å; F260-Y265 HydrophobicContact CD2-CD2 4.26Å; F260-Y265 HydrophobicContact CD2-CG 4.4Å; P261-Y265 HydrophobicContact CG-CD2 4.08Å; P261-Y265 HydrophobicContact CG-CE2 3.98Å; P261-Y265 PolarHBondContact O-N 3.33Å; E262-Y265 PolarHBondContact O-N 3.42Å; Y265-Y267 VanDerWaalsContact C-N 3.29Å; Y265-Y267 PolarHBondContact O-N 2.83Å; Y265-W268 PolarHBondContact O-N 3.45Å; Y265-W268 VanDerWaalsContact O-N 3.14Å; Y265-Y269 HydrophobicContact CD1-CE1 4.41Å; Y265-Y269 HydrophobicContact CD1-CE2 4.31Å; Y265-Y269 AromaticContact CD1-CZ 3.88Å; Y265-Y269 WeakPolarHBondContact O-CB 3.45Å; Y265-Y269 VanDerWaalsContact O-CD2 3.24Å; Y265-Y269 WeakPolarHBondContact O-CD2 3.46Å; Y265-Y269 VanDerWaalsContact O-CG 3.23Å; Y265-Y269 PolarHBondContact O-N 3.3Å
266	F	90.9	Very high	89.3	Confident	39 Å²	39	79.3 Å²	79.3	17%	0.171	37%	0.372	C	S	.	.	H	α-helix	trans	-55	-39.9	175.1	175.4	-94.7	0	0	0	113.5	T184 F187 I188 E262 T270	T184-F266 HydrophobicContact CG2-CB 3.88Å; T184-F266 HydrophobicContact CG2-CD2 3.92Å; T184-F266 HydrophobicContact CG2-CG 4.1Å; F187-F266 HydrophobicContact CB-CD2 4.45Å; F187-F266 HydrophobicContact CB-CE2 3.46Å; F187-F266 VanDerWaalsContact CB-CE2 3.46Å; F187-F266 HydrophobicContact CB-CZ 3.61Å; F187-F266 HydrophobicContact CG-CZ 4.4Å; I188-F266 HydrophobicContact CD1-CD2 3.65Å; I188-F266 HydrophobicContact CD1-CE2 3.85Å; I188-F266 HydrophobicContact CG1-CD2 4.06Å; I188-F266 HydrophobicContact CG1-CE2 4.23Å; E262-F266 VanDerWaalsContact O-CB 3.3Å; E262-F266 WeakPolarHBondContact O-CB 3.46Å; E262-F266 PolarHBondContact O-N 3.15Å; F266-T270 WeakPolarHBondContact O-CB 3.29Å; F266-T270 PolarHBondContact O-N 2.96Å; F266-T270 PolarHBondContact O-OG1 2.94Å
267	Y	91.6	Very high	89.6	Confident	141 Å²	141	76.1 Å²	76.1	55%	0.553	35%	0.352	S	S	*	.	H	α-helix	trans	-63.5	-52.3	175.1	-179.8	-94.8	0	0	0	111.1	R263 R264 Y265 Y269 T270 I271	R263-Y267 PolarHBondContact O-N 3.38Å; R264-Y267 PolarHBondContact O-N 3.1Å; Y265-Y267 VanDerWaalsContact C-N 3.29Å; Y265-Y267 PolarHBondContact O-N 2.83Å; Y267-Y269 PolarHBondContact O-N 2.99Å; Y267-T270 WeakPolarHBondContact O-CB 3.49Å; Y267-T270 PolarHBondContact O-N 3.44Å; Y267-T270 VanDerWaalsContact O-N 3.09Å; Y267-I271 HydrophobicContact CD1-CG1 4.2Å; Y267-I271 HydrophobicContact CE1-CD1 4.34Å; Y267-I271 HydrophobicContact CE1-CG1 3.82Å; Y267-I271 WeakPolarHBondContact O-CG1 3.16Å; Y267-I271 PolarHBondContact O-N 3.03Å
268	W	93.6	Very high	89.9	Confident	142 Å²	142	71.9 Å²	71.9	54%	0.538	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-41.2	178.8	-78.6	102.5	0	0	0	113.1	R264 Y265 T270 I271 I272	R264-W268 VanDerWaalsContact O-CD1 3.29Å; R264-W268 PolarHBondContact O-N 2.99Å; Y265-W268 PolarHBondContact O-N 3.45Å; Y265-W268 VanDerWaalsContact O-N 3.14Å; W268-T270 VanDerWaalsContact C-N 3.29Å; W268-T270 PolarHBondContact O-N 3.2Å; W268-I271 PolarHBondContact O-N 2.69Å; W268-I271 VanDerWaalsContact O-N 3.16Å; W268-I272 WeakPolarHBondContact O-CG1 3.46Å; W268-I272 PolarHBondContact O-N 3.16Å
269	Y	94.9	Very high	90.8	Very high	11 Å²	11	70.8 Å²	70.8	4%	0.043	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-36.4	173.3	-65.7	-33.3	0	0	0	112.6	I246 L249 Y250 T253 Y265 Y267 I272 G273	I246-Y269 HydrophobicContact CD1-CD1 3.83Å; I246-Y269 HydrophobicContact CD1-CG 4.29Å; I246-Y269 HydrophobicContact CG2-CG 4.33Å; L249-Y269 HydrophobicContact CD2-CD1 4.25Å; L249-Y269 HydrophobicContact CD2-CE1 3.63Å; L249-Y269 HydrophobicContact CG-CE1 4Å; Y250-Y269 HydrophobicContact CD2-CD2 4.44Å; Y250-Y269 AromaticContact CD2-CE2 4Å; Y250-Y269 HydrophobicContact CD2-CE2 4Å; T253-Y269 PolarHBondContact OG1-OH 3.24Å; Y265-Y269 HydrophobicContact CD1-CE1 4.41Å; Y265-Y269 HydrophobicContact CD1-CE2 4.31Å; Y265-Y269 AromaticContact CD1-CZ 3.88Å; Y265-Y269 WeakPolarHBondContact O-CB 3.45Å; Y265-Y269 VanDerWaalsContact O-CD2 3.24Å; Y265-Y269 WeakPolarHBondContact O-CD2 3.46Å; Y265-Y269 VanDerWaalsContact O-CG 3.23Å; Y265-Y269 PolarHBondContact O-N 3.3Å; Y267-Y269 PolarHBondContact O-N 2.99Å; Y269-I272 PolarHBondContact O-N 3.42Å; Y269-G273 PolarHBondContact O-N 3.49Å
270	T	93.5	Very high	91.5	Very high	20 Å²	20	62.8 Å²	62.8	12%	0.123	29%	0.294	C	S	.	.	H	α-helix	trans	-70.1	-34.8	174.8	-54.5	0	0	0	0	112.2	F266 Y267 W268 W274	F266-T270 WeakPolarHBondContact O-CB 3.29Å; F266-T270 PolarHBondContact O-N 2.96Å; F266-T270 PolarHBondContact O-OG1 2.94Å; Y267-T270 WeakPolarHBondContact O-CB 3.49Å; Y267-T270 PolarHBondContact O-N 3.44Å; Y267-T270 VanDerWaalsContact O-N 3.09Å; W268-T270 VanDerWaalsContact C-N 3.29Å; W268-T270 PolarHBondContact O-N 3.2Å; T270-W274 PolarHBondContact O-N 2.91Å
271	I	94.2	Very high	92.4	Very high	68 Å²	68	61.2 Å²	61.2	35%	0.349	29%	0.287	S	S	.	.	H	α-helix	trans	-67.8	-42.8	173.7	-65.1	-63	0	0	0	110.9	Y267 W268 G275	Y267-I271 HydrophobicContact CD1-CG1 4.2Å; Y267-I271 HydrophobicContact CE1-CD1 4.34Å; Y267-I271 HydrophobicContact CE1-CG1 3.82Å; Y267-I271 WeakPolarHBondContact O-CG1 3.16Å; Y267-I271 PolarHBondContact O-N 3.03Å; W268-I271 PolarHBondContact O-N 2.69Å; W268-I271 VanDerWaalsContact O-N 3.16Å; I271-G275 WeakPolarHBondContact O-CA 3.46Å; I271-G275 PolarHBondContact O-N 2.99Å
272	I	94.4	Very high	92.9	Very high	55 Å²	55	59.3 Å²	59.3	28%	0.282	27%	0.274	S	S	.	.	H	α-helix	trans	-67.1	-49.5	177.8	-64.8	161.7	0	0	0	110.8	F242 I246 W268 Y269 W274 T276 P277	F242-I272 HydrophobicContact CD1-CG2 4.36Å; I246-I272 HydrophobicContact CD1-CB 4.13Å; I246-I272 HydrophobicContact CD1-CG2 3.96Å; W268-I272 WeakPolarHBondContact O-CG1 3.46Å; W268-I272 PolarHBondContact O-N 3.16Å; Y269-I272 PolarHBondContact O-N 3.42Å; I272-W274 VanDerWaalsContact C-N 3.27Å; I272-W274 PolarHBondContact O-N 3.49Å; I272-T276 PolarHBondContact O-N 3.38Å; I272-T276 VanDerWaalsContact O-N 3.11Å; I272-T276 PolarHBondContact O-OG1 3.09Å; I272-P277 WeakPolarHBondContact O-CD 3.25Å
273	G	95.3	Very high	93.4	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-20.3	-173.3	0	0	0	0	0	116	W243 Y269	W243-G273 PolarHBondContact NE1-O 3.18Å; Y269-G273 PolarHBondContact O-N 3.49Å
274	W	96.1	Very high	93.9	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.015	24%	0.244	C	C	.	.	H	α-helix	trans	-114	-34.7	172	-61.7	115.9	0	0	0	112.8	V4 V5 V194 L198 W243 T270 I272 T278	V4-W274 HydrophobicContact CG1-CB 4.43Å; V5-W274 HydrophobicContact CG2-CZ2 4.41Å; V194-W274 HydrophobicContact CG1-CH2 4.06Å; V194-W274 HydrophobicContact CG1-CZ2 4.19Å; L198-W274 HydrophobicContact CD1-CH2 3.82Å; L198-W274 HydrophobicContact CD1-CZ3 3.85Å; W243-W274 AromaticContact CE2-CE2 3.77Å; W243-W274 AromaticContact CE2-NE1 3.72Å; W243-W274 AromaticContact CZ2-CD1 3.7Å; W243-W274 AromaticContact CZ2-CE2 3.97Å; W243-W274 HydrophobicContact CZ2-CG 4.39Å; W243-W274 AromaticContact CZ2-NE1 3.41Å; W243-W274 AromaticContact NE1-CD1 3.99Å; W243-W274 AromaticContact NE1-CD2 3.38Å; W243-W274 AromaticContact NE1-CE2 3.19Å; W243-W274 AromaticContact NE1-CE3 3.75Å; W243-W274 AromaticContact NE1-CG 3.91Å; W243-W274 AromaticContact NE1-CH2 3.79Å; W243-W274 AromaticContact NE1-CZ2 3.42Å; W243-W274 AromaticContact NE1-CZ3 3.95Å; W243-W274 AromaticContact NE1-NE1 3.59Å; T270-W274 PolarHBondContact O-N 2.91Å; I272-W274 VanDerWaalsContact C-N 3.27Å; I272-W274 PolarHBondContact O-N 3.49Å; W274-T278 PolarHBondContact O-N 3.05Å; W274-T278 PolarHBondContact O-OG1 3.16Å
275	G	94.7	Very high	94	Very high	27 Å²	27	42.2 Å²	42.2	28%	0.278	21%	0.212	S	C	.	.	H	α-helix	trans	-73.6	-45.1	-175.2	0	0	0	0	0	113.7	I271 T278 V279	I271-G275 WeakPolarHBondContact O-CA 3.46Å; I271-G275 PolarHBondContact O-N 2.99Å; G275-T278 WeakPolarHBondContact O-CB 3.07Å; G275-T278 PolarHBondContact O-N 3.44Å; G275-T278 VanDerWaalsContact O-N 3.11Å; G275-V279 WeakPolarHBondContact O-CG2 3.2Å; G275-V279 PolarHBondContact O-N 3.19Å
276	T	93.6	Very high	94.1	Very high	50 Å²	50	39.7 Å²	39.7	31%	0.307	21%	0.208	S	C	.	.	H	α-helix	trans	-63.1	-44.9	178.4	-54.3	0	0	0	0	112.2	F242 I272 T278 V279 C280	F242-T276 HydrophobicContact CD1-CG2 4.32Å; F242-T276 HydrophobicContact CE1-CG2 3.46Å; F242-T276 VanDerWaalsContact CE1-CG2 3.46Å; F242-T276 HydrophobicContact CE2-CG2 4.39Å; F242-T276 HydrophobicContact CZ-CG2 3.5Å; I272-T276 PolarHBondContact O-N 3.38Å; I272-T276 VanDerWaalsContact O-N 3.11Å; I272-T276 PolarHBondContact O-OG1 3.09Å; T276-T278 VanDerWaalsContact C-N 3.3Å; T276-T278 PolarHBondContact O-N 2.83Å; T276-V279 PolarHBondContact O-N 3.27Å; T276-C280 PolarHBondContact O-N 3.2Å; T276-C280 PolarHBondContact O-SG 3.38Å; T276-C280 VanDerWaalsContact O-SG 3.36Å
277	P	96.3	Very high	94.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.3	-40.7	168.5	-26.1	32.9	0	0	0	114	Y235 V238 S239 F242 I272 V281	Y235-P277 HydrophobicContact CD2-CB 4.08Å; Y235-P277 HydrophobicContact CE2-CB 4.01Å; V238-P277 HydrophobicContact CB-CB 4.28Å; V238-P277 HydrophobicContact CG1-CB 3.87Å; V238-P277 HydrophobicContact CG1-CG 4.17Å; S239-P277 VanDerWaalsContact OG-CB 3.29Å; S239-P277 WeakPolarHBondContact OG-CB 3.31Å; F242-P277 HydrophobicContact CB-CG 3.84Å; F242-P277 HydrophobicContact CD2-CG 3.98Å; F242-P277 HydrophobicContact CG-CG 3.9Å; I272-P277 WeakPolarHBondContact O-CD 3.25Å; P277-V281 WeakPolarHBondContact O-CB 3.4Å; P277-V281 WeakPolarHBondContact O-CG2 3.44Å; P277-V281 PolarHBondContact O-N 2.9Å; P277-V281 VanDerWaalsContact O-N 3.13Å
278	T	94.9	Very high	94	Very high	19 Å²	19	33.6 Å²	33.6	12%	0.117	19%	0.186	C	C	.	.	H	α-helix	trans	-58.9	-51.6	176.1	-52	0	0	0	0	109.8	S8 Y235 W274 G275 T276 V281 T282	S8-T278 PolarHBondContact OG-OG1 3.14Å; Y235-T278 WeakPolarHBondContact CE2-OG1 3.16Å; W274-T278 PolarHBondContact O-N 3.05Å; W274-T278 PolarHBondContact O-OG1 3.16Å; G275-T278 WeakPolarHBondContact O-CB 3.07Å; G275-T278 PolarHBondContact O-N 3.44Å; G275-T278 VanDerWaalsContact O-N 3.11Å; T276-T278 VanDerWaalsContact C-N 3.3Å; T276-T278 PolarHBondContact O-N 2.83Å; T278-V281 PolarHBondContact O-N 2.9Å; T278-T282 HydrophobicContact CG2-CG2 4.45Å; T278-T282 WeakPolarHBondContact O-CG2 3.49Å; T278-T282 PolarHBondContact O-N 3.19Å; T278-T282 PolarHBondContact O-OG1 2.9Å; T278-T282 VanDerWaalsContact O-OG1 3.07Å
279	V	95.1	Very high	93.8	Very high	89 Å²	89	28.5 Å²	28.5	54%	0.539	17%	0.169	S	C	.	.	H	α-helix	trans	-61.4	-51.6	-178	174.5	0	0	0	0	111.8	G275 T276 V281 T282 V283	G275-V279 WeakPolarHBondContact O-CG2 3.2Å; G275-V279 PolarHBondContact O-N 3.19Å; T276-V279 PolarHBondContact O-N 3.27Å; V279-V281 VanDerWaalsContact C-N 3.31Å; V279-V281 PolarHBondContact O-N 3.47Å; V279-T282 WeakPolarHBondContact CA-OG1 3.31Å; V279-T282 PolarHBondContact O-N 3.22Å; V279-T282 PolarHBondContact O-OG1 3.31Å; V279-V283 WeakPolarHBondContact O-CG2 3.42Å; V279-V283 PolarHBondContact O-N 3.46Å
280	C	94.7	Very high	93.4	Very high	21 Å²	21	37.1 Å²	37.1	14%	0.142	20%	0.203	C	C	.	.	H	α-helix	trans	-57.8	-43.3	-178.9	-65.6	0	0	0	0	112	T276 V283 W284	T276-C280 PolarHBondContact O-N 3.2Å; T276-C280 PolarHBondContact O-SG 3.38Å; T276-C280 VanDerWaalsContact O-SG 3.36Å; C280-V283 PolarHBondContact O-N 3.29Å; C280-W284 PolarHBondContact O-N 3.14Å
281	V	95.5	Very high	93	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-73.9	-36.1	179.8	174.4	0	0	0	0	112.2	L12 V231 H234 V238 P277 T278 V279 V283 W284 A285 I309	L12-V281 HydrophobicContact CD2-CG1 4.33Å; V231-V281 HydrophobicContact CG1-CG1 3.92Å; H234-V281 HydrophobicContact CB-CG1 4.41Å; H234-V281 HydrophobicContact CB-CG2 4.13Å; V238-V281 HydrophobicContact CG2-CG2 4.41Å; P277-V281 WeakPolarHBondContact O-CB 3.4Å; P277-V281 WeakPolarHBondContact O-CG2 3.44Å; P277-V281 PolarHBondContact O-N 2.9Å; P277-V281 VanDerWaalsContact O-N 3.13Å; T278-V281 PolarHBondContact O-N 2.9Å; V279-V281 VanDerWaalsContact C-N 3.31Å; V279-V281 PolarHBondContact O-N 3.47Å; V281-V283 VanDerWaalsContact C-N 3.33Å; V281-V283 PolarHBondContact O-N 3.07Å; V281-W284 PolarHBondContact O-N 3.22Å; V281-A285 VanDerWaalsContact O-CB 3.26Å; V281-A285 WeakPolarHBondContact O-CB 3.46Å; V281-A285 PolarHBondContact O-N 3.5Å; V281-I309 HydrophobicContact CG2-CD1 3.76Å
282	T	93.7	Very high	92.1	Very high	38 Å²	38	41.9 Å²	41.9	23%	0.233	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-40.3	171.8	49.6	0	0	0	0	112.2	L12 L15 T278 V279 T286	L12-T282 HydrophobicContact CD2-CG2 3.63Å; L15-T282 HydrophobicContact CD1-CG2 4.46Å; T278-T282 HydrophobicContact CG2-CG2 4.45Å; T278-T282 WeakPolarHBondContact O-CG2 3.49Å; T278-T282 PolarHBondContact O-N 3.19Å; T278-T282 PolarHBondContact O-OG1 2.9Å; T278-T282 VanDerWaalsContact O-OG1 3.07Å; V279-T282 WeakPolarHBondContact CA-OG1 3.31Å; V279-T282 PolarHBondContact O-N 3.22Å; V279-T282 PolarHBondContact O-OG1 3.31Å; T282-T286 WeakPolarHBondContact O-CG2 3.39Å; T282-T286 PolarHBondContact O-N 2.97Å; T282-T286 PolarHBondContact O-OG1 2.99Å; T282-T286 VanDerWaalsContact O-OG1 3.13Å
283	V	94.4	Very high	91.4	Very high	64 Å²	64	41.3 Å²	41.3	39%	0.388	22%	0.218	S	C	.	.	H	α-helix	trans	-66.1	-49.9	178.1	174.5	0	0	0	0	110.3	V279 C280 V281 A285 T286 L287 V308	V279-V283 WeakPolarHBondContact O-CG2 3.42Å; V279-V283 PolarHBondContact O-N 3.46Å; C280-V283 PolarHBondContact O-N 3.29Å; V281-V283 VanDerWaalsContact C-N 3.33Å; V281-V283 PolarHBondContact O-N 3.07Å; V283-A285 PolarHBondContact O-N 3.09Å; V283-T286 PolarHBondContact O-N 3.45Å; V283-T286 PolarHBondContact O-OG1 3.08Å; V283-L287 HydrophobicContact CG1-CD1 3.9Å; V283-L287 HydrophobicContact CG1-CG 4.41Å; V283-L287 WeakPolarHBondContact O-CG 3.36Å; V283-L287 PolarHBondContact O-N 3.1Å; V283-V308 HydrophobicContact CB-CG1 4.43Å; V283-V308 HydrophobicContact CG1-CG1 4.09Å
284	W	94.5	Very high	90.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.4	-46.8	175.7	172.9	82.4	0	0	0	112.7	V231 H234 C280 V281 T286 L287 R288 W297 V308 I309	V231-W284 HydrophobicContact CG2-CZ3 4.2Å; H234-W284 AromaticContact CE1-CH2 3.52Å; H234-W284 AromaticContact CE1-CZ2 3.75Å; H234-W284 AromaticContact ND1-CH2 3.42Å; H234-W284 WeakPolarHBondContact ND1-CH2 2.97Å; H234-W284 AromaticContact ND1-CZ3 3.68Å; C280-W284 PolarHBondContact O-N 3.14Å; V281-W284 PolarHBondContact O-N 3.22Å; W284-T286 PolarHBondContact O-N 2.77Å; W284-L287 PolarHBondContact O-N 3.45Å; W284-L287 VanDerWaalsContact O-N 3.13Å; W284-R288 HydrophobicContact CD2-CG 4.44Å; W284-R288 HydrophobicContact CZ2-CG 4.04Å; W284-R288 PolarHBondContact O-N 3.36Å; W284-W297 HydrophobicContact CH2-CB 3.82Å; W284-W297 HydrophobicContact CH2-CD2 4.45Å; W284-W297 AromaticContact CH2-CE3 3.8Å; W284-W297 HydrophobicContact CH2-CE3 3.8Å; W284-W297 HydrophobicContact CZ2-CB 4.15Å; W284-W297 AromaticContact CZ3-CE3 3.78Å; W284-W297 HydrophobicContact CZ3-CE3 3.78Å; W284-W297 HydrophobicContact CZ3-CZ3 4.3Å; W284-V308 HydrophobicContact CB-CB 4.39Å; W284-V308 HydrophobicContact CB-CG1 4.03Å; W284-I309 HydrophobicContact CB-CD1 3.63Å; W284-I309 HydrophobicContact CB-CG1 3.83Å; W284-I309 HydrophobicContact CD2-CD1 4.34Å; W284-I309 HydrophobicContact CD2-CG1 4.03Å; W284-I309 HydrophobicContact CG-CD1 3.86Å; W284-I309 HydrophobicContact CG-CG1 3.55Å
285	A	92.5	Very high	89.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-41.2	178.9	0	0	0	0	0	112.3	V231 V281 V283 L287 R288 L289 W297	V231-A285 HydrophobicContact CG2-CB 3.96Å; V281-A285 VanDerWaalsContact O-CB 3.26Å; V281-A285 WeakPolarHBondContact O-CB 3.46Å; V281-A285 PolarHBondContact O-N 3.5Å; V283-A285 PolarHBondContact O-N 3.09Å; A285-L287 VanDerWaalsContact C-N 3.33Å; A285-L287 PolarHBondContact O-N 3.13Å; A285-R288 PolarHBondContact O-N 3.5Å; A285-L289 WeakPolarHBondContact O-CG 3.1Å; A285-L289 PolarHBondContact O-N 2.84Å; A285-W297 HydrophobicContact CB-CH2 4.38Å; A285-W297 HydrophobicContact CB-CZ3 3.89Å
286	T	92.2	Very high	88.3	Confident	46 Å²	46	44.1 Å²	44.1	28%	0.282	23%	0.234	S	C	.	.	H	α-helix	trans	-66.1	-34.4	173.5	54	0	0	0	0	112.7	L15 T282 V283 W284 L289 Y290	L15-T286 HydrophobicContact CD2-CG2 4.27Å; T282-T286 WeakPolarHBondContact O-CG2 3.39Å; T282-T286 PolarHBondContact O-N 2.97Å; T282-T286 PolarHBondContact O-OG1 2.99Å; T282-T286 VanDerWaalsContact O-OG1 3.13Å; V283-T286 PolarHBondContact O-N 3.45Å; V283-T286 PolarHBondContact O-OG1 3.08Å; W284-T286 PolarHBondContact O-N 2.77Å; T286-L289 PolarHBondContact O-N 3.3Å; T286-Y290 WeakPolarHBondContact O-CD2 3.41Å; T286-Y290 PolarHBondContact O-N 3.11Å; T286-Y290 VanDerWaalsContact O-N 3.11Å
287	L	91.7	Very high	87.7	Confident	49 Å²	49	41.7 Å²	41.7	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-69.2	-41.5	176.5	-69.1	170	0	0	0	111.9	V283 W284 A285 Y290 F291 L305 V308	V283-L287 HydrophobicContact CG1-CD1 3.9Å; V283-L287 HydrophobicContact CG1-CG 4.41Å; V283-L287 WeakPolarHBondContact O-CG 3.36Å; V283-L287 PolarHBondContact O-N 3.1Å; W284-L287 PolarHBondContact O-N 3.45Å; W284-L287 VanDerWaalsContact O-N 3.13Å; A285-L287 VanDerWaalsContact C-N 3.33Å; A285-L287 PolarHBondContact O-N 3.13Å; L287-Y290 PolarHBondContact O-N 2.99Å; L287-F291 HydrophobicContact CD2-CD2 3.95Å; L287-F291 HydrophobicContact CD2-CE2 3.76Å; L287-F291 WeakPolarHBondContact O-CB 3.48Å; L287-F291 WeakPolarHBondContact O-CD2 3.37Å; L287-F291 PolarHBondContact O-N 3.41Å; L287-L305 HydrophobicContact CB-CD2 4.04Å; L287-L305 HydrophobicContact CB-CG 4.17Å; L287-V308 HydrophobicContact CD1-CG2 3.89Å
288	R	88.9	Confident	86.7	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-59	-50.1	170.6	-71.5	-64.7	-63.7	-149.3	-3.2	110.9	W284 A285 Y290 F291 D292 D293 T294 W297 M299 L305	W284-R288 HydrophobicContact CD2-CG 4.44Å; W284-R288 HydrophobicContact CZ2-CG 4.04Å; W284-R288 PolarHBondContact O-N 3.36Å; A285-R288 PolarHBondContact O-N 3.5Å; R288-Y290 PolarHBondContact O-N 2.73Å; R288-Y290 VanDerWaalsContact O-N 3.15Å; R288-F291 PolarHBondContact O-N 2.88Å; R288-D292 VanDerWaalsContact CZ-CG 3.48Å; R288-D292 IonicContact CZ-OD1 3.86Å; R288-D292 IonicContact CZ-OD2 2.72Å; R288-D292 PolarHBondContact NE-O 3.4Å; R288-D292 IonicContact NE-OD2 3.2Å; R288-D292 IonicContact NH1-OD2 3.9Å; R288-D292 PolarHBondContact NH1-OD2 2.88Å; R288-D292 PolarHBondContact NH2-O 3.37Å; R288-D292 IonicContact NH2-OD1 2.7Å; R288-D292 IonicContact NH2-OD2 3.35Å; R288-D292 CarbonylContact O-C 3.58Å; R288-D292 PolarHBondContact O-N 2.91Å; R288-D293 PolarHBondContact O-N 3.46Å; R288-D293 VanDerWaalsContact O-N 3.16Å; R288-T294 PolarHBondContact NH2-O 3.46Å; R288-T294 PolarHBondContact NH2-OG1 3.45Å; R288-W297 HydrophobicContact CB-CD2 3.79Å; R288-W297 HydrophobicContact CB-CE3 4.18Å; R288-W297 HydrophobicContact CB-CG 4.18Å; R288-W297 HydrophobicContact CB-CH2 4.36Å; R288-W297 HydrophobicContact CB-CZ2 3.98Å; R288-W297 HydrophobicContact CB-CZ3 4.44Å; R288-W297 HydrophobicContact CG-CD2 4.14Å; R288-W297 HydrophobicContact CG-CE3 4.44Å; R288-W297 HydrophobicContact CG-CG 4.19Å; R288-M299 PolarHBondContact NH1-O 2.97Å; R288-M299 PolarHBondContact NH2-O 2.82Å; R288-L305 HydrophobicContact CG-CD2 4.09Å
289	L	88	Confident	85.5	Confident	36 Å²	36	48.3 Å²	48.3	19%	0.188	25%	0.253	C	S	.	.	H	α-helix	trans	-55.9	-32.5	178.4	-76.4	167.2	0	0	0	114.8	M17 A285 T286 W297	M17-L289 HydrophobicContact CB-CD2 4.04Å; M17-L289 HydrophobicContact CG-CD1 4.15Å; M17-L289 HydrophobicContact CG-CD2 4.42Å; M17-L289 HydrophobicContact SD-CD1 4.08Å; A285-L289 WeakPolarHBondContact O-CG 3.1Å; A285-L289 PolarHBondContact O-N 2.84Å; T286-L289 PolarHBondContact O-N 3.3Å; L289-W297 HydrophobicContact CD1-CH2 4.25Å; L289-W297 HydrophobicContact CD2-CH2 3.96Å; L289-W297 HydrophobicContact CD2-CZ2 3.69Å; L289-W297 HydrophobicContact CG-CH2 3.65Å; L289-W297 HydrophobicContact CG-CZ2 3.69Å
290	Y	87.5	Confident	84.4	Confident	192 Å²	192	45.8 Å²	45.8	75%	0.753	24%	0.236	S	C	*	.	H	α-helix	trans	-96.8	-26.4	-176.6	-75.4	-56.8	0	0	0	115	T286 L287 R288	T286-Y290 WeakPolarHBondContact O-CD2 3.41Å; T286-Y290 PolarHBondContact O-N 3.11Å; T286-Y290 VanDerWaalsContact O-N 3.11Å; L287-Y290 PolarHBondContact O-N 2.99Å; R288-Y290 PolarHBondContact O-N 2.73Å; R288-Y290 VanDerWaalsContact O-N 3.15Å
291	F	84.3	Confident	83.1	Confident	160 Å²	160	50 Å²	50	70%	0.702	26%	0.257	S	S	*	.	H	α-helix	trans	-120.6	-26.1	-172.4	-64.9	-78.9	0	0	0	114.5	L287 R288	L287-F291 HydrophobicContact CD2-CD2 3.95Å; L287-F291 HydrophobicContact CD2-CE2 3.76Å; L287-F291 WeakPolarHBondContact O-CB 3.48Å; L287-F291 WeakPolarHBondContact O-CD2 3.37Å; L287-F291 PolarHBondContact O-N 3.41Å; R288-F291 PolarHBondContact O-N 2.88Å
292	D	76.8	Confident	82.3	Confident	28 Å²	28	52.1 Å²	52.1	15%	0.15	27%	0.272	C	S	.	.			trans	-156.9	68.5	-169.8	-179.8	14.2	0	0	0	110.8	R288 T294 L305	R288-D292 VanDerWaalsContact CZ-CG 3.48Å; R288-D292 IonicContact CZ-OD1 3.86Å; R288-D292 IonicContact CZ-OD2 2.72Å; R288-D292 PolarHBondContact NE-O 3.4Å; R288-D292 IonicContact NE-OD2 3.2Å; R288-D292 IonicContact NH1-OD2 3.9Å; R288-D292 PolarHBondContact NH1-OD2 2.88Å; R288-D292 PolarHBondContact NH2-O 3.37Å; R288-D292 IonicContact NH2-OD1 2.7Å; R288-D292 IonicContact NH2-OD2 3.35Å; R288-D292 CarbonylContact O-C 3.58Å; R288-D292 PolarHBondContact O-N 2.91Å; D292-T294 PolarHBondContact O-N 3.06Å; D292-T294 VanDerWaalsContact O-N 3.14Å; D292-T294 VanDerWaalsContact OD1-CG2 3.29Å; D292-T294 WeakPolarHBondContact OD1-CG2 3.43Å; D292-T294 PolarHBondContact OD1-OG1 3.04Å; D292-L305 HydrophobicContact CB-CD2 4.38Å
293	D	79.2	Confident	81.7	Confident	43 Å²	43	54.6 Å²	54.6	23%	0.23	29%	0.287	C	S	.	.			trans	-88.1	39.3	-176.2	-163.2	31.4	0	0	0	113.3	K227 R288 W297	K227-D293 WeakPolarHBondContact CE-OD1 3.3Å; K227-D293 IonicContact NZ-OD1 2.68Å; K227-D293 PolarHBondContact NZ-OD1 2.87Å; K227-D293 IonicContact NZ-OD2 2.77Å; K227-D293 PolarHBondContact NZ-OD2 3.13Å; R288-D293 PolarHBondContact O-N 3.46Å; R288-D293 VanDerWaalsContact O-N 3.16Å; D293-W297 VanDerWaalsContact OD1-CE2 3.32Å; D293-W297 VanDerWaalsContact OD1-CZ2 3.28Å; D293-W297 WeakPolarHBondContact OD1-CZ2 3.42Å; D293-W297 PolarHBondContact OD1-NE1 3.41Å
294	T	71.4	Confident	81.4	Confident	69 Å²	69	55 Å²	55	42%	0.423	30%	0.297	S	S	.	.			trans	-82.8	140.9	-176	53.4	0	0	0	0	113	R288 D292 C296 W297	R288-T294 PolarHBondContact NH2-O 3.46Å; R288-T294 PolarHBondContact NH2-OG1 3.45Å; D292-T294 PolarHBondContact O-N 3.06Å; D292-T294 VanDerWaalsContact O-N 3.14Å; D292-T294 VanDerWaalsContact OD1-CG2 3.29Å; D292-T294 WeakPolarHBondContact OD1-CG2 3.43Å; D292-T294 PolarHBondContact OD1-OG1 3.04Å; T294-C296 PolarHBondContact O-N 3.49Å; T294-W297 PolarHBondContact O-N 3.19Å
295	G	71.6	Confident	81	Confident	19 Å²	19	56 Å²	56	20%	0.196	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	-131.3	170.9	0	0	0	0	0	114.7	S222 K227	S222-G295 WeakPolarHBondContact CB-O 3.43Å; S222-G295 WeakPolarHBondContact OG-CA 3.44Å; S222-G295 PolarHBondContact OG-O 3.38Å; K227-G295 WeakPolarHBondContact CE-O 3.24Å
296	C	76.5	Confident	80.8	Confident	1 Å²	1	59 Å²	59	1%	0.007	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-0.1	176.7	-179.6	0	0	0	0	112.9	I221 C226 M230 T294 D298	I221-C296 HydrophobicContact CG2-CB 4.27Å; C226-C296 HydrophobicContact CB-CB 4.08Å; C226-C296 WeakPolarHBondContact CB-SG 3.45Å; C226-C296 PolarHBondContact O-SG 3.46Å; C226-C296 VanDerWaalsContact O-SG 3.39Å; C226-C296 WeakPolarHBondContact SG-CB 3.39Å; C226-C296 CovalentContact SG-SG 2.03Å; C226-C296 PolarHBondContact SG-SG 2.8Å; M230-C296 WeakPolarHBondContact CB-O 3.36Å; M230-C296 VanDerWaalsContact CG-O 3.29Å; M230-C296 WeakPolarHBondContact CG-O 3.32Å; M230-C296 WeakPolarHBondContact CG-SG 3.4Å; T294-C296 PolarHBondContact O-N 3.49Å; C296-D298 VanDerWaalsContact C-N 3.35Å
297	W	82.6	Confident	80.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	65.3	32.7	-167.7	-41	-22.3	0	0	0	114.3	M17 K227 V231 W284 A285 R288 L289 D293 T294	M17-W297 HydrophobicContact CE-CH2 4.02Å; M17-W297 HydrophobicContact CE-CZ3 4.2Å; M17-W297 HydrophobicContact SD-CH2 3.55Å; M17-W297 VanDerWaalsContact SD-CH2 3.55Å; M17-W297 HydrophobicContact SD-CZ3 4.04Å; K227-W297 HydrophobicContact CD-CZ2 3.97Å; K227-W297 HydrophobicContact CG-CD2 4.45Å; V231-W297 HydrophobicContact CG2-CE3 4.01Å; V231-W297 HydrophobicContact CG2-CZ3 3.49Å; V231-W297 VanDerWaalsContact CG2-CZ3 3.49Å; W284-W297 HydrophobicContact CH2-CB 3.82Å; W284-W297 HydrophobicContact CH2-CD2 4.45Å; W284-W297 AromaticContact CH2-CE3 3.8Å; W284-W297 HydrophobicContact CH2-CE3 3.8Å; W284-W297 HydrophobicContact CZ2-CB 4.15Å; W284-W297 AromaticContact CZ3-CE3 3.78Å; W284-W297 HydrophobicContact CZ3-CE3 3.78Å; W284-W297 HydrophobicContact CZ3-CZ3 4.3Å; A285-W297 HydrophobicContact CB-CH2 4.38Å; A285-W297 HydrophobicContact CB-CZ3 3.89Å; R288-W297 HydrophobicContact CB-CD2 3.79Å; R288-W297 HydrophobicContact CB-CE3 4.18Å; R288-W297 HydrophobicContact CB-CG 4.18Å; R288-W297 HydrophobicContact CB-CH2 4.36Å; R288-W297 HydrophobicContact CB-CZ2 3.98Å; R288-W297 HydrophobicContact CB-CZ3 4.44Å; R288-W297 HydrophobicContact CG-CD2 4.14Å; R288-W297 HydrophobicContact CG-CE3 4.44Å; R288-W297 HydrophobicContact CG-CG 4.19Å; L289-W297 HydrophobicContact CD1-CH2 4.25Å; L289-W297 HydrophobicContact CD2-CH2 3.96Å; L289-W297 HydrophobicContact CD2-CZ2 3.69Å; L289-W297 HydrophobicContact CG-CH2 3.65Å; L289-W297 HydrophobicContact CG-CZ2 3.69Å; D293-W297 VanDerWaalsContact OD1-CE2 3.32Å; D293-W297 VanDerWaalsContact OD1-CZ2 3.28Å; D293-W297 WeakPolarHBondContact OD1-CZ2 3.42Å; D293-W297 PolarHBondContact OD1-NE1 3.41Å; T294-W297 PolarHBondContact O-N 3.19Å
298	D	74.7	Confident	80.8	Confident	64 Å²	64	62.8 Å²	62.8	34%	0.342	32%	0.324	S	S	.	.			trans	-80.2	-45.2	162.8	51.5	-20.3	0	0	0	111.8	M230 C296 N300	M230-D298 HydrophobicContact CE-CB 4.18Å; C296-D298 VanDerWaalsContact C-N 3.35Å; D298-N300 PolarHBondContact O-ND2 3.18Å
299	M	69.1	Low	81	Confident	94 Å²	94	63 Å²	63	46%	0.463	33%	0.325	S	S	.	.			trans	-76.5	132.5	173.2	-58.9	-58.8	-77.8	0	0	111.6	I83 R288	I83-M299 HydrophobicContact CG2-CE 4.41Å; R288-M299 PolarHBondContact NH1-O 2.97Å; R288-M299 PolarHBondContact NH2-O 2.82Å
300	N	73	Confident	81.1	Confident	36 Å²	36	63.1 Å²	63.1	19%	0.193	32%	0.324	C	S	.	.			trans	-123.4	41.7	-168.7	-82.3	-89.8	0	0	0	111.9	D298 S302 W306	D298-N300 PolarHBondContact O-ND2 3.18Å; N300-S302 VanDerWaalsContact C-N 3.27Å; N300-S302 CarbonylContact O-C 3.59Å; N300-S302 PolarHBondContact O-N 3.37Å; N300-W306 HydrophobicContact CB-CB 4.46Å; N300-W306 HydrophobicContact CB-CD2 4.36Å; N300-W306 HydrophobicContact CB-CE3 4.27Å; N300-W306 HydrophobicContact CB-CG 4.46Å
301	D	67.2	Low	81.4	Confident	108 Å²	108	55.1 Å²	55.1	58%	0.578	30%	0.3	S	S	*	.			trans	-58.9	-38.3	-169.4	-39.8	-39.7	0	0	0	111.9	T303	D301-T303 PolarHBondContact O-N 3.11Å
302	S	78.3	Confident	81.9	Confident	45 Å²	45	49.4 Å²	49.4	32%	0.315	28%	0.279	S	S	.	.			trans	-72.9	91.5	168.8	-167.1	0	0	0	0	111.9	N300 A304 L305 W306	N300-S302 VanDerWaalsContact C-N 3.27Å; N300-S302 CarbonylContact O-C 3.59Å; N300-S302 PolarHBondContact O-N 3.37Å; S302-A304 PolarHBondContact O-N 2.72Å; S302-L305 PolarHBondContact O-N 3.11Å; S302-L305 WeakPolarHBondContact OG-CD1 3.15Å; S302-W306 PolarHBondContact O-N 2.7Å; S302-W306 VanDerWaalsContact O-N 3.14Å
303	T	81.8	Confident	82.7	Confident	91 Å²	91	49 Å²	49	56%	0.558	28%	0.277	S	S	*	.	H	α-helix	trans	-48.1	-34.2	172.9	-73.3	0	0	0	0	112.9	D301 W306 W307	D301-T303 PolarHBondContact O-N 3.11Å; T303-W306 PolarHBondContact O-N 2.87Å; T303-W307 VanDerWaalsContact O-CD1 3.25Å; T303-W307 PolarHBondContact O-N 3.25Å; T303-W307 VanDerWaalsContact O-N 3.12Å
304	A	86.6	Confident	83.2	Confident	72 Å²	72	48 Å²	48	60%	0.595	27%	0.273	S	S	*	.	H	α-helix	trans	-63.4	-41.1	177.6	0	0	0	0	0	112.9	S302	S302-A304 PolarHBondContact O-N 2.72Å
305	L	87.2	Confident	84.3	Confident	20 Å²	20	46.4 Å²	46.4	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-72.9	-37.8	175.7	-84.4	71.1	0	0	0	110.8	L287 R288 D292 S302 W307 V308	L287-L305 HydrophobicContact CB-CD2 4.04Å; L287-L305 HydrophobicContact CB-CG 4.17Å; R288-L305 HydrophobicContact CG-CD2 4.09Å; D292-L305 HydrophobicContact CB-CD2 4.38Å; S302-L305 PolarHBondContact O-N 3.11Å; S302-L305 WeakPolarHBondContact OG-CD1 3.15Å; L305-W307 VanDerWaalsContact C-N 3.29Å; L305-W307 PolarHBondContact O-N 3.46Å; L305-V308 VanDerWaalsContact O-CB 3.28Å; L305-V308 WeakPolarHBondContact O-CB 3.49Å; L305-V308 WeakPolarHBondContact O-CG2 3.4Å; L305-V308 PolarHBondContact O-N 2.8Å
306	W	88.7	Confident	85.4	Confident	65 Å²	65	46 Å²	46	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-58.5	-38.6	177.1	-175.7	-138.5	0	0	0	112.7	H234 N300 S302 T303 V308 I309 K310 E374	H234-W306 AromaticContact NE2-CZ3 3.81Å; N300-W306 HydrophobicContact CB-CB 4.46Å; N300-W306 HydrophobicContact CB-CD2 4.36Å; N300-W306 HydrophobicContact CB-CE3 4.27Å; N300-W306 HydrophobicContact CB-CG 4.46Å; S302-W306 PolarHBondContact O-N 2.7Å; S302-W306 VanDerWaalsContact O-N 3.14Å; T303-W306 PolarHBondContact O-N 2.87Å; W306-V308 PolarHBondContact O-N 3.22Å; W306-I309 HydrophobicContact CZ3-CG2 4.48Å; W306-I309 PolarHBondContact O-N 3.28Å; W306-I309 VanDerWaalsContact O-N 3.1Å; W306-K310 WeakPolarHBondContact O-CB 3.3Å; W306-K310 PolarHBondContact O-N 2.9Å; W306-E374 PolarHBondContact NE1-OE2 3.15Å
307	W	91.2	Very high	86.1	Confident	134 Å²	134	46.7 Å²	46.7	51%	0.508	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-21.2	175.9	-87.9	108.2	0	0	0	114.8	T303 L305 I309 K310 G311	T303-W307 VanDerWaalsContact O-CD1 3.25Å; T303-W307 PolarHBondContact O-N 3.25Å; T303-W307 VanDerWaalsContact O-N 3.12Å; L305-W307 VanDerWaalsContact C-N 3.29Å; L305-W307 PolarHBondContact O-N 3.46Å; W307-I309 VanDerWaalsContact C-N 3.25Å; W307-I309 PolarHBondContact O-N 3.1Å; W307-K310 HydrophobicContact CE3-CB 4.49Å; W307-K310 HydrophobicContact CE3-CG 4.36Å; W307-K310 HydrophobicContact CZ3-CG 4.36Å; W307-G311 WeakPolarHBondContact O-CA 3.34Å; W307-G311 PolarHBondContact O-N 2.94Å
308	V	92.9	Very high	86.5	Confident	39 Å²	39	48.9 Å²	48.9	24%	0.236	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-31.1	174.7	-176.3	0	0	0	0	111.7	V283 W284 L287 L305 W306 P312	V283-V308 HydrophobicContact CB-CG1 4.43Å; V283-V308 HydrophobicContact CG1-CG1 4.09Å; W284-V308 HydrophobicContact CB-CB 4.39Å; W284-V308 HydrophobicContact CB-CG1 4.03Å; L287-V308 HydrophobicContact CD1-CG2 3.89Å; L305-V308 VanDerWaalsContact O-CB 3.28Å; L305-V308 WeakPolarHBondContact O-CB 3.49Å; L305-V308 WeakPolarHBondContact O-CG2 3.4Å; L305-V308 PolarHBondContact O-N 2.8Å; W306-V308 PolarHBondContact O-N 3.22Å; V308-P312 VanDerWaalsContact O-CD 3.3Å; V308-P312 WeakPolarHBondContact O-CD 3.41Å; V308-P312 WeakPolarHBondContact O-CG 3.14Å
309	I	92.6	Very high	87.4	Confident	8 Å²	8	49.2 Å²	49.2	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-94.3	-48.7	174.6	-63	-58.7	0	0	0	111.1	V238 V281 W284 W306 W307 G311 P312 V313	V238-I309 HydrophobicContact CG2-CG2 3.78Å; V281-I309 HydrophobicContact CG2-CD1 3.76Å; W284-I309 HydrophobicContact CB-CD1 3.63Å; W284-I309 HydrophobicContact CB-CG1 3.83Å; W284-I309 HydrophobicContact CD2-CD1 4.34Å; W284-I309 HydrophobicContact CD2-CG1 4.03Å; W284-I309 HydrophobicContact CG-CD1 3.86Å; W284-I309 HydrophobicContact CG-CG1 3.55Å; W306-I309 HydrophobicContact CZ3-CG2 4.48Å; W306-I309 PolarHBondContact O-N 3.28Å; W306-I309 VanDerWaalsContact O-N 3.1Å; W307-I309 VanDerWaalsContact C-N 3.25Å; W307-I309 PolarHBondContact O-N 3.1Å; I309-G311 PolarHBondContact O-N 2.97Å; I309-P312 WeakPolarHBondContact O-CD 3.49Å; I309-V313 WeakPolarHBondContact O-CG2 3.2Å; I309-V313 PolarHBondContact O-N 2.87Å
310	K	90.6	Very high	88.5	Confident	38 Å²	38	45 Å²	45	17%	0.165	26%	0.262	C	S	.	.	H	α-helix	trans	-65.3	-38.7	-175.2	178.4	173	171.9	175.3	0	112.8	W306 W307 V313 V314 E374	W306-K310 WeakPolarHBondContact O-CB 3.3Å; W306-K310 PolarHBondContact O-N 2.9Å; W307-K310 HydrophobicContact CE3-CB 4.49Å; W307-K310 HydrophobicContact CE3-CG 4.36Å; W307-K310 HydrophobicContact CZ3-CG 4.36Å; K310-V313 PolarHBondContact O-N 2.88Å; K310-V314 HydrophobicContact CG-CG2 4.05Å; K310-V314 WeakPolarHBondContact O-CG2 3.4Å; K310-V314 PolarHBondContact O-N 3.03Å; K310-E374 WeakPolarHBondContact CE-OE1 3.03Å; K310-E374 IonicContact NZ-OE1 3.98Å; K310-E374 PolarHBondContact NZ-OE1 3.3Å; K310-E374 IonicContact NZ-OE2 2.69Å; K310-E374 PolarHBondContact NZ-OE2 3.23Å
311	G	92.3	Very high	89.3	Confident	24 Å²	24	47 Å²	47	25%	0.247	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-56.6	-179.9	0	0	0	0	0	113.4	W307 I309 V313 V314 G315	W307-G311 WeakPolarHBondContact O-CA 3.34Å; W307-G311 PolarHBondContact O-N 2.94Å; I309-G311 PolarHBondContact O-N 2.97Å; G311-V313 VanDerWaalsContact C-N 3.29Å; G311-V313 PolarHBondContact O-N 3.46Å; G311-V314 PolarHBondContact O-N 3.37Å; G311-G315 PolarHBondContact O-N 3.5Å
312	P	95	Very high	90.5	Very high	40 Å²	40	46.9 Å²	46.9	26%	0.26	27%	0.272	S	S	.	.	H	α-helix	trans	-56.7	-38	174.4	-28.6	36.2	0	0	0	114	F242 V308 I309 S316	F242-P312 HydrophobicContact CE2-CB 4.13Å; F242-P312 HydrophobicContact CZ-CB 4.22Å; V308-P312 VanDerWaalsContact O-CD 3.3Å; V308-P312 WeakPolarHBondContact O-CD 3.41Å; V308-P312 WeakPolarHBondContact O-CG 3.14Å; I309-P312 WeakPolarHBondContact O-CD 3.49Å; P312-S316 WeakPolarHBondContact O-CB 3.45Å; P312-S316 PolarHBondContact O-N 3.11Å
313	V	93.5	Very high	91.2	Very high	18 Å²	18	45.5 Å²	45.5	11%	0.109	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-54.9	177.1	169.8	0	0	0	0	111.1	V238 Y241 I309 K310 G311 G315 S316 I317	V238-V313 HydrophobicContact CG1-CG2 4.37Å; V238-V313 HydrophobicContact CG2-CG2 3.95Å; Y241-V313 HydrophobicContact CD1-CG1 4.09Å; Y241-V313 HydrophobicContact CD2-CB 4.48Å; Y241-V313 HydrophobicContact CD2-CG1 3.6Å; Y241-V313 HydrophobicContact CD2-CG2 4.03Å; Y241-V313 HydrophobicContact CE1-CG1 4.24Å; Y241-V313 HydrophobicContact CE2-CG1 3.75Å; Y241-V313 HydrophobicContact CG-CG1 3.78Å; Y241-V313 HydrophobicContact CG-CG2 4.48Å; I309-V313 WeakPolarHBondContact O-CG2 3.2Å; I309-V313 PolarHBondContact O-N 2.87Å; K310-V313 PolarHBondContact O-N 2.88Å; G311-V313 VanDerWaalsContact C-N 3.29Å; G311-V313 PolarHBondContact O-N 3.46Å; V313-G315 VanDerWaalsContact C-N 3.31Å; V313-G315 PolarHBondContact O-N 3.43Å; V313-S316 PolarHBondContact O-N 3.01Å; V313-S316 VanDerWaalsContact O-N 3.11Å; V313-S316 PolarHBondContact O-OG 3.25Å; V313-I317 HydrophobicContact CG1-CD1 3.81Å; V313-I317 WeakPolarHBondContact O-CG1 3.41Å; V313-I317 PolarHBondContact O-N 2.96Å
314	V	91.5	Very high	91.6	Very high	23 Å²	23	42 Å²	42	14%	0.139	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-41.2	178.7	173.5	0	0	0	0	111.2	K310 G311 S316 I317 M318	K310-V314 HydrophobicContact CG-CG2 4.05Å; K310-V314 WeakPolarHBondContact O-CG2 3.4Å; K310-V314 PolarHBondContact O-N 3.03Å; G311-V314 PolarHBondContact O-N 3.37Å; V314-S316 PolarHBondContact O-N 3.49Å; V314-I317 PolarHBondContact O-N 2.84Å; V314-M318 HydrophobicContact CG1-CG 4.44Å; V314-M318 WeakPolarHBondContact O-CG 3.34Å; V314-M318 PolarHBondContact O-N 3.34Å
315	G	93.4	Very high	91.7	Very high	36 Å²	36	42.3 Å²	42.3	37%	0.371	23%	0.229	S	C	.	.	H	α-helix	trans	-58.7	-44.7	173.9	0	0	0	0	0	112.8	G311 V313 I317 M318 V319	G311-G315 PolarHBondContact O-N 3.5Å; V313-G315 VanDerWaalsContact C-N 3.31Å; V313-G315 PolarHBondContact O-N 3.43Å; G315-I317 PolarHBondContact O-N 2.94Å; G315-M318 PolarHBondContact O-N 3.18Å; G315-V319 WeakPolarHBondContact O-CG2 3.41Å; G315-V319 PolarHBondContact O-N 3.48Å
316	S	94.3	Very high	92	Very high	9 Å²	9	42.3 Å²	42.3	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-39.9	176.8	77.2	0	0	0	0	112.4	P312 V313 V314 N320	P312-S316 WeakPolarHBondContact O-CB 3.45Å; P312-S316 PolarHBondContact O-N 3.11Å; V313-S316 PolarHBondContact O-N 3.01Å; V313-S316 VanDerWaalsContact O-N 3.11Å; V313-S316 PolarHBondContact O-OG 3.25Å; V314-S316 PolarHBondContact O-N 3.49Å; S316-N320 WeakPolarHBondContact O-CB 3.3Å; S316-N320 PolarHBondContact O-N 2.95Å
317	I	91.7	Very high	92	Very high	17 Å²	17	39.4 Å²	39.4	9%	0.087	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-44	177.2	-65.8	162.6	0	0	0	110.6	Y241 V313 V314 G315 N320 F321 T367	Y241-I317 HydrophobicContact CD1-CD1 4Å; Y241-I317 HydrophobicContact CD1-CG1 4.05Å; Y241-I317 HydrophobicContact CE1-CD1 3.81Å; Y241-I317 HydrophobicContact CE1-CG1 4.27Å; V313-I317 HydrophobicContact CG1-CD1 3.81Å; V313-I317 WeakPolarHBondContact O-CG1 3.41Å; V313-I317 PolarHBondContact O-N 2.96Å; V314-I317 PolarHBondContact O-N 2.84Å; G315-I317 PolarHBondContact O-N 2.94Å; I317-N320 PolarHBondContact O-N 3.39Å; I317-F321 PolarHBondContact O-N 3.05Å; I317-T367 HydrophobicContact CG2-CG2 3.64Å
318	M	91.6	Very high	91.8	Very high	45 Å²	45	34.6 Å²	34.6	22%	0.222	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-43.4	178.9	-73.9	-58.8	122.7	0	0	112.9	V314 G315 N320 F321 V322 A370 F371	V314-M318 HydrophobicContact CG1-CG 4.44Å; V314-M318 WeakPolarHBondContact O-CG 3.34Å; V314-M318 PolarHBondContact O-N 3.34Å; G315-M318 PolarHBondContact O-N 3.18Å; M318-N320 VanDerWaalsContact C-N 3.32Å; M318-N320 PolarHBondContact O-N 2.91Å; M318-F321 PolarHBondContact O-N 3.1Å; M318-V322 PolarHBondContact O-N 3.45Å; M318-A370 HydrophobicContact CE-CB 3.7Å; M318-F371 HydrophobicContact CE-CD2 4.15Å; M318-F371 HydrophobicContact CE-CE2 3.46Å; M318-F371 VanDerWaalsContact CE-CE2 3.46Å; M318-F371 HydrophobicContact CE-CZ 3.88Å; M318-F371 HydrophobicContact CG-CZ 4.02Å; M318-F371 HydrophobicContact SD-CE2 3.38Å; M318-F371 WeakPolarHBondContact SD-CE2 3.07Å; M318-F371 HydrophobicContact SD-CZ 3.42Å; M318-F371 WeakPolarHBondContact SD-CZ 3.43Å
319	V	93.3	Very high	91.6	Very high	72 Å²	72	36.2 Å²	36.2	44%	0.436	22%	0.216	S	C	.	.	H	α-helix	trans	-64.5	-39.7	174.3	179.8	0	0	0	0	110.4	F245 G315 F321 V322 L323	F245-V319 HydrophobicContact CD2-CB 4.45Å; F245-V319 HydrophobicContact CD2-CG1 4.26Å; F245-V319 HydrophobicContact CE2-CB 4.2Å; F245-V319 HydrophobicContact CE2-CG1 3.65Å; G315-V319 WeakPolarHBondContact O-CG2 3.41Å; G315-V319 PolarHBondContact O-N 3.48Å; V319-F321 VanDerWaalsContact C-N 3.3Å; V319-F321 PolarHBondContact O-N 3.38Å; V319-V322 PolarHBondContact O-N 3.36Å; V319-L323 HydrophobicContact CG1-CD1 3.96Å; V319-L323 HydrophobicContact CG1-CG 4.25Å; V319-L323 VanDerWaalsContact O-CG 3.27Å; V319-L323 WeakPolarHBondContact O-CG 3.1Å; V319-L323 PolarHBondContact O-N 3.23Å
320	N	91.5	Very high	91.4	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-32.7	177.9	-141.2	22.2	0	0	0	112.9	L244 G248 S316 I317 M318 F324 F362	L244-N320 PolarHBondContact O-ND2 2.88Å; G248-N320 WeakPolarHBondContact CA-OD1 3.29Å; S316-N320 WeakPolarHBondContact O-CB 3.3Å; S316-N320 PolarHBondContact O-N 2.95Å; I317-N320 PolarHBondContact O-N 3.39Å; M318-N320 VanDerWaalsContact C-N 3.32Å; M318-N320 PolarHBondContact O-N 2.91Å; N320-F324 WeakPolarHBondContact O-CB 3.42Å; N320-F324 PolarHBondContact O-N 2.03Å; N320-F362 PolarHBondContact ND2-O 3.13Å
321	F	90.8	Very high	91.1	Very high	80 Å²	80	37.3 Å²	37.3	35%	0.351	22%	0.224	S	C	.	.	H	α-helix	trans	-63.8	-47.1	172	-177.7	-106.1	0	0	0	112.1	I317 M318 V319 L323 F324 I325 I364 T367	I317-F321 PolarHBondContact O-N 3.05Å; M318-F321 PolarHBondContact O-N 3.1Å; V319-F321 VanDerWaalsContact C-N 3.3Å; V319-F321 PolarHBondContact O-N 3.38Å; F321-L323 VanDerWaalsContact C-N 3.34Å; F321-L323 PolarHBondContact O-N 2.9Å; F321-F324 WeakPolarHBondContact O-CB 3.49Å; F321-F324 PolarHBondContact O-N 3.04Å; F321-I325 HydrophobicContact CE1-CG1 4.19Å; F321-I325 HydrophobicContact CE2-CD1 4.37Å; F321-I325 HydrophobicContact CE2-CG1 4.46Å; F321-I325 HydrophobicContact CZ-CD1 4.18Å; F321-I325 HydrophobicContact CZ-CG1 4.14Å; F321-I325 WeakPolarHBondContact O-CG1 3.39Å; F321-I325 PolarHBondContact O-N 3.26Å; F321-I364 HydrophobicContact CD2-CD1 4.44Å; F321-I364 HydrophobicContact CD2-CG2 4.16Å; F321-I364 HydrophobicContact CE2-CG2 4.42Å; F321-T367 HydrophobicContact CB-CG2 3.92Å; F321-T367 HydrophobicContact CD2-CG2 3.94Å; F321-T367 HydrophobicContact CG-CG2 4.19Å
322	V	92.2	Very high	90.7	Very high	104 Å²	104	38.1 Å²	38.1	63%	0.63	22%	0.224	S	C	*	.	H	α-helix	trans	-61.8	-42.4	176.4	176.5	0	0	0	0	111.2	M318 V319 I325 G326	M318-V322 PolarHBondContact O-N 3.45Å; V319-V322 PolarHBondContact O-N 3.36Å; V322-I325 PolarHBondContact O-N 2.9Å; V322-G326 PolarHBondContact O-N 2.9Å
323	L	92.6	Very high	90.1	Very high	16 Å²	16	41.8 Å²	41.8	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-42.7	174.7	-67.7	169.9	0	0	0	111.7	F245 L249 F252 V319 F321 G326 I327	F245-L323 HydrophobicContact CD2-CD1 4.3Å; F245-L323 HydrophobicContact CE2-CD1 4.11Å; L249-L323 HydrophobicContact CB-CD1 4.13Å; L249-L323 HydrophobicContact CD1-CD1 4.32Å; L249-L323 HydrophobicContact CD1-CD2 4.44Å; F252-L323 HydrophobicContact CB-CD2 3.79Å; F252-L323 HydrophobicContact CD1-CD2 3.49Å; F252-L323 VanDerWaalsContact CD1-CD2 3.49Å; F252-L323 HydrophobicContact CD2-CD2 4.14Å; F252-L323 HydrophobicContact CE1-CD2 4.06Å; F252-L323 HydrophobicContact CG-CD2 3.53Å; V319-L323 HydrophobicContact CG1-CD1 3.96Å; V319-L323 HydrophobicContact CG1-CG 4.25Å; V319-L323 VanDerWaalsContact O-CG 3.27Å; V319-L323 WeakPolarHBondContact O-CG 3.1Å; V319-L323 PolarHBondContact O-N 3.23Å; F321-L323 VanDerWaalsContact C-N 3.34Å; F321-L323 PolarHBondContact O-N 2.9Å; L323-G326 PolarHBondContact O-N 3.48Å; L323-I327 WeakPolarHBondContact O-CD1 3.4Å; L323-I327 VanDerWaalsContact O-CG1 3.23Å; L323-I327 WeakPolarHBondContact O-CG1 3.43Å; L323-I327 PolarHBondContact O-N 3.47Å
324	F	90.6	Very high	89.6	Confident	17 Å²	17	46.6 Å²	46.6	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-47.9	175.7	169.8	-117.2	0	0	0	112.1	N320 F321 G326 I327 I328 T355 L358 I359 F362 I364	N320-F324 WeakPolarHBondContact O-CB 3.42Å; N320-F324 PolarHBondContact O-N 2.03Å; F321-F324 WeakPolarHBondContact O-CB 3.49Å; F321-F324 PolarHBondContact O-N 3.04Å; F324-G326 VanDerWaalsContact C-N 3.31Å; F324-G326 PolarHBondContact O-N 3.39Å; F324-I327 PolarHBondContact O-N 3.45Å; F324-I328 HydrophobicContact CD2-CD1 4.46Å; F324-I328 HydrophobicContact CD2-CG1 4.02Å; F324-I328 HydrophobicContact CE2-CD1 3.88Å; F324-I328 HydrophobicContact CE2-CG1 3.68Å; F324-I328 HydrophobicContact CZ-CD1 4.41Å; F324-I328 HydrophobicContact CZ-CG1 4Å; F324-I328 WeakPolarHBondContact O-CG1 3.42Å; F324-I328 PolarHBondContact O-N 2.95Å; F324-T355 HydrophobicContact CE2-CG2 4.28Å; F324-T355 HydrophobicContact CZ-CG2 3.92Å; F324-L358 HydrophobicContact CD2-CB 4.47Å; F324-L358 HydrophobicContact CE2-CB 4.01Å; F324-I359 HydrophobicContact CZ-CG1 4.04Å; F324-F362 HydrophobicContact CB-CD2 4.03Å; F324-F362 AromaticContact CD2-CD2 3.55Å; F324-F362 HydrophobicContact CD2-CD2 3.55Å; F324-F362 AromaticContact CD2-CE2 3.83Å; F324-F362 HydrophobicContact CD2-CE2 3.83Å; F324-F362 HydrophobicContact CE2-CD2 4.38Å; F324-F362 HydrophobicContact CG-CD2 4.13Å; F324-I364 HydrophobicContact CB-CD1 3.78Å; F324-I364 HydrophobicContact CB-CG1 4.46Å; F324-I364 HydrophobicContact CD1-CD1 3.87Å; F324-I364 HydrophobicContact CD1-CG1 3.88Å; F324-I364 HydrophobicContact CD1-CG2 4.41Å; F324-I364 HydrophobicContact CE1-CG1 4.18Å; F324-I364 HydrophobicContact CE1-CG2 4.36Å; F324-I364 HydrophobicContact CG-CD1 3.88Å; F324-I364 HydrophobicContact CG-CG1 4.04Å
325	I	89.4	Confident	88.7	Confident	80 Å²	80	46.9 Å²	46.9	41%	0.41	26%	0.258	S	S	.	.	H	α-helix	trans	-59.2	-43.4	175.4	-61.9	-59	0	0	0	110.8	F321 V322 I327 I328 V329	F321-I325 HydrophobicContact CE1-CG1 4.19Å; F321-I325 HydrophobicContact CE2-CD1 4.37Å; F321-I325 HydrophobicContact CE2-CG1 4.46Å; F321-I325 HydrophobicContact CZ-CD1 4.18Å; F321-I325 HydrophobicContact CZ-CG1 4.14Å; F321-I325 WeakPolarHBondContact O-CG1 3.39Å; F321-I325 PolarHBondContact O-N 3.26Å; V322-I325 PolarHBondContact O-N 2.9Å; I325-I327 PolarHBondContact O-N 3.34Å; I325-I328 PolarHBondContact O-N 3.45Å; I325-V329 WeakPolarHBondContact O-CG2 3.47Å; I325-V329 PolarHBondContact O-N 2.98Å
326	G	91.6	Very high	87.8	Confident	20 Å²	20	51.5 Å²	51.5	21%	0.206	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-44.1	174.7	0	0	0	0	0	113.7	V322 L323 F324 I328 V329 I330	V322-G326 PolarHBondContact O-N 2.9Å; L323-G326 PolarHBondContact O-N 3.48Å; F324-G326 VanDerWaalsContact C-N 3.31Å; F324-G326 PolarHBondContact O-N 3.39Å; G326-I328 VanDerWaalsContact C-N 3.34Å; G326-I328 PolarHBondContact O-N 3.13Å; G326-V329 PolarHBondContact O-N 2.81Å; G326-I330 WeakPolarHBondContact O-CD1 3.42Å; G326-I330 VanDerWaalsContact O-CG1 3.32Å; G326-I330 WeakPolarHBondContact O-CG1 3.26Å; G326-I330 PolarHBondContact O-N 2.95Å
327	I	89.6	Confident	86.5	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-43.4	175.1	-69.6	161.5	0	0	0	110.7	L251 F252 L255 L323 F324 I325 I330 L331 L358 F362	L251-I327 HydrophobicContact CB-CD1 4.34Å; L251-I327 HydrophobicContact CD2-CD1 4.29Å; L251-I327 HydrophobicContact CD2-CG2 4.39Å; F252-I327 HydrophobicContact CB-CD1 4.21Å; F252-I327 HydrophobicContact CB-CG1 4.12Å; F252-I327 HydrophobicContact CD2-CG1 4.12Å; L255-I327 HydrophobicContact CD1-CB 4.46Å; L255-I327 HydrophobicContact CD1-CG1 4.2Å; L255-I327 HydrophobicContact CD1-CG2 3.95Å; L323-I327 WeakPolarHBondContact O-CD1 3.4Å; L323-I327 VanDerWaalsContact O-CG1 3.23Å; L323-I327 WeakPolarHBondContact O-CG1 3.43Å; L323-I327 PolarHBondContact O-N 3.47Å; F324-I327 PolarHBondContact O-N 3.45Å; I325-I327 PolarHBondContact O-N 3.34Å; I327-I330 PolarHBondContact O-N 3.07Å; I327-L331 VanDerWaalsContact O-CB 3.23Å; I327-L331 WeakPolarHBondContact O-CB 3.34Å; I327-L331 PolarHBondContact O-N 2.96Å; I327-L358 HydrophobicContact CG2-CD1 4.46Å; I327-F362 HydrophobicContact CD1-CE1 4.5Å; I327-F362 HydrophobicContact CD1-CE2 4Å; I327-F362 HydrophobicContact CD1-CZ 3.73Å
328	I	86.2	Confident	85.1	Confident	33 Å²	33	58.6 Å²	58.6	17%	0.169	32%	0.318	C	S	.	.	H	α-helix	trans	-66.7	-41.3	178.7	-65.7	-54.7	0	0	0	111.6	F324 I325 G326 L331 V332 T355 L358	F324-I328 HydrophobicContact CD2-CD1 4.46Å; F324-I328 HydrophobicContact CD2-CG1 4.02Å; F324-I328 HydrophobicContact CE2-CD1 3.88Å; F324-I328 HydrophobicContact CE2-CG1 3.68Å; F324-I328 HydrophobicContact CZ-CD1 4.41Å; F324-I328 HydrophobicContact CZ-CG1 4Å; F324-I328 WeakPolarHBondContact O-CG1 3.42Å; F324-I328 PolarHBondContact O-N 2.95Å; I325-I328 PolarHBondContact O-N 3.45Å; G326-I328 VanDerWaalsContact C-N 3.34Å; G326-I328 PolarHBondContact O-N 3.13Å; I328-L331 HydrophobicContact CD1-CD2 4.44Å; I328-L331 PolarHBondContact O-N 2.75Å; I328-V332 HydrophobicContact CG2-CG2 4.32Å; I328-V332 WeakPolarHBondContact O-CB 3.38Å; I328-V332 VanDerWaalsContact O-CG2 3.29Å; I328-V332 WeakPolarHBondContact O-CG2 3.26Å; I328-V332 PolarHBondContact O-N 3.3Å; I328-T355 HydrophobicContact CD1-CG2 3.86Å; I328-T355 WeakPolarHBondContact CD1-OG1 3.31Å; I328-T355 HydrophobicContact CG1-CG2 4.47Å; I328-L358 HydrophobicContact CD1-CD1 4.27Å
329	V	90.3	Very high	83.6	Confident	72 Å²	72	63.5 Å²	63.5	44%	0.436	35%	0.345	S	S	.	.	H	α-helix	trans	-60.2	-48	174.9	170.6	0	0	0	0	111.3	I325 G326 L331 V332 Q333	I325-V329 WeakPolarHBondContact O-CG2 3.47Å; I325-V329 PolarHBondContact O-N 2.98Å; G326-V329 PolarHBondContact O-N 2.81Å; V329-L331 VanDerWaalsContact C-N 3.31Å; V329-L331 PolarHBondContact O-N 2.98Å; V329-V332 PolarHBondContact O-N 3.22Å; V329-Q333 VanDerWaalsContact O-CG 3.3Å; V329-Q333 WeakPolarHBondContact O-CG 2.87Å; V329-Q333 PolarHBondContact O-N 2.96Å
330	I	87.6	Confident	81.9	Confident	27 Å²	27	65.1 Å²	65.1	14%	0.138	35%	0.349	C	S	.	.	H	α-helix	trans	-63.5	-37.5	178	-65.5	163.2	0	0	0	111.3	F252 L255 V256 G326 I327 K334	F252-I330 HydrophobicContact CD2-CD1 4.48Å; F252-I330 HydrophobicContact CE2-CD1 4.15Å; L255-I330 HydrophobicContact CB-CD1 4.44Å; L255-I330 HydrophobicContact CB-CG2 4.31Å; V256-I330 HydrophobicContact CG2-CD1 3.61Å; G326-I330 WeakPolarHBondContact O-CD1 3.42Å; G326-I330 VanDerWaalsContact O-CG1 3.32Å; G326-I330 WeakPolarHBondContact O-CG1 3.26Å; G326-I330 PolarHBondContact O-N 2.95Å; I327-I330 PolarHBondContact O-N 3.07Å; I330-K334 HydrophobicContact CG2-CD 3.93Å; I330-K334 WeakPolarHBondContact O-CB 3.37Å; I330-K334 WeakPolarHBondContact O-CG 3.48Å; I330-K334 PolarHBondContact O-N 3.37Å
331	L	84.4	Confident	80.2	Confident	42 Å²	42	69.5 Å²	69.5	22%	0.22	40%	0.395	C	S	.	.	H	α-helix	trans	-68.5	-42.2	177.7	-177.8	60.2	0	0	0	111.8	I327 I328 V329 K334 L335 L351	I327-L331 VanDerWaalsContact O-CB 3.23Å; I327-L331 WeakPolarHBondContact O-CB 3.34Å; I327-L331 PolarHBondContact O-N 2.96Å; I328-L331 HydrophobicContact CD1-CD2 4.44Å; I328-L331 PolarHBondContact O-N 2.75Å; V329-L331 VanDerWaalsContact C-N 3.31Å; V329-L331 PolarHBondContact O-N 2.98Å; L331-K334 PolarHBondContact O-N 3.27Å; L331-L335 HydrophobicContact CD1-CD1 4.01Å; L331-L335 HydrophobicContact CD1-CG 4.35Å; L331-L335 HydrophobicContact CG-CD1 3.9Å; L331-L335 WeakPolarHBondContact O-CB 3.38Å; L331-L335 WeakPolarHBondContact O-CD1 3.27Å; L331-L335 WeakPolarHBondContact O-CG 3.17Å; L331-L335 PolarHBondContact O-N 3.49Å; L331-L335 VanDerWaalsContact O-N 3.09Å; L331-L351 HydrophobicContact CD2-CD1 3.68Å; L331-L351 HydrophobicContact CG-CD1 3.96Å
332	V	82.8	Confident	78.9	Confident	42 Å²	42	67.4 Å²	67.4	26%	0.255	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-48.5	174.4	168.4	0	0	0	0	110.6	I328 V329 K334 L335 Q336 L351	I328-V332 HydrophobicContact CG2-CG2 4.32Å; I328-V332 WeakPolarHBondContact O-CB 3.38Å; I328-V332 VanDerWaalsContact O-CG2 3.29Å; I328-V332 WeakPolarHBondContact O-CG2 3.26Å; I328-V332 PolarHBondContact O-N 3.3Å; V329-V332 PolarHBondContact O-N 3.22Å; V332-K334 VanDerWaalsContact C-N 3.34Å; V332-K334 PolarHBondContact O-N 3.18Å; V332-L335 CarbonylContact O-C 3.6Å; V332-L335 PolarHBondContact O-N 3.5Å; V332-Q336 HydrophobicContact CG1-CG 4.29Å; V332-Q336 WeakPolarHBondContact O-CG 3.45Å; V332-Q336 PolarHBondContact O-N 2.95Å; V332-L351 HydrophobicContact CG2-CD1 4.47Å; V332-L351 HydrophobicContact CG2-CD2 3.69Å
333	Q	84.4	Confident	77.6	Confident	117 Å²	117	68.5 Å²	68.5	55%	0.547	40%	0.398	S	S	.	.	H	α-helix	trans	-57.8	-44.3	177.5	-71.7	169.4	-11.2	0	0	112.2	V329 L335 Q336 S337	V329-Q333 VanDerWaalsContact O-CG 3.3Å; V329-Q333 WeakPolarHBondContact O-CG 2.87Å; V329-Q333 PolarHBondContact O-N 2.96Å; Q333-L335 PolarHBondContact O-N 3.34Å; Q333-Q336 PolarHBondContact O-N 3.32Å; Q333-S337 PolarHBondContact O-N 3.28Å
334	K	81.4	Confident	76.4	Confident	118 Å²	118	74.5 Å²	74.5	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-73.9	-4.4	176.4	-71.4	173.2	-179.6	166.7	0	114.4	L255 I330 L331 V332 S337	L255-K334 PolarHBondContact O-NZ 2.94Å; I330-K334 HydrophobicContact CG2-CD 3.93Å; I330-K334 WeakPolarHBondContact O-CB 3.37Å; I330-K334 WeakPolarHBondContact O-CG 3.48Å; I330-K334 PolarHBondContact O-N 3.37Å; L331-K334 PolarHBondContact O-N 3.27Å; V332-K334 VanDerWaalsContact C-N 3.34Å; V332-K334 PolarHBondContact O-N 3.18Å; K334-S337 PolarHBondContact O-OG 3.25Å
335	L	72.9	Confident	75.4	Confident	30 Å²	30	77.1 Å²	77.1	16%	0.157	45%	0.446	C	S	.	.	H	α-helix	trans	-106.9	-17.9	173.8	-73	168.9	0	0	0	113.1	L331 V332 Q333 I347 R350 L351	L331-L335 HydrophobicContact CD1-CD1 4.01Å; L331-L335 HydrophobicContact CD1-CG 4.35Å; L331-L335 HydrophobicContact CG-CD1 3.9Å; L331-L335 WeakPolarHBondContact O-CB 3.38Å; L331-L335 WeakPolarHBondContact O-CD1 3.27Å; L331-L335 WeakPolarHBondContact O-CG 3.17Å; L331-L335 PolarHBondContact O-N 3.49Å; L331-L335 VanDerWaalsContact O-N 3.09Å; V332-L335 CarbonylContact O-C 3.6Å; V332-L335 PolarHBondContact O-N 3.5Å; Q333-L335 PolarHBondContact O-N 3.34Å; L335-I347 HydrophobicContact CB-CG2 4.12Å; L335-R350 VanDerWaalsContact CD2-NH2 3.29Å; L335-L351 HydrophobicContact CD1-CB 4.01Å; L335-L351 HydrophobicContact CD1-CD1 3.9Å; L335-L351 HydrophobicContact CD1-CG 4.38Å
336	Q	74.3	Confident	74.7	Confident	133 Å²	133	76.3 Å²	76.3	62%	0.621	45%	0.448	S	S	*	.	H	α-helix	trans	-93.2	-9.6	176.5	-72.4	179.1	-38	0	0	113.5	V332 Q333	V332-Q336 HydrophobicContact CG1-CG 4.29Å; V332-Q336 WeakPolarHBondContact O-CG 3.45Å; V332-Q336 PolarHBondContact O-N 2.95Å; Q333-Q336 PolarHBondContact O-N 3.32Å
337	S	67.2	Low	73.7	Confident	50 Å²	50	76.9 Å²	76.9	35%	0.35	45%	0.446	S	S	.	.	S	Bend	trans	-60.2	135.4	170.5	47.8	0	0	0	0	110.9	Q333 K334 D339	Q333-S337 PolarHBondContact O-N 3.28Å; K334-S337 PolarHBondContact O-OG 3.25Å; S337-D339 PolarHBondContact O-N 3.34Å
338	P	62.8	Low	72.9	Confident	124 Å²	124	83.5 Å²	83.5	81%	0.805	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	9.2	-160.4	27.5	-36.7	0	0	0	116.9	M340	P338-M340 PolarHBondContact O-N 3.43Å
339	D	59.1	Low	72.5	Confident	149 Å²	149	88.1 Å²	88.1	80%	0.797	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-0.5	177.9	-59.9	-49.3	0	0	0	114.2	S337	S337-D339 PolarHBondContact O-N 3.34Å
340	M	57.6	Low	71.8	Confident	105 Å²	105	89.9 Å²	89.9	52%	0.517	50%	0.495	S	S	.	.			trans	-130.6	84	176.5	-74.3	-165.4	151.2	0	0	112.4	P338 G342 R350	P338-M340 PolarHBondContact O-N 3.43Å; M340-G342 PolarHBondContact O-N 3.31Å; M340-R350 PolarHBondContact SD-NH1 2.9Å; M340-R350 PolarHBondContact SD-NH2 3.44Å
341	G	56.6	Low	71	Confident	96 Å²	96	89.8 Å²	89.8	99%	0.99	50%	0.495	S	S	*	.			trans	-68.9	56.6	163.5	0	0	0	0	0	112.7
342	G	63	Low	70.4	Confident	37 Å²	37	90.5 Å²	90.5	38%	0.381	51%	0.507	S	S	.	.	S	Bend	trans	-123.2	146.5	-178.4	0	0	0	0	0	111.5	M340 E344	M340-G342 PolarHBondContact O-N 3.31Å; G342-E344 PolarHBondContact O-N 3.37Å
343	N	65.9	Low	70.2	Confident	126 Å²	126	97.3 Å²	97.3	67%	0.674	53%	0.528	S	S	*	.			trans	-45.9	123.6	-172.6	-160.7	2.8	0	0	0	112.5	S345 S346	N343-S345 PolarHBondContact O-N 3.23Å; N343-S345 VanDerWaalsContact O-N 3.11Å; N343-S346 WeakPolarHBondContact O-CB 3.1Å; N343-S346 PolarHBondContact O-N 2.99Å; N343-S346 PolarHBondContact O-OG 3.42Å
344	E	67.5	Low	69.6	Low	142 Å²	142	94 Å²	94	66%	0.664	52%	0.518	S	S	*	.	H	α-helix	trans	-54.2	-39.7	-166.6	-60.5	-177.8	140.3	0	0	113	G342 S346 I347 Y348	G342-E344 PolarHBondContact O-N 3.37Å; E344-S346 PolarHBondContact O-N 3.17Å; E344-S346 VanDerWaalsContact O-N 3.15Å; E344-I347 WeakPolarHBondContact O-CA 3.43Å; E344-I347 WeakPolarHBondContact O-CB 3.42Å; E344-I347 PolarHBondContact O-N 3.1Å; E344-Y348 HydrophobicContact CB-CD2 4.35Å; E344-Y348 HydrophobicContact CB-CE2 4.26Å; E344-Y348 VanDerWaalsContact O-CD2 3.26Å; E344-Y348 WeakPolarHBondContact O-CD2 3.44Å; E344-Y348 PolarHBondContact O-N 3.32Å
345	S	68.8	Low	69.3	Low	72 Å²	72	89.7 Å²	89.7	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-54.1	-31.9	176	56.6	0	0	0	0	113.6	N343 L349	N343-S345 PolarHBondContact O-N 3.23Å; N343-S345 VanDerWaalsContact O-N 3.11Å; S345-L349 VanDerWaalsContact O-CB 3.24Å; S345-L349 WeakPolarHBondContact O-CB 3.33Å; S345-L349 PolarHBondContact O-N 3.07Å
346	S	75	Confident	69.4	Low	64 Å²	64	94 Å²	94	45%	0.448	52%	0.524	S	S	.	.	H	α-helix	trans	-74	-31.8	175.8	74.2	0	0	0	0	112.7	N343 E344 R350	N343-S346 WeakPolarHBondContact O-CB 3.1Å; N343-S346 PolarHBondContact O-N 2.99Å; N343-S346 PolarHBondContact O-OG 3.42Å; E344-S346 PolarHBondContact O-N 3.17Å; E344-S346 VanDerWaalsContact O-N 3.15Å; S346-R350 VanDerWaalsContact O-CB 3.25Å; S346-R350 WeakPolarHBondContact O-CB 3.14Å; S346-R350 PolarHBondContact O-N 3.31Å
347	I	71.6	Confident	69.3	Low	32 Å²	32	91.1 Å²	91.1	16%	0.164	51%	0.512	C	S	.	.	H	α-helix	trans	-70.6	-48	174.3	-57.9	176.2	0	0	0	109	L335 E344 L349 R350 L351	L335-I347 HydrophobicContact CB-CG2 4.12Å; E344-I347 WeakPolarHBondContact O-CA 3.43Å; E344-I347 WeakPolarHBondContact O-CB 3.42Å; E344-I347 PolarHBondContact O-N 3.1Å; I347-L349 PolarHBondContact O-N 2.95Å; I347-R350 PolarHBondContact O-N 2.95Å; I347-L351 WeakPolarHBondContact O-CB 3.3Å; I347-L351 PolarHBondContact O-N 3.25Å
348	Y	72	Confident	69.8	Low	143 Å²	143	89.6 Å²	89.6	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-60.7	-43.2	175.1	-74.1	-68.5	0	0	0	112.6	E344 R350 L351 A352	E344-Y348 HydrophobicContact CB-CD2 4.35Å; E344-Y348 HydrophobicContact CB-CE2 4.26Å; E344-Y348 VanDerWaalsContact O-CD2 3.26Å; E344-Y348 WeakPolarHBondContact O-CD2 3.44Å; E344-Y348 PolarHBondContact O-N 3.32Å; Y348-R350 PolarHBondContact O-N 3.12Å; Y348-L351 PolarHBondContact O-N 3.35Å; Y348-A352 VanDerWaalsContact O-CB 3.23Å; Y348-A352 WeakPolarHBondContact O-CB 3.32Å; Y348-A352 PolarHBondContact O-N 3.14Å
349	L	77.3	Confident	70.5	Confident	130 Å²	130	86.8 Å²	86.8	68%	0.681	48%	0.478	S	S	*	.	H	α-helix	trans	-64.7	-40.1	176.8	-178.3	62.9	0	0	0	112.3	S345 I347 R353	S345-L349 VanDerWaalsContact O-CB 3.24Å; S345-L349 WeakPolarHBondContact O-CB 3.33Å; S345-L349 PolarHBondContact O-N 3.07Å; I347-L349 PolarHBondContact O-N 2.95Å; L349-R353 WeakPolarHBondContact O-CB 3.33Å; L349-R353 PolarHBondContact O-N 3.05Å
350	R	75	Confident	71	Confident	109 Å²	109	81.2 Å²	81.2	41%	0.411	45%	0.449	S	S	.	.	H	α-helix	trans	-66.3	-42.1	175.7	-179.2	177.1	62.1	-178.6	-4.7	111.7	L335 M340 S346 I347 Y348 S354	L335-R350 VanDerWaalsContact CD2-NH2 3.29Å; M340-R350 PolarHBondContact SD-NH1 2.9Å; M340-R350 PolarHBondContact SD-NH2 3.44Å; S346-R350 VanDerWaalsContact O-CB 3.25Å; S346-R350 WeakPolarHBondContact O-CB 3.14Å; S346-R350 PolarHBondContact O-N 3.31Å; I347-R350 PolarHBondContact O-N 2.95Å; Y348-R350 PolarHBondContact O-N 3.12Å; R350-S354 PolarHBondContact O-N 2.63Å
351	L	71.5	Confident	71.7	Confident	25 Å²	25	76.3 Å²	76.3	13%	0.131	43%	0.425	C	S	.	.	H	α-helix	trans	-63.1	-53.7	174.3	174	58.3	0	0	0	110.9	L331 V332 L335 I347 Y348 R353 S354 T355	L331-L351 HydrophobicContact CD2-CD1 3.68Å; L331-L351 HydrophobicContact CG-CD1 3.96Å; V332-L351 HydrophobicContact CG2-CD1 4.47Å; V332-L351 HydrophobicContact CG2-CD2 3.69Å; L335-L351 HydrophobicContact CD1-CB 4.01Å; L335-L351 HydrophobicContact CD1-CD1 3.9Å; L335-L351 HydrophobicContact CD1-CG 4.38Å; I347-L351 WeakPolarHBondContact O-CB 3.3Å; I347-L351 PolarHBondContact O-N 3.25Å; Y348-L351 PolarHBondContact O-N 3.35Å; L351-R353 VanDerWaalsContact C-N 3.26Å; L351-R353 PolarHBondContact O-N 3.2Å; L351-S354 CarbonylContact O-C 3.59Å; L351-S354 WeakPolarHBondContact O-CA 3.28Å; L351-S354 WeakPolarHBondContact O-CB 3.4Å; L351-S354 PolarHBondContact O-N 2.94Å; L351-T355 PolarHBondContact O-N 3.39Å; L351-T355 PolarHBondContact O-OG1 3.4Å; L351-T355 VanDerWaalsContact O-OG1 3.11Å
352	A	71.8	Confident	72.7	Confident	57 Å²	57	72 Å²	72	47%	0.471	38%	0.38	S	S	.	.	H	α-helix	trans	-55.4	-41.9	179.3	0	0	0	0	0	111.7	Y348 T355 L356	Y348-A352 VanDerWaalsContact O-CB 3.23Å; Y348-A352 WeakPolarHBondContact O-CB 3.32Å; Y348-A352 PolarHBondContact O-N 3.14Å; A352-T355 PolarHBondContact O-N 2.71Å; A352-L356 VanDerWaalsContact O-CB 3.27Å; A352-L356 WeakPolarHBondContact O-CB 3.12Å; A352-L356 PolarHBondContact O-N 2.82Å
353	R	78.6	Confident	73.3	Confident	184 Å²	184	70.3 Å²	70.3	69%	0.694	36%	0.362	S	S	*	.	H	α-helix	trans	-60.7	-48	171.6	-176.3	176.4	178.6	174.1	0.8	111.5	L349 L351 L357	L349-R353 WeakPolarHBondContact O-CB 3.33Å; L349-R353 PolarHBondContact O-N 3.05Å; L351-R353 VanDerWaalsContact C-N 3.26Å; L351-R353 PolarHBondContact O-N 3.2Å; R353-L357 VanDerWaalsContact O-CG 3.31Å; R353-L357 WeakPolarHBondContact O-CG 3.43Å; R353-L357 PolarHBondContact O-N 3.3Å
354	S	72.2	Confident	74	Confident	48 Å²	48	65.2 Å²	65.2	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-59.8	-46.2	177.6	-163.5	0	0	0	0	112.2	R350 L351 L357 L358	R350-S354 PolarHBondContact O-N 2.63Å; L351-S354 CarbonylContact O-C 3.59Å; L351-S354 WeakPolarHBondContact O-CA 3.28Å; L351-S354 WeakPolarHBondContact O-CB 3.4Å; L351-S354 PolarHBondContact O-N 2.94Å; S354-L357 PolarHBondContact O-N 2.82Å; S354-L358 WeakPolarHBondContact O-CG 3.28Å; S354-L358 PolarHBondContact O-N 3.31Å
355	T	74.1	Confident	74.7	Confident	28 Å²	28	59.2 Å²	59.2	17%	0.172	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-43.8	179.4	-56.1	0	0	0	0	112.4	F324 I328 L351 A352 L357 L358 I359	F324-T355 HydrophobicContact CE2-CG2 4.28Å; F324-T355 HydrophobicContact CZ-CG2 3.92Å; I328-T355 HydrophobicContact CD1-CG2 3.86Å; I328-T355 WeakPolarHBondContact CD1-OG1 3.31Å; I328-T355 HydrophobicContact CG1-CG2 4.47Å; L351-T355 PolarHBondContact O-N 3.39Å; L351-T355 PolarHBondContact O-OG1 3.4Å; L351-T355 VanDerWaalsContact O-OG1 3.11Å; A352-T355 PolarHBondContact O-N 2.71Å; T355-L357 PolarHBondContact O-N 3.27Å; T355-L358 WeakPolarHBondContact O-CB 3.44Å; T355-L358 PolarHBondContact O-N 3.45Å; T355-I359 PolarHBondContact O-N 3.46Å; T355-I359 VanDerWaalsContact O-N 3.14Å
356	L	75.6	Confident	75.3	Confident	120 Å²	120	56 Å²	56	63%	0.628	28%	0.283	S	S	*	.	H	α-helix	trans	-58.8	-34.3	177.1	-167.6	82	0	0	0	111.9	A352 L358 P360	A352-L356 VanDerWaalsContact O-CB 3.27Å; A352-L356 WeakPolarHBondContact O-CB 3.12Å; A352-L356 PolarHBondContact O-N 2.82Å; L356-L358 VanDerWaalsContact C-N 3.32Å; L356-P360 WeakPolarHBondContact O-CD 3.36Å
357	L	72.7	Confident	75.6	Confident	72 Å²	72	54.3 Å²	54.3	38%	0.377	27%	0.27	S	S	.	.	H	α-helix	trans	-73.8	-21.5	175.6	-63.9	-173.1	0	0	0	113.4	R353 S354 T355 L399	R353-L357 VanDerWaalsContact O-CG 3.31Å; R353-L357 WeakPolarHBondContact O-CG 3.43Å; R353-L357 PolarHBondContact O-N 3.3Å; S354-L357 PolarHBondContact O-N 2.82Å; T355-L357 PolarHBondContact O-N 3.27Å; L357-L399 HydrophobicContact CB-CD1 4.08Å; L357-L399 HydrophobicContact CD1-CD2 4.1Å; L357-L399 HydrophobicContact CD2-CD1 3.87Å; L357-L399 HydrophobicContact CD2-CD2 3.47Å; L357-L399 VanDerWaalsContact CD2-CD2 3.47Å; L357-L399 HydrophobicContact CD2-CG 4.32Å; L357-L399 HydrophobicContact CG-CD1 4.44Å; L357-L399 HydrophobicContact CG-CD2 4.26Å
358	L	77	Confident	76.1	Confident	19 Å²	19	57.2 Å²	57.2	10%	0.099	29%	0.289	C	S	.	.	H	α-helix	trans	-88	-24.5	178.8	-66.2	170.9	0	0	0	113.4	L251 F324 I327 I328 S354 T355 L356 L361 F362	L251-L358 HydrophobicContact CD2-CD2 4.42Å; F324-L358 HydrophobicContact CD2-CB 4.47Å; F324-L358 HydrophobicContact CE2-CB 4.01Å; I327-L358 HydrophobicContact CG2-CD1 4.46Å; I328-L358 HydrophobicContact CD1-CD1 4.27Å; S354-L358 WeakPolarHBondContact O-CG 3.28Å; S354-L358 PolarHBondContact O-N 3.31Å; T355-L358 WeakPolarHBondContact O-CB 3.44Å; T355-L358 PolarHBondContact O-N 3.45Å; L356-L358 VanDerWaalsContact C-N 3.32Å; L358-L361 HydrophobicContact CD2-CD2 4.03Å; L358-L361 VanDerWaalsContact O-CB 3.29Å; L358-L361 WeakPolarHBondContact O-CB 3.41Å; L358-L361 PolarHBondContact O-N 2.69Å; L358-F362 HydrophobicContact CB-CD2 4.12Å; L358-F362 HydrophobicContact CB-CE2 3.83Å; L358-F362 HydrophobicContact CD1-CE2 4.35Å; L358-F362 HydrophobicContact CD2-CE2 3.78Å; L358-F362 HydrophobicContact CD2-CZ 3.85Å; L358-F362 HydrophobicContact CG-CE2 4.18Å; L358-F362 WeakPolarHBondContact O-CD2 3.49Å; L358-F362 PolarHBondContact O-N 2.82Å
359	I	77.5	Confident	76.5	Confident	65 Å²	65	51.9 Å²	51.9	33%	0.333	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-52.9	178.1	-70.5	169.1	0	0	0	113.6	F324 T355 L361 I364	F324-I359 HydrophobicContact CZ-CG1 4.04Å; T355-I359 PolarHBondContact O-N 3.46Å; T355-I359 VanDerWaalsContact O-N 3.14Å; I359-L361 PolarHBondContact O-N 3.01Å; I359-I364 HydrophobicContact CG2-CB 4.42Å; I359-I364 PolarHBondContact O-N 3.48Å; I359-I364 VanDerWaalsContact O-N 3.12Å
360	P	70.6	Confident	76.3	Confident	31 Å²	31	46.5 Å²	46.5	20%	0.201	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.6	174.6	29.7	-34.7	0	0	0	111.4	L356 Q392 V395	L356-P360 WeakPolarHBondContact O-CD 3.36Å; P360-Q392 VanDerWaalsContact O-CG 3.32Å; P360-Q392 WeakPolarHBondContact O-CG 3.41Å; P360-Q392 PolarHBondContact O-NE2 3.49Å; P360-V395 HydrophobicContact CB-CG1 4.1Å; P360-V395 HydrophobicContact CG-CG1 3.84Å
361	L	71.6	Confident	76.3	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.016	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-55.1	-178	-160.2	91.7	0	0	0	112.2	L244 E247 L358 I359 G363 V396 Y400	L244-L361 WeakPolarHBondContact CD2-O 3.44Å; E247-L361 HydrophobicContact CG-CD2 4.48Å; E247-L361 WeakPolarHBondContact OE2-CD2 3.04Å; E247-L361 WeakPolarHBondContact OE2-CG 3.03Å; L358-L361 HydrophobicContact CD2-CD2 4.03Å; L358-L361 VanDerWaalsContact O-CB 3.29Å; L358-L361 WeakPolarHBondContact O-CB 3.41Å; L358-L361 PolarHBondContact O-N 2.69Å; I359-L361 PolarHBondContact O-N 3.01Å; L361-G363 PolarHBondContact O-N 2.93Å; L361-V396 HydrophobicContact CD1-CG2 4.1Å; L361-Y400 HydrophobicContact CD1-CD2 3.87Å; L361-Y400 HydrophobicContact CD1-CE2 3.27Å; L361-Y400 HydrophobicContact CD2-CE2 3.89Å; L361-Y400 WeakPolarHBondContact CD2-OH 3.33Å; L361-Y400 HydrophobicContact CG-CE2 4.07Å
362	F	77.5	Confident	76.4	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.026	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	2.3	-178.8	-58.6	-48.2	0	0	0	113.5	G248 L251 N320 F324 I327 L358 I364	G248-F362 VanDerWaalsContact CA-CE1 3.44Å; L251-F362 HydrophobicContact CD2-CZ 3.86Å; N320-F362 PolarHBondContact ND2-O 3.13Å; F324-F362 HydrophobicContact CB-CD2 4.03Å; F324-F362 AromaticContact CD2-CD2 3.55Å; F324-F362 HydrophobicContact CD2-CD2 3.55Å; F324-F362 AromaticContact CD2-CE2 3.83Å; F324-F362 HydrophobicContact CD2-CE2 3.83Å; F324-F362 HydrophobicContact CE2-CD2 4.38Å; F324-F362 HydrophobicContact CG-CD2 4.13Å; I327-F362 HydrophobicContact CD1-CE1 4.5Å; I327-F362 HydrophobicContact CD1-CE2 4Å; I327-F362 HydrophobicContact CD1-CZ 3.73Å; L358-F362 HydrophobicContact CB-CD2 4.12Å; L358-F362 HydrophobicContact CB-CE2 3.83Å; L358-F362 HydrophobicContact CD1-CE2 4.35Å; L358-F362 HydrophobicContact CD2-CE2 3.78Å; L358-F362 HydrophobicContact CD2-CZ 3.85Å; L358-F362 HydrophobicContact CG-CE2 4.18Å; L358-F362 WeakPolarHBondContact O-CD2 3.49Å; L358-F362 PolarHBondContact O-N 2.82Å; F362-I364 VanDerWaalsContact C-N 3.32Å; F362-I364 HydrophobicContact CB-CD1 3.72Å; F362-I364 HydrophobicContact CB-CG1 3.93Å
363	G	76	Confident	76.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	29.1	-176	0	0	0	0	0	113.1	L361 H365 Y366	L361-G363 PolarHBondContact O-N 2.93Å; G363-H365 PolarHBondContact O-N 3.24Å; G363-H365 VanDerWaalsContact O-N 3.09Å; G363-Y366 WeakPolarHBondContact O-CB 3.26Å; G363-Y366 WeakPolarHBondContact O-CD2 3.33Å; G363-Y366 PolarHBondContact O-N 3Å
364	I	80	Confident	75.7	Confident	18 Å²	18	44.7 Å²	44.7	9%	0.092	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-61.9	-22.6	-176.4	-53.4	-56.8	0	0	0	111.8	F321 F324 I359 F362 Y366 T367	F321-I364 HydrophobicContact CD2-CD1 4.44Å; F321-I364 HydrophobicContact CD2-CG2 4.16Å; F321-I364 HydrophobicContact CE2-CG2 4.42Å; F324-I364 HydrophobicContact CB-CD1 3.78Å; F324-I364 HydrophobicContact CB-CG1 4.46Å; F324-I364 HydrophobicContact CD1-CD1 3.87Å; F324-I364 HydrophobicContact CD1-CG1 3.88Å; F324-I364 HydrophobicContact CD1-CG2 4.41Å; F324-I364 HydrophobicContact CE1-CG1 4.18Å; F324-I364 HydrophobicContact CE1-CG2 4.36Å; F324-I364 HydrophobicContact CG-CD1 3.88Å; F324-I364 HydrophobicContact CG-CG1 4.04Å; I359-I364 HydrophobicContact CG2-CB 4.42Å; I359-I364 PolarHBondContact O-N 3.48Å; I359-I364 VanDerWaalsContact O-N 3.12Å; F362-I364 VanDerWaalsContact C-N 3.32Å; F362-I364 HydrophobicContact CB-CD1 3.72Å; F362-I364 HydrophobicContact CB-CG1 3.93Å; I364-Y366 PolarHBondContact O-N 3.46Å; I364-T367 HydrophobicContact CG2-CG2 4.4Å; I364-T367 PolarHBondContact O-N 3.13Å; I364-T367 PolarHBondContact O-OG1 3.27Å
365	H	83.2	Confident	75.4	Confident	17 Å²	17	48 Å²	48	8%	0.079	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-58.6	-32	170.7	57	-84.5	0	0	0	113	G363 T367 V368 F384	G363-H365 PolarHBondContact O-N 3.24Å; G363-H365 VanDerWaalsContact O-N 3.09Å; H365-T367 PolarHBondContact O-N 2.03Å; H365-V368 WeakPolarHBondContact O-CB 3.45Å; H365-V368 WeakPolarHBondContact O-CG2 3.46Å; H365-V368 PolarHBondContact O-N 2.95Å; H365-F384 HydrophobicContact CB-CE1 3.83Å; H365-F384 HydrophobicContact CB-CZ 4.19Å; H365-F384 WeakPolarHBondContact O-CE1 3.12Å
366	Y	81.2	Confident	74.8	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.016	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-67.6	-20.3	174.9	-55.7	-65.6	0	0	0	113	R199 Y241 L244 G363 I364 V368 A370 E385 G389 Q392	R199-Y366 PolarHBondContact NH1-OH 3.4Å; R199-Y366 PolarHBondContact NH2-OH 2.94Å; Y241-Y366 HydrophobicContact CD1-CD2 4.45Å; Y241-Y366 HydrophobicContact CE1-CD1 4.18Å; Y241-Y366 AromaticContact CE1-CD2 3.68Å; Y241-Y366 HydrophobicContact CE1-CD2 3.68Å; Y241-Y366 HydrophobicContact CE1-CE1 4.26Å; Y241-Y366 AromaticContact CE1-CE2 3.78Å; Y241-Y366 HydrophobicContact CE1-CE2 3.78Å; Y241-Y366 AromaticContact CE1-CG 3.91Å; Y241-Y366 HydrophobicContact CE1-CG 3.91Å; L244-Y366 HydrophobicContact CD1-CE2 4.31Å; G363-Y366 WeakPolarHBondContact O-CB 3.26Å; G363-Y366 WeakPolarHBondContact O-CD2 3.33Å; G363-Y366 PolarHBondContact O-N 3Å; I364-Y366 PolarHBondContact O-N 3.46Å; Y366-V368 PolarHBondContact O-N 2.84Å; Y366-A370 WeakPolarHBondContact O-CB 3.47Å; Y366-A370 PolarHBondContact O-N 2.83Å; Y366-E385 HydrophobicContact CD1-CG 4.26Å; Y366-G389 WeakPolarHBondContact OH-CA 3.44Å; Y366-Q392 PolarHBondContact OH-OE1 2.82Å
367	T	80.5	Confident	74.5	Confident	28 Å²	28	47 Å²	47	17%	0.172	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-71	-20.6	178.2	75	0	0	0	0	112.6	I317 F321 I364 H365 F369	I317-T367 HydrophobicContact CG2-CG2 3.64Å; F321-T367 HydrophobicContact CB-CG2 3.92Å; F321-T367 HydrophobicContact CD2-CG2 3.94Å; F321-T367 HydrophobicContact CG-CG2 4.19Å; I364-T367 HydrophobicContact CG2-CG2 4.4Å; I364-T367 PolarHBondContact O-N 3.13Å; I364-T367 PolarHBondContact O-OG1 3.27Å; H365-T367 PolarHBondContact O-N 2.03Å; T367-F369 VanDerWaalsContact C-N 3.33Å; T367-F369 PolarHBondContact O-N 2.8Å
368	V	81.6	Confident	74.4	Confident	93 Å²	93	49.5 Å²	49.5	56%	0.564	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-40.2	-177.5	179.4	0	0	0	0	111.3	H365 Y366 F384	H365-V368 WeakPolarHBondContact O-CB 3.45Å; H365-V368 WeakPolarHBondContact O-CG2 3.46Å; H365-V368 PolarHBondContact O-N 2.95Å; Y366-V368 PolarHBondContact O-N 2.84Å; V368-F384 HydrophobicContact CB-CE1 4.31Å; V368-F384 HydrophobicContact CG2-CE1 4.27Å; V368-F384 HydrophobicContact CG2-CZ 4.46Å
369	F	79.9	Confident	74.2	Confident	31 Å²	31	53.9 Å²	53.9	14%	0.136	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-0.8	-177.1	-68.8	-76.5	0	0	0	114	T367 F371 S372 R381 F384 E385	T367-F369 VanDerWaalsContact C-N 3.33Å; T367-F369 PolarHBondContact O-N 2.8Å; F369-F371 PolarHBondContact O-N 2.71Å; F369-F371 VanDerWaalsContact O-N 3.07Å; F369-S372 VanDerWaalsContact O-CB 3.28Å; F369-S372 WeakPolarHBondContact O-CB 3.46Å; F369-S372 PolarHBondContact O-N 3.03Å; F369-R381 HydrophobicContact CB-CG 3.74Å; F369-R381 HydrophobicContact CD1-CB 3.87Å; F369-R381 HydrophobicContact CD1-CG 4Å; F369-R381 HydrophobicContact CD2-CB 4.4Å; F369-R381 HydrophobicContact CD2-CG 4.17Å; F369-R381 HydrophobicContact CE1-CB 4.1Å; F369-R381 HydrophobicContact CG-CB 4.03Å; F369-R381 HydrophobicContact CG-CG 3.72Å; F369-R381 HydrophobicContact CZ-CB 4.47Å; F369-F384 AromaticContact CD2-CD1 3.83Å; F369-F384 HydrophobicContact CD2-CD1 3.83Å; F369-F384 HydrophobicContact CD2-CE1 4.4Å; F369-F384 HydrophobicContact CD2-CG 4.43Å; F369-F384 HydrophobicContact CE2-CB 3.86Å; F369-F384 AromaticContact CE2-CD1 3.62Å; F369-F384 HydrophobicContact CE2-CD1 3.62Å; F369-F384 HydrophobicContact CE2-CE1 4.25Å; F369-F384 AromaticContact CE2-CG 3.8Å; F369-F384 HydrophobicContact CE2-CG 3.8Å; F369-E385 WeakPolarHBondContact CB-OE1 3.31Å
370	A	74.7	Confident	74.2	Confident	17 Å²	17	56.8 Å²	56.8	14%	0.14	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.9	-178	0	0	0	0	0	115.1	M318 Y366	M318-A370 HydrophobicContact CE-CB 3.7Å; Y366-A370 WeakPolarHBondContact O-CB 3.47Å; Y366-A370 PolarHBondContact O-N 2.83Å
371	F	75	Confident	74.6	Confident	157 Å²	157	57.9 Å²	57.9	69%	0.689	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	2	175	-64.7	-67.5	0	0	0	113.8	M318 F369 P373	M318-F371 HydrophobicContact CE-CD2 4.15Å; M318-F371 HydrophobicContact CE-CE2 3.46Å; M318-F371 VanDerWaalsContact CE-CE2 3.46Å; M318-F371 HydrophobicContact CE-CZ 3.88Å; M318-F371 HydrophobicContact CG-CZ 4.02Å; M318-F371 HydrophobicContact SD-CE2 3.38Å; M318-F371 WeakPolarHBondContact SD-CE2 3.07Å; M318-F371 HydrophobicContact SD-CZ 3.42Å; M318-F371 WeakPolarHBondContact SD-CZ 3.43Å; F369-F371 PolarHBondContact O-N 2.71Å; F369-F371 VanDerWaalsContact O-N 3.07Å; F371-P373 WeakPolarHBondContact O-CD 3.35Å
372	S	72.6	Confident	75	Confident	27 Å²	27	60.2 Å²	60.2	19%	0.189	31%	0.307	C	S	.	.	S	Bend	trans	-71	124.5	176.1	-165.7	0	0	0	0	109.1	F369 E374 V376	F369-S372 VanDerWaalsContact O-CB 3.28Å; F369-S372 WeakPolarHBondContact O-CB 3.46Å; F369-S372 PolarHBondContact O-N 3.03Å; S372-E374 PolarHBondContact O-N 3.29Å; S372-V376 WeakPolarHBondContact OG-CG2 3.05Å
373	P	68.8	Low	75.1	Confident	84 Å²	84	63 Å²	63	55%	0.545	33%	0.325	S	S	.	.			trans	-51.9	141.2	168.5	-25.6	33.4	0	0	0	110.6	F371 N375 V376	F371-P373 WeakPolarHBondContact O-CD 3.35Å; P373-N375 PolarHBondContact O-N 2.84Å; P373-N375 VanDerWaalsContact O-N 3.13Å; P373-V376 HydrophobicContact CB-CG2 4.12Å; P373-V376 HydrophobicContact CG-CG2 4.18Å; P373-V376 WeakPolarHBondContact O-CG2 3.42Å; P373-V376 PolarHBondContact O-N 3.45Å; P373-V376 VanDerWaalsContact O-N 3.09Å
374	E	67.5	Low	75.4	Confident	69 Å²	69	66.3 Å²	66.3	32%	0.322	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.3	-172.8	-84.9	169.6	177.5	0	0	113.7	W306 K310 S372 K378 R381	W306-E374 PolarHBondContact NE1-OE2 3.15Å; K310-E374 WeakPolarHBondContact CE-OE1 3.03Å; K310-E374 IonicContact NZ-OE1 3.98Å; K310-E374 PolarHBondContact NZ-OE1 3.3Å; K310-E374 IonicContact NZ-OE2 2.69Å; K310-E374 PolarHBondContact NZ-OE2 3.23Å; S372-E374 PolarHBondContact O-N 3.29Å; E374-K378 WeakPolarHBondContact O-CE 3.32Å; E374-K378 WeakPolarHBondContact O-CG 3.47Å; E374-R381 IonicContact OE1-NH1 3.4Å; E374-R381 PolarHBondContact OE1-NH1 2.98Å
375	N	65.4	Low	75.6	Confident	119 Å²	119	66.4 Å²	66.4	64%	0.636	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-12.3	174.4	-71.6	-12	0	0	0	114.6	P373 K378	P373-N375 PolarHBondContact O-N 2.84Å; P373-N375 VanDerWaalsContact O-N 3.13Å; N375-K378 WeakPolarHBondContact OD1-CE 3.22Å; N375-K378 PolarHBondContact OD1-NZ 3.48Å
376	V	62.2	Low	75.6	Confident	76 Å²	76	67.7 Å²	67.7	46%	0.461	35%	0.346	S	S	.	.	S	Bend	trans	-101.6	136.4	174.3	-53.8	0	0	0	0	110.9	S372 P373 K378	S372-V376 WeakPolarHBondContact OG-CG2 3.05Å; P373-V376 HydrophobicContact CB-CG2 4.12Å; P373-V376 HydrophobicContact CG-CG2 4.18Å; P373-V376 WeakPolarHBondContact O-CG2 3.42Å; P373-V376 PolarHBondContact O-N 3.45Å; P373-V376 VanDerWaalsContact O-N 3.09Å; V376-K378 VanDerWaalsContact C-N 3.27Å; V376-K378 PolarHBondContact O-N 3.25Å
377	S	68.4	Low	75.6	Confident	50 Å²	50	67.8 Å²	67.8	35%	0.35	35%	0.348	S	S	.	.	S	Bend	trans	56.1	28.5	-179.8	-68.5	0	0	0	0	115.9	R379 E380 R381	S377-R379 VanDerWaalsContact C-N 3.26Å; S377-R379 PolarHBondContact O-N 3.05Å; S377-R379 VanDerWaalsContact O-N 3.17Å; S377-E380 WeakPolarHBondContact CB-OE2 3.29Å; S377-E380 PolarHBondContact O-N 3.01Å; S377-E380 VanDerWaalsContact O-N 3.1Å; S377-E380 PolarHBondContact OG-OE2 2.96Å; S377-R381 VanDerWaalsContact O-CB 3.28Å; S377-R381 WeakPolarHBondContact O-CB 3.45Å; S377-R381 PolarHBondContact O-N 3.29Å
378	K	70.4	Confident	75.7	Confident	125 Å²	125	70.8 Å²	70.8	54%	0.543	36%	0.363	S	S	.	.	H	α-helix	trans	-40.6	-53.8	173.2	-79.2	-179.9	171.9	160.3	0	112.2	E374 N375 V376 E380 L382	E374-K378 WeakPolarHBondContact O-CE 3.32Å; E374-K378 WeakPolarHBondContact O-CG 3.47Å; N375-K378 WeakPolarHBondContact OD1-CE 3.22Å; N375-K378 PolarHBondContact OD1-NZ 3.48Å; V376-K378 VanDerWaalsContact C-N 3.27Å; V376-K378 PolarHBondContact O-N 3.25Å; K378-E380 PolarHBondContact O-N 2.04Å; K378-L382 VanDerWaalsContact O-CB 3.31Å; K378-L382 WeakPolarHBondContact O-CB 3.25Å; K378-L382 PolarHBondContact O-N 2.98Å
379	R	73.9	Confident	76	Confident	111 Å²	111	66.4 Å²	66.4	42%	0.419	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-40.6	-175.7	-161.3	-174.4	-85.7	-129.9	4.7	112.9	D145 Y149 S377 V383	D145-R379 IonicContact OD1-NH1 2.68Å; D145-R379 IonicContact OD2-CZ 3.55Å; D145-R379 IonicContact OD2-NH1 2.71Å; D145-R379 PolarHBondContact OD2-NH1 3.35Å; D145-R379 IonicContact OD2-NH2 3.63Å; D145-R379 PolarHBondContact OD2-NH2 2.98Å; Y149-R379 HydrophobicContact CD2-CG 3.83Å; Y149-R379 HydrophobicContact CE1-CG 4.14Å; Y149-R379 HydrophobicContact CE2-CB 4.47Å; Y149-R379 HydrophobicContact CE2-CG 3.33Å; Y149-R379 HydrophobicContact CG-CG 4.4Å; Y149-R379 WeakPolarHBondContact OH-CA 3.47Å; Y149-R379 PolarHBondContact OH-O 2.87Å; S377-R379 VanDerWaalsContact C-N 3.26Å; S377-R379 PolarHBondContact O-N 3.05Å; S377-R379 VanDerWaalsContact O-N 3.17Å; R379-V383 VanDerWaalsContact O-CG2 3.3Å; R379-V383 WeakPolarHBondContact O-CG2 3.47Å
380	E	77	Confident	76.6	Confident	125 Å²	125	65 Å²	65	58%	0.584	33%	0.33	S	S	*	.	H	α-helix	trans	-78.1	-45.7	-178.8	-56	176.7	117.6	0	0	111.4	S377 K378 L382 V383 F384	S377-E380 WeakPolarHBondContact CB-OE2 3.29Å; S377-E380 PolarHBondContact O-N 3.01Å; S377-E380 VanDerWaalsContact O-N 3.1Å; S377-E380 PolarHBondContact OG-OE2 2.96Å; K378-E380 PolarHBondContact O-N 2.04Å; E380-L382 PolarHBondContact O-N 2.98Å; E380-V383 PolarHBondContact O-N 3.37Å; E380-F384 WeakPolarHBondContact O-CB 3.5Å; E380-F384 PolarHBondContact O-N 3.16Å
381	R	79.9	Confident	77.4	Confident	55 Å²	55	67.2 Å²	67.2	21%	0.208	34%	0.337	C	S	.	.	H	α-helix	trans	-58.4	-46	178.7	179.9	177.5	178.4	-135.2	-28.9	111.3	F369 E374 S377 F384 E385	F369-R381 HydrophobicContact CB-CG 3.74Å; F369-R381 HydrophobicContact CD1-CB 3.87Å; F369-R381 HydrophobicContact CD1-CG 4Å; F369-R381 HydrophobicContact CD2-CB 4.4Å; F369-R381 HydrophobicContact CD2-CG 4.17Å; F369-R381 HydrophobicContact CE1-CB 4.1Å; F369-R381 HydrophobicContact CG-CB 4.03Å; F369-R381 HydrophobicContact CG-CG 3.72Å; F369-R381 HydrophobicContact CZ-CB 4.47Å; E374-R381 IonicContact OE1-NH1 3.4Å; E374-R381 PolarHBondContact OE1-NH1 2.98Å; S377-R381 VanDerWaalsContact O-CB 3.28Å; S377-R381 WeakPolarHBondContact O-CB 3.45Å; S377-R381 PolarHBondContact O-N 3.29Å; R381-F384 PolarHBondContact O-N 2.93Å; R381-E385 HydrophobicContact CG-CG 4.18Å; R381-E385 IonicContact CZ-OE1 3.71Å; R381-E385 IonicContact CZ-OE2 2.8Å; R381-E385 VanDerWaalsContact NE-CD 3.31Å; R381-E385 IonicContact NE-OE1 3.98Å; R381-E385 PolarHBondContact NE-OE1 2.74Å; R381-E385 IonicContact NE-OE2 3.6Å; R381-E385 PolarHBondContact NE-OE2 3.19Å; R381-E385 IonicContact NH2-OE1 3.68Å; R381-E385 PolarHBondContact NH2-OE1 3.02Å; R381-E385 IonicContact NH2-OE2 2.71Å; R381-E385 PolarHBondContact NH2-OE2 3.14Å; R381-E385 WeakPolarHBondContact O-CB 3.35Å; R381-E385 PolarHBondContact O-N 3.47Å
382	L	79.1	Confident	78.3	Confident	52 Å²	52	59.9 Å²	59.9	27%	0.272	31%	0.305	S	S	.	.	H	α-helix	trans	-64.8	-44.1	-179	-167.3	81.6	0	0	0	111.5	Y149 Y150 V153 K378 E380 F384 L386	Y149-L382 HydrophobicContact CE1-CD2 4.02Å; Y149-L382 WeakPolarHBondContact OH-CB 3.45Å; Y150-L382 HydrophobicContact CD1-CD2 4.4Å; Y150-L382 HydrophobicContact CE1-CD2 4.34Å; V153-L382 HydrophobicContact CB-CD2 4.46Å; V153-L382 HydrophobicContact CG1-CD2 3.89Å; V153-L382 HydrophobicContact CG1-CG 4.08Å; V153-L382 HydrophobicContact CG2-CD2 4.44Å; K378-L382 VanDerWaalsContact O-CB 3.31Å; K378-L382 WeakPolarHBondContact O-CB 3.25Å; K378-L382 PolarHBondContact O-N 2.98Å; E380-L382 PolarHBondContact O-N 2.98Å; L382-F384 VanDerWaalsContact C-N 3.32Å; L382-F384 PolarHBondContact O-N 3.48Å; L382-L386 HydrophobicContact CD1-CD1 3.66Å; L382-L386 HydrophobicContact CD1-CD2 3.77Å; L382-L386 HydrophobicContact CD1-CG 4.35Å; L382-L386 HydrophobicContact CG-CD1 4.19Å; L382-L386 HydrophobicContact CG-CD2 4.13Å; L382-L386 WeakPolarHBondContact O-CB 3.39Å; L382-L386 PolarHBondContact O-N 3.4Å
383	V	80.6	Confident	79.3	Confident	64 Å²	64	58.6 Å²	58.6	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-61.2	-41	174.7	171.6	0	0	0	0	111.2	Y149 V153 R379 E380 G387	Y149-V383 HydrophobicContact CE2-CG2 3.71Å; V153-V383 HydrophobicContact CG2-CG2 3.82Å; R379-V383 VanDerWaalsContact O-CG2 3.3Å; R379-V383 WeakPolarHBondContact O-CG2 3.47Å; E380-V383 PolarHBondContact O-N 3.37Å; V383-G387 WeakPolarHBondContact O-CA 3.39Å; V383-G387 PolarHBondContact O-N 3.07Å
384	F	82.4	Confident	80.5	Confident	70 Å²	70	58 Å²	58	31%	0.307	29%	0.285	S	S	.	.	H	α-helix	trans	-73.1	-51.7	-178.6	-168.9	-97.3	0	0	0	112.8	H365 V368 F369 E380 R381 L382 L388	H365-F384 HydrophobicContact CB-CE1 3.83Å; H365-F384 HydrophobicContact CB-CZ 4.19Å; H365-F384 WeakPolarHBondContact O-CE1 3.12Å; V368-F384 HydrophobicContact CB-CE1 4.31Å; V368-F384 HydrophobicContact CG2-CE1 4.27Å; V368-F384 HydrophobicContact CG2-CZ 4.46Å; F369-F384 AromaticContact CD2-CD1 3.83Å; F369-F384 HydrophobicContact CD2-CD1 3.83Å; F369-F384 HydrophobicContact CD2-CE1 4.4Å; F369-F384 HydrophobicContact CD2-CG 4.43Å; F369-F384 HydrophobicContact CE2-CB 3.86Å; F369-F384 AromaticContact CE2-CD1 3.62Å; F369-F384 HydrophobicContact CE2-CD1 3.62Å; F369-F384 HydrophobicContact CE2-CE1 4.25Å; F369-F384 AromaticContact CE2-CG 3.8Å; F369-F384 HydrophobicContact CE2-CG 3.8Å; E380-F384 WeakPolarHBondContact O-CB 3.5Å; E380-F384 PolarHBondContact O-N 3.16Å; R381-F384 PolarHBondContact O-N 2.93Å; L382-F384 VanDerWaalsContact C-N 3.32Å; L382-F384 PolarHBondContact O-N 3.48Å; F384-L388 HydrophobicContact CD1-CD1 4.39Å; F384-L388 HydrophobicContact CD2-CD1 3.7Å; F384-L388 HydrophobicContact CE1-CD1 4.2Å; F384-L388 HydrophobicContact CE2-CD1 3.45Å; F384-L388 VanDerWaalsContact CE2-CD1 3.45Å; F384-L388 HydrophobicContact CG-CD1 4.17Å; F384-L388 HydrophobicContact CZ-CD1 3.73Å; F384-L388 VanDerWaalsContact O-CB 3.28Å; F384-L388 WeakPolarHBondContact O-CB 3.34Å; F384-L388 WeakPolarHBondContact O-CG 3.41Å; F384-L388 PolarHBondContact O-N 2.85Å
385	E	82.8	Confident	81.7	Confident	20 Å²	20	57 Å²	57	9%	0.093	28%	0.283	C	S	.	.	H	α-helix	trans	-70.6	-44.3	-177.2	-71.8	-174.7	-174.7	0	0	112.9	Y366 F369 R381 G389	Y366-E385 HydrophobicContact CD1-CG 4.26Å; F369-E385 WeakPolarHBondContact CB-OE1 3.31Å; R381-E385 HydrophobicContact CG-CG 4.18Å; R381-E385 IonicContact CZ-OE1 3.71Å; R381-E385 IonicContact CZ-OE2 2.8Å; R381-E385 VanDerWaalsContact NE-CD 3.31Å; R381-E385 IonicContact NE-OE1 3.98Å; R381-E385 PolarHBondContact NE-OE1 2.74Å; R381-E385 IonicContact NE-OE2 3.6Å; R381-E385 PolarHBondContact NE-OE2 3.19Å; R381-E385 IonicContact NH2-OE1 3.68Å; R381-E385 PolarHBondContact NH2-OE1 3.02Å; R381-E385 IonicContact NH2-OE2 2.71Å; R381-E385 PolarHBondContact NH2-OE2 3.14Å; R381-E385 WeakPolarHBondContact O-CB 3.35Å; R381-E385 PolarHBondContact O-N 3.47Å; E385-G389 WeakPolarHBondContact O-CA 3.4Å; E385-G389 PolarHBondContact O-N 3.37Å
386	L	82.8	Confident	83.1	Confident	45 Å²	45	51.3 Å²	51.3	24%	0.236	25%	0.253	C	S	.	.	H	α-helix	trans	-82.1	-36.9	-179.7	-73.9	63.4	0	0	0	110.9	V153 Y157 L382 S390	V153-L386 HydrophobicContact CG1-CD2 4.34Å; Y157-L386 HydrophobicContact CD1-CB 4.23Å; Y157-L386 HydrophobicContact CD1-CD2 3.71Å; Y157-L386 HydrophobicContact CD1-CG 4.5Å; Y157-L386 HydrophobicContact CE1-CD2 3.94Å; L382-L386 HydrophobicContact CD1-CD1 3.66Å; L382-L386 HydrophobicContact CD1-CD2 3.77Å; L382-L386 HydrophobicContact CD1-CG 4.35Å; L382-L386 HydrophobicContact CG-CD1 4.19Å; L382-L386 HydrophobicContact CG-CD2 4.13Å; L382-L386 WeakPolarHBondContact O-CB 3.39Å; L382-L386 PolarHBondContact O-N 3.4Å; L386-S390 WeakPolarHBondContact O-CB 3.16Å; L386-S390 PolarHBondContact O-N 3.11Å; L386-S390 PolarHBondContact O-OG 3.16Å
387	G	82.9	Confident	84.6	Confident	6 Å²	6	47.7 Å²	47.7	6%	0.062	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-66.3	174	0	0	0	0	0	111.5	V383 G389 S390 F391	V383-G387 WeakPolarHBondContact O-CA 3.39Å; V383-G387 PolarHBondContact O-N 3.07Å; G387-G389 PolarHBondContact O-N 3.43Å; G387-S390 PolarHBondContact O-N 3.15Å; G387-S390 PolarHBondContact O-OG 2.97Å; G387-F391 WeakPolarHBondContact O-CD2 3.05Å
388	L	82.7	Confident	85.8	Confident	91 Å²	91	47.2 Å²	47.2	48%	0.476	23%	0.226	S	C	.	.	H	α-helix	trans	-68	-36.9	-178.1	-58.4	179.7	0	0	0	112.2	F384 S390 F391 Q392	F384-L388 HydrophobicContact CD1-CD1 4.39Å; F384-L388 HydrophobicContact CD2-CD1 3.7Å; F384-L388 HydrophobicContact CE1-CD1 4.2Å; F384-L388 HydrophobicContact CE2-CD1 3.45Å; F384-L388 VanDerWaalsContact CE2-CD1 3.45Å; F384-L388 HydrophobicContact CG-CD1 4.17Å; F384-L388 HydrophobicContact CZ-CD1 3.73Å; F384-L388 VanDerWaalsContact O-CB 3.28Å; F384-L388 WeakPolarHBondContact O-CB 3.34Å; F384-L388 WeakPolarHBondContact O-CG 3.41Å; F384-L388 PolarHBondContact O-N 2.85Å; L388-S390 PolarHBondContact O-N 3.47Å; L388-F391 PolarHBondContact O-N 3.5Å; L388-Q392 PolarHBondContact O-N 3.26Å
389	G	86.8	Confident	86.7	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-34.6	179	0	0	0	0	0	113.9	Y366 E385 G387 Q392	Y366-G389 WeakPolarHBondContact OH-CA 3.44Å; E385-G389 WeakPolarHBondContact O-CA 3.4Å; E385-G389 PolarHBondContact O-N 3.37Å; G387-G389 PolarHBondContact O-N 3.43Å; G389-Q392 WeakPolarHBondContact O-CB 3.46Å; G389-Q392 PolarHBondContact O-N 3.41Å
390	S	92.3	Very high	87.5	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-70.3	-32.6	177.3	65	0	0	0	0	113.2	G160 S164 L386 G387 L388	G160-S390 CarbonylContact C-O 3.55Å; G160-S390 VanDerWaalsContact C-O 3.29Å; S164-S390 PolarHBondContact OG-O 3.17Å; L386-S390 WeakPolarHBondContact O-CB 3.16Å; L386-S390 PolarHBondContact O-N 3.11Å; L386-S390 PolarHBondContact O-OG 3.16Å; G387-S390 PolarHBondContact O-N 3.15Å; G387-S390 PolarHBondContact O-OG 2.97Å; L388-S390 PolarHBondContact O-N 3.47Å
391	F	92.8	Very high	88.3	Confident	64 Å²	64	33.7 Å²	33.7	28%	0.281	17%	0.168	S	C	.	.	H	α-helix	trans	-84.3	-8.6	171.9	-72	-81.4	0	0	0	113.9	L156 V159 G387 L388 G393 F394 V395	L156-F391 HydrophobicContact CD1-CE2 4.19Å; V159-F391 HydrophobicContact CG1-CZ 4.27Å; G387-F391 WeakPolarHBondContact O-CD2 3.05Å; L388-F391 PolarHBondContact O-N 3.5Å; F391-G393 VanDerWaalsContact C-N 3.29Å; F391-G393 PolarHBondContact O-N 2.89Å; F391-F394 WeakPolarHBondContact O-CB 3.3Å; F391-F394 PolarHBondContact O-N 3.38Å; F391-F394 VanDerWaalsContact O-N 3.17Å; F391-V395 PolarHBondContact O-N 3.37Å; F391-V395 VanDerWaalsContact O-N 3.08Å
392	Q	92.7	Very high	88.9	Confident	3 Å²	3	34.4 Å²	34.4	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-55.6	-43.1	-179.8	-167	-172.4	4.1	0	0	112	F196 P360 Y366 L388 G389 F394 V395 V396	F196-Q392 HydrophobicContact CE1-CB 4Å; F196-Q392 HydrophobicContact CE1-CG 4.01Å; F196-Q392 HydrophobicContact CZ-CB 4.22Å; F196-Q392 HydrophobicContact CZ-CG 3.76Å; P360-Q392 VanDerWaalsContact O-CG 3.32Å; P360-Q392 WeakPolarHBondContact O-CG 3.41Å; P360-Q392 PolarHBondContact O-NE2 3.49Å; Y366-Q392 PolarHBondContact OH-OE1 2.82Å; L388-Q392 PolarHBondContact O-N 3.26Å; G389-Q392 WeakPolarHBondContact O-CB 3.46Å; G389-Q392 PolarHBondContact O-N 3.41Å; Q392-F394 PolarHBondContact O-N 3.09Å; Q392-V395 PolarHBondContact O-N 3.17Å; Q392-V396 WeakPolarHBondContact O-CB 3.28Å; Q392-V396 VanDerWaalsContact O-CG2 3.29Å; Q392-V396 WeakPolarHBondContact O-CG2 2.96Å; Q392-V396 PolarHBondContact O-N 3.18Å
393	G	94.2	Very high	89.5	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.4	-41.4	178	0	0	0	0	0	113.6	F391 V396 A397	F391-G393 VanDerWaalsContact C-N 3.29Å; F391-G393 PolarHBondContact O-N 2.89Å; G393-V396 PolarHBondContact O-N 2.89Å; G393-A397 WeakPolarHBondContact O-CB 3.44Å; G393-A397 PolarHBondContact O-N 3.35Å
394	F	94.6	Very high	90	Very high	72 Å²	72	35.5 Å²	35.5	32%	0.316	18%	0.176	S	C	.	.	H	α-helix	trans	-59.8	-48.6	173	162.3	-104.7	0	0	0	111.4	T163 S164 T167 F391 Q392 V396 A397 V398	T163-F394 HydrophobicContact CG2-CB 4.37Å; T163-F394 HydrophobicContact CG2-CD2 3.82Å; T163-F394 HydrophobicContact CG2-CE2 4.29Å; T163-F394 HydrophobicContact CG2-CG 4.07Å; S164-F394 PolarHBondContact OG-N 3.21Å; T167-F394 HydrophobicContact CG2-CD2 3.79Å; T167-F394 HydrophobicContact CG2-CE2 4.13Å; F391-F394 WeakPolarHBondContact O-CB 3.3Å; F391-F394 PolarHBondContact O-N 3.38Å; F391-F394 VanDerWaalsContact O-N 3.17Å; Q392-F394 PolarHBondContact O-N 3.09Å; F394-V396 PolarHBondContact O-N 2.88Å; F394-A397 PolarHBondContact O-N 2.85Å; F394-V398 HydrophobicContact CD2-CG2 4.1Å; F394-V398 HydrophobicContact CE1-CG2 4.47Å; F394-V398 HydrophobicContact CE2-CG2 3.7Å; F394-V398 HydrophobicContact CZ-CG2 3.91Å; F394-V398 WeakPolarHBondContact O-CG2 3.29Å; F394-V398 PolarHBondContact O-N 2.79Å
395	V	92.8	Very high	90.3	Very high	46 Å²	46	34.5 Å²	34.5	28%	0.279	19%	0.186	S	C	.	.	H	α-helix	trans	-60.7	-48.4	178.2	176.5	0	0	0	0	110.5	P360 F391 Q392 A397 V398 L399	P360-V395 HydrophobicContact CB-CG1 4.1Å; P360-V395 HydrophobicContact CG-CG1 3.84Å; F391-V395 PolarHBondContact O-N 3.37Å; F391-V395 VanDerWaalsContact O-N 3.08Å; Q392-V395 PolarHBondContact O-N 3.17Å; V395-A397 VanDerWaalsContact C-N 3.33Å; V395-A397 PolarHBondContact O-N 2.82Å; V395-V398 PolarHBondContact O-N 2.65Å; V395-V398 VanDerWaalsContact O-N 3.16Å; V395-L399 HydrophobicContact CG1-CD1 3.81Å; V395-L399 HydrophobicContact CG1-CG 4.27Å; V395-L399 VanDerWaalsContact O-CG 3.29Å; V395-L399 WeakPolarHBondContact O-CG 3.48Å; V395-L399 PolarHBondContact O-N 2.69Å
396	V	93.3	Very high	90.7	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-57.4	-43.2	177.1	166.7	0	0	0	0	111.8	L192 F193 F196 L361 Q392 G393 F394 L399 Y400	L192-V396 HydrophobicContact CD2-CG1 4.04Å; F193-V396 HydrophobicContact CD1-CG1 4Å; F193-V396 HydrophobicContact CE1-CG1 3.63Å; F196-V396 HydrophobicContact CE2-CB 4.36Å; F196-V396 HydrophobicContact CE2-CG1 4.31Å; F196-V396 HydrophobicContact CE2-CG2 4.1Å; F196-V396 HydrophobicContact CZ-CG2 4.41Å; L361-V396 HydrophobicContact CD1-CG2 4.1Å; Q392-V396 WeakPolarHBondContact O-CB 3.28Å; Q392-V396 VanDerWaalsContact O-CG2 3.29Å; Q392-V396 WeakPolarHBondContact O-CG2 2.96Å; Q392-V396 PolarHBondContact O-N 3.18Å; G393-V396 PolarHBondContact O-N 2.89Å; F394-V396 PolarHBondContact O-N 2.88Å; V396-L399 PolarHBondContact O-N 2.83Å; V396-Y400 HydrophobicContact CG1-CD2 4.49Å; V396-Y400 PolarHBondContact O-N 3.02Å
397	A	94.2	Very high	91.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-43.2	175.8	0	0	0	0	0	112.6	L168 A171 G393 F394 V395 C401 F402	L168-A397 HydrophobicContact CD2-CB 3.91Å; L168-A397 HydrophobicContact CG-CB 4.2Å; A171-A397 HydrophobicContact CB-CB 4.24Å; G393-A397 WeakPolarHBondContact O-CB 3.44Å; G393-A397 PolarHBondContact O-N 3.35Å; F394-A397 PolarHBondContact O-N 2.85Å; V395-A397 VanDerWaalsContact C-N 3.33Å; V395-A397 PolarHBondContact O-N 2.82Å; A397-C401 WeakPolarHBondContact O-CA 3.45Å; A397-C401 VanDerWaalsContact O-CB 3.26Å; A397-C401 WeakPolarHBondContact O-CB 3.46Å; A397-C401 PolarHBondContact O-N 3.03Å; A397-F402 HydrophobicContact CB-CE2 4.35Å; A397-F402 WeakPolarHBondContact O-CD2 3.43Å; A397-F402 PolarHBondContact O-N 2.79Å
398	V	93.2	Very high	91.8	Very high	39 Å²	39	39.9 Å²	39.9	24%	0.236	21%	0.208	C	C	.	.	I	π-helix	trans	-60.6	-44.9	176.7	168.9	0	0	0	0	111.2	F394 V395 F402 L403	F394-V398 HydrophobicContact CD2-CG2 4.1Å; F394-V398 HydrophobicContact CE1-CG2 4.47Å; F394-V398 HydrophobicContact CE2-CG2 3.7Å; F394-V398 HydrophobicContact CZ-CG2 3.91Å; F394-V398 WeakPolarHBondContact O-CG2 3.29Å; F394-V398 PolarHBondContact O-N 2.79Å; V395-V398 PolarHBondContact O-N 2.65Å; V395-V398 VanDerWaalsContact O-N 3.16Å; V398-F402 PolarHBondContact O-N 3.4Å; V398-L403 HydrophobicContact CG1-CD1 3.74Å; V398-L403 HydrophobicContact CG1-CG 3.97Å; V398-L403 WeakPolarHBondContact O-CB 3.33Å; V398-L403 WeakPolarHBondContact O-CG 3.49Å; V398-L403 PolarHBondContact O-N 2.83Å
399	L	90.7	Very high	92.3	Very high	29 Å²	29	38 Å²	38	15%	0.152	21%	0.206	C	C	.	.	I	π-helix	trans	-73.3	-52.4	-176.6	-61.2	178.1	0	0	0	112.8	L357 V395 V396 L403	L357-L399 HydrophobicContact CB-CD1 4.08Å; L357-L399 HydrophobicContact CD1-CD2 4.1Å; L357-L399 HydrophobicContact CD2-CD1 3.87Å; L357-L399 HydrophobicContact CD2-CD2 3.47Å; L357-L399 VanDerWaalsContact CD2-CD2 3.47Å; L357-L399 HydrophobicContact CD2-CG 4.32Å; L357-L399 HydrophobicContact CG-CD1 4.44Å; L357-L399 HydrophobicContact CG-CD2 4.26Å; V395-L399 HydrophobicContact CG1-CD1 3.81Å; V395-L399 HydrophobicContact CG1-CG 4.27Å; V395-L399 VanDerWaalsContact O-CG 3.29Å; V395-L399 WeakPolarHBondContact O-CG 3.48Å; V395-L399 PolarHBondContact O-N 2.69Å; V396-L399 PolarHBondContact O-N 2.83Å; L399-L403 HydrophobicContact CD2-CD1 4.28Å
400	Y	89.2	Confident	92.6	Very high	49 Å²	49	38.5 Å²	38.5	19%	0.192	21%	0.208	C	C	.	.	I	π-helix	trans	-86.5	-18.4	-173.1	-76.4	-32.6	0	0	0	115.5	H189 E247 L361 V396 N404	H189-Y400 AromaticContact CE1-CD2 3.45Å; H189-Y400 VanDerWaalsContact CE1-CD2 3.45Å; H189-Y400 WeakPolarHBondContact CE1-CD2 3.13Å; H189-Y400 AromaticContact CE1-CE1 3.86Å; H189-Y400 AromaticContact CE1-CE2 3.12Å; H189-Y400 WeakPolarHBondContact CE1-CE2 3.3Å; H189-Y400 AromaticContact CE1-CG 3.91Å; H189-Y400 AromaticContact CE1-CZ 3.35Å; H189-Y400 AromaticContact CG-CD2 3.94Å; H189-Y400 AromaticContact ND1-CD2 3.48Å; H189-Y400 WeakPolarHBondContact ND1-CD2 3.4Å; H189-Y400 AromaticContact ND1-CE2 3.41Å; H189-Y400 WeakPolarHBondContact ND1-CE2 3.43Å; H189-Y400 AromaticContact NE2-CD1 3.9Å; H189-Y400 AromaticContact NE2-CD2 3.89Å; H189-Y400 AromaticContact NE2-CE1 3.94Å; H189-Y400 AromaticContact NE2-CE2 3.89Å; H189-Y400 AromaticContact NE2-CG 3.88Å; H189-Y400 AromaticContact NE2-CZ 3.91Å; E247-Y400 WeakPolarHBondContact OE2-CE2 2.94Å; L361-Y400 HydrophobicContact CD1-CD2 3.87Å; L361-Y400 HydrophobicContact CD1-CE2 3.27Å; L361-Y400 HydrophobicContact CD2-CE2 3.89Å; L361-Y400 WeakPolarHBondContact CD2-OH 3.33Å; L361-Y400 HydrophobicContact CG-CE2 4.07Å; V396-Y400 HydrophobicContact CG1-CD2 4.49Å; V396-Y400 PolarHBondContact O-N 3.02Å; Y400-N404 VanDerWaalsContact O-CB 3.23Å; Y400-N404 WeakPolarHBondContact O-CB 3.28Å; Y400-N404 PolarHBondContact O-ND2 2.72Å
401	C	93.4	Very high	92.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	-108.8	-62.1	174.5	-159	0	0	0	0	112.8	A171 F193 A397 V407	A171-C401 HydrophobicContact CB-CB 3.57Å; F193-C401 HydrophobicContact CE2-CB 4.43Å; A397-C401 WeakPolarHBondContact O-CA 3.45Å; A397-C401 VanDerWaalsContact O-CB 3.26Å; A397-C401 WeakPolarHBondContact O-CB 3.46Å; A397-C401 PolarHBondContact O-N 3.03Å; C401-V407 VanDerWaalsContact O-CB 3.3Å; C401-V407 WeakPolarHBondContact O-CB 3.24Å; C401-V407 WeakPolarHBondContact O-CG1 3.43Å
402	F	93.7	Very high	92.6	Very high	69 Å²	69	45.3 Å²	45.3	30%	0.303	24%	0.24	S	C	.	.	I	π-helix	trans	-77.9	-35	-165.7	-62.4	-74.6	0	0	0	114.3	T170 A171 I174 A397 V398 Q408	T170-F402 HydrophobicContact CG2-CE1 4.02Å; T170-F402 HydrophobicContact CG2-CZ 3.76Å; A171-F402 HydrophobicContact CB-CE2 4.06Å; A171-F402 HydrophobicContact CB-CZ 4.31Å; I174-F402 HydrophobicContact CD1-CD1 4.36Å; I174-F402 HydrophobicContact CD1-CE1 3.72Å; I174-F402 HydrophobicContact CD1-CZ 4.37Å; A397-F402 HydrophobicContact CB-CE2 4.35Å; A397-F402 WeakPolarHBondContact O-CD2 3.43Å; A397-F402 PolarHBondContact O-N 2.79Å; V398-F402 PolarHBondContact O-N 3.4Å; F402-Q408 WeakPolarHBondContact O-CG 3.46Å; F402-Q408 PolarHBondContact O-NE2 3.21Å
403	L	91.1	Very high	92.6	Very high	107 Å²	107	51.4 Å²	51.4	56%	0.56	26%	0.263	S	S	*	.	S	Bend	trans	-93.7	-5	176.2	-64.2	-177.7	0	0	0	113.9	V398 L399 G405	V398-L403 HydrophobicContact CG1-CD1 3.74Å; V398-L403 HydrophobicContact CG1-CG 3.97Å; V398-L403 WeakPolarHBondContact O-CB 3.33Å; V398-L403 WeakPolarHBondContact O-CG 3.49Å; V398-L403 PolarHBondContact O-N 2.83Å; L399-L403 HydrophobicContact CD2-CD1 4.28Å; L403-G405 PolarHBondContact O-N 3.43Å
404	N	90.4	Very high	92.5	Very high	32 Å²	32	57.2 Å²	57.2	17%	0.171	29%	0.288	C	S	.	.			trans	-69.5	119.6	179.6	-179.3	-18.9	0	0	0	111.2	Y400 E406 V407 Q408	Y400-N404 VanDerWaalsContact O-CB 3.23Å; Y400-N404 WeakPolarHBondContact O-CB 3.28Å; Y400-N404 PolarHBondContact O-ND2 2.72Å; N404-E406 VanDerWaalsContact C-N 3.28Å; N404-E406 PolarHBondContact O-N 3.46Å; N404-E406 WeakPolarHBondContact OD1-CB 3.44Å; N404-E406 PolarHBondContact OD1-N 2.83Å; N404-V407 HydrophobicContact CB-CB 4.22Å; N404-V407 HydrophobicContact CB-CG2 3.8Å; N404-V407 WeakPolarHBondContact O-CB 3.34Å; N404-V407 PolarHBondContact O-N 3.3Å; N404-V407 VanDerWaalsContact O-N 3.08Å; N404-Q408 WeakPolarHBondContact O-CG 3.29Å; N404-Q408 PolarHBondContact O-N 2.79Å
405	G	90.1	Very high	92.3	Very high	49 Å²	49	60.9 Å²	60.9	51%	0.505	30%	0.3	S	S	.	.	H	α-helix	trans	-59.4	-32.1	-176.3	0	0	0	0	0	114.5	L403 A409	L403-G405 PolarHBondContact O-N 3.43Å; G405-A409 WeakPolarHBondContact O-CB 3.01Å; G405-A409 PolarHBondContact O-N 2.94Å
406	E	91.7	Very high	92.4	Very high	90 Å²	90	65.4 Å²	65.4	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-45.8	174.8	-63.1	179.9	-167.9	0	0	111	L181 R185 N404 A409 E410	L181-E406 HydrophobicContact CD2-CB 4.39Å; R185-E406 IonicContact NH1-OE1 3.23Å; N404-E406 VanDerWaalsContact C-N 3.28Å; N404-E406 PolarHBondContact O-N 3.46Å; N404-E406 WeakPolarHBondContact OD1-CB 3.44Å; N404-E406 PolarHBondContact OD1-N 2.83Å; E406-A409 PolarHBondContact O-N 3.29Å; E406-E410 WeakPolarHBondContact O-CG 3.46Å; E406-E410 PolarHBondContact O-N 3.31Å
407	V	93.3	Very high	92.3	Very high	1 Å²	1	67.8 Å²	67.8	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-46.1	179.5	-175.4	0	0	0	0	110.3	I174 L175 L181 C401 N404 A409 E410 I411	I174-V407 HydrophobicContact CG2-CG1 3.64Å; L175-V407 HydrophobicContact CD2-CG2 4.45Å; L181-V407 HydrophobicContact CD1-CG1 4.43Å; L181-V407 HydrophobicContact CD1-CG2 4.01Å; C401-V407 VanDerWaalsContact O-CB 3.3Å; C401-V407 WeakPolarHBondContact O-CB 3.24Å; C401-V407 WeakPolarHBondContact O-CG1 3.43Å; N404-V407 HydrophobicContact CB-CB 4.22Å; N404-V407 HydrophobicContact CB-CG2 3.8Å; N404-V407 WeakPolarHBondContact O-CB 3.34Å; N404-V407 PolarHBondContact O-N 3.3Å; N404-V407 VanDerWaalsContact O-N 3.08Å; V407-A409 PolarHBondContact O-N 3.44Å; V407-E410 PolarHBondContact O-N 2.96Å; V407-I411 HydrophobicContact CG1-CD1 3.85Å; V407-I411 HydrophobicContact CG1-CG1 4.44Å; V407-I411 WeakPolarHBondContact O-CG1 3.31Å; V407-I411 PolarHBondContact O-N 3.09Å
408	Q	93.7	Very high	92.1	Very high	94 Å²	94	73.9 Å²	73.9	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-41.5	175.8	-69.2	-171.2	0.2	0	0	112.2	F402 N404 E410 K412	F402-Q408 WeakPolarHBondContact O-CG 3.46Å; F402-Q408 PolarHBondContact O-NE2 3.21Å; N404-Q408 WeakPolarHBondContact O-CG 3.29Å; N404-Q408 PolarHBondContact O-N 2.79Å; Q408-E410 PolarHBondContact O-N 3.33Å; Q408-K412 WeakPolarHBondContact O-CB 3.49Å; Q408-K412 PolarHBondContact O-N 3.35Å
409	A	93.9	Very high	92.1	Very high	51 Å²	51	76.5 Å²	76.5	42%	0.421	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-41	175.9	0	0	0	0	0	111.9	G405 E406 V407 K412 R413	G405-A409 WeakPolarHBondContact O-CB 3.01Å; G405-A409 PolarHBondContact O-N 2.94Å; E406-A409 PolarHBondContact O-N 3.29Å; V407-A409 PolarHBondContact O-N 3.44Å; A409-K412 PolarHBondContact O-N 2.92Å; A409-R413 VanDerWaalsContact O-CB 3.27Å; A409-R413 WeakPolarHBondContact O-CB 3.31Å; A409-R413 PolarHBondContact O-N 2.87Å
410	E	93.4	Very high	92	Very high	12 Å²	12	78.6 Å²	78.6	6%	0.056	37%	0.374	C	S	.	.	H	α-helix	trans	-70.9	-40.7	177.5	-76.7	-57.8	134.5	0	0	113.4	K180 L181 E406 V407 Q408 R413 K414	K180-E410 WeakPolarHBondContact CD-OE1 3.03Å; K180-E410 WeakPolarHBondContact CE-OE1 3.19Å; K180-E410 IonicContact NZ-OE1 3.05Å; K180-E410 PolarHBondContact NZ-OE1 2.69Å; L181-E410 HydrophobicContact CD2-CG 4.2Å; E406-E410 WeakPolarHBondContact O-CG 3.46Å; E406-E410 PolarHBondContact O-N 3.31Å; V407-E410 PolarHBondContact O-N 2.96Å; Q408-E410 PolarHBondContact O-N 3.33Å; E410-R413 VanDerWaalsContact CD-NE 3.3Å; E410-R413 WeakPolarHBondContact O-CB 3.44Å; E410-R413 PolarHBondContact O-N 2.86Å; E410-R413 IonicContact OE1-CZ 3.45Å; E410-R413 IonicContact OE1-NE 3Å; E410-R413 PolarHBondContact OE1-NE 2.94Å; E410-R413 IonicContact OE1-NH2 2.73Å; E410-R413 PolarHBondContact OE1-NH2 2.89Å; E410-R413 IonicContact OE2-CZ 3.17Å; E410-R413 IonicContact OE2-NE 2.85Å; E410-R413 PolarHBondContact OE2-NE 2.03Å; E410-R413 IonicContact OE2-NH2 3.45Å; E410-R413 PolarHBondContact OE2-NH2 2.89Å; E410-K414 PolarHBondContact O-N 2.98Å
411	I	92.1	Very high	91.9	Very high	70 Å²	70	81.2 Å²	81.2	36%	0.359	39%	0.391	S	S	.	.	H	α-helix	trans	-60.4	-48.7	171.2	-69.1	170.2	0	0	0	109.6	F178 V407 R413 K414 W415	F178-I411 HydrophobicContact CE2-CG1 3.86Å; F178-I411 HydrophobicContact CZ-CG1 4.14Å; V407-I411 HydrophobicContact CG1-CD1 3.85Å; V407-I411 HydrophobicContact CG1-CG1 4.44Å; V407-I411 WeakPolarHBondContact O-CG1 3.31Å; V407-I411 PolarHBondContact O-N 3.09Å; I411-R413 VanDerWaalsContact C-N 3.26Å; I411-R413 PolarHBondContact O-N 2.85Å; I411-K414 PolarHBondContact O-N 3.43Å; I411-W415 VanDerWaalsContact O-CB 3.26Å; I411-W415 WeakPolarHBondContact O-CB 3.46Å; I411-W415 PolarHBondContact O-N 2.92Å
412	K	93.5	Very high	91.4	Very high	137 Å²	137	88.2 Å²	88.2	60%	0.596	42%	0.417	S	S	*	.	H	α-helix	trans	-64.3	-26.7	176.7	-168.9	173	-175.6	174.1	0	112.7	Q408 A409 R416	Q408-K412 WeakPolarHBondContact O-CB 3.49Å; Q408-K412 PolarHBondContact O-N 3.35Å; A409-K412 PolarHBondContact O-N 2.92Å; K412-R416 WeakPolarHBondContact O-CB 3.27Å; K412-R416 VanDerWaalsContact O-CG 3.3Å; K412-R416 WeakPolarHBondContact O-CG 3.2Å; K412-R416 PolarHBondContact O-N 2.8Å; K412-R416 PolarHBondContact O-NE 3.01Å
413	R	92.8	Very high	90.5	Very high	131 Å²	131	92 Å²	92	49%	0.494	43%	0.431	S	S	.	.	H	α-helix	trans	-73	-50.3	172.3	-173	171.2	76.6	122.3	-2	111	A409 E410 I411 R416 S417	A409-R413 VanDerWaalsContact O-CB 3.27Å; A409-R413 WeakPolarHBondContact O-CB 3.31Å; A409-R413 PolarHBondContact O-N 2.87Å; E410-R413 VanDerWaalsContact CD-NE 3.3Å; E410-R413 WeakPolarHBondContact O-CB 3.44Å; E410-R413 PolarHBondContact O-N 2.86Å; E410-R413 IonicContact OE1-CZ 3.45Å; E410-R413 IonicContact OE1-NE 3Å; E410-R413 PolarHBondContact OE1-NE 2.94Å; E410-R413 IonicContact OE1-NH2 2.73Å; E410-R413 PolarHBondContact OE1-NH2 2.89Å; E410-R413 IonicContact OE2-CZ 3.17Å; E410-R413 IonicContact OE2-NE 2.85Å; E410-R413 PolarHBondContact OE2-NE 2.03Å; E410-R413 IonicContact OE2-NH2 3.45Å; E410-R413 PolarHBondContact OE2-NH2 2.89Å; I411-R413 VanDerWaalsContact C-N 3.26Å; I411-R413 PolarHBondContact O-N 2.85Å; R413-R416 PolarHBondContact O-N 3.06Å; R413-S417 PolarHBondContact O-N 3.32Å; R413-S417 VanDerWaalsContact O-N 3.08Å
414	K	90.8	Very high	89.8	Confident	122 Å²	122	92.9 Å²	92.9	53%	0.53	43%	0.43	S	S	.	.	H	α-helix	trans	-69.7	-36.5	-178.8	-166.8	61.8	172.7	176.4	0	112.5	F178 E410 I411 S417 W418	F178-K414 HydrophobicContact CE1-CB 4.01Å; F178-K414 HydrophobicContact CE1-CG 4.16Å; F178-K414 HydrophobicContact CZ-CB 4.45Å; E410-K414 PolarHBondContact O-N 2.98Å; I411-K414 PolarHBondContact O-N 3.43Å; K414-S417 PolarHBondContact O-N 2.69Å; K414-W418 WeakPolarHBondContact O-CB 3.35Å; K414-W418 PolarHBondContact O-N 2.7Å
415	W	92	Very high	89	Confident	150 Å²	150	94.5 Å²	94.5	57%	0.568	45%	0.448	S	S	*	.	H	α-helix	trans	-65.4	-42	175.2	-171.3	77.5	0	0	0	112.2	I411 W418 K419	I411-W415 VanDerWaalsContact O-CB 3.26Å; I411-W415 WeakPolarHBondContact O-CB 3.46Å; I411-W415 PolarHBondContact O-N 2.92Å; W415-W418 PolarHBondContact O-N 2.82Å; W415-K419 WeakPolarHBondContact O-CB 3.49Å; W415-K419 PolarHBondContact O-N 2.86Å
416	R	93.6	Very high	88	Confident	141 Å²	141	96 Å²	96	53%	0.532	45%	0.447	S	S	.	.	H	α-helix	trans	-60.4	-47.8	171.8	-80.5	-178.6	-72.6	174.2	-1.9	112	K412 R413 W418 K419 V420	K412-R416 WeakPolarHBondContact O-CB 3.27Å; K412-R416 VanDerWaalsContact O-CG 3.3Å; K412-R416 WeakPolarHBondContact O-CG 3.2Å; K412-R416 PolarHBondContact O-N 2.8Å; K412-R416 PolarHBondContact O-NE 3.01Å; R413-R416 PolarHBondContact O-N 3.06Å; R416-W418 PolarHBondContact O-N 3.38Å; R416-K419 PolarHBondContact O-N 2.89Å; R416-V420 WeakPolarHBondContact O-CG2 3.46Å; R416-V420 PolarHBondContact O-N 3.32Å
417	S	91.1	Very high	86.6	Confident	50 Å²	50	96.2 Å²	96.2	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-58.3	-44.1	175.5	166	0	0	0	0	112.4	R413 K414 V420 N421	R413-S417 PolarHBondContact O-N 3.32Å; R413-S417 VanDerWaalsContact O-N 3.08Å; K414-S417 PolarHBondContact O-N 2.69Å; S417-V420 PolarHBondContact O-N 3.06Å; S417-N421 WeakPolarHBondContact O-CB 3.13Å; S417-N421 PolarHBondContact O-N 3.22Å; S417-N421 PolarHBondContact O-OD1 3.44Å; S417-N421 VanDerWaalsContact O-OD1 3.1Å
418	W	91.2	Very high	84.9	Confident	128 Å²	128	104.5 Å²	104.5	49%	0.485	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-39.1	178	177.6	88.3	0	0	0	112.8	K414 W415 R416 N421 R422	K414-W418 WeakPolarHBondContact O-CB 3.35Å; K414-W418 PolarHBondContact O-N 2.7Å; W415-W418 PolarHBondContact O-N 2.82Å; R416-W418 PolarHBondContact O-N 3.38Å; W418-N421 PolarHBondContact O-N 3.43Å; W418-R422 VanDerWaalsContact CH2-CZ 3.49Å; W418-R422 WeakPolarHBondContact O-CB 3.31Å; W418-R422 PolarHBondContact O-N 2.84Å
419	K	91.8	Very high	83.1	Confident	95 Å²	95	108.5 Å²	108.5	41%	0.413	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-46.7	174.2	-179	168.9	179.9	173.4	0	111	W415 R416 R422 Y423	W415-K419 WeakPolarHBondContact O-CB 3.49Å; W415-K419 PolarHBondContact O-N 2.86Å; R416-K419 PolarHBondContact O-N 2.89Å; K419-R422 PolarHBondContact O-N 2.88Å; K419-Y423 HydrophobicContact CD-CE2 4.38Å; K419-Y423 HydrophobicContact CG-CD2 4.26Å; K419-Y423 HydrophobicContact CG-CE2 3.78Å; K419-Y423 WeakPolarHBondContact O-CD2 3.45Å; K419-Y423 PolarHBondContact O-N 2.9Å
420	V	89	Confident	81.3	Confident	73 Å²	73	113.2 Å²	113.2	44%	0.442	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-48.2	176	171.1	0	0	0	0	111.3	R416 S417 R422 Y423 F424	R416-V420 WeakPolarHBondContact O-CG2 3.46Å; R416-V420 PolarHBondContact O-N 3.32Å; S417-V420 PolarHBondContact O-N 3.06Å; V420-R422 PolarHBondContact O-N 2.04Å; V420-Y423 PolarHBondContact O-N 3.37Å; V420-Y423 VanDerWaalsContact O-N 3.15Å; V420-F424 HydrophobicContact CG1-CD2 3.91Å; V420-F424 HydrophobicContact CG1-CE2 3.62Å; V420-F424 WeakPolarHBondContact O-CD2 3.48Å; V420-F424 PolarHBondContact O-N 2.9Å
421	N	87.1	Confident	79.2	Confident	103 Å²	103	123 Å²	123	55%	0.551	55%	0.552	S	S	*	*	H	α-helix	trans	-61.7	-31.9	177.5	-72.6	24.5	0	0	0	112.6	S417 W418 A425	S417-N421 WeakPolarHBondContact O-CB 3.13Å; S417-N421 PolarHBondContact O-N 3.22Å; S417-N421 PolarHBondContact O-OD1 3.44Å; S417-N421 VanDerWaalsContact O-OD1 3.1Å; W418-N421 PolarHBondContact O-N 3.43Å; N421-A425 WeakPolarHBondContact O-CB 3.47Å; N421-A425 PolarHBondContact O-N 3.4Å
422	R	82.9	Confident	76.9	Confident	148 Å²	148	127.4 Å²	127.4	56%	0.558	57%	0.571	S	S	*	*	H	α-helix	trans	-67.7	-37.2	174.4	-89.5	-169.8	163.3	-161.3	-1.4	113.3	W418 K419 V420 A425 V426	W418-R422 VanDerWaalsContact CH2-CZ 3.49Å; W418-R422 WeakPolarHBondContact O-CB 3.31Å; W418-R422 PolarHBondContact O-N 2.84Å; K419-R422 PolarHBondContact O-N 2.88Å; V420-R422 PolarHBondContact O-N 2.04Å; R422-A425 PolarHBondContact O-N 3.08Å; R422-V426 WeakPolarHBondContact O-CG2 3.37Å; R422-V426 PolarHBondContact O-N 3.29Å
423	Y	75.8	Confident	74.6	Confident	149 Å²	149	126.2 Å²	126.2	58%	0.584	58%	0.578	S	S	*	*	H	α-helix	trans	-61.9	-52.4	173.6	-77.7	-75.7	0	0	0	111	K419 V420 A425 V426 D427	K419-Y423 HydrophobicContact CD-CE2 4.38Å; K419-Y423 HydrophobicContact CG-CD2 4.26Å; K419-Y423 HydrophobicContact CG-CE2 3.78Å; K419-Y423 WeakPolarHBondContact O-CD2 3.45Å; K419-Y423 PolarHBondContact O-N 2.9Å; V420-Y423 PolarHBondContact O-N 3.37Å; V420-Y423 VanDerWaalsContact O-N 3.15Å; Y423-A425 VanDerWaalsContact C-N 3.28Å; Y423-A425 PolarHBondContact O-N 3.24Å; Y423-V426 WeakPolarHBondContact O-CB 3.42Å; Y423-V426 PolarHBondContact O-N 3.24Å; Y423-D427 PolarHBondContact O-N 3.06Å
424	F	75.3	Confident	72.5	Confident	125 Å²	125	125.6 Å²	125.6	55%	0.548	59%	0.593	S	S	.	*	H	α-helix	trans	-59.4	-36.4	177.8	-71.4	-61.6	0	0	0	113.2	V420 V426 D427 F428	V420-F424 HydrophobicContact CG1-CD2 3.91Å; V420-F424 HydrophobicContact CG1-CE2 3.62Å; V420-F424 WeakPolarHBondContact O-CD2 3.48Å; V420-F424 PolarHBondContact O-N 2.9Å; F424-V426 VanDerWaalsContact C-N 3.27Å; F424-V426 PolarHBondContact O-N 2.7Å; F424-D427 PolarHBondContact O-N 3.29Å; F424-F428 WeakPolarHBondContact O-CD2 3.36Å; F424-F428 PolarHBondContact O-N 3.09Å
425	A	73.7	Confident	70.2	Confident	66 Å²	66	128.1 Å²	128.1	55%	0.545	61%	0.612	S	S	.	*	H	α-helix	trans	-66.8	-25.6	175.5	0	0	0	0	0	113.7	N421 R422 Y423	N421-A425 WeakPolarHBondContact O-CB 3.47Å; N421-A425 PolarHBondContact O-N 3.4Å; R422-A425 PolarHBondContact O-N 3.08Å; Y423-A425 VanDerWaalsContact C-N 3.28Å; Y423-A425 PolarHBondContact O-N 3.24Å
426	V	70.1	Confident	67.9	Low	81 Å²	81	125.3 Å²	125.3	49%	0.491	62%	0.62	S	S	.	*	H	α-helix	trans	-79.9	-43	173.7	172.3	0	0	0	0	110.8	R422 Y423 F424 F428 K429 H430	R422-V426 WeakPolarHBondContact O-CG2 3.37Å; R422-V426 PolarHBondContact O-N 3.29Å; Y423-V426 WeakPolarHBondContact O-CB 3.42Å; Y423-V426 PolarHBondContact O-N 3.24Å; F424-V426 VanDerWaalsContact C-N 3.27Å; F424-V426 PolarHBondContact O-N 2.7Å; V426-F428 PolarHBondContact O-N 3.29Å; V426-K429 PolarHBondContact O-N 2.94Å; V426-K429 VanDerWaalsContact O-N 3.13Å; V426-H430 PolarHBondContact O-N 2.57Å; V426-H430 PolarHBondContact O-ND1 3.07Å
427	D	61.6	Low	65.5	Low	94 Å²	94	123.7 Å²	123.7	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-60.4	-45.2	177.9	-72.2	-41.4	0	0	0	112.2	Y423 F424 K429 H430 R431	Y423-D427 PolarHBondContact O-N 3.06Å; F424-D427 PolarHBondContact O-N 3.29Å; D427-K429 PolarHBondContact O-N 2.92Å; D427-H430 PolarHBondContact O-N 3.45Å; D427-H430 VanDerWaalsContact O-N 3.11Å; D427-R431 PolarHBondContact O-N 3.49Å
428	F	56.9	Low	63.4	Low	174 Å²	174	126.9 Å²	126.9	76%	0.763	65%	0.653	S	S	*	*	H	α-helix	trans	-63.5	-23	177	-93.8	-79.9	0	0	0	113.6	F424 V426	F424-F428 WeakPolarHBondContact O-CD2 3.36Å; F424-F428 PolarHBondContact O-N 3.09Å; V426-F428 PolarHBondContact O-N 3.29Å
429	K	56	Low	61	Low	178 Å²	178	124.2 Å²	124.2	77%	0.774	67%	0.666	S	S	*	*	H	α-helix	trans	-85.2	-14.7	176.4	-154	178.1	-179	-174	0	113.5	V426 D427	V426-K429 PolarHBondContact O-N 2.94Å; V426-K429 VanDerWaalsContact O-N 3.13Å; D427-K429 PolarHBondContact O-N 2.92Å
430	H	56.9	Low	58.6	Low	151 Å²	151	126 Å²	126	70%	0.699	68%	0.684	S	S	*	*	H	α-helix	trans	-95.3	-17.7	176.3	-71.7	85	0	0	0	113.4	V426 D427 H432	V426-H430 PolarHBondContact O-N 2.57Å; V426-H430 PolarHBondContact O-ND1 3.07Å; D427-H430 PolarHBondContact O-N 3.45Å; D427-H430 VanDerWaalsContact O-N 3.11Å; H430-H432 PolarHBondContact O-N 3.27Å; H430-H432 VanDerWaalsContact O-N 3.17Å
431	R	48	Very low	56.2	Low	216 Å²	216	130.2 Å²	130.2	82%	0.815	70%	0.704	S	S	*	*			trans	-86.5	76.1	173.7	-71.9	-172.5	174	-174.4	-1.9	112.1	D427	D427-R431 PolarHBondContact O-N 3.49Å
432	H	44.1	Very low	53.8	Low	163 Å²	163	129.2 Å²	129.2	76%	0.755	72%	0.718	S	S	*	*			trans	-59.2	137.5	154.5	-99.8	-101.3	0	0	0	109.5	H430 S434	H430-H432 PolarHBondContact O-N 3.27Å; H430-H432 VanDerWaalsContact O-N 3.17Å; H432-S434 PolarHBondContact O-N 3.26Å
433	P	46.7	Very low	51.5	Low	113 Å²	113	125.4 Å²	125.4	73%	0.734	73%	0.725	S	S	*	*			trans	-78.9	87.7	180	31.3	-34.4	0	0	0	111	L435	P433-L435 PolarHBondContact O-N 3.06Å
434	S	48.4	Very low	50.1	Low	117 Å²	117	124.9 Å²	124.9	82%	0.818	74%	0.738	S	S	*	*			trans	-66.7	116.1	173.6	-58.1	0	0	0	0	111.3	H432 A436	H432-S434 PolarHBondContact O-N 3.26Å; S434-A436 PolarHBondContact O-N 2.82Å
435	L	42.1	Very low	48.4	Very low	176 Å²	176	125.7 Å²	125.7	92%	0.921	74%	0.743	S	S	*	*			trans	-70	113.2	172	-87.5	69.1	0	0	0	110.9	P433	P433-L435 PolarHBondContact O-N 3.06Å
436	A	43.5	Very low	46.9	Very low	90 Å²	90	130.5 Å²	130.5	74%	0.744	76%	0.759	S	S	*	*			trans	-151.4	97.2	157	0	0	0	0	0	106.6	S434	S434-A436 PolarHBondContact O-N 2.82Å
437	S	44.3	Very low	45.6	Very low	108 Å²	108	131.7 Å²	131.7	76%	0.755	77%	0.771	S	S	*	*				76.9	124.3	71.1	-170.7	0	0	0	0	113.5
438	S	45.9	Very low	44.8	Very low	116 Å²	116	133.1 Å²	133.1	81%	0.811	78%	0.777	S	S	*	*			trans	53.7	117.7	153.4	54.5	0	0	0	0	119.9
439	G	40.1	Very low	44.2	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	78%	0.782	S	S	*	*			trans	153	66.8	152.4	0	0	0	0	0	119.6
440	V	42.2	Very low	43.7	Very low	131 Å²	131	129.9 Å²	129.9	79%	0.794	78%	0.784	S	S	*	*			trans	44.1	121.2	140.8	178.4	0	0	0	0	120.6
441	N	37.9	Very low	42.9	Very low	162 Å²	162	132.1 Å²	132.1	87%	0.866	79%	0.792	S	S	*	*			trans	47.6	95.4	151.5	-58.5	-6	0	0	0	119.9
442	G	36.6	Very low	42.4	Very low	83 Å²	83	127.4 Å²	127.4	86%	0.856	79%	0.792	S	S	*	*			trans	-158.3	107	158.8	0	0	0	0	0	110.3
443	G	36.5	Very low	42.3	Very low	68 Å²	68	125 Å²	125	70%	0.701	79%	0.793	S	S	*	*			trans	-92.1	159.8	-168.5	0	0	0	0	0	115.5
444	T	46.2	Very low	42.2	Very low	138 Å²	138	125 Å²	125	85%	0.847	80%	0.797	S	S	*	*			trans	76.2	147.3	158.6	8.5	0	0	0	0	120.3
445	Q	39.9	Very low	41.8	Very low	142 Å²	142	128.4 Å²	128.4	66%	0.664	80%	0.8	S	S	*	*			trans	66.9	75.6	158	-59.6	-70.6	3.5	0	0	118.8
446	L	40.9	Very low	41.6	Very low	167 Å²	167	127.8 Å²	127.8	87%	0.874	80%	0.795	S	S	*	*			trans	-139	59.2	164.1	-132.1	164.7	0	0	0	113.1
447	S	42.7	Very low	41.3	Very low	105 Å²	105	134.7 Å²	134.7	73%	0.734	80%	0.802	S	S	*	*	S	Bend	trans	-137.9	-6.2	-179.3	57.6	0	0	0	0	116.1
448	I	46.1	Very low	41	Very low	124 Å²	124	138.7 Å²	138.7	64%	0.636	81%	0.811	S	S	*	*	S	Bend	trans	-104.8	-22.2	-169	-60	179.2	0	0	0	113.6	S450	I448-S450 PolarHBondContact O-N 2.86Å
449	L	42.7	Very low	40.7	Very low	167 Å²	167	139.1 Å²	139.1	87%	0.874	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	3.2	-165.3	-103.3	165.5	0	0	0	117.3
450	S	45.3	Very low	40.6	Very low	117 Å²	117	139.1 Å²	139.1	82%	0.818	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	1.5	-177.8	-161.3	0	0	0	0	114.7	I448	I448-S450 PolarHBondContact O-N 2.86Å
451	K	41.4	Very low	40.5	Very low	199 Å²	199	140.8 Å²	140.8	87%	0.865	82%	0.818	S	S	*	*	S	Bend	trans	-122.1	5.4	-167.2	-114.8	-179.7	179.9	-178.7	0	117.3
452	S	37	Very low	40.6	Very low	116 Å²	116	138.8 Å²	138.8	81%	0.811	81%	0.814	S	S	*	*	S	Bend	trans	-122.9	21.7	-165.8	-151.2	0	0	0	0	116.2
453	S	41.9	Very low	41.3	Very low	112 Å²	112	139.5 Å²	139.5	78%	0.783	81%	0.812	S	S	*	*	S	Bend	trans	-109.9	3.8	-174.6	54.5	0	0	0	0	115.6
454	S	44.3	Very low	41.6	Very low	115 Å²	115	143.1 Å²	143.1	80%	0.804	82%	0.815	S	S	*	*	S	Bend	trans	-102.6	-1.4	-164.3	-51.3	0	0	0	0	116.5
455	Q	41	Very low	41.5	Very low	188 Å²	188	143.6 Å²	143.6	88%	0.879	81%	0.812	S	S	*	*	S	Bend	trans	-125.2	12.8	-159.6	-145.9	172	4.4	0	0	116.1
456	I	37.7	Very low	41.6	Very low	163 Å²	163	144.5 Å²	144.5	84%	0.836	82%	0.821	S	S	*	*			trans	-126.1	85.1	-179.3	-51.3	179.1	0	0	0	111
457	R	37.2	Very low	42	Very low	234 Å²	234	140.6 Å²	140.6	88%	0.883	81%	0.813	S	S	*	*			trans	172.3	94.2	150.7	-99.9	173	-170.2	-166.9	3.6	111.8
458	M	37.9	Very low	42.1	Very low	192 Å²	192	146 Å²	146	95%	0.946	84%	0.842	S	S	*	*			trans	172.7	90.3	132.9	-97.8	-176.5	-70.5	0	0	110.2
459	S	39.4	Very low	41.9	Very low	125 Å²	125	147.1 Å²	147.1	87%	0.874	85%	0.852	S	S	*	*			trans	-151.2	100	167.2	41.4	0	0	0	0	107.5
460	G	37.2	Very low	41.8	Very low	74 Å²	74	146 Å²	146	76%	0.763	85%	0.851	S	S	*	*			trans	-110.9	116.6	-177.4	0	0	0	0	0	111.3
461	L	41.8	Very low	41.7	Very low	165 Å²	165	147.6 Å²	147.6	86%	0.864	85%	0.852	S	S	*	*			trans	30.1	104.1	151.4	-69	158	0	0	0	118
462	P	39.3	Very low	41.7	Very low	120 Å²	120	144.6 Å²	144.6	78%	0.779	85%	0.852	S	S	*	*			trans	-69.1	147.5	137.9	33.6	-31.8	0	0	0	109.2
463	A	51	Low	42	Very low	99 Å²	99	146.4 Å²	146.4	82%	0.818	85%	0.854	S	S	*	*			trans	-126	96.2	176.9	0	0	0	0	0	110
464	D	42.6	Very low	42	Very low	143 Å²	143	148.7 Å²	148.7	77%	0.765	86%	0.859	S	S	*	*			trans	-80.7	131.8	164.2	-66	-56.1	0	0	0	109.5
465	N	43.7	Very low	41.8	Very low	148 Å²	148	151.1 Å²	151.1	79%	0.791	86%	0.863	S	S	*	*			trans	167.6	142.4	130	-93.2	-65.5	0	0	0	113.1
466	L	43	Very low	41.9	Very low	161 Å²	161	148.2 Å²	148.2	84%	0.843	86%	0.862	S	S	*	*			trans	45.8	110.2	153.9	-93	60.6	0	0	0	119.7
467	A	48.1	Very low	42.2	Very low	85 Å²	85	147 Å²	147	70%	0.702	86%	0.864	S	S	*	*				159.2	134.2	91	0	0	0	0	0	112.3
468	T	45.3	Very low	42.7	Very low	218 Å²	218	139.1 Å²	139.1	100%	1.337	86%	0.862	S	S	*	*			trans	49	0	170.5	52.4	0	0	0	0	117.7

Retrieved 468 of 468 residues in 171 ms (Link to these results)

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