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Exocyst complex component SEC10b

Component of the exocyst complex involved in the docking of exocytic vesicles with fusion sites on the plasma membrane during regulated or polarized secretion. Involved in polarized cell growth and organ morphogenesis. During cytokinesis, involved in cell plate initiation, cell plate maturation and formation of new primary cell wall.

AlphaFold DB , UniProt , Accession X5JB51, Species ARATH (Arabidopsis thaliana, Mouse-ear cress), Gene SEC10b, Length 829 aa.

						>SECAB_ARATH|X5JB51|SEC10b
MTERIRARGPRSSSVNSVPLILDIEDFKGDFSFDALFGNLVNDLLPSFLDEEADSGDGHGNIAGVDGLTNGHLRGQSAPLSSAPFFPEVDGLLSLFKDACKELVDLRKQVDGRLNTLKKEVSTQDSKHRKTLTEIEKGVDGLFESFARLDGRISSVGQTAAKIGDHLQSADAQRETASQTIDLIKYLMEFNGSPGDLMELSALFSDDSRVAEAASIAQKLRSFAEEDIGRQGASTAAGNATPGRGLEVAVANLQDYCNELENRLLSRFDAASQRRDLSTMSECAKILSQFNRGTSAMQHYVATRPMFIDVEVMNSDIRLVLGDHGSQPSPSNVARGLSALFKEITDTVRKEAATITAVFPTPNEVMAILVQRVLEQRVTGILDKILAKPSLMSPPPVQEGGLLLYLRMLAVAYERTQELAKDLRAVGCGDLDVEDLTESLFSSHKDEYPEHERASLKQLYQAKMEELRAESQQVSESSGTIGRSKGASISSSLQQISVTFVTEFVRWNEEAITRCTLFSSQPATLAANVKAIFTCLLDQVSVYITEGLERARDSLSEAAALRERFVLGTSVSRRVAAAAASAAEAAAAAGESSFKSFMVAVQRCGSSVAIVQQYFANSISRLLLPVDGAHAASCEEMSTALSKAEAAAYKGLQQCIETVMAEVDRLLSSEQKSTDYRSPDDGIASDHRPTNACIRVVAYLSRVLESAFTALEGLNKQAFLTELGNRLEKLLLTHWQKFTFNPSGGLRLKRDLNEYVGFVKSFGAPSVDEKFELLGIIANVFIVAPDSLPTLFEGSPSIRKDAQRFIQLREDYKSAKLATKLSSLWPSLS
					

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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	34	Very low	29.4	Very low	242 Å²	242	180.4 Å²	180.4	100%	1.192	88%	0.88	S	S	*	*				0	100.2	0	-128.1	174.2	-175.7	0	0	107.3
2	T	34.2	Very low	29.2	Very low	126 Å²	126	175.1 Å²	175.1	77%	0.773	88%	0.875	S	S	*	*			trans	20.6	111.9	166.8	43.8	0	0	0	0	119.7	R4	T2-R4 PolarHBondContact O-N 3.3Å
3	E	30.5	Very low	28.8	Very low	188 Å²	188	170.2 Å²	170.2	88%	0.879	87%	0.867	S	S	*	*			trans	-46.9	125.9	150	-70.7	174.6	141	0	0	110.8
4	R	32.2	Very low	28.5	Very low	224 Å²	224	166.2 Å²	166.2	85%	0.845	86%	0.863	S	S	*	*			trans	-108	92.2	168.8	-83.8	-175.7	172.4	178.2	-1.3	108.9	T2 R6	T2-R4 PolarHBondContact O-N 3.3Å; R4-R6 PolarHBondContact O-N 3.5Å
5	I	29.6	Very low	28.4	Very low	164 Å²	164	163.3 Å²	163.3	84%	0.841	86%	0.855	S	S	*	*			trans	-66.3	107.5	158.9	-63.3	171.8	0	0	0	106.6
6	R	30.7	Very low	28.4	Very low	233 Å²	233	163.5 Å²	163.5	88%	0.879	86%	0.857	S	S	*	*			trans	-99.3	112.6	174.3	-129.8	-179.9	-174.2	179.8	0.1	109	R4	R4-R6 PolarHBondContact O-N 3.5Å
7	A	27.8	Very low	28.4	Very low	93 Å²	93	160.2 Å²	160.2	77%	0.769	85%	0.851	S	S	*	*			trans	-63.8	146.4	178.6	0	0	0	0	0	113.3
8	R	23.9	Very low	29	Very low	257 Å²	257	157.3 Å²	157.3	97%	0.97	84%	0.84	S	S	*	*			trans	-56	129.5	167.4	-87.8	174.9	162	171.5	-5	111.4
9	G	26.2	Very low	29.9	Very low	67 Å²	67	154.6 Å²	154.6	69%	0.691	83%	0.832	S	S	*	*			trans	-111.7	164.5	164.5	0	0	0	0	0	111.7
10	P	30.3	Very low	30.9	Very low	136 Å²	136	154 Å²	154	88%	0.883	83%	0.828	S	S	*	*			trans	-94.3	159.2	-148.7	36	-34.9	0	0	0	116.2
11	R	24	Very low	32.5	Very low	254 Å²	254	148.5 Å²	148.5	96%	0.958	80%	0.797	S	S	*	*			trans	-39.6	122.3	176.9	-65.2	171.8	172	176	-4.3	115
12	S	27.1	Very low	34.4	Very low	117 Å²	117	137.4 Å²	137.4	82%	0.818	74%	0.743	S	S	*	*			trans	-98.1	118.1	154	61	0	0	0	0	109.7
13	S	23.8	Very low	36.3	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	73%	0.729	S	S	*	*			trans	-72	122.5	165.2	41	0	0	0	0	110.3
14	S	24.6	Very low	38.4	Very low	115 Å²	115	128.1 Å²	128.1	80%	0.804	69%	0.694	S	S	*	*			trans	174.9	130.8	140.4	-74.3	0	0	0	0	112.3
15	V	27.3	Very low	40.4	Very low	123 Å²	123	122.4 Å²	122.4	75%	0.745	68%	0.677	S	S	*	*	S	Bend	trans	86.6	94.3	157	-158.5	0	0	0	0	119.4	S17	V15-S17 PolarHBondContact O-N 3.03Å
16	N	28.1	Very low	42.5	Very low	166 Å²	166	118.2 Å²	118.2	89%	0.888	66%	0.657	S	S	*	*			trans	38.2	39.8	138.3	-68.1	1.2	0	0	0	120.4	V18	N16-V18 PolarHBondContact O-N 2.82Å
17	S	29	Very low	44.7	Very low	108 Å²	108	111 Å²	111	76%	0.755	63%	0.632	S	S	*	*			trans	-85.9	107.3	164.6	53.1	0	0	0	0	109.4	V15	V15-S17 PolarHBondContact O-N 3.03Å
18	V	38.4	Very low	46.8	Very low	107 Å²	107	112.4 Å²	112.4	65%	0.648	62%	0.62	S	S	*	*			trans	-45.7	137.3	155	179.5	0	0	0	0	107.2	N16 L20	N16-V18 PolarHBondContact O-N 2.82Å; V18-L20 PolarHBondContact O-N 3.2Å
19	P	47.1	Very low	49.2	Very low	106 Å²	106	103.6 Å²	103.6	69%	0.688	61%	0.61	S	S	*	*			trans	-54.1	130.7	-176.7	-18.6	29.8	0	0	0	109.2	I21	P19-I21 PolarHBondContact O-N 2.93Å; P19-I21 VanDerWaalsContact O-N 3.16Å
20	L	50.1	Low	51.2	Low	143 Å²	143	108.6 Å²	108.6	75%	0.749	62%	0.621	S	S	*	*			trans	-50.8	123.2	169	-85	146.9	0	0	0	107.6	V18	V18-L20 PolarHBondContact O-N 3.2Å
21	I	64.1	Low	53.5	Low	38 Å²	38	107 Å²	107	20%	0.195	60%	0.6	C	S	.	*	S	Bend	trans	-79.5	-31.9	-177.5	-63	170.1	0	0	0	109.7	P19 L40 L95 D98 A99 E102	P19-I21 PolarHBondContact O-N 2.93Å; P19-I21 VanDerWaalsContact O-N 3.16Å; I21-L40 HydrophobicContact CB-CD1 4.48Å; I21-L40 HydrophobicContact CG2-CD1 3.01Å; I21-L40 HydrophobicContact CG2-CG 4.47Å; I21-L95 HydrophobicContact CD1-CD1 3.6Å; I21-L95 HydrophobicContact CD1-CG 4.45Å; I21-L95 HydrophobicContact CG1-CD1 4.13Å; I21-L95 HydrophobicContact CG2-CD1 4.43Å; I21-D98 HydrophobicContact CD1-CB 3.49Å; I21-D98 VanDerWaalsContact CD1-CB 3.49Å; I21-A99 HydrophobicContact CG2-CB 4.1Å; I21-E102 WeakPolarHBondContact CA-OE2 3.48Å; I21-E102 WeakPolarHBondContact CB-OE2 3.37Å; I21-E102 PolarHBondContact N-OE1 3.2Å; I21-E102 PolarHBondContact N-OE2 3.43Å
22	L	72.6	Confident	56.1	Low	10 Å²	10	97.5 Å²	97.5	5%	0.052	57%	0.573	C	S	.	*			trans	-137.1	127.7	-175.5	-60.7	171.1	0	0	0	111.8	L36 A99 E102 L103 L106	L22-L36 HydrophobicContact CD2-CD1 3.75Å; L22-L36 HydrophobicContact CD2-CD2 4.15Å; L22-L36 HydrophobicContact CD2-CG 4.09Å; L22-A99 HydrophobicContact CD1-CB 4.13Å; L22-E102 PolarHBondContact N-OE2 2.87Å; L22-L103 HydrophobicContact CD1-CD1 4.11Å; L22-L103 HydrophobicContact CD1-CD2 3.9Å; L22-L103 HydrophobicContact CD1-CG 3.57Å; L22-L106 HydrophobicContact CB-CD1 4.15Å
23	D	75.9	Confident	58.5	Low	89 Å²	89	97.9 Å²	97.9	48%	0.476	56%	0.56	S	S	.	*			trans	-108.7	157	172.3	-162.4	-11.4	0	0	0	110.8	E25 D26 F27	D23-E25 PolarHBondContact O-N 3.18Å; D23-D26 PolarHBondContact N-OD2 3.48Å; D23-D26 WeakPolarHBondContact O-CB 3.49Å; D23-D26 PolarHBondContact O-N 3.45Å; D23-F27 WeakPolarHBondContact O-CD2 3.45Å
24	I	74.4	Confident	61.1	Low	29 Å²	29	98.6 Å²	98.6	15%	0.149	56%	0.555	C	S	.	*	G	3₁₀ helix	trans	-62.7	-25	176.3	-151.4	165.5	0	0	0	112.3	D26 F27 L106 V110	I24-D26 VanDerWaalsContact C-N 3.26Å; I24-D26 PolarHBondContact O-N 3.22Å; I24-F27 PolarHBondContact O-N 3.08Å; I24-L106 HydrophobicContact CB-CD2 3.87Å; I24-L106 HydrophobicContact CG1-CD2 4.26Å; I24-V110 HydrophobicContact CD1-CG2 3.73Å; I24-V110 HydrophobicContact CG1-CG2 4.45Å
25	E	74.6	Confident	63.6	Low	104 Å²	104	95.7 Å²	95.7	49%	0.486	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-67.1	-27.2	175.2	-58.5	-59.3	141	0	0	111.9	D23 F27 K28	D23-E25 PolarHBondContact O-N 3.18Å; E25-F27 PolarHBondContact O-N 3.13Å; E25-F27 VanDerWaalsContact O-N 3.15Å; E25-K28 PolarHBondContact O-N 2.99Å; E25-K28 VanDerWaalsContact O-N 3.08Å; E25-K28 WeakPolarHBondContact OE1-CE 3.34Å; E25-K28 IonicContact OE1-NZ 2.85Å; E25-K28 PolarHBondContact OE1-NZ 3.42Å; E25-K28 VanDerWaalsContact OE2-CD 3.3Å; E25-K28 WeakPolarHBondContact OE2-CD 3.44Å; E25-K28 WeakPolarHBondContact OE2-CE 3.39Å; E25-K28 IonicContact OE2-NZ 2.82Å; E25-K28 PolarHBondContact OE2-NZ 3.04Å
26	D	72	Confident	66.1	Low	77 Å²	77	91.4 Å²	91.4	41%	0.412	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-65.4	-18.4	176.6	-58.5	-33.9	0	0	0	112.2	D23 I24 L36	D23-D26 PolarHBondContact N-OD2 3.48Å; D23-D26 WeakPolarHBondContact O-CB 3.49Å; D23-D26 PolarHBondContact O-N 3.45Å; I24-D26 VanDerWaalsContact C-N 3.26Å; I24-D26 PolarHBondContact O-N 3.22Å; D26-L36 HydrophobicContact CB-CD1 4.1Å
27	F	77.9	Confident	68.6	Low	80 Å²	80	87.5 Å²	87.5	35%	0.351	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-103.2	9.8	178.6	-59.5	-83	0	0	0	113.3	D23 I24 E25 F31 L103 L106	D23-F27 WeakPolarHBondContact O-CD2 3.45Å; I24-F27 PolarHBondContact O-N 3.08Å; E25-F27 PolarHBondContact O-N 3.13Å; E25-F27 VanDerWaalsContact O-N 3.15Å; F27-F31 AromaticContact CD1-CD2 3.91Å; F27-F31 HydrophobicContact CD1-CD2 3.91Å; F27-F31 AromaticContact CD1-CE2 3.79Å; F27-F31 HydrophobicContact CD1-CE2 3.79Å; F27-F31 HydrophobicContact CE1-CD2 4.26Å; F27-F31 AromaticContact CE1-CE2 3.66Å; F27-F31 HydrophobicContact CE1-CE2 3.66Å; F27-F31 HydrophobicContact CE1-CZ 4.31Å; F27-L103 HydrophobicContact CE1-CD2 4.18Å; F27-L103 HydrophobicContact CE2-CD2 4.2Å; F27-L103 HydrophobicContact CZ-CD2 3.49Å; F27-L103 VanDerWaalsContact CZ-CD2 3.49Å; F27-L106 HydrophobicContact CD2-CD1 4.45Å; F27-L106 HydrophobicContact CE2-CD1 3.92Å
28	K	71.6	Confident	70.9	Confident	123 Å²	123	83.2 Å²	83.2	54%	0.535	46%	0.459	S	S	.	.	S	Bend	trans	-99.5	138.1	176.9	-68.4	-167.3	-164.2	161.9	0	111.5	E25	E25-K28 PolarHBondContact O-N 2.99Å; E25-K28 VanDerWaalsContact O-N 3.08Å; E25-K28 WeakPolarHBondContact OE1-CE 3.34Å; E25-K28 IonicContact OE1-NZ 2.85Å; E25-K28 PolarHBondContact OE1-NZ 3.42Å; E25-K28 VanDerWaalsContact OE2-CD 3.3Å; E25-K28 WeakPolarHBondContact OE2-CD 3.44Å; E25-K28 WeakPolarHBondContact OE2-CE 3.39Å; E25-K28 IonicContact OE2-NZ 2.82Å; E25-K28 PolarHBondContact OE2-NZ 3.04Å
29	G	73.7	Confident	72.7	Confident	72 Å²	72	84.3 Å²	84.3	74%	0.742	46%	0.461	S	S	*	.	S	Bend	trans	85.1	-143.4	-179.6	0	0	0	0	0	112.1	F31	G29-F31 PolarHBondContact O-N 3.25Å
30	D	69.6	Low	74.2	Confident	173 Å²	173	80.6 Å²	80.6	93%	0.925	44%	0.435	S	S	*	.	S	Bend	trans	-81.5	92.9	-179.9	-64.8	-28.5	0	0	0	110.1
31	F	77.4	Confident	75.6	Confident	101 Å²	101	74 Å²	74	44%	0.443	40%	0.401	S	S	.	.			trans	-70.1	130	178.7	172.2	-97.5	0	0	0	111.9	F27 G29 F33 L36	F27-F31 AromaticContact CD1-CD2 3.91Å; F27-F31 HydrophobicContact CD1-CD2 3.91Å; F27-F31 AromaticContact CD1-CE2 3.79Å; F27-F31 HydrophobicContact CD1-CE2 3.79Å; F27-F31 HydrophobicContact CE1-CD2 4.26Å; F27-F31 AromaticContact CE1-CE2 3.66Å; F27-F31 HydrophobicContact CE1-CE2 3.66Å; F27-F31 HydrophobicContact CE1-CZ 4.31Å; G29-F31 PolarHBondContact O-N 3.25Å; F31-F33 HydrophobicContact CE1-CB 4.28Å; F31-F33 HydrophobicContact CZ-CB 4.48Å; F31-L36 HydrophobicContact CE2-CB 4.47Å; F31-L36 HydrophobicContact CE2-CD1 4.32Å; F31-L36 HydrophobicContact CE2-CD2 4.2Å; F31-L36 HydrophobicContact CZ-CD2 4.35Å
32	S	79.1	Confident	76	Confident	55 Å²	55	74.9 Å²	74.9	39%	0.385	41%	0.406	S	S	.	.			trans	-121.9	123.3	170.6	172.2	0	0	0	0	110.7	A35 L36	S32-A35 PolarHBondContact OG-N 3.17Å; S32-L36 PolarHBondContact O-N 3.47Å; S32-L36 VanDerWaalsContact O-N 3.17Å
33	F	78.2	Confident	75.9	Confident	126 Å²	126	81.8 Å²	81.8	55%	0.553	44%	0.443	S	S	*	.	H	α-helix	trans	-65.3	-41.1	176.5	177.8	-95.4	0	0	0	111.7	F31 A35 L36 F37	F31-F33 HydrophobicContact CE1-CB 4.28Å; F31-F33 HydrophobicContact CZ-CB 4.48Å; F33-A35 VanDerWaalsContact C-N 3.34Å; F33-A35 PolarHBondContact O-N 3.24Å; F33-L36 WeakPolarHBondContact O-CB 3.4Å; F33-L36 PolarHBondContact O-N 3.04Å; F33-F37 HydrophobicContact CE1-CB 4.17Å; F33-F37 HydrophobicContact CE1-CG 4.47Å; F33-F37 HydrophobicContact CZ-CB 4.4Å; F33-F37 HydrophobicContact CZ-CD2 4.31Å; F33-F37 VanDerWaalsContact O-CB 3.31Å; F33-F37 WeakPolarHBondContact O-CB 3.36Å; F33-F37 PolarHBondContact O-N 3.5Å
34	D	77.2	Confident	75.6	Confident	126 Å²	126	80.1 Å²	80.1	67%	0.674	43%	0.434	S	S	*	.	H	α-helix	trans	-65.2	-39.9	-177.7	-59.9	-38.2	0	0	0	111.2	F37 G38	D34-F37 PolarHBondContact O-N 3.1Å; D34-G38 PolarHBondContact O-N 3.48Å
35	A	78	Confident	75.4	Confident	54 Å²	54	79.7 Å²	79.7	45%	0.446	43%	0.432	S	S	.	.	H	α-helix	trans	-65.8	-42.6	175.3	0	0	0	0	0	111.9	S32 F33 N39	S32-A35 PolarHBondContact OG-N 3.17Å; F33-A35 VanDerWaalsContact C-N 3.34Å; F33-A35 PolarHBondContact O-N 3.24Å; A35-N39 WeakPolarHBondContact O-CB 3.49Å; A35-N39 PolarHBondContact O-N 3.48Å; A35-N39 PolarHBondContact O-ND2 2.82Å
36	L	79.7	Confident	74.6	Confident	32 Å²	32	78.7 Å²	78.7	17%	0.168	43%	0.434	C	S	.	.	H	α-helix	trans	-62.3	-48.1	175.9	-168.6	92.6	0	0	0	111.1	L22 D26 F31 S32 F33 N39 L40	L22-L36 HydrophobicContact CD2-CD1 3.75Å; L22-L36 HydrophobicContact CD2-CD2 4.15Å; L22-L36 HydrophobicContact CD2-CG 4.09Å; D26-L36 HydrophobicContact CB-CD1 4.1Å; F31-L36 HydrophobicContact CE2-CB 4.47Å; F31-L36 HydrophobicContact CE2-CD1 4.32Å; F31-L36 HydrophobicContact CE2-CD2 4.2Å; F31-L36 HydrophobicContact CZ-CD2 4.35Å; S32-L36 PolarHBondContact O-N 3.47Å; S32-L36 VanDerWaalsContact O-N 3.17Å; F33-L36 WeakPolarHBondContact O-CB 3.4Å; F33-L36 PolarHBondContact O-N 3.04Å; L36-N39 PolarHBondContact O-N 2.74Å; L36-L40 VanDerWaalsContact O-CB 3.28Å; L36-L40 WeakPolarHBondContact O-CB 3.39Å; L36-L40 PolarHBondContact O-N 3.21Å
37	F	80.9	Confident	73.8	Confident	84 Å²	84	78.6 Å²	78.6	37%	0.368	44%	0.44	S	S	.	.	H	α-helix	trans	-66.1	-43.2	-179	-177.9	-93.9	0	0	0	111.9	F33 D34 L40 V41 F96	F33-F37 HydrophobicContact CE1-CB 4.17Å; F33-F37 HydrophobicContact CE1-CG 4.47Å; F33-F37 HydrophobicContact CZ-CB 4.4Å; F33-F37 HydrophobicContact CZ-CD2 4.31Å; F33-F37 VanDerWaalsContact O-CB 3.31Å; F33-F37 WeakPolarHBondContact O-CB 3.36Å; F33-F37 PolarHBondContact O-N 3.5Å; D34-F37 PolarHBondContact O-N 3.1Å; F37-L40 WeakPolarHBondContact O-CB 3.28Å; F37-L40 PolarHBondContact O-N 3.44Å; F37-V41 HydrophobicContact CD1-CG2 4.48Å; F37-V41 HydrophobicContact CD2-CG2 4.27Å; F37-V41 HydrophobicContact CE1-CB 4.46Å; F37-V41 HydrophobicContact CE1-CG2 4.1Å; F37-V41 HydrophobicContact CE2-CG2 3.88Å; F37-V41 HydrophobicContact CZ-CG2 3.78Å; F37-V41 PolarHBondContact O-N 3.35Å; F37-F96 HydrophobicContact CD2-CE1 4.37Å; F37-F96 AromaticContact CE2-CE1 3.8Å; F37-F96 HydrophobicContact CE2-CE1 3.8Å; F37-F96 AromaticContact CE2-CZ 3.69Å; F37-F96 HydrophobicContact CE2-CZ 3.69Å; F37-F96 HydrophobicContact CZ-CZ 4.21Å
38	G	75.9	Confident	72.4	Confident	19 Å²	19	80.9 Å²	80.9	20%	0.196	45%	0.45	C	S	.	.	H	α-helix	trans	-57.9	-53.5	174.2	0	0	0	0	0	111.3	D34 L40 V41 N42	D34-G38 PolarHBondContact O-N 3.48Å; G38-L40 PolarHBondContact O-N 2.68Å; G38-V41 PolarHBondContact O-N 3.44Å; G38-N42 VanDerWaalsContact O-CB 3.29Å; G38-N42 WeakPolarHBondContact O-CB 3.47Å; G38-N42 PolarHBondContact O-N 3.08Å; G38-N42 PolarHBondContact O-ND2 2.72Å; G38-N42 VanDerWaalsContact O-ND2 3.12Å; G38-N42 PolarHBondContact O-OD1 3.32Å
39	N	77	Confident	71.3	Confident	129 Å²	129	79.8 Å²	79.8	69%	0.69	45%	0.449	S	S	*	.	H	α-helix	trans	-57.8	-34.3	177.6	-72.3	-21.7	0	0	0	113.1	A35 L36	A35-N39 WeakPolarHBondContact O-CB 3.49Å; A35-N39 PolarHBondContact O-N 3.48Å; A35-N39 PolarHBondContact O-ND2 2.82Å; L36-N39 PolarHBondContact O-N 2.74Å
40	L	77.7	Confident	70.1	Confident	28 Å²	28	82.2 Å²	82.2	15%	0.147	45%	0.445	C	S	.	.	H	α-helix	trans	-67.7	-47	178.4	-179.4	62	0	0	0	111.7	I21 L36 F37 G38 L95 F96 A99	I21-L40 HydrophobicContact CB-CD1 4.48Å; I21-L40 HydrophobicContact CG2-CD1 3.01Å; I21-L40 HydrophobicContact CG2-CG 4.47Å; L36-L40 VanDerWaalsContact O-CB 3.28Å; L36-L40 WeakPolarHBondContact O-CB 3.39Å; L36-L40 PolarHBondContact O-N 3.21Å; F37-L40 WeakPolarHBondContact O-CB 3.28Å; F37-L40 PolarHBondContact O-N 3.44Å; G38-L40 PolarHBondContact O-N 2.68Å; L40-L95 HydrophobicContact CD1-CD1 3.9Å; L40-L95 HydrophobicContact CD1-CD2 3.72Å; L40-L95 HydrophobicContact CD1-CG 3.74Å; L40-L95 HydrophobicContact CG-CD2 3.76Å; L40-L95 HydrophobicContact CG-CG 4.23Å; L40-L95 WeakPolarHBondContact O-CD2 3.19Å; L40-F96 HydrophobicContact CD2-CD1 4Å; L40-F96 HydrophobicContact CD2-CE1 3.83Å; L40-A99 HydrophobicContact CD1-CB 4.4Å; L40-A99 HydrophobicContact CD2-CB 4.32Å
41	V	79.8	Confident	69	Low	5 Å²	5	82.2 Å²	82.2	3%	0.03	44%	0.44	C	S	.	.	H	α-helix	trans	-96.5	-22.6	-165	174.2	0	0	0	0	113.9	F37 G38 D43 L44 L45 L92 F96	F37-V41 HydrophobicContact CD1-CG2 4.48Å; F37-V41 HydrophobicContact CD2-CG2 4.27Å; F37-V41 HydrophobicContact CE1-CB 4.46Å; F37-V41 HydrophobicContact CE1-CG2 4.1Å; F37-V41 HydrophobicContact CE2-CG2 3.88Å; F37-V41 HydrophobicContact CZ-CG2 3.78Å; F37-V41 PolarHBondContact O-N 3.35Å; G38-V41 PolarHBondContact O-N 3.44Å; V41-D43 PolarHBondContact O-N 2.86Å; V41-L44 PolarHBondContact O-N 3.36Å; V41-L45 HydrophobicContact CG1-CB 3.99Å; V41-L45 HydrophobicContact CG1-CD1 3.43Å; V41-L45 VanDerWaalsContact CG1-CD1 3.43Å; V41-L45 HydrophobicContact CG1-CG 3.75Å; V41-L45 PolarHBondContact O-N 2.79Å; V41-L92 HydrophobicContact CG1-CD2 3.76Å; V41-L92 HydrophobicContact CG2-CD2 4.17Å; V41-F96 HydrophobicContact CG2-CE1 4.03Å; V41-F96 HydrophobicContact CG2-CZ 3.81Å
42	N	72.7	Confident	67.1	Low	56 Å²	56	85.1 Å²	85.1	30%	0.299	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.4	-172.9	-78.2	-12.8	0	0	0	114.6	G38 L44	G38-N42 VanDerWaalsContact O-CB 3.29Å; G38-N42 WeakPolarHBondContact O-CB 3.47Å; G38-N42 PolarHBondContact O-N 3.08Å; G38-N42 PolarHBondContact O-ND2 2.72Å; G38-N42 VanDerWaalsContact O-ND2 3.12Å; G38-N42 PolarHBondContact O-OD1 3.32Å; N42-L44 VanDerWaalsContact C-N 3.31Å; N42-L44 PolarHBondContact O-N 2.81Å
43	D	70.1	Confident	65.3	Low	156 Å²	156	86 Å²	86	83%	0.834	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-25.1	178.4	-77.9	-8.6	0	0	0	113.4	V41	V41-D43 PolarHBondContact O-N 2.86Å
44	L	69.7	Low	63.2	Low	53 Å²	53	87.5 Å²	87.5	28%	0.277	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-21.6	-179.2	-72.3	170.3	0	0	0	113.3	V41 N42 L92 L95	V41-L44 PolarHBondContact O-N 3.36Å; N42-L44 VanDerWaalsContact C-N 3.31Å; N42-L44 PolarHBondContact O-N 2.81Å; L44-L92 HydrophobicContact CB-CD2 4.36Å; L44-L92 HydrophobicContact CB-CG 4.39Å; L44-L92 HydrophobicContact CD1-CD2 4.24Å; L44-L92 HydrophobicContact CD1-CG 4.24Å; L44-L95 HydrophobicContact CD1-CB 4.02Å; L44-L95 HydrophobicContact CD1-CD2 3.79Å; L44-L95 HydrophobicContact CD1-CG 4.45Å
45	L	71.3	Confident	61.1	Low	21 Å²	21	87 Å²	87	11%	0.11	49%	0.485	C	S	.	.			trans	-122.1	78.9	176	-66.1	-179.6	0	0	0	111.1	V41 S47 F48 F86 L92	V41-L45 HydrophobicContact CG1-CB 3.99Å; V41-L45 HydrophobicContact CG1-CD1 3.43Å; V41-L45 VanDerWaalsContact CG1-CD1 3.43Å; V41-L45 HydrophobicContact CG1-CG 3.75Å; V41-L45 PolarHBondContact O-N 2.79Å; L45-S47 PolarHBondContact O-N 3.15Å; L45-F48 HydrophobicContact CB-CD2 4.14Å; L45-F48 HydrophobicContact CD1-CD2 3.88Å; L45-F48 HydrophobicContact CD1-CE2 4.04Å; L45-F48 PolarHBondContact O-N 3.48Å; L45-F86 HydrophobicContact CD2-CE1 4.06Å; L45-F86 HydrophobicContact CD2-CZ 3.95Å; L45-L92 HydrophobicContact CD1-CD1 4.16Å; L45-L92 HydrophobicContact CD2-CD1 4.12Å; L45-L92 HydrophobicContact CG-CD1 4.16Å
46	P	57.2	Low	58.8	Low	83 Å²	83	87.5 Å²	87.5	54%	0.539	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.2	174.8	-19.7	30.8	0	0	0	112.8	F48 L49	P46-F48 PolarHBondContact O-N 3.35Å; P46-F48 VanDerWaalsContact O-N 3.13Å; P46-L49 WeakPolarHBondContact O-CB 3.12Å; P46-L49 PolarHBondContact O-N 3.09Å
47	S	54.4	Low	56.3	Low	75 Å²	75	94.4 Å²	94.4	52%	0.524	53%	0.533	S	S	.	.	H	α-helix	trans	-64.1	-16.8	-178.7	60.7	0	0	0	0	113.9	L45 L49	L45-S47 PolarHBondContact O-N 3.15Å; S47-L49 PolarHBondContact O-N 3.41Å
48	F	49.1	Very low	53.8	Low	128 Å²	128	94.1 Å²	94.1	56%	0.561	55%	0.553	S	S	*	*	H	α-helix	trans	-73.1	-15.2	171.6	-103.5	-87.7	0	0	0	113	L45 P46	L45-F48 HydrophobicContact CB-CD2 4.14Å; L45-F48 HydrophobicContact CD1-CD2 3.88Å; L45-F48 HydrophobicContact CD1-CE2 4.04Å; L45-F48 PolarHBondContact O-N 3.48Å; P46-F48 PolarHBondContact O-N 3.35Å; P46-F48 VanDerWaalsContact O-N 3.13Å
49	L	48.9	Very low	51.5	Low	100 Å²	100	103.1 Å²	103.1	52%	0.524	59%	0.59	S	S	.	*	H	α-helix	trans	-83.9	-28.6	174.3	-65.7	170.6	0	0	0	112.6	P46 S47	P46-L49 WeakPolarHBondContact O-CB 3.12Å; P46-L49 PolarHBondContact O-N 3.09Å; S47-L49 PolarHBondContact O-N 3.41Å
50	D	48.4	Very low	49.1	Very low	123 Å²	123	100.6 Å²	100.6	66%	0.658	59%	0.594	S	S	*	*	H	α-helix	trans	-75.9	-26.5	-175.4	-72.2	-31.4	0	0	0	112.7
51	E	45.4	Very low	46.5	Very low	172 Å²	172	107.3 Å²	107.3	80%	0.804	63%	0.63	S	S	*	*	H	α-helix	trans	-76.5	-20.6	178.5	-73.1	-167.2	158.3	0	0	113.7
52	E	38.3	Very low	44.1	Very low	162 Å²	162	115.1 Å²	115.1	76%	0.757	67%	0.67	S	S	*	*	H	α-helix	trans	-89.9	-20.1	176.6	-74.1	-166.9	160.8	0	0	113.6
53	A	40.8	Very low	41.9	Very low	74 Å²	74	117.2 Å²	117.2	61%	0.612	70%	0.695	S	S	*	*	H	α-helix	trans	-81.2	-18.8	-174.1	0	0	0	0	0	115	S55	A53-S55 PolarHBondContact O-N 3.35Å
54	D	33.8	Very low	39.8	Very low	158 Å²	158	113.2 Å²	113.2	85%	0.845	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	25.1	-170.7	-105.4	-3.3	0	0	0	115.2
55	S	34.6	Very low	37.9	Very low	115 Å²	115	117.7 Å²	117.7	80%	0.804	72%	0.721	S	S	*	*			trans	-105.7	59.5	169.3	55	0	0	0	0	112.1	A53	A53-S55 PolarHBondContact O-N 3.35Å
56	G	28.7	Very low	36	Very low	64 Å²	64	124.2 Å²	124.2	66%	0.66	76%	0.756	S	S	*	*	S	Bend	trans	-155.9	105.7	176.4	0	0	0	0	0	114.5
57	D	27.5	Very low	34.6	Very low	177 Å²	177	123.1 Å²	123.1	95%	0.947	76%	0.759	S	S	*	*			trans	26.8	118.1	153.5	-73.5	-25.3	0	0	0	120.5
58	G	28.5	Very low	33.4	Very low	78 Å²	78	128.3 Å²	128.3	80%	0.804	78%	0.78	S	S	*	*			trans	177.2	88.4	163.5	0	0	0	0	0	116.6	G60	G58-G60 PolarHBondContact O-N 2.89Å
59	H	27.1	Very low	32.4	Very low	208 Å²	208	128.3 Å²	128.3	96%	0.963	79%	0.791	S	S	*	*			trans	-57.4	127.3	164.6	-78	-68	0	0	0	112.7
60	G	26.8	Very low	31.6	Very low	76 Å²	76	131.8 Å²	131.8	78%	0.784	81%	0.81	S	S	*	*			trans	-175.7	102.4	169.7	0	0	0	0	0	113.8	G58 I62	G58-G60 PolarHBondContact O-N 2.89Å; G60-I62 PolarHBondContact O-N 3.11Å
61	N	24.3	Very low	30.7	Very low	169 Å²	169	129.2 Å²	129.2	90%	0.904	81%	0.813	S	S	*	*			trans	-52.3	124	169	-74.7	-30	0	0	0	112.2
62	I	28.5	Very low	29.8	Very low	169 Å²	169	130 Å²	130	87%	0.867	82%	0.816	S	S	*	*			trans	-144	127.4	139	-87.4	153.6	0	0	0	107.4	G60	G60-I62 PolarHBondContact O-N 3.11Å
63	A	26.9	Very low	29.4	Very low	100 Å²	100	130.3 Å²	130.3	83%	0.826	82%	0.822	S	S	*	*			trans	-69.4	137	173.8	0	0	0	0	0	111.7
64	G	26.2	Very low	28.7	Very low	73 Å²	73	139.1 Å²	139.1	75%	0.753	84%	0.839	S	S	*	*			trans	89.4	84.5	150.1	0	0	0	0	0	116.7
65	V	30.1	Very low	28.4	Very low	147 Å²	147	134.7 Å²	134.7	89%	0.891	83%	0.831	S	S	*	*				-147.1	120.7	129.1	177	0	0	0	0	106.4
66	D	29.8	Very low	28.2	Very low	158 Å²	158	138.1 Å²	138.1	85%	0.845	83%	0.834	S	S	*	*			trans	-50.7	137	178.4	-81.5	-52	0	0	0	111.9	L68	D66-L68 PolarHBondContact O-N 2.98Å
67	G	29.4	Very low	28.2	Very low	59 Å²	59	141.1 Å²	141.1	61%	0.608	85%	0.845	S	S	*	*			trans	-50.2	135.6	175.4	0	0	0	0	0	111.4	T69	G67-T69 PolarHBondContact O-N 2.78Å
68	L	28.7	Very low	28.5	Very low	184 Å²	184	136.9 Å²	136.9	96%	0.963	84%	0.835	S	S	*	*			trans	-52.5	91.1	162.1	-70.3	159.3	0	0	0	108.1	D66 N70	D66-L68 PolarHBondContact O-N 2.98Å; L68-N70 PolarHBondContact O-N 2.72Å
69	T	28.2	Very low	29	Very low	129 Å²	129	139.3 Å²	139.3	79%	0.791	84%	0.836	S	S	*	*			trans	-71.3	118	166.7	45.9	0	0	0	0	106.6	G67 G71	G67-T69 PolarHBondContact O-N 2.78Å; T69-G71 PolarHBondContact O-N 2.72Å
70	N	31.2	Very low	29.3	Very low	173 Å²	173	137.6 Å²	137.6	93%	0.925	83%	0.833	S	S	*	*			trans	-53.9	101	172.6	-113.6	-14.5	0	0	0	108.9	L68 H72	L68-N70 PolarHBondContact O-N 2.72Å; N70-H72 PolarHBondContact O-N 2.78Å
71	G	29.2	Very low	30	Very low	69 Å²	69	139.3 Å²	139.3	71%	0.711	83%	0.833	S	S	*	*			trans	-73.6	92.5	-176.2	0	0	0	0	0	111.7	T69 L73	T69-G71 PolarHBondContact O-N 2.72Å; G71-L73 PolarHBondContact O-N 2.69Å
72	H	26.7	Very low	31	Very low	188 Å²	188	137 Å²	137	87%	0.87	83%	0.831	S	S	*	*			trans	-83.4	83.2	145.9	-93.3	-13.5	0	0	0	109.1	N70	N70-H72 PolarHBondContact O-N 2.78Å
73	L	30.6	Very low	31.9	Very low	169 Å²	169	132.5 Å²	132.5	89%	0.885	82%	0.818	S	S	*	*			trans	-130	89.7	157.7	-78.1	177.3	0	0	0	110.3	G71 G75	G71-L73 PolarHBondContact O-N 2.69Å; L73-G75 PolarHBondContact O-N 3.09Å
74	R	25.9	Very low	33	Very low	259 Å²	259	132.3 Å²	132.3	98%	0.977	81%	0.808	S	S	*	*			trans	-61.2	102.5	160.9	-178.7	177.3	161.5	175.6	-4.2	108.7
75	G	27.1	Very low	34.7	Very low	65 Å²	65	139 Å²	139	67%	0.67	82%	0.817	S	S	*	*			trans	179.4	111	172.1	0	0	0	0	0	114.4	L73	L73-G75 PolarHBondContact O-N 3.09Å
76	Q	30.4	Very low	36.6	Very low	186 Å²	186	137.1 Å²	137.1	87%	0.869	80%	0.797	S	S	*	*			trans	84.6	82.4	161.1	-55.1	-176.6	21.3	0	0	117.6	A78	Q76-A78 PolarHBondContact O-N 3.44Å
77	S	28.9	Very low	38.5	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	78%	0.783	S	S	*	*			trans	4.4	98.6	130.9	43.2	0	0	0	0	117.7
78	A	34.6	Very low	40.5	Very low	89 Å²	89	134.2 Å²	134.2	74%	0.736	77%	0.77	S	S	*	*			trans	-139.9	149.9	149	0	0	0	0	0	107.4	Q76	Q76-A78 PolarHBondContact O-N 3.44Å
79	P	38.2	Very low	42.9	Very low	129 Å²	129	128.9 Å²	128.9	84%	0.838	75%	0.745	S	S	*	*			trans	-74.2	134.9	-138.2	27.9	-33.9	0	0	0	114.2	S81	P79-S81 PolarHBondContact O-N 3.45Å; P79-S81 VanDerWaalsContact O-N 3.11Å
80	L	33.5	Very low	45.3	Very low	172 Å²	172	128.9 Å²	128.9	90%	0.901	74%	0.74	S	S	*	*			trans	-54	106.6	175	-71.1	135.8	0	0	0	111	S82	L80-S82 PolarHBondContact O-N 3.03Å
81	S	41.3	Very low	47.7	Very low	111 Å²	111	122 Å²	122	78%	0.776	71%	0.71	S	S	*	*			trans	-67.1	117.6	155.2	179.7	0	0	0	0	107.3	P79 A83	P79-S81 PolarHBondContact O-N 3.45Å; P79-S81 VanDerWaalsContact O-N 3.11Å; S81-A83 VanDerWaalsContact C-N 3.31Å; S81-A83 PolarHBondContact O-N 3.5Å
82	S	46.3	Very low	50.2	Low	122 Å²	122	119.7 Å²	119.7	85%	0.853	68%	0.681	S	S	*	*			trans	-66.7	83.9	178.1	53.9	0	0	0	0	110.8	L80	L80-S82 PolarHBondContact O-N 3.03Å
83	A	47.5	Very low	52.8	Low	73 Å²	73	114.8 Å²	114.8	60%	0.603	66%	0.661	S	S	*	*			trans	-118.7	127.1	161.7	0	0	0	0	0	107.7	S81	S81-A83 VanDerWaalsContact C-N 3.31Å; S81-A83 PolarHBondContact O-N 3.5Å
84	P	49.7	Very low	55.3	Low	96 Å²	96	109.8 Å²	109.8	62%	0.623	64%	0.64	S	S	*	*			trans	-63.1	141.5	179.8	24.3	-31	0	0	0	110.8	F86 P87	P84-F86 PolarHBondContact O-N 2.95Å; P84-F86 VanDerWaalsContact O-N 3.1Å; P84-P87 HydrophobicContact CG-CB 4.36Å
85	F	61.9	Low	58.1	Low	214 Å²	214	98.9 Å²	98.9	94%	0.939	60%	0.601	S	S	*	*	S	Bend	trans	-61	-16.8	-176.3	-90.2	-90.1	0	0	0	114.6
86	F	70.4	Confident	60.8	Low	107 Å²	107	99.3 Å²	99.3	47%	0.469	59%	0.585	S	S	.	*			trans	-156.3	83.1	180	-151.9	-82.7	0	0	0	109.2	L45 P84 E88 V89 L92	L45-F86 HydrophobicContact CD2-CE1 4.06Å; L45-F86 HydrophobicContact CD2-CZ 3.95Å; P84-F86 PolarHBondContact O-N 2.95Å; P84-F86 VanDerWaalsContact O-N 3.1Å; F86-E88 HydrophobicContact CD1-CB 4.06Å; F86-E88 WeakPolarHBondContact CD1-OE2 3.33Å; F86-E88 HydrophobicContact CE1-CB 3.91Å; F86-E88 PolarHBondContact O-N 2.8Å; F86-V89 HydrophobicContact CB-CG2 3.82Å; F86-V89 HydrophobicContact CD1-CB 4.48Å; F86-V89 HydrophobicContact CD1-CG2 3.41Å; F86-V89 VanDerWaalsContact CD1-CG2 3.41Å; F86-V89 HydrophobicContact CE1-CG2 4.31Å; F86-V89 HydrophobicContact CG-CG2 3.93Å; F86-V89 WeakPolarHBondContact O-CG2 3.3Å; F86-V89 PolarHBondContact O-N 3.46Å; F86-L92 HydrophobicContact CE1-CD1 4.46Å
87	P	68.3	Low	63.5	Low	84 Å²	84	96.6 Å²	96.6	55%	0.545	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	-18.3	-175.4	23.2	-30.5	0	0	0	113.9	P84	P84-P87 HydrophobicContact CG-CB 4.36Å
88	E	73.2	Confident	66.2	Low	73 Å²	73	93.5 Å²	93.5	34%	0.341	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-14.9	-177.2	-55.2	76.3	-168.1	0	0	113.5	F86 D90 G91 L92	F86-E88 HydrophobicContact CD1-CB 4.06Å; F86-E88 WeakPolarHBondContact CD1-OE2 3.33Å; F86-E88 HydrophobicContact CE1-CB 3.91Å; F86-E88 PolarHBondContact O-N 2.8Å; E88-D90 VanDerWaalsContact C-N 3.3Å; E88-D90 PolarHBondContact O-N 3.15Å; E88-G91 PolarHBondContact O-N 3.04Å; E88-G91 VanDerWaalsContact O-N 3.1Å; E88-L92 PolarHBondContact O-N 3.14Å
89	V	78.7	Confident	68.6	Low	72 Å²	72	89.6 Å²	89.6	44%	0.436	51%	0.511	S	S	.	.	H	α-helix	trans	-57.9	-43	-176.9	176.3	0	0	0	0	111.6	F86 G91 L92 L93	F86-V89 HydrophobicContact CB-CG2 3.82Å; F86-V89 HydrophobicContact CD1-CB 4.48Å; F86-V89 HydrophobicContact CD1-CG2 3.41Å; F86-V89 VanDerWaalsContact CD1-CG2 3.41Å; F86-V89 HydrophobicContact CE1-CG2 4.31Å; F86-V89 HydrophobicContact CG-CG2 3.93Å; F86-V89 WeakPolarHBondContact O-CG2 3.3Å; F86-V89 PolarHBondContact O-N 3.46Å; V89-G91 VanDerWaalsContact C-N 3.28Å; V89-G91 PolarHBondContact O-N 3.49Å; V89-L92 PolarHBondContact O-N 3.44Å; V89-L93 VanDerWaalsContact O-CB 3.31Å; V89-L93 WeakPolarHBondContact O-CB 3.49Å; V89-L93 PolarHBondContact O-N 2.89Å
90	D	78.7	Confident	70.9	Confident	128 Å²	128	87.2 Å²	87.2	68%	0.684	50%	0.496	S	S	*	.	H	α-helix	trans	-66.9	-34	-178.4	-72.2	-34.5	0	0	0	111.3	E88 S94	E88-D90 VanDerWaalsContact C-N 3.3Å; E88-D90 PolarHBondContact O-N 3.15Å; D90-S94 PolarHBondContact O-N 3.44Å; D90-S94 VanDerWaalsContact O-N 3.13Å
91	G	81.3	Confident	73.5	Confident	28 Å²	28	85.6 Å²	85.6	29%	0.289	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-49.4	173.1	0	0	0	0	0	112.1	E88 V89 L93 S94 L95	E88-G91 PolarHBondContact O-N 3.04Å; E88-G91 VanDerWaalsContact O-N 3.1Å; V89-G91 VanDerWaalsContact C-N 3.28Å; V89-G91 PolarHBondContact O-N 3.49Å; G91-L93 PolarHBondContact O-N 2.84Å; G91-S94 PolarHBondContact O-N 3.3Å; G91-L95 WeakPolarHBondContact O-CB 3.49Å; G91-L95 PolarHBondContact O-N 3.49Å
92	L	81.1	Confident	75.7	Confident	22 Å²	22	82.1 Å²	82.1	12%	0.115	45%	0.454	C	S	.	.	H	α-helix	trans	-61.4	-43.5	178.1	-80.9	163.6	0	0	0	112	V41 L44 L45 F86 E88 V89 S94 L95 F96	V41-L92 HydrophobicContact CG1-CD2 3.76Å; V41-L92 HydrophobicContact CG2-CD2 4.17Å; L44-L92 HydrophobicContact CB-CD2 4.36Å; L44-L92 HydrophobicContact CB-CG 4.39Å; L44-L92 HydrophobicContact CD1-CD2 4.24Å; L44-L92 HydrophobicContact CD1-CG 4.24Å; L45-L92 HydrophobicContact CD1-CD1 4.16Å; L45-L92 HydrophobicContact CD2-CD1 4.12Å; L45-L92 HydrophobicContact CG-CD1 4.16Å; F86-L92 HydrophobicContact CE1-CD1 4.46Å; E88-L92 PolarHBondContact O-N 3.14Å; V89-L92 PolarHBondContact O-N 3.44Å; L92-S94 VanDerWaalsContact C-N 3.32Å; L92-S94 PolarHBondContact O-N 2.74Å; L92-L95 PolarHBondContact O-N 2.86Å; L92-F96 HydrophobicContact CB-CD2 4.49Å; L92-F96 HydrophobicContact CB-CE2 4.27Å; L92-F96 HydrophobicContact CD2-CE2 4.02Å; L92-F96 HydrophobicContact CD2-CZ 4.24Å; L92-F96 WeakPolarHBondContact O-CD2 3.3Å; L92-F96 WeakPolarHBondContact O-CG 3.45Å; L92-F96 PolarHBondContact O-N 3.34Å
93	L	80.4	Confident	77.7	Confident	84 Å²	84	79.7 Å²	79.7	44%	0.44	43%	0.431	S	S	.	.	H	α-helix	trans	-63.9	-38.8	178.8	-177.1	64.7	0	0	0	111.7	V89 G91 K97	V89-L93 VanDerWaalsContact O-CB 3.31Å; V89-L93 WeakPolarHBondContact O-CB 3.49Å; V89-L93 PolarHBondContact O-N 2.89Å; G91-L93 PolarHBondContact O-N 2.84Å; L93-K97 HydrophobicContact CG-CD 4.42Å; L93-K97 WeakPolarHBondContact O-CB 3.03Å; L93-K97 VanDerWaalsContact O-CG 3.26Å; L93-K97 WeakPolarHBondContact O-CG 3.47Å; L93-K97 PolarHBondContact O-N 3.31Å
94	S	83.6	Confident	79.7	Confident	64 Å²	64	79.9 Å²	79.9	45%	0.448	42%	0.424	S	S	.	.	H	α-helix	trans	-64.2	-48.4	173.9	-165.8	0	0	0	0	110.8	D90 G91 L92 F96 K97 D98	D90-S94 PolarHBondContact O-N 3.44Å; D90-S94 VanDerWaalsContact O-N 3.13Å; G91-S94 PolarHBondContact O-N 3.3Å; L92-S94 VanDerWaalsContact C-N 3.32Å; L92-S94 PolarHBondContact O-N 2.74Å; S94-F96 PolarHBondContact O-N 3.47Å; S94-K97 WeakPolarHBondContact O-CB 3.12Å; S94-K97 PolarHBondContact O-N 3.35Å; S94-D98 PolarHBondContact O-N 2.74Å
95	L	84.9	Confident	81.6	Confident	31 Å²	31	78.8 Å²	78.8	16%	0.162	41%	0.413	C	S	.	.	H	α-helix	trans	-58.4	-48.3	-179.6	-176.8	76.1	0	0	0	112.3	I21 L40 L44 G91 L92 K97 D98 A99	I21-L95 HydrophobicContact CD1-CD1 3.6Å; I21-L95 HydrophobicContact CD1-CG 4.45Å; I21-L95 HydrophobicContact CG1-CD1 4.13Å; I21-L95 HydrophobicContact CG2-CD1 4.43Å; L40-L95 HydrophobicContact CD1-CD1 3.9Å; L40-L95 HydrophobicContact CD1-CD2 3.72Å; L40-L95 HydrophobicContact CD1-CG 3.74Å; L40-L95 HydrophobicContact CG-CD2 3.76Å; L40-L95 HydrophobicContact CG-CG 4.23Å; L40-L95 WeakPolarHBondContact O-CD2 3.19Å; L44-L95 HydrophobicContact CD1-CB 4.02Å; L44-L95 HydrophobicContact CD1-CD2 3.79Å; L44-L95 HydrophobicContact CD1-CG 4.45Å; G91-L95 WeakPolarHBondContact O-CB 3.49Å; G91-L95 PolarHBondContact O-N 3.49Å; L92-L95 PolarHBondContact O-N 2.86Å; L95-K97 VanDerWaalsContact C-N 3.32Å; L95-K97 PolarHBondContact O-N 3.27Å; L95-D98 PolarHBondContact O-N 3.34Å; L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 2.97Å
96	F	84.9	Confident	82.9	Confident	73 Å²	73	69.7 Å²	69.7	32%	0.32	37%	0.374	S	S	.	.	H	α-helix	trans	-65.9	-33.5	178.4	-70.4	-49	0	0	0	112.8	F37 L40 V41 L92 S94 C100	F37-F96 HydrophobicContact CD2-CE1 4.37Å; F37-F96 AromaticContact CE2-CE1 3.8Å; F37-F96 HydrophobicContact CE2-CE1 3.8Å; F37-F96 AromaticContact CE2-CZ 3.69Å; F37-F96 HydrophobicContact CE2-CZ 3.69Å; F37-F96 HydrophobicContact CZ-CZ 4.21Å; L40-F96 HydrophobicContact CD2-CD1 4Å; L40-F96 HydrophobicContact CD2-CE1 3.83Å; V41-F96 HydrophobicContact CG2-CE1 4.03Å; V41-F96 HydrophobicContact CG2-CZ 3.81Å; L92-F96 HydrophobicContact CB-CD2 4.49Å; L92-F96 HydrophobicContact CB-CE2 4.27Å; L92-F96 HydrophobicContact CD2-CE2 4.02Å; L92-F96 HydrophobicContact CD2-CZ 4.24Å; L92-F96 WeakPolarHBondContact O-CD2 3.3Å; L92-F96 WeakPolarHBondContact O-CG 3.45Å; L92-F96 PolarHBondContact O-N 3.34Å; S94-F96 PolarHBondContact O-N 3.47Å; F96-C100 VanDerWaalsContact O-CB 3.29Å; F96-C100 WeakPolarHBondContact O-CB 3.06Å; F96-C100 PolarHBondContact O-N 3.27Å; F96-C100 PolarHBondContact O-SG 3.47Å; F96-C100 VanDerWaalsContact O-SG 3.32Å
97	K	85.9	Confident	83.8	Confident	130 Å²	130	73 Å²	73	57%	0.565	38%	0.383	S	S	*	.	H	α-helix	trans	-65.6	-41.6	173.9	-78.7	173.2	-179.4	171.3	0	111.4	L93 S94 L95 K101	L93-K97 HydrophobicContact CG-CD 4.42Å; L93-K97 WeakPolarHBondContact O-CB 3.03Å; L93-K97 VanDerWaalsContact O-CG 3.26Å; L93-K97 WeakPolarHBondContact O-CG 3.47Å; L93-K97 PolarHBondContact O-N 3.31Å; S94-K97 WeakPolarHBondContact O-CB 3.12Å; S94-K97 PolarHBondContact O-N 3.35Å; L95-K97 VanDerWaalsContact C-N 3.32Å; L95-K97 PolarHBondContact O-N 3.27Å; K97-K101 WeakPolarHBondContact O-CB 3.17Å; K97-K101 PolarHBondContact O-N 2.87Å; K97-K101 VanDerWaalsContact O-N 3.16Å
98	D	86.6	Confident	84.9	Confident	62 Å²	62	74.9 Å²	74.9	33%	0.332	38%	0.383	S	S	.	.	H	α-helix	trans	-68.6	-45.8	178.5	-67.6	-28.9	0	0	0	110.9	I21 S94 L95 C100 K101 E102	I21-D98 HydrophobicContact CD1-CB 3.49Å; I21-D98 VanDerWaalsContact CD1-CB 3.49Å; S94-D98 PolarHBondContact O-N 2.74Å; L95-D98 PolarHBondContact O-N 3.34Å; D98-C100 PolarHBondContact O-N 3.26Å; D98-K101 WeakPolarHBondContact O-CB 2.97Å; D98-K101 PolarHBondContact O-N 3.06Å; D98-K101 VanDerWaalsContact O-N 3.11Å; D98-E102 PolarHBondContact O-N 2.64Å
99	A	85.4	Confident	85.7	Confident	6 Å²	6	76.5 Å²	76.5	5%	0.05	39%	0.391	C	S	.	.	H	α-helix	trans	-59	-45.6	175.4	0	0	0	0	0	112.8	I21 L22 L40 L95 K101 E102 L103	I21-A99 HydrophobicContact CG2-CB 4.1Å; L22-A99 HydrophobicContact CD1-CB 4.13Å; L40-A99 HydrophobicContact CD1-CB 4.4Å; L40-A99 HydrophobicContact CD2-CB 4.32Å; L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 2.97Å; A99-K101 VanDerWaalsContact C-N 3.27Å; A99-K101 PolarHBondContact O-N 2.8Å; A99-E102 PolarHBondContact O-N 2.79Å; A99-L103 WeakPolarHBondContact O-CG 3.48Å; A99-L103 PolarHBondContact O-N 2.79Å
100	C	86.1	Confident	86.2	Confident	79 Å²	79	76.3 Å²	76.3	53%	0.534	39%	0.39	S	S	.	.	H	α-helix	trans	-59.5	-38.4	175.2	-82	0	0	0	0	112.3	F96 D98 V104	F96-C100 VanDerWaalsContact O-CB 3.29Å; F96-C100 WeakPolarHBondContact O-CB 3.06Å; F96-C100 PolarHBondContact O-N 3.27Å; F96-C100 PolarHBondContact O-SG 3.47Å; F96-C100 VanDerWaalsContact O-SG 3.32Å; D98-C100 PolarHBondContact O-N 3.26Å; C100-V104 WeakPolarHBondContact O-CG2 3.15Å; C100-V104 PolarHBondContact O-N 3.39Å
101	K	88.2	Confident	86.9	Confident	139 Å²	139	73.3 Å²	73.3	60%	0.604	37%	0.374	S	S	*	.	H	α-helix	trans	-68.8	-43.1	178.4	-171.2	-179.7	176.3	-174	0	111.3	K97 D98 A99 V104 D105	K97-K101 WeakPolarHBondContact O-CB 3.17Å; K97-K101 PolarHBondContact O-N 2.87Å; K97-K101 VanDerWaalsContact O-N 3.16Å; D98-K101 WeakPolarHBondContact O-CB 2.97Å; D98-K101 PolarHBondContact O-N 3.06Å; D98-K101 VanDerWaalsContact O-N 3.11Å; A99-K101 VanDerWaalsContact C-N 3.27Å; A99-K101 PolarHBondContact O-N 2.8Å; K101-V104 PolarHBondContact O-N 2.93Å; K101-D105 PolarHBondContact O-N 3.02Å; K101-D105 VanDerWaalsContact O-N 3.13Å
102	E	87.6	Confident	87.5	Confident	37 Å²	37	73.6 Å²	73.6	17%	0.173	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-41.4	176.4	-72.4	-174	-178.3	0	0	112.5	I21 L22 D98 A99 V104 D105 L106	I21-E102 WeakPolarHBondContact CA-OE2 3.48Å; I21-E102 WeakPolarHBondContact CB-OE2 3.37Å; I21-E102 PolarHBondContact N-OE1 3.2Å; I21-E102 PolarHBondContact N-OE2 3.43Å; L22-E102 PolarHBondContact N-OE2 2.87Å; D98-E102 PolarHBondContact O-N 2.64Å; A99-E102 PolarHBondContact O-N 2.79Å; E102-V104 VanDerWaalsContact C-N 3.3Å; E102-V104 PolarHBondContact O-N 3.14Å; E102-D105 PolarHBondContact O-N 3.43Å; E102-D105 VanDerWaalsContact O-N 3.1Å; E102-L106 WeakPolarHBondContact O-CB 3.42Å; E102-L106 PolarHBondContact O-N 3.41Å
103	L	86.7	Confident	88	Confident	71 Å²	71	79.8 Å²	79.8	37%	0.372	40%	0.398	S	S	.	.	H	α-helix	trans	-57.6	-42.5	173.8	-79.5	169.6	0	0	0	112.5	L22 F27 A99 D105 R107	L22-L103 HydrophobicContact CD1-CD1 4.11Å; L22-L103 HydrophobicContact CD1-CD2 3.9Å; L22-L103 HydrophobicContact CD1-CG 3.57Å; F27-L103 HydrophobicContact CE1-CD2 4.18Å; F27-L103 HydrophobicContact CE2-CD2 4.2Å; F27-L103 HydrophobicContact CZ-CD2 3.49Å; F27-L103 VanDerWaalsContact CZ-CD2 3.49Å; A99-L103 WeakPolarHBondContact O-CG 3.48Å; A99-L103 PolarHBondContact O-N 2.79Å; L103-D105 VanDerWaalsContact C-N 3.3Å; L103-D105 PolarHBondContact O-N 3.22Å; L103-R107 WeakPolarHBondContact O-CB 3.4Å; L103-R107 PolarHBondContact O-N 3.39Å
104	V	89.6	Confident	88.6	Confident	77 Å²	77	81 Å²	81	47%	0.467	41%	0.405	S	S	.	.	H	α-helix	trans	-64.3	-37.8	177.2	169.5	0	0	0	0	111.1	C100 K101 E102 K108	C100-V104 WeakPolarHBondContact O-CG2 3.15Å; C100-V104 PolarHBondContact O-N 3.39Å; K101-V104 PolarHBondContact O-N 2.93Å; E102-V104 VanDerWaalsContact C-N 3.3Å; E102-V104 PolarHBondContact O-N 3.14Å; V104-K108 WeakPolarHBondContact O-CG 3.31Å; V104-K108 PolarHBondContact O-N 2.91Å; V104-K108 VanDerWaalsContact O-N 3.14Å
105	D	89.5	Confident	89.1	Confident	73 Å²	73	82.2 Å²	82.2	39%	0.39	41%	0.406	S	S	.	.	H	α-helix	trans	-76.8	-36.8	179.7	-71.2	-20.5	0	0	0	112.6	K101 E102 L103 K108 Q109	K101-D105 PolarHBondContact O-N 3.02Å; K101-D105 VanDerWaalsContact O-N 3.13Å; E102-D105 PolarHBondContact O-N 3.43Å; E102-D105 VanDerWaalsContact O-N 3.1Å; L103-D105 VanDerWaalsContact C-N 3.3Å; L103-D105 PolarHBondContact O-N 3.22Å; D105-K108 PolarHBondContact O-N 3.23Å; D105-K108 IonicContact OD1-NZ 3.71Å; D105-K108 PolarHBondContact OD1-NZ 2.84Å; D105-Q109 PolarHBondContact O-N 2.87Å
106	L	89.6	Confident	89.6	Confident	23 Å²	23	84.3 Å²	84.3	12%	0.12	42%	0.421	C	S	.	.	H	α-helix	trans	-59.7	-46.5	169.5	-82.3	171.3	0	0	0	111.1	L22 I24 F27 E102 K108 Q109 V110	L22-L106 HydrophobicContact CB-CD1 4.15Å; I24-L106 HydrophobicContact CB-CD2 3.87Å; I24-L106 HydrophobicContact CG1-CD2 4.26Å; F27-L106 HydrophobicContact CD2-CD1 4.45Å; F27-L106 HydrophobicContact CE2-CD1 3.92Å; E102-L106 WeakPolarHBondContact O-CB 3.42Å; E102-L106 PolarHBondContact O-N 3.41Å; L106-K108 VanDerWaalsContact C-N 3.33Å; L106-K108 PolarHBondContact O-N 3.13Å; L106-Q109 WeakPolarHBondContact O-CB 3.41Å; L106-Q109 PolarHBondContact O-N 3.26Å; L106-Q109 VanDerWaalsContact O-N 3.11Å; L106-V110 WeakPolarHBondContact O-CG2 3.07Å; L106-V110 PolarHBondContact O-N 3.25Å
107	R	88.8	Confident	90	Very high	176 Å²	176	85.9 Å²	85.9	66%	0.664	43%	0.432	S	S	*	.	H	α-helix	trans	-55.9	-47	174.8	179.4	-178.3	168.1	-145.3	-1.7	111.5	L103 Q109 V110 D111	L103-R107 WeakPolarHBondContact O-CB 3.4Å; L103-R107 PolarHBondContact O-N 3.39Å; R107-Q109 VanDerWaalsContact C-N 3.33Å; R107-Q109 PolarHBondContact O-N 3.42Å; R107-V110 PolarHBondContact O-N 3.49Å; R107-D111 IonicContact NE-OD2 2.65Å; R107-D111 WeakPolarHBondContact O-CB 3.48Å; R107-D111 PolarHBondContact O-N 3.21Å
108	K	92	Very high	90.5	Very high	125 Å²	125	87.1 Å²	87.1	54%	0.543	44%	0.437	S	S	.	.	H	α-helix	trans	-61.3	-38.7	176.6	-71.6	170.7	-164.8	154.6	0	112.5	V104 D105 L106 G112	V104-K108 WeakPolarHBondContact O-CG 3.31Å; V104-K108 PolarHBondContact O-N 2.91Å; V104-K108 VanDerWaalsContact O-N 3.14Å; D105-K108 PolarHBondContact O-N 3.23Å; D105-K108 IonicContact OD1-NZ 3.71Å; D105-K108 PolarHBondContact OD1-NZ 2.84Å; L106-K108 VanDerWaalsContact C-N 3.33Å; L106-K108 PolarHBondContact O-N 3.13Å; K108-G112 PolarHBondContact O-N 3.42Å
109	Q	90.2	Very high	90.9	Very high	106 Å²	106	91.4 Å²	91.4	50%	0.495	45%	0.453	S	S	.	.	H	α-helix	trans	-63.6	-46	175.3	-83.3	-167.4	25.6	0	0	112	D105 L106 R107 G112 R113	D105-Q109 PolarHBondContact O-N 2.87Å; L106-Q109 WeakPolarHBondContact O-CB 3.41Å; L106-Q109 PolarHBondContact O-N 3.26Å; L106-Q109 VanDerWaalsContact O-N 3.11Å; R107-Q109 VanDerWaalsContact C-N 3.33Å; R107-Q109 PolarHBondContact O-N 3.42Å; Q109-G112 PolarHBondContact O-N 3.1Å; Q109-R113 WeakPolarHBondContact O-CG 3.3Å; Q109-R113 PolarHBondContact O-N 3.41Å
110	V	89.7	Confident	91.3	Very high	68 Å²	68	96.4 Å²	96.4	41%	0.412	48%	0.475	S	S	.	.	H	α-helix	trans	-62	-47.5	178	173.4	0	0	0	0	110.4	I24 L106 R107 G112 R113 L114	I24-V110 HydrophobicContact CD1-CG2 3.73Å; I24-V110 HydrophobicContact CG1-CG2 4.45Å; L106-V110 WeakPolarHBondContact O-CG2 3.07Å; L106-V110 PolarHBondContact O-N 3.25Å; R107-V110 PolarHBondContact O-N 3.49Å; V110-G112 VanDerWaalsContact C-N 3.27Å; V110-G112 PolarHBondContact O-N 3.41Å; V110-R113 PolarHBondContact O-N 3.06Å; V110-L114 WeakPolarHBondContact O-CB 3.37Å; V110-L114 PolarHBondContact O-N 3.5Å
111	D	92.5	Very high	91.8	Very high	66 Å²	66	97.3 Å²	97.3	35%	0.353	48%	0.478	S	S	.	.	H	α-helix	trans	-59	-39	175.8	-74.1	-24.5	0	0	0	111.4	R107 N115	R107-D111 IonicContact NE-OD2 2.65Å; R107-D111 WeakPolarHBondContact O-CB 3.48Å; R107-D111 PolarHBondContact O-N 3.21Å; D111-N115 WeakPolarHBondContact O-CB 3.43Å; D111-N115 VanDerWaalsContact O-CG 3.3Å; D111-N115 PolarHBondContact O-N 3.13Å; D111-N115 PolarHBondContact O-ND2 3.37Å
112	G	93.9	Very high	92.1	Very high	34 Å²	34	94.3 Å²	94.3	35%	0.351	48%	0.475	S	S	.	.	H	α-helix	trans	-64.7	-44.7	174.9	0	0	0	0	0	113.6	K108 Q109 V110 N115 T116	K108-G112 PolarHBondContact O-N 3.42Å; Q109-G112 PolarHBondContact O-N 3.1Å; V110-G112 VanDerWaalsContact C-N 3.27Å; V110-G112 PolarHBondContact O-N 3.41Å; G112-N115 PolarHBondContact O-N 2.89Å; G112-T116 PolarHBondContact O-N 3.05Å; G112-T116 PolarHBondContact O-OG1 3.1Å
113	R	91.7	Very high	92.5	Very high	151 Å²	151	96.2 Å²	96.2	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-63.8	-45.5	176.1	-72.2	-179	-174.2	179.8	5.9	111.2	Q109 V110 N115 T116 L117	Q109-R113 WeakPolarHBondContact O-CG 3.3Å; Q109-R113 PolarHBondContact O-N 3.41Å; V110-R113 PolarHBondContact O-N 3.06Å; R113-N115 VanDerWaalsContact C-N 3.33Å; R113-N115 PolarHBondContact O-N 3.34Å; R113-T116 PolarHBondContact O-N 3.03Å; R113-L117 WeakPolarHBondContact O-CB 3.26Å; R113-L117 PolarHBondContact O-N 2.88Å
114	L	93	Very high	92.8	Very high	110 Å²	110	97.3 Å²	97.3	58%	0.576	49%	0.492	S	S	*	.	H	α-helix	trans	-59.2	-44.6	178.2	-174.3	67.4	0	0	0	111.5	V110 T116 L117 K118	V110-L114 WeakPolarHBondContact O-CB 3.37Å; V110-L114 PolarHBondContact O-N 3.5Å; L114-T116 VanDerWaalsContact C-N 3.35Å; L114-T116 PolarHBondContact O-N 3.22Å; L114-L117 PolarHBondContact O-N 3.26Å; L114-K118 WeakPolarHBondContact O-CB 3.28Å; L114-K118 PolarHBondContact O-N 3.23Å
115	N	94.5	Very high	93.1	Very high	90 Å²	90	98 Å²	98	48%	0.481	49%	0.493	S	S	.	.	H	α-helix	trans	-65.6	-35.9	177.3	-79.1	-46.9	0	0	0	113.1	D111 G112 R113 K119	D111-N115 WeakPolarHBondContact O-CB 3.43Å; D111-N115 VanDerWaalsContact O-CG 3.3Å; D111-N115 PolarHBondContact O-N 3.13Å; D111-N115 PolarHBondContact O-ND2 3.37Å; G112-N115 PolarHBondContact O-N 2.89Å; R113-N115 VanDerWaalsContact C-N 3.33Å; R113-N115 PolarHBondContact O-N 3.34Å; N115-K119 WeakPolarHBondContact O-CG 3.4Å; N115-K119 PolarHBondContact O-N 3.39Å
116	T	94.6	Very high	93.3	Very high	75 Å²	75	97.4 Å²	97.4	46%	0.46	49%	0.494	S	S	.	.	H	α-helix	trans	-68.3	-47.8	177.1	-54.1	0	0	0	0	110.6	G112 R113 L114 K118 K119 E120	G112-T116 PolarHBondContact O-N 3.05Å; G112-T116 PolarHBondContact O-OG1 3.1Å; R113-T116 PolarHBondContact O-N 3.03Å; L114-T116 VanDerWaalsContact C-N 3.35Å; L114-T116 PolarHBondContact O-N 3.22Å; T116-K118 VanDerWaalsContact C-N 3.3Å; T116-K118 PolarHBondContact O-N 3.39Å; T116-K119 WeakPolarHBondContact O-CB 3.48Å; T116-K119 PolarHBondContact O-N 2.89Å; T116-K119 VanDerWaalsContact O-N 3.08Å; T116-E120 PolarHBondContact O-N 3.23Å
117	L	94.9	Very high	93.5	Very high	106 Å²	106	101.8 Å²	101.8	56%	0.555	51%	0.513	S	S	*	.	H	α-helix	trans	-61	-40.3	178.3	-161.2	70.2	0	0	0	111.5	R113 L114 K119 E120 V121	R113-L117 WeakPolarHBondContact O-CB 3.26Å; R113-L117 PolarHBondContact O-N 2.88Å; L114-L117 PolarHBondContact O-N 3.26Å; L117-K119 VanDerWaalsContact C-N 3.33Å; L117-K119 PolarHBondContact O-N 2.97Å; L117-E120 PolarHBondContact O-N 3.48Å; L117-V121 VanDerWaalsContact O-CG2 3.31Å; L117-V121 WeakPolarHBondContact O-CG2 3.21Å; L117-V121 PolarHBondContact O-N 3.34Å
118	K	94.6	Very high	93.7	Very high	156 Å²	156	99 Å²	99	68%	0.678	51%	0.507	S	S	*	.	H	α-helix	trans	-59.9	-40.4	174.4	-172.2	174.8	-178.7	176.7	0	112.7	L114 T116 S122	L114-K118 WeakPolarHBondContact O-CB 3.28Å; L114-K118 PolarHBondContact O-N 3.23Å; T116-K118 VanDerWaalsContact C-N 3.3Å; T116-K118 PolarHBondContact O-N 3.39Å; K118-S122 WeakPolarHBondContact O-CB 3.4Å; K118-S122 PolarHBondContact O-N 3Å; K118-S122 VanDerWaalsContact O-N 3.13Å
119	K	95.1	Very high	93.8	Very high	151 Å²	151	101.3 Å²	101.3	66%	0.657	51%	0.512	S	S	*	.	H	α-helix	trans	-68.8	-40.2	176.2	-73	174.8	-178.4	178.7	0	112.2	N115 T116 L117 S122 T123	N115-K119 WeakPolarHBondContact O-CG 3.4Å; N115-K119 PolarHBondContact O-N 3.39Å; T116-K119 WeakPolarHBondContact O-CB 3.48Å; T116-K119 PolarHBondContact O-N 2.89Å; T116-K119 VanDerWaalsContact O-N 3.08Å; L117-K119 VanDerWaalsContact C-N 3.33Å; L117-K119 PolarHBondContact O-N 2.97Å; K119-S122 PolarHBondContact O-N 3.24Å; K119-T123 WeakPolarHBondContact O-CB 3.26Å; K119-T123 PolarHBondContact O-N 3.2Å; K119-T123 PolarHBondContact O-OG1 3.04Å
120	E	95.1	Very high	94	Very high	112 Å²	112	103 Å²	103	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-64.5	-45.8	177.3	-73.2	179.3	179	0	0	111.7	T116 L117 S122 T123 Q124	T116-E120 PolarHBondContact O-N 3.23Å; L117-E120 PolarHBondContact O-N 3.48Å; E120-S122 VanDerWaalsContact C-N 3.35Å; E120-S122 PolarHBondContact O-N 2.83Å; E120-T123 WeakPolarHBondContact O-CB 3.05Å; E120-T123 PolarHBondContact O-N 3.38Å; E120-T123 VanDerWaalsContact O-N 3.17Å; E120-Q124 WeakPolarHBondContact O-CG 3.48Å; E120-Q124 PolarHBondContact O-N 2.68Å
121	V	96	Very high	94.1	Very high	97 Å²	97	103 Å²	103	59%	0.588	52%	0.518	S	S	*	.	H	α-helix	trans	-59.1	-45.7	175.5	170.9	0	0	0	0	110.8	L117 T123 Q124 D125	L117-V121 VanDerWaalsContact O-CG2 3.31Å; L117-V121 WeakPolarHBondContact O-CG2 3.21Å; L117-V121 PolarHBondContact O-N 3.34Å; V121-T123 VanDerWaalsContact C-N 3.32Å; V121-T123 PolarHBondContact O-N 3.07Å; V121-Q124 PolarHBondContact O-N 2.91Å; V121-D125 WeakPolarHBondContact O-CB 3.2Å; V121-D125 PolarHBondContact O-N 3.49Å
122	S	94.8	Very high	94.1	Very high	77 Å²	77	104.5 Å²	104.5	54%	0.538	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-37.1	176.6	179	0	0	0	0	113	K118 K119 E120 S126	K118-S122 WeakPolarHBondContact O-CB 3.4Å; K118-S122 PolarHBondContact O-N 3Å; K118-S122 VanDerWaalsContact O-N 3.13Å; K119-S122 PolarHBondContact O-N 3.24Å; E120-S122 VanDerWaalsContact C-N 3.35Å; E120-S122 PolarHBondContact O-N 2.83Å; S122-S126 PolarHBondContact O-N 3.13Å; S122-S126 VanDerWaalsContact O-N 3.11Å
123	T	95	Very high	94	Very high	76 Å²	76	105.8 Å²	105.8	47%	0.466	53%	0.526	S	S	.	.	H	α-helix	trans	-68	-41.3	176.8	-56.7	0	0	0	0	111.4	K119 E120 V121 K127	K119-T123 WeakPolarHBondContact O-CB 3.26Å; K119-T123 PolarHBondContact O-N 3.2Å; K119-T123 PolarHBondContact O-OG1 3.04Å; E120-T123 WeakPolarHBondContact O-CB 3.05Å; E120-T123 PolarHBondContact O-N 3.38Å; E120-T123 VanDerWaalsContact O-N 3.17Å; V121-T123 VanDerWaalsContact C-N 3.32Å; V121-T123 PolarHBondContact O-N 3.07Å; T123-K127 WeakPolarHBondContact O-CG 3.46Å; T123-K127 PolarHBondContact O-N 2.98Å
124	Q	94.4	Very high	94.1	Very high	95 Å²	95	105.3 Å²	105.3	44%	0.444	53%	0.531	S	S	.	.	H	α-helix	trans	-66.4	-43.5	175.7	-71.7	-62.4	-16.7	0	0	111.2	E120 V121 S126 K127 H128	E120-Q124 WeakPolarHBondContact O-CG 3.48Å; E120-Q124 PolarHBondContact O-N 2.68Å; V121-Q124 PolarHBondContact O-N 2.91Å; Q124-S126 VanDerWaalsContact C-N 3.31Å; Q124-S126 PolarHBondContact O-N 2.94Å; Q124-K127 PolarHBondContact O-N 2.8Å; Q124-K127 VanDerWaalsContact O-N 3.11Å; Q124-H128 PolarHBondContact O-N 3.22Å; Q124-H128 PolarHBondContact O-ND1 3.37Å
125	D	94.3	Very high	94	Very high	92 Å²	92	105.2 Å²	105.2	49%	0.492	53%	0.53	S	S	.	.	H	α-helix	trans	-56.7	-44.5	176.4	-173.2	59.3	0	0	0	111.8	V121 K127 H128 R129	V121-D125 WeakPolarHBondContact O-CB 3.2Å; V121-D125 PolarHBondContact O-N 3.49Å; D125-K127 VanDerWaalsContact C-N 3.34Å; D125-K127 PolarHBondContact O-N 3.35Å; D125-H128 PolarHBondContact O-N 3.11Å; D125-R129 WeakPolarHBondContact O-CB 3.33Å; D125-R129 PolarHBondContact O-N 2.97Å
126	S	94.4	Very high	93.8	Very high	59 Å²	59	105.6 Å²	105.6	41%	0.413	53%	0.529	S	S	.	.	H	α-helix	trans	-61.6	-38.1	175.8	-176.5	0	0	0	0	113.4	S122 Q124 K130	S122-S126 PolarHBondContact O-N 3.13Å; S122-S126 VanDerWaalsContact O-N 3.11Å; Q124-S126 VanDerWaalsContact C-N 3.31Å; Q124-S126 PolarHBondContact O-N 2.94Å; S126-K130 WeakPolarHBondContact O-CG 3.49Å; S126-K130 PolarHBondContact O-N 3.37Å
127	K	94.5	Very high	93.7	Very high	116 Å²	116	109.1 Å²	109.1	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-67.3	-48	176.5	-72.9	176.7	-179.2	178.2	0	111.3	T123 Q124 D125 R129 K130 T131	T123-K127 WeakPolarHBondContact O-CG 3.46Å; T123-K127 PolarHBondContact O-N 2.98Å; Q124-K127 PolarHBondContact O-N 2.8Å; Q124-K127 VanDerWaalsContact O-N 3.11Å; D125-K127 VanDerWaalsContact C-N 3.34Å; D125-K127 PolarHBondContact O-N 3.35Å; K127-R129 VanDerWaalsContact C-N 3.27Å; K127-R129 PolarHBondContact O-N 3.01Å; K127-K130 PolarHBondContact O-N 3.38Å; K127-K130 VanDerWaalsContact O-N 3.15Å; K127-T131 PolarHBondContact O-N 3.33Å; K127-T131 PolarHBondContact O-OG1 3.47Å
128	H	92.9	Very high	93.5	Very high	116 Å²	116	106 Å²	106	54%	0.537	53%	0.531	S	S	.	.	H	α-helix	trans	-60.1	-39.6	178.1	-69.7	100.6	0	0	0	111.6	Q124 D125 K130 T131 L132	Q124-H128 PolarHBondContact O-N 3.22Å; Q124-H128 PolarHBondContact O-ND1 3.37Å; D125-H128 PolarHBondContact O-N 3.11Å; H128-K130 PolarHBondContact O-N 3.29Å; H128-T131 WeakPolarHBondContact CA-OG1 3.23Å; H128-T131 PolarHBondContact O-N 2.9Å; H128-T131 PolarHBondContact O-OG1 2.8Å; H128-L132 WeakPolarHBondContact O-CB 3.37Å; H128-L132 PolarHBondContact O-N 2.99Å
129	R	93.4	Very high	93.4	Very high	175 Å²	175	101.4 Å²	101.4	66%	0.66	52%	0.516	S	S	*	.	H	α-helix	trans	-64	-37.8	177.2	-162.9	179.9	-86.4	-143.2	-3.1	112.4	D125 K127 T133	D125-R129 WeakPolarHBondContact O-CB 3.33Å; D125-R129 PolarHBondContact O-N 2.97Å; K127-R129 VanDerWaalsContact C-N 3.27Å; K127-R129 PolarHBondContact O-N 3.01Å; R129-T133 PolarHBondContact O-N 3.34Å; R129-T133 PolarHBondContact O-OG1 3.15Å; R129-T133 VanDerWaalsContact O-OG1 3.1Å
130	K	93.9	Very high	93.2	Very high	141 Å²	141	99.3 Å²	99.3	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-68.3	-45.1	175.2	-72.5	176.7	-176.9	-179.5	0	112.7	S126 K127 H128 L132 T133 E134	S126-K130 WeakPolarHBondContact O-CG 3.49Å; S126-K130 PolarHBondContact O-N 3.37Å; K127-K130 PolarHBondContact O-N 3.38Å; K127-K130 VanDerWaalsContact O-N 3.15Å; H128-K130 PolarHBondContact O-N 3.29Å; K130-L132 PolarHBondContact O-N 2.81Å; K130-T133 PolarHBondContact O-N 3.18Å; K130-E134 PolarHBondContact O-N 3.27Å; K130-E134 VanDerWaalsContact O-N 3.13Å
131	T	92.5	Very high	93.1	Very high	68 Å²	68	96.2 Å²	96.2	42%	0.417	51%	0.51	S	S	.	.	H	α-helix	trans	-62.5	-35.7	177.6	49.2	0	0	0	0	111.5	K127 H128 E134 I135	K127-T131 PolarHBondContact O-N 3.33Å; K127-T131 PolarHBondContact O-OG1 3.47Å; H128-T131 WeakPolarHBondContact CA-OG1 3.23Å; H128-T131 PolarHBondContact O-N 2.9Å; H128-T131 PolarHBondContact O-OG1 2.8Å; T131-E134 PolarHBondContact O-N 3.49Å; T131-I135 VanDerWaalsContact O-CG1 3.32Å; T131-I135 WeakPolarHBondContact O-CG1 3.32Å; T131-I135 PolarHBondContact O-N 3.02Å
132	L	93	Very high	92.9	Very high	97 Å²	97	96.1 Å²	96.1	51%	0.508	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-44.9	175.6	-167.8	67.7	0	0	0	111.3	H128 K130 E134 I135 E136	H128-L132 WeakPolarHBondContact O-CB 3.37Å; H128-L132 PolarHBondContact O-N 2.99Å; K130-L132 PolarHBondContact O-N 2.81Å; L132-E134 VanDerWaalsContact C-N 3.33Å; L132-E134 PolarHBondContact O-N 2.94Å; L132-I135 PolarHBondContact O-N 3.35Å; L132-E136 WeakPolarHBondContact O-CG 3.33Å; L132-E136 PolarHBondContact O-N 3.21Å
133	T	92.5	Very high	92.7	Very high	61 Å²	61	99.2 Å²	99.2	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-65.2	-32.1	177.4	-52.2	0	0	0	0	113.6	R129 K130 K137	R129-T133 PolarHBondContact O-N 3.34Å; R129-T133 PolarHBondContact O-OG1 3.15Å; R129-T133 VanDerWaalsContact O-OG1 3.1Å; K130-T133 PolarHBondContact O-N 3.18Å; T133-K137 WeakPolarHBondContact O-CG 3.44Å; T133-K137 PolarHBondContact O-N 3.45Å
134	E	92.5	Very high	92.5	Very high	142 Å²	142	102.2 Å²	102.2	66%	0.664	52%	0.518	S	S	*	.	H	α-helix	trans	-70.2	-40.5	174.1	-73	178	-179.9	0	0	111.8	K130 T131 L132 K137 G138	K130-E134 PolarHBondContact O-N 3.27Å; K130-E134 VanDerWaalsContact O-N 3.13Å; T131-E134 PolarHBondContact O-N 3.49Å; L132-E134 VanDerWaalsContact C-N 3.33Å; L132-E134 PolarHBondContact O-N 2.94Å; E134-K137 PolarHBondContact O-N 3.15Å; E134-G138 PolarHBondContact O-N 3.19Å
135	I	90.7	Very high	92.4	Very high	107 Å²	107	101 Å²	101	55%	0.549	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-44.4	175.4	-68	167.6	0	0	0	110.3	T131 L132 K137 G138 V139	T131-I135 VanDerWaalsContact O-CG1 3.32Å; T131-I135 WeakPolarHBondContact O-CG1 3.32Å; T131-I135 PolarHBondContact O-N 3.02Å; L132-I135 PolarHBondContact O-N 3.35Å; I135-K137 VanDerWaalsContact C-N 3.34Å; I135-K137 PolarHBondContact O-N 2.92Å; I135-G138 PolarHBondContact O-N 3.4Å; I135-G138 VanDerWaalsContact O-N 3.13Å; I135-V139 HydrophobicContact CG2-CG2 4.14Å; I135-V139 WeakPolarHBondContact O-CB 3.32Å; I135-V139 VanDerWaalsContact O-CG2 3.26Å; I135-V139 WeakPolarHBondContact O-CG2 3.42Å; I135-V139 PolarHBondContact O-N 3.4Å
136	E	91.1	Very high	92.2	Very high	99 Å²	99	102.4 Å²	102.4	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-54.2	-48.8	175.5	-75.3	168.2	173.3	0	0	111.5	L132 G138 V139 D140	L132-E136 WeakPolarHBondContact O-CG 3.33Å; L132-E136 PolarHBondContact O-N 3.21Å; E136-G138 PolarHBondContact O-N 2.88Å; E136-V139 WeakPolarHBondContact O-CB 3.45Å; E136-V139 PolarHBondContact O-N 3.38Å; E136-D140 PolarHBondContact O-N 3.02Å
137	K	92.6	Very high	92	Very high	149 Å²	149	102.2 Å²	102.2	65%	0.648	52%	0.524	S	S	*	.	H	α-helix	trans	-63.7	-38.1	176.7	-71.7	177	-178.5	178.5	0	113.4	T133 E134 I135 V139 D140 G141	T133-K137 WeakPolarHBondContact O-CG 3.44Å; T133-K137 PolarHBondContact O-N 3.45Å; E134-K137 PolarHBondContact O-N 3.15Å; I135-K137 VanDerWaalsContact C-N 3.34Å; I135-K137 PolarHBondContact O-N 2.92Å; K137-V139 VanDerWaalsContact C-N 3.33Å; K137-D140 PolarHBondContact O-N 3.4Å; K137-G141 PolarHBondContact O-N 3.11Å; K137-G141 VanDerWaalsContact O-N 3.15Å
138	G	90.8	Very high	91.8	Very high	41 Å²	41	106.3 Å²	106.3	42%	0.423	54%	0.537	S	S	.	.	H	α-helix	trans	-64.9	-40.5	176.1	0	0	0	0	0	111.8	E134 I135 E136 G141 L142	E134-G138 PolarHBondContact O-N 3.19Å; I135-G138 PolarHBondContact O-N 3.4Å; I135-G138 VanDerWaalsContact O-N 3.13Å; E136-G138 PolarHBondContact O-N 2.88Å; G138-G141 PolarHBondContact O-N 3.13Å; G138-L142 WeakPolarHBondContact O-CB 3.14Å; G138-L142 PolarHBondContact O-N 3.42Å
139	V	92.4	Very high	91.6	Very high	59 Å²	59	104.7 Å²	104.7	36%	0.358	53%	0.532	S	S	.	.	H	α-helix	trans	-65.2	-43.2	175.8	167.4	0	0	0	0	111	I135 E136 K137 G141 L142 F143	I135-V139 HydrophobicContact CG2-CG2 4.14Å; I135-V139 WeakPolarHBondContact O-CB 3.32Å; I135-V139 VanDerWaalsContact O-CG2 3.26Å; I135-V139 WeakPolarHBondContact O-CG2 3.42Å; I135-V139 PolarHBondContact O-N 3.4Å; E136-V139 WeakPolarHBondContact O-CB 3.45Å; E136-V139 PolarHBondContact O-N 3.38Å; K137-V139 VanDerWaalsContact C-N 3.33Å; V139-G141 PolarHBondContact O-N 3.41Å; V139-L142 WeakPolarHBondContact O-CB 3.47Å; V139-L142 PolarHBondContact O-N 3.38Å; V139-L142 VanDerWaalsContact O-N 3.14Å; V139-F143 HydrophobicContact CG1-CD2 3.5Å; V139-F143 VanDerWaalsContact CG1-CD2 3.5Å; V139-F143 HydrophobicContact CG1-CE2 3.21Å; V139-F143 HydrophobicContact CG1-CZ 4.3Å; V139-F143 WeakPolarHBondContact O-CD2 3.05Å; V139-F143 PolarHBondContact O-N 3.4Å
140	D	90.8	Very high	91.4	Very high	107 Å²	107	101 Å²	101	57%	0.572	53%	0.525	S	S	*	.	H	α-helix	trans	-59.9	-44	175.5	-71	-24.2	0	0	0	112.3	E136 K137 L142 F143 E144	E136-D140 PolarHBondContact O-N 3.02Å; K137-D140 PolarHBondContact O-N 3.4Å; D140-L142 VanDerWaalsContact C-N 3.3Å; D140-L142 PolarHBondContact O-N 2.71Å; D140-F143 PolarHBondContact O-N 3.23Å; D140-E144 PolarHBondContact O-N 3.39Å
141	G	91.7	Very high	91.3	Very high	46 Å²	46	96.3 Å²	96.3	47%	0.474	52%	0.517	S	S	.	.	H	α-helix	trans	-64.1	-36	175.3	0	0	0	0	0	112.9	K137 G138 V139 S145	K137-G141 PolarHBondContact O-N 3.11Å; K137-G141 VanDerWaalsContact O-N 3.15Å; G138-G141 PolarHBondContact O-N 3.13Å; V139-G141 PolarHBondContact O-N 3.41Å; G141-S145 PolarHBondContact O-N 3.34Å
142	L	91.6	Very high	91.1	Very high	96 Å²	96	101.8 Å²	101.8	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-43.4	174.6	-118.8	148.2	0	0	0	111.1	G138 V139 D140 E144 S145 F146	G138-L142 WeakPolarHBondContact O-CB 3.14Å; G138-L142 PolarHBondContact O-N 3.42Å; V139-L142 WeakPolarHBondContact O-CB 3.47Å; V139-L142 PolarHBondContact O-N 3.38Å; V139-L142 VanDerWaalsContact O-N 3.14Å; D140-L142 VanDerWaalsContact C-N 3.3Å; D140-L142 PolarHBondContact O-N 2.71Å; L142-E144 PolarHBondContact O-N 3.01Å; L142-S145 PolarHBondContact O-N 2.99Å; L142-S145 PolarHBondContact O-OG 3.05Å; L142-F146 HydrophobicContact CD2-CD2 3.61Å; L142-F146 HydrophobicContact CD2-CE2 3.33Å; L142-F146 HydrophobicContact CD2-CZ 4.49Å; L142-F146 WeakPolarHBondContact O-CB 3.28Å; L142-F146 WeakPolarHBondContact O-CD2 3.16Å; L142-F146 PolarHBondContact O-N 2.86Å
143	F	91.8	Very high	90.9	Very high	141 Å²	141	101.8 Å²	101.8	62%	0.618	53%	0.53	S	S	*	.	H	α-helix	trans	-60.6	-41.3	175.5	-82.7	-61.1	0	0	0	112.6	V139 D140 S145 F146 A147	V139-F143 HydrophobicContact CG1-CD2 3.5Å; V139-F143 VanDerWaalsContact CG1-CD2 3.5Å; V139-F143 HydrophobicContact CG1-CE2 3.21Å; V139-F143 HydrophobicContact CG1-CZ 4.3Å; V139-F143 WeakPolarHBondContact O-CD2 3.05Å; V139-F143 PolarHBondContact O-N 3.4Å; D140-F143 PolarHBondContact O-N 3.23Å; F143-S145 PolarHBondContact O-N 3.08Å; F143-F146 PolarHBondContact O-N 3.25Å; F143-A147 WeakPolarHBondContact O-CB 3.46Å; F143-A147 PolarHBondContact O-N 3.44Å
144	E	91.1	Very high	90.7	Very high	139 Å²	139	101.3 Å²	101.3	65%	0.65	53%	0.529	S	S	*	.	H	α-helix	trans	-64.7	-40.6	176.3	-174	60.6	-152.7	0	0	111.7	D140 L142 A147 R148	D140-E144 PolarHBondContact O-N 3.39Å; L142-E144 PolarHBondContact O-N 3.01Å; E144-A147 PolarHBondContact O-N 2.91Å; E144-R148 PolarHBondContact O-N 2.81Å; E144-R148 VanDerWaalsContact O-N 3.09Å
145	S	91.5	Very high	90.6	Very high	69 Å²	69	98 Å²	98	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-65.9	-39.1	176	77.4	0	0	0	0	112.4	G141 L142 F143 R148 L149	G141-S145 PolarHBondContact O-N 3.34Å; L142-S145 PolarHBondContact O-N 2.99Å; L142-S145 PolarHBondContact O-OG 3.05Å; F143-S145 PolarHBondContact O-N 3.08Å; S145-R148 PolarHBondContact O-N 3.28Å; S145-L149 WeakPolarHBondContact O-CB 3.38Å; S145-L149 PolarHBondContact O-N 3.36Å
146	F	90.8	Very high	90.5	Very high	122 Å²	122	97.7 Å²	97.7	54%	0.535	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-42.6	174.6	-93.5	-65.4	0	0	0	111.5	L142 F143 R148 L149 D150	L142-F146 HydrophobicContact CD2-CD2 3.61Å; L142-F146 HydrophobicContact CD2-CE2 3.33Å; L142-F146 HydrophobicContact CD2-CZ 4.49Å; L142-F146 WeakPolarHBondContact O-CB 3.28Å; L142-F146 WeakPolarHBondContact O-CD2 3.16Å; L142-F146 PolarHBondContact O-N 2.86Å; F143-F146 PolarHBondContact O-N 3.25Å; F146-R148 VanDerWaalsContact C-N 3.28Å; F146-R148 PolarHBondContact O-N 3.47Å; F146-L149 PolarHBondContact O-N 2.86Å; F146-D150 WeakPolarHBondContact O-CB 3.35Å; F146-D150 PolarHBondContact O-N 3.37Å
147	A	89.7	Confident	90.3	Very high	56 Å²	56	94.6 Å²	94.6	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-39.2	176.9	0	0	0	0	0	111.7	F143 E144 D150 G151	F143-A147 WeakPolarHBondContact O-CB 3.46Å; F143-A147 PolarHBondContact O-N 3.44Å; E144-A147 PolarHBondContact O-N 2.91Å; A147-D150 PolarHBondContact O-N 3.42Å; A147-G151 PolarHBondContact O-N 3.42Å
148	R	90.8	Very high	90	Very high	201 Å²	201	93.7 Å²	93.7	76%	0.758	52%	0.517	S	S	*	.	H	α-helix	trans	-70.5	-38.9	176.8	-161.6	177.4	-170.3	160.5	3.7	112.7	E144 S145 F146 R152	E144-R148 PolarHBondContact O-N 2.81Å; E144-R148 VanDerWaalsContact O-N 3.09Å; S145-R148 PolarHBondContact O-N 3.28Å; F146-R148 VanDerWaalsContact C-N 3.28Å; F146-R148 PolarHBondContact O-N 3.47Å; R148-R152 PolarHBondContact O-N 3.42Å
149	L	88.9	Confident	89.8	Confident	83 Å²	83	95.7 Å²	95.7	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-44.2	174	179.6	62.5	0	0	0	110.6	S145 F146 G151 R152 I153	S145-L149 WeakPolarHBondContact O-CB 3.38Å; S145-L149 PolarHBondContact O-N 3.36Å; F146-L149 PolarHBondContact O-N 2.86Å; L149-G151 PolarHBondContact O-N 3.21Å; L149-R152 WeakPolarHBondContact O-CB 3.35Å; L149-R152 PolarHBondContact O-N 3.47Å; L149-R152 VanDerWaalsContact O-N 3.1Å; L149-I153 HydrophobicContact CD1-CD1 4.01Å; L149-I153 HydrophobicContact CD1-CG1 4.23Å; L149-I153 HydrophobicContact CD2-CD1 4.24Å; L149-I153 HydrophobicContact CG-CD1 3.72Å; L149-I153 HydrophobicContact CG-CG1 4.3Å; L149-I153 WeakPolarHBondContact O-CG1 3.48Å; L149-I153 PolarHBondContact O-N 3.04Å
150	D	88.9	Confident	89.5	Confident	96 Å²	96	95.7 Å²	95.7	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-39.3	178.8	-171.2	51.1	0	0	0	111.7	F146 A147 R152 I153 S154	F146-D150 WeakPolarHBondContact O-CB 3.35Å; F146-D150 PolarHBondContact O-N 3.37Å; A147-D150 PolarHBondContact O-N 3.42Å; D150-R152 VanDerWaalsContact C-N 3.3Å; D150-R152 PolarHBondContact O-N 3Å; D150-I153 PolarHBondContact O-N 3.03Å; D150-S154 WeakPolarHBondContact O-CA 3.48Å; D150-S154 WeakPolarHBondContact O-CB 3.41Å; D150-S154 PolarHBondContact O-N 3.26Å; D150-S154 PolarHBondContact O-OG 3.29Å
151	G	91	Very high	89.2	Confident	44 Å²	44	92.6 Å²	92.6	45%	0.454	52%	0.517	S	S	.	.	H	α-helix	trans	-60.8	-37.3	171.9	0	0	0	0	0	113.2	A147 L149 S155	A147-G151 PolarHBondContact O-N 3.42Å; L149-G151 PolarHBondContact O-N 3.21Å; G151-S155 PolarHBondContact O-N 2.8Å; G151-S155 VanDerWaalsContact O-N 3.11Å
152	R	89.8	Confident	88.9	Confident	183 Å²	183	97 Å²	97	69%	0.691	52%	0.523	S	S	*	.	H	α-helix	trans	-74.2	-43.7	175.9	-71	179.3	65.7	-167.4	-0.9	112.1	R148 L149 D150 S154 S155 V156	R148-R152 PolarHBondContact O-N 3.42Å; L149-R152 WeakPolarHBondContact O-CB 3.35Å; L149-R152 PolarHBondContact O-N 3.47Å; L149-R152 VanDerWaalsContact O-N 3.1Å; D150-R152 VanDerWaalsContact C-N 3.3Å; D150-R152 PolarHBondContact O-N 3Å; R152-S154 VanDerWaalsContact C-N 3.29Å; R152-S154 PolarHBondContact O-N 3.39Å; R152-S155 PolarHBondContact O-N 3.28Å; R152-V156 WeakPolarHBondContact O-CG2 3.49Å; R152-V156 PolarHBondContact O-N 2.97Å
153	I	87.6	Confident	88.3	Confident	97 Å²	97	97.2 Å²	97.2	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-63.3	-39.6	176.1	-69.4	174.7	0	0	0	109.7	L149 D150 V156 G157	L149-I153 HydrophobicContact CD1-CD1 4.01Å; L149-I153 HydrophobicContact CD1-CG1 4.23Å; L149-I153 HydrophobicContact CD2-CD1 4.24Å; L149-I153 HydrophobicContact CG-CD1 3.72Å; L149-I153 HydrophobicContact CG-CG1 4.3Å; L149-I153 WeakPolarHBondContact O-CG1 3.48Å; L149-I153 PolarHBondContact O-N 3.04Å; D150-I153 PolarHBondContact O-N 3.03Å; I153-V156 PolarHBondContact O-N 3.14Å; I153-G157 VanDerWaalsContact O-CA 3.28Å; I153-G157 WeakPolarHBondContact O-CA 3.27Å; I153-G157 PolarHBondContact O-N 3.47Å
154	S	88.3	Confident	88.1	Confident	51 Å²	51	92 Å²	92	36%	0.357	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-42.2	175.5	-75.7	0	0	0	0	111.8	D150 R152 Q158	D150-S154 WeakPolarHBondContact O-CA 3.48Å; D150-S154 WeakPolarHBondContact O-CB 3.41Å; D150-S154 PolarHBondContact O-N 3.26Å; D150-S154 PolarHBondContact O-OG 3.29Å; R152-S154 VanDerWaalsContact C-N 3.29Å; R152-S154 PolarHBondContact O-N 3.39Å; S154-Q158 VanDerWaalsContact O-CB 3.25Å; S154-Q158 WeakPolarHBondContact O-CB 3.46Å; S154-Q158 WeakPolarHBondContact O-CG 3.39Å; S154-Q158 PolarHBondContact O-N 3.05Å
155	S	89.8	Confident	87.7	Confident	72 Å²	72	89.7 Å²	89.7	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-45.2	176.8	176.9	0	0	0	0	112.7	G151 R152 T159	G151-S155 PolarHBondContact O-N 2.8Å; G151-S155 VanDerWaalsContact O-N 3.11Å; R152-S155 PolarHBondContact O-N 3.28Å; S155-T159 PolarHBondContact O-N 3.22Å; S155-T159 PolarHBondContact O-OG1 2.64Å
156	V	89.8	Confident	87.5	Confident	101 Å²	101	93.1 Å²	93.1	61%	0.612	51%	0.509	S	S	*	.	H	α-helix	trans	-68.1	-42.8	176.8	174.7	0	0	0	0	110.5	R152 I153 T159 A160	R152-V156 WeakPolarHBondContact O-CG2 3.49Å; R152-V156 PolarHBondContact O-N 2.97Å; I153-V156 PolarHBondContact O-N 3.14Å; V156-T159 PolarHBondContact O-N 3.14Å; V156-A160 WeakPolarHBondContact O-CB 3.39Å; V156-A160 PolarHBondContact O-N 3.09Å
157	G	85.6	Confident	87.1	Confident	34 Å²	34	93 Å²	93	35%	0.351	51%	0.514	S	S	.	.	H	α-helix	trans	-61.6	-42.4	177	0	0	0	0	0	112.1	I153 T159 A160 A161	I153-G157 VanDerWaalsContact O-CA 3.28Å; I153-G157 WeakPolarHBondContact O-CA 3.27Å; I153-G157 PolarHBondContact O-N 3.47Å; G157-T159 VanDerWaalsContact C-N 3.33Å; G157-T159 PolarHBondContact O-N 3.28Å; G157-A160 PolarHBondContact O-N 3.2Å; G157-A161 WeakPolarHBondContact O-CA 3.4Å; G157-A161 WeakPolarHBondContact O-CB 3.31Å; G157-A161 PolarHBondContact O-N 3.29Å
158	Q	87.3	Confident	86.9	Confident	130 Å²	130	96.8 Å²	96.8	61%	0.607	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-36.6	174.2	-79.7	177.8	3.6	0	0	112.4	S154 K162	S154-Q158 VanDerWaalsContact O-CB 3.25Å; S154-Q158 WeakPolarHBondContact O-CB 3.46Å; S154-Q158 WeakPolarHBondContact O-CG 3.39Å; S154-Q158 PolarHBondContact O-N 3.05Å; Q158-K162 WeakPolarHBondContact O-CG 3.26Å; Q158-K162 PolarHBondContact O-N 3.4Å
159	T	86	Confident	86.5	Confident	82 Å²	82	90.6 Å²	90.6	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-72.8	-43	178.1	-50.9	0	0	0	0	110.9	S155 V156 G157 K162 I163	S155-T159 PolarHBondContact O-N 3.22Å; S155-T159 PolarHBondContact O-OG1 2.64Å; V156-T159 PolarHBondContact O-N 3.14Å; G157-T159 VanDerWaalsContact C-N 3.33Å; G157-T159 PolarHBondContact O-N 3.28Å; T159-K162 PolarHBondContact O-N 3.07Å; T159-I163 HydrophobicContact CG2-CD1 4.42Å; T159-I163 WeakPolarHBondContact O-CG1 3.28Å; T159-I163 PolarHBondContact O-N 3.19Å
160	A	86.5	Confident	86.2	Confident	59 Å²	59	89.5 Å²	89.5	49%	0.488	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-38.5	175.3	0	0	0	0	0	111.9	V156 G157 I163 G164	V156-A160 WeakPolarHBondContact O-CB 3.39Å; V156-A160 PolarHBondContact O-N 3.09Å; G157-A160 PolarHBondContact O-N 3.2Å; A160-I163 PolarHBondContact O-N 3.06Å; A160-G164 PolarHBondContact O-N 3.28Å
161	A	84.6	Confident	85.9	Confident	43 Å²	43	89.8 Å²	89.8	36%	0.355	51%	0.513	S	S	.	.	H	α-helix	trans	-63.1	-50.5	174.2	0	0	0	0	0	110.3	G157 I163 G164 D165	G157-A161 WeakPolarHBondContact O-CA 3.4Å; G157-A161 WeakPolarHBondContact O-CB 3.31Å; G157-A161 PolarHBondContact O-N 3.29Å; A161-I163 VanDerWaalsContact C-N 3.28Å; A161-I163 PolarHBondContact O-N 3.44Å; A161-G164 CarbonylContact O-C 3.27Å; A161-G164 WeakPolarHBondContact O-CA 3.43Å; A161-G164 PolarHBondContact O-N 2.82Å; A161-G164 VanDerWaalsContact O-N 3.08Å; A161-D165 VanDerWaalsContact O-CB 3.3Å; A161-D165 WeakPolarHBondContact O-CB 3.39Å; A161-D165 PolarHBondContact O-N 3.44Å
162	K	85	Confident	85.3	Confident	139 Å²	139	89.8 Å²	89.8	60%	0.604	51%	0.51	S	S	*	.	H	α-helix	trans	-56.3	-41.5	177.1	-78	179	-178.6	-179.4	0	113.3	Q158 T159 H166	Q158-K162 WeakPolarHBondContact O-CG 3.26Å; Q158-K162 PolarHBondContact O-N 3.4Å; T159-K162 PolarHBondContact O-N 3.07Å; K162-H166 PolarHBondContact O-CD2 3.5Å; K162-H166 VanDerWaalsContact O-CG 3.3Å; K162-H166 PolarHBondContact O-N 2.94Å; K162-H166 VanDerWaalsContact O-N 3.13Å
163	I	80.4	Confident	85	Confident	100 Å²	100	87.9 Å²	87.9	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-70.2	-43.1	177.6	-65.2	169.2	0	0	0	110.5	T159 A160 A161 H166 L167	T159-I163 HydrophobicContact CG2-CD1 4.42Å; T159-I163 WeakPolarHBondContact O-CG1 3.28Å; T159-I163 PolarHBondContact O-N 3.19Å; A160-I163 PolarHBondContact O-N 3.06Å; A161-I163 VanDerWaalsContact C-N 3.28Å; A161-I163 PolarHBondContact O-N 3.44Å; I163-H166 PolarHBondContact O-N 3.47Å; I163-L167 HydrophobicContact CG2-CD1 4.03Å; I163-L167 WeakPolarHBondContact O-CG 3.37Å; I163-L167 PolarHBondContact O-N 2.93Å
164	G	86.2	Confident	84.8	Confident	30 Å²	30	91.9 Å²	91.9	31%	0.309	52%	0.517	S	S	.	.	H	α-helix	trans	-58.8	-47.6	174.9	0	0	0	0	0	111.9	A160 A161 H166 L167 Q168	A160-G164 PolarHBondContact O-N 3.28Å; A161-G164 CarbonylContact O-C 3.27Å; A161-G164 WeakPolarHBondContact O-CA 3.43Å; A161-G164 PolarHBondContact O-N 2.82Å; A161-G164 VanDerWaalsContact O-N 3.08Å; G164-H166 PolarHBondContact O-N 2.97Å; G164-L167 PolarHBondContact O-N 2.9Å; G164-Q168 WeakPolarHBondContact O-CB 3.39Å; G164-Q168 PolarHBondContact O-N 2.87Å
165	D	84	Confident	84.2	Confident	91 Å²	91	93.3 Å²	93.3	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-42	179.1	-65.6	-18.1	0	0	0	111.2	A161 S169	A161-D165 VanDerWaalsContact O-CB 3.3Å; A161-D165 WeakPolarHBondContact O-CB 3.39Å; A161-D165 PolarHBondContact O-N 3.44Å; D165-S169 WeakPolarHBondContact O-CA 3.32Å; D165-S169 WeakPolarHBondContact O-CB 3.42Å; D165-S169 PolarHBondContact O-N 3.45Å
166	H	86.4	Confident	83.6	Confident	141 Å²	141	93.7 Å²	93.7	65%	0.653	52%	0.517	S	S	*	.	H	α-helix	trans	-66.8	-42.9	176.5	-72.1	-36.1	0	0	0	112.3	K162 I163 G164 A170	K162-H166 PolarHBondContact O-CD2 3.5Å; K162-H166 VanDerWaalsContact O-CG 3.3Å; K162-H166 PolarHBondContact O-N 2.94Å; K162-H166 VanDerWaalsContact O-N 3.13Å; I163-H166 PolarHBondContact O-N 3.47Å; G164-H166 PolarHBondContact O-N 2.97Å; H166-A170 WeakPolarHBondContact O-CB 3.32Å; H166-A170 PolarHBondContact O-N 3.27Å; H166-A170 VanDerWaalsContact O-N 3.09Å
167	L	83.3	Confident	83.1	Confident	121 Å²	121	91.3 Å²	91.3	63%	0.634	51%	0.509	S	S	*	.	H	α-helix	trans	-68.9	-45.2	178	-74.1	171	0	0	0	111.7	I163 G164 A170 D171	I163-L167 HydrophobicContact CG2-CD1 4.03Å; I163-L167 WeakPolarHBondContact O-CG 3.37Å; I163-L167 PolarHBondContact O-N 2.93Å; G164-L167 PolarHBondContact O-N 2.9Å; L167-A170 PolarHBondContact O-N 3.39Å; L167-D171 VanDerWaalsContact O-CB 3.3Å; L167-D171 WeakPolarHBondContact O-CB 3.44Å; L167-D171 PolarHBondContact O-N 3.17Å
168	Q	84.5	Confident	82.8	Confident	134 Å²	134	92.6 Å²	92.6	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-66.1	-39.7	177.7	-175	178.1	0.9	0	0	111	G164 A170 D171 A172	G164-Q168 WeakPolarHBondContact O-CB 3.39Å; G164-Q168 PolarHBondContact O-N 2.87Å; Q168-A170 VanDerWaalsContact C-N 3.34Å; Q168-A170 PolarHBondContact O-N 3.36Å; Q168-D171 PolarHBondContact O-N 2.67Å; Q168-A172 WeakPolarHBondContact O-CA 3.49Å; Q168-A172 WeakPolarHBondContact O-CB 3.22Å; Q168-A172 PolarHBondContact O-N 3.39Å
169	S	83.3	Confident	82.3	Confident	72 Å²	72	89.7 Å²	89.7	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-41.2	175.4	-179	0	0	0	0	111.3	D165 Q173	D165-S169 WeakPolarHBondContact O-CA 3.32Å; D165-S169 WeakPolarHBondContact O-CB 3.42Å; D165-S169 PolarHBondContact O-N 3.45Å; S169-Q173 WeakPolarHBondContact O-CB 3.36Å; S169-Q173 PolarHBondContact O-N 2.76Å
170	A	82.2	Confident	81.8	Confident	60 Å²	60	88.2 Å²	88.2	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-68.5	-44.1	178.2	0	0	0	0	0	111.7	H166 L167 Q168 Q173 R174	H166-A170 WeakPolarHBondContact O-CB 3.32Å; H166-A170 PolarHBondContact O-N 3.27Å; H166-A170 VanDerWaalsContact O-N 3.09Å; L167-A170 PolarHBondContact O-N 3.39Å; Q168-A170 VanDerWaalsContact C-N 3.34Å; Q168-A170 PolarHBondContact O-N 3.36Å; A170-Q173 PolarHBondContact O-N 3.14Å; A170-R174 PolarHBondContact O-N 3.11Å
171	D	82.3	Confident	81.3	Confident	101 Å²	101	90 Å²	90	54%	0.54	49%	0.49	S	S	.	.	H	α-helix	trans	-68.1	-45.7	178.5	-168.4	57.4	0	0	0	111.5	L167 Q168 Q173 R174 E175	L167-D171 VanDerWaalsContact O-CB 3.3Å; L167-D171 WeakPolarHBondContact O-CB 3.44Å; L167-D171 PolarHBondContact O-N 3.17Å; Q168-D171 PolarHBondContact O-N 2.67Å; D171-Q173 VanDerWaalsContact C-N 3.3Å; D171-Q173 PolarHBondContact O-N 3.47Å; D171-R174 WeakPolarHBondContact O-CB 3.46Å; D171-R174 PolarHBondContact O-N 3.31Å; D171-R174 VanDerWaalsContact O-N 3.15Å; D171-E175 WeakPolarHBondContact O-CB 3.27Å; D171-E175 PolarHBondContact O-N 2.99Å
172	A	79	Confident	80.9	Confident	45 Å²	45	91 Å²	91	37%	0.372	49%	0.489	S	S	.	.	H	α-helix	trans	-60.3	-39.9	174.6	0	0	0	0	0	111.4	Q168 T176	Q168-A172 WeakPolarHBondContact O-CA 3.49Å; Q168-A172 WeakPolarHBondContact O-CB 3.22Å; Q168-A172 PolarHBondContact O-N 3.39Å; A172-T176 WeakPolarHBondContact O-CA 3.5Å; A172-T176 WeakPolarHBondContact O-CB 3.49Å; A172-T176 PolarHBondContact O-N 2.88Å; A172-T176 PolarHBondContact O-OG1 3.39Å
173	Q	82.9	Confident	80.4	Confident	142 Å²	142	85.1 Å²	85.1	66%	0.664	46%	0.464	S	S	*	.	H	α-helix	trans	-67.2	-38.6	176.9	-170.6	169.5	3	0	0	111.7	S169 A170 D171 A177	S169-Q173 WeakPolarHBondContact O-CB 3.36Å; S169-Q173 PolarHBondContact O-N 2.76Å; A170-Q173 PolarHBondContact O-N 3.14Å; D171-Q173 VanDerWaalsContact C-N 3.3Å; D171-Q173 PolarHBondContact O-N 3.47Å; Q173-A177 VanDerWaalsContact O-CB 3.26Å; Q173-A177 WeakPolarHBondContact O-CB 3.43Å; Q173-A177 PolarHBondContact O-N 2.83Å
174	R	83	Confident	80	Confident	182 Å²	182	84.7 Å²	84.7	69%	0.687	46%	0.462	S	S	*	.	H	α-helix	trans	-65.8	-47.8	175.1	-169.5	-170.4	106.1	141.2	5.9	111.7	A170 D171 A177 S178	A170-R174 PolarHBondContact O-N 3.11Å; D171-R174 WeakPolarHBondContact O-CB 3.46Å; D171-R174 PolarHBondContact O-N 3.31Å; D171-R174 VanDerWaalsContact O-N 3.15Å; R174-A177 PolarHBondContact O-N 2.96Å; R174-S178 PolarHBondContact O-N 3Å
175	E	77	Confident	79.5	Confident	81 Å²	81	88.6 Å²	88.6	38%	0.379	47%	0.47	S	S	.	.	H	α-helix	trans	-66.9	-42.2	-178.9	-173	56.5	-151.3	0	0	110.7	D171 A177 S178 Q179	D171-E175 WeakPolarHBondContact O-CB 3.27Å; D171-E175 PolarHBondContact O-N 2.99Å; E175-A177 PolarHBondContact O-N 3.11Å; E175-S178 PolarHBondContact O-N 3.36Å; E175-Q179 WeakPolarHBondContact O-CB 3.31Å; E175-Q179 VanDerWaalsContact O-CG 3.31Å; E175-Q179 WeakPolarHBondContact O-CG 3.11Å; E175-Q179 PolarHBondContact O-N 3.08Å; E175-Q179 PolarHBondContact OE1-NE2 3.42Å
176	T	76.9	Confident	79	Confident	79 Å²	79	86.7 Å²	86.7	49%	0.485	46%	0.457	S	S	.	.	H	α-helix	trans	-61	-46.2	173.6	-60.1	0	0	0	0	110.2	A172 S178 Q179 T180	A172-T176 WeakPolarHBondContact O-CA 3.5Å; A172-T176 WeakPolarHBondContact O-CB 3.49Å; A172-T176 PolarHBondContact O-N 2.88Å; A172-T176 PolarHBondContact O-OG1 3.39Å; T176-S178 VanDerWaalsContact C-N 3.33Å; T176-S178 PolarHBondContact O-N 2.82Å; T176-Q179 PolarHBondContact O-N 2.81Å; T176-T180 VanDerWaalsContact O-CB 3.28Å; T176-T180 WeakPolarHBondContact O-CB 3.43Å; T176-T180 PolarHBondContact O-N 2.89Å; T176-T180 PolarHBondContact O-OG1 3.12Å
177	A	78.2	Confident	78.3	Confident	52 Å²	52	81.9 Å²	81.9	43%	0.43	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-41.9	177.2	0	0	0	0	0	112.4	Q173 R174 E175 I181	Q173-A177 VanDerWaalsContact O-CB 3.26Å; Q173-A177 WeakPolarHBondContact O-CB 3.43Å; Q173-A177 PolarHBondContact O-N 2.83Å; R174-A177 PolarHBondContact O-N 2.96Å; E175-A177 PolarHBondContact O-N 3.11Å; A177-I181 VanDerWaalsContact O-CG1 3.3Å; A177-I181 WeakPolarHBondContact O-CG1 3.35Å; A177-I181 PolarHBondContact O-N 3.46Å; A177-I181 VanDerWaalsContact O-N 3.14Å
178	S	80.6	Confident	77.7	Confident	60 Å²	60	82.7 Å²	82.7	42%	0.42	44%	0.438	S	S	.	.	H	α-helix	trans	-64.8	-48.5	176.9	-164.3	0	0	0	0	111.6	R174 E175 T176 T180 I181 D182	R174-S178 PolarHBondContact O-N 3Å; E175-S178 PolarHBondContact O-N 3.36Å; T176-S178 VanDerWaalsContact C-N 3.33Å; T176-S178 PolarHBondContact O-N 2.82Å; S178-T180 PolarHBondContact O-N 2.82Å; S178-I181 PolarHBondContact O-N 3.18Å; S178-D182 PolarHBondContact O-N 2.86Å
179	Q	77.1	Confident	77	Confident	70 Å²	70	79.7 Å²	79.7	33%	0.327	42%	0.424	S	S	.	.	H	α-helix	trans	-63.7	-40.2	178.3	-70.5	-177.7	21.5	0	0	111.8	E175 T176 I181 D182 L183 K219	E175-Q179 WeakPolarHBondContact O-CB 3.31Å; E175-Q179 VanDerWaalsContact O-CG 3.31Å; E175-Q179 WeakPolarHBondContact O-CG 3.11Å; E175-Q179 PolarHBondContact O-N 3.08Å; E175-Q179 PolarHBondContact OE1-NE2 3.42Å; T176-Q179 PolarHBondContact O-N 2.81Å; Q179-I181 VanDerWaalsContact C-N 3.31Å; Q179-I181 PolarHBondContact O-N 3.3Å; Q179-D182 PolarHBondContact O-N 2.89Å; Q179-L183 WeakPolarHBondContact O-CB 3.46Å; Q179-L183 WeakPolarHBondContact O-CG 3.48Å; Q179-L183 PolarHBondContact O-N 2.79Å; Q179-K219 VanDerWaalsContact OE1-NZ 3.13Å
180	T	74.2	Confident	76.4	Confident	50 Å²	50	76.3 Å²	76.3	31%	0.307	40%	0.4	S	S	.	.	H	α-helix	trans	-61.1	-39.4	176.2	-62.6	0	0	0	0	111.5	T176 S178 D182 L183 I184	T176-T180 VanDerWaalsContact O-CB 3.28Å; T176-T180 WeakPolarHBondContact O-CB 3.43Å; T176-T180 PolarHBondContact O-N 2.89Å; T176-T180 PolarHBondContact O-OG1 3.12Å; S178-T180 PolarHBondContact O-N 2.82Å; T180-D182 PolarHBondContact O-N 3.47Å; T180-L183 PolarHBondContact O-N 3.16Å; T180-I184 HydrophobicContact CG2-CD1 3.83Å; T180-I184 HydrophobicContact CG2-CG1 4.34Å; T180-I184 VanDerWaalsContact O-CG1 3.23Å; T180-I184 WeakPolarHBondContact O-CG1 3.45Å; T180-I184 PolarHBondContact O-N 2.79Å
181	I	76.8	Confident	75.7	Confident	98 Å²	98	77.2 Å²	77.2	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-62.2	-44.8	176.6	-70.8	164.7	0	0	0	111	A177 S178 Q179 I184 K185	A177-I181 VanDerWaalsContact O-CG1 3.3Å; A177-I181 WeakPolarHBondContact O-CG1 3.35Å; A177-I181 PolarHBondContact O-N 3.46Å; A177-I181 VanDerWaalsContact O-N 3.14Å; S178-I181 PolarHBondContact O-N 3.18Å; Q179-I181 VanDerWaalsContact C-N 3.31Å; Q179-I181 PolarHBondContact O-N 3.3Å; I181-I184 PolarHBondContact O-N 3.2Å; I181-K185 WeakPolarHBondContact O-CG 3.18Å; I181-K185 PolarHBondContact O-N 3.26Å
182	D	75.5	Confident	74.9	Confident	64 Å²	64	73.7 Å²	73.7	34%	0.342	38%	0.384	S	S	.	.	H	α-helix	trans	-70.7	-37.3	179.9	-67.4	-28.4	0	0	0	111.8	S178 Q179 T180 I184 K185 Y186	S178-D182 PolarHBondContact O-N 2.86Å; Q179-D182 PolarHBondContact O-N 2.89Å; T180-D182 PolarHBondContact O-N 3.47Å; D182-I184 PolarHBondContact O-N 3.4Å; D182-K185 WeakPolarHBondContact O-CB 3.36Å; D182-K185 PolarHBondContact O-N 3.29Å; D182-K185 IonicContact OD1-NZ 2.87Å; D182-K185 PolarHBondContact OD1-NZ 2.65Å; D182-Y186 HydrophobicContact CB-CE2 4.32Å; D182-Y186 WeakPolarHBondContact O-CD2 3.3Å; D182-Y186 PolarHBondContact O-N 3.49Å; D182-Y186 VanDerWaalsContact O-N 3.1Å
183	L	74.5	Confident	73.9	Confident	15 Å²	15	74.7 Å²	74.7	8%	0.079	39%	0.388	C	S	.	.	H	α-helix	trans	-61.1	-42.6	171.8	-71.4	167.4	0	0	0	112.2	Q179 T180 K185 Y186 L187 I216 K219 L220 F223	Q179-L183 WeakPolarHBondContact O-CB 3.46Å; Q179-L183 WeakPolarHBondContact O-CG 3.48Å; Q179-L183 PolarHBondContact O-N 2.79Å; T180-L183 PolarHBondContact O-N 3.16Å; L183-K185 VanDerWaalsContact C-N 3.29Å; L183-K185 PolarHBondContact O-N 2.96Å; L183-Y186 PolarHBondContact O-N 2.74Å; L183-L187 WeakPolarHBondContact O-CB 3.19Å; L183-L187 PolarHBondContact O-N 2.98Å; L183-I216 HydrophobicContact CD2-CG2 4.06Å; L183-K219 HydrophobicContact CD1-CB 4.38Å; L183-K219 HydrophobicContact CD1-CD 4.4Å; L183-K219 HydrophobicContact CD2-CB 3.85Å; L183-K219 HydrophobicContact CD2-CD 4.46Å; L183-L220 HydrophobicContact CB-CD2 3.88Å; L183-L220 HydrophobicContact CD2-CD2 3.72Å; L183-L220 HydrophobicContact CD2-CG 3.86Å; L183-L220 HydrophobicContact CG-CD2 4.43Å; L183-L220 WeakPolarHBondContact O-CD2 3.36Å; L183-F223 HydrophobicContact CD1-CD2 4.01Å; L183-F223 HydrophobicContact CD1-CE2 3.52Å; L183-F223 HydrophobicContact CD1-CZ 4.41Å
184	I	71.7	Confident	72.4	Confident	91 Å²	91	72.9 Å²	72.9	47%	0.467	39%	0.389	S	S	.	.	H	α-helix	trans	-61.2	-40.2	177	-70.9	165.3	0	0	0	110.9	T180 I181 D182 L187 M188	T180-I184 HydrophobicContact CG2-CD1 3.83Å; T180-I184 HydrophobicContact CG2-CG1 4.34Å; T180-I184 VanDerWaalsContact O-CG1 3.23Å; T180-I184 WeakPolarHBondContact O-CG1 3.45Å; T180-I184 PolarHBondContact O-N 2.79Å; I181-I184 PolarHBondContact O-N 3.2Å; D182-I184 PolarHBondContact O-N 3.4Å; I184-L187 PolarHBondContact O-N 3.22Å; I184-M188 HydrophobicContact CG2-SD 4.45Å; I184-M188 WeakPolarHBondContact O-CG 3.24Å; I184-M188 PolarHBondContact O-N 3.49Å
185	K	75.2	Confident	71	Confident	111 Å²	111	67.1 Å²	67.1	48%	0.483	39%	0.386	S	S	.	.	H	α-helix	trans	-60.8	-47.6	176	-67.5	171.6	-166.2	154.4	0	111.2	I181 D182 L183 L187 M188 E189	I181-K185 WeakPolarHBondContact O-CG 3.18Å; I181-K185 PolarHBondContact O-N 3.26Å; D182-K185 WeakPolarHBondContact O-CB 3.36Å; D182-K185 PolarHBondContact O-N 3.29Å; D182-K185 IonicContact OD1-NZ 2.87Å; D182-K185 PolarHBondContact OD1-NZ 2.65Å; L183-K185 VanDerWaalsContact C-N 3.29Å; L183-K185 PolarHBondContact O-N 2.96Å; K185-L187 PolarHBondContact O-N 3.28Å; K185-M188 WeakPolarHBondContact O-CB 3.37Å; K185-M188 PolarHBondContact O-N 3.15Å; K185-E189 PolarHBondContact O-N 3.28Å
186	Y	75.2	Confident	69.8	Low	51 Å²	51	67.4 Å²	67.4	20%	0.2	39%	0.39	C	S	.	.	H	α-helix	trans	-65.8	-36.6	177.6	-61.9	-50.5	0	0	0	112.5	D182 L183 M188 E189 F190 F204 I216	D182-Y186 HydrophobicContact CB-CE2 4.32Å; D182-Y186 WeakPolarHBondContact O-CD2 3.3Å; D182-Y186 PolarHBondContact O-N 3.49Å; D182-Y186 VanDerWaalsContact O-N 3.1Å; L183-Y186 PolarHBondContact O-N 2.74Å; Y186-M188 VanDerWaalsContact C-N 3.29Å; Y186-M188 PolarHBondContact O-N 3.32Å; Y186-E189 WeakPolarHBondContact O-CB 3.4Å; Y186-E189 PolarHBondContact O-N 3.31Å; Y186-E189 VanDerWaalsContact O-N 3.13Å; Y186-F190 VanDerWaalsContact O-CD2 3.28Å; Y186-F190 WeakPolarHBondContact O-CD2 3.28Å; Y186-F190 PolarHBondContact O-N 3.14Å; Y186-F190 VanDerWaalsContact O-N 3.11Å; Y186-F204 AromaticContact CD1-CE2 3.68Å; Y186-F204 HydrophobicContact CD1-CE2 3.68Å; Y186-F204 HydrophobicContact CD1-CZ 4.1Å; Y186-F204 HydrophobicContact CE1-CE2 4.21Å; Y186-F204 HydrophobicContact CG-CE2 4.15Å; Y186-F204 HydrophobicContact CG-CZ 4.12Å; Y186-I216 HydrophobicContact CD2-CD1 4.19Å; Y186-I216 HydrophobicContact CD2-CG2 3.58Å; Y186-I216 HydrophobicContact CE2-CD1 3.66Å; Y186-I216 HydrophobicContact CE2-CG2 4.13Å; Y186-I216 HydrophobicContact CG-CG2 4.17Å
187	L	70.4	Confident	68.5	Low	41 Å²	41	65.9 Å²	65.9	22%	0.215	38%	0.379	C	S	.	.	H	α-helix	trans	-61.5	-38.5	174.1	-170.8	64.9	0	0	0	111.8	L183 I184 K185 E189 F190 N191 L220 A224 L246 A249 L253	L183-L187 WeakPolarHBondContact O-CB 3.19Å; L183-L187 PolarHBondContact O-N 2.98Å; I184-L187 PolarHBondContact O-N 3.22Å; K185-L187 PolarHBondContact O-N 3.28Å; L187-E189 VanDerWaalsContact C-N 3.3Å; L187-E189 PolarHBondContact O-N 3.41Å; L187-F190 PolarHBondContact O-N 3.45Å; L187-N191 PolarHBondContact O-N 2.89Å; L187-N191 VanDerWaalsContact O-N 3.08Å; L187-L220 HydrophobicContact CB-CD2 3.97Å; L187-A224 HydrophobicContact CD1-CB 4.33Å; L187-L246 HydrophobicContact CD1-CD1 4.49Å; L187-L246 HydrophobicContact CD2-CD1 4.11Å; L187-A249 HydrophobicContact CD1-CB 4.06Å; L187-L253 HydrophobicContact CD1-CD1 4.01Å
188	M	70.4	Confident	67.2	Low	138 Å²	138	71.9 Å²	71.9	68%	0.68	40%	0.4	S	S	*	.	H	α-helix	trans	-64.3	-35.1	174.9	-72.4	178.7	60	0	0	112.2	I184 K185 Y186 N191	I184-M188 HydrophobicContact CG2-SD 4.45Å; I184-M188 WeakPolarHBondContact O-CG 3.24Å; I184-M188 PolarHBondContact O-N 3.49Å; K185-M188 WeakPolarHBondContact O-CB 3.37Å; K185-M188 PolarHBondContact O-N 3.15Å; Y186-M188 VanDerWaalsContact C-N 3.29Å; Y186-M188 PolarHBondContact O-N 3.32Å; M188-N191 PolarHBondContact O-N 2.85Å
189	E	71	Confident	65.8	Low	71 Å²	71	76.8 Å²	76.8	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-41.9	173.2	-64.2	176.2	-161.8	0	0	111.2	K185 Y186 L187 N191 G192 L200 S201	K185-E189 PolarHBondContact O-N 3.28Å; Y186-E189 WeakPolarHBondContact O-CB 3.4Å; Y186-E189 PolarHBondContact O-N 3.31Å; Y186-E189 VanDerWaalsContact O-N 3.13Å; L187-E189 VanDerWaalsContact C-N 3.3Å; L187-E189 PolarHBondContact O-N 3.41Å; E189-N191 VanDerWaalsContact C-N 3.31Å; E189-N191 PolarHBondContact O-N 3.38Å; E189-G192 PolarHBondContact O-N 2.95Å; E189-L200 HydrophobicContact CB-CD2 4.02Å; E189-S201 PolarHBondContact OE1-OG 3.36Å; E189-S201 WeakPolarHBondContact OE2-CB 3.43Å; E189-S201 PolarHBondContact OE2-N 3.41Å; E189-S201 PolarHBondContact OE2-OG 3.13Å
190	F	69.8	Low	64.8	Low	0 Å²	0	74.4 Å²	74.4	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-72.6	-16.8	176.9	-78.9	-75.8	0	0	0	114.9	Y186 L187 G192 L200 F204 L220 A249 N252 L253 Y256	Y186-F190 VanDerWaalsContact O-CD2 3.28Å; Y186-F190 WeakPolarHBondContact O-CD2 3.28Å; Y186-F190 PolarHBondContact O-N 3.14Å; Y186-F190 VanDerWaalsContact O-N 3.11Å; L187-F190 PolarHBondContact O-N 3.45Å; F190-G192 PolarHBondContact O-N 2.86Å; F190-L200 HydrophobicContact CD1-CD2 4.1Å; F190-L200 HydrophobicContact CD2-CD2 4.18Å; F190-L200 HydrophobicContact CE1-CD1 3.82Å; F190-L200 HydrophobicContact CE1-CD2 3.86Å; F190-L200 HydrophobicContact CE2-CD2 3.95Å; F190-L200 HydrophobicContact CG-CD2 4.25Å; F190-L200 HydrophobicContact CZ-CD1 4.02Å; F190-L200 HydrophobicContact CZ-CD2 3.78Å; F190-F204 HydrophobicContact CE2-CD1 4.38Å; F190-F204 AromaticContact CE2-CE1 3.86Å; F190-F204 HydrophobicContact CE2-CE1 3.86Å; F190-F204 HydrophobicContact CE2-CE2 4.01Å; F190-F204 AromaticContact CE2-CZ 3.66Å; F190-F204 HydrophobicContact CE2-CZ 3.66Å; F190-F204 HydrophobicContact CZ-CD1 4.11Å; F190-F204 AromaticContact CZ-CE1 4Å; F190-F204 HydrophobicContact CZ-CE1 4Å; F190-F204 HydrophobicContact CZ-CE2 4.5Å; F190-F204 HydrophobicContact CZ-CG 4.43Å; F190-F204 HydrophobicContact CZ-CZ 4.2Å; F190-L220 HydrophobicContact CD2-CD1 4Å; F190-L220 HydrophobicContact CE2-CD1 3.97Å; F190-A249 HydrophobicContact CB-CB 4.49Å; F190-N252 HydrophobicContact CD1-CB 4.32Å; F190-N252 PolarHBondContact O-ND2 3.09Å; F190-L253 HydrophobicContact CB-CD2 4.43Å; F190-L253 HydrophobicContact CB-CG 4.13Å; F190-L253 HydrophobicContact CD1-CD2 3.87Å; F190-L253 HydrophobicContact CD1-CG 4.03Å; F190-L253 HydrophobicContact CD2-CD2 3.51Å; F190-L253 HydrophobicContact CD2-CG 4.14Å; F190-L253 HydrophobicContact CE1-CD2 3.94Å; F190-L253 HydrophobicContact CE2-CD2 3.59Å; F190-L253 HydrophobicContact CG-CD2 3.67Å; F190-L253 HydrophobicContact CG-CG 3.84Å; F190-L253 HydrophobicContact CZ-CD2 3.81Å; F190-Y256 HydrophobicContact CE1-CD1 4.24Å; F190-Y256 HydrophobicContact CE1-CD2 4.41Å; F190-Y256 AromaticContact CE1-CG 3.89Å; F190-Y256 HydrophobicContact CE1-CG 3.89Å; F190-Y256 AromaticContact CZ-CD1 3.98Å; F190-Y256 HydrophobicContact CZ-CD1 3.98Å; F190-Y256 HydrophobicContact CZ-CE1 4.45Å; F190-Y256 HydrophobicContact CZ-CG 4.05Å
191	N	69.1	Low	64.1	Low	79 Å²	79	73.8 Å²	73.8	42%	0.422	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	4.9	175.9	-161.2	14.1	0	0	0	113	L187 M188 E189 G245 A249	L187-N191 PolarHBondContact O-N 2.89Å; L187-N191 VanDerWaalsContact O-N 3.08Å; M188-N191 PolarHBondContact O-N 2.85Å; E189-N191 VanDerWaalsContact C-N 3.31Å; E189-N191 PolarHBondContact O-N 3.38Å; N191-G245 VanDerWaalsContact OD1-CA 3.22Å; N191-G245 WeakPolarHBondContact OD1-CA 3.43Å; N191-G245 PolarHBondContact OD1-O 3.41Å; N191-A249 HydrophobicContact CB-CB 4.2Å
192	G	64.7	Low	63.3	Low	27 Å²	27	72.8 Å²	72.8	28%	0.278	41%	0.41	S	S	.	.	S	Bend	trans	-66.8	163.8	172.7	0	0	0	0	0	113.3	E189 F190 N252	E189-G192 PolarHBondContact O-N 2.95Å; F190-G192 PolarHBondContact O-N 2.86Å; G192-N252 PolarHBondContact O-ND2 3.36Å
193	S	56.9	Low	62.6	Low	66 Å²	66	70.4 Å²	70.4	46%	0.462	40%	0.397	S	S	.	.			trans	-60.7	145.7	176.6	80.2	0	0	0	0	110.2	G195 D196	S193-G195 PolarHBondContact O-N 2.82Å; S193-D196 PolarHBondContact O-N 3.26Å; S193-D196 PolarHBondContact OG-OD2 2.8Å
194	P	52.9	Low	62.2	Low	105 Å²	105	70 Å²	70	68%	0.682	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-9.3	-171.4	16.6	-29.2	0	0	0	115.7
195	G	52	Low	61.8	Low	60 Å²	60	69.2 Å²	69.2	62%	0.619	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-18.6	173.2	0	0	0	0	0	115.4	S193 L197	S193-G195 PolarHBondContact O-N 2.82Å; G195-L197 VanDerWaalsContact C-N 3.28Å; G195-L197 PolarHBondContact O-N 2.98Å
196	D	52.2	Low	61.3	Low	87 Å²	87	66.8 Å²	66.8	47%	0.465	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-88.8	9.9	-175.5	-66.8	-39.5	0	0	0	113.2	S193 M198 E199	S193-D196 PolarHBondContact O-N 3.26Å; S193-D196 PolarHBondContact OG-OD2 2.8Å; D196-M198 PolarHBondContact O-N 3.27Å; D196-E199 PolarHBondContact O-N 3.08Å
197	L	49.2	Very low	60.9	Low	47 Å²	47	68.4 Å²	68.4	25%	0.246	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-58.3	-18.3	175.3	-137.6	79.1	0	0	0	112.8	G195 E199 L200 N252	G195-L197 VanDerWaalsContact C-N 3.28Å; G195-L197 PolarHBondContact O-N 2.98Å; L197-E199 PolarHBondContact O-N 3.2Å; L197-L200 HydrophobicContact CD1-CD1 4.36Å; L197-L200 HydrophobicContact CG-CD1 3.89Å; L197-N252 HydrophobicContact CD1-CB 4.18Å
198	M	50.9	Low	60.8	Low	178 Å²	178	70.9 Å²	70.9	88%	0.877	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-69.2	-14.5	174.5	-69.2	-88.1	156.1	0	0	113.7	D196	D196-M198 PolarHBondContact O-N 3.27Å
199	E	51.9	Low	60.9	Low	164 Å²	164	70 Å²	70	77%	0.766	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-107	15.6	-178.5	-63.4	-165.1	167.4	0	0	114.2	D196 L197	D196-E199 PolarHBondContact O-N 3.08Å; L197-E199 PolarHBondContact O-N 3.2Å
200	L	56.8	Low	61.1	Low	19 Å²	19	67 Å²	67	10%	0.099	40%	0.398	C	S	.	.	S	Bend	trans	-57.8	147.3	171.3	-74.7	166.4	0	0	0	110.9	E189 F190 L197 A202 F204 Y256	E189-L200 HydrophobicContact CB-CD2 4.02Å; F190-L200 HydrophobicContact CD1-CD2 4.1Å; F190-L200 HydrophobicContact CD2-CD2 4.18Å; F190-L200 HydrophobicContact CE1-CD1 3.82Å; F190-L200 HydrophobicContact CE1-CD2 3.86Å; F190-L200 HydrophobicContact CE2-CD2 3.95Å; F190-L200 HydrophobicContact CG-CD2 4.25Å; F190-L200 HydrophobicContact CZ-CD1 4.02Å; F190-L200 HydrophobicContact CZ-CD2 3.78Å; L197-L200 HydrophobicContact CD1-CD1 4.36Å; L197-L200 HydrophobicContact CG-CD1 3.89Å; L200-A202 PolarHBondContact O-N 2.93Å; L200-F204 HydrophobicContact CB-CB 3.96Å; L200-F204 HydrophobicContact CB-CD2 3.99Å; L200-F204 HydrophobicContact CB-CG 4.33Å; L200-F204 HydrophobicContact CD1-CB 4.22Å; L200-F204 HydrophobicContact CD2-CD2 4.15Å; L200-Y256 HydrophobicContact CD1-CD2 4.34Å
201	S	58.7	Low	61.2	Low	38 Å²	38	69 Å²	69	27%	0.266	42%	0.415	S	S	.	.			trans	-42.9	141.2	172.3	-84	0	0	0	0	111.7	E189 L203 F204	E189-S201 PolarHBondContact OE1-OG 3.36Å; E189-S201 WeakPolarHBondContact OE2-CB 3.43Å; E189-S201 PolarHBondContact OE2-N 3.41Å; E189-S201 PolarHBondContact OE2-OG 3.13Å; S201-L203 PolarHBondContact O-N 3.48Å; S201-F204 PolarHBondContact O-N 2.94Å
202	A	60.8	Low	61.4	Low	77 Å²	77	70.2 Å²	70.2	64%	0.636	42%	0.418	S	S	*	.	H	α-helix	trans	-51.1	-22.1	-178.3	0	0	0	0	0	114.1	L200 F204 S205 D206	L200-A202 PolarHBondContact O-N 2.93Å; A202-F204 VanDerWaalsContact C-N 3.28Å; A202-F204 PolarHBondContact O-N 3.16Å; A202-S205 PolarHBondContact O-N 3.25Å; A202-D206 WeakPolarHBondContact O-CB 3.34Å; A202-D206 PolarHBondContact O-N 2.83Å
203	L	59.5	Low	62	Low	14 Å²	14	69 Å²	69	7%	0.073	41%	0.405	C	S	.	.	H	α-helix	trans	-52.2	-41.9	169.7	-166	77.3	0	0	0	113.4	S201 R209 E212 A213 I216	S201-L203 PolarHBondContact O-N 3.48Å; L203-R209 HydrophobicContact CD1-CB 4.13Å; L203-E212 HydrophobicContact CD1-CB 3.98Å; L203-E212 WeakPolarHBondContact CD1-OE2 3.41Å; L203-A213 WeakPolarHBondContact O-CB 3.34Å; L203-I216 HydrophobicContact CD2-CD1 3.47Å; L203-I216 VanDerWaalsContact CD2-CD1 3.47Å
204	F	66.8	Low	62.9	Low	6 Å²	6	65.9 Å²	65.9	3%	0.026	38%	0.383	C	S	.	.	H	α-helix	trans	-83.8	-18.8	-175.9	-62.3	-70.9	0	0	0	113.6	Y186 F190 L200 S201 A202 A213 I216 Y256	Y186-F204 AromaticContact CD1-CE2 3.68Å; Y186-F204 HydrophobicContact CD1-CE2 3.68Å; Y186-F204 HydrophobicContact CD1-CZ 4.1Å; Y186-F204 HydrophobicContact CE1-CE2 4.21Å; Y186-F204 HydrophobicContact CG-CE2 4.15Å; Y186-F204 HydrophobicContact CG-CZ 4.12Å; F190-F204 HydrophobicContact CE2-CD1 4.38Å; F190-F204 AromaticContact CE2-CE1 3.86Å; F190-F204 HydrophobicContact CE2-CE1 3.86Å; F190-F204 HydrophobicContact CE2-CE2 4.01Å; F190-F204 AromaticContact CE2-CZ 3.66Å; F190-F204 HydrophobicContact CE2-CZ 3.66Å; F190-F204 HydrophobicContact CZ-CD1 4.11Å; F190-F204 AromaticContact CZ-CE1 4Å; F190-F204 HydrophobicContact CZ-CE1 4Å; F190-F204 HydrophobicContact CZ-CE2 4.5Å; F190-F204 HydrophobicContact CZ-CG 4.43Å; F190-F204 HydrophobicContact CZ-CZ 4.2Å; L200-F204 HydrophobicContact CB-CB 3.96Å; L200-F204 HydrophobicContact CB-CD2 3.99Å; L200-F204 HydrophobicContact CB-CG 4.33Å; L200-F204 HydrophobicContact CD1-CB 4.22Å; L200-F204 HydrophobicContact CD2-CD2 4.15Å; S201-F204 PolarHBondContact O-N 2.94Å; A202-F204 VanDerWaalsContact C-N 3.28Å; A202-F204 PolarHBondContact O-N 3.16Å; F204-A213 HydrophobicContact CD1-CB 4.06Å; F204-I216 HydrophobicContact CE1-CG2 4.34Å; F204-I216 HydrophobicContact CZ-CG2 3.99Å; F204-Y256 WeakPolarHBondContact CA-OH 3.13Å; F204-Y256 HydrophobicContact CB-CE2 4.07Å; F204-Y256 AromaticContact CD1-CE1 3.73Å; F204-Y256 HydrophobicContact CD1-CE1 3.73Å; F204-Y256 HydrophobicContact CD1-CE2 4.44Å; F204-Y256 AromaticContact CD1-CZ 3.64Å; F204-Y256 WeakPolarHBondContact CD1-OH 3.25Å; F204-Y256 HydrophobicContact CE1-CE1 4.36Å; F204-Y256 PolarHBondContact O-OH 3.19Å
205	S	64.3	Low	64	Low	74 Å²	74	63 Å²	63	52%	0.517	37%	0.365	S	S	.	.	H	α-helix	trans	-95.3	-23.3	177.6	-46.5	0	0	0	0	113.6	A202	A202-S205 PolarHBondContact O-N 3.25Å
206	D	64.6	Low	65.2	Low	61 Å²	61	61.6 Å²	61.6	33%	0.326	34%	0.344	S	S	.	.			trans	-83.6	116.9	-172.6	-171.6	-11.6	0	0	0	112.8	A202 S208 R209	A202-D206 WeakPolarHBondContact O-CB 3.34Å; A202-D206 PolarHBondContact O-N 2.83Å; D206-S208 PolarHBondContact O-N 3.46Å; D206-S208 WeakPolarHBondContact OD1-CB 3.22Å; D206-S208 PolarHBondContact OD1-N 2.81Å; D206-S208 PolarHBondContact OD1-OG 2.81Å; D206-S208 PolarHBondContact OD2-OG 3.35Å; D206-S208 VanDerWaalsContact OD2-OG 3.04Å; D206-R209 HydrophobicContact CB-CG 4.42Å; D206-R209 PolarHBondContact O-N 3.26Å; D206-R209 VanDerWaalsContact O-N 3.07Å; D206-R209 IonicContact OD2-NE 3.77Å
207	D	65.2	Low	66.4	Low	85 Å²	85	57.5 Å²	57.5	46%	0.455	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.2	177.7	-83.5	20.5	0	0	0	114.3	V210 R263 R267	D207-V210 VanDerWaalsContact O-CG2 3.32Å; D207-V210 WeakPolarHBondContact O-CG2 3.25Å; D207-R263 IonicContact OD1-CZ 2.75Å; D207-R263 IonicContact OD1-NE 2.72Å; D207-R263 IonicContact OD1-NH1 3.32Å; D207-R263 PolarHBondContact OD1-NH1 3.33Å; D207-R263 IonicContact OD1-NH2 3.31Å; D207-R263 PolarHBondContact OD1-NH2 2.79Å; D207-R267 PolarHBondContact O-NH1 2.94Å; D207-R267 VanDerWaalsContact O-NH1 3.07Å
208	S	69.6	Low	67.6	Low	92 Å²	92	57.3 Å²	57.3	64%	0.643	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-20.4	176.1	71.1	0	0	0	0	113	D206	D206-S208 PolarHBondContact O-N 3.46Å; D206-S208 WeakPolarHBondContact OD1-CB 3.22Å; D206-S208 PolarHBondContact OD1-N 2.81Å; D206-S208 PolarHBondContact OD1-OG 2.81Å; D206-S208 PolarHBondContact OD2-OG 3.35Å; D206-S208 VanDerWaalsContact OD2-OG 3.04Å
209	R	71.6	Confident	68.9	Low	121 Å²	121	52.5 Å²	52.5	46%	0.457	29%	0.294	S	S	.	.	S	Bend	trans	-110.5	18.5	-175.9	-57	-169	-170.5	-161	1.1	113.9	L203 D206 A211 E212 A213	L203-R209 HydrophobicContact CD1-CB 4.13Å; D206-R209 HydrophobicContact CB-CG 4.42Å; D206-R209 PolarHBondContact O-N 3.26Å; D206-R209 VanDerWaalsContact O-N 3.07Å; D206-R209 IonicContact OD2-NE 3.77Å; R209-A211 PolarHBondContact O-N 2.95Å; R209-A211 VanDerWaalsContact O-N 3.13Å; R209-E212 WeakPolarHBondContact O-CB 3.05Å; R209-E212 PolarHBondContact O-N 2.8Å; R209-A213 PolarHBondContact O-N 3.21Å
210	V	75.2	Confident	70.1	Confident	6 Å²	6	44.9 Å²	44.9	4%	0.036	26%	0.258	C	S	.	.	H	α-helix	trans	-55.4	-35.5	-175.9	174.1	0	0	0	0	113.1	D207 A214 L260 R263 L264 I286	D207-V210 VanDerWaalsContact O-CG2 3.32Å; D207-V210 WeakPolarHBondContact O-CG2 3.25Å; V210-A214 WeakPolarHBondContact O-CB 3.47Å; V210-A214 PolarHBondContact O-N 2.86Å; V210-L260 HydrophobicContact CG1-CD1 3.97Å; V210-R263 VanDerWaalsContact CG2-NH2 3.31Å; V210-L264 HydrophobicContact CG1-CD1 4.03Å; V210-L264 HydrophobicContact CG1-CD2 3.5Å; V210-L264 VanDerWaalsContact CG1-CD2 3.5Å; V210-L264 HydrophobicContact CG1-CG 3.89Å; V210-I286 HydrophobicContact CG1-CD1 4.43Å
211	A	72.1	Confident	70.9	Confident	43 Å²	43	45.8 Å²	45.8	36%	0.355	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-39.6	175.7	0	0	0	0	0	113	R209 S215 I286	R209-A211 PolarHBondContact O-N 2.95Å; R209-A211 VanDerWaalsContact O-N 3.13Å; A211-S215 PolarHBondContact O-N 2.83Å; A211-I286 HydrophobicContact CB-CD1 3.73Å; A211-I286 HydrophobicContact CB-CG1 3.85Å
212	E	74.2	Confident	71.7	Confident	105 Å²	105	46.1 Å²	46.1	49%	0.491	26%	0.262	S	S	.	.	H	α-helix	trans	-72.7	-47.6	178.4	-64.8	178.8	-174.8	0	0	110.6	L203 R209 A214 S215 I216	L203-E212 HydrophobicContact CD1-CB 3.98Å; L203-E212 WeakPolarHBondContact CD1-OE2 3.41Å; R209-E212 WeakPolarHBondContact O-CB 3.05Å; R209-E212 PolarHBondContact O-N 2.8Å; E212-A214 VanDerWaalsContact C-N 3.26Å; E212-A214 PolarHBondContact O-N 3.38Å; E212-S215 PolarHBondContact O-N 3.33Å; E212-I216 WeakPolarHBondContact O-CG1 3.44Å; E212-I216 PolarHBondContact O-N 3.17Å
213	A	77.1	Confident	72.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-56	-43.1	176.1	0	0	0	0	0	111.8	L203 F204 R209 I216 A217	L203-A213 WeakPolarHBondContact O-CB 3.34Å; F204-A213 HydrophobicContact CD1-CB 4.06Å; R209-A213 PolarHBondContact O-N 3.21Å; A213-I216 PolarHBondContact O-N 2.86Å; A213-A217 VanDerWaalsContact O-CB 3.27Å; A213-A217 WeakPolarHBondContact O-CB 3.35Å; A213-A217 PolarHBondContact O-N 3.3Å
214	A	74.3	Confident	72.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-49.8	177.6	0	0	0	0	0	113.3	V210 E212 I216 A217 Q218 L260 I286 F290	V210-A214 WeakPolarHBondContact O-CB 3.47Å; V210-A214 PolarHBondContact O-N 2.86Å; E212-A214 VanDerWaalsContact C-N 3.26Å; E212-A214 PolarHBondContact O-N 3.38Å; A214-I216 VanDerWaalsContact C-N 3.31Å; A214-I216 PolarHBondContact O-N 2.87Å; A214-A217 PolarHBondContact O-N 3.18Å; A214-Q218 WeakPolarHBondContact O-CB 3.3Å; A214-Q218 PolarHBondContact O-N 3.33Å; A214-L260 HydrophobicContact CB-CD2 4.01Å; A214-I286 HydrophobicContact CB-CG2 3.55Å; A214-F290 HydrophobicContact CB-CE2 3.32Å; A214-F290 HydrophobicContact CB-CZ 3.41Å; A214-F290 VanDerWaalsContact CB-CZ 3.41Å
215	S	77.9	Confident	72.8	Confident	44 Å²	44	50.3 Å²	50.3	31%	0.308	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-40.8	180	-173	0	0	0	0	111.7	A211 E212 K219	A211-S215 PolarHBondContact O-N 2.83Å; E212-S215 PolarHBondContact O-N 3.33Å; S215-K219 WeakPolarHBondContact O-CG 3.45Å; S215-K219 PolarHBondContact O-N 2.81Å; S215-K219 VanDerWaalsContact O-N 3.15Å
216	I	76.7	Confident	72.9	Confident	32 Å²	32	52.8 Å²	52.8	16%	0.164	27%	0.271	C	S	.	.	H	α-helix	trans	-69.6	-48.1	178	-66.2	-174	0	0	0	111	L183 Y186 L203 F204 E212 A213 A214 Q218 K219 L220	L183-I216 HydrophobicContact CD2-CG2 4.06Å; Y186-I216 HydrophobicContact CD2-CD1 4.19Å; Y186-I216 HydrophobicContact CD2-CG2 3.58Å; Y186-I216 HydrophobicContact CE2-CD1 3.66Å; Y186-I216 HydrophobicContact CE2-CG2 4.13Å; Y186-I216 HydrophobicContact CG-CG2 4.17Å; L203-I216 HydrophobicContact CD2-CD1 3.47Å; L203-I216 VanDerWaalsContact CD2-CD1 3.47Å; F204-I216 HydrophobicContact CE1-CG2 4.34Å; F204-I216 HydrophobicContact CZ-CG2 3.99Å; E212-I216 WeakPolarHBondContact O-CG1 3.44Å; E212-I216 PolarHBondContact O-N 3.17Å; A213-I216 PolarHBondContact O-N 2.86Å; A214-I216 VanDerWaalsContact C-N 3.31Å; A214-I216 PolarHBondContact O-N 2.87Å; I216-Q218 VanDerWaalsContact C-N 3.32Å; I216-Q218 PolarHBondContact O-N 3.18Å; I216-K219 PolarHBondContact O-N 3Å; I216-L220 HydrophobicContact CG2-CD1 3.81Å; I216-L220 HydrophobicContact CG2-CG 4.21Å; I216-L220 VanDerWaalsContact O-CG 3.26Å; I216-L220 WeakPolarHBondContact O-CG 3.34Å; I216-L220 PolarHBondContact O-N 2.86Å
217	A	77.2	Confident	72.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58	-41.9	179	0	0	0	0	0	112.3	A213 A214 L220 R221 Y256	A213-A217 VanDerWaalsContact O-CB 3.27Å; A213-A217 WeakPolarHBondContact O-CB 3.35Å; A213-A217 PolarHBondContact O-N 3.3Å; A214-A217 PolarHBondContact O-N 3.18Å; A217-L220 PolarHBondContact O-N 3.16Å; A217-R221 WeakPolarHBondContact O-CB 3.29Å; A217-R221 PolarHBondContact O-N 3.45Å; A217-Y256 HydrophobicContact CB-CD1 3.96Å; A217-Y256 HydrophobicContact CB-CE1 3.93Å
218	Q	73.7	Confident	72.1	Confident	43 Å²	43	52.8 Å²	52.8	20%	0.201	27%	0.27	C	S	.	.	H	α-helix	trans	-67.3	-41.1	177.2	-173.2	61.1	42.9	0	0	112.3	A214 I216 R221 S222 F290	A214-Q218 WeakPolarHBondContact O-CB 3.3Å; A214-Q218 PolarHBondContact O-N 3.33Å; I216-Q218 VanDerWaalsContact C-N 3.32Å; I216-Q218 PolarHBondContact O-N 3.18Å; Q218-R221 PolarHBondContact O-N 3.02Å; Q218-S222 PolarHBondContact O-N 3.27Å; Q218-S222 PolarHBondContact O-OG 3.47Å; Q218-F290 HydrophobicContact CB-CE1 4.36Å
219	K	77.9	Confident	71.3	Confident	78 Å²	78	51.4 Å²	51.4	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-59.6	-49.5	173	-79.3	179.4	179.7	-176.6	0	110.5	Q179 L183 S215 I216 R221 S222 F223	Q179-K219 VanDerWaalsContact OE1-NZ 3.13Å; L183-K219 HydrophobicContact CD1-CB 4.38Å; L183-K219 HydrophobicContact CD1-CD 4.4Å; L183-K219 HydrophobicContact CD2-CB 3.85Å; L183-K219 HydrophobicContact CD2-CD 4.46Å; S215-K219 WeakPolarHBondContact O-CG 3.45Å; S215-K219 PolarHBondContact O-N 2.81Å; S215-K219 VanDerWaalsContact O-N 3.15Å; I216-K219 PolarHBondContact O-N 3Å; K219-R221 VanDerWaalsContact C-N 3.32Å; K219-R221 PolarHBondContact O-N 2.95Å; K219-S222 PolarHBondContact O-N 3.46Å; K219-S222 PolarHBondContact O-OG 2.98Å; K219-F223 WeakPolarHBondContact O-CD2 3.26Å; K219-F223 PolarHBondContact O-N 3.18Å
220	L	77.7	Confident	70.3	Confident	3 Å²	3	55 Å²	55	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-57.4	-44.1	177.9	-68.2	171.3	0	0	0	112.2	L183 L187 F190 I216 A217 F223 A224 L253	L183-L220 HydrophobicContact CB-CD2 3.88Å; L183-L220 HydrophobicContact CD2-CD2 3.72Å; L183-L220 HydrophobicContact CD2-CG 3.86Å; L183-L220 HydrophobicContact CG-CD2 4.43Å; L183-L220 WeakPolarHBondContact O-CD2 3.36Å; L187-L220 HydrophobicContact CB-CD2 3.97Å; F190-L220 HydrophobicContact CD2-CD1 4Å; F190-L220 HydrophobicContact CE2-CD1 3.97Å; I216-L220 HydrophobicContact CG2-CD1 3.81Å; I216-L220 HydrophobicContact CG2-CG 4.21Å; I216-L220 VanDerWaalsContact O-CG 3.26Å; I216-L220 WeakPolarHBondContact O-CG 3.34Å; I216-L220 PolarHBondContact O-N 2.86Å; A217-L220 PolarHBondContact O-N 3.16Å; L220-F223 PolarHBondContact O-N 3.49Å; L220-A224 VanDerWaalsContact O-CB 3.31Å; L220-A224 WeakPolarHBondContact O-CB 3.41Å; L220-A224 PolarHBondContact O-N 3.15Å; L220-L253 HydrophobicContact CB-CD1 3.81Å; L220-L253 HydrophobicContact CB-CD2 3.93Å; L220-L253 HydrophobicContact CD1-CD2 4.11Å
221	R	74.1	Confident	69	Low	38 Å²	38	60.2 Å²	60.2	14%	0.143	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-46.6	177.4	-160.6	-178.1	85.1	-153.1	2.6	111.6	A217 Q218 K219 F223 A224 E225	A217-R221 WeakPolarHBondContact O-CB 3.29Å; A217-R221 PolarHBondContact O-N 3.45Å; Q218-R221 PolarHBondContact O-N 3.02Å; K219-R221 VanDerWaalsContact C-N 3.32Å; K219-R221 PolarHBondContact O-N 2.95Å; R221-F223 PolarHBondContact O-N 3.36Å; R221-A224 PolarHBondContact O-N 3.49Å; R221-E225 WeakPolarHBondContact CD-OE1 3.38Å; R221-E225 HydrophobicContact CG-CG 4.35Å; R221-E225 WeakPolarHBondContact CG-OE1 3.31Å; R221-E225 IonicContact NE-OE1 3.07Å; R221-E225 PolarHBondContact NE-OE1 3.44Å; R221-E225 VanDerWaalsContact NE-OE1 3.12Å; R221-E225 WeakPolarHBondContact O-CB 3.38Å; R221-E225 WeakPolarHBondContact O-CG 3.29Å; R221-E225 PolarHBondContact O-N 3.34Å
222	S	75.3	Confident	67.6	Low	45 Å²	45	61.8 Å²	61.8	32%	0.315	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-42.5	176.7	63.3	0	0	0	0	112.7	Q218 K219 E226	Q218-S222 PolarHBondContact O-N 3.27Å; Q218-S222 PolarHBondContact O-OG 3.47Å; K219-S222 PolarHBondContact O-N 3.46Å; K219-S222 PolarHBondContact O-OG 2.98Å; S222-E226 WeakPolarHBondContact O-CB 3.31Å; S222-E226 WeakPolarHBondContact O-CG 3.46Å; S222-E226 PolarHBondContact O-N 2.76Å
223	F	71.3	Confident	66	Low	98 Å²	98	61.3 Å²	61.3	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-42.4	175.6	-82.4	-66	0	0	0	112.2	L183 K219 L220 R221 D227	L183-F223 HydrophobicContact CD1-CD2 4.01Å; L183-F223 HydrophobicContact CD1-CE2 3.52Å; L183-F223 HydrophobicContact CD1-CZ 4.41Å; K219-F223 WeakPolarHBondContact O-CD2 3.26Å; K219-F223 PolarHBondContact O-N 3.18Å; L220-F223 PolarHBondContact O-N 3.49Å; R221-F223 PolarHBondContact O-N 3.36Å; F223-D227 PolarHBondContact O-N 3.31Å
224	A	70.1	Confident	64	Low	1 Å²	1	66.1 Å²	66.1	1%	0.008	38%	0.376	C	S	.	.	H	α-helix	trans	-74.4	-34.1	-177.6	0	0	0	0	0	112.7	L187 L220 R221 I228 L246 V250	L187-A224 HydrophobicContact CD1-CB 4.33Å; L220-A224 VanDerWaalsContact O-CB 3.31Å; L220-A224 WeakPolarHBondContact O-CB 3.41Å; L220-A224 PolarHBondContact O-N 3.15Å; R221-A224 PolarHBondContact O-N 3.49Å; A224-I228 WeakPolarHBondContact O-CG1 3.38Å; A224-I228 PolarHBondContact O-N 3.36Å; A224-L246 HydrophobicContact CB-CD1 3.78Å; A224-L246 HydrophobicContact CB-CG 4.28Å; A224-V250 HydrophobicContact CB-CG2 3.34Å
225	E	69.8	Low	62.1	Low	87 Å²	87	73.2 Å²	73.2	41%	0.407	42%	0.419	S	S	.	.	H	α-helix	trans	-69.7	-40.1	173.6	-74.7	172.7	-174.9	0	0	112.5	R221 D227 I228 G229	R221-E225 WeakPolarHBondContact CD-OE1 3.38Å; R221-E225 HydrophobicContact CG-CG 4.35Å; R221-E225 WeakPolarHBondContact CG-OE1 3.31Å; R221-E225 IonicContact NE-OE1 3.07Å; R221-E225 PolarHBondContact NE-OE1 3.44Å; R221-E225 VanDerWaalsContact NE-OE1 3.12Å; R221-E225 WeakPolarHBondContact O-CB 3.38Å; R221-E225 WeakPolarHBondContact O-CG 3.29Å; R221-E225 PolarHBondContact O-N 3.34Å; E225-D227 VanDerWaalsContact C-N 3.34Å; E225-D227 PolarHBondContact O-N 3.2Å; E225-I228 PolarHBondContact O-N 2.92Å; E225-G229 PolarHBondContact O-N 3.44Å
226	E	65.8	Low	60.1	Low	126 Å²	126	75.6 Å²	75.6	59%	0.589	44%	0.442	S	S	*	.	H	α-helix	trans	-62.2	-37.6	179.5	-82	-172	176.9	0	0	113	S222 R230	S222-E226 WeakPolarHBondContact O-CB 3.31Å; S222-E226 WeakPolarHBondContact O-CG 3.46Å; S222-E226 PolarHBondContact O-N 2.76Å; E226-R230 PolarHBondContact O-N 2.79Å
227	D	57.8	Low	58.3	Low	90 Å²	90	79.3 Å²	79.3	48%	0.481	48%	0.477	S	S	.	.	H	α-helix	trans	-77.1	-31.6	179.1	-94.2	-17.6	0	0	0	113	F223 E225 Q231 L246	F223-D227 PolarHBondContact O-N 3.31Å; E225-D227 VanDerWaalsContact C-N 3.34Å; E225-D227 PolarHBondContact O-N 3.2Å; D227-Q231 PolarHBondContact O-N 2.81Å; D227-L246 HydrophobicContact CB-CD2 3.82Å
228	I	55	Low	56.4	Low	55 Å²	55	82.8 Å²	82.8	28%	0.282	51%	0.513	S	S	.	.	H	α-helix	trans	-67.6	-43	172.9	-66.7	176	0	0	0	110.6	A224 E225 R230 Q231 G232 L246 E247 V250	A224-I228 WeakPolarHBondContact O-CG1 3.38Å; A224-I228 PolarHBondContact O-N 3.36Å; E225-I228 PolarHBondContact O-N 2.92Å; I228-R230 PolarHBondContact O-N 2.96Å; I228-Q231 PolarHBondContact O-N 3.43Å; I228-Q231 VanDerWaalsContact O-N 3.14Å; I228-G232 PolarHBondContact O-N 3.44Å; I228-L246 HydrophobicContact CD1-CD2 4.48Å; I228-L246 HydrophobicContact CD1-CG 4.31Å; I228-L246 HydrophobicContact CG1-CD2 3.82Å; I228-L246 HydrophobicContact CG1-CG 4.17Å; I228-E247 HydrophobicContact CD1-CG 4.31Å; I228-V250 HydrophobicContact CD1-CB 4.19Å; I228-V250 HydrophobicContact CD1-CG2 3.61Å
229	G	52.7	Low	54.6	Low	63 Å²	63	87.9 Å²	87.9	65%	0.649	54%	0.541	S	S	*	.	H	α-helix	trans	-61.5	-29.5	178.8	0	0	0	0	0	113.9	E225	E225-G229 PolarHBondContact O-N 3.44Å
230	R	51.5	Low	52.9	Low	197 Å²	197	89.2 Å²	89.2	74%	0.743	57%	0.567	S	S	*	*	H	α-helix	trans	-78.4	-25	176.5	-73.5	-175.9	179.1	-169.5	3.8	113.9	E226 I228	E226-R230 PolarHBondContact O-N 2.79Å; I228-R230 PolarHBondContact O-N 2.96Å
231	Q	46.6	Very low	51.3	Low	116 Å²	116	93.5 Å²	93.5	54%	0.542	59%	0.594	S	S	.	*	H	α-helix	trans	-98.1	-8	-175.5	-69.8	-175.5	6.4	0	0	114.4	D227 I228 A233	D227-Q231 PolarHBondContact O-N 2.81Å; I228-Q231 PolarHBondContact O-N 3.43Å; I228-Q231 VanDerWaalsContact O-N 3.14Å; Q231-A233 PolarHBondContact O-N 3.16Å; Q231-A233 VanDerWaalsContact O-N 3.14Å
232	G	43.3	Very low	50.1	Low	75 Å²	75	96.6 Å²	96.6	77%	0.773	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-9.9	173.9	0	0	0	0	0	115.7	I228	I228-G232 PolarHBondContact O-N 3.44Å
233	A	41.1	Very low	49.1	Very low	95 Å²	95	95 Å²	95	79%	0.785	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	3.4	-174.4	0	0	0	0	0	115.9	Q231	Q231-A233 PolarHBondContact O-N 3.16Å; Q231-A233 VanDerWaalsContact O-N 3.14Å
234	S	35	Very low	48.5	Very low	103 Å²	103	99.7 Å²	99.7	72%	0.72	62%	0.624	S	S	*	*			trans	-149.8	91.8	176.5	-164.9	0	0	0	0	114.1	A236	S234-A236 PolarHBondContact O-N 2.82Å
235	T	33.3	Very low	48.2	Very low	148 Å²	148	100.6 Å²	100.6	91%	0.908	63%	0.633	S	S	*	*			trans	-56.4	110.4	163.5	46.7	0	0	0	0	111.6
236	A	36.8	Very low	48.2	Very low	94 Å²	94	97.9 Å²	97.9	78%	0.777	62%	0.621	S	S	*	*			trans	-143.1	121.3	158.1	0	0	0	0	0	109.7	S234	S234-A236 PolarHBondContact O-N 2.82Å
237	A	37.9	Very low	48.4	Very low	111 Å²	111	97.2 Å²	97.2	92%	0.917	62%	0.618	S	S	*	*			trans	-59.6	147.5	-175.8	0	0	0	0	0	113.7
238	G	37.6	Very low	49.2	Very low	72 Å²	72	95.7 Å²	95.7	74%	0.742	61%	0.612	S	S	*	*			trans	127.3	-8.2	138.1	0	0	0	0	0	119
239	N	36.6	Very low	50.1	Low	150 Å²	150	93.1 Å²	93.1	80%	0.802	60%	0.599	S	S	*	*	S	Bend	trans	-129.7	133.1	179.3	-73.4	-24.8	0	0	0	110.3	T241	N239-T241 WeakPolarHBondContact O-CA 3.31Å; N239-T241 PolarHBondContact O-N 2.84Å
240	A	41.8	Very low	51.2	Low	106 Å²	106	90.9 Å²	90.9	88%	0.876	57%	0.573	S	S	*	*			trans	-31.6	96	178	0	0	0	0	0	111.4	P242	A240-P242 VanDerWaalsContact O-CD 3.28Å; A240-P242 WeakPolarHBondContact O-CD 3.28Å
241	T	43.9	Very low	52.3	Low	94 Å²	94	83.7 Å²	83.7	58%	0.577	56%	0.555	S	S	*	*			trans	-72.7	119.6	-164.1	-19.1	0	0	0	0	108	N239 G243 R244	N239-T241 WeakPolarHBondContact O-CA 3.31Å; N239-T241 PolarHBondContact O-N 2.84Å; T241-G243 PolarHBondContact O-N 2.93Å; T241-R244 PolarHBondContact O-N 3.19Å
242	P	49.9	Very low	53.9	Low	102 Å²	102	78.7 Å²	78.7	66%	0.662	53%	0.532	S	S	*	.	H	α-helix	trans	-55.7	-21.6	172.5	19.6	-29.6	0	0	0	112	A240 R244 G245 L246	A240-P242 VanDerWaalsContact O-CD 3.28Å; A240-P242 WeakPolarHBondContact O-CD 3.28Å; P242-R244 VanDerWaalsContact C-N 3.27Å; P242-R244 PolarHBondContact O-N 3.42Å; P242-G245 PolarHBondContact O-N 3.44Å; P242-L246 WeakPolarHBondContact O-CB 3.44Å; P242-L246 PolarHBondContact O-N 2.92Å
243	G	53.8	Low	55.5	Low	11 Å²	11	75.1 Å²	75.1	11%	0.113	50%	0.496	C	S	.	.	H	α-helix	trans	-55.2	-31.9	170.5	0	0	0	0	0	114.9	T241 E247	T241-G243 PolarHBondContact O-N 2.93Å; G243-E247 VanDerWaalsContact O-CB 3.25Å; G243-E247 WeakPolarHBondContact O-CB 3.16Å; G243-E247 WeakPolarHBondContact O-CG 3.39Å; G243-E247 PolarHBondContact O-N 3.06Å
244	R	58.9	Low	57.3	Low	198 Å²	198	75.2 Å²	75.2	75%	0.747	48%	0.48	S	S	*	.	H	α-helix	trans	-76	-37.1	-178.6	-136.7	-170.7	-158.3	-160.2	5.6	113.1	T241 P242 V248	T241-R244 PolarHBondContact O-N 3.19Å; P242-R244 VanDerWaalsContact C-N 3.27Å; P242-R244 PolarHBondContact O-N 3.42Å; R244-V248 WeakPolarHBondContact O-CG2 3.43Å; R244-V248 PolarHBondContact O-N 3.47Å; R244-V248 VanDerWaalsContact O-N 3.16Å
245	G	64.1	Low	59.3	Low	20 Å²	20	74.9 Å²	74.9	21%	0.206	47%	0.47	C	S	.	.	H	α-helix	trans	-71.2	-39.9	172.4	0	0	0	0	0	111	N191 P242 E247 V248 A249	N191-G245 VanDerWaalsContact OD1-CA 3.22Å; N191-G245 WeakPolarHBondContact OD1-CA 3.43Å; N191-G245 PolarHBondContact OD1-O 3.41Å; P242-G245 PolarHBondContact O-N 3.44Å; G245-E247 VanDerWaalsContact C-N 3.35Å; G245-E247 PolarHBondContact O-N 3.01Å; G245-V248 PolarHBondContact O-N 2.88Å; G245-A249 WeakPolarHBondContact O-CB 3.3Å; G245-A249 PolarHBondContact O-N 3.09Å
246	L	68.4	Low	61.5	Low	30 Å²	30	68.6 Å²	68.6	16%	0.157	43%	0.43	C	S	.	.	H	α-helix	trans	-64.2	-39.3	174.2	-164.4	65.2	0	0	0	111.9	L187 A224 D227 I228 P242 V248 A249 V250	L187-L246 HydrophobicContact CD1-CD1 4.49Å; L187-L246 HydrophobicContact CD2-CD1 4.11Å; A224-L246 HydrophobicContact CB-CD1 3.78Å; A224-L246 HydrophobicContact CB-CG 4.28Å; D227-L246 HydrophobicContact CB-CD2 3.82Å; I228-L246 HydrophobicContact CD1-CD2 4.48Å; I228-L246 HydrophobicContact CD1-CG 4.31Å; I228-L246 HydrophobicContact CG1-CD2 3.82Å; I228-L246 HydrophobicContact CG1-CG 4.17Å; P242-L246 WeakPolarHBondContact O-CB 3.44Å; P242-L246 PolarHBondContact O-N 2.92Å; L246-V248 PolarHBondContact O-N 3.48Å; L246-A249 PolarHBondContact O-N 2.81Å; L246-V250 WeakPolarHBondContact O-CB 3.49Å; L246-V250 VanDerWaalsContact O-CG2 3.28Å; L246-V250 WeakPolarHBondContact O-CG2 3.3Å; L246-V250 PolarHBondContact O-N 2.97Å
247	E	70.6	Confident	63.4	Low	111 Å²	111	64.2 Å²	64.2	52%	0.519	39%	0.393	S	S	.	.	H	α-helix	trans	-58.9	-43.4	171.7	-81.6	166.3	-163.9	0	0	111.9	I228 G243 G245 V250 A251	I228-E247 HydrophobicContact CD1-CG 4.31Å; G243-E247 VanDerWaalsContact O-CB 3.25Å; G243-E247 WeakPolarHBondContact O-CB 3.16Å; G243-E247 WeakPolarHBondContact O-CG 3.39Å; G243-E247 PolarHBondContact O-N 3.06Å; G245-E247 VanDerWaalsContact C-N 3.35Å; G245-E247 PolarHBondContact O-N 3.01Å; E247-V250 PolarHBondContact O-N 3.47Å; E247-A251 WeakPolarHBondContact O-CB 3.17Å; E247-A251 PolarHBondContact O-N 3.43Å
248	V	74.6	Confident	65.4	Low	58 Å²	58	62.1 Å²	62.1	35%	0.352	37%	0.367	S	S	.	.	H	α-helix	trans	-64.9	-44.3	175.3	172	0	0	0	0	111	R244 G245 L246 V250 A251 N252	R244-V248 WeakPolarHBondContact O-CG2 3.43Å; R244-V248 PolarHBondContact O-N 3.47Å; R244-V248 VanDerWaalsContact O-N 3.16Å; G245-V248 PolarHBondContact O-N 2.88Å; L246-V248 PolarHBondContact O-N 3.48Å; V248-V250 VanDerWaalsContact C-N 3.34Å; V248-V250 PolarHBondContact O-N 3.47Å; V248-A251 PolarHBondContact O-N 2.9Å; V248-N252 WeakPolarHBondContact O-CB 3.44Å; V248-N252 VanDerWaalsContact O-CG 3.28Å; V248-N252 PolarHBondContact O-N 3.37Å
249	A	72.9	Confident	67.4	Low	1 Å²	1	64.5 Å²	64.5	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-38.3	176.1	0	0	0	0	0	112.1	L187 F190 N191 G245 L246 L253	L187-A249 HydrophobicContact CD1-CB 4.06Å; F190-A249 HydrophobicContact CB-CB 4.49Å; N191-A249 HydrophobicContact CB-CB 4.2Å; G245-A249 WeakPolarHBondContact O-CB 3.3Å; G245-A249 PolarHBondContact O-N 3.09Å; L246-A249 PolarHBondContact O-N 2.81Å; A249-L253 WeakPolarHBondContact O-CB 3.29Å; A249-L253 WeakPolarHBondContact O-CD1 3.38Å; A249-L253 WeakPolarHBondContact O-CG 3.44Å; A249-L253 PolarHBondContact O-N 3.45Å
250	V	76	Confident	69.4	Low	17 Å²	17	57.5 Å²	57.5	10%	0.103	32%	0.321	C	S	.	.	H	α-helix	trans	-65.2	-44.7	174	168.4	0	0	0	0	111.1	A224 I228 L246 E247 V248 L253 Q254	A224-V250 HydrophobicContact CB-CG2 3.34Å; I228-V250 HydrophobicContact CD1-CB 4.19Å; I228-V250 HydrophobicContact CD1-CG2 3.61Å; L246-V250 WeakPolarHBondContact O-CB 3.49Å; L246-V250 VanDerWaalsContact O-CG2 3.28Å; L246-V250 WeakPolarHBondContact O-CG2 3.3Å; L246-V250 PolarHBondContact O-N 2.97Å; E247-V250 PolarHBondContact O-N 3.47Å; V248-V250 VanDerWaalsContact C-N 3.34Å; V248-V250 PolarHBondContact O-N 3.47Å; V250-L253 PolarHBondContact O-N 2.93Å; V250-Q254 VanDerWaalsContact O-CB 3.24Å; V250-Q254 WeakPolarHBondContact O-CB 3.29Å; V250-Q254 PolarHBondContact O-N 3.03Å
251	A	75.7	Confident	71.2	Confident	45 Å²	45	53.5 Å²	53.5	37%	0.372	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-48.1	175.9	0	0	0	0	0	111.5	E247 V248 L253 Q254 D255	E247-A251 WeakPolarHBondContact O-CB 3.17Å; E247-A251 PolarHBondContact O-N 3.43Å; V248-A251 PolarHBondContact O-N 2.9Å; A251-L253 PolarHBondContact O-N 2.92Å; A251-Q254 WeakPolarHBondContact O-CB 3.39Å; A251-Q254 PolarHBondContact O-N 3.44Å; A251-Q254 VanDerWaalsContact O-N 3.16Å; A251-D255 PolarHBondContact O-N 2.8Å
252	N	79.1	Confident	73	Confident	12 Å²	12	54 Å²	54	6%	0.064	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-39.6	177.2	-71.1	-14.2	0	0	0	112.2	F190 G192 L197 V248 Q254 Y256	F190-N252 HydrophobicContact CD1-CB 4.32Å; F190-N252 PolarHBondContact O-ND2 3.09Å; G192-N252 PolarHBondContact O-ND2 3.36Å; L197-N252 HydrophobicContact CD1-CB 4.18Å; V248-N252 WeakPolarHBondContact O-CB 3.44Å; V248-N252 VanDerWaalsContact O-CG 3.28Å; V248-N252 PolarHBondContact O-N 3.37Å; N252-Q254 VanDerWaalsContact C-N 3.33Å; N252-Y256 VanDerWaalsContact O-CB 3.3Å; N252-Y256 WeakPolarHBondContact O-CB 3.34Å; N252-Y256 PolarHBondContact O-N 3.47Å
253	L	78.5	Confident	74.5	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-37.1	173.9	-80.7	166.4	0	0	0	111.6	L187 F190 L220 A249 V250 A251 C257	L187-L253 HydrophobicContact CD1-CD1 4.01Å; F190-L253 HydrophobicContact CB-CD2 4.43Å; F190-L253 HydrophobicContact CB-CG 4.13Å; F190-L253 HydrophobicContact CD1-CD2 3.87Å; F190-L253 HydrophobicContact CD1-CG 4.03Å; F190-L253 HydrophobicContact CD2-CD2 3.51Å; F190-L253 HydrophobicContact CD2-CG 4.14Å; F190-L253 HydrophobicContact CE1-CD2 3.94Å; F190-L253 HydrophobicContact CE2-CD2 3.59Å; F190-L253 HydrophobicContact CG-CD2 3.67Å; F190-L253 HydrophobicContact CG-CG 3.84Å; F190-L253 HydrophobicContact CZ-CD2 3.81Å; L220-L253 HydrophobicContact CB-CD1 3.81Å; L220-L253 HydrophobicContact CB-CD2 3.93Å; L220-L253 HydrophobicContact CD1-CD2 4.11Å; A249-L253 WeakPolarHBondContact O-CB 3.29Å; A249-L253 WeakPolarHBondContact O-CD1 3.38Å; A249-L253 WeakPolarHBondContact O-CG 3.44Å; A249-L253 PolarHBondContact O-N 3.45Å; V250-L253 PolarHBondContact O-N 2.93Å; A251-L253 PolarHBondContact O-N 2.92Å; L253-C257 VanDerWaalsContact O-CB 3.3Å; L253-C257 WeakPolarHBondContact O-CB 3.37Å; L253-C257 PolarHBondContact O-N 3.41Å; L253-C257 PolarHBondContact O-SG 2.98Å
254	Q	77.3	Confident	75.9	Confident	96 Å²	96	52.7 Å²	52.7	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-68.9	-44.1	177.2	-174	160.2	-1.1	0	0	111	V250 A251 N252 C257 N258	V250-Q254 VanDerWaalsContact O-CB 3.24Å; V250-Q254 WeakPolarHBondContact O-CB 3.29Å; V250-Q254 PolarHBondContact O-N 3.03Å; A251-Q254 WeakPolarHBondContact O-CB 3.39Å; A251-Q254 PolarHBondContact O-N 3.44Å; A251-Q254 VanDerWaalsContact O-N 3.16Å; N252-Q254 VanDerWaalsContact C-N 3.33Å; Q254-C257 PolarHBondContact O-N 2.87Å; Q254-N258 WeakPolarHBondContact O-CB 3.42Å; Q254-N258 PolarHBondContact O-N 3.49Å; Q254-N258 PolarHBondContact O-ND2 3.06Å
255	D	78.4	Confident	77.1	Confident	97 Å²	97	44.1 Å²	44.1	52%	0.519	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-43.5	173.5	-72.1	-19.5	0	0	0	111.3	A251 N258 E259	A251-D255 PolarHBondContact O-N 2.8Å; D255-N258 PolarHBondContact O-N 3.4Å; D255-E259 WeakPolarHBondContact O-CB 3.49Å; D255-E259 PolarHBondContact O-N 2.52Å
256	Y	79.2	Confident	78	Confident	16 Å²	16	46.2 Å²	46.2	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-42.5	174.3	-179.4	-99.7	0	0	0	112.4	F190 L200 F204 A217 N252 N258 E259 L260	F190-Y256 HydrophobicContact CE1-CD1 4.24Å; F190-Y256 HydrophobicContact CE1-CD2 4.41Å; F190-Y256 AromaticContact CE1-CG 3.89Å; F190-Y256 HydrophobicContact CE1-CG 3.89Å; F190-Y256 AromaticContact CZ-CD1 3.98Å; F190-Y256 HydrophobicContact CZ-CD1 3.98Å; F190-Y256 HydrophobicContact CZ-CE1 4.45Å; F190-Y256 HydrophobicContact CZ-CG 4.05Å; L200-Y256 HydrophobicContact CD1-CD2 4.34Å; F204-Y256 WeakPolarHBondContact CA-OH 3.13Å; F204-Y256 HydrophobicContact CB-CE2 4.07Å; F204-Y256 AromaticContact CD1-CE1 3.73Å; F204-Y256 HydrophobicContact CD1-CE1 3.73Å; F204-Y256 HydrophobicContact CD1-CE2 4.44Å; F204-Y256 AromaticContact CD1-CZ 3.64Å; F204-Y256 WeakPolarHBondContact CD1-OH 3.25Å; F204-Y256 HydrophobicContact CE1-CE1 4.36Å; F204-Y256 PolarHBondContact O-OH 3.19Å; A217-Y256 HydrophobicContact CB-CD1 3.96Å; A217-Y256 HydrophobicContact CB-CE1 3.93Å; N252-Y256 VanDerWaalsContact O-CB 3.3Å; N252-Y256 WeakPolarHBondContact O-CB 3.34Å; N252-Y256 PolarHBondContact O-N 3.47Å; Y256-N258 VanDerWaalsContact C-N 3.34Å; Y256-E259 PolarHBondContact O-N 3.22Å; Y256-L260 HydrophobicContact CE1-CB 4.43Å; Y256-L260 HydrophobicContact CE1-CD2 3.92Å; Y256-L260 WeakPolarHBondContact O-CB 3.26Å; Y256-L260 PolarHBondContact O-N 3.48Å
257	C	76.9	Confident	78.8	Confident	2 Å²	2	49 Å²	49	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-43	175.1	-72.6	0	0	0	0	111.1	L253 Q254 L260 E261	L253-C257 VanDerWaalsContact O-CB 3.3Å; L253-C257 WeakPolarHBondContact O-CB 3.37Å; L253-C257 PolarHBondContact O-N 3.41Å; L253-C257 PolarHBondContact O-SG 2.98Å; Q254-C257 PolarHBondContact O-N 2.87Å; C257-L260 PolarHBondContact O-N 3.19Å; C257-E261 WeakPolarHBondContact O-CB 3.4Å; C257-E261 PolarHBondContact O-N 2.91Å
258	N	78.3	Confident	79.5	Confident	67 Å²	67	43.7 Å²	43.7	36%	0.358	23%	0.226	S	C	.	.	H	α-helix	trans	-64.3	-42.9	177	-69.2	-24.5	0	0	0	111.2	Q254 D255 Y256 N262	Q254-N258 WeakPolarHBondContact O-CB 3.42Å; Q254-N258 PolarHBondContact O-N 3.49Å; Q254-N258 PolarHBondContact O-ND2 3.06Å; D255-N258 PolarHBondContact O-N 3.4Å; Y256-N258 VanDerWaalsContact C-N 3.34Å; N258-N262 WeakPolarHBondContact O-CB 3.22Å; N258-N262 VanDerWaalsContact O-CG 3.32Å; N258-N262 PolarHBondContact O-N 3.36Å; N258-N262 PolarHBondContact O-ND2 2.77Å
259	E	80.9	Confident	80	Confident	122 Å²	122	42.8 Å²	42.8	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-65.9	-45.2	176.7	-174.7	173.6	-177.9	0	0	111.2	D255 Y256 N262 R263	D255-E259 WeakPolarHBondContact O-CB 3.49Å; D255-E259 PolarHBondContact O-N 2.52Å; Y256-E259 PolarHBondContact O-N 3.22Å; E259-N262 PolarHBondContact O-N 3.48Å; E259-R263 VanDerWaalsContact O-CB 3.26Å; E259-R263 WeakPolarHBondContact O-CB 3.47Å; E259-R263 PolarHBondContact O-N 2.84Å
260	L	79.3	Confident	80.6	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-41.3	177.5	-172.6	64.2	0	0	0	111.9	V210 A214 Y256 C257 R263 L264 F290	V210-L260 HydrophobicContact CG1-CD1 3.97Å; A214-L260 HydrophobicContact CB-CD2 4.01Å; Y256-L260 HydrophobicContact CE1-CB 4.43Å; Y256-L260 HydrophobicContact CE1-CD2 3.92Å; Y256-L260 WeakPolarHBondContact O-CB 3.26Å; Y256-L260 PolarHBondContact O-N 3.48Å; C257-L260 PolarHBondContact O-N 3.19Å; L260-R263 PolarHBondContact O-N 3.17Å; L260-L264 HydrophobicContact CG-CD1 4.2Å; L260-L264 VanDerWaalsContact O-CB 3.31Å; L260-L264 WeakPolarHBondContact O-CB 3.46Å; L260-L264 WeakPolarHBondContact O-CG 3.38Å; L260-L264 PolarHBondContact O-N 2.96Å; L260-F290 HydrophobicContact CD2-CE2 4.34Å; L260-F290 HydrophobicContact CD2-CZ 3.87Å
261	E	79	Confident	81	Confident	21 Å²	21	44.2 Å²	44.2	10%	0.098	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-48.4	174.6	-177.3	172.1	-163.7	0	0	110.7	C257 R263 L264 L265 L287 S295	C257-E261 WeakPolarHBondContact O-CB 3.4Å; C257-E261 PolarHBondContact O-N 2.91Å; E261-R263 VanDerWaalsContact C-N 3.32Å; E261-R263 PolarHBondContact O-N 3.32Å; E261-L264 PolarHBondContact O-N 2.61Å; E261-L265 HydrophobicContact CG-CD1 4.16Å; E261-L265 WeakPolarHBondContact O-CB 3.35Å; E261-L265 VanDerWaalsContact O-CG 3.29Å; E261-L265 WeakPolarHBondContact O-CG 3.41Å; E261-L265 PolarHBondContact O-N 3.09Å; E261-L287 HydrophobicContact CG-CD2 4.16Å; E261-S295 WeakPolarHBondContact OE1-CB 3.38Å; E261-S295 PolarHBondContact OE1-OG 3.13Å
262	N	81.1	Confident	81.5	Confident	105 Å²	105	43.1 Å²	43.1	56%	0.561	22%	0.223	S	C	*	.	H	α-helix	trans	-62.7	-37.5	175	-76.3	-48.9	0	0	0	112.5	N258 E259 L265 S266	N258-N262 WeakPolarHBondContact O-CB 3.22Å; N258-N262 VanDerWaalsContact O-CG 3.32Å; N258-N262 PolarHBondContact O-N 3.36Å; N258-N262 PolarHBondContact O-ND2 2.77Å; E259-N262 PolarHBondContact O-N 3.48Å; N262-L265 PolarHBondContact O-N 2.92Å; N262-S266 WeakPolarHBondContact O-CB 3.36Å; N262-S266 PolarHBondContact O-N 3.11Å; N262-S266 PolarHBondContact O-OG 3.41Å; N262-S266 VanDerWaalsContact O-OG 3.09Å
263	R	82.4	Confident	81.8	Confident	81 Å²	81	50.4 Å²	50.4	31%	0.306	26%	0.256	S	S	.	.	H	α-helix	trans	-67.4	-40.3	175.7	-166.2	172.1	79.8	149.2	8.4	111.8	D207 V210 E259 L260 E261 S266 R267	D207-R263 IonicContact OD1-CZ 2.75Å; D207-R263 IonicContact OD1-NE 2.72Å; D207-R263 IonicContact OD1-NH1 3.32Å; D207-R263 PolarHBondContact OD1-NH1 3.33Å; D207-R263 IonicContact OD1-NH2 3.31Å; D207-R263 PolarHBondContact OD1-NH2 2.79Å; V210-R263 VanDerWaalsContact CG2-NH2 3.31Å; E259-R263 VanDerWaalsContact O-CB 3.26Å; E259-R263 WeakPolarHBondContact O-CB 3.47Å; E259-R263 PolarHBondContact O-N 2.84Å; L260-R263 PolarHBondContact O-N 3.17Å; E261-R263 VanDerWaalsContact C-N 3.32Å; E261-R263 PolarHBondContact O-N 3.32Å; R263-S266 WeakPolarHBondContact CA-OG 3.47Å; R263-S266 PolarHBondContact O-OG 2.92Å; R263-R267 WeakPolarHBondContact O-CB 3.48Å; R263-R267 PolarHBondContact O-N 3.19Å
264	L	82.8	Confident	82.2	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-68.8	-40.2	174.6	-82.4	169.9	0	0	0	112.1	V210 L260 E261 R267 F268 I286 L287 F290	V210-L264 HydrophobicContact CG1-CD1 4.03Å; V210-L264 HydrophobicContact CG1-CD2 3.5Å; V210-L264 VanDerWaalsContact CG1-CD2 3.5Å; V210-L264 HydrophobicContact CG1-CG 3.89Å; L260-L264 HydrophobicContact CG-CD1 4.2Å; L260-L264 VanDerWaalsContact O-CB 3.31Å; L260-L264 WeakPolarHBondContact O-CB 3.46Å; L260-L264 WeakPolarHBondContact O-CG 3.38Å; L260-L264 PolarHBondContact O-N 2.96Å; E261-L264 PolarHBondContact O-N 2.61Å; L264-R267 PolarHBondContact O-N 3.5Å; L264-F268 WeakPolarHBondContact O-CB 3.25Å; L264-F268 PolarHBondContact O-N 3.28Å; L264-I286 HydrophobicContact CD1-CB 4.35Å; L264-I286 HydrophobicContact CD1-CG2 3.6Å; L264-I286 HydrophobicContact CD2-CD1 4.49Å; L264-I286 HydrophobicContact CD2-CG2 4.46Å; L264-L287 HydrophobicContact CB-CD1 4.18Å; L264-L287 HydrophobicContact CB-CD2 3.66Å; L264-L287 HydrophobicContact CB-CG 3.94Å; L264-L287 HydrophobicContact CD1-CD2 4.05Å; L264-L287 HydrophobicContact CD1-CG 4.29Å; L264-F290 HydrophobicContact CD1-CE2 4.28Å
265	L	83	Confident	82.4	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-46.8	174.2	-75.1	170.2	0	0	0	111.2	E261 N262 R267 F268 D269 L287 A296 H299	E261-L265 HydrophobicContact CG-CD1 4.16Å; E261-L265 WeakPolarHBondContact O-CB 3.35Å; E261-L265 VanDerWaalsContact O-CG 3.29Å; E261-L265 WeakPolarHBondContact O-CG 3.41Å; E261-L265 PolarHBondContact O-N 3.09Å; N262-L265 PolarHBondContact O-N 2.92Å; L265-R267 PolarHBondContact O-N 2.98Å; L265-F268 CarbonylContact O-C 3.6Å; L265-F268 WeakPolarHBondContact O-CB 3.09Å; L265-F268 PolarHBondContact O-N 3.24Å; L265-F268 VanDerWaalsContact O-N 3.16Å; L265-D269 VanDerWaalsContact O-CG 3.24Å; L265-D269 PolarHBondContact O-N 3.01Å; L265-L287 HydrophobicContact CD2-CD1 4.16Å; L265-A296 HydrophobicContact CD2-CB 4.39Å; L265-H299 HydrophobicContact CD2-CB 3.96Å
266	S	84	Confident	82.9	Confident	65 Å²	65	64.5 Å²	64.5	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-64.5	-37.5	176.4	60.3	0	0	0	0	113.1	N262 R263 D269 A270	N262-S266 WeakPolarHBondContact O-CB 3.36Å; N262-S266 PolarHBondContact O-N 3.11Å; N262-S266 PolarHBondContact O-OG 3.41Å; N262-S266 VanDerWaalsContact O-OG 3.09Å; R263-S266 WeakPolarHBondContact CA-OG 3.47Å; R263-S266 PolarHBondContact O-OG 2.92Å; S266-D269 PolarHBondContact O-N 3.4Å; S266-A270 WeakPolarHBondContact O-CB 3.4Å; S266-A270 PolarHBondContact O-N 3.21Å
267	R	84.3	Confident	83.2	Confident	88 Å²	88	67.4 Å²	67.4	33%	0.332	32%	0.319	S	S	.	.	H	α-helix	trans	-65.1	-40.8	171.9	-175.4	172.9	170.8	173.9	-7.5	111.5	D207 R263 L264 L265 A270 A271	D207-R267 PolarHBondContact O-NH1 2.94Å; D207-R267 VanDerWaalsContact O-NH1 3.07Å; R263-R267 WeakPolarHBondContact O-CB 3.48Å; R263-R267 PolarHBondContact O-N 3.19Å; L264-R267 PolarHBondContact O-N 3.5Å; L265-R267 PolarHBondContact O-N 2.98Å; R267-A270 PolarHBondContact O-N 3.38Å; R267-A271 WeakPolarHBondContact O-CB 3.38Å; R267-A271 PolarHBondContact O-N 3.18Å
268	F	85.3	Confident	83.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.9	-41.2	175.5	179.7	-91	0	0	0	111.7	L264 L265 A271 S272 M280 C283 A284 Y300 V358 F359	L264-F268 WeakPolarHBondContact O-CB 3.25Å; L264-F268 PolarHBondContact O-N 3.28Å; L265-F268 CarbonylContact O-C 3.6Å; L265-F268 WeakPolarHBondContact O-CB 3.09Å; L265-F268 PolarHBondContact O-N 3.24Å; L265-F268 VanDerWaalsContact O-N 3.16Å; F268-A271 PolarHBondContact O-N 3.01Å; F268-S272 WeakPolarHBondContact O-CB 3.29Å; F268-S272 PolarHBondContact O-N 3Å; F268-M280 HydrophobicContact CD2-CB 4.21Å; F268-M280 HydrophobicContact CD2-CG 4.4Å; F268-M280 HydrophobicContact CE1-CE 4.4Å; F268-M280 HydrophobicContact CE2-CB 3.94Å; F268-M280 HydrophobicContact CE2-CE 4.06Å; F268-M280 HydrophobicContact CE2-CG 4.27Å; F268-M280 HydrophobicContact CZ-CE 3.78Å; F268-C283 HydrophobicContact CB-CB 4.04Å; F268-C283 HydrophobicContact CD2-CB 3.95Å; F268-A284 HydrophobicContact CE2-CB 4.23Å; F268-Y300 AromaticContact CE1-CD2 3.59Å; F268-Y300 HydrophobicContact CE1-CD2 3.59Å; F268-Y300 HydrophobicContact CE1-CG 4.22Å; F268-Y300 AromaticContact CZ-CD2 3.51Å; F268-Y300 HydrophobicContact CZ-CD2 3.51Å; F268-Y300 HydrophobicContact CZ-CE2 4.29Å; F268-Y300 HydrophobicContact CZ-CG 4.14Å; F268-V358 HydrophobicContact CE2-CG1 3.88Å; F268-V358 HydrophobicContact CZ-CG1 4.37Å; F268-F359 HydrophobicContact CE2-CZ 4.21Å; F268-F359 HydrophobicContact CZ-CE2 4.23Å; F268-F359 AromaticContact CZ-CZ 3.69Å; F268-F359 HydrophobicContact CZ-CZ 3.69Å
269	D	84.9	Confident	84	Confident	38 Å²	38	70 Å²	70	20%	0.203	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-44.2	175.3	-67.8	-28.4	0	0	0	111.9	L265 S266 A271 S272 Q273 H299	L265-D269 VanDerWaalsContact O-CG 3.24Å; L265-D269 PolarHBondContact O-N 3.01Å; S266-D269 PolarHBondContact O-N 3.4Å; D269-A271 VanDerWaalsContact C-N 3.31Å; D269-A271 PolarHBondContact O-N 3.08Å; D269-S272 PolarHBondContact O-N 2.93Å; D269-Q273 WeakPolarHBondContact O-CG 3.25Å; D269-Q273 PolarHBondContact O-N 3.42Å; D269-H299 VanDerWaalsContact CG-CE1 3.47Å; D269-H299 IonicContact OD1-CE1 3.98Å; D269-H299 PolarHBondContact OD1-CE1 3.36Å; D269-H299 IonicContact OD1-ND1 3.12Å; D269-H299 PolarHBondContact OD1-ND1 3.28Å; D269-H299 IonicContact OD2-CE1 2.64Å; D269-H299 PolarHBondContact OD2-CE1 3.04Å; D269-H299 IonicContact OD2-ND1 3.2Å; D269-H299 IonicContact OD2-NE2 3.56Å
270	A	85.8	Confident	84.3	Confident	43 Å²	43	64.3 Å²	64.3	36%	0.355	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-39.9	175.5	0	0	0	0	0	111.7	S266 R267 R274	S266-A270 WeakPolarHBondContact O-CB 3.4Å; S266-A270 PolarHBondContact O-N 3.21Å; R267-A270 PolarHBondContact O-N 3.38Å; A270-R274 VanDerWaalsContact O-CG 3.29Å; A270-R274 WeakPolarHBondContact O-CG 3.31Å; A270-R274 PolarHBondContact O-N 2.97Å; A270-R274 VanDerWaalsContact O-N 3.15Å
271	A	85.6	Confident	84.6	Confident	6 Å²	6	65 Å²	65	5%	0.05	32%	0.319	C	S	.	.	H	α-helix	trans	-66.2	-41.5	173.5	0	0	0	0	0	112	R267 F268 D269 Q273 R274 R275 D276 T279 M280	R267-A271 WeakPolarHBondContact O-CB 3.38Å; R267-A271 PolarHBondContact O-N 3.18Å; F268-A271 PolarHBondContact O-N 3.01Å; D269-A271 VanDerWaalsContact C-N 3.31Å; D269-A271 PolarHBondContact O-N 3.08Å; A271-Q273 PolarHBondContact O-N 3.49Å; A271-R274 CarbonylContact O-C 3.59Å; A271-R274 PolarHBondContact O-N 3.44Å; A271-R275 PolarHBondContact O-N 3.24Å; A271-D276 PolarHBondContact O-N 3.11Å; A271-T279 WeakPolarHBondContact CB-OG1 3.4Å; A271-M280 HydrophobicContact CB-CG 3.64Å
272	S	85.5	Confident	84.9	Confident	21 Å²	21	68.1 Å²	68.1	15%	0.147	33%	0.334	C	S	.	.	H	α-helix	trans	-63.1	-40.2	175.5	-176.7	0	0	0	0	112.1	F268 D269 R274 R275 M280 R304	F268-S272 WeakPolarHBondContact O-CB 3.29Å; F268-S272 PolarHBondContact O-N 3Å; D269-S272 PolarHBondContact O-N 2.93Å; S272-R274 VanDerWaalsContact C-N 3.29Å; S272-R274 PolarHBondContact O-N 2.86Å; S272-R275 PolarHBondContact O-N 3.11Å; S272-M280 VanDerWaalsContact CA-SD 3.57Å; S272-R304 PolarHBondContact OG-NH2 2.89Å
273	Q	84.8	Confident	85.1	Confident	166 Å²	166	63.2 Å²	63.2	78%	0.776	31%	0.308	S	S	*	.	H	α-helix	trans	-64.8	-35.2	175	-73.2	176.1	14.4	0	0	111.8	D269 A271 R275	D269-Q273 WeakPolarHBondContact O-CG 3.25Å; D269-Q273 PolarHBondContact O-N 3.42Å; A271-Q273 PolarHBondContact O-N 3.49Å; Q273-R275 VanDerWaalsContact C-N 3.31Å
274	R	87.3	Confident	85.2	Confident	207 Å²	207	59.4 Å²	59.4	78%	0.781	29%	0.294	S	S	*	.	H	α-helix	trans	-82	-5.2	177.4	-68.2	175.5	-178.2	-150.9	1.6	114.1	A270 A271 S272 D276	A270-R274 VanDerWaalsContact O-CG 3.29Å; A270-R274 WeakPolarHBondContact O-CG 3.31Å; A270-R274 PolarHBondContact O-N 2.97Å; A270-R274 VanDerWaalsContact O-N 3.15Å; A271-R274 CarbonylContact O-C 3.59Å; A271-R274 PolarHBondContact O-N 3.44Å; S272-R274 VanDerWaalsContact C-N 3.29Å; S272-R274 PolarHBondContact O-N 2.86Å; R274-D276 PolarHBondContact O-N 2.94Å
275	R	82.6	Confident	85.3	Confident	218 Å²	218	64.8 Å²	64.8	82%	0.823	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	31.5	-171.9	-58.4	-174.4	174.1	-136.2	-1.2	113.5	A271 S272 Q273 L277	A271-R275 PolarHBondContact O-N 3.24Å; S272-R275 PolarHBondContact O-N 3.11Å; Q273-R275 VanDerWaalsContact C-N 3.31Å; R275-L277 PolarHBondContact O-N 3.33Å
276	D	87.5	Confident	85.2	Confident	63 Å²	63	64.5 Å²	64.5	34%	0.337	32%	0.315	S	S	.	.			trans	-87.6	91.8	177	179.9	8.6	0	0	0	110.5	A271 R274 S278 T279 M280	A271-D276 PolarHBondContact O-N 3.11Å; R274-D276 PolarHBondContact O-N 2.94Å; D276-S278 PolarHBondContact O-N 2.88Å; D276-S278 PolarHBondContact OD1-N 2.88Å; D276-T279 WeakPolarHBondContact CB-OG1 3.41Å; D276-T279 PolarHBondContact O-OG1 3.26Å; D276-T279 WeakPolarHBondContact OD2-CB 3.37Å; D276-T279 WeakPolarHBondContact OD2-CG2 3.41Å; D276-T279 PolarHBondContact OD2-OG1 3.41Å; D276-M280 VanDerWaalsContact O-CG 3.25Å; D276-M280 WeakPolarHBondContact O-CG 3.12Å; D276-M280 PolarHBondContact O-N 2.92Å; D276-M280 VanDerWaalsContact O-N 3.15Å
277	L	86.9	Confident	85	Confident	77 Å²	77	61.4 Å²	61.4	40%	0.403	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-26.4	-177.4	-58.6	-179.7	0	0	0	113.2	R275 M280 S281 T354 V358	R275-L277 PolarHBondContact O-N 3.33Å; L277-M280 HydrophobicContact CD2-SD 4.24Å; L277-S281 WeakPolarHBondContact O-CB 3.38Å; L277-S281 PolarHBondContact O-N 2.87Å; L277-T354 HydrophobicContact CD2-CG2 3.83Å; L277-V358 HydrophobicContact CD2-CG2 4.05Å
278	S	86.9	Confident	84.8	Confident	90 Å²	90	59.1 Å²	59.1	63%	0.629	29%	0.292	S	S	*	.	H	α-helix	trans	-70.9	-50.4	-177.5	-173.5	0	0	0	0	110.9	D276 S281 E282	D276-S278 PolarHBondContact O-N 2.88Å; D276-S278 PolarHBondContact OD1-N 2.88Å; S278-S281 PolarHBondContact O-N 2.6Å; S278-E282 PolarHBondContact O-N 2.87Å
279	T	84.5	Confident	84.2	Confident	33 Å²	33	63.5 Å²	63.5	20%	0.202	31%	0.312	C	S	.	.	H	α-helix	trans	-69.8	-34.4	178.2	52.4	0	0	0	0	111.7	A271 D276 S281 E282 C283	A271-T279 WeakPolarHBondContact CB-OG1 3.4Å; D276-T279 WeakPolarHBondContact CB-OG1 3.41Å; D276-T279 PolarHBondContact O-OG1 3.26Å; D276-T279 WeakPolarHBondContact OD2-CB 3.37Å; D276-T279 WeakPolarHBondContact OD2-CG2 3.41Å; D276-T279 PolarHBondContact OD2-OG1 3.41Å; T279-S281 PolarHBondContact O-N 2.88Å; T279-E282 PolarHBondContact O-N 3.43Å; T279-C283 WeakPolarHBondContact O-CB 3.35Å; T279-C283 PolarHBondContact O-N 3.34Å; T279-C283 PolarHBondContact O-SG 2.83Å; T279-C283 VanDerWaalsContact O-SG 3.38Å
280	M	86.4	Confident	83.6	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.02	30%	0.302	C	S	.	.	H	α-helix	trans	-58.6	-45.9	170.1	-72.1	176.4	73.1	0	0	111.8	F268 A271 S272 D276 L277 C283 A284 Y300 V358	F268-M280 HydrophobicContact CD2-CB 4.21Å; F268-M280 HydrophobicContact CD2-CG 4.4Å; F268-M280 HydrophobicContact CE1-CE 4.4Å; F268-M280 HydrophobicContact CE2-CB 3.94Å; F268-M280 HydrophobicContact CE2-CE 4.06Å; F268-M280 HydrophobicContact CE2-CG 4.27Å; F268-M280 HydrophobicContact CZ-CE 3.78Å; A271-M280 HydrophobicContact CB-CG 3.64Å; S272-M280 VanDerWaalsContact CA-SD 3.57Å; D276-M280 VanDerWaalsContact O-CG 3.25Å; D276-M280 WeakPolarHBondContact O-CG 3.12Å; D276-M280 PolarHBondContact O-N 2.92Å; D276-M280 VanDerWaalsContact O-N 3.15Å; L277-M280 HydrophobicContact CD2-SD 4.24Å; M280-C283 PolarHBondContact O-N 2.92Å; M280-A284 VanDerWaalsContact O-CB 3.3Å; M280-A284 WeakPolarHBondContact O-CB 3.45Å; M280-A284 PolarHBondContact O-N 3.43Å; M280-Y300 HydrophobicContact CE-CD2 4.21Å; M280-Y300 HydrophobicContact CE-CE2 3.7Å; M280-V358 HydrophobicContact CB-CG1 3.85Å; M280-V358 HydrophobicContact CB-CG2 3.93Å; M280-V358 HydrophobicContact CE-CG1 4.41Å; M280-V358 HydrophobicContact CE-CG2 4.19Å; M280-V358 HydrophobicContact SD-CG2 4.48Å
281	S	86.7	Confident	82.8	Confident	16 Å²	16	63.6 Å²	63.6	11%	0.112	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-39.8	-179.9	-174.7	0	0	0	0	112.3	L277 S278 T279 A284 K285 V358	L277-S281 WeakPolarHBondContact O-CB 3.38Å; L277-S281 PolarHBondContact O-N 2.87Å; S278-S281 PolarHBondContact O-N 2.6Å; T279-S281 PolarHBondContact O-N 2.88Å; S281-A284 PolarHBondContact O-N 3.44Å; S281-K285 WeakPolarHBondContact O-CB 3.46Å; S281-K285 VanDerWaalsContact O-CG 3.27Å; S281-K285 WeakPolarHBondContact O-CG 3.22Å; S281-K285 PolarHBondContact O-N 3.01Å; S281-V358 VanDerWaalsContact CA-O 3.29Å; S281-V358 WeakPolarHBondContact CA-O 3.45Å; S281-V358 PolarHBondContact OG-O 3.34Å; S281-V358 VanDerWaalsContact OG-O 3.09Å
282	E	85.3	Confident	81.8	Confident	88 Å²	88	73.6 Å²	73.6	41%	0.411	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-49.8	174.8	-172.3	179.2	-163.6	0	0	111.3	S278 T279 A284 K285 I286	S278-E282 PolarHBondContact O-N 2.87Å; T279-E282 PolarHBondContact O-N 3.43Å; E282-A284 PolarHBondContact O-N 3.05Å; E282-K285 PolarHBondContact O-N 2.9Å; E282-I286 HydrophobicContact CG-CD1 4.16Å; E282-I286 VanDerWaalsContact O-CG1 3.31Å; E282-I286 WeakPolarHBondContact O-CG1 3.45Å; E282-I286 PolarHBondContact O-N 2.66Å
283	C	84.2	Confident	81.1	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.007	34%	0.338	C	S	.	.	H	α-helix	trans	-60.1	-43.4	176	-71.9	0	0	0	0	112.1	F268 T279 M280 K285 I286 L287	F268-C283 HydrophobicContact CB-CB 4.04Å; F268-C283 HydrophobicContact CD2-CB 3.95Å; T279-C283 WeakPolarHBondContact O-CB 3.35Å; T279-C283 PolarHBondContact O-N 3.34Å; T279-C283 PolarHBondContact O-SG 2.83Å; T279-C283 VanDerWaalsContact O-SG 3.38Å; M280-C283 PolarHBondContact O-N 2.92Å; C283-K285 PolarHBondContact O-N 2.93Å; C283-I286 PolarHBondContact O-N 3.39Å; C283-L287 VanDerWaalsContact O-CB 3.31Å; C283-L287 WeakPolarHBondContact O-CB 3.46Å; C283-L287 VanDerWaalsContact O-CG 3.29Å; C283-L287 WeakPolarHBondContact O-CG 3.47Å; C283-L287 PolarHBondContact O-N 3.5Å
284	A	84.8	Confident	80.9	Confident	2 Å²	2	67.4 Å²	67.4	2%	0.017	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-38.6	178	0	0	0	0	0	112.6	F268 M280 S281 E282 S288 V358 F359	F268-A284 HydrophobicContact CE2-CB 4.23Å; M280-A284 VanDerWaalsContact O-CB 3.3Å; M280-A284 WeakPolarHBondContact O-CB 3.45Å; M280-A284 PolarHBondContact O-N 3.43Å; S281-A284 PolarHBondContact O-N 3.44Å; E282-A284 PolarHBondContact O-N 3.05Å; A284-S288 WeakPolarHBondContact O-CB 3.04Å; A284-S288 PolarHBondContact O-N 2.88Å; A284-V358 HydrophobicContact CB-CG1 3.9Å; A284-F359 HydrophobicContact CB-CD1 3.86Å; A284-F359 HydrophobicContact CB-CE1 3.99Å; A284-F359 HydrophobicContact CB-CG 4.4Å
285	K	84.3	Confident	80.4	Confident	116 Å²	116	58.9 Å²	58.9	50%	0.504	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-44.1	173.1	-77.7	166.9	-173.9	169.6	0	111.8	S281 E282 C283 S288 P360	S281-K285 WeakPolarHBondContact O-CB 3.46Å; S281-K285 VanDerWaalsContact O-CG 3.27Å; S281-K285 WeakPolarHBondContact O-CG 3.22Å; S281-K285 PolarHBondContact O-N 3.01Å; E282-K285 PolarHBondContact O-N 2.9Å; C283-K285 PolarHBondContact O-N 2.93Å; K285-S288 PolarHBondContact O-N 2.57Å; K285-S288 PolarHBondContact O-OG 3.18Å; K285-P360 HydrophobicContact CB-CG 4.42Å; K285-P360 HydrophobicContact CG-CG 3.74Å
286	I	80.7	Confident	80.3	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.062	25%	0.25	C	S	.	.	H	α-helix	trans	-68.6	-46.6	178.7	-59.9	164.1	0	0	0	110.1	V210 A211 A214 L264 E282 C283 S288 Q289 F290	V210-I286 HydrophobicContact CG1-CD1 4.43Å; A211-I286 HydrophobicContact CB-CD1 3.73Å; A211-I286 HydrophobicContact CB-CG1 3.85Å; A214-I286 HydrophobicContact CB-CG2 3.55Å; L264-I286 HydrophobicContact CD1-CB 4.35Å; L264-I286 HydrophobicContact CD1-CG2 3.6Å; L264-I286 HydrophobicContact CD2-CD1 4.49Å; L264-I286 HydrophobicContact CD2-CG2 4.46Å; E282-I286 HydrophobicContact CG-CD1 4.16Å; E282-I286 VanDerWaalsContact O-CG1 3.31Å; E282-I286 WeakPolarHBondContact O-CG1 3.45Å; E282-I286 PolarHBondContact O-N 2.66Å; C283-I286 PolarHBondContact O-N 3.39Å; I286-S288 VanDerWaalsContact C-N 3.27Å; I286-S288 PolarHBondContact O-N 2.85Å; I286-Q289 WeakPolarHBondContact O-CB 3.42Å; I286-Q289 PolarHBondContact O-N 2.91Å; I286-Q289 VanDerWaalsContact O-N 3.11Å; I286-F290 HydrophobicContact CG2-CE2 4.2Å; I286-F290 WeakPolarHBondContact O-CD2 3.41Å
287	L	81	Confident	80.2	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-31	176.9	-74.2	166.7	0	0	0	112.6	E261 L264 L265 C283 Q289 F290 G293 A296	E261-L287 HydrophobicContact CG-CD2 4.16Å; L264-L287 HydrophobicContact CB-CD1 4.18Å; L264-L287 HydrophobicContact CB-CD2 3.66Å; L264-L287 HydrophobicContact CB-CG 3.94Å; L264-L287 HydrophobicContact CD1-CD2 4.05Å; L264-L287 HydrophobicContact CD1-CG 4.29Å; L265-L287 HydrophobicContact CD2-CD1 4.16Å; C283-L287 VanDerWaalsContact O-CB 3.31Å; C283-L287 WeakPolarHBondContact O-CB 3.46Å; C283-L287 VanDerWaalsContact O-CG 3.29Å; C283-L287 WeakPolarHBondContact O-CG 3.47Å; C283-L287 PolarHBondContact O-N 3.5Å; L287-Q289 PolarHBondContact O-N 3.42Å; L287-Q289 VanDerWaalsContact O-N 3.14Å; L287-F290 CarbonylContact O-C 3.37Å; L287-F290 PolarHBondContact O-N 3.11Å; L287-G293 WeakPolarHBondContact O-CA 3.48Å; L287-G293 PolarHBondContact O-N 2.86Å; L287-A296 HydrophobicContact CB-CB 3.73Å; L287-A296 HydrophobicContact CD1-CB 3.61Å; L287-A296 HydrophobicContact CG-CB 4.19Å
288	S	79.1	Confident	80.2	Confident	41 Å²	41	47.4 Å²	47.4	29%	0.287	24%	0.241	S	C	.	.	H	α-helix	trans	-59.7	-24.2	175.4	75.9	0	0	0	0	113.8	A284 K285 I286 F290 R292 G293	A284-S288 WeakPolarHBondContact O-CB 3.04Å; A284-S288 PolarHBondContact O-N 2.88Å; K285-S288 PolarHBondContact O-N 2.57Å; K285-S288 PolarHBondContact O-OG 3.18Å; I286-S288 VanDerWaalsContact C-N 3.27Å; I286-S288 PolarHBondContact O-N 2.85Å; S288-F290 VanDerWaalsContact C-N 3.33Å; S288-R292 CarbonylContact O-C 3.51Å; S288-R292 WeakPolarHBondContact O-CA 3.31Å; S288-G293 PolarHBondContact O-N 3.36Å
289	Q	74.2	Confident	80.1	Confident	91 Å²	91	46 Å²	46	43%	0.425	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-22.8	175.6	-55.6	-178.7	15.1	0	0	112.3	I286 L287	I286-Q289 WeakPolarHBondContact O-CB 3.42Å; I286-Q289 PolarHBondContact O-N 2.91Å; I286-Q289 VanDerWaalsContact O-N 3.11Å; L287-Q289 PolarHBondContact O-N 3.42Å; L287-Q289 VanDerWaalsContact O-N 3.14Å
290	F	71.1	Confident	80.2	Confident	1 Å²	1	44.5 Å²	44.5	0%	0.004	22%	0.215	C	C	.	.	S	Bend	trans	-98.1	125.9	177.4	-64.9	-77.8	0	0	0	110.2	A214 Q218 L260 L264 I286 L287 S288 R292 G293	A214-F290 HydrophobicContact CB-CE2 3.32Å; A214-F290 HydrophobicContact CB-CZ 3.41Å; A214-F290 VanDerWaalsContact CB-CZ 3.41Å; Q218-F290 HydrophobicContact CB-CE1 4.36Å; L260-F290 HydrophobicContact CD2-CE2 4.34Å; L260-F290 HydrophobicContact CD2-CZ 3.87Å; L264-F290 HydrophobicContact CD1-CE2 4.28Å; I286-F290 HydrophobicContact CG2-CE2 4.2Å; I286-F290 WeakPolarHBondContact O-CD2 3.41Å; L287-F290 CarbonylContact O-C 3.37Å; L287-F290 PolarHBondContact O-N 3.11Å; S288-F290 VanDerWaalsContact C-N 3.33Å; F290-R292 PolarHBondContact O-N 2.65Å; F290-G293 PolarHBondContact O-N 2.91Å
291	N	69.8	Low	80.3	Confident	83 Å²	83	44.3 Å²	44.3	44%	0.444	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	50.1	31.4	178	-60.7	-30.2	0	0	0	113.9	G293 T294	N291-G293 PolarHBondContact O-N 2.81Å; N291-T294 WeakPolarHBondContact O-CB 3.39Å; N291-T294 PolarHBondContact O-N 3.31Å; N291-T294 VanDerWaalsContact O-N 3.17Å; N291-T294 PolarHBondContact O-OG1 2.9Å
292	R	64	Low	80.3	Confident	215 Å²	215	44.8 Å²	44.8	81%	0.811	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	57.4	23.5	-174.7	-53.9	-178.7	179	-172.4	-0.5	114.4	S288 F290 T294	S288-R292 CarbonylContact O-C 3.51Å; S288-R292 WeakPolarHBondContact O-CA 3.31Å; F290-R292 PolarHBondContact O-N 2.65Å; R292-T294 PolarHBondContact O-N 3.41Å
293	G	71.3	Confident	80.4	Confident	4 Å²	4	42.6 Å²	42.6	4%	0.041	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	75.2	-0.9	-176.4	0	0	0	0	0	115.1	L287 S288 F290 N291 S295 A296 M297	L287-G293 WeakPolarHBondContact O-CA 3.48Å; L287-G293 PolarHBondContact O-N 2.86Å; S288-G293 PolarHBondContact O-N 3.36Å; F290-G293 PolarHBondContact O-N 2.91Å; N291-G293 PolarHBondContact O-N 2.81Å; G293-S295 VanDerWaalsContact C-N 3.28Å; G293-S295 PolarHBondContact O-N 3.28Å; G293-A296 PolarHBondContact O-N 2.94Å; G293-M297 VanDerWaalsContact O-CG 3.25Å; G293-M297 WeakPolarHBondContact O-CG 3.3Å; G293-M297 PolarHBondContact O-N 3.39Å
294	T	79.5	Confident	80.5	Confident	54 Å²	54	43.9 Å²	43.9	33%	0.331	22%	0.216	S	C	.	.	H	α-helix	trans	-54.3	-42.5	-173	-46	0	0	0	0	112.7	N291 R292 M297 Q298	N291-T294 WeakPolarHBondContact O-CB 3.39Å; N291-T294 PolarHBondContact O-N 3.31Å; N291-T294 VanDerWaalsContact O-N 3.17Å; N291-T294 PolarHBondContact O-OG1 2.9Å; R292-T294 PolarHBondContact O-N 3.41Å; T294-M297 PolarHBondContact O-N 2.99Å; T294-Q298 HydrophobicContact CG2-CG 4.34Å; T294-Q298 VanDerWaalsContact O-CB 3.31Å; T294-Q298 WeakPolarHBondContact O-CB 3.36Å; T294-Q298 VanDerWaalsContact O-CG 3.25Å; T294-Q298 WeakPolarHBondContact O-CG 3.45Å; T294-Q298 PolarHBondContact O-N 3.16Å
295	S	77.1	Confident	80.5	Confident	28 Å²	28	47.9 Å²	47.9	20%	0.196	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-46.5	177.9	52.1	0	0	0	0	112.1	E261 G293 Q298 H299	E261-S295 WeakPolarHBondContact OE1-CB 3.38Å; E261-S295 PolarHBondContact OE1-OG 3.13Å; G293-S295 VanDerWaalsContact C-N 3.28Å; G293-S295 PolarHBondContact O-N 3.28Å; S295-Q298 PolarHBondContact O-N 3.47Å; S295-H299 WeakPolarHBondContact O-CB 3.39Å; S295-H299 PolarHBondContact O-N 3.1Å
296	A	80.8	Confident	80.5	Confident	2 Å²	2	43.5 Å²	43.5	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-41.3	177.2	0	0	0	0	0	112.3	L265 L287 G293 Y300	L265-A296 HydrophobicContact CD2-CB 4.39Å; L287-A296 HydrophobicContact CB-CB 3.73Å; L287-A296 HydrophobicContact CD1-CB 3.61Å; L287-A296 HydrophobicContact CG-CB 4.19Å; G293-A296 PolarHBondContact O-N 2.94Å; A296-Y300 VanDerWaalsContact O-CB 3.22Å; A296-Y300 WeakPolarHBondContact O-CB 3.15Å; A296-Y300 PolarHBondContact O-N 3.49Å
297	M	85.6	Confident	80.7	Confident	7 Å²	7	43.8 Å²	43.8	3%	0.034	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-50.2	176.5	-61.6	-167.9	-81.4	0	0	111.1	G293 T294 H299 Y300 V301 F359 E364 V365 I368	G293-M297 VanDerWaalsContact O-CG 3.25Å; G293-M297 WeakPolarHBondContact O-CG 3.3Å; G293-M297 PolarHBondContact O-N 3.39Å; T294-M297 PolarHBondContact O-N 2.99Å; M297-H299 PolarHBondContact O-N 3.49Å; M297-Y300 PolarHBondContact O-N 3.14Å; M297-V301 WeakPolarHBondContact O-CG2 3.37Å; M297-V301 PolarHBondContact O-N 3.18Å; M297-V301 VanDerWaalsContact O-N 3.08Å; M297-F359 HydrophobicContact CG-CD1 4.21Å; M297-F359 HydrophobicContact CG-CE1 4.16Å; M297-E364 HydrophobicContact CE-CB 4.24Å; M297-E364 HydrophobicContact SD-CB 3.84Å; M297-V365 HydrophobicContact CB-CG2 4.17Å; M297-V365 HydrophobicContact CG-CG2 3.59Å; M297-V365 HydrophobicContact SD-CG2 3.48Å; M297-V365 WeakPolarHBondContact SD-CG2 3.18Å; M297-I368 HydrophobicContact CB-CD1 3.83Å
298	Q	86.7	Confident	80.8	Confident	107 Å²	107	49 Å²	49	50%	0.5	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-42	177.3	-73.9	176.9	-8.5	0	0	112	T294 S295 V301 A302 I368	T294-Q298 HydrophobicContact CG2-CG 4.34Å; T294-Q298 VanDerWaalsContact O-CB 3.31Å; T294-Q298 WeakPolarHBondContact O-CB 3.36Å; T294-Q298 VanDerWaalsContact O-CG 3.25Å; T294-Q298 WeakPolarHBondContact O-CG 3.45Å; T294-Q298 PolarHBondContact O-N 3.16Å; S295-Q298 PolarHBondContact O-N 3.47Å; Q298-V301 PolarHBondContact O-N 2.85Å; Q298-A302 WeakPolarHBondContact O-CB 3.4Å; Q298-A302 PolarHBondContact O-N 2.82Å; Q298-I368 HydrophobicContact CG-CD1 4.47Å
299	H	84.6	Confident	80.9	Confident	61 Å²	61	50.1 Å²	50.1	28%	0.282	25%	0.254	S	S	.	.	H	α-helix	trans	-65.5	-44.5	178	-166.8	-90.1	0	0	0	111.8	L265 D269 S295 M297 V301 A302 T303	L265-H299 HydrophobicContact CD2-CB 3.96Å; D269-H299 VanDerWaalsContact CG-CE1 3.47Å; D269-H299 IonicContact OD1-CE1 3.98Å; D269-H299 PolarHBondContact OD1-CE1 3.36Å; D269-H299 IonicContact OD1-ND1 3.12Å; D269-H299 PolarHBondContact OD1-ND1 3.28Å; D269-H299 IonicContact OD2-CE1 2.64Å; D269-H299 PolarHBondContact OD2-CE1 3.04Å; D269-H299 IonicContact OD2-ND1 3.2Å; D269-H299 IonicContact OD2-NE2 3.56Å; S295-H299 WeakPolarHBondContact O-CB 3.39Å; S295-H299 PolarHBondContact O-N 3.1Å; M297-H299 PolarHBondContact O-N 3.49Å; H299-V301 PolarHBondContact O-N 3.47Å; H299-A302 PolarHBondContact O-N 3.42Å; H299-T303 VanDerWaalsContact CE1-CG2 3.42Å; H299-T303 WeakPolarHBondContact CE1-CG2 3.39Å; H299-T303 WeakPolarHBondContact O-CB 3.34Å; H299-T303 VanDerWaalsContact O-CG2 3.31Å; H299-T303 WeakPolarHBondContact O-CG2 3.38Å; H299-T303 PolarHBondContact O-N 3.39Å; H299-T303 PolarHBondContact O-OG1 3.4Å
300	Y	87.3	Confident	81.1	Confident	2 Å²	2	50 Å²	50	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-58.3	-47.6	176.1	176.1	-99.9	0	0	0	111.9	F268 M280 A296 M297 T303 R304 E351 T354 I355 F359 V365	F268-Y300 AromaticContact CE1-CD2 3.59Å; F268-Y300 HydrophobicContact CE1-CD2 3.59Å; F268-Y300 HydrophobicContact CE1-CG 4.22Å; F268-Y300 AromaticContact CZ-CD2 3.51Å; F268-Y300 HydrophobicContact CZ-CD2 3.51Å; F268-Y300 HydrophobicContact CZ-CE2 4.29Å; F268-Y300 HydrophobicContact CZ-CG 4.14Å; M280-Y300 HydrophobicContact CE-CD2 4.21Å; M280-Y300 HydrophobicContact CE-CE2 3.7Å; A296-Y300 VanDerWaalsContact O-CB 3.22Å; A296-Y300 WeakPolarHBondContact O-CB 3.15Å; A296-Y300 PolarHBondContact O-N 3.49Å; M297-Y300 PolarHBondContact O-N 3.14Å; Y300-T303 PolarHBondContact O-OG1 2.92Å; Y300-R304 VanDerWaalsContact CE2-CZ 3.48Å; Y300-R304 WeakPolarHBondContact O-CG 3.19Å; Y300-R304 PolarHBondContact O-NE 2.89Å; Y300-R304 VanDerWaalsContact O-NE 3.09Å; Y300-R304 PolarHBondContact OH-NH1 3.2Å; Y300-E351 PolarHBondContact OH-OE2 3.35Å; Y300-T354 WeakPolarHBondContact OH-CG2 3.34Å; Y300-I355 HydrophobicContact CD1-CG1 4.46Å; Y300-I355 HydrophobicContact CE1-CD1 4.13Å; Y300-I355 HydrophobicContact CE1-CG1 3.71Å; Y300-F359 AromaticContact CD1-CE2 3.8Å; Y300-F359 HydrophobicContact CD1-CE2 3.8Å; Y300-F359 HydrophobicContact CD1-CZ 4.08Å; Y300-F359 HydrophobicContact CD2-CE2 4.13Å; Y300-F359 HydrophobicContact CD2-CZ 4.19Å; Y300-F359 HydrophobicContact CE1-CE2 4.2Å; Y300-F359 HydrophobicContact CE2-CE2 4.44Å; Y300-F359 AromaticContact CG-CE2 3.77Å; Y300-F359 HydrophobicContact CG-CE2 3.77Å; Y300-F359 AromaticContact CG-CZ 3.7Å; Y300-F359 HydrophobicContact CG-CZ 3.7Å; Y300-V365 HydrophobicContact CD1-CG1 4.27Å
301	V	88.8	Confident	81.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-42.4	177.3	175.1	0	0	0	0	110.4	M297 Q298 H299 T303 R304 F307 V365 I368 L369 R372	M297-V301 WeakPolarHBondContact O-CG2 3.37Å; M297-V301 PolarHBondContact O-N 3.18Å; M297-V301 VanDerWaalsContact O-N 3.08Å; Q298-V301 PolarHBondContact O-N 2.85Å; H299-V301 PolarHBondContact O-N 3.47Å; V301-T303 VanDerWaalsContact C-N 3.31Å; V301-T303 PolarHBondContact O-N 3.01Å; V301-R304 WeakPolarHBondContact O-CG 3.37Å; V301-R304 PolarHBondContact O-N 3.24Å; V301-F307 HydrophobicContact CG1-CD2 4.49Å; V301-F307 HydrophobicContact CG1-CE2 3.84Å; V301-F307 HydrophobicContact CG1-CZ 4.48Å; V301-F307 WeakPolarHBondContact O-CD2 3.43Å; V301-V365 HydrophobicContact CG2-CG1 4.22Å; V301-I368 HydrophobicContact CB-CG2 4.21Å; V301-I368 HydrophobicContact CG1-CG2 4.28Å; V301-I368 HydrophobicContact CG2-CB 4.48Å; V301-I368 HydrophobicContact CG2-CG2 4.04Å; V301-L369 HydrophobicContact CG1-CB 4.5Å; V301-L369 HydrophobicContact CG1-CD1 4.12Å; V301-L369 HydrophobicContact CG2-CB 4.08Å; V301-R372 HydrophobicContact CG1-CB 4.2Å
302	A	86.8	Confident	82.3	Confident	26 Å²	26	54.4 Å²	54.4	22%	0.215	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-33.5	-179.6	0	0	0	0	0	114.2	Q298 H299 R304 I308	Q298-A302 WeakPolarHBondContact O-CB 3.4Å; Q298-A302 PolarHBondContact O-N 2.82Å; H299-A302 PolarHBondContact O-N 3.42Å; A302-R304 VanDerWaalsContact C-N 3.31Å; A302-R304 PolarHBondContact O-N 3.49Å; A302-I308 WeakPolarHBondContact O-CD1 3.37Å; A302-I308 WeakPolarHBondContact O-CG1 3.5Å
303	T	86.7	Confident	83.1	Confident	42 Å²	42	49.1 Å²	49.1	26%	0.258	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-3.8	-178.5	53	0	0	0	0	114	H299 Y300 V301	H299-T303 VanDerWaalsContact CE1-CG2 3.42Å; H299-T303 WeakPolarHBondContact CE1-CG2 3.39Å; H299-T303 WeakPolarHBondContact O-CB 3.34Å; H299-T303 VanDerWaalsContact O-CG2 3.31Å; H299-T303 WeakPolarHBondContact O-CG2 3.38Å; H299-T303 PolarHBondContact O-N 3.39Å; H299-T303 PolarHBondContact O-OG1 3.4Å; Y300-T303 PolarHBondContact O-OG1 2.92Å; V301-T303 VanDerWaalsContact C-N 3.31Å; V301-T303 PolarHBondContact O-N 3.01Å
304	R	86.5	Confident	83.7	Confident	28 Å²	28	52.3 Å²	52.3	11%	0.106	28%	0.281	C	S	.	.	S	Bend	trans	-66.9	135.4	179.9	-61.8	-60	87.4	-175.1	2.5	110.4	S272 Y300 V301 A302 M306 F307 E351	S272-R304 PolarHBondContact OG-NH2 2.89Å; Y300-R304 VanDerWaalsContact CE2-CZ 3.48Å; Y300-R304 WeakPolarHBondContact O-CG 3.19Å; Y300-R304 PolarHBondContact O-NE 2.89Å; Y300-R304 VanDerWaalsContact O-NE 3.09Å; Y300-R304 PolarHBondContact OH-NH1 3.2Å; V301-R304 WeakPolarHBondContact O-CG 3.37Å; V301-R304 PolarHBondContact O-N 3.24Å; A302-R304 VanDerWaalsContact C-N 3.31Å; A302-R304 PolarHBondContact O-N 3.49Å; R304-M306 HydrophobicContact CB-CE 3.68Å; R304-M306 HydrophobicContact CB-CG 3.97Å; R304-M306 HydrophobicContact CG-CE 3.75Å; R304-M306 PolarHBondContact O-N 2.93Å; R304-F307 HydrophobicContact CB-CD2 4Å; R304-F307 HydrophobicContact CB-CE2 4.3Å; R304-F307 PolarHBondContact O-N 3.31Å; R304-E351 WeakPolarHBondContact CD-OE2 3.5Å; R304-E351 IonicContact NH1-OE2 3.12Å
305	P	83.9	Confident	84	Confident	85 Å²	85	51.8 Å²	51.8	55%	0.552	28%	0.279	S	S	*	.	H	α-helix	trans	-53.3	-33	-179.5	-28.5	34.8	0	0	0	114.1	F307 I308 D309	P305-F307 PolarHBondContact O-N 3.4Å; P305-I308 PolarHBondContact O-N 3.22Å; P305-D309 WeakPolarHBondContact O-CB 3.39Å; P305-D309 PolarHBondContact O-N 2.69Å
306	M	84.4	Confident	84.5	Confident	24 Å²	24	50.7 Å²	50.7	12%	0.118	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-13.3	179.4	64.5	-176.9	147.9	0	0	115.4	R304 E351 L369	R304-M306 HydrophobicContact CB-CE 3.68Å; R304-M306 HydrophobicContact CB-CG 3.97Å; R304-M306 HydrophobicContact CG-CE 3.75Å; R304-M306 PolarHBondContact O-N 2.93Å; M306-E351 HydrophobicContact CE-CG 3.99Å; M306-L369 HydrophobicContact CE-CD1 3.49Å; M306-L369 VanDerWaalsContact CE-CD1 3.49Å
307	F	86.7	Confident	84.8	Confident	19 Å²	19	52.3 Å²	52.3	8%	0.083	28%	0.279	C	S	.	.	H	α-helix	trans	-114.4	-18.2	178.4	-57.8	-63.1	0	0	0	114.6	V301 R304 P305 L369 R372 V373 Q376	V301-F307 HydrophobicContact CG1-CD2 4.49Å; V301-F307 HydrophobicContact CG1-CE2 3.84Å; V301-F307 HydrophobicContact CG1-CZ 4.48Å; V301-F307 WeakPolarHBondContact O-CD2 3.43Å; R304-F307 HydrophobicContact CB-CD2 4Å; R304-F307 HydrophobicContact CB-CE2 4.3Å; R304-F307 PolarHBondContact O-N 3.31Å; P305-F307 PolarHBondContact O-N 3.4Å; F307-L369 HydrophobicContact CE2-CD1 3.91Å; F307-L369 HydrophobicContact CZ-CD1 4.01Å; F307-R372 HydrophobicContact CD1-CG 4.05Å; F307-R372 HydrophobicContact CE1-CB 4.16Å; F307-R372 HydrophobicContact CE1-CG 3.76Å; F307-R372 HydrophobicContact CE2-CG 4.38Å; F307-R372 HydrophobicContact CG-CG 4.48Å; F307-R372 HydrophobicContact CZ-CB 3.98Å; F307-R372 HydrophobicContact CZ-CG 3.93Å; F307-V373 HydrophobicContact CE1-CG2 4.14Å; F307-V373 HydrophobicContact CZ-CG2 3.76Å; F307-Q376 PolarHBondContact O-NE2 3.04Å
308	I	82	Confident	84.8	Confident	109 Å²	109	58.7 Å²	58.7	56%	0.559	30%	0.303	S	S	*	.	H	α-helix	trans	-100	-38.1	-175.7	-64.6	175.7	0	0	0	110.9	A302 P305 V310	A302-I308 WeakPolarHBondContact O-CD1 3.37Å; A302-I308 WeakPolarHBondContact O-CG1 3.5Å; P305-I308 PolarHBondContact O-N 3.22Å; I308-V310 PolarHBondContact O-N 3.46Å
309	D	80.3	Confident	84.9	Confident	65 Å²	65	57.3 Å²	57.3	35%	0.348	30%	0.299	S	S	.	.			trans	-75.7	110.4	-170	-167	-15.5	0	0	0	111.3	P305 E311 V312 M313	P305-D309 WeakPolarHBondContact O-CB 3.39Å; P305-D309 PolarHBondContact O-N 2.69Å; D309-E311 PolarHBondContact O-N 2.88Å; D309-E311 WeakPolarHBondContact OD1-CA 3.44Å; D309-E311 VanDerWaalsContact OD1-CB 3.24Å; D309-E311 WeakPolarHBondContact OD1-CB 3.28Å; D309-E311 PolarHBondContact OD1-N 3.18Å; D309-V312 HydrophobicContact CB-CB 4.1Å; D309-V312 HydrophobicContact CB-CG2 3.68Å; D309-V312 WeakPolarHBondContact O-CB 3.45Å; D309-V312 PolarHBondContact O-N 3.49Å; D309-V312 VanDerWaalsContact O-N 3.07Å; D309-M313 PolarHBondContact O-N 3.06Å
310	V	79.8	Confident	85	Confident	89 Å²	89	54.6 Å²	54.6	54%	0.539	29%	0.287	S	S	.	.	H	α-helix	trans	-61.5	-29	176.7	179.3	0	0	0	0	110.9	I308 V312 M313 N314	I308-V310 PolarHBondContact O-N 3.46Å; V310-V312 VanDerWaalsContact C-N 3.34Å; V310-M313 HydrophobicContact CG1-CE 4.44Å; V310-M313 PolarHBondContact O-N 3.22Å; V310-N314 WeakPolarHBondContact O-CB 3.22Å; V310-N314 VanDerWaalsContact O-CG 3.3Å; V310-N314 PolarHBondContact O-N 2.79Å; V310-N314 PolarHBondContact O-ND2 2.84Å
311	E	82.7	Confident	84.8	Confident	144 Å²	144	56.7 Å²	56.7	67%	0.673	30%	0.298	S	S	*	.	H	α-helix	trans	-67.7	-36.3	175.2	-59.5	-171.4	174.2	0	0	111.6	D309 N314 S315	D309-E311 PolarHBondContact O-N 2.88Å; D309-E311 WeakPolarHBondContact OD1-CA 3.44Å; D309-E311 VanDerWaalsContact OD1-CB 3.24Å; D309-E311 WeakPolarHBondContact OD1-CB 3.28Å; D309-E311 PolarHBondContact OD1-N 3.18Å; E311-N314 PolarHBondContact O-N 2.85Å; E311-S315 VanDerWaalsContact O-CB 3.25Å; E311-S315 WeakPolarHBondContact O-CB 3.21Å; E311-S315 PolarHBondContact O-N 3.5Å
312	V	83.1	Confident	84.5	Confident	32 Å²	32	58.2 Å²	58.2	19%	0.194	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-49.4	174.5	175.1	0	0	0	0	109.9	D309 V310 N314 S315 D316	D309-V312 HydrophobicContact CB-CB 4.1Å; D309-V312 HydrophobicContact CB-CG2 3.68Å; D309-V312 WeakPolarHBondContact O-CB 3.45Å; D309-V312 PolarHBondContact O-N 3.49Å; D309-V312 VanDerWaalsContact O-N 3.07Å; V310-V312 VanDerWaalsContact C-N 3.34Å; V312-N314 VanDerWaalsContact C-N 3.32Å; V312-N314 PolarHBondContact O-N 3.23Å; V312-S315 WeakPolarHBondContact CA-OG 3.35Å; V312-S315 WeakPolarHBondContact O-CA 3.43Å; V312-S315 WeakPolarHBondContact O-CB 3.35Å; V312-S315 PolarHBondContact O-N 2.79Å; V312-S315 PolarHBondContact O-OG 3.1Å; V312-D316 PolarHBondContact O-N 2.83Å
313	M	80.7	Confident	83.8	Confident	103 Å²	103	63.3 Å²	63.3	51%	0.507	34%	0.337	S	S	.	.	H	α-helix	trans	-59.6	-41.5	177	-175	178.5	63.2	0	0	112.2	D309 V310 S315 D316 I317	D309-M313 PolarHBondContact O-N 3.06Å; V310-M313 HydrophobicContact CG1-CE 4.44Å; V310-M313 PolarHBondContact O-N 3.22Å; M313-S315 VanDerWaalsContact C-N 3.33Å; M313-D316 PolarHBondContact O-N 3.43Å; M313-I317 WeakPolarHBondContact O-CG1 3.36Å; M313-I317 PolarHBondContact O-N 2.76Å
314	N	84.6	Confident	82.4	Confident	72 Å²	72	70.7 Å²	70.7	39%	0.385	37%	0.368	S	S	.	.	H	α-helix	trans	-70.3	-28.9	175	-73.3	-31.7	0	0	0	112.8	V310 E311 V312 R318	V310-N314 WeakPolarHBondContact O-CB 3.22Å; V310-N314 VanDerWaalsContact O-CG 3.3Å; V310-N314 PolarHBondContact O-N 2.79Å; V310-N314 PolarHBondContact O-ND2 2.84Å; E311-N314 PolarHBondContact O-N 2.85Å; V312-N314 VanDerWaalsContact C-N 3.32Å; V312-N314 PolarHBondContact O-N 3.23Å; N314-R318 WeakPolarHBondContact O-CG 3.5Å; N314-R318 PolarHBondContact O-N 3.15Å; N314-R318 VanDerWaalsContact O-N 3.07Å; N314-R318 PolarHBondContact O-NE 3.31Å
315	S	85.7	Confident	81.1	Confident	42 Å²	42	73.1 Å²	73.1	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-68.6	-39.5	173.4	78.8	0	0	0	0	111.5	E311 V312 M313 I317 R318 L319	E311-S315 VanDerWaalsContact O-CB 3.25Å; E311-S315 WeakPolarHBondContact O-CB 3.21Å; E311-S315 PolarHBondContact O-N 3.5Å; V312-S315 WeakPolarHBondContact CA-OG 3.35Å; V312-S315 WeakPolarHBondContact O-CA 3.43Å; V312-S315 WeakPolarHBondContact O-CB 3.35Å; V312-S315 PolarHBondContact O-N 2.79Å; V312-S315 PolarHBondContact O-OG 3.1Å; M313-S315 VanDerWaalsContact C-N 3.33Å; S315-I317 VanDerWaalsContact C-N 3.35Å; S315-I317 PolarHBondContact O-N 3.08Å; S315-R318 PolarHBondContact O-N 3.43Å; S315-L319 VanDerWaalsContact O-CB 3.31Å; S315-L319 WeakPolarHBondContact O-CB 3.36Å; S315-L319 PolarHBondContact O-N 2.83Å
316	D	87.6	Confident	80.1	Confident	6 Å²	6	72.6 Å²	72.6	3%	0.032	40%	0.4	C	S	.	.	H	α-helix	trans	-60.5	-46.2	174.7	-64.7	-10.8	0	0	0	110.1	V312 M313 R318 L319 V320 L340 R377	V312-D316 PolarHBondContact O-N 2.83Å; M313-D316 PolarHBondContact O-N 3.43Å; D316-R318 PolarHBondContact O-N 3.5Å; D316-L319 PolarHBondContact O-N 3.15Å; D316-V320 WeakPolarHBondContact O-CG2 3.45Å; D316-V320 PolarHBondContact O-N 3.05Å; D316-V320 VanDerWaalsContact O-N 3.1Å; D316-L340 HydrophobicContact CB-CD1 3.97Å; D316-L340 HydrophobicContact CB-CD2 4.02Å; D316-L340 VanDerWaalsContact CG-CD1 3.44Å; D316-L340 WeakPolarHBondContact OD1-CD1 3.3Å; D316-R377 IonicContact OD1-CZ 3.99Å; D316-R377 IonicContact OD1-NE 3.32Å; D316-R377 IonicContact OD1-NH2 3.41Å; D316-R377 PolarHBondContact OD1-NH2 3.35Å; D316-R377 IonicContact OD2-CZ 3.3Å; D316-R377 IonicContact OD2-NE 2.6Å; D316-R377 PolarHBondContact OD2-NE 2.94Å; D316-R377 IonicContact OD2-NH2 3.74Å; D316-R377 PolarHBondContact OD2-NH2 3.38Å
317	I	85.8	Confident	79.3	Confident	35 Å²	35	77.6 Å²	77.6	18%	0.179	42%	0.424	C	S	.	.	H	α-helix	trans	-59.4	-48.3	176.8	-66.5	168.9	0	0	0	111.1	M313 S315 L319 V320 L321 I381 K384	M313-I317 WeakPolarHBondContact O-CG1 3.36Å; M313-I317 PolarHBondContact O-N 2.76Å; S315-I317 VanDerWaalsContact C-N 3.35Å; S315-I317 PolarHBondContact O-N 3.08Å; I317-L319 VanDerWaalsContact C-N 3.34Å; I317-L319 PolarHBondContact O-N 2.99Å; I317-V320 PolarHBondContact O-N 3.06Å; I317-L321 HydrophobicContact CG2-CD1 4.24Å; I317-L321 WeakPolarHBondContact O-CB 3.47Å; I317-L321 PolarHBondContact O-N 3.33Å; I317-I381 HydrophobicContact CB-CD1 4.45Å; I317-I381 HydrophobicContact CG1-CD1 3.97Å; I317-K384 HydrophobicContact CD1-CG 4.33Å; I317-K384 HydrophobicContact CG1-CG 4.49Å
318	R	86.6	Confident	78.7	Confident	141 Å²	141	78.7 Å²	78.7	53%	0.532	43%	0.432	S	S	.	.	H	α-helix	trans	-64.9	-36.9	178.7	-75.6	-177.4	-66.8	-167.8	0.5	112.6	N314 S315 D316 V320 G322	N314-R318 WeakPolarHBondContact O-CG 3.5Å; N314-R318 PolarHBondContact O-N 3.15Å; N314-R318 VanDerWaalsContact O-N 3.07Å; N314-R318 PolarHBondContact O-NE 3.31Å; S315-R318 PolarHBondContact O-N 3.43Å; D316-R318 PolarHBondContact O-N 3.5Å; R318-V320 VanDerWaalsContact C-N 3.3Å; R318-V320 PolarHBondContact O-N 3.07Å; R318-G322 WeakPolarHBondContact O-CA 3.49Å; R318-G322 PolarHBondContact O-N 2.95Å
319	L	87.4	Confident	78.8	Confident	78 Å²	78	75 Å²	75	41%	0.408	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-37.2	178.4	-177.9	63.6	0	0	0	111.6	S315 D316 I317 A339 L340	S315-L319 VanDerWaalsContact O-CB 3.31Å; S315-L319 WeakPolarHBondContact O-CB 3.36Å; S315-L319 PolarHBondContact O-N 2.83Å; D316-L319 PolarHBondContact O-N 3.15Å; I317-L319 VanDerWaalsContact C-N 3.34Å; I317-L319 PolarHBondContact O-N 2.99Å; L319-A339 HydrophobicContact CD1-CB 4.48Å; L319-A339 HydrophobicContact CD2-CB 4.26Å; L319-L340 HydrophobicContact CD2-CB 3.99Å
320	V	87.7	Confident	79.2	Confident	5 Å²	5	73.5 Å²	73.5	3%	0.03	41%	0.41	C	S	.	.	H	α-helix	trans	-91.9	-46.5	-175.5	-176.2	0	0	0	0	113.4	D316 I317 R318 V333 L337 L340 I381 I385	D316-V320 WeakPolarHBondContact O-CG2 3.45Å; D316-V320 PolarHBondContact O-N 3.05Å; D316-V320 VanDerWaalsContact O-N 3.1Å; I317-V320 PolarHBondContact O-N 3.06Å; R318-V320 VanDerWaalsContact C-N 3.3Å; R318-V320 PolarHBondContact O-N 3.07Å; V320-V333 HydrophobicContact CG1-CB 4.49Å; V320-V333 HydrophobicContact CG1-CG1 3.93Å; V320-L337 HydrophobicContact CG1-CD2 4.01Å; V320-L337 HydrophobicContact CG1-CG 3.92Å; V320-L337 HydrophobicContact CG2-CD2 4.11Å; V320-L340 HydrophobicContact CG2-CB 4.29Å; V320-L340 HydrophobicContact CG2-CD2 3.84Å; V320-I381 HydrophobicContact CB-CD1 4.17Å; V320-I381 HydrophobicContact CB-CG1 4.35Å; V320-I381 HydrophobicContact CG2-CD1 4.16Å; V320-I381 HydrophobicContact CG2-CG1 4.07Å; V320-I385 HydrophobicContact CG1-CD1 3.71Å; V320-I385 HydrophobicContact CG1-CG1 4.33Å
321	L	83.8	Confident	79.7	Confident	45 Å²	45	73.3 Å²	73.3	24%	0.236	41%	0.413	C	S	.	.	H	α-helix	trans	-94.4	-11.5	-175.7	-63.4	-179.1	0	0	0	113.6	I317 P328 V333 K384 I385	I317-L321 HydrophobicContact CG2-CD1 4.24Å; I317-L321 WeakPolarHBondContact O-CB 3.47Å; I317-L321 PolarHBondContact O-N 3.33Å; L321-P328 HydrophobicContact CD2-CB 4.34Å; L321-V333 HydrophobicContact CD2-CG2 4.29Å; L321-K384 HydrophobicContact CD1-CB 4.26Å; L321-I385 HydrophobicContact CD2-CG1 4.06Å
322	G	80.6	Confident	80	Confident	33 Å²	33	70.1 Å²	70.1	34%	0.34	40%	0.401	S	S	.	.			trans	75.1	-169.2	-173.8	0	0	0	0	0	113.1	R318	R318-G322 WeakPolarHBondContact O-CA 3.49Å; R318-G322 PolarHBondContact O-N 2.95Å
323	D	72.3	Confident	80.4	Confident	132 Å²	132	68.7 Å²	68.7	71%	0.706	39%	0.392	S	S	*	.	S	Bend	trans	-69.5	146.4	175.3	-70.9	-35.1	0	0	0	111.2	G325	D323-G325 PolarHBondContact O-N 3.29Å
324	H	57.9	Low	81	Confident	197 Å²	197	64.3 Å²	64.3	91%	0.912	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	106	-179.3	-68.5	-65.5	0	0	0	111.7
325	G	59.3	Low	81.5	Confident	79 Å²	79	69.2 Å²	69.2	81%	0.814	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	143	-19.1	170.3	0	0	0	0	0	116.4	D323	D323-G325 PolarHBondContact O-N 3.29Å
326	S	63.5	Low	81.8	Confident	74 Å²	74	67.4 Å²	67.4	52%	0.517	37%	0.374	S	S	.	.	S	Bend	trans	-80.5	133	172.9	52.8	0	0	0	0	111.4
327	Q	66.8	Low	82.2	Confident	130 Å²	130	67.1 Å²	67.1	61%	0.607	37%	0.372	S	S	*	.			trans	-56.8	128.6	168.5	-81.9	-71.7	-26.9	0	0	109.5	S329	Q327-S329 PolarHBondContact O-N 3.29Å; Q327-S329 VanDerWaalsContact O-N 3.08Å
328	P	73.7	Confident	82.7	Confident	41 Å²	41	67.7 Å²	67.7	27%	0.266	38%	0.379	S	S	.	.			trans	-66	112.1	-177.5	25.6	-32.3	0	0	0	109.5	L321 V333 M408	L321-P328 HydrophobicContact CD2-CB 4.34Å; P328-V333 HydrophobicContact CB-CG2 4.21Å; P328-M408 HydrophobicContact CB-CE 4.02Å; P328-M408 HydrophobicContact CB-SD 4.27Å; P328-M408 HydrophobicContact CG-CE 4.16Å; P328-M408 HydrophobicContact CG-SD 4.1Å
329	S	84.3	Confident	83.1	Confident	33 Å²	33	63 Å²	63	23%	0.231	37%	0.371	C	S	.	.			trans	-87.3	139	172.8	78.2	0	0	0	0	110	Q327 S331 N332 V333	Q327-S329 PolarHBondContact O-N 3.29Å; Q327-S329 VanDerWaalsContact O-N 3.08Å; S329-S331 PolarHBondContact O-N 2.95Å; S329-S331 VanDerWaalsContact O-N 3.15Å; S329-S331 PolarHBondContact OG-OG 3.36Å; S329-N332 PolarHBondContact O-N 2.94Å; S329-N332 VanDerWaalsContact O-N 3.12Å; S329-N332 VanDerWaalsContact OG-CB 3.24Å; S329-N332 WeakPolarHBondContact OG-CB 3.45Å; S329-N332 PolarHBondContact OG-N 3.32Å; S329-N332 PolarHBondContact OG-ND2 3.4Å; S329-V333 WeakPolarHBondContact O-CG2 3.41Å; S329-V333 PolarHBondContact O-N 2.8Å
330	P	88.8	Confident	83.4	Confident	32 Å²	32	59.3 Å²	59.3	21%	0.208	35%	0.351	C	S	.	.	H	α-helix	trans	-56	-34.2	179.5	-27.9	35.2	0	0	0	113.4	A334 L404 R407 V411	P330-A334 VanDerWaalsContact O-CB 3.28Å; P330-A334 WeakPolarHBondContact O-CB 3.23Å; P330-A334 PolarHBondContact O-N 3.2Å; P330-L404 HydrophobicContact CG-CD1 3.94Å; P330-R407 HydrophobicContact CB-CB 4.17Å; P330-R407 HydrophobicContact CG-CB 3.71Å; P330-V411 HydrophobicContact CB-CG2 4.23Å
331	S	89.8	Confident	83.8	Confident	85 Å²	85	59.5 Å²	59.5	59%	0.594	35%	0.352	S	S	*	.	H	α-helix	trans	-71.2	-38.9	178.5	54.5	0	0	0	0	113.3	S329 R335	S329-S331 PolarHBondContact O-N 2.95Å; S329-S331 VanDerWaalsContact O-N 3.15Å; S329-S331 PolarHBondContact OG-OG 3.36Å; S331-R335 PolarHBondContact O-N 3.25Å; S331-R335 VanDerWaalsContact O-N 3.15Å
332	N	89.4	Confident	84.4	Confident	78 Å²	78	63.9 Å²	63.9	42%	0.417	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-44.5	175.5	-75.7	-26.7	0	0	0	110.8	S329 A334 R335 G336	S329-N332 PolarHBondContact O-N 2.94Å; S329-N332 VanDerWaalsContact O-N 3.12Å; S329-N332 VanDerWaalsContact OG-CB 3.24Å; S329-N332 WeakPolarHBondContact OG-CB 3.45Å; S329-N332 PolarHBondContact OG-N 3.32Å; S329-N332 PolarHBondContact OG-ND2 3.4Å; N332-A334 VanDerWaalsContact C-N 3.34Å; N332-A334 PolarHBondContact O-N 3.21Å; N332-R335 PolarHBondContact O-N 3.31Å; N332-R335 PolarHBondContact OD1-NH2 3.3Å; N332-G336 PolarHBondContact O-N 2.9Å
333	V	91.9	Very high	85	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-60.9	-43.6	175.9	174.3	0	0	0	0	110.7	V320 L321 P328 S329 R335 G336 L337 I385 V411	V320-V333 HydrophobicContact CG1-CB 4.49Å; V320-V333 HydrophobicContact CG1-CG1 3.93Å; L321-V333 HydrophobicContact CD2-CG2 4.29Å; P328-V333 HydrophobicContact CB-CG2 4.21Å; S329-V333 WeakPolarHBondContact O-CG2 3.41Å; S329-V333 PolarHBondContact O-N 2.8Å; V333-R335 VanDerWaalsContact C-N 3.34Å; V333-R335 PolarHBondContact O-N 3Å; V333-G336 PolarHBondContact O-N 3.24Å; V333-L337 HydrophobicContact CG1-CD1 3.89Å; V333-L337 HydrophobicContact CG1-CG 4.18Å; V333-L337 WeakPolarHBondContact O-CB 3.44Å; V333-L337 WeakPolarHBondContact O-CG 3.34Å; V333-L337 PolarHBondContact O-N 3.49Å; V333-I385 HydrophobicContact CG1-CD1 4.13Å; V333-I385 HydrophobicContact CG1-CG2 4.14Å; V333-V411 HydrophobicContact CG1-CG1 4.4Å
334	A	93.8	Very high	86.1	Confident	12 Å²	12	60.1 Å²	60.1	10%	0.099	34%	0.338	C	S	.	.	H	α-helix	trans	-57.6	-46.3	176.8	0	0	0	0	0	112.2	P330 N332 S338 V411	P330-A334 VanDerWaalsContact O-CB 3.28Å; P330-A334 WeakPolarHBondContact O-CB 3.23Å; P330-A334 PolarHBondContact O-N 3.2Å; N332-A334 VanDerWaalsContact C-N 3.34Å; N332-A334 PolarHBondContact O-N 3.21Å; A334-S338 WeakPolarHBondContact O-CB 3.4Å; A334-S338 PolarHBondContact O-N 3.12Å; A334-S338 PolarHBondContact O-OG 2.87Å; A334-V411 VanDerWaalsContact CA-CG1 3.41Å; A334-V411 HydrophobicContact CB-CG1 3.46Å; A334-V411 VanDerWaalsContact CB-CG1 3.46Å; A334-V411 HydrophobicContact CB-CG2 4.35Å
335	R	93.9	Very high	87.8	Confident	174 Å²	174	50.9 Å²	50.9	66%	0.657	30%	0.296	S	S	*	.	H	α-helix	trans	-65.6	-43.5	178	178.1	175.8	55.8	168.2	-5.5	111.6	S331 N332 V333 S338 A339	S331-R335 PolarHBondContact O-N 3.25Å; S331-R335 VanDerWaalsContact O-N 3.15Å; N332-R335 PolarHBondContact O-N 3.31Å; N332-R335 PolarHBondContact OD1-NH2 3.3Å; V333-R335 VanDerWaalsContact C-N 3.34Å; V333-R335 PolarHBondContact O-N 3Å; R335-S338 PolarHBondContact O-N 2.91Å; R335-A339 PolarHBondContact O-N 2.5Å
336	G	93.3	Very high	89.5	Confident	5 Å²	5	49.9 Å²	49.9	5%	0.052	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-47.7	177.7	0	0	0	0	0	112.3	N332 V333 S338 A339 L340	N332-G336 PolarHBondContact O-N 2.9Å; V333-G336 PolarHBondContact O-N 3.24Å; G336-S338 VanDerWaalsContact C-N 3.34Å; G336-S338 PolarHBondContact O-N 2.93Å; G336-A339 PolarHBondContact O-N 3.45Å; G336-L340 WeakPolarHBondContact O-CB 3.48Å; G336-L340 PolarHBondContact O-N 3.39Å
337	L	95.6	Very high	90.8	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-42.3	174.8	-74.2	177	0	0	0	111.8	V320 V333 A339 L340 F341 I381 I385 V411 A412 R415	V320-L337 HydrophobicContact CG1-CD2 4.01Å; V320-L337 HydrophobicContact CG1-CG 3.92Å; V320-L337 HydrophobicContact CG2-CD2 4.11Å; V333-L337 HydrophobicContact CG1-CD1 3.89Å; V333-L337 HydrophobicContact CG1-CG 4.18Å; V333-L337 WeakPolarHBondContact O-CB 3.44Å; V333-L337 WeakPolarHBondContact O-CG 3.34Å; V333-L337 PolarHBondContact O-N 3.49Å; L337-A339 VanDerWaalsContact C-N 3.31Å; L337-A339 PolarHBondContact O-N 3.35Å; L337-L340 PolarHBondContact O-N 3.37Å; L337-F341 HydrophobicContact CB-CD2 4.5Å; L337-F341 HydrophobicContact CB-CE2 4.31Å; L337-F341 HydrophobicContact CD2-CE1 4.15Å; L337-F341 HydrophobicContact CD2-CE2 4.34Å; L337-F341 HydrophobicContact CD2-CZ 3.87Å; L337-F341 VanDerWaalsContact O-CB 3.24Å; L337-F341 WeakPolarHBondContact O-CB 3.45Å; L337-F341 WeakPolarHBondContact O-CG 3.43Å; L337-F341 PolarHBondContact O-N 2.86Å; L337-I381 HydrophobicContact CD2-CG1 4.47Å; L337-I381 HydrophobicContact CD2-CG2 4.32Å; L337-I385 HydrophobicContact CD1-CD1 4.21Å; L337-I385 HydrophobicContact CD2-CD1 3.79Å; L337-I385 HydrophobicContact CG-CD1 4.23Å; L337-V411 HydrophobicContact CD1-CG1 4.34Å; L337-A412 HydrophobicContact CD1-CB 4.34Å; L337-R415 HydrophobicContact CB-CB 4.15Å; L337-R415 HydrophobicContact CB-CG 4.26Å; L337-R415 HydrophobicContact CD1-CB 4.38Å
338	S	95.5	Very high	92.2	Very high	46 Å²	46	41.8 Å²	41.8	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-61.3	-40.8	177.5	-52.6	0	0	0	0	111.7	A334 R335 G336 K342 R415	A334-S338 WeakPolarHBondContact O-CB 3.4Å; A334-S338 PolarHBondContact O-N 3.12Å; A334-S338 PolarHBondContact O-OG 2.87Å; R335-S338 PolarHBondContact O-N 2.91Å; G336-S338 VanDerWaalsContact C-N 3.34Å; G336-S338 PolarHBondContact O-N 2.93Å; S338-K342 VanDerWaalsContact O-CB 3.26Å; S338-K342 WeakPolarHBondContact O-CB 3.26Å; S338-K342 PolarHBondContact O-N 3.46Å; S338-K342 VanDerWaalsContact O-N 3.1Å; S338-R415 WeakPolarHBondContact OG-CD 3.39Å; S338-R415 PolarHBondContact OG-NE 2.85Å
339	A	95	Very high	93.2	Very high	44 Å²	44	45.8 Å²	45.8	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-67	-47	176.5	0	0	0	0	0	111.6	L319 R335 G336 L337 K342 E343	L319-A339 HydrophobicContact CD1-CB 4.48Å; L319-A339 HydrophobicContact CD2-CB 4.26Å; R335-A339 PolarHBondContact O-N 2.5Å; G336-A339 PolarHBondContact O-N 3.45Å; L337-A339 VanDerWaalsContact C-N 3.31Å; L337-A339 PolarHBondContact O-N 3.35Å; A339-K342 PolarHBondContact O-N 2.91Å; A339-E343 PolarHBondContact O-N 3.14Å
340	L	94.4	Very high	93.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-48.5	178.2	177.1	58.2	0	0	0	111.8	D316 L319 V320 G336 L337 K342 E343 I344 I381	D316-L340 HydrophobicContact CB-CD1 3.97Å; D316-L340 HydrophobicContact CB-CD2 4.02Å; D316-L340 VanDerWaalsContact CG-CD1 3.44Å; D316-L340 WeakPolarHBondContact OD1-CD1 3.3Å; L319-L340 HydrophobicContact CD2-CB 3.99Å; V320-L340 HydrophobicContact CG2-CB 4.29Å; V320-L340 HydrophobicContact CG2-CD2 3.84Å; G336-L340 WeakPolarHBondContact O-CB 3.48Å; G336-L340 PolarHBondContact O-N 3.39Å; L337-L340 PolarHBondContact O-N 3.37Å; L340-K342 VanDerWaalsContact C-N 3.32Å; L340-K342 PolarHBondContact O-N 2.64Å; L340-E343 WeakPolarHBondContact O-CB 3.41Å; L340-E343 PolarHBondContact O-N 3.08Å; L340-E343 VanDerWaalsContact O-N 3.15Å; L340-I344 HydrophobicContact CD1-CD1 4.04Å; L340-I344 HydrophobicContact CD1-CG1 4.23Å; L340-I344 HydrophobicContact CG-CD1 3.95Å; L340-I344 WeakPolarHBondContact O-CG1 3.35Å; L340-I344 PolarHBondContact O-N 3.3Å; L340-I381 HydrophobicContact CD2-CB 4.42Å; L340-I381 HydrophobicContact CD2-CG1 4.15Å; L340-I381 HydrophobicContact CD2-CG2 4.19Å
341	F	96.6	Very high	93.7	Very high	8 Å²	8	51.4 Å²	51.4	4%	0.035	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-34	-178.5	-69.7	-8.6	0	0	0	112.3	L337 I344 T345 V378 R415 L419	L337-F341 HydrophobicContact CB-CD2 4.5Å; L337-F341 HydrophobicContact CB-CE2 4.31Å; L337-F341 HydrophobicContact CD2-CE1 4.15Å; L337-F341 HydrophobicContact CD2-CE2 4.34Å; L337-F341 HydrophobicContact CD2-CZ 3.87Å; L337-F341 VanDerWaalsContact O-CB 3.24Å; L337-F341 WeakPolarHBondContact O-CB 3.45Å; L337-F341 WeakPolarHBondContact O-CG 3.43Å; L337-F341 PolarHBondContact O-N 2.86Å; F341-I344 HydrophobicContact CD1-CD1 4.18Å; F341-I344 PolarHBondContact O-N 3.4Å; F341-T345 WeakPolarHBondContact O-CB 3.33Å; F341-T345 PolarHBondContact O-N 3.29Å; F341-T345 PolarHBondContact O-OG1 2.93Å; F341-V378 HydrophobicContact CE1-CG1 4.18Å; F341-V378 HydrophobicContact CE1-CG2 4.07Å; F341-V378 HydrophobicContact CZ-CG1 4.07Å; F341-R415 HydrophobicContact CD2-CB 3.86Å; F341-R415 VanDerWaalsContact CD2-O 3.23Å; F341-R415 WeakPolarHBondContact CD2-O 3.41Å; F341-R415 HydrophobicContact CE2-CB 3.68Å; F341-R415 WeakPolarHBondContact CE2-O 3.33Å; F341-L419 HydrophobicContact CB-CB 4.14Å; F341-L419 HydrophobicContact CB-CD1 4.01Å; F341-L419 HydrophobicContact CB-CD2 4.42Å; F341-L419 HydrophobicContact CB-CG 4.41Å; F341-L419 HydrophobicContact CD1-CD2 3.74Å; F341-L419 HydrophobicContact CD2-CB 3.81Å; F341-L419 HydrophobicContact CD2-CD2 4.23Å; F341-L419 HydrophobicContact CE1-CD2 3.93Å; F341-L419 HydrophobicContact CE2-CB 4.35Å; F341-L419 HydrophobicContact CE2-CD2 4.41Å; F341-L419 HydrophobicContact CG-CB 3.98Å; F341-L419 HydrophobicContact CG-CD1 4.37Å; F341-L419 HydrophobicContact CG-CD2 3.88Å; F341-L419 HydrophobicContact CG-CG 4.29Å; F341-L419 HydrophobicContact CZ-CD2 4.25Å
342	K	95.3	Very high	93.8	Very high	138 Å²	138	48 Å²	48	60%	0.6	23%	0.232	S	C	*	.	H	α-helix	trans	-64.2	-44.8	169.9	-174.4	178.4	-179.8	-179.4	0	111.8	S338 A339 L340 T345 D346	S338-K342 VanDerWaalsContact O-CB 3.26Å; S338-K342 WeakPolarHBondContact O-CB 3.26Å; S338-K342 PolarHBondContact O-N 3.46Å; S338-K342 VanDerWaalsContact O-N 3.1Å; A339-K342 PolarHBondContact O-N 2.91Å; L340-K342 VanDerWaalsContact C-N 3.32Å; L340-K342 PolarHBondContact O-N 2.64Å; K342-T345 PolarHBondContact O-N 3.22Å; K342-D346 WeakPolarHBondContact O-CB 3.48Å; K342-D346 PolarHBondContact O-N 3.19Å
343	E	94.1	Very high	93.9	Very high	84 Å²	84	47.4 Å²	47.4	39%	0.393	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-47	175.8	-172.3	-169.1	137.1	0	0	111.3	A339 L340 T345 D346 T347 R377	A339-E343 PolarHBondContact O-N 3.14Å; L340-E343 WeakPolarHBondContact O-CB 3.41Å; L340-E343 PolarHBondContact O-N 3.08Å; L340-E343 VanDerWaalsContact O-N 3.15Å; E343-T345 VanDerWaalsContact C-N 3.33Å; E343-T345 PolarHBondContact O-N 3.02Å; E343-D346 PolarHBondContact O-N 3.09Å; E343-T347 WeakPolarHBondContact O-CG2 3.35Å; E343-T347 PolarHBondContact O-N 2.85Å; E343-T347 PolarHBondContact O-OG1 2.64Å; E343-R377 IonicContact OE1-NH2 2.84Å
344	I	94.1	Very high	93.9	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-56	-49.5	175.6	-72.5	173.2	0	0	0	110.1	L340 F341 D346 T347 V348 V373 R377 V378 L419	L340-I344 HydrophobicContact CD1-CD1 4.04Å; L340-I344 HydrophobicContact CD1-CG1 4.23Å; L340-I344 HydrophobicContact CG-CD1 3.95Å; L340-I344 WeakPolarHBondContact O-CG1 3.35Å; L340-I344 PolarHBondContact O-N 3.3Å; F341-I344 HydrophobicContact CD1-CD1 4.18Å; F341-I344 PolarHBondContact O-N 3.4Å; I344-D346 VanDerWaalsContact C-N 3.31Å; I344-D346 PolarHBondContact O-N 3.16Å; I344-T347 WeakPolarHBondContact CA-OG1 3.48Å; I344-T347 PolarHBondContact O-N 3.3Å; I344-T347 VanDerWaalsContact O-N 3.11Å; I344-T347 PolarHBondContact O-OG1 2.93Å; I344-V348 HydrophobicContact CG2-CG2 4.36Å; I344-V348 WeakPolarHBondContact O-CG2 3.34Å; I344-V348 PolarHBondContact O-N 3.05Å; I344-V373 HydrophobicContact CG2-CG1 3.42Å; I344-V373 VanDerWaalsContact CG2-CG1 3.42Å; I344-R377 HydrophobicContact CD1-CG 4.15Å; I344-V378 HydrophobicContact CD1-CG2 4.44Å; I344-L419 HydrophobicContact CG2-CD1 4.3Å
345	T	94.6	Very high	93.8	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-41.6	178.9	-57.3	0	0	0	0	111.6	F341 K342 E343 V348 R349 L419 D422 V426	F341-T345 WeakPolarHBondContact O-CB 3.33Å; F341-T345 PolarHBondContact O-N 3.29Å; F341-T345 PolarHBondContact O-OG1 2.93Å; K342-T345 PolarHBondContact O-N 3.22Å; E343-T345 VanDerWaalsContact C-N 3.33Å; E343-T345 PolarHBondContact O-N 3.02Å; T345-V348 PolarHBondContact O-N 2.8Å; T345-R349 WeakPolarHBondContact O-CB 3.5Å; T345-R349 PolarHBondContact O-N 3.39Å; T345-L419 WeakPolarHBondContact OG1-CD1 3.4Å; T345-D422 HydrophobicContact CG2-CB 3.95Å; T345-V426 HydrophobicContact CG2-CG2 3.99Å
346	D	94.5	Very high	93.6	Very high	59 Å²	59	44.7 Å²	44.7	32%	0.316	24%	0.24	S	C	.	.	H	α-helix	trans	-65.6	-37.2	176.1	-72.7	-14.8	0	0	0	112.1	K342 E343 I344 R349 K350	K342-D346 WeakPolarHBondContact O-CB 3.48Å; K342-D346 PolarHBondContact O-N 3.19Å; E343-D346 PolarHBondContact O-N 3.09Å; I344-D346 VanDerWaalsContact C-N 3.31Å; I344-D346 PolarHBondContact O-N 3.16Å; D346-R349 IonicContact OD1-CZ 2.72Å; D346-R349 IonicContact OD1-NH1 3.26Å; D346-R349 PolarHBondContact OD1-NH1 3.38Å; D346-R349 IonicContact OD1-NH2 2.65Å; D346-K350 WeakPolarHBondContact O-CG 3.48Å; D346-K350 PolarHBondContact O-N 2.98Å
347	T	92.4	Very high	93.5	Very high	34 Å²	34	47.1 Å²	47.1	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-66.7	-45.5	173.3	58.4	0	0	0	0	112	E343 I344 R349 K350 E351	E343-T347 WeakPolarHBondContact O-CG2 3.35Å; E343-T347 PolarHBondContact O-N 2.85Å; E343-T347 PolarHBondContact O-OG1 2.64Å; I344-T347 WeakPolarHBondContact CA-OG1 3.48Å; I344-T347 PolarHBondContact O-N 3.3Å; I344-T347 VanDerWaalsContact O-N 3.11Å; I344-T347 PolarHBondContact O-OG1 2.93Å; T347-R349 VanDerWaalsContact C-N 3.28Å; T347-R349 PolarHBondContact O-N 3.46Å; T347-K350 PolarHBondContact O-N 2.9Å; T347-K350 VanDerWaalsContact O-N 3.17Å; T347-E351 WeakPolarHBondContact O-CG 3.35Å; T347-E351 PolarHBondContact O-N 2.85Å
348	V	94.6	Very high	93.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-38.4	177.6	174.1	0	0	0	0	110.4	I344 T345 K350 E351 A352 M366 L369 V370 V373 L423 V426	I344-V348 HydrophobicContact CG2-CG2 4.36Å; I344-V348 WeakPolarHBondContact O-CG2 3.34Å; I344-V348 PolarHBondContact O-N 3.05Å; T345-V348 PolarHBondContact O-N 2.8Å; V348-K350 PolarHBondContact O-N 3.31Å; V348-E351 PolarHBondContact O-N 3.25Å; V348-A352 VanDerWaalsContact O-CB 3.3Å; V348-A352 WeakPolarHBondContact O-CB 3.43Å; V348-A352 PolarHBondContact O-N 3.03Å; V348-M366 HydrophobicContact CG1-CE 3.78Å; V348-L369 HydrophobicContact CG1-CD2 4.32Å; V348-V370 HydrophobicContact CG1-CG2 4.43Å; V348-V373 HydrophobicContact CG2-CG2 4.03Å; V348-L423 HydrophobicContact CB-CD2 4.15Å; V348-L423 HydrophobicContact CG1-CD2 4.06Å; V348-L423 HydrophobicContact CG2-CD2 3.97Å; V348-V426 HydrophobicContact CG1-CG1 4.02Å
349	R	94.6	Very high	92.9	Very high	124 Å²	124	45.6 Å²	45.6	47%	0.468	25%	0.247	S	C	.	.	H	α-helix	trans	-64.3	-39.1	176.2	-166.8	-179.1	-58.1	106.5	1.2	113.1	T345 D346 T347 A353 V426	T345-R349 WeakPolarHBondContact O-CB 3.5Å; T345-R349 PolarHBondContact O-N 3.39Å; D346-R349 IonicContact OD1-CZ 2.72Å; D346-R349 IonicContact OD1-NH1 3.26Å; D346-R349 PolarHBondContact OD1-NH1 3.38Å; D346-R349 IonicContact OD1-NH2 2.65Å; T347-R349 VanDerWaalsContact C-N 3.28Å; T347-R349 PolarHBondContact O-N 3.46Å; R349-A353 PolarHBondContact O-N 2.65Å; R349-V426 HydrophobicContact CB-CG1 4.31Å; R349-V426 HydrophobicContact CB-CG2 4.43Å
350	K	92	Very high	92.4	Very high	148 Å²	148	46.6 Å²	46.6	64%	0.643	25%	0.25	S	C	*	.	H	α-helix	trans	-67.9	-41.2	175.2	-70.7	169.8	-174.5	169.8	0	111.4	D346 T347 V348 A353 T354	D346-K350 WeakPolarHBondContact O-CG 3.48Å; D346-K350 PolarHBondContact O-N 2.98Å; T347-K350 PolarHBondContact O-N 2.9Å; T347-K350 VanDerWaalsContact O-N 3.17Å; V348-K350 PolarHBondContact O-N 3.31Å; K350-A353 PolarHBondContact O-N 3.02Å; K350-T354 PolarHBondContact O-N 2.91Å; K350-T354 PolarHBondContact O-OG1 3.28Å
351	E	91.9	Very high	92	Very high	36 Å²	36	49.1 Å²	49.1	17%	0.168	27%	0.265	C	S	.	.	H	α-helix	trans	-67.1	-39.4	176	-69.1	-62.1	150.5	0	0	111.4	Y300 R304 M306 T347 V348 A353 T354 I355 L369	Y300-E351 PolarHBondContact OH-OE2 3.35Å; R304-E351 WeakPolarHBondContact CD-OE2 3.5Å; R304-E351 IonicContact NH1-OE2 3.12Å; M306-E351 HydrophobicContact CE-CG 3.99Å; T347-E351 WeakPolarHBondContact O-CG 3.35Å; T347-E351 PolarHBondContact O-N 2.85Å; V348-E351 PolarHBondContact O-N 3.25Å; E351-A353 VanDerWaalsContact C-N 3.3Å; E351-A353 PolarHBondContact O-N 3.34Å; E351-T354 CarbonylContact O-C 3.55Å; E351-T354 WeakPolarHBondContact O-CA 3.23Å; E351-T354 WeakPolarHBondContact O-CB 3.47Å; E351-T354 PolarHBondContact O-N 3.07Å; E351-I355 HydrophobicContact CB-CD1 4.4Å; E351-I355 WeakPolarHBondContact O-CB 3.24Å; E351-I355 VanDerWaalsContact O-CG1 3.29Å; E351-I355 WeakPolarHBondContact O-CG1 3.41Å; E351-I355 PolarHBondContact O-N 3.11Å; E351-L369 HydrophobicContact CB-CD2 3.85Å
352	A	93.3	Very high	91.7	Very high	13 Å²	13	50.3 Å²	50.3	11%	0.107	27%	0.274	C	S	.	.	H	α-helix	trans	-57.3	-41.6	176.6	0	0	0	0	0	112.4	V348 T354 I355 T356 M366 V426	V348-A352 VanDerWaalsContact O-CB 3.3Å; V348-A352 WeakPolarHBondContact O-CB 3.43Å; V348-A352 PolarHBondContact O-N 3.03Å; A352-T354 VanDerWaalsContact C-N 3.31Å; A352-T354 PolarHBondContact O-N 2.85Å; A352-I355 PolarHBondContact O-N 3.16Å; A352-T356 WeakPolarHBondContact O-CB 3.31Å; A352-T356 PolarHBondContact O-N 3.44Å; A352-T356 PolarHBondContact O-OG1 3.21Å; A352-M366 HydrophobicContact CB-CE 3.68Å; A352-M366 HydrophobicContact CB-SD 3.72Å; A352-V426 HydrophobicContact CB-CG1 4.17Å
353	A	91.8	Very high	91.5	Very high	65 Å²	65	48.8 Å²	48.8	54%	0.537	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-38.5	174.7	0	0	0	0	0	112.1	R349 K350 E351 A357	R349-A353 PolarHBondContact O-N 2.65Å; K350-A353 PolarHBondContact O-N 3.02Å; E351-A353 VanDerWaalsContact C-N 3.3Å; E351-A353 PolarHBondContact O-N 3.34Å; A353-A357 PolarHBondContact O-N 2.87Å
354	T	90.4	Very high	91.3	Very high	37 Å²	37	49.4 Å²	49.4	23%	0.227	28%	0.275	C	S	.	.	H	α-helix	trans	-70.4	-45.4	177.7	-54.8	0	0	0	0	111	L277 Y300 K350 E351 A352 T356 A357 V358	L277-T354 HydrophobicContact CD2-CG2 3.83Å; Y300-T354 WeakPolarHBondContact OH-CG2 3.34Å; K350-T354 PolarHBondContact O-N 2.91Å; K350-T354 PolarHBondContact O-OG1 3.28Å; E351-T354 CarbonylContact O-C 3.55Å; E351-T354 WeakPolarHBondContact O-CA 3.23Å; E351-T354 WeakPolarHBondContact O-CB 3.47Å; E351-T354 PolarHBondContact O-N 3.07Å; A352-T354 VanDerWaalsContact C-N 3.31Å; A352-T354 PolarHBondContact O-N 2.85Å; T354-T356 VanDerWaalsContact C-N 3.34Å; T354-T356 PolarHBondContact O-N 2.98Å; T354-A357 PolarHBondContact O-N 3.21Å; T354-A357 VanDerWaalsContact O-N 3.14Å; T354-V358 HydrophobicContact CG2-CG2 4.3Å; T354-V358 WeakPolarHBondContact O-CB 3.43Å; T354-V358 WeakPolarHBondContact O-CG2 3.12Å; T354-V358 PolarHBondContact O-N 3.17Å
355	I	91.7	Very high	91.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-45.5	178.6	-72.5	165.4	0	0	0	110.5	Y300 E351 A352 A357 V358 F359 P362 V365 M366 L369	Y300-I355 HydrophobicContact CD1-CG1 4.46Å; Y300-I355 HydrophobicContact CE1-CD1 4.13Å; Y300-I355 HydrophobicContact CE1-CG1 3.71Å; E351-I355 HydrophobicContact CB-CD1 4.4Å; E351-I355 WeakPolarHBondContact O-CB 3.24Å; E351-I355 VanDerWaalsContact O-CG1 3.29Å; E351-I355 WeakPolarHBondContact O-CG1 3.41Å; E351-I355 PolarHBondContact O-N 3.11Å; A352-I355 PolarHBondContact O-N 3.16Å; I355-A357 PolarHBondContact O-N 3.47Å; I355-V358 PolarHBondContact O-N 3.4Å; I355-F359 HydrophobicContact CB-CD2 4.49Å; I355-F359 HydrophobicContact CG1-CD2 4.49Å; I355-F359 HydrophobicContact CG2-CD2 4.26Å; I355-F359 PolarHBondContact O-N 3.35Å; I355-P362 HydrophobicContact CG2-CB 4.07Å; I355-V365 HydrophobicContact CD1-CB 4.46Å; I355-V365 HydrophobicContact CD1-CG1 3.73Å; I355-V365 HydrophobicContact CG1-CG1 3.85Å; I355-V365 HydrophobicContact CG2-CB 3.66Å; I355-V365 HydrophobicContact CG2-CG1 3.89Å; I355-V365 HydrophobicContact CG2-CG2 4.21Å; I355-M366 HydrophobicContact CB-SD 4.47Å; I355-M366 HydrophobicContact CD1-SD 3.54Å; I355-M366 VanDerWaalsContact CD1-SD 3.54Å; I355-M366 HydrophobicContact CG2-CG 4.32Å; I355-M366 HydrophobicContact CG2-SD 4.46Å; I355-L369 HydrophobicContact CD1-CD2 3.8Å
356	T	90.8	Very high	91.1	Very high	94 Å²	94	49.6 Å²	49.6	58%	0.577	28%	0.276	S	S	*	.	H	α-helix	trans	-62.2	-32	178.1	-56	0	0	0	0	112.4	A352 T354	A352-T356 WeakPolarHBondContact O-CB 3.31Å; A352-T356 PolarHBondContact O-N 3.44Å; A352-T356 PolarHBondContact O-OG1 3.21Å; T354-T356 VanDerWaalsContact C-N 3.34Å; T354-T356 PolarHBondContact O-N 2.98Å
357	A	90.4	Very high	91	Very high	55 Å²	55	47.7 Å²	47.7	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-81.1	-29.3	178	0	0	0	0	0	113.3	A353 T354 I355	A353-A357 PolarHBondContact O-N 2.87Å; T354-A357 PolarHBondContact O-N 3.21Å; T354-A357 VanDerWaalsContact O-N 3.14Å; I355-A357 PolarHBondContact O-N 3.47Å
358	V	88.4	Confident	91	Very high	1 Å²	1	48 Å²	48	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-96.2	-50.4	-171.6	170.8	0	0	0	0	112.1	F268 L277 M280 S281 A284 T354 I355	F268-V358 HydrophobicContact CE2-CG1 3.88Å; F268-V358 HydrophobicContact CZ-CG1 4.37Å; L277-V358 HydrophobicContact CD2-CG2 4.05Å; M280-V358 HydrophobicContact CB-CG1 3.85Å; M280-V358 HydrophobicContact CB-CG2 3.93Å; M280-V358 HydrophobicContact CE-CG1 4.41Å; M280-V358 HydrophobicContact CE-CG2 4.19Å; M280-V358 HydrophobicContact SD-CG2 4.48Å; S281-V358 VanDerWaalsContact CA-O 3.29Å; S281-V358 WeakPolarHBondContact CA-O 3.45Å; S281-V358 PolarHBondContact OG-O 3.34Å; S281-V358 VanDerWaalsContact OG-O 3.09Å; A284-V358 HydrophobicContact CB-CG1 3.9Å; T354-V358 HydrophobicContact CG2-CG2 4.3Å; T354-V358 WeakPolarHBondContact O-CB 3.43Å; T354-V358 WeakPolarHBondContact O-CG2 3.12Å; T354-V358 PolarHBondContact O-N 3.17Å; I355-V358 PolarHBondContact O-N 3.4Å
359	F	90.2	Very high	91	Very high	13 Å²	13	48 Å²	48	6%	0.057	27%	0.269	C	S	.	.			trans	-94.6	140.3	-166.4	-70.8	-89.4	0	0	0	113.3	F268 A284 M297 Y300 I355 T361 V365	F268-F359 HydrophobicContact CE2-CZ 4.21Å; F268-F359 HydrophobicContact CZ-CE2 4.23Å; F268-F359 AromaticContact CZ-CZ 3.69Å; F268-F359 HydrophobicContact CZ-CZ 3.69Å; A284-F359 HydrophobicContact CB-CD1 3.86Å; A284-F359 HydrophobicContact CB-CE1 3.99Å; A284-F359 HydrophobicContact CB-CG 4.4Å; M297-F359 HydrophobicContact CG-CD1 4.21Å; M297-F359 HydrophobicContact CG-CE1 4.16Å; Y300-F359 AromaticContact CD1-CE2 3.8Å; Y300-F359 HydrophobicContact CD1-CE2 3.8Å; Y300-F359 HydrophobicContact CD1-CZ 4.08Å; Y300-F359 HydrophobicContact CD2-CE2 4.13Å; Y300-F359 HydrophobicContact CD2-CZ 4.19Å; Y300-F359 HydrophobicContact CE1-CE2 4.2Å; Y300-F359 HydrophobicContact CE2-CE2 4.44Å; Y300-F359 AromaticContact CG-CE2 3.77Å; Y300-F359 HydrophobicContact CG-CE2 3.77Å; Y300-F359 AromaticContact CG-CZ 3.7Å; Y300-F359 HydrophobicContact CG-CZ 3.7Å; I355-F359 HydrophobicContact CB-CD2 4.49Å; I355-F359 HydrophobicContact CG1-CD2 4.49Å; I355-F359 HydrophobicContact CG2-CD2 4.26Å; I355-F359 PolarHBondContact O-N 3.35Å; F359-T361 VanDerWaalsContact C-N 3.32Å; F359-T361 PolarHBondContact O-N 3.08Å; F359-V365 HydrophobicContact CB-CG2 3.88Å; F359-V365 HydrophobicContact CD1-CG2 3.81Å; F359-V365 HydrophobicContact CD2-CG1 4.38Å; F359-V365 HydrophobicContact CD2-CG2 4.05Å; F359-V365 HydrophobicContact CE1-CG2 4.35Å; F359-V365 HydrophobicContact CE2-CG1 4.37Å; F359-V365 HydrophobicContact CG-CG2 3.64Å
360	P	85.3	Confident	91.1	Very high	65 Å²	65	42.1 Å²	42.1	42%	0.422	25%	0.246	S	C	.	.	S	Bend	trans	-65.5	-29.3	173.8	-22	33.8	0	0	0	114.5	K285 P362	K285-P360 HydrophobicContact CB-CG 4.42Å; K285-P360 HydrophobicContact CG-CG 3.74Å; P360-P362 VanDerWaalsContact C-CD 3.47Å; P360-P362 WeakPolarHBondContact O-CD 3.34Å
361	T	86.3	Confident	91.2	Very high	53 Å²	53	38.7 Å²	38.7	33%	0.325	23%	0.232	S	C	.	.			trans	-118	72.6	178.6	51.1	0	0	0	0	111.6	F359 N363 E364	F359-T361 VanDerWaalsContact C-N 3.32Å; F359-T361 PolarHBondContact O-N 3.08Å; T361-N363 PolarHBondContact O-N 3.35Å; T361-N363 VanDerWaalsContact O-N 3.16Å; T361-E364 VanDerWaalsContact CB-OE2 3.28Å; T361-E364 WeakPolarHBondContact CB-OE2 3.39Å; T361-E364 PolarHBondContact O-N 2.93Å; T361-E364 PolarHBondContact OG1-OE2 3.24Å
362	P	88.7	Confident	91.2	Very high	34 Å²	34	40.4 Å²	40.4	22%	0.221	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-36.3	-175.6	-27	35.7	0	0	0	114.1	I355 P360 E364 V365 M366	I355-P362 HydrophobicContact CG2-CB 4.07Å; P360-P362 VanDerWaalsContact C-CD 3.47Å; P360-P362 WeakPolarHBondContact O-CD 3.34Å; P362-E364 PolarHBondContact O-N 2.88Å; P362-V365 PolarHBondContact O-N 3.16Å; P362-M366 WeakPolarHBondContact O-CB 3.43Å; P362-M366 VanDerWaalsContact O-CG 3.26Å; P362-M366 WeakPolarHBondContact O-CG 3.42Å; P362-M366 PolarHBondContact O-N 3.29Å
363	N	91.1	Very high	91.3	Very high	106 Å²	106	39.8 Å²	39.8	57%	0.567	23%	0.232	S	C	*	.	H	α-helix	trans	-63.8	-39.1	-177.2	-69.9	-16.9	0	0	0	113	T361 M366 A367	T361-N363 PolarHBondContact O-N 3.35Å; T361-N363 VanDerWaalsContact O-N 3.16Å; N363-M366 PolarHBondContact O-N 3.08Å; N363-A367 WeakPolarHBondContact O-CB 3.34Å; N363-A367 PolarHBondContact O-N 2.92Å
364	E	89.8	Confident	91.5	Very high	97 Å²	97	36.7 Å²	36.7	45%	0.453	21%	0.207	S	C	.	.	H	α-helix	trans	-68.2	-41.7	179	-66	176.2	162.4	0	0	110.9	M297 T361 P362 A367 I368	M297-E364 HydrophobicContact CE-CB 4.24Å; M297-E364 HydrophobicContact SD-CB 3.84Å; T361-E364 VanDerWaalsContact CB-OE2 3.28Å; T361-E364 WeakPolarHBondContact CB-OE2 3.39Å; T361-E364 PolarHBondContact O-N 2.93Å; T361-E364 PolarHBondContact OG1-OE2 3.24Å; P362-E364 PolarHBondContact O-N 2.88Å; E364-A367 PolarHBondContact O-N 2.97Å; E364-I368 WeakPolarHBondContact O-CG1 3.41Å; E364-I368 PolarHBondContact O-N 2.92Å; E364-I368 VanDerWaalsContact O-N 3.09Å
365	V	90.8	Very high	91.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.9	-41.5	175.9	-170.4	0	0	0	0	111	M297 Y300 V301 I355 F359 P362 A367 I368 L369	M297-V365 HydrophobicContact CB-CG2 4.17Å; M297-V365 HydrophobicContact CG-CG2 3.59Å; M297-V365 HydrophobicContact SD-CG2 3.48Å; M297-V365 WeakPolarHBondContact SD-CG2 3.18Å; Y300-V365 HydrophobicContact CD1-CG1 4.27Å; V301-V365 HydrophobicContact CG2-CG1 4.22Å; I355-V365 HydrophobicContact CD1-CB 4.46Å; I355-V365 HydrophobicContact CD1-CG1 3.73Å; I355-V365 HydrophobicContact CG1-CG1 3.85Å; I355-V365 HydrophobicContact CG2-CB 3.66Å; I355-V365 HydrophobicContact CG2-CG1 3.89Å; I355-V365 HydrophobicContact CG2-CG2 4.21Å; F359-V365 HydrophobicContact CB-CG2 3.88Å; F359-V365 HydrophobicContact CD1-CG2 3.81Å; F359-V365 HydrophobicContact CD2-CG1 4.38Å; F359-V365 HydrophobicContact CD2-CG2 4.05Å; F359-V365 HydrophobicContact CE1-CG2 4.35Å; F359-V365 HydrophobicContact CE2-CG1 4.37Å; F359-V365 HydrophobicContact CG-CG2 3.64Å; P362-V365 PolarHBondContact O-N 3.16Å; V365-A367 VanDerWaalsContact C-N 3.34Å; V365-I368 PolarHBondContact O-N 2.95Å; V365-L369 WeakPolarHBondContact O-CB 3.41Å; V365-L369 PolarHBondContact O-N 3.3Å
366	M	93.7	Very high	91.6	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.039	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-39.8	176.5	-74.5	-56.7	-64.5	0	0	111.7	V348 A352 I355 P362 N363 L369 V370 V426 G427	V348-M366 HydrophobicContact CG1-CE 3.78Å; A352-M366 HydrophobicContact CB-CE 3.68Å; A352-M366 HydrophobicContact CB-SD 3.72Å; I355-M366 HydrophobicContact CB-SD 4.47Å; I355-M366 HydrophobicContact CD1-SD 3.54Å; I355-M366 VanDerWaalsContact CD1-SD 3.54Å; I355-M366 HydrophobicContact CG2-CG 4.32Å; I355-M366 HydrophobicContact CG2-SD 4.46Å; P362-M366 WeakPolarHBondContact O-CB 3.43Å; P362-M366 VanDerWaalsContact O-CG 3.26Å; P362-M366 WeakPolarHBondContact O-CG 3.42Å; P362-M366 PolarHBondContact O-N 3.29Å; N363-M366 PolarHBondContact O-N 3.08Å; M366-L369 HydrophobicContact CE-CD2 4.49Å; M366-L369 PolarHBondContact O-N 2.73Å; M366-L369 HydrophobicContact SD-CD2 4.19Å; M366-V370 WeakPolarHBondContact O-CB 3.24Å; M366-V370 VanDerWaalsContact O-CG2 3.3Å; M366-V370 WeakPolarHBondContact O-CG2 3.49Å; M366-V370 PolarHBondContact O-N 3.48Å; M366-V426 HydrophobicContact CE-CG1 4.35Å; M366-G427 WeakPolarHBondContact CE-O 3.43Å
367	A	93.8	Very high	91.7	Very high	19 Å²	19	39.7 Å²	39.7	16%	0.157	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-48.6	174.1	0	0	0	0	0	111.4	N363 E364 V365 L369 V370 Q371 C428 L431	N363-A367 WeakPolarHBondContact O-CB 3.34Å; N363-A367 PolarHBondContact O-N 2.92Å; E364-A367 PolarHBondContact O-N 2.97Å; V365-A367 VanDerWaalsContact C-N 3.34Å; A367-L369 VanDerWaalsContact C-N 3.34Å; A367-L369 PolarHBondContact O-N 3.26Å; A367-V370 PolarHBondContact O-N 3.06Å; A367-Q371 WeakPolarHBondContact O-CB 3.42Å; A367-Q371 PolarHBondContact O-N 3.19Å; A367-C428 WeakPolarHBondContact CA-O 3.33Å; A367-L431 HydrophobicContact CB-CB 4.06Å
368	I	92.4	Very high	91.9	Very high	39 Å²	39	37 Å²	37	20%	0.2	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-41.6	177.2	-63.3	164.6	0	0	0	111.2	M297 Q298 V301 E364 V365 R372	M297-I368 HydrophobicContact CB-CD1 3.83Å; Q298-I368 HydrophobicContact CG-CD1 4.47Å; V301-I368 HydrophobicContact CB-CG2 4.21Å; V301-I368 HydrophobicContact CG1-CG2 4.28Å; V301-I368 HydrophobicContact CG2-CB 4.48Å; V301-I368 HydrophobicContact CG2-CG2 4.04Å; E364-I368 WeakPolarHBondContact O-CG1 3.41Å; E364-I368 PolarHBondContact O-N 2.92Å; E364-I368 VanDerWaalsContact O-N 3.09Å; V365-I368 PolarHBondContact O-N 2.95Å; I368-R372 WeakPolarHBondContact O-CB 3.46Å; I368-R372 PolarHBondContact O-N 3.36Å
369	L	94.1	Very high	92.1	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-52.3	178.5	174.7	61.3	0	0	0	111.3	V301 M306 F307 V348 E351 I355 V365 M366 A367 R372 V373	V301-L369 HydrophobicContact CG1-CB 4.5Å; V301-L369 HydrophobicContact CG1-CD1 4.12Å; V301-L369 HydrophobicContact CG2-CB 4.08Å; M306-L369 HydrophobicContact CE-CD1 3.49Å; M306-L369 VanDerWaalsContact CE-CD1 3.49Å; F307-L369 HydrophobicContact CE2-CD1 3.91Å; F307-L369 HydrophobicContact CZ-CD1 4.01Å; V348-L369 HydrophobicContact CG1-CD2 4.32Å; E351-L369 HydrophobicContact CB-CD2 3.85Å; I355-L369 HydrophobicContact CD1-CD2 3.8Å; V365-L369 WeakPolarHBondContact O-CB 3.41Å; V365-L369 PolarHBondContact O-N 3.3Å; M366-L369 HydrophobicContact CE-CD2 4.49Å; M366-L369 PolarHBondContact O-N 2.73Å; M366-L369 HydrophobicContact SD-CD2 4.19Å; A367-L369 VanDerWaalsContact C-N 3.34Å; A367-L369 PolarHBondContact O-N 3.26Å; L369-R372 PolarHBondContact O-N 2.98Å; L369-V373 HydrophobicContact CD1-CG2 4.34Å; L369-V373 WeakPolarHBondContact O-CG2 3.43Å; L369-V373 PolarHBondContact O-N 3.4Å
370	V	95.6	Very high	92.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-42.7	-178.3	172	0	0	0	0	111	V348 M366 A367 R372 V373 L374 L423 C428 L431 V433	V348-V370 HydrophobicContact CG1-CG2 4.43Å; M366-V370 WeakPolarHBondContact O-CB 3.24Å; M366-V370 VanDerWaalsContact O-CG2 3.3Å; M366-V370 WeakPolarHBondContact O-CG2 3.49Å; M366-V370 PolarHBondContact O-N 3.48Å; A367-V370 PolarHBondContact O-N 3.06Å; V370-R372 VanDerWaalsContact C-N 3.31Å; V370-R372 PolarHBondContact O-N 3.17Å; V370-V373 PolarHBondContact O-N 2.83Å; V370-L374 HydrophobicContact CG1-CD1 4.35Å; V370-L374 PolarHBondContact O-N 2.95Å; V370-L423 HydrophobicContact CG1-CB 4.39Å; V370-L423 HydrophobicContact CG1-CD1 4.13Å; V370-C428 HydrophobicContact CB-CB 4.41Å; V370-C428 HydrophobicContact CG1-CB 4.26Å; V370-C428 HydrophobicContact CG2-CB 4.18Å; V370-L431 HydrophobicContact CB-CD2 3.95Å; V370-L431 HydrophobicContact CG1-CD2 3.69Å; V370-V433 HydrophobicContact CG1-CG2 3.9Å
371	Q	94.5	Very high	92.5	Very high	75 Å²	75	36.2 Å²	36.2	35%	0.35	19%	0.189	S	C	.	.	H	α-helix	trans	-55	-49.1	174.3	-179.3	179.1	3.7	0	0	110.7	A367 V373 L374 E375 L431 L436	A367-Q371 WeakPolarHBondContact O-CB 3.42Å; A367-Q371 PolarHBondContact O-N 3.19Å; Q371-V373 PolarHBondContact O-N 2.89Å; Q371-L374 PolarHBondContact O-N 3.28Å; Q371-E375 VanDerWaalsContact CG-CD 3.49Å; Q371-E375 HydrophobicContact CG-CG 4.23Å; Q371-E375 WeakPolarHBondContact CG-OE1 3.32Å; Q371-E375 PolarHBondContact NE2-OE1 3.31Å; Q371-E375 WeakPolarHBondContact O-CB 3.47Å; Q371-E375 WeakPolarHBondContact O-CG 3.38Å; Q371-E375 PolarHBondContact O-N 3.23Å; Q371-L431 HydrophobicContact CB-CD1 4.4Å; Q371-L431 HydrophobicContact CB-CD2 4Å; Q371-L436 HydrophobicContact CB-CD2 4.31Å; Q371-L436 HydrophobicContact CG-CD2 4.07Å
372	R	93.2	Very high	92.8	Very high	73 Å²	73	34.1 Å²	34.1	28%	0.275	18%	0.176	S	C	.	.	H	α-helix	trans	-68.2	-35.6	179.8	-164.6	179.6	-174.2	146	-6.7	113.4	V301 F307 I368 L369 V370 L374 Q376	V301-R372 HydrophobicContact CG1-CB 4.2Å; F307-R372 HydrophobicContact CD1-CG 4.05Å; F307-R372 HydrophobicContact CE1-CB 4.16Å; F307-R372 HydrophobicContact CE1-CG 3.76Å; F307-R372 HydrophobicContact CE2-CG 4.38Å; F307-R372 HydrophobicContact CG-CG 4.48Å; F307-R372 HydrophobicContact CZ-CB 3.98Å; F307-R372 HydrophobicContact CZ-CG 3.93Å; I368-R372 WeakPolarHBondContact O-CB 3.46Å; I368-R372 PolarHBondContact O-N 3.36Å; L369-R372 PolarHBondContact O-N 2.98Å; V370-R372 VanDerWaalsContact C-N 3.31Å; V370-R372 PolarHBondContact O-N 3.17Å; R372-L374 VanDerWaalsContact C-N 3.3Å; R372-L374 PolarHBondContact O-N 3.26Å; R372-Q376 HydrophobicContact CG-CB 4.26Å; R372-Q376 VanDerWaalsContact O-CB 3.23Å; R372-Q376 WeakPolarHBondContact O-CB 3.44Å; R372-Q376 PolarHBondContact O-N 2.96Å
373	V	94.5	Very high	93	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-56.9	-48	172.1	166.4	0	0	0	0	110.1	F307 I344 V348 L369 V370 Q371 R377 V378	F307-V373 HydrophobicContact CE1-CG2 4.14Å; F307-V373 HydrophobicContact CZ-CG2 3.76Å; I344-V373 HydrophobicContact CG2-CG1 3.42Å; I344-V373 VanDerWaalsContact CG2-CG1 3.42Å; V348-V373 HydrophobicContact CG2-CG2 4.03Å; L369-V373 HydrophobicContact CD1-CG2 4.34Å; L369-V373 WeakPolarHBondContact O-CG2 3.43Å; L369-V373 PolarHBondContact O-N 3.4Å; V370-V373 PolarHBondContact O-N 2.83Å; Q371-V373 PolarHBondContact O-N 2.89Å; V373-R377 WeakPolarHBondContact O-CB 3.4Å; V373-R377 PolarHBondContact O-N 2.93Å; V373-R377 VanDerWaalsContact O-N 3.12Å; V373-V378 HydrophobicContact CG1-CG2 4.36Å; V373-V378 PolarHBondContact O-N 3Å
374	L	95.2	Very high	92.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-68.1	-53	179.6	-70.9	176.3	0	0	0	111.9	V370 Q371 R372 Q376 V378 T379 L419 L423 V433 L436 L440	V370-L374 HydrophobicContact CG1-CD1 4.35Å; V370-L374 PolarHBondContact O-N 2.95Å; Q371-L374 PolarHBondContact O-N 3.28Å; R372-L374 VanDerWaalsContact C-N 3.3Å; R372-L374 PolarHBondContact O-N 3.26Å; L374-Q376 PolarHBondContact O-N 2.77Å; L374-V378 HydrophobicContact CD2-CB 4.41Å; L374-V378 HydrophobicContact CD2-CG2 4.13Å; L374-V378 WeakPolarHBondContact O-CB 3.5Å; L374-T379 PolarHBondContact O-N 3.34Å; L374-T379 PolarHBondContact O-OG1 2.99Å; L374-L419 HydrophobicContact CD2-CD2 4.3Å; L374-L423 HydrophobicContact CD2-CD1 4.28Å; L374-L423 HydrophobicContact CG-CD1 4.48Å; L374-V433 HydrophobicContact CD1-CG1 3.95Å; L374-L436 HydrophobicContact CB-CD2 4.01Å; L374-L436 HydrophobicContact CB-CG 4.4Å; L374-L436 HydrophobicContact CD1-CB 4.37Å; L374-L436 HydrophobicContact CD1-CD2 3.66Å; L374-L436 HydrophobicContact CD1-CG 3.99Å; L374-L436 HydrophobicContact CG-CD2 4.47Å; L374-L440 HydrophobicContact CB-CD1 4.44Å
375	E	93.8	Very high	92.9	Very high	93 Å²	93	34.5 Å²	34.5	44%	0.435	17%	0.173	S	C	.	.	I	π-helix	trans	-71.2	-30.5	-173	-71.5	177.1	175.9	0	0	114.3	Q371 T379 L436	Q371-E375 VanDerWaalsContact CG-CD 3.49Å; Q371-E375 HydrophobicContact CG-CG 4.23Å; Q371-E375 WeakPolarHBondContact CG-OE1 3.32Å; Q371-E375 PolarHBondContact NE2-OE1 3.31Å; Q371-E375 WeakPolarHBondContact O-CB 3.47Å; Q371-E375 WeakPolarHBondContact O-CG 3.38Å; Q371-E375 PolarHBondContact O-N 3.23Å; E375-T379 VanDerWaalsContact C-OG1 3.29Å; E375-T379 WeakPolarHBondContact CA-OG1 3.23Å; E375-T379 WeakPolarHBondContact O-CB 3.21Å; E375-T379 PolarHBondContact O-OG1 3.06Å; E375-L436 HydrophobicContact CG-CD1 4.24Å
376	Q	91.8	Very high	92.9	Very high	83 Å²	83	34.8 Å²	34.8	39%	0.388	18%	0.175	S	C	.	.	I	π-helix	trans	-105	-56.4	-176.6	-165.7	-175.3	-10.9	0	0	111.8	F307 R372 L374 G380	F307-Q376 PolarHBondContact O-NE2 3.04Å; R372-Q376 HydrophobicContact CG-CB 4.26Å; R372-Q376 VanDerWaalsContact O-CB 3.23Å; R372-Q376 WeakPolarHBondContact O-CB 3.44Å; R372-Q376 PolarHBondContact O-N 2.96Å; L374-Q376 PolarHBondContact O-N 2.77Å; Q376-G380 PolarHBondContact O-N 3.14Å; Q376-G380 VanDerWaalsContact O-N 3.08Å
377	R	91.4	Very high	92.7	Very high	17 Å²	17	38 Å²	38	6%	0.064	20%	0.203	C	C	.	.	I	π-helix	trans	-79.6	-45.5	-171.6	-165.3	169.2	-178.4	-164.3	-2.2	111.8	D316 E343 I344 V373 I381	D316-R377 IonicContact OD1-CZ 3.99Å; D316-R377 IonicContact OD1-NE 3.32Å; D316-R377 IonicContact OD1-NH2 3.41Å; D316-R377 PolarHBondContact OD1-NH2 3.35Å; D316-R377 IonicContact OD2-CZ 3.3Å; D316-R377 IonicContact OD2-NE 2.6Å; D316-R377 PolarHBondContact OD2-NE 2.94Å; D316-R377 IonicContact OD2-NH2 3.74Å; D316-R377 PolarHBondContact OD2-NH2 3.38Å; E343-R377 IonicContact OE1-NH2 2.84Å; I344-R377 HydrophobicContact CD1-CG 4.15Å; V373-R377 WeakPolarHBondContact O-CB 3.4Å; V373-R377 PolarHBondContact O-N 2.93Å; V373-R377 VanDerWaalsContact O-N 3.12Å; R377-I381 PolarHBondContact O-N 3.48Å
378	V	94.5	Very high	92.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-73.7	-48.8	177.9	179.7	0	0	0	0	110.9	F341 I344 V373 L374 G380 I381 L382 T416 L419 L440	F341-V378 HydrophobicContact CE1-CG1 4.18Å; F341-V378 HydrophobicContact CE1-CG2 4.07Å; F341-V378 HydrophobicContact CZ-CG1 4.07Å; I344-V378 HydrophobicContact CD1-CG2 4.44Å; V373-V378 HydrophobicContact CG1-CG2 4.36Å; V373-V378 PolarHBondContact O-N 3Å; L374-V378 HydrophobicContact CD2-CB 4.41Å; L374-V378 HydrophobicContact CD2-CG2 4.13Å; L374-V378 WeakPolarHBondContact O-CB 3.5Å; V378-G380 VanDerWaalsContact C-N 3.27Å; V378-G380 PolarHBondContact O-N 3.16Å; V378-I381 WeakPolarHBondContact O-CG2 3.27Å; V378-I381 PolarHBondContact O-N 3.01Å; V378-I381 VanDerWaalsContact O-N 3.16Å; V378-L382 HydrophobicContact CG1-CD1 3.81Å; V378-L382 HydrophobicContact CG1-CG 4.08Å; V378-L382 WeakPolarHBondContact O-CB 3.41Å; V378-L382 VanDerWaalsContact O-CG 3.27Å; V378-L382 WeakPolarHBondContact O-CG 3.13Å; V378-L382 PolarHBondContact O-N 3.16Å; V378-T416 HydrophobicContact CG1-CG2 4.05Å; V378-L419 HydrophobicContact CG2-CD2 3.6Å; V378-L440 HydrophobicContact CG1-CD1 4.25Å
379	T	93.6	Very high	92.3	Very high	32 Å²	32	40.9 Å²	40.9	20%	0.196	21%	0.212	C	C	.	.	H	α-helix	trans	-55.6	-43.5	174.4	-49.6	0	0	0	0	111.9	L374 E375 I381 L382 D383 L440	L374-T379 PolarHBondContact O-N 3.34Å; L374-T379 PolarHBondContact O-OG1 2.99Å; E375-T379 VanDerWaalsContact C-OG1 3.29Å; E375-T379 WeakPolarHBondContact CA-OG1 3.23Å; E375-T379 WeakPolarHBondContact O-CB 3.21Å; E375-T379 PolarHBondContact O-OG1 3.06Å; T379-I381 VanDerWaalsContact C-N 3.29Å; T379-I381 PolarHBondContact O-N 3.22Å; T379-L382 PolarHBondContact O-N 3.41Å; T379-L382 VanDerWaalsContact O-N 3.11Å; T379-D383 PolarHBondContact O-N 3.1Å; T379-L440 VanDerWaalsContact OG1-CD2 3.31Å; T379-L440 WeakPolarHBondContact OG1-CD2 3.26Å
380	G	91.3	Very high	92.1	Very high	27 Å²	27	43.4 Å²	43.4	28%	0.278	23%	0.23	S	C	.	.	H	α-helix	trans	-59.8	-36	179.9	0	0	0	0	0	113.8	Q376 V378 K384	Q376-G380 PolarHBondContact O-N 3.14Å; Q376-G380 VanDerWaalsContact O-N 3.08Å; V378-G380 VanDerWaalsContact C-N 3.27Å; V378-G380 PolarHBondContact O-N 3.16Å; G380-K384 WeakPolarHBondContact O-CG 3.43Å
381	I	92	Very high	91.8	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.015	25%	0.247	C	C	.	.	H	α-helix	trans	-78.1	-38.2	173.9	-163.2	68.9	0	0	0	111.6	I317 V320 L337 L340 R377 V378 T379 D383 K384 I385	I317-I381 HydrophobicContact CB-CD1 4.45Å; I317-I381 HydrophobicContact CG1-CD1 3.97Å; V320-I381 HydrophobicContact CB-CD1 4.17Å; V320-I381 HydrophobicContact CB-CG1 4.35Å; V320-I381 HydrophobicContact CG2-CD1 4.16Å; V320-I381 HydrophobicContact CG2-CG1 4.07Å; L337-I381 HydrophobicContact CD2-CG1 4.47Å; L337-I381 HydrophobicContact CD2-CG2 4.32Å; L340-I381 HydrophobicContact CD2-CB 4.42Å; L340-I381 HydrophobicContact CD2-CG1 4.15Å; L340-I381 HydrophobicContact CD2-CG2 4.19Å; R377-I381 PolarHBondContact O-N 3.48Å; V378-I381 WeakPolarHBondContact O-CG2 3.27Å; V378-I381 PolarHBondContact O-N 3.01Å; V378-I381 VanDerWaalsContact O-N 3.16Å; T379-I381 VanDerWaalsContact C-N 3.29Å; T379-I381 PolarHBondContact O-N 3.22Å; I381-D383 PolarHBondContact O-N 3.18Å; I381-K384 PolarHBondContact O-N 3.45Å; I381-I385 HydrophobicContact CG1-CD1 3.89Å; I381-I385 VanDerWaalsContact O-CG1 3.28Å; I381-I385 WeakPolarHBondContact O-CG1 3.49Å; I381-I385 PolarHBondContact O-N 2.98Å; I381-I385 VanDerWaalsContact O-N 3.13Å
382	L	93.5	Very high	91.5	Very high	8 Å²	8	51.6 Å²	51.6	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-43.1	177.3	-69.7	179.2	0	0	0	111.7	V378 T379 K384 I385 L386 A412 L440 F441	V378-L382 HydrophobicContact CG1-CD1 3.81Å; V378-L382 HydrophobicContact CG1-CG 4.08Å; V378-L382 WeakPolarHBondContact O-CB 3.41Å; V378-L382 VanDerWaalsContact O-CG 3.27Å; V378-L382 WeakPolarHBondContact O-CG 3.13Å; V378-L382 PolarHBondContact O-N 3.16Å; T379-L382 PolarHBondContact O-N 3.41Å; T379-L382 VanDerWaalsContact O-N 3.11Å; L382-K384 PolarHBondContact O-N 3.23Å; L382-I385 PolarHBondContact O-N 3.29Å; L382-I385 VanDerWaalsContact O-N 3.09Å; L382-L386 HydrophobicContact CB-CD1 4.44Å; L382-L386 HydrophobicContact CD2-CD1 4.23Å; L382-L386 WeakPolarHBondContact O-CB 3.36Å; L382-L386 PolarHBondContact O-N 2.87Å; L382-A412 HydrophobicContact CD2-CB 3.74Å; L382-L440 HydrophobicContact CD1-CB 4.38Å; L382-L440 HydrophobicContact CD1-CD1 4.2Å; L382-F441 HydrophobicContact CD1-CE1 4.28Å; L382-F441 HydrophobicContact CD1-CE2 4.06Å; L382-F441 HydrophobicContact CD1-CZ 3.69Å; L382-F441 HydrophobicContact CD2-CE1 4.25Å; L382-F441 HydrophobicContact CD2-CZ 3.95Å
383	D	91.8	Very high	91.2	Very high	108 Å²	108	52.1 Å²	52.1	58%	0.578	29%	0.287	S	S	*	.	H	α-helix	trans	-60	-30.5	177.3	-74.6	-16.2	0	0	0	112.8	T379 I381	T379-D383 PolarHBondContact O-N 3.1Å; I381-D383 PolarHBondContact O-N 3.18Å
384	K	89.6	Confident	91	Very high	130 Å²	130	54.6 Å²	54.6	57%	0.565	30%	0.303	S	S	*	.	H	α-helix	trans	-79.9	-32	177.1	-64.3	-62.9	-179.6	-170.8	0	112.7	I317 L321 G380 I381 L382	I317-K384 HydrophobicContact CD1-CG 4.33Å; I317-K384 HydrophobicContact CG1-CG 4.49Å; L321-K384 HydrophobicContact CD1-CB 4.26Å; G380-K384 WeakPolarHBondContact O-CG 3.43Å; I381-K384 PolarHBondContact O-N 3.45Å; L382-K384 PolarHBondContact O-N 3.23Å
385	I	90	Very high	90.7	Very high	7 Å²	7	56.7 Å²	56.7	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-81.2	-46	179.9	-66.1	167.6	0	0	0	110.1	V320 L321 V333 L337 I381 L382 A387 M408	V320-I385 HydrophobicContact CG1-CD1 3.71Å; V320-I385 HydrophobicContact CG1-CG1 4.33Å; L321-I385 HydrophobicContact CD2-CG1 4.06Å; V333-I385 HydrophobicContact CG1-CD1 4.13Å; V333-I385 HydrophobicContact CG1-CG2 4.14Å; L337-I385 HydrophobicContact CD1-CD1 4.21Å; L337-I385 HydrophobicContact CD2-CD1 3.79Å; L337-I385 HydrophobicContact CG-CD1 4.23Å; I381-I385 HydrophobicContact CG1-CD1 3.89Å; I381-I385 VanDerWaalsContact O-CG1 3.28Å; I381-I385 WeakPolarHBondContact O-CG1 3.49Å; I381-I385 PolarHBondContact O-N 2.98Å; I381-I385 VanDerWaalsContact O-N 3.13Å; L382-I385 PolarHBondContact O-N 3.29Å; L382-I385 VanDerWaalsContact O-N 3.09Å; I385-A387 PolarHBondContact O-N 2.96Å; I385-M408 HydrophobicContact CB-CE 4.26Å; I385-M408 HydrophobicContact CG2-CB 4.35Å; I385-M408 HydrophobicContact CG2-CE 3.41Å; I385-M408 VanDerWaalsContact CG2-CE 3.41Å; I385-M408 WeakPolarHBondContact O-CE 3.43Å
386	L	91.7	Very high	90.4	Very high	7 Å²	7	54.9 Å²	54.9	4%	0.037	31%	0.313	C	S	.	.			trans	-98.4	56	-168.7	-56.6	178.4	0	0	0	111.6	L382 K388 M408 L409 A412 F441 H444	L382-L386 HydrophobicContact CB-CD1 4.44Å; L382-L386 HydrophobicContact CD2-CD1 4.23Å; L382-L386 WeakPolarHBondContact O-CB 3.36Å; L382-L386 PolarHBondContact O-N 2.87Å; L386-K388 PolarHBondContact O-N 3Å; L386-M408 HydrophobicContact CD2-CB 4.3Å; L386-L409 HydrophobicContact CD1-CD1 3.85Å; L386-L409 HydrophobicContact CD2-CB 4.13Å; L386-L409 HydrophobicContact CD2-CD1 4.22Å; L386-A412 HydrophobicContact CD1-CB 4.17Å; L386-A412 HydrophobicContact CD2-CB 4.21Å; L386-A412 HydrophobicContact CG-CB 4.47Å; L386-F441 HydrophobicContact CD1-CD1 4.28Å; L386-F441 HydrophobicContact CD1-CE1 3.88Å; L386-H444 PolarHBondContact O-CE1 3.18Å
387	A	87.8	Confident	90.2	Very high	76 Å²	76	53.2 Å²	53.2	63%	0.628	31%	0.309	S	S	*	.			trans	-66.4	106.7	169.6	0	0	0	0	0	109.7	I385 P389	I385-A387 PolarHBondContact O-N 2.96Å; A387-P389 VanDerWaalsContact O-CD 3.3Å; A387-P389 WeakPolarHBondContact O-CD 3.45Å
388	K	88.6	Confident	89.8	Confident	98 Å²	98	60.2 Å²	60.2	43%	0.426	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-63.7	117.1	-175	-175	173.8	176.5	176.3	0	111.6	L386 E447	L386-K388 PolarHBondContact O-N 3Å; K388-E447 WeakPolarHBondContact CE-OE2 3.17Å; K388-E447 IonicContact NZ-OE1 3.77Å; K388-E447 PolarHBondContact NZ-OE1 3.25Å; K388-E447 IonicContact NZ-OE2 3.71Å; K388-E447 PolarHBondContact NZ-OE2 3.01Å
389	P	89.7	Confident	89.3	Confident	19 Å²	19	66 Å²	66	12%	0.123	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-76.3	152.1	177.2	31.4	-34.1	0	0	0	111.5	A387 P395 L402 Y405 H451	A387-P389 VanDerWaalsContact O-CD 3.3Å; A387-P389 WeakPolarHBondContact O-CD 3.45Å; P389-P395 HydrophobicContact CB-CG 4.01Å; P389-L402 HydrophobicContact CB-CD2 3.81Å; P389-L402 HydrophobicContact CG-CD2 3.58Å; P389-Y405 VanDerWaalsContact CD-CD2 3.47Å; P389-Y405 VanDerWaalsContact CD-CG 3.47Å; P389-Y405 HydrophobicContact CG-CD1 3.78Å; P389-Y405 HydrophobicContact CG-CD2 4.23Å; P389-Y405 HydrophobicContact CG-CE1 4.34Å; P389-Y405 HydrophobicContact CG-CG 3.71Å; P389-H451 PolarHBondContact O-NE2 2.98Å
390	S	90.5	Very high	88.9	Confident	56 Å²	56	65.8 Å²	65.8	39%	0.392	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-80.7	130.8	174.7	175.3	0	0	0	0	111.1	M392 S393 P394	S390-M392 VanDerWaalsContact C-N 3.26Å; S390-M392 PolarHBondContact O-N 3.47Å; S390-M392 PolarHBondContact OG-N 2.82Å; S390-S393 CarbonylContact O-C 3.56Å; S390-S393 VanDerWaalsContact O-C 3.27Å; S390-S393 PolarHBondContact O-N 3.49Å; S390-S393 PolarHBondContact OG-N 3.26Å; S390-P394 WeakPolarHBondContact O-CA 3.39Å
391	L	88.3	Confident	88.9	Confident	69 Å²	69	64.7 Å²	64.7	36%	0.361	36%	0.362	S	S	.	.	S	Bend	trans	-68.1	-25	172.1	-69.1	175.3	0	0	0	113.1	L402 E450 H451 A454	L391-L402 HydrophobicContact CD2-CD1 4.08Å; L391-E450 HydrophobicContact CD1-CB 3.75Å; L391-H451 HydrophobicContact CD2-CB 4.41Å; L391-A454 HydrophobicContact CD2-CB 3.91Å
392	M	88.4	Confident	89.1	Confident	177 Å²	177	64.6 Å²	64.6	87%	0.872	36%	0.362	S	S	*	.	S	Bend	trans	-77	-30.8	179.6	-66.4	-61.1	-65.6	0	0	112.3	S390	S390-M392 VanDerWaalsContact C-N 3.26Å; S390-M392 PolarHBondContact O-N 3.47Å; S390-M392 PolarHBondContact OG-N 2.82Å
393	S	87.9	Confident	89.1	Confident	85 Å²	85	64.9 Å²	64.9	59%	0.594	36%	0.363	S	S	*	.	S	Bend	trans	-135.7	72	179.9	60.1	0	0	0	0	108.7	S390	S390-S393 CarbonylContact O-C 3.56Å; S390-S393 VanDerWaalsContact O-C 3.27Å; S390-S393 PolarHBondContact O-N 3.49Å; S390-S393 PolarHBondContact OG-N 3.26Å
394	P	88.9	Confident	89.2	Confident	52 Å²	52	61.3 Å²	61.3	34%	0.338	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-68.5	151.2	-175.5	27.8	-34.1	0	0	0	111.5	S390 L402	S390-P394 WeakPolarHBondContact O-CA 3.39Å; P394-L402 HydrophobicContact CB-CD1 4.21Å; P394-L402 HydrophobicContact CB-CD2 4.15Å; P394-L402 HydrophobicContact CB-CG 4.01Å
395	P	89.4	Confident	89.4	Confident	43 Å²	43	55.9 Å²	55.9	28%	0.279	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-57.9	147.5	172.2	-21.1	32.1	0	0	0	111.4	P389 G401	P389-P395 HydrophobicContact CB-CG 4.01Å; P395-G401 WeakPolarHBondContact O-CA 3.25Å
396	P	88.1	Confident	89.7	Confident	55 Å²	55	55.5 Å²	55.5	36%	0.357	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-64.2	146.5	176.3	27.8	-33.2	0	0	0	110.8	Q398 E399 G401	P396-Q398 PolarHBondContact O-N 3.17Å; P396-E399 HydrophobicContact CG-CB 4Å; P396-E399 HydrophobicContact CG-CG 3.76Å; P396-E399 PolarHBondContact O-N 3.03Å; P396-G401 WeakPolarHBondContact O-CA 3.43Å; P396-G401 PolarHBondContact O-N 3.39Å
397	V	87	Confident	89.9	Confident	49 Å²	49	59.7 Å²	59.7	30%	0.297	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-61.1	-29	-178.5	-179.8	0	0	0	0	111.7	E399 G400 Q458 L459 A462	V397-E399 VanDerWaalsContact C-N 3.26Å; V397-E399 PolarHBondContact O-N 3.15Å; V397-G400 WeakPolarHBondContact O-CA 3.27Å; V397-G400 PolarHBondContact O-N 3.28Å; V397-Q458 HydrophobicContact CG2-CB 3.93Å; V397-L459 HydrophobicContact CG1-CD2 4.45Å; V397-A462 HydrophobicContact CB-CB 4.24Å; V397-A462 HydrophobicContact CG1-CB 4.15Å; V397-A462 HydrophobicContact CG2-CB 4.07Å
398	Q	83.1	Confident	90.3	Very high	164 Å²	164	56.7 Å²	56.7	77%	0.766	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-64.2	-29.1	175.8	-62.6	79.1	7.4	0	0	112.9	P396 G400	P396-Q398 PolarHBondContact O-N 3.17Å; Q398-G400 VanDerWaalsContact C-N 3.26Å
399	E	83.9	Confident	90.6	Very high	120 Å²	120	52 Å²	52	56%	0.561	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-89.7	10.3	173.3	-65.9	176.5	-172.4	0	0	112	P396 V397	P396-E399 HydrophobicContact CG-CB 4Å; P396-E399 HydrophobicContact CG-CG 3.76Å; P396-E399 PolarHBondContact O-N 3.03Å; V397-E399 VanDerWaalsContact C-N 3.26Å; V397-E399 PolarHBondContact O-N 3.15Å
400	G	85.5	Confident	91	Very high	28 Å²	28	51.7 Å²	51.7	29%	0.289	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.5	-10	-178.8	0	0	0	0	0	114.6	V397 Q398 L404	V397-G400 WeakPolarHBondContact O-CA 3.27Å; V397-G400 PolarHBondContact O-N 3.28Å; Q398-G400 VanDerWaalsContact C-N 3.26Å; G400-L404 PolarHBondContact O-N 3.25Å
401	G	91.4	Very high	91.3	Very high	5 Å²	5	50 Å²	50	5%	0.052	27%	0.272	C	S	.	.	H	α-helix	trans	55.3	-157.7	176.9	0	0	0	0	0	114.1	P395 P396 L403	P395-G401 WeakPolarHBondContact O-CA 3.25Å; P396-G401 WeakPolarHBondContact O-CA 3.43Å; P396-G401 PolarHBondContact O-N 3.39Å; G401-L403 PolarHBondContact O-N 2.89Å
402	L	94.9	Very high	91.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-25.7	172.4	-66.2	177.2	0	0	0	112.8	P389 L391 P394 L404 Y405 L406 A454	P389-L402 HydrophobicContact CB-CD2 3.81Å; P389-L402 HydrophobicContact CG-CD2 3.58Å; L391-L402 HydrophobicContact CD2-CD1 4.08Å; P394-L402 HydrophobicContact CB-CD1 4.21Å; P394-L402 HydrophobicContact CB-CD2 4.15Å; P394-L402 HydrophobicContact CB-CG 4.01Å; L402-L404 VanDerWaalsContact C-N 3.31Å; L402-L404 PolarHBondContact O-N 3.45Å; L402-Y405 PolarHBondContact O-N 3.33Å; L402-L406 WeakPolarHBondContact O-CG 3.48Å; L402-L406 PolarHBondContact O-N 3.1Å; L402-L406 VanDerWaalsContact O-N 3.09Å; L402-A454 HydrophobicContact CD1-CB 3.47Å; L402-A454 VanDerWaalsContact CD1-CB 3.47Å
403	L	94.7	Very high	92	Very high	15 Å²	15	38.5 Å²	38.5	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-37.9	-178.9	-176.3	62.7	0	0	0	112.3	G401 L406 R407 L459	G401-L403 PolarHBondContact O-N 2.89Å; L403-L406 PolarHBondContact O-N 3.47Å; L403-R407 HydrophobicContact CD1-CG 4.37Å; L403-R407 HydrophobicContact CG-CG 4.41Å; L403-R407 WeakPolarHBondContact O-CB 3.42Å; L403-R407 WeakPolarHBondContact O-CG 3.46Å; L403-R407 PolarHBondContact O-N 2.84Å; L403-L459 HydrophobicContact CD2-CD1 4.1Å; L403-L459 HydrophobicContact CD2-CD2 4.14Å
404	L	93.2	Very high	92.4	Very high	33 Å²	33	38 Å²	38	17%	0.173	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-47.7	177.4	179.3	59.9	0	0	0	111.3	P330 G400 L402 L406 R407 M408	P330-L404 HydrophobicContact CG-CD1 3.94Å; G400-L404 PolarHBondContact O-N 3.25Å; L402-L404 VanDerWaalsContact C-N 3.31Å; L402-L404 PolarHBondContact O-N 3.45Å; L404-L406 PolarHBondContact O-N 3.29Å; L404-R407 PolarHBondContact O-N 3.4Å; L404-M408 HydrophobicContact CD1-CG 4.33Å; L404-M408 HydrophobicContact CD1-SD 4.23Å; L404-M408 HydrophobicContact CG-SD 4.07Å; L404-M408 WeakPolarHBondContact O-CB 3.31Å; L404-M408 VanDerWaalsContact O-CG 3.3Å; L404-M408 WeakPolarHBondContact O-CG 3.41Å; L404-M408 PolarHBondContact O-N 3.07Å
405	Y	94.8	Very high	92.8	Very high	15 Å²	15	37.8 Å²	37.8	6%	0.059	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-46	175.1	162.7	-101.8	0	0	0	111.8	P389 L402 R407 M408 L409 H444 H451	P389-Y405 VanDerWaalsContact CD-CD2 3.47Å; P389-Y405 VanDerWaalsContact CD-CG 3.47Å; P389-Y405 HydrophobicContact CG-CD1 3.78Å; P389-Y405 HydrophobicContact CG-CD2 4.23Å; P389-Y405 HydrophobicContact CG-CE1 4.34Å; P389-Y405 HydrophobicContact CG-CG 3.71Å; L402-Y405 PolarHBondContact O-N 3.33Å; Y405-R407 VanDerWaalsContact C-N 3.35Å; Y405-R407 PolarHBondContact O-N 3.29Å; Y405-M408 PolarHBondContact O-N 3.42Å; Y405-L409 WeakPolarHBondContact O-CB 3.38Å; Y405-L409 PolarHBondContact O-N 3.44Å; Y405-H444 AromaticContact CE2-ND1 3.9Å; Y405-H444 AromaticContact CZ-ND1 3.76Å; Y405-H444 PolarHBondContact OH-ND1 3.42Å; Y405-H451 AromaticContact CE1-CD2 3.95Å
406	L	96.4	Very high	93.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.6	-38.4	178.8	-68.4	168.6	0	0	0	112.8	L402 L403 L404 L409 A410 Y448 H451 E452	L402-L406 WeakPolarHBondContact O-CG 3.48Å; L402-L406 PolarHBondContact O-N 3.1Å; L402-L406 VanDerWaalsContact O-N 3.09Å; L403-L406 PolarHBondContact O-N 3.47Å; L404-L406 PolarHBondContact O-N 3.29Å; L406-L409 PolarHBondContact O-N 3.45Å; L406-A410 WeakPolarHBondContact O-CB 3.39Å; L406-A410 PolarHBondContact O-N 3.19Å; L406-Y448 HydrophobicContact CD2-CD2 3.73Å; L406-Y448 HydrophobicContact CD2-CE2 3.93Å; L406-H451 HydrophobicContact CD2-CB 3.97Å; L406-E452 HydrophobicContact CD1-CB 4.42Å
407	R	96.1	Very high	93.5	Very high	95 Å²	95	35.8 Å²	35.8	36%	0.358	18%	0.177	S	C	.	.	H	α-helix	trans	-67.1	-41.3	174.3	-73.5	173.6	172.9	174.2	-1.8	111.6	P330 L403 L404 Y405 A410 V411 E510	P330-R407 HydrophobicContact CB-CB 4.17Å; P330-R407 HydrophobicContact CG-CB 3.71Å; L403-R407 HydrophobicContact CD1-CG 4.37Å; L403-R407 HydrophobicContact CG-CG 4.41Å; L403-R407 WeakPolarHBondContact O-CB 3.42Å; L403-R407 WeakPolarHBondContact O-CG 3.46Å; L403-R407 PolarHBondContact O-N 2.84Å; L404-R407 PolarHBondContact O-N 3.4Å; Y405-R407 VanDerWaalsContact C-N 3.35Å; Y405-R407 PolarHBondContact O-N 3.29Å; R407-A410 PolarHBondContact O-N 3.48Å; R407-V411 WeakPolarHBondContact O-CG2 3.38Å; R407-V411 PolarHBondContact O-N 3.32Å; R407-E510 IonicContact CZ-OE1 3.56Å; R407-E510 IonicContact CZ-OE2 2.75Å; R407-E510 IonicContact NE-OE1 3.41Å; R407-E510 PolarHBondContact NE-OE1 3.08Å; R407-E510 IonicContact NE-OE2 3.71Å; R407-E510 IonicContact NH2-OE1 2.87Å; R407-E510 PolarHBondContact NH2-OE1 3.48Å; R407-E510 IonicContact NH2-OE2 2.7Å; R407-E510 PolarHBondContact NH2-OE2 3.44Å
408	M	94.7	Very high	94	Very high	12 Å²	12	37.7 Å²	37.7	6%	0.059	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-42	175.2	-71.6	178.1	68.6	0	0	111.4	P328 I385 L386 L404 Y405 A410 V411 A412	P328-M408 HydrophobicContact CB-CE 4.02Å; P328-M408 HydrophobicContact CB-SD 4.27Å; P328-M408 HydrophobicContact CG-CE 4.16Å; P328-M408 HydrophobicContact CG-SD 4.1Å; I385-M408 HydrophobicContact CB-CE 4.26Å; I385-M408 HydrophobicContact CG2-CB 4.35Å; I385-M408 HydrophobicContact CG2-CE 3.41Å; I385-M408 VanDerWaalsContact CG2-CE 3.41Å; I385-M408 WeakPolarHBondContact O-CE 3.43Å; L386-M408 HydrophobicContact CD2-CB 4.3Å; L404-M408 HydrophobicContact CD1-CG 4.33Å; L404-M408 HydrophobicContact CD1-SD 4.23Å; L404-M408 HydrophobicContact CG-SD 4.07Å; L404-M408 WeakPolarHBondContact O-CB 3.31Å; L404-M408 VanDerWaalsContact O-CG 3.3Å; L404-M408 WeakPolarHBondContact O-CG 3.41Å; L404-M408 PolarHBondContact O-N 3.07Å; Y405-M408 PolarHBondContact O-N 3.42Å; M408-A410 PolarHBondContact O-N 2.77Å; M408-V411 PolarHBondContact O-N 2.9Å; M408-A412 WeakPolarHBondContact O-CB 3.48Å; M408-A412 PolarHBondContact O-N 2.9Å
409	L	96.5	Very high	94.6	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-59.7	-44.6	174.6	-178.3	63.3	0	0	0	111.7	L386 Y405 L406 A412 Y413 F441 H444 F518	L386-L409 HydrophobicContact CD1-CD1 3.85Å; L386-L409 HydrophobicContact CD2-CB 4.13Å; L386-L409 HydrophobicContact CD2-CD1 4.22Å; Y405-L409 WeakPolarHBondContact O-CB 3.38Å; Y405-L409 PolarHBondContact O-N 3.44Å; L406-L409 PolarHBondContact O-N 3.45Å; L409-A412 PolarHBondContact O-N 2.81Å; L409-Y413 VanDerWaalsContact O-CB 3.27Å; L409-Y413 WeakPolarHBondContact O-CB 3.15Å; L409-Y413 PolarHBondContact O-N 2.94Å; L409-F441 HydrophobicContact CD1-CD1 3.83Å; L409-F441 HydrophobicContact CD1-CE1 4.28Å; L409-H444 HydrophobicContact CD1-CB 3.7Å; L409-H444 HydrophobicContact CD2-CB 4.11Å; L409-F518 HydrophobicContact CB-CZ 4.19Å; L409-F518 HydrophobicContact CD2-CE1 4.43Å; L409-F518 HydrophobicContact CD2-CE2 4.12Å; L409-F518 HydrophobicContact CD2-CZ 3.89Å; L409-F518 HydrophobicContact CG-CE1 4.02Å; L409-F518 HydrophobicContact CG-CE2 4.35Å; L409-F518 HydrophobicContact CG-CZ 3.64Å
410	A	96.7	Very high	95.2	Very high	11 Å²	11	24.3 Å²	24.3	9%	0.091	12%	0.121	C	C	.	.	H	α-helix	trans	-64.1	-48.1	179.6	0	0	0	0	0	111.7	L406 R407 M408 A412 Y413 E414 R514 L517 F518	L406-A410 WeakPolarHBondContact O-CB 3.39Å; L406-A410 PolarHBondContact O-N 3.19Å; R407-A410 PolarHBondContact O-N 3.48Å; M408-A410 PolarHBondContact O-N 2.77Å; A410-A412 PolarHBondContact O-N 3.18Å; A410-Y413 PolarHBondContact O-N 3.19Å; A410-E414 WeakPolarHBondContact O-CB 3.28Å; A410-E414 WeakPolarHBondContact O-CG 3.31Å; A410-E414 PolarHBondContact O-N 3.05Å; A410-R514 HydrophobicContact CB-CG 4.05Å; A410-L517 HydrophobicContact CB-CD2 3.88Å; A410-F518 HydrophobicContact CB-CZ 3.87Å
411	V	96.4	Very high	95.7	Very high	20 Å²	20	28.4 Å²	28.4	12%	0.121	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-46	176.7	165.8	0	0	0	0	111.5	P330 V333 A334 L337 R407 M408 R415	P330-V411 HydrophobicContact CB-CG2 4.23Å; V333-V411 HydrophobicContact CG1-CG1 4.4Å; A334-V411 VanDerWaalsContact CA-CG1 3.41Å; A334-V411 HydrophobicContact CB-CG1 3.46Å; A334-V411 VanDerWaalsContact CB-CG1 3.46Å; A334-V411 HydrophobicContact CB-CG2 4.35Å; L337-V411 HydrophobicContact CD1-CG1 4.34Å; R407-V411 WeakPolarHBondContact O-CG2 3.38Å; R407-V411 PolarHBondContact O-N 3.32Å; M408-V411 PolarHBondContact O-N 2.9Å; V411-R415 WeakPolarHBondContact O-CB 3.25Å; V411-R415 WeakPolarHBondContact O-CG 3.43Å; V411-R415 PolarHBondContact O-N 3.46Å; V411-R415 VanDerWaalsContact O-N 3.08Å
412	A	96.4	Very high	95.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-46.6	179.2	0	0	0	0	0	111.1	L337 L382 L386 M408 L409 A410 T416 F441	L337-A412 HydrophobicContact CD1-CB 4.34Å; L382-A412 HydrophobicContact CD2-CB 3.74Å; L386-A412 HydrophobicContact CD1-CB 4.17Å; L386-A412 HydrophobicContact CD2-CB 4.21Å; L386-A412 HydrophobicContact CG-CB 4.47Å; M408-A412 WeakPolarHBondContact O-CB 3.48Å; M408-A412 PolarHBondContact O-N 2.9Å; L409-A412 PolarHBondContact O-N 2.81Å; A410-A412 PolarHBondContact O-N 3.18Å; A412-T416 WeakPolarHBondContact O-CB 3.39Å; A412-T416 PolarHBondContact O-N 3.11Å; A412-T416 PolarHBondContact O-OG1 3.13Å; A412-F441 HydrophobicContact CB-CE1 4.09Å; A412-F441 HydrophobicContact CB-CZ 4.4Å
413	Y	96.9	Very high	95.9	Very high	6 Å²	6	31.9 Å²	31.9	2%	0.024	15%	0.148	C	C	.	.	H	α-helix	trans	-64.2	-48.9	179.3	-179	-106.1	0	0	0	112.7	L409 A410 R415 T416 Q417 E438 F441 K445 L517 F518	L409-Y413 VanDerWaalsContact O-CB 3.27Å; L409-Y413 WeakPolarHBondContact O-CB 3.15Å; L409-Y413 PolarHBondContact O-N 2.94Å; A410-Y413 PolarHBondContact O-N 3.19Å; Y413-R415 VanDerWaalsContact C-N 3.35Å; Y413-R415 PolarHBondContact O-N 3.49Å; Y413-T416 PolarHBondContact O-N 3.47Å; Y413-Q417 HydrophobicContact CD1-CG 4.48Å; Y413-Q417 VanDerWaalsContact CE1-CD 3.47Å; Y413-Q417 HydrophobicContact CE1-CG 4.19Å; Y413-Q417 VanDerWaalsContact CE1-NE2 3.34Å; Y413-Q417 HydrophobicContact CE2-CG 4.27Å; Y413-Q417 WeakPolarHBondContact O-CG 3.41Å; Y413-Q417 PolarHBondContact O-N 3.48Å; Y413-Q417 PolarHBondContact OH-NE2 3.22Å; Y413-E438 WeakPolarHBondContact CE2-OE1 3.39Å; Y413-E438 PolarHBondContact OH-OE1 3.44Å; Y413-F441 HydrophobicContact CD2-CB 4.17Å; Y413-F441 HydrophobicContact CD2-CD1 4.13Å; Y413-F441 AromaticContact CD2-CD2 3.62Å; Y413-F441 HydrophobicContact CD2-CD2 3.62Å; Y413-F441 HydrophobicContact CD2-CE1 4.42Å; Y413-F441 AromaticContact CD2-CE2 3.96Å; Y413-F441 HydrophobicContact CD2-CE2 3.96Å; Y413-F441 AromaticContact CD2-CG 3.71Å; Y413-F441 HydrophobicContact CD2-CG 3.71Å; Y413-F441 HydrophobicContact CD2-CZ 4.35Å; Y413-F441 HydrophobicContact CE2-CD2 4.26Å; Y413-F441 HydrophobicContact CE2-CG 4.47Å; Y413-K445 VanDerWaalsContact CE2-CE 3.46Å; Y413-K445 PolarHBondContact OH-NZ 2.87Å; Y413-L517 HydrophobicContact CD1-CD1 3.72Å; Y413-L517 HydrophobicContact CD1-CD2 3.98Å; Y413-L517 HydrophobicContact CD1-CG 3.61Å; Y413-L517 HydrophobicContact CE1-CD1 3.79Å; Y413-L517 HydrophobicContact CE1-CG 3.87Å; Y413-L517 WeakPolarHBondContact CE1-O 3.45Å; Y413-F518 AromaticContact CD1-CD1 4Å; Y413-F518 HydrophobicContact CD1-CD1 4Å; Y413-F518 AromaticContact CD1-CE1 4Å; Y413-F518 HydrophobicContact CD1-CE1 4Å; Y413-F518 HydrophobicContact CE1-CD1 4.36Å; Y413-F518 HydrophobicContact CG-CD1 4.24Å; Y413-F518 HydrophobicContact CG-CE1 4.04Å
414	E	96.3	Very high	95.8	Very high	73 Å²	73	37.3 Å²	37.3	34%	0.341	17%	0.167	S	C	.	.	H	α-helix	trans	-57.3	-46.8	177.8	-76	178.4	174.5	0	0	112	A410 Q417 E418 L517	A410-E414 WeakPolarHBondContact O-CB 3.28Å; A410-E414 WeakPolarHBondContact O-CG 3.31Å; A410-E414 PolarHBondContact O-N 3.05Å; E414-Q417 WeakPolarHBondContact O-CB 3.26Å; E414-Q417 PolarHBondContact O-N 3.2Å; E414-E418 WeakPolarHBondContact O-CG 3.49Å; E414-E418 PolarHBondContact O-N 3.27Å; E414-L517 HydrophobicContact CG-CD1 3.78Å; E414-L517 HydrophobicContact CG-CD2 3.72Å; E414-L517 HydrophobicContact CG-CG 4.4Å
415	R	96.8	Very high	95.8	Very high	49 Å²	49	39.9 Å²	39.9	19%	0.185	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-35.8	-179.8	-66.1	-62.1	176	-85.2	-16.5	111.9	L337 S338 F341 V411 Y413 Q417 E418 L419	L337-R415 HydrophobicContact CB-CB 4.15Å; L337-R415 HydrophobicContact CB-CG 4.26Å; L337-R415 HydrophobicContact CD1-CB 4.38Å; S338-R415 WeakPolarHBondContact OG-CD 3.39Å; S338-R415 PolarHBondContact OG-NE 2.85Å; F341-R415 HydrophobicContact CD2-CB 3.86Å; F341-R415 VanDerWaalsContact CD2-O 3.23Å; F341-R415 WeakPolarHBondContact CD2-O 3.41Å; F341-R415 HydrophobicContact CE2-CB 3.68Å; F341-R415 WeakPolarHBondContact CE2-O 3.33Å; V411-R415 WeakPolarHBondContact O-CB 3.25Å; V411-R415 WeakPolarHBondContact O-CG 3.43Å; V411-R415 PolarHBondContact O-N 3.46Å; V411-R415 VanDerWaalsContact O-N 3.08Å; Y413-R415 VanDerWaalsContact C-N 3.35Å; Y413-R415 PolarHBondContact O-N 3.49Å; R415-Q417 VanDerWaalsContact C-N 3.34Å; R415-E418 WeakPolarHBondContact CD-OE2 3.29Å; R415-E418 IonicContact CZ-OE1 3.64Å; R415-E418 IonicContact NE-OE2 3.28Å; R415-E418 IonicContact NH1-OE1 3.43Å; R415-E418 PolarHBondContact NH1-OE1 2.85Å; R415-E418 IonicContact NH1-OE2 2.77Å; R415-E418 PolarHBondContact O-N 3.19Å; R415-L419 PolarHBondContact O-N 3.42Å
416	T	96.8	Very high	95.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.1	-33.8	175.9	-54.4	0	0	0	0	111.2	V378 A412 Y413 L419 A420 T437 F441	V378-T416 HydrophobicContact CG1-CG2 4.05Å; A412-T416 WeakPolarHBondContact O-CB 3.39Å; A412-T416 PolarHBondContact O-N 3.11Å; A412-T416 PolarHBondContact O-OG1 3.13Å; Y413-T416 PolarHBondContact O-N 3.47Å; T416-L419 WeakPolarHBondContact O-CB 3.49Å; T416-L419 PolarHBondContact O-N 3.39Å; T416-A420 WeakPolarHBondContact O-CB 3.28Å; T416-A420 PolarHBondContact O-N 3.48Å; T416-T437 HydrophobicContact CG2-CG2 3.68Å; T416-F441 HydrophobicContact CG2-CE2 4Å
417	Q	95.7	Very high	95.4	Very high	56 Å²	56	42.2 Å²	42.2	26%	0.262	22%	0.215	S	C	.	.	H	α-helix	trans	-65.3	-37.4	171.2	-74.1	-169.3	-34.1	0	0	113	Y413 E414 R415 A420 K421	Y413-Q417 HydrophobicContact CD1-CG 4.48Å; Y413-Q417 VanDerWaalsContact CE1-CD 3.47Å; Y413-Q417 HydrophobicContact CE1-CG 4.19Å; Y413-Q417 VanDerWaalsContact CE1-NE2 3.34Å; Y413-Q417 HydrophobicContact CE2-CG 4.27Å; Y413-Q417 WeakPolarHBondContact O-CG 3.41Å; Y413-Q417 PolarHBondContact O-N 3.48Å; Y413-Q417 PolarHBondContact OH-NE2 3.22Å; E414-Q417 WeakPolarHBondContact O-CB 3.26Å; E414-Q417 PolarHBondContact O-N 3.2Å; R415-Q417 VanDerWaalsContact C-N 3.34Å; Q417-A420 PolarHBondContact O-N 3.01Å; Q417-K421 WeakPolarHBondContact O-CG 3.4Å; Q417-K421 PolarHBondContact O-N 2.76Å
418	E	96	Very high	95	Very high	88 Å²	88	38.2 Å²	38.2	41%	0.411	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-46.6	171.6	-72.8	170.1	-158.8	0	0	110.8	E414 R415 A420 K421 D422	E414-E418 WeakPolarHBondContact O-CG 3.49Å; E414-E418 PolarHBondContact O-N 3.27Å; R415-E418 WeakPolarHBondContact CD-OE2 3.29Å; R415-E418 IonicContact CZ-OE1 3.64Å; R415-E418 IonicContact NE-OE2 3.28Å; R415-E418 IonicContact NH1-OE1 3.43Å; R415-E418 PolarHBondContact NH1-OE1 2.85Å; R415-E418 IonicContact NH1-OE2 2.77Å; R415-E418 PolarHBondContact O-N 3.19Å; E418-A420 VanDerWaalsContact C-N 3.33Å; E418-A420 PolarHBondContact O-N 3.31Å; E418-K421 WeakPolarHBondContact O-CB 3.46Å; E418-K421 PolarHBondContact O-N 3.47Å; E418-D422 PolarHBondContact O-N 2.94Å
419	L	96.9	Very high	94.6	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-44.5	174.5	175.1	65.5	0	0	0	111.9	F341 I344 T345 L374 V378 R415 T416 K421 D422 L423	F341-L419 HydrophobicContact CB-CB 4.14Å; F341-L419 HydrophobicContact CB-CD1 4.01Å; F341-L419 HydrophobicContact CB-CD2 4.42Å; F341-L419 HydrophobicContact CB-CG 4.41Å; F341-L419 HydrophobicContact CD1-CD2 3.74Å; F341-L419 HydrophobicContact CD2-CB 3.81Å; F341-L419 HydrophobicContact CD2-CD2 4.23Å; F341-L419 HydrophobicContact CE1-CD2 3.93Å; F341-L419 HydrophobicContact CE2-CB 4.35Å; F341-L419 HydrophobicContact CE2-CD2 4.41Å; F341-L419 HydrophobicContact CG-CB 3.98Å; F341-L419 HydrophobicContact CG-CD1 4.37Å; F341-L419 HydrophobicContact CG-CD2 3.88Å; F341-L419 HydrophobicContact CG-CG 4.29Å; F341-L419 HydrophobicContact CZ-CD2 4.25Å; I344-L419 HydrophobicContact CG2-CD1 4.3Å; T345-L419 WeakPolarHBondContact OG1-CD1 3.4Å; L374-L419 HydrophobicContact CD2-CD2 4.3Å; V378-L419 HydrophobicContact CG2-CD2 3.6Å; R415-L419 PolarHBondContact O-N 3.42Å; T416-L419 WeakPolarHBondContact O-CB 3.49Å; T416-L419 PolarHBondContact O-N 3.39Å; L419-K421 VanDerWaalsContact C-N 3.31Å; L419-K421 PolarHBondContact O-N 2.96Å; L419-D422 PolarHBondContact O-N 3.25Å; L419-D422 VanDerWaalsContact O-N 3.16Å; L419-L423 HydrophobicContact CD1-CD1 3.83Å; L419-L423 HydrophobicContact CD1-CD2 4.27Å; L419-L423 HydrophobicContact CD1-CG 3.8Å; L419-L423 HydrophobicContact CD2-CD1 4.23Å; L419-L423 HydrophobicContact CG-CD1 3.7Å; L419-L423 HydrophobicContact CG-CG 4.11Å; L419-L423 WeakPolarHBondContact O-CB 3.31Å; L419-L423 VanDerWaalsContact O-CG 3.28Å; L419-L423 WeakPolarHBondContact O-CG 3.38Å; L419-L423 PolarHBondContact O-N 2.96Å
420	A	95.9	Very high	94.2	Very high	3 Å²	3	46.7 Å²	46.7	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-44.6	178	0	0	0	0	0	111.7	T416 Q417 E418 D422 L423 R424 V433 T437	T416-A420 WeakPolarHBondContact O-CB 3.28Å; T416-A420 PolarHBondContact O-N 3.48Å; Q417-A420 PolarHBondContact O-N 3.01Å; E418-A420 VanDerWaalsContact C-N 3.33Å; E418-A420 PolarHBondContact O-N 3.31Å; A420-D422 PolarHBondContact O-N 3.45Å; A420-L423 PolarHBondContact O-N 2.82Å; A420-R424 WeakPolarHBondContact O-CB 3.41Å; A420-R424 PolarHBondContact O-N 2.9Å; A420-V433 HydrophobicContact CB-CG1 3.8Å; A420-T437 HydrophobicContact CB-CG2 4.45Å; A420-T437 WeakPolarHBondContact CB-OG1 3.4Å
421	K	95.8	Very high	93.9	Very high	113 Å²	113	47.9 Å²	47.9	49%	0.491	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-41.9	175.8	-68.7	168	-173.1	168.9	0	111.8	Q417 E418 L419 A425	Q417-K421 WeakPolarHBondContact O-CG 3.4Å; Q417-K421 PolarHBondContact O-N 2.76Å; E418-K421 WeakPolarHBondContact O-CB 3.46Å; E418-K421 PolarHBondContact O-N 3.47Å; L419-K421 VanDerWaalsContact C-N 3.31Å; L419-K421 PolarHBondContact O-N 2.96Å; K421-A425 WeakPolarHBondContact O-CB 3.37Å; K421-A425 PolarHBondContact O-N 2.84Å
422	D	95.8	Very high	93.7	Very high	79 Å²	79	51.4 Å²	51.4	42%	0.422	28%	0.276	S	S	.	.	H	α-helix	trans	-66.9	-42.7	178.4	-76.6	-11.5	0	0	0	111.9	T345 E418 L419 A420 A425 V426	T345-D422 HydrophobicContact CG2-CB 3.95Å; E418-D422 PolarHBondContact O-N 2.94Å; L419-D422 PolarHBondContact O-N 3.25Å; L419-D422 VanDerWaalsContact O-N 3.16Å; A420-D422 PolarHBondContact O-N 3.45Å; D422-A425 WeakPolarHBondContact O-CB 3.21Å; D422-A425 PolarHBondContact O-N 3.07Å; D422-V426 WeakPolarHBondContact O-CG2 3.28Å; D422-V426 PolarHBondContact O-N 3.14Å
423	L	95	Very high	93.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-41.3	176.3	-69.1	173.7	0	0	0	111.6	V348 V370 L374 L419 A420 A425 V426 G427	V348-L423 HydrophobicContact CB-CD2 4.15Å; V348-L423 HydrophobicContact CG1-CD2 4.06Å; V348-L423 HydrophobicContact CG2-CD2 3.97Å; V370-L423 HydrophobicContact CG1-CB 4.39Å; V370-L423 HydrophobicContact CG1-CD1 4.13Å; L374-L423 HydrophobicContact CD2-CD1 4.28Å; L374-L423 HydrophobicContact CG-CD1 4.48Å; L419-L423 HydrophobicContact CD1-CD1 3.83Å; L419-L423 HydrophobicContact CD1-CD2 4.27Å; L419-L423 HydrophobicContact CD1-CG 3.8Å; L419-L423 HydrophobicContact CD2-CD1 4.23Å; L419-L423 HydrophobicContact CG-CD1 3.7Å; L419-L423 HydrophobicContact CG-CG 4.11Å; L419-L423 WeakPolarHBondContact O-CB 3.31Å; L419-L423 VanDerWaalsContact O-CG 3.28Å; L419-L423 WeakPolarHBondContact O-CG 3.38Å; L419-L423 PolarHBondContact O-N 2.96Å; A420-L423 PolarHBondContact O-N 2.82Å; L423-A425 VanDerWaalsContact C-N 3.28Å; L423-A425 PolarHBondContact O-N 2.91Å; L423-V426 PolarHBondContact O-N 2.78Å; L423-G427 PolarHBondContact O-N 3.23Å
424	R	93.8	Very high	93.3	Very high	128 Å²	128	54.3 Å²	54.3	48%	0.483	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-37.6	172.9	-170.3	-179.5	66.3	-152.3	-10.6	111.8	A420 G427 E434	A420-R424 WeakPolarHBondContact O-CB 3.41Å; A420-R424 PolarHBondContact O-N 2.9Å; R424-G427 PolarHBondContact O-N 3.21Å; R424-E434 IonicContact CZ-OE1 3.88Å; R424-E434 VanDerWaalsContact CZ-OE1 3.3Å; R424-E434 IonicContact NE-OE1 3.92Å; R424-E434 IonicContact NH1-OE1 3.11Å; R424-E434 PolarHBondContact NH1-OE1 3.39Å; R424-E434 IonicContact NH1-OE2 3.11Å; R424-E434 PolarHBondContact NH1-OE2 3.17Å
425	A	93.1	Very high	93.2	Very high	87 Å²	87	56.1 Å²	56.1	72%	0.719	30%	0.302	S	S	*	.	H	α-helix	trans	-70	-30.2	176.2	0	0	0	0	0	113.3	K421 D422 L423	K421-A425 WeakPolarHBondContact O-CB 3.37Å; K421-A425 PolarHBondContact O-N 2.84Å; D422-A425 WeakPolarHBondContact O-CB 3.21Å; D422-A425 PolarHBondContact O-N 3.07Å; L423-A425 VanDerWaalsContact C-N 3.28Å; L423-A425 PolarHBondContact O-N 2.91Å
426	V	91.7	Very high	93.1	Very high	36 Å²	36	54.8 Å²	54.8	22%	0.218	30%	0.299	C	S	.	.	H	α-helix	trans	-73.9	-34.2	173	174.6	0	0	0	0	111.6	T345 V348 R349 A352 M366 D422 L423	T345-V426 HydrophobicContact CG2-CG2 3.99Å; V348-V426 HydrophobicContact CG1-CG1 4.02Å; R349-V426 HydrophobicContact CB-CG1 4.31Å; R349-V426 HydrophobicContact CB-CG2 4.43Å; A352-V426 HydrophobicContact CB-CG1 4.17Å; M366-V426 HydrophobicContact CE-CG1 4.35Å; D422-V426 WeakPolarHBondContact O-CG2 3.28Å; D422-V426 PolarHBondContact O-N 3.14Å; L423-V426 PolarHBondContact O-N 2.78Å
427	G	89.5	Confident	93	Very high	29 Å²	29	54.9 Å²	54.9	30%	0.299	30%	0.299	S	S	.	.			trans	116.8	115.4	176.7	0	0	0	0	0	112	M366 L423 R424	M366-G427 WeakPolarHBondContact CE-O 3.43Å; L423-G427 PolarHBondContact O-N 3.23Å; R424-G427 PolarHBondContact O-N 3.21Å
428	C	87.5	Confident	92.9	Very high	11 Å²	11	54.9 Å²	54.9	7%	0.074	30%	0.299	C	S	.	.			trans	-116.8	9.6	-174.6	55.5	0	0	0	0	114.2	A367 V370 L431 V433	A367-C428 WeakPolarHBondContact CA-O 3.33Å; V370-C428 HydrophobicContact CB-CB 4.41Å; V370-C428 HydrophobicContact CG1-CB 4.26Å; V370-C428 HydrophobicContact CG2-CB 4.18Å; C428-L431 WeakPolarHBondContact O-CB 3.49Å; C428-L431 PolarHBondContact O-N 3.14Å; C428-V433 HydrophobicContact CB-CG2 3.45Å; C428-V433 VanDerWaalsContact CB-CG2 3.45Å; C428-V433 WeakPolarHBondContact SG-CG2 3.42Å
429	G	86.6	Confident	92.8	Very high	27 Å²	27	53.5 Å²	53.5	28%	0.278	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	-139.8	-175.5	0	0	0	0	0	112.3	L431	G429-L431 VanDerWaalsContact C-N 3.27Å; G429-L431 PolarHBondContact O-N 3.2Å
430	D	87.7	Confident	92.7	Very high	164 Å²	164	55.1 Å²	55.1	88%	0.877	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	5.4	179	-62.6	-29.9	0	0	0	113.3	D432	D430-D432 PolarHBondContact O-N 2.94Å
431	L	91.7	Very high	92.7	Very high	36 Å²	36	55 Å²	55	19%	0.188	31%	0.307	C	S	.	.			trans	-69.9	124.8	177.7	-178.1	68.6	0	0	0	110.3	A367 V370 Q371 C428 G429 V433 L436	A367-L431 HydrophobicContact CB-CB 4.06Å; V370-L431 HydrophobicContact CB-CD2 3.95Å; V370-L431 HydrophobicContact CG1-CD2 3.69Å; Q371-L431 HydrophobicContact CB-CD1 4.4Å; Q371-L431 HydrophobicContact CB-CD2 4Å; C428-L431 WeakPolarHBondContact O-CB 3.49Å; C428-L431 PolarHBondContact O-N 3.14Å; G429-L431 VanDerWaalsContact C-N 3.27Å; G429-L431 PolarHBondContact O-N 3.2Å; L431-V433 VanDerWaalsContact C-N 3.33Å; L431-V433 HydrophobicContact CD2-CG2 4.05Å; L431-V433 HydrophobicContact CG-CG2 4.19Å; L431-V433 PolarHBondContact O-N 3.29Å; L431-L436 HydrophobicContact CD1-CD2 4.22Å; L431-L436 HydrophobicContact CD2-CD2 4.18Å
432	D	92.8	Very high	92.6	Very high	93 Å²	93	52.2 Å²	52.2	50%	0.497	30%	0.301	S	S	.	.			trans	-75.8	87.7	166.9	-164.7	-29.6	0	0	0	109.4	D430 E434 D435 L436	D430-D432 PolarHBondContact O-N 2.94Å; D432-E434 PolarHBondContact O-N 3.35Å; D432-E434 WeakPolarHBondContact OD1-CB 3.33Å; D432-E434 PolarHBondContact OD1-N 3.41Å; D432-D435 HydrophobicContact CB-CB 4.03Å; D432-D435 PolarHBondContact O-N 3.45Å; D432-D435 PolarHBondContact OD1-N 2.83Å; D432-L436 WeakPolarHBondContact O-CB 3.4Å; D432-L436 PolarHBondContact O-N 3.44Å
433	V	93.3	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-30.8	-179.1	-178.5	0	0	0	0	110.8	V370 L374 A420 C428 L431 T437	V370-V433 HydrophobicContact CG1-CG2 3.9Å; L374-V433 HydrophobicContact CD1-CG1 3.95Å; A420-V433 HydrophobicContact CB-CG1 3.8Å; C428-V433 HydrophobicContact CB-CG2 3.45Å; C428-V433 VanDerWaalsContact CB-CG2 3.45Å; C428-V433 WeakPolarHBondContact SG-CG2 3.42Å; L431-V433 VanDerWaalsContact C-N 3.33Å; L431-V433 HydrophobicContact CD2-CG2 4.05Å; L431-V433 HydrophobicContact CG-CG2 4.19Å; L431-V433 PolarHBondContact O-N 3.29Å; V433-T437 VanDerWaalsContact O-CB 3.23Å; V433-T437 WeakPolarHBondContact O-CB 3.35Å; V433-T437 PolarHBondContact O-N 3.38Å; V433-T437 PolarHBondContact O-OG1 3.28Å
434	E	91.1	Very high	92.3	Very high	68 Å²	68	52.6 Å²	52.6	32%	0.318	31%	0.308	S	S	.	.	H	α-helix	trans	-67.9	-49.7	177.4	-77.3	74.3	-148.7	0	0	111.3	R424 D432 T437 E438	R424-E434 IonicContact CZ-OE1 3.88Å; R424-E434 VanDerWaalsContact CZ-OE1 3.3Å; R424-E434 IonicContact NE-OE1 3.92Å; R424-E434 IonicContact NH1-OE1 3.11Å; R424-E434 PolarHBondContact NH1-OE1 3.39Å; R424-E434 IonicContact NH1-OE2 3.11Å; R424-E434 PolarHBondContact NH1-OE2 3.17Å; D432-E434 PolarHBondContact O-N 3.35Å; D432-E434 WeakPolarHBondContact OD1-CB 3.33Å; D432-E434 PolarHBondContact OD1-N 3.41Å; E434-T437 WeakPolarHBondContact O-CB 3.42Å; E434-T437 PolarHBondContact O-N 3.38Å; E434-E438 WeakPolarHBondContact O-CG 3.34Å; E434-E438 PolarHBondContact O-N 3.05Å
435	D	93.7	Very high	92.3	Very high	110 Å²	110	48 Å²	48	59%	0.588	29%	0.291	S	S	*	.	H	α-helix	trans	-64.8	-41.6	178.3	-168.8	55.9	0	0	0	112	D432 T437 E438 S439	D432-D435 HydrophobicContact CB-CB 4.03Å; D432-D435 PolarHBondContact O-N 3.45Å; D432-D435 PolarHBondContact OD1-N 2.83Å; D435-T437 VanDerWaalsContact C-N 3.29Å; D435-T437 PolarHBondContact O-N 3.44Å; D435-E438 WeakPolarHBondContact O-CB 3.28Å; D435-E438 PolarHBondContact O-N 3.2Å; D435-S439 PolarHBondContact O-N 3.43Å
436	L	94.4	Very high	92.2	Very high	22 Å²	22	49.9 Å²	49.9	12%	0.115	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-37.4	174	-175.9	60.4	0	0	0	111.6	Q371 L374 E375 L431 D432 S439 L440	Q371-L436 HydrophobicContact CB-CD2 4.31Å; Q371-L436 HydrophobicContact CG-CD2 4.07Å; L374-L436 HydrophobicContact CB-CD2 4.01Å; L374-L436 HydrophobicContact CB-CG 4.4Å; L374-L436 HydrophobicContact CD1-CB 4.37Å; L374-L436 HydrophobicContact CD1-CD2 3.66Å; L374-L436 HydrophobicContact CD1-CG 3.99Å; L374-L436 HydrophobicContact CG-CD2 4.47Å; E375-L436 HydrophobicContact CG-CD1 4.24Å; L431-L436 HydrophobicContact CD1-CD2 4.22Å; L431-L436 HydrophobicContact CD2-CD2 4.18Å; D432-L436 WeakPolarHBondContact O-CB 3.4Å; D432-L436 PolarHBondContact O-N 3.44Å; L436-S439 PolarHBondContact O-N 3.42Å; L436-S439 PolarHBondContact O-OG 3.47Å; L436-L440 WeakPolarHBondContact O-CG 3.18Å; L436-L440 PolarHBondContact O-N 3.08Å
437	T	94.1	Very high	92.1	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-42.9	174.3	-63.8	0	0	0	0	111	T416 A420 V433 E434 D435 S439 L440 F441	T416-T437 HydrophobicContact CG2-CG2 3.68Å; A420-T437 HydrophobicContact CB-CG2 4.45Å; A420-T437 WeakPolarHBondContact CB-OG1 3.4Å; V433-T437 VanDerWaalsContact O-CB 3.23Å; V433-T437 WeakPolarHBondContact O-CB 3.35Å; V433-T437 PolarHBondContact O-N 3.38Å; V433-T437 PolarHBondContact O-OG1 3.28Å; E434-T437 WeakPolarHBondContact O-CB 3.42Å; E434-T437 PolarHBondContact O-N 3.38Å; D435-T437 VanDerWaalsContact C-N 3.29Å; D435-T437 PolarHBondContact O-N 3.44Å; T437-S439 VanDerWaalsContact C-N 3.32Å; T437-S439 PolarHBondContact O-N 3Å; T437-L440 PolarHBondContact O-N 2.97Å; T437-F441 WeakPolarHBondContact O-CD2 3.22Å
438	E	93.9	Very high	92.3	Very high	56 Å²	56	50.6 Å²	50.6	26%	0.262	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-40	175.5	-72.7	-61.2	140.4	0	0	112	Y413 E434 D435 L440 F441 S442 K445	Y413-E438 WeakPolarHBondContact CE2-OE1 3.39Å; Y413-E438 PolarHBondContact OH-OE1 3.44Å; E434-E438 WeakPolarHBondContact O-CG 3.34Å; E434-E438 PolarHBondContact O-N 3.05Å; D435-E438 WeakPolarHBondContact O-CB 3.28Å; D435-E438 PolarHBondContact O-N 3.2Å; E438-L440 VanDerWaalsContact C-N 3.27Å; E438-L440 PolarHBondContact O-N 3.04Å; E438-F441 PolarHBondContact O-N 3.43Å; E438-F441 VanDerWaalsContact O-N 3.08Å; E438-S442 PolarHBondContact O-N 2.92Å; E438-S442 VanDerWaalsContact O-N 3.14Å; E438-K445 IonicContact OE1-NZ 3.7Å; E438-K445 IonicContact OE2-NZ 3.22Å; E438-K445 PolarHBondContact OE2-NZ 3.07Å
439	S	94.9	Very high	92.7	Very high	59 Å²	59	51.2 Å²	51.2	41%	0.413	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-32.3	-179.5	76.2	0	0	0	0	112.8	D435 L436 T437 F441 S442	D435-S439 PolarHBondContact O-N 3.43Å; L436-S439 PolarHBondContact O-N 3.42Å; L436-S439 PolarHBondContact O-OG 3.47Å; T437-S439 VanDerWaalsContact C-N 3.32Å; T437-S439 PolarHBondContact O-N 3Å; S439-F441 PolarHBondContact O-N 3.04Å; S439-S442 PolarHBondContact O-N 3.35Å; S439-S442 PolarHBondContact O-OG 2.97Å
440	L	95.2	Very high	93.1	Very high	35 Å²	35	54.3 Å²	54.3	18%	0.183	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-27.5	175.5	-62.4	-176.8	0	0	0	113.2	L374 V378 T379 L382 L436 T437 E438	L374-L440 HydrophobicContact CB-CD1 4.44Å; V378-L440 HydrophobicContact CG1-CD1 4.25Å; T379-L440 VanDerWaalsContact OG1-CD2 3.31Å; T379-L440 WeakPolarHBondContact OG1-CD2 3.26Å; L382-L440 HydrophobicContact CD1-CB 4.38Å; L382-L440 HydrophobicContact CD1-CD1 4.2Å; L436-L440 WeakPolarHBondContact O-CG 3.18Å; L436-L440 PolarHBondContact O-N 3.08Å; T437-L440 PolarHBondContact O-N 2.97Å; E438-L440 VanDerWaalsContact C-N 3.27Å; E438-L440 PolarHBondContact O-N 3.04Å
441	F	95.9	Very high	93.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-107.8	-4.9	-176.8	-65.7	-89.1	0	0	0	113.9	L382 L386 L409 A412 Y413 T416 T437 E438 S439 S443 H444 K445	L382-F441 HydrophobicContact CD1-CE1 4.28Å; L382-F441 HydrophobicContact CD1-CE2 4.06Å; L382-F441 HydrophobicContact CD1-CZ 3.69Å; L382-F441 HydrophobicContact CD2-CE1 4.25Å; L382-F441 HydrophobicContact CD2-CZ 3.95Å; L386-F441 HydrophobicContact CD1-CD1 4.28Å; L386-F441 HydrophobicContact CD1-CE1 3.88Å; L409-F441 HydrophobicContact CD1-CD1 3.83Å; L409-F441 HydrophobicContact CD1-CE1 4.28Å; A412-F441 HydrophobicContact CB-CE1 4.09Å; A412-F441 HydrophobicContact CB-CZ 4.4Å; Y413-F441 HydrophobicContact CD2-CB 4.17Å; Y413-F441 HydrophobicContact CD2-CD1 4.13Å; Y413-F441 AromaticContact CD2-CD2 3.62Å; Y413-F441 HydrophobicContact CD2-CD2 3.62Å; Y413-F441 HydrophobicContact CD2-CE1 4.42Å; Y413-F441 AromaticContact CD2-CE2 3.96Å; Y413-F441 HydrophobicContact CD2-CE2 3.96Å; Y413-F441 AromaticContact CD2-CG 3.71Å; Y413-F441 HydrophobicContact CD2-CG 3.71Å; Y413-F441 HydrophobicContact CD2-CZ 4.35Å; Y413-F441 HydrophobicContact CE2-CD2 4.26Å; Y413-F441 HydrophobicContact CE2-CG 4.47Å; T416-F441 HydrophobicContact CG2-CE2 4Å; T437-F441 WeakPolarHBondContact O-CD2 3.22Å; E438-F441 PolarHBondContact O-N 3.43Å; E438-F441 VanDerWaalsContact O-N 3.08Å; S439-F441 PolarHBondContact O-N 3.04Å; F441-S443 VanDerWaalsContact C-N 3.34Å; F441-S443 PolarHBondContact O-N 3.12Å; F441-H444 PolarHBondContact O-N 2.97Å; F441-K445 HydrophobicContact CB-CD 4.45Å; F441-K445 HydrophobicContact CB-CG 4.36Å; F441-K445 WeakPolarHBondContact O-CG 3.5Å; F441-K445 PolarHBondContact O-N 2.97Å
442	S	92.6	Very high	93.8	Very high	54 Å²	54	44.9 Å²	44.9	38%	0.378	24%	0.243	S	C	.	.	H	α-helix	trans	-47.9	-51.4	-178.1	57.2	0	0	0	0	113.1	E438 S439 H444 K445 D446	E438-S442 PolarHBondContact O-N 2.92Å; E438-S442 VanDerWaalsContact O-N 3.14Å; S439-S442 PolarHBondContact O-N 3.35Å; S439-S442 PolarHBondContact O-OG 2.97Å; S442-H444 VanDerWaalsContact C-N 3.25Å; S442-H444 PolarHBondContact O-N 3.27Å; S442-K445 PolarHBondContact O-N 3.13Å; S442-K445 VanDerWaalsContact O-N 3.14Å; S442-D446 VanDerWaalsContact O-CG 3.3Å; S442-D446 PolarHBondContact O-N 3.47Å
443	S	91.9	Very high	94	Very high	67 Å²	67	46.4 Å²	46.4	47%	0.469	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-30	179.5	65.6	0	0	0	0	114.4	F441	F441-S443 VanDerWaalsContact C-N 3.34Å; F441-S443 PolarHBondContact O-N 3.12Å
444	H	93.7	Very high	94.2	Very high	20 Å²	20	47.7 Å²	47.7	9%	0.093	25%	0.253	C	S	.	.	H	α-helix	trans	-87	-32.7	177.6	-67	-82.1	0	0	0	111.9	L386 Y405 L409 F441 S442 Y448	L386-H444 PolarHBondContact O-CE1 3.18Å; Y405-H444 AromaticContact CE2-ND1 3.9Å; Y405-H444 AromaticContact CZ-ND1 3.76Å; Y405-H444 PolarHBondContact OH-ND1 3.42Å; L409-H444 HydrophobicContact CD1-CB 3.7Å; L409-H444 HydrophobicContact CD2-CB 4.11Å; F441-H444 PolarHBondContact O-N 2.97Å; S442-H444 VanDerWaalsContact C-N 3.25Å; S442-H444 PolarHBondContact O-N 3.27Å; H444-Y448 PolarHBondContact O-N 3.1Å
445	K	92.6	Very high	94.5	Very high	32 Å²	32	44.6 Å²	44.6	14%	0.139	24%	0.238	C	C	.	.	H	α-helix	trans	-72.3	-35.5	179	-76.8	-173.5	171.6	-163	0	113	Y413 E438 F441 S442 E447 Y448	Y413-K445 VanDerWaalsContact CE2-CE 3.46Å; Y413-K445 PolarHBondContact OH-NZ 2.87Å; E438-K445 IonicContact OE1-NZ 3.7Å; E438-K445 IonicContact OE2-NZ 3.22Å; E438-K445 PolarHBondContact OE2-NZ 3.07Å; F441-K445 HydrophobicContact CB-CD 4.45Å; F441-K445 HydrophobicContact CB-CG 4.36Å; F441-K445 WeakPolarHBondContact O-CG 3.5Å; F441-K445 PolarHBondContact O-N 2.97Å; S442-K445 PolarHBondContact O-N 3.13Å; S442-K445 VanDerWaalsContact O-N 3.14Å; K445-E447 VanDerWaalsContact C-N 3.29Å; K445-E447 PolarHBondContact O-N 3.31Å; K445-Y448 WeakPolarHBondContact O-CB 3.31Å; K445-Y448 PolarHBondContact O-N 2.84Å
446	D	91.2	Very high	94.7	Very high	126 Å²	126	39.4 Å²	39.4	67%	0.674	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-35.7	-177.9	-71.4	-19.4	0	0	0	112.6	S442	S442-D446 VanDerWaalsContact O-CG 3.3Å; S442-D446 PolarHBondContact O-N 3.47Å
447	E	90	Very high	94.8	Very high	78 Å²	78	44.5 Å²	44.5	36%	0.364	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	1.7	178.8	-65.8	178.5	-150	0	0	113.5	K388 K445 P449 E450 H451	K388-E447 WeakPolarHBondContact CE-OE2 3.17Å; K388-E447 IonicContact NZ-OE1 3.77Å; K388-E447 PolarHBondContact NZ-OE1 3.25Å; K388-E447 IonicContact NZ-OE2 3.71Å; K388-E447 PolarHBondContact NZ-OE2 3.01Å; K445-E447 VanDerWaalsContact C-N 3.29Å; K445-E447 PolarHBondContact O-N 3.31Å; E447-P449 VanDerWaalsContact C-CD 3.43Å; E447-E450 WeakPolarHBondContact CA-OE2 3.46Å; E447-E450 PolarHBondContact O-N 3.39Å; E447-H451 PolarHBondContact O-N 3.12Å; E447-H451 PolarHBondContact O-ND1 3.17Å; E447-H451 IonicContact OE2-CE1 2.79Å
448	Y	94.6	Very high	94.9	Very high	3 Å²	3	45.5 Å²	45.5	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-52.7	-46.6	-180	157	-101.1	0	0	0	113	L406 H444 K445 E450 H451 E452 A511 R514 C515 F518	L406-Y448 HydrophobicContact CD2-CD2 3.73Å; L406-Y448 HydrophobicContact CD2-CE2 3.93Å; H444-Y448 PolarHBondContact O-N 3.1Å; K445-Y448 WeakPolarHBondContact O-CB 3.31Å; K445-Y448 PolarHBondContact O-N 2.84Å; Y448-E450 VanDerWaalsContact C-N 3.28Å; Y448-E450 PolarHBondContact O-N 3.22Å; Y448-H451 PolarHBondContact O-N 3.34Å; Y448-H451 VanDerWaalsContact O-N 3.14Å; Y448-E452 HydrophobicContact CE2-CB 3.92Å; Y448-E452 HydrophobicContact CE2-CG 4.2Å; Y448-E452 WeakPolarHBondContact CE2-OE2 3.37Å; Y448-E452 VanDerWaalsContact CZ-OE2 3.29Å; Y448-E452 PolarHBondContact O-N 3.48Å; Y448-E452 PolarHBondContact OH-OE2 3.15Å; Y448-A511 PolarHBondContact OH-O 3.46Å; Y448-R514 HydrophobicContact CE2-CB 4.28Å; Y448-C515 HydrophobicContact CE1-CB 4.4Å; Y448-C515 VanDerWaalsContact OH-CA 3.28Å; Y448-C515 WeakPolarHBondContact OH-CA 3.42Å; Y448-C515 PolarHBondContact OH-N 3.03Å; Y448-F518 HydrophobicContact CD1-CB 4.28Å; Y448-F518 HydrophobicContact CD1-CD2 4.06Å; Y448-F518 AromaticContact CD2-CD2 3.47Å; Y448-F518 HydrophobicContact CD2-CD2 3.47Å; Y448-F518 VanDerWaalsContact CD2-CD2 3.47Å; Y448-F518 AromaticContact CD2-CE2 3.71Å; Y448-F518 HydrophobicContact CD2-CE2 3.71Å; Y448-F518 HydrophobicContact CE1-CB 4.45Å; Y448-F518 HydrophobicContact CE1-CD2 4Å; Y448-F518 AromaticContact CE2-CD2 3.4Å; Y448-F518 HydrophobicContact CE2-CD2 3.4Å; Y448-F518 AromaticContact CE2-CE2 3.6Å; Y448-F518 HydrophobicContact CE2-CE2 3.6Å; Y448-F518 AromaticContact CG-CD2 3.82Å; Y448-F518 HydrophobicContact CG-CD2 3.82Å; Y448-F518 HydrophobicContact CG-CE2 4.45Å; Y448-F518 AromaticContact CZ-CD2 3.7Å
449	P	94.6	Very high	95	Very high	23 Å²	23	44 Å²	44	15%	0.149	23%	0.23	C	C	.	.	H	α-helix	trans	-59	-37.9	-176.6	-25.2	36	0	0	0	113.1	E447 R453 N528	E447-P449 VanDerWaalsContact C-CD 3.43Å; P449-R453 VanDerWaalsContact O-CG 3.25Å; P449-R453 WeakPolarHBondContact O-CG 3.36Å; P449-R453 PolarHBondContact O-N 3.45Å; P449-R453 VanDerWaalsContact O-N 3.1Å; P449-N528 WeakPolarHBondContact CG-OD1 3.48Å
450	E	95.6	Very high	95.1	Very high	93 Å²	93	42.7 Å²	42.7	44%	0.435	22%	0.216	S	C	.	.	H	α-helix	trans	-67.6	-43.7	177.4	-68.7	71.7	-160.4	0	0	111.4	L391 E447 Y448 R453 A454	L391-E450 HydrophobicContact CD1-CB 3.75Å; E447-E450 WeakPolarHBondContact CA-OE2 3.46Å; E447-E450 PolarHBondContact O-N 3.39Å; Y448-E450 VanDerWaalsContact C-N 3.28Å; Y448-E450 PolarHBondContact O-N 3.22Å; E450-R453 PolarHBondContact O-N 3.02Å; E450-A454 VanDerWaalsContact O-CB 3.26Å; E450-A454 WeakPolarHBondContact O-CB 3.48Å; E450-A454 PolarHBondContact O-N 2.9Å
451	H	96	Very high	95	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-41	177.3	-70.6	78	0	0	0	111.8	P389 L391 Y405 L406 E447 Y448 A454 S455	P389-H451 PolarHBondContact O-NE2 2.98Å; L391-H451 HydrophobicContact CD2-CB 4.41Å; Y405-H451 AromaticContact CE1-CD2 3.95Å; L406-H451 HydrophobicContact CD2-CB 3.97Å; E447-H451 PolarHBondContact O-N 3.12Å; E447-H451 PolarHBondContact O-ND1 3.17Å; E447-H451 IonicContact OE2-CE1 2.79Å; Y448-H451 PolarHBondContact O-N 3.34Å; Y448-H451 VanDerWaalsContact O-N 3.14Å; H451-A454 PolarHBondContact O-N 3.47Å; H451-S455 VanDerWaalsContact O-CB 3.25Å; H451-S455 WeakPolarHBondContact O-CB 3.31Å; H451-S455 PolarHBondContact O-N 3.22Å
452	E	97.5	Very high	95	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.5	-47	177.8	-167.6	71.3	-105.6	0	0	111.3	L406 Y448 A454 S455 L456 A511 R514 I532	L406-E452 HydrophobicContact CD1-CB 4.42Å; Y448-E452 HydrophobicContact CE2-CB 3.92Å; Y448-E452 HydrophobicContact CE2-CG 4.2Å; Y448-E452 WeakPolarHBondContact CE2-OE2 3.37Å; Y448-E452 VanDerWaalsContact CZ-OE2 3.29Å; Y448-E452 PolarHBondContact O-N 3.48Å; Y448-E452 PolarHBondContact OH-OE2 3.15Å; E452-A454 PolarHBondContact O-N 2.88Å; E452-S455 WeakPolarHBondContact O-CB 3.38Å; E452-S455 PolarHBondContact O-N 3.39Å; E452-L456 WeakPolarHBondContact O-CG 3.24Å; E452-L456 PolarHBondContact O-N 3.09Å; E452-A511 HydrophobicContact CG-CB 3.84Å; E452-A511 WeakPolarHBondContact OE1-CB 3.49Å; E452-R514 IonicContact OE1-CZ 2.66Å; E452-R514 IonicContact OE1-NE 3.72Å; E452-R514 PolarHBondContact OE1-NE 2.96Å; E452-R514 IonicContact OE1-NH2 3.75Å; E452-R514 PolarHBondContact OE1-NH2 3.22Å; E452-R514 IonicContact OE2-CZ 2.57Å; E452-R514 IonicContact OE2-NE 2.91Å; E452-R514 PolarHBondContact OE2-NE 2.62Å; E452-R514 IonicContact OE2-NH2 3.99Å; E452-I532 HydrophobicContact CG-CD1 3.88Å; E452-I532 HydrophobicContact CG-CG1 4.11Å
453	R	97.4	Very high	95	Very high	125 Å²	125	45.1 Å²	45.1	47%	0.472	23%	0.225	S	C	.	.	H	α-helix	trans	-64.4	-41	177.2	-68.3	172.7	68.5	-164.8	-0	112.2	P449 E450 L456 K457	P449-R453 VanDerWaalsContact O-CG 3.25Å; P449-R453 WeakPolarHBondContact O-CG 3.36Å; P449-R453 PolarHBondContact O-N 3.45Å; P449-R453 VanDerWaalsContact O-N 3.1Å; E450-R453 PolarHBondContact O-N 3.02Å; R453-L456 PolarHBondContact O-N 3.4Å; R453-K457 PolarHBondContact O-N 2.84Å; R453-K457 VanDerWaalsContact O-N 3.08Å
454	A	96.7	Very high	95.1	Very high	28 Å²	28	42.6 Å²	42.6	23%	0.231	21%	0.206	C	C	.	.	H	α-helix	trans	-66.3	-37.7	176.7	0	0	0	0	0	112.1	L391 L402 E450 H451 E452 K457 Q458	L391-A454 HydrophobicContact CD2-CB 3.91Å; L402-A454 HydrophobicContact CD1-CB 3.47Å; L402-A454 VanDerWaalsContact CD1-CB 3.47Å; E450-A454 VanDerWaalsContact O-CB 3.26Å; E450-A454 WeakPolarHBondContact O-CB 3.48Å; E450-A454 PolarHBondContact O-N 2.9Å; H451-A454 PolarHBondContact O-N 3.47Å; E452-A454 PolarHBondContact O-N 2.88Å; A454-K457 PolarHBondContact O-N 3.16Å; A454-Q458 PolarHBondContact O-N 3.47Å
455	S	97.4	Very high	94.9	Very high	2 Å²	2	47 Å²	47	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-50	173.8	176.8	0	0	0	0	111.4	H451 E452 K457 Q458 L459	H451-S455 VanDerWaalsContact O-CB 3.25Å; H451-S455 WeakPolarHBondContact O-CB 3.31Å; H451-S455 PolarHBondContact O-N 3.22Å; E452-S455 WeakPolarHBondContact O-CB 3.38Å; E452-S455 PolarHBondContact O-N 3.39Å; S455-K457 VanDerWaalsContact C-N 3.27Å; S455-K457 PolarHBondContact O-N 3.28Å; S455-Q458 WeakPolarHBondContact O-CB 3.18Å; S455-Q458 PolarHBondContact O-N 3.4Å; S455-Q458 VanDerWaalsContact O-N 3.12Å; S455-L459 WeakPolarHBondContact O-CG 3.31Å; S455-L459 PolarHBondContact O-N 3.07Å
456	L	98	Very high	94.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-58.4	-40.2	176.4	-70.6	172.6	0	0	0	112	E452 R453 L459 Y460 W507 A511 I532 C535 Q539	E452-L456 WeakPolarHBondContact O-CG 3.24Å; E452-L456 PolarHBondContact O-N 3.09Å; R453-L456 PolarHBondContact O-N 3.4Å; L456-L459 PolarHBondContact O-N 2.78Å; L456-Y460 WeakPolarHBondContact O-CB 3.29Å; L456-Y460 PolarHBondContact O-N 3.41Å; L456-W507 HydrophobicContact CD2-CB 3.88Å; L456-A511 HydrophobicContact CD1-CB 4.2Å; L456-A511 HydrophobicContact CD2-CB 4.31Å; L456-I532 HydrophobicContact CD1-CG2 4Å; L456-C535 HydrophobicContact CD1-CB 4.17Å; L456-Q539 PolarHBondContact O-NE2 3.01Å
457	K	96.5	Very high	94.5	Very high	129 Å²	129	45.1 Å²	45.1	56%	0.561	22%	0.215	S	C	*	.	H	α-helix	trans	-64.3	-41.6	176.1	-172.9	176.6	-180	179.2	0	112.3	R453 A454 S455 Y460 Q461	R453-K457 PolarHBondContact O-N 2.84Å; R453-K457 VanDerWaalsContact O-N 3.08Å; A454-K457 PolarHBondContact O-N 3.16Å; S455-K457 VanDerWaalsContact C-N 3.27Å; S455-K457 PolarHBondContact O-N 3.28Å; K457-Y460 PolarHBondContact O-N 3.38Å; K457-Q461 WeakPolarHBondContact O-CB 3.44Å; K457-Q461 VanDerWaalsContact O-CG 3.27Å; K457-Q461 WeakPolarHBondContact O-CG 3.32Å; K457-Q461 PolarHBondContact O-N 3.49Å
458	Q	95.8	Very high	94.2	Very high	23 Å²	23	47.7 Å²	47.7	11%	0.107	22%	0.221	C	C	.	.	H	α-helix	trans	-64.2	-44.3	175.9	-81.1	171.1	28.8	0	0	112.6	V397 A454 S455 Y460 Q461 A462	V397-Q458 HydrophobicContact CG2-CB 3.93Å; A454-Q458 PolarHBondContact O-N 3.47Å; S455-Q458 WeakPolarHBondContact O-CB 3.18Å; S455-Q458 PolarHBondContact O-N 3.4Å; S455-Q458 VanDerWaalsContact O-N 3.12Å; Q458-Y460 VanDerWaalsContact C-N 3.31Å; Q458-Y460 PolarHBondContact O-N 2.71Å; Q458-Q461 PolarHBondContact O-N 2.82Å; Q458-A462 WeakPolarHBondContact O-CB 3.47Å; Q458-A462 PolarHBondContact O-N 3.43Å
459	L	96.4	Very high	93.8	Very high	24 Å²	24	49.5 Å²	49.5	13%	0.126	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-45.6	176.9	-68.2	171.4	0	0	0	110.9	V397 L403 S455 L456 K463 W507	V397-L459 HydrophobicContact CG1-CD2 4.45Å; L403-L459 HydrophobicContact CD2-CD1 4.1Å; L403-L459 HydrophobicContact CD2-CD2 4.14Å; S455-L459 WeakPolarHBondContact O-CG 3.31Å; S455-L459 PolarHBondContact O-N 3.07Å; L456-L459 PolarHBondContact O-N 2.78Å; L459-K463 WeakPolarHBondContact O-CB 3.12Å; L459-K463 PolarHBondContact O-N 2.92Å; L459-W507 HydrophobicContact CB-CD2 3.94Å; L459-W507 HydrophobicContact CB-CE3 3.66Å; L459-W507 HydrophobicContact CB-CH2 4.1Å; L459-W507 HydrophobicContact CB-CZ2 4.34Å; L459-W507 HydrophobicContact CB-CZ3 3.74Å; L459-W507 HydrophobicContact CD1-CB 4.15Å; L459-W507 HydrophobicContact CD1-CD2 3.97Å; L459-W507 HydrophobicContact CD1-CE3 4.34Å; L459-W507 HydrophobicContact CD1-CG 3.87Å
460	Y	96.5	Very high	93.2	Very high	32 Å²	32	51.9 Å²	51.9	13%	0.125	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-47.7	174.9	178	-101.4	0	0	0	112.3	L456 K457 Q458 A462 K463 M464 F504 Q539 V542	L456-Y460 WeakPolarHBondContact O-CB 3.29Å; L456-Y460 PolarHBondContact O-N 3.41Å; K457-Y460 PolarHBondContact O-N 3.38Å; Q458-Y460 VanDerWaalsContact C-N 3.31Å; Q458-Y460 PolarHBondContact O-N 2.71Å; Y460-A462 PolarHBondContact O-N 2.81Å; Y460-K463 PolarHBondContact O-N 3.45Å; Y460-M464 HydrophobicContact CD1-CG 4.23Å; Y460-M464 HydrophobicContact CD2-CG 4.25Å; Y460-M464 HydrophobicContact CE1-CG 3.84Å; Y460-M464 HydrophobicContact CE2-CG 3.86Å; Y460-M464 HydrophobicContact CE2-SD 4.06Å; Y460-M464 HydrophobicContact CG-CG 4.42Å; Y460-M464 VanDerWaalsContact O-CG 3.28Å; Y460-M464 WeakPolarHBondContact O-CG 3.15Å; Y460-M464 PolarHBondContact O-N 3.39Å; Y460-F504 HydrophobicContact CD2-CE1 4.04Å; Y460-F504 HydrophobicContact CD2-CE2 4.13Å; Y460-F504 AromaticContact CD2-CZ 3.77Å; Y460-F504 HydrophobicContact CD2-CZ 3.77Å; Y460-F504 AromaticContact CE2-CE2 3.94Å; Y460-F504 HydrophobicContact CE2-CE2 3.94Å; Y460-F504 AromaticContact CE2-CZ 3.79Å; Y460-F504 HydrophobicContact CE2-CZ 3.79Å; Y460-Q539 HydrophobicContact CD1-CG 4.27Å; Y460-Q539 HydrophobicContact CD2-CB 3.72Å; Y460-Q539 HydrophobicContact CD2-CG 3.66Å; Y460-Q539 HydrophobicContact CE2-CB 3.89Å; Y460-Q539 HydrophobicContact CE2-CG 4.19Å; Y460-Q539 HydrophobicContact CG-CB 4.29Å; Y460-Q539 HydrophobicContact CG-CG 3.7Å; Y460-V542 WeakPolarHBondContact OH-CG1 3.44Å
461	Q	95.1	Very high	92.2	Very high	87 Å²	87	48.7 Å²	48.7	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-47.1	179.5	-75.6	174.2	-24.3	0	0	112.4	K457 Q458 K463 M464 E465	K457-Q461 WeakPolarHBondContact O-CB 3.44Å; K457-Q461 VanDerWaalsContact O-CG 3.27Å; K457-Q461 WeakPolarHBondContact O-CG 3.32Å; K457-Q461 PolarHBondContact O-N 3.49Å; Q458-Q461 PolarHBondContact O-N 2.82Å; Q461-K463 VanDerWaalsContact C-N 3.29Å; Q461-K463 PolarHBondContact O-N 3.31Å; Q461-M464 PolarHBondContact O-N 3.4Å; Q461-E465 WeakPolarHBondContact O-CG 3.43Å; Q461-E465 PolarHBondContact O-N 2.94Å
462	A	94.5	Very high	91.2	Very high	28 Å²	28	54.7 Å²	54.7	23%	0.231	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-40.3	177.1	0	0	0	0	0	111.5	V397 Q458 Y460 E465 E466	V397-A462 HydrophobicContact CB-CB 4.24Å; V397-A462 HydrophobicContact CG1-CB 4.15Å; V397-A462 HydrophobicContact CG2-CB 4.07Å; Q458-A462 WeakPolarHBondContact O-CB 3.47Å; Q458-A462 PolarHBondContact O-N 3.43Å; Y460-A462 PolarHBondContact O-N 2.81Å; A462-E465 PolarHBondContact O-N 3.29Å; A462-E466 PolarHBondContact O-N 2.94Å
463	K	93.4	Very high	89.9	Confident	26 Å²	26	61 Å²	61	11%	0.113	29%	0.292	C	S	.	.	H	α-helix	trans	-68.1	-39.9	177.5	-170.3	64.8	-176.6	-178.2	0	113.1	L459 Y460 Q461 E465 E466 L467 F500 E503 F504 W507	L459-K463 WeakPolarHBondContact O-CB 3.12Å; L459-K463 PolarHBondContact O-N 2.92Å; Y460-K463 PolarHBondContact O-N 3.45Å; Q461-K463 VanDerWaalsContact C-N 3.29Å; Q461-K463 PolarHBondContact O-N 3.31Å; K463-E465 VanDerWaalsContact C-N 3.29Å; K463-E465 PolarHBondContact O-N 3.09Å; K463-E466 WeakPolarHBondContact CD-OE2 3.3Å; K463-E466 WeakPolarHBondContact CE-OE2 3.5Å; K463-E466 IonicContact NZ-OE2 3.51Å; K463-E466 PolarHBondContact NZ-OE2 3.03Å; K463-E466 PolarHBondContact O-N 3.46Å; K463-L467 WeakPolarHBondContact O-CG 3.45Å; K463-L467 PolarHBondContact O-N 2.91Å; K463-F500 HydrophobicContact CD-CD1 4.43Å; K463-F500 HydrophobicContact CG-CD1 4.49Å; K463-E503 WeakPolarHBondContact CE-OE2 2.89Å; K463-E503 IonicContact NZ-OE1 3.37Å; K463-E503 IonicContact NZ-OE2 3.4Å; K463-E503 PolarHBondContact NZ-OE2 3.4Å; K463-F504 HydrophobicContact CG-CE1 4.24Å; K463-W507 HydrophobicContact CB-CH2 3.68Å; K463-W507 HydrophobicContact CD-CH2 4.5Å; K463-W507 HydrophobicContact CG-CH2 3.96Å
464	M	92.7	Very high	88.2	Confident	14 Å²	14	56.7 Å²	56.7	7%	0.069	28%	0.279	C	S	.	.	H	α-helix	trans	-68.5	-28.7	174.4	-66.2	-53.2	-64.3	0	0	112.3	Y460 Q461 L467 R468 Y543	Y460-M464 HydrophobicContact CD1-CG 4.23Å; Y460-M464 HydrophobicContact CD2-CG 4.25Å; Y460-M464 HydrophobicContact CE1-CG 3.84Å; Y460-M464 HydrophobicContact CE2-CG 3.86Å; Y460-M464 HydrophobicContact CE2-SD 4.06Å; Y460-M464 HydrophobicContact CG-CG 4.42Å; Y460-M464 VanDerWaalsContact O-CG 3.28Å; Y460-M464 WeakPolarHBondContact O-CG 3.15Å; Y460-M464 PolarHBondContact O-N 3.39Å; Q461-M464 PolarHBondContact O-N 3.4Å; M464-L467 HydrophobicContact CE-CD1 4.46Å; M464-L467 HydrophobicContact SD-CD1 3.89Å; M464-R468 VanDerWaalsContact O-CG 3.32Å; M464-R468 WeakPolarHBondContact O-CG 3.49Å; M464-R468 PolarHBondContact O-N 3.33Å; M464-Y543 HydrophobicContact CE-CD2 3.99Å; M464-Y543 HydrophobicContact CE-CE2 4.44Å; M464-Y543 HydrophobicContact SD-CD2 3.79Å; M464-Y543 HydrophobicContact SD-CE2 4.29Å
465	E	90.6	Very high	86.4	Confident	113 Å²	113	58.5 Å²	58.5	53%	0.528	29%	0.29	S	S	.	.	H	α-helix	trans	-71.7	-43.5	171.7	-78.3	172.2	-169.3	0	0	112.7	Q461 A462 K463 L467 R468 A469	Q461-E465 WeakPolarHBondContact O-CG 3.43Å; Q461-E465 PolarHBondContact O-N 2.94Å; A462-E465 PolarHBondContact O-N 3.29Å; K463-E465 VanDerWaalsContact C-N 3.29Å; K463-E465 PolarHBondContact O-N 3.09Å; E465-L467 VanDerWaalsContact C-N 3.31Å; E465-L467 PolarHBondContact O-N 2.88Å; E465-R468 PolarHBondContact O-N 3.43Å; E465-R468 VanDerWaalsContact O-N 3.15Å; E465-A469 PolarHBondContact O-N 3.35Å
466	E	88.9	Confident	84.7	Confident	91 Å²	91	66 Å²	66	43%	0.425	33%	0.325	S	S	.	.	H	α-helix	trans	-53.9	-50	172.4	-178.1	-177.7	-157	0	0	110.4	A462 K463 R468 A469 E470	A462-E466 PolarHBondContact O-N 2.94Å; K463-E466 WeakPolarHBondContact CD-OE2 3.3Å; K463-E466 WeakPolarHBondContact CE-OE2 3.5Å; K463-E466 IonicContact NZ-OE2 3.51Å; K463-E466 PolarHBondContact NZ-OE2 3.03Å; K463-E466 PolarHBondContact O-N 3.46Å; E466-R468 VanDerWaalsContact C-N 3.32Å; E466-R468 PolarHBondContact O-N 3.36Å; E466-A469 PolarHBondContact O-N 2.73Å; E466-A469 VanDerWaalsContact O-N 3.12Å; E466-E470 WeakPolarHBondContact O-CG 3.37Å; E466-E470 PolarHBondContact O-N 2.87Å
467	L	85.4	Confident	82.6	Confident	26 Å²	26	70 Å²	70	14%	0.136	35%	0.353	C	S	.	.	H	α-helix	trans	-57.5	-41.4	176.4	-79.9	173.9	0	0	0	113.6	K463 M464 E465 S471 F500 Y543	K463-L467 WeakPolarHBondContact O-CG 3.45Å; K463-L467 PolarHBondContact O-N 2.91Å; M464-L467 HydrophobicContact CE-CD1 4.46Å; M464-L467 HydrophobicContact SD-CD1 3.89Å; E465-L467 VanDerWaalsContact C-N 3.31Å; E465-L467 PolarHBondContact O-N 2.88Å; L467-S471 PolarHBondContact O-N 2.79Å; L467-S471 VanDerWaalsContact O-N 3.13Å; L467-F500 HydrophobicContact CD1-CD2 4.09Å; L467-F500 HydrophobicContact CD1-CE2 3.97Å; L467-F500 HydrophobicContact CD1-CG 4.5Å; L467-F500 HydrophobicContact CD1-CZ 4.23Å; L467-F500 HydrophobicContact CD2-CD2 4.33Å; L467-F500 HydrophobicContact CD2-CE1 4.12Å; L467-F500 HydrophobicContact CD2-CE2 3.39Å; L467-F500 HydrophobicContact CD2-CZ 3.24Å; L467-F500 HydrophobicContact CG-CE2 4.19Å; L467-F500 HydrophobicContact CG-CZ 4.06Å; L467-Y543 HydrophobicContact CD1-CE2 4.21Å
468	R	85.2	Confident	80.4	Confident	132 Å²	132	66.5 Å²	66.5	50%	0.498	35%	0.345	S	S	.	.	H	α-helix	trans	-67.5	-39.5	177	-75.9	-177.1	-126.3	114.9	0.3	111.4	M464 E465 E466 S471 Q472	M464-R468 VanDerWaalsContact O-CG 3.32Å; M464-R468 WeakPolarHBondContact O-CG 3.49Å; M464-R468 PolarHBondContact O-N 3.33Å; E465-R468 PolarHBondContact O-N 3.43Å; E465-R468 VanDerWaalsContact O-N 3.15Å; E466-R468 VanDerWaalsContact C-N 3.32Å; E466-R468 PolarHBondContact O-N 3.36Å; R468-S471 PolarHBondContact O-N 3.43Å; R468-Q472 WeakPolarHBondContact O-CG 3.27Å; R468-Q472 PolarHBondContact O-N 2.9Å; R468-Q472 VanDerWaalsContact O-N 3.12Å
469	A	85.1	Confident	78.1	Confident	41 Å²	41	68.5 Å²	68.5	34%	0.339	37%	0.371	S	S	.	.	H	α-helix	trans	-66.4	-43.8	178	0	0	0	0	0	111.9	E465 E466 S471 Q472 Q473	E465-A469 PolarHBondContact O-N 3.35Å; E466-A469 PolarHBondContact O-N 2.73Å; E466-A469 VanDerWaalsContact O-N 3.12Å; A469-S471 VanDerWaalsContact C-N 3.33Å; A469-S471 PolarHBondContact O-N 2.88Å; A469-Q472 PolarHBondContact O-N 3.1Å; A469-Q472 VanDerWaalsContact O-N 3.16Å; A469-Q473 WeakPolarHBondContact O-CG 3.42Å; A469-Q473 PolarHBondContact O-N 3.14Å
470	E	81.7	Confident	75.7	Confident	73 Å²	73	72.6 Å²	72.6	34%	0.341	40%	0.398	S	S	.	.	H	α-helix	trans	-59.5	-43	175	-71.5	-179.6	166	0	0	111.6	E466 Q472 Q473 V474	E466-E470 WeakPolarHBondContact O-CG 3.37Å; E466-E470 PolarHBondContact O-N 2.87Å; E470-Q472 VanDerWaalsContact C-N 3.31Å; E470-Q472 PolarHBondContact O-N 3.28Å; E470-Q473 PolarHBondContact O-N 3.49Å; E470-V474 WeakPolarHBondContact O-CG2 3.47Å; E470-V474 PolarHBondContact O-N 3.28Å
471	S	74.7	Confident	73	Confident	26 Å²	26	79.2 Å²	79.2	18%	0.182	43%	0.433	C	S	.	.	H	α-helix	trans	-64.1	-33.4	176.4	-175.6	0	0	0	0	113.1	L467 R468 A469 S475	L467-S471 PolarHBondContact O-N 2.79Å; L467-S471 VanDerWaalsContact O-N 3.13Å; R468-S471 PolarHBondContact O-N 3.43Å; A469-S471 VanDerWaalsContact C-N 3.33Å; A469-S471 PolarHBondContact O-N 2.88Å; S471-S475 PolarHBondContact O-N 3.47Å; S471-S475 PolarHBondContact O-OG 3.19Å
472	Q	75.3	Confident	70.3	Confident	127 Å²	127	77.2 Å²	77.2	59%	0.593	44%	0.437	S	S	*	.	H	α-helix	trans	-75.1	-42.9	178.7	-73.9	173.3	1.5	0	0	111.8	R468 A469 E470 V474 S475 E476	R468-Q472 WeakPolarHBondContact O-CG 3.27Å; R468-Q472 PolarHBondContact O-N 2.9Å; R468-Q472 VanDerWaalsContact O-N 3.12Å; A469-Q472 PolarHBondContact O-N 3.1Å; A469-Q472 VanDerWaalsContact O-N 3.16Å; E470-Q472 VanDerWaalsContact C-N 3.31Å; E470-Q472 PolarHBondContact O-N 3.28Å; Q472-V474 VanDerWaalsContact C-N 3.3Å; Q472-V474 PolarHBondContact O-N 3.27Å; Q472-S475 WeakPolarHBondContact O-CB 3.33Å; Q472-S475 PolarHBondContact O-N 3.33Å; Q472-E476 PolarHBondContact O-N 2.75Å
473	Q	70.6	Confident	67.8	Low	133 Å²	133	88.3 Å²	88.3	62%	0.621	47%	0.472	S	S	*	.	H	α-helix	trans	-61.6	-36.7	178.3	-72	-178.9	4.4	0	0	112.7	A469 E470 S475 S477	A469-Q473 WeakPolarHBondContact O-CG 3.42Å; A469-Q473 PolarHBondContact O-N 3.14Å; E470-Q473 PolarHBondContact O-N 3.49Å; Q473-S475 VanDerWaalsContact C-N 3.33Å; Q473-S477 WeakPolarHBondContact O-CB 3.27Å; Q473-S477 PolarHBondContact O-N 3.43Å; Q473-S477 PolarHBondContact O-OG 2.77Å
474	V	61.7	Low	65.3	Low	35 Å²	35	91.7 Å²	91.7	21%	0.212	50%	0.499	C	S	.	.	H	α-helix	trans	-69.2	-33	174.9	174.8	0	0	0	0	111.9	E470 Q472 S477 S478 I489 L493	E470-V474 WeakPolarHBondContact O-CG2 3.47Å; E470-V474 PolarHBondContact O-N 3.28Å; Q472-V474 VanDerWaalsContact C-N 3.3Å; Q472-V474 PolarHBondContact O-N 3.27Å; V474-S477 WeakPolarHBondContact CA-OG 3.5Å; V474-S477 PolarHBondContact O-OG 2.68Å; V474-S478 WeakPolarHBondContact O-CB 3.36Å; V474-S478 PolarHBondContact O-N 2.98Å; V474-I489 HydrophobicContact CG1-CG2 4.09Å; V474-L493 HydrophobicContact CB-CD1 4.18Å; V474-L493 HydrophobicContact CG1-CD1 4.28Å; V474-L493 HydrophobicContact CG2-CD1 3.57Å
475	S	60	Low	62.7	Low	66 Å²	66	99 Å²	99	46%	0.462	53%	0.531	S	S	.	.	H	α-helix	trans	-69.8	-39.6	176.2	-60	0	0	0	0	112.3	S471 Q472 Q473	S471-S475 PolarHBondContact O-N 3.47Å; S471-S475 PolarHBondContact O-OG 3.19Å; Q472-S475 WeakPolarHBondContact O-CB 3.33Å; Q472-S475 PolarHBondContact O-N 3.33Å; Q473-S475 VanDerWaalsContact C-N 3.33Å
476	E	60	Low	60.1	Low	158 Å²	158	94.3 Å²	94.3	74%	0.738	51%	0.513	S	S	*	.	H	α-helix	trans	-72	-40.8	178.1	-69.6	-176.3	169.4	0	0	112.7	Q472 S478 G479	Q472-E476 PolarHBondContact O-N 2.75Å; E476-S478 VanDerWaalsContact C-N 3.31Å; E476-S478 PolarHBondContact O-N 3.32Å; E476-G479 PolarHBondContact O-N 3Å
477	S	54.6	Low	57.9	Low	86 Å²	86	93.3 Å²	93.3	60%	0.601	52%	0.52	S	S	*	.	H	α-helix	trans	-68.7	-27.4	177.8	54.5	0	0	0	0	113.3	Q473 V474 G479	Q473-S477 WeakPolarHBondContact O-CB 3.27Å; Q473-S477 PolarHBondContact O-N 3.43Å; Q473-S477 PolarHBondContact O-OG 2.77Å; V474-S477 WeakPolarHBondContact CA-OG 3.5Å; V474-S477 PolarHBondContact O-OG 2.68Å; S477-G479 PolarHBondContact O-N 3.42Å
478	S	51.4	Low	55.9	Low	56 Å²	56	95.9 Å²	95.9	39%	0.392	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-3.1	176.3	-166.1	0	0	0	0	114.3	V474 E476 T480 G486	V474-S478 WeakPolarHBondContact O-CB 3.36Å; V474-S478 PolarHBondContact O-N 2.98Å; E476-S478 VanDerWaalsContact C-N 3.31Å; E476-S478 PolarHBondContact O-N 3.32Å; S478-T480 PolarHBondContact O-N 3.2Å; S478-G486 WeakPolarHBondContact OG-CA 3.46Å
479	G	46.7	Very low	53.9	Low	64 Å²	64	93.9 Å²	93.9	66%	0.66	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.3	178	0	0	0	0	0	115.2	E476 S477	E476-G479 PolarHBondContact O-N 3Å; S477-G479 PolarHBondContact O-N 3.42Å
480	T	46.9	Very low	52.1	Low	111 Å²	111	93.2 Å²	93.2	68%	0.681	53%	0.531	S	S	*	.	S	Bend	trans	-129.3	101.2	-175.4	-39.5	0	0	0	0	111.1	S478	S478-T480 PolarHBondContact O-N 3.2Å
481	I	38.8	Very low	50.8	Low	170 Å²	170	92.2 Å²	92.2	87%	0.872	53%	0.532	S	S	*	.	S	Bend	trans	78	94.1	164.5	-50.1	159.3	0	0	0	115.7
482	G	39.4	Very low	49.8	Very low	46 Å²	46	94 Å²	94	47%	0.474	55%	0.545	S	S	.	.			trans	134.4	77	158.7	0	0	0	0	0	115.3	S484	G482-S484 PolarHBondContact O-N 3.02Å
483	R	41	Very low	48.7	Very low	260 Å²	260	91.1 Å²	91.1	98%	0.981	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	0.5	-175.2	-90.6	-178.8	174.7	172.4	-1.7	117.4
484	S	41.3	Very low	48.5	Very low	97 Å²	97	88.5 Å²	88.5	68%	0.678	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-26.1	-176.9	44.2	0	0	0	0	115.5	G482	G482-S484 PolarHBondContact O-N 3.02Å
485	K	37.8	Very low	49.4	Very low	169 Å²	169	89.6 Å²	89.6	74%	0.735	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-32.1	-180	-76.7	-174.7	175.3	-177.2	0	113.9	A487 S488 I489	K485-A487 PolarHBondContact O-N 3.48Å; K485-S488 PolarHBondContact O-N 3.09Å; K485-I489 PolarHBondContact O-N 3.25Å
486	G	36	Very low	50.8	Low	14 Å²	14	86.7 Å²	86.7	14%	0.144	50%	0.503	C	S	.	.	H	α-helix	trans	-66.9	-34.6	-179.3	0	0	0	0	0	114.3	S478 S488 I489 S490	S478-G486 WeakPolarHBondContact OG-CA 3.46Å; G486-S488 PolarHBondContact O-N 3.28Å; G486-I489 PolarHBondContact O-N 3.17Å; G486-S490 WeakPolarHBondContact O-CB 3.33Å; G486-S490 PolarHBondContact O-N 3.4Å
487	A	43	Very low	52.3	Low	70 Å²	70	81 Å²	81	58%	0.579	48%	0.48	S	S	*	.	H	α-helix	trans	-65.9	-36	178.3	0	0	0	0	0	112.9	K485 S491	K485-A487 PolarHBondContact O-N 3.48Å; A487-S491 PolarHBondContact O-N 3.2Å; A487-S491 PolarHBondContact O-OG 2.94Å
488	S	43.7	Very low	54.2	Low	79 Å²	79	78.1 Å²	78.1	55%	0.552	46%	0.459	S	S	*	.	H	α-helix	trans	-75.3	-31.6	179	-54.4	0	0	0	0	113.3	K485 G486 S491 S492	K485-S488 PolarHBondContact O-N 3.09Å; G486-S488 PolarHBondContact O-N 3.28Å; S488-S491 PolarHBondContact O-OG 3.08Å; S488-S492 PolarHBondContact O-N 2.76Å
489	I	42.6	Very low	56.2	Low	91 Å²	91	79.1 Å²	79.1	47%	0.467	46%	0.463	S	S	.	.	H	α-helix	trans	-76.3	-43.3	176.5	-61.9	169.7	0	0	0	109.8	V474 K485 G486 S491 S492 L493	V474-I489 HydrophobicContact CG1-CG2 4.09Å; K485-I489 PolarHBondContact O-N 3.25Å; G486-I489 PolarHBondContact O-N 3.17Å; I489-S491 VanDerWaalsContact C-N 3.28Å; I489-S491 PolarHBondContact O-N 3.02Å; I489-S492 PolarHBondContact O-N 3.19Å; I489-S492 PolarHBondContact O-OG 2.73Å; I489-L493 HydrophobicContact CG2-CD1 4.45Å; I489-L493 PolarHBondContact O-N 3.43Å
490	S	48.1	Very low	58.4	Low	27 Å²	27	77.5 Å²	77.5	19%	0.189	44%	0.438	C	S	.	.	H	α-helix	trans	-60.6	-34.4	176	-171	0	0	0	0	113.1	G486 Q494	G486-S490 WeakPolarHBondContact O-CB 3.33Å; G486-S490 PolarHBondContact O-N 3.4Å; S490-Q494 WeakPolarHBondContact O-CG 3.07Å
491	S	53.4	Low	60.8	Low	51 Å²	51	72.2 Å²	72.2	36%	0.357	41%	0.405	S	S	.	.	H	α-helix	trans	-72.8	-35.1	177.1	66.4	0	0	0	0	112.6	A487 S488 I489 Q494	A487-S491 PolarHBondContact O-N 3.2Å; A487-S491 PolarHBondContact O-OG 2.94Å; S488-S491 PolarHBondContact O-OG 3.08Å; I489-S491 VanDerWaalsContact C-N 3.28Å; I489-S491 PolarHBondContact O-N 3.02Å; S491-Q494 PolarHBondContact O-N 2.94Å
492	S	52.8	Low	63.6	Low	64 Å²	64	66.8 Å²	66.8	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-65.6	-37.8	179.1	66.7	0	0	0	0	113.8	S488 I489 Q494 Q495	S488-S492 PolarHBondContact O-N 2.76Å; I489-S492 PolarHBondContact O-N 3.19Å; I489-S492 PolarHBondContact O-OG 2.73Å; S492-Q494 VanDerWaalsContact C-N 3.28Å; S492-Q494 PolarHBondContact O-N 3.37Å; S492-Q495 PolarHBondContact O-N 2.72Å
493	L	53.6	Low	66.3	Low	66 Å²	66	67.6 Å²	67.6	35%	0.346	37%	0.371	S	S	.	.	H	α-helix	trans	-72.6	-20.2	177.4	-78.3	156.5	0	0	0	113.3	V474 I489 Q495	V474-L493 HydrophobicContact CB-CD1 4.18Å; V474-L493 HydrophobicContact CG1-CD1 4.28Å; V474-L493 HydrophobicContact CG2-CD1 3.57Å; I489-L493 HydrophobicContact CG2-CD1 4.45Å; I489-L493 PolarHBondContact O-N 3.43Å; L493-Q495 VanDerWaalsContact C-N 3.35Å
494	Q	66.8	Low	69	Low	79 Å²	79	55.2 Å²	55.2	37%	0.369	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-3.1	177.8	-69.3	-177.9	-14.1	0	0	113.3	S490 S491 S492 R550	S490-Q494 WeakPolarHBondContact O-CG 3.07Å; S491-Q494 PolarHBondContact O-N 2.94Å; S492-Q494 VanDerWaalsContact C-N 3.28Å; S492-Q494 PolarHBondContact O-N 3.37Å; Q494-R550 PolarHBondContact O-NH1 3.4Å; Q494-R550 VanDerWaalsContact O-NH1 3.16Å
495	Q	79.8	Confident	71.7	Confident	58 Å²	58	51 Å²	51	27%	0.271	30%	0.295	S	S	.	.	S	Bend	trans	-78	161	177.7	-73.1	179	-11.4	0	0	112.6	S492 L493 S497 S596	S492-Q495 PolarHBondContact O-N 2.72Å; L493-Q495 VanDerWaalsContact C-N 3.35Å; Q495-S497 PolarHBondContact O-N 3.15Å; Q495-S596 PolarHBondContact NE2-OG 3.48Å
496	I	89.9	Confident	74.6	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.026	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-67.1	118	170.9	-62.3	166	0	0	0	108.4	Y543 I544 L548 A600 R603 C604	I496-Y543 HydrophobicContact CG2-CE1 3.96Å; I496-I544 HydrophobicContact CD1-CB 4.46Å; I496-I544 HydrophobicContact CG2-CG2 4.35Å; I496-L548 HydrophobicContact CD1-CD2 4.41Å; I496-L548 HydrophobicContact CD1-CG 4.08Å; I496-A600 HydrophobicContact CD1-CB 4.31Å; I496-R603 HydrophobicContact CB-CB 4.01Å; I496-R603 HydrophobicContact CG2-CB 3.98Å; I496-R603 WeakPolarHBondContact O-CG 3.28Å; I496-C604 HydrophobicContact CD1-CB 4.3Å
497	S	91.7	Very high	77.6	Confident	37 Å²	37	52.5 Å²	52.5	26%	0.259	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-98.1	127.3	170.3	-173.3	0	0	0	0	110.8	Q495 T499 F500 Y543	Q495-S497 PolarHBondContact O-N 3.15Å; S497-T499 PolarHBondContact O-N 3.09Å; S497-T499 PolarHBondContact OG-N 3.42Å; S497-T499 PolarHBondContact OG-OG1 3.44Å; S497-F500 VanDerWaalsContact CB-CD2 3.49Å; S497-F500 PolarHBondContact O-N 2.99Å; S497-Y543 PolarHBondContact N-OH 2.96Å
498	V	93.6	Very high	80.2	Confident	26 Å²	26	49.2 Å²	49.2	16%	0.158	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-28.9	174.9	177	0	0	0	0	110.9	F500 V501 T502 R603 I610	V498-F500 VanDerWaalsContact C-N 3.32Å; V498-F500 PolarHBondContact O-N 3.31Å; V498-V501 PolarHBondContact O-N 3.4Å; V498-T502 PolarHBondContact O-N 2.87Å; V498-R603 HydrophobicContact CG2-CB 4.31Å; V498-I610 HydrophobicContact CG1-CD1 3.27Å
499	T	93	Very high	82.8	Confident	77 Å²	77	49.1 Å²	49.1	47%	0.472	26%	0.255	S	S	.	.	H	α-helix	trans	-63.1	-35.9	-180	61.5	0	0	0	0	112.4	S497 V501 T502 E503	S497-T499 PolarHBondContact O-N 3.09Å; S497-T499 PolarHBondContact OG-N 3.42Å; S497-T499 PolarHBondContact OG-OG1 3.44Å; T499-V501 VanDerWaalsContact C-N 3.35Å; T499-V501 PolarHBondContact O-N 3.01Å; T499-T502 WeakPolarHBondContact CA-OG1 3.25Å; T499-T502 PolarHBondContact O-N 3.33Å; T499-T502 PolarHBondContact O-OG1 3.5Å; T499-E503 PolarHBondContact O-N 3.25Å
500	F	93.8	Very high	85.4	Confident	30 Å²	30	47.4 Å²	47.4	13%	0.132	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-37.9	176.3	-62	-47.8	0	0	0	112.1	K463 L467 S497 V498 T502 E503 F504 Y543	K463-F500 HydrophobicContact CD-CD1 4.43Å; K463-F500 HydrophobicContact CG-CD1 4.49Å; L467-F500 HydrophobicContact CD1-CD2 4.09Å; L467-F500 HydrophobicContact CD1-CE2 3.97Å; L467-F500 HydrophobicContact CD1-CG 4.5Å; L467-F500 HydrophobicContact CD1-CZ 4.23Å; L467-F500 HydrophobicContact CD2-CD2 4.33Å; L467-F500 HydrophobicContact CD2-CE1 4.12Å; L467-F500 HydrophobicContact CD2-CE2 3.39Å; L467-F500 HydrophobicContact CD2-CZ 3.24Å; L467-F500 HydrophobicContact CG-CE2 4.19Å; L467-F500 HydrophobicContact CG-CZ 4.06Å; S497-F500 VanDerWaalsContact CB-CD2 3.49Å; S497-F500 PolarHBondContact O-N 2.99Å; V498-F500 VanDerWaalsContact C-N 3.32Å; V498-F500 PolarHBondContact O-N 3.31Å; F500-T502 VanDerWaalsContact C-N 3.29Å; F500-T502 PolarHBondContact O-N 2.94Å; F500-E503 WeakPolarHBondContact O-CB 3.41Å; F500-E503 PolarHBondContact O-N 3.21Å; F500-E503 VanDerWaalsContact O-N 3.12Å; F500-F504 HydrophobicContact CB-CE1 4.41Å; F500-F504 HydrophobicContact CB-CZ 4.18Å; F500-F504 WeakPolarHBondContact O-CD1 3.27Å; F500-F504 WeakPolarHBondContact O-CG 3.47Å; F500-F504 PolarHBondContact O-N 3.08Å; F500-Y543 HydrophobicContact CB-CE1 4.33Å; F500-Y543 HydrophobicContact CD2-CE2 4.39Å; F500-Y543 AromaticContact CD2-CZ 3.85Å; F500-Y543 VanDerWaalsContact CD2-OH 3.3Å; F500-Y543 WeakPolarHBondContact CD2-OH 3.32Å
501	V	96.6	Very high	87.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.9	-37.6	174.2	177	0	0	0	0	110.8	V498 T499 E503 F504 V505 V540 Y543 S607 V611	V498-V501 PolarHBondContact O-N 3.4Å; T499-V501 VanDerWaalsContact C-N 3.35Å; T499-V501 PolarHBondContact O-N 3.01Å; V501-E503 VanDerWaalsContact C-N 3.33Å; V501-E503 PolarHBondContact O-N 3.36Å; V501-F504 PolarHBondContact O-N 3.4Å; V501-V505 WeakPolarHBondContact O-CG2 3.44Å; V501-V505 PolarHBondContact O-N 3.39Å; V501-V540 HydrophobicContact CG1-CG1 4.43Å; V501-V540 HydrophobicContact CG1-CG2 4.04Å; V501-Y543 HydrophobicContact CG2-CD1 3.97Å; V501-Y543 HydrophobicContact CG2-CE1 4.18Å; V501-S607 WeakPolarHBondContact CG2-OG 3.46Å; V501-V611 HydrophobicContact CG1-CG2 4.18Å
502	T	97.1	Very high	89.9	Confident	56 Å²	56	44.3 Å²	44.3	34%	0.344	22%	0.222	S	C	.	.	H	α-helix	trans	-63.5	-36.7	171.8	62.8	0	0	0	0	112.6	V498 T499 F500 V505 R506 I610	V498-T502 PolarHBondContact O-N 2.87Å; T499-T502 WeakPolarHBondContact CA-OG1 3.25Å; T499-T502 PolarHBondContact O-N 3.33Å; T499-T502 PolarHBondContact O-OG1 3.5Å; F500-T502 VanDerWaalsContact C-N 3.29Å; F500-T502 PolarHBondContact O-N 2.94Å; T502-V505 PolarHBondContact O-N 2.89Å; T502-R506 VanDerWaalsContact O-CG 3.29Å; T502-R506 WeakPolarHBondContact O-CG 3.5Å; T502-R506 PolarHBondContact O-N 3.47Å; T502-I610 HydrophobicContact CG2-CD1 3.87Å
503	E	96.8	Very high	92	Very high	63 Å²	63	45.5 Å²	45.5	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-64.6	-42.7	173.4	-72.2	-178.3	-175.8	0	0	111.8	K463 T499 F500 V501 V505 R506 W507	K463-E503 WeakPolarHBondContact CE-OE2 2.89Å; K463-E503 IonicContact NZ-OE1 3.37Å; K463-E503 IonicContact NZ-OE2 3.4Å; K463-E503 PolarHBondContact NZ-OE2 3.4Å; T499-E503 PolarHBondContact O-N 3.25Å; F500-E503 WeakPolarHBondContact O-CB 3.41Å; F500-E503 PolarHBondContact O-N 3.21Å; F500-E503 VanDerWaalsContact O-N 3.12Å; V501-E503 VanDerWaalsContact C-N 3.33Å; V501-E503 PolarHBondContact O-N 3.36Å; E503-V505 VanDerWaalsContact C-N 3.32Å; E503-V505 PolarHBondContact O-N 3.01Å; E503-R506 WeakPolarHBondContact O-CB 3.5Å; E503-R506 PolarHBondContact O-N 3.29Å; E503-R506 VanDerWaalsContact O-N 3.15Å; E503-W507 HydrophobicContact CB-CZ2 4.34Å; E503-W507 PolarHBondContact O-N 3.47Å
504	F	98.2	Very high	94.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-42.9	176.9	-56.9	-15.3	0	0	0	111.2	Y460 K463 F500 V501 W507 N508 L536 Q539 V540 Y543	Y460-F504 HydrophobicContact CD2-CE1 4.04Å; Y460-F504 HydrophobicContact CD2-CE2 4.13Å; Y460-F504 AromaticContact CD2-CZ 3.77Å; Y460-F504 HydrophobicContact CD2-CZ 3.77Å; Y460-F504 AromaticContact CE2-CE2 3.94Å; Y460-F504 HydrophobicContact CE2-CE2 3.94Å; Y460-F504 AromaticContact CE2-CZ 3.79Å; Y460-F504 HydrophobicContact CE2-CZ 3.79Å; K463-F504 HydrophobicContact CG-CE1 4.24Å; F500-F504 HydrophobicContact CB-CE1 4.41Å; F500-F504 HydrophobicContact CB-CZ 4.18Å; F500-F504 WeakPolarHBondContact O-CD1 3.27Å; F500-F504 WeakPolarHBondContact O-CG 3.47Å; F500-F504 PolarHBondContact O-N 3.08Å; V501-F504 PolarHBondContact O-N 3.4Å; F504-W507 AromaticContact CD1-CE3 3.89Å; F504-W507 HydrophobicContact CD1-CE3 3.89Å; F504-W507 AromaticContact CD1-CH2 3.82Å; F504-W507 HydrophobicContact CD1-CH2 3.82Å; F504-W507 AromaticContact CD1-CZ3 3.36Å; F504-W507 HydrophobicContact CD1-CZ3 3.36Å; F504-W507 AromaticContact CE1-CH2 3.91Å; F504-W507 HydrophobicContact CE1-CH2 3.91Å; F504-W507 AromaticContact CE1-CZ3 3.72Å; F504-W507 HydrophobicContact CE1-CZ3 3.72Å; F504-W507 HydrophobicContact CG-CZ3 4.46Å; F504-W507 PolarHBondContact O-N 3.44Å; F504-N508 PolarHBondContact O-N 3.3Å; F504-L536 HydrophobicContact CB-CD1 3.63Å; F504-Q539 HydrophobicContact CD2-CB 4.48Å; F504-V540 HydrophobicContact CD2-CG2 4.06Å; F504-Y543 HydrophobicContact CE2-CD1 4.15Å; F504-Y543 HydrophobicContact CE2-CG 4.02Å; F504-Y543 HydrophobicContact CZ-CG 4.45Å
505	V	98.3	Very high	95.6	Very high	8 Å²	8	39.3 Å²	39.3	5%	0.048	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-43.1	174.5	171.3	0	0	0	0	111.1	V501 T502 E503 W507 N508 E509 L536 I610 Y614	V501-V505 WeakPolarHBondContact O-CG2 3.44Å; V501-V505 PolarHBondContact O-N 3.39Å; T502-V505 PolarHBondContact O-N 2.89Å; E503-V505 VanDerWaalsContact C-N 3.32Å; E503-V505 PolarHBondContact O-N 3.01Å; V505-W507 PolarHBondContact O-N 2.97Å; V505-N508 CarbonylContact O-C 3.56Å; V505-N508 WeakPolarHBondContact O-CA 3.5Å; V505-N508 WeakPolarHBondContact O-CB 3.47Å; V505-N508 PolarHBondContact O-N 3.01Å; V505-N508 VanDerWaalsContact O-N 3.09Å; V505-E509 HydrophobicContact CG1-CG 4.3Å; V505-E509 WeakPolarHBondContact O-CG 3.29Å; V505-E509 PolarHBondContact O-N 3.39Å; V505-L536 HydrophobicContact CG2-CD1 4.19Å; V505-L536 HydrophobicContact CG2-CD2 4.07Å; V505-I610 HydrophobicContact CG2-CG2 4.03Å; V505-Y614 HydrophobicContact CG1-CD1 4Å; V505-Y614 HydrophobicContact CG1-CD2 3.95Å; V505-Y614 HydrophobicContact CG1-CE1 4.46Å; V505-Y614 HydrophobicContact CG1-CE2 4.45Å; V505-Y614 HydrophobicContact CG1-CG 3.71Å
506	R	98.2	Very high	96.3	Very high	172 Å²	172	39.4 Å²	39.4	65%	0.649	20%	0.2	S	C	*	.	H	α-helix	trans	-61.6	-40.8	176.7	-72.9	179.8	74.4	88.9	7.1	112.8	T502 E503 N508 E509 E510	T502-R506 VanDerWaalsContact O-CG 3.29Å; T502-R506 WeakPolarHBondContact O-CG 3.5Å; T502-R506 PolarHBondContact O-N 3.47Å; E503-R506 WeakPolarHBondContact O-CB 3.5Å; E503-R506 PolarHBondContact O-N 3.29Å; E503-R506 VanDerWaalsContact O-N 3.15Å; R506-N508 VanDerWaalsContact C-N 3.28Å; R506-N508 PolarHBondContact O-N 2.85Å; R506-E509 PolarHBondContact O-N 2.86Å; R506-E510 PolarHBondContact O-N 3.25Å; R506-E510 VanDerWaalsContact O-N 3.07Å
507	W	98	Very high	96.6	Very high	44 Å²	44	40.8 Å²	40.8	17%	0.167	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-39	173.7	-58.1	-23	0	0	0	111.3	L456 L459 K463 E503 F504 V505 E510 A511	L456-W507 HydrophobicContact CD2-CB 3.88Å; L459-W507 HydrophobicContact CB-CD2 3.94Å; L459-W507 HydrophobicContact CB-CE3 3.66Å; L459-W507 HydrophobicContact CB-CH2 4.1Å; L459-W507 HydrophobicContact CB-CZ2 4.34Å; L459-W507 HydrophobicContact CB-CZ3 3.74Å; L459-W507 HydrophobicContact CD1-CB 4.15Å; L459-W507 HydrophobicContact CD1-CD2 3.97Å; L459-W507 HydrophobicContact CD1-CE3 4.34Å; L459-W507 HydrophobicContact CD1-CG 3.87Å; K463-W507 HydrophobicContact CB-CH2 3.68Å; K463-W507 HydrophobicContact CD-CH2 4.5Å; K463-W507 HydrophobicContact CG-CH2 3.96Å; E503-W507 HydrophobicContact CB-CZ2 4.34Å; E503-W507 PolarHBondContact O-N 3.47Å; F504-W507 AromaticContact CD1-CE3 3.89Å; F504-W507 HydrophobicContact CD1-CE3 3.89Å; F504-W507 AromaticContact CD1-CH2 3.82Å; F504-W507 HydrophobicContact CD1-CH2 3.82Å; F504-W507 AromaticContact CD1-CZ3 3.36Å; F504-W507 HydrophobicContact CD1-CZ3 3.36Å; F504-W507 AromaticContact CE1-CH2 3.91Å; F504-W507 HydrophobicContact CE1-CH2 3.91Å; F504-W507 AromaticContact CE1-CZ3 3.72Å; F504-W507 HydrophobicContact CE1-CZ3 3.72Å; F504-W507 HydrophobicContact CG-CZ3 4.46Å; F504-W507 PolarHBondContact O-N 3.44Å; V505-W507 PolarHBondContact O-N 2.97Å; W507-E510 PolarHBondContact O-N 3.2Å; W507-A511 WeakPolarHBondContact O-CB 3.29Å; W507-A511 PolarHBondContact O-N 3.02Å
508	N	98.3	Very high	96.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-42.9	176	-157.6	-95.6	0	0	0	112.1	F504 V505 R506 E510 A511 I512 I532 L536 Y614	F504-N508 PolarHBondContact O-N 3.3Å; V505-N508 CarbonylContact O-C 3.56Å; V505-N508 WeakPolarHBondContact O-CA 3.5Å; V505-N508 WeakPolarHBondContact O-CB 3.47Å; V505-N508 PolarHBondContact O-N 3.01Å; V505-N508 VanDerWaalsContact O-N 3.09Å; R506-N508 VanDerWaalsContact C-N 3.28Å; R506-N508 PolarHBondContact O-N 2.85Å; N508-E510 VanDerWaalsContact C-N 3.31Å; N508-E510 PolarHBondContact O-N 2.94Å; N508-A511 CarbonylContact O-C 3.59Å; N508-A511 WeakPolarHBondContact O-CB 3.37Å; N508-A511 PolarHBondContact O-N 3.36Å; N508-A511 VanDerWaalsContact O-N 3.16Å; N508-I512 WeakPolarHBondContact O-CB 3.46Å; N508-I512 VanDerWaalsContact O-CG1 3.27Å; N508-I512 WeakPolarHBondContact O-CG1 3.45Å; N508-I512 PolarHBondContact O-N 2.87Å; N508-I532 WeakPolarHBondContact ND2-CG2 3.45Å; N508-I532 PolarHBondContact ND2-O 3.06Å; N508-L536 HydrophobicContact CB-CB 4.26Å; N508-L536 HydrophobicContact CB-CD2 3.99Å; N508-L536 HydrophobicContact CB-CG 4.49Å; N508-L536 WeakPolarHBondContact ND2-CB 3.49Å; N508-Y614 HydrophobicContact CB-CE1 4.17Å; N508-Y614 VanDerWaalsContact OD1-CE1 3.27Å; N508-Y614 WeakPolarHBondContact OD1-CE1 3.5Å; N508-Y614 PolarHBondContact OD1-OH 2.82Å
509	E	98.1	Very high	96.8	Very high	78 Å²	78	38.9 Å²	38.9	36%	0.364	19%	0.194	S	C	.	.	H	α-helix	trans	-57.6	-43.6	175	-77.7	175.5	162.4	0	0	111.8	V505 R506 I512 T513 Y614	V505-E509 HydrophobicContact CG1-CG 4.3Å; V505-E509 WeakPolarHBondContact O-CG 3.29Å; V505-E509 PolarHBondContact O-N 3.39Å; R506-E509 PolarHBondContact O-N 2.86Å; E509-I512 PolarHBondContact O-N 3.32Å; E509-T513 PolarHBondContact O-N 3.36Å; E509-T513 PolarHBondContact O-OG1 3.13Å; E509-Y614 HydrophobicContact CG-CD2 4.02Å; E509-Y614 HydrophobicContact CG-CE2 3.34Å; E509-Y614 PolarHBondContact N-OH 3.46Å
510	E	97.7	Very high	96.5	Very high	55 Å²	55	40 Å²	40	26%	0.257	21%	0.205	S	C	.	.	H	α-helix	trans	-64.1	-42.2	176.4	-152.6	-164.9	131.9	0	0	111.5	R407 R506 W507 N508 T513 R514	R407-E510 IonicContact CZ-OE1 3.56Å; R407-E510 IonicContact CZ-OE2 2.75Å; R407-E510 IonicContact NE-OE1 3.41Å; R407-E510 PolarHBondContact NE-OE1 3.08Å; R407-E510 IonicContact NE-OE2 3.71Å; R407-E510 IonicContact NH2-OE1 2.87Å; R407-E510 PolarHBondContact NH2-OE1 3.48Å; R407-E510 IonicContact NH2-OE2 2.7Å; R407-E510 PolarHBondContact NH2-OE2 3.44Å; R506-E510 PolarHBondContact O-N 3.25Å; R506-E510 VanDerWaalsContact O-N 3.07Å; W507-E510 PolarHBondContact O-N 3.2Å; N508-E510 VanDerWaalsContact C-N 3.31Å; N508-E510 PolarHBondContact O-N 2.94Å; E510-T513 PolarHBondContact O-N 2.97Å; E510-R514 PolarHBondContact O-N 3.48Å; E510-R514 IonicContact OE1-CZ 3.67Å; E510-R514 IonicContact OE1-NH1 2.82Å; E510-R514 PolarHBondContact OE1-NH1 3.32Å
511	A	98.1	Very high	96.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-41	175.3	0	0	0	0	0	112.3	Y448 E452 L456 W507 N508 T513 R514 C515 I532	Y448-A511 PolarHBondContact OH-O 3.46Å; E452-A511 HydrophobicContact CG-CB 3.84Å; E452-A511 WeakPolarHBondContact OE1-CB 3.49Å; L456-A511 HydrophobicContact CD1-CB 4.2Å; L456-A511 HydrophobicContact CD2-CB 4.31Å; W507-A511 WeakPolarHBondContact O-CB 3.29Å; W507-A511 PolarHBondContact O-N 3.02Å; N508-A511 CarbonylContact O-C 3.59Å; N508-A511 WeakPolarHBondContact O-CB 3.37Å; N508-A511 PolarHBondContact O-N 3.36Å; N508-A511 VanDerWaalsContact O-N 3.16Å; A511-T513 VanDerWaalsContact C-N 3.33Å; A511-T513 PolarHBondContact O-N 2.9Å; A511-R514 PolarHBondContact O-N 2.93Å; A511-C515 WeakPolarHBondContact O-CB 3.3Å; A511-C515 PolarHBondContact O-N 3.44Å; A511-I532 HydrophobicContact CB-CG2 3.88Å
512	I	98	Very high	96.2	Very high	12 Å²	12	48.2 Å²	48.2	6%	0.062	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-38.7	176.4	-68.7	-60.4	0	0	0	111	N508 E509 R514 C515 T516 V529 I532 Y614 I619 L622	N508-I512 WeakPolarHBondContact O-CB 3.46Å; N508-I512 VanDerWaalsContact O-CG1 3.27Å; N508-I512 WeakPolarHBondContact O-CG1 3.45Å; N508-I512 PolarHBondContact O-N 2.87Å; E509-I512 PolarHBondContact O-N 3.32Å; I512-R514 PolarHBondContact O-N 3.1Å; I512-C515 WeakPolarHBondContact O-CB 3.43Å; I512-C515 PolarHBondContact O-N 3.28Å; I512-T516 HydrophobicContact CG2-CG2 4.48Å; I512-T516 WeakPolarHBondContact O-CG2 3.48Å; I512-T516 PolarHBondContact O-N 2.91Å; I512-T516 PolarHBondContact O-OG1 2.95Å; I512-V529 HydrophobicContact CD1-CB 4.18Å; I512-V529 HydrophobicContact CD1-CG1 3.92Å; I512-V529 HydrophobicContact CD1-CG2 4.04Å; I512-I532 HydrophobicContact CD1-CB 4.05Å; I512-I532 HydrophobicContact CD1-CD1 4.47Å; I512-I532 HydrophobicContact CD1-CG2 3.65Å; I512-I532 HydrophobicContact CG1-CG2 4.11Å; I512-Y614 WeakPolarHBondContact CG1-OH 3.39Å; I512-I619 HydrophobicContact CD1-CD1 3.91Å; I512-I619 HydrophobicContact CG1-CD1 3.78Å; I512-L622 HydrophobicContact CG2-CD1 3.49Å; I512-L622 VanDerWaalsContact CG2-CD1 3.49Å
513	T	97.1	Very high	96.1	Very high	90 Å²	90	48.4 Å²	48.4	55%	0.552	26%	0.259	S	S	*	.	H	α-helix	trans	-59.4	-46.6	175.1	-56.1	0	0	0	0	111	E509 E510 A511 T516 L517	E509-T513 PolarHBondContact O-N 3.36Å; E509-T513 PolarHBondContact O-OG1 3.13Å; E510-T513 PolarHBondContact O-N 2.97Å; A511-T513 VanDerWaalsContact C-N 3.33Å; A511-T513 PolarHBondContact O-N 2.9Å; T513-T516 PolarHBondContact O-N 2.83Å; T513-T516 PolarHBondContact O-OG1 3.05Å; T513-L517 PolarHBondContact O-N 2.98Å; T513-L517 VanDerWaalsContact O-N 3.17Å
514	R	97.4	Very high	95.9	Very high	14 Å²	14	48.2 Å²	48.2	5%	0.053	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-40	173.2	-73.2	-172.5	-68.3	-85	1	112.7	A410 Y448 E452 E510 A511 I512 T516 L517 F518	A410-R514 HydrophobicContact CB-CG 4.05Å; Y448-R514 HydrophobicContact CE2-CB 4.28Å; E452-R514 IonicContact OE1-CZ 2.66Å; E452-R514 IonicContact OE1-NE 3.72Å; E452-R514 PolarHBondContact OE1-NE 2.96Å; E452-R514 IonicContact OE1-NH2 3.75Å; E452-R514 PolarHBondContact OE1-NH2 3.22Å; E452-R514 IonicContact OE2-CZ 2.57Å; E452-R514 IonicContact OE2-NE 2.91Å; E452-R514 PolarHBondContact OE2-NE 2.62Å; E452-R514 IonicContact OE2-NH2 3.99Å; E510-R514 PolarHBondContact O-N 3.48Å; E510-R514 IonicContact OE1-CZ 3.67Å; E510-R514 IonicContact OE1-NH1 2.82Å; E510-R514 PolarHBondContact OE1-NH1 3.32Å; A511-R514 PolarHBondContact O-N 2.93Å; I512-R514 PolarHBondContact O-N 3.1Å; R514-T516 VanDerWaalsContact C-N 3.31Å; R514-T516 PolarHBondContact O-N 3.12Å; R514-L517 WeakPolarHBondContact O-CB 3.42Å; R514-L517 PolarHBondContact O-N 3.32Å; R514-F518 HydrophobicContact CB-CD2 4.28Å; R514-F518 HydrophobicContact CB-CE2 3.96Å; R514-F518 HydrophobicContact CG-CE2 4.38Å; R514-F518 WeakPolarHBondContact O-CD2 3.25Å; R514-F518 PolarHBondContact O-N 3.3Å
515	C	97.2	Very high	95.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-41.7	179.3	-175.8	0	0	0	0	111.5	Y448 A511 I512 L517 S519 N528 I532	Y448-C515 HydrophobicContact CE1-CB 4.4Å; Y448-C515 VanDerWaalsContact OH-CA 3.28Å; Y448-C515 WeakPolarHBondContact OH-CA 3.42Å; Y448-C515 PolarHBondContact OH-N 3.03Å; A511-C515 WeakPolarHBondContact O-CB 3.3Å; A511-C515 PolarHBondContact O-N 3.44Å; I512-C515 WeakPolarHBondContact O-CB 3.43Å; I512-C515 PolarHBondContact O-N 3.28Å; C515-L517 VanDerWaalsContact C-N 3.29Å; C515-L517 PolarHBondContact O-N 3.49Å; C515-S519 WeakPolarHBondContact O-CB 3.44Å; C515-S519 PolarHBondContact O-N 3.49Å; C515-S519 PolarHBondContact O-OG 3.47Å; C515-N528 WeakPolarHBondContact SG-CB 3.26Å; C515-I532 HydrophobicContact CB-CD1 3.6Å
516	T	96	Very high	95.8	Very high	60 Å²	60	49.2 Å²	49.2	37%	0.368	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-30.2	174.6	54.6	0	0	0	0	113	I512 T513 R514 L525 L622	I512-T516 HydrophobicContact CG2-CG2 4.48Å; I512-T516 WeakPolarHBondContact O-CG2 3.48Å; I512-T516 PolarHBondContact O-N 2.91Å; I512-T516 PolarHBondContact O-OG1 2.95Å; T513-T516 PolarHBondContact O-N 2.83Å; T513-T516 PolarHBondContact O-OG1 3.05Å; R514-T516 VanDerWaalsContact C-N 3.31Å; R514-T516 PolarHBondContact O-N 3.12Å; T516-L525 HydrophobicContact CG2-CD1 3.98Å; T516-L622 HydrophobicContact CG2-CD1 3.92Å; T516-L622 HydrophobicContact CG2-CD2 4.01Å
517	L	95.5	Very high	95.7	Very high	35 Å²	35	43.8 Å²	43.8	18%	0.183	26%	0.259	C	S	.	.	H	α-helix	trans	-72.6	-43.4	177	178.7	67.6	0	0	0	111.7	A410 Y413 E414 T513 R514 C515	A410-L517 HydrophobicContact CB-CD2 3.88Å; Y413-L517 HydrophobicContact CD1-CD1 3.72Å; Y413-L517 HydrophobicContact CD1-CD2 3.98Å; Y413-L517 HydrophobicContact CD1-CG 3.61Å; Y413-L517 HydrophobicContact CE1-CD1 3.79Å; Y413-L517 HydrophobicContact CE1-CG 3.87Å; Y413-L517 WeakPolarHBondContact CE1-O 3.45Å; E414-L517 HydrophobicContact CG-CD1 3.78Å; E414-L517 HydrophobicContact CG-CD2 3.72Å; E414-L517 HydrophobicContact CG-CG 4.4Å; T513-L517 PolarHBondContact O-N 2.98Å; T513-L517 VanDerWaalsContact O-N 3.17Å; R514-L517 WeakPolarHBondContact O-CB 3.42Å; R514-L517 PolarHBondContact O-N 3.32Å; C515-L517 VanDerWaalsContact C-N 3.29Å; C515-L517 PolarHBondContact O-N 3.49Å
518	F	95.2	Very high	95.6	Very high	11 Å²	11	43.2 Å²	43.2	5%	0.048	26%	0.259	C	S	.	.	H	α-helix	trans	-89.5	-23.4	-174.2	-57.9	-45.8	0	0	0	114.7	L409 A410 Y413 Y448 R514	L409-F518 HydrophobicContact CB-CZ 4.19Å; L409-F518 HydrophobicContact CD2-CE1 4.43Å; L409-F518 HydrophobicContact CD2-CE2 4.12Å; L409-F518 HydrophobicContact CD2-CZ 3.89Å; L409-F518 HydrophobicContact CG-CE1 4.02Å; L409-F518 HydrophobicContact CG-CE2 4.35Å; L409-F518 HydrophobicContact CG-CZ 3.64Å; A410-F518 HydrophobicContact CB-CZ 3.87Å; Y413-F518 AromaticContact CD1-CD1 4Å; Y413-F518 HydrophobicContact CD1-CD1 4Å; Y413-F518 AromaticContact CD1-CE1 4Å; Y413-F518 HydrophobicContact CD1-CE1 4Å; Y413-F518 HydrophobicContact CE1-CD1 4.36Å; Y413-F518 HydrophobicContact CG-CD1 4.24Å; Y413-F518 HydrophobicContact CG-CE1 4.04Å; Y448-F518 HydrophobicContact CD1-CB 4.28Å; Y448-F518 HydrophobicContact CD1-CD2 4.06Å; Y448-F518 AromaticContact CD2-CD2 3.47Å; Y448-F518 HydrophobicContact CD2-CD2 3.47Å; Y448-F518 VanDerWaalsContact CD2-CD2 3.47Å; Y448-F518 AromaticContact CD2-CE2 3.71Å; Y448-F518 HydrophobicContact CD2-CE2 3.71Å; Y448-F518 HydrophobicContact CE1-CB 4.45Å; Y448-F518 HydrophobicContact CE1-CD2 4Å; Y448-F518 AromaticContact CE2-CD2 3.4Å; Y448-F518 HydrophobicContact CE2-CD2 3.4Å; Y448-F518 AromaticContact CE2-CE2 3.6Å; Y448-F518 HydrophobicContact CE2-CE2 3.6Å; Y448-F518 AromaticContact CG-CD2 3.82Å; Y448-F518 HydrophobicContact CG-CD2 3.82Å; Y448-F518 HydrophobicContact CG-CE2 4.45Å; Y448-F518 AromaticContact CZ-CD2 3.7Å; R514-F518 HydrophobicContact CB-CD2 4.28Å; R514-F518 HydrophobicContact CB-CE2 3.96Å; R514-F518 HydrophobicContact CG-CE2 4.38Å; R514-F518 WeakPolarHBondContact O-CD2 3.25Å; R514-F518 PolarHBondContact O-N 3.3Å
519	S	93.6	Very high	95.6	Very high	11 Å²	11	43.2 Å²	43.2	8%	0.077	26%	0.259	C	S	.	.			trans	-96	97.9	-177.6	-48.7	0	0	0	0	110.9	C515 N528	C515-S519 WeakPolarHBondContact O-CB 3.44Å; C515-S519 PolarHBondContact O-N 3.49Å; C515-S519 PolarHBondContact O-OG 3.47Å; S519-N528 PolarHBondContact OG-ND2 2.98Å; S519-N528 VanDerWaalsContact OG-ND2 3.16Å
520	S	86.9	Confident	95.5	Very high	101 Å²	101	42.4 Å²	42.4	71%	0.706	25%	0.254	S	S	*	.			trans	-75.7	-31.6	-177.8	53.9	0	0	0	0	114
521	Q	91.7	Very high	95.5	Very high	119 Å²	119	41.1 Å²	41.1	56%	0.556	25%	0.253	S	S	*	.	S	Bend	trans	-92.2	137.3	-178.4	-62.5	-178.6	-1.7	0	0	111.6	A523 T524 L525	Q521-A523 VanDerWaalsContact C-N 3.29Å; Q521-A523 PolarHBondContact O-N 2.94Å; Q521-T524 HydrophobicContact CB-CG2 4.45Å; Q521-T524 PolarHBondContact O-N 3.25Å; Q521-T524 PolarHBondContact O-OG1 3.06Å; Q521-L525 WeakPolarHBondContact O-CB 3.37Å; Q521-L525 PolarHBondContact O-N 2.92Å
522	P	92.4	Very high	95.5	Very high	83 Å²	83	41.2 Å²	41.2	54%	0.539	25%	0.254	S	S	.	.	H	α-helix	trans	-57.4	-37.1	-179.8	-27.6	35.1	0	0	0	114.4	A526 V626	P522-A526 WeakPolarHBondContact O-CB 3.4Å; P522-A526 PolarHBondContact O-N 2.88Å; P522-V626 HydrophobicContact CB-CG2 4.44Å; P522-V626 WeakPolarHBondContact O-CG2 3.47Å
523	A	94.5	Very high	95.5	Very high	61 Å²	61	40.7 Å²	40.7	50%	0.504	25%	0.251	S	S	.	.	H	α-helix	trans	-67.2	-46.2	179.9	0	0	0	0	0	112.6	Q521 A526 A527	Q521-A523 VanDerWaalsContact C-N 3.29Å; Q521-A523 PolarHBondContact O-N 2.94Å; A523-A526 PolarHBondContact O-N 3.34Å; A523-A527 PolarHBondContact O-N 3.48Å; A523-A527 VanDerWaalsContact O-N 3.1Å
524	T	94.5	Very high	95.5	Very high	58 Å²	58	38.5 Å²	38.5	36%	0.356	24%	0.238	S	C	.	.	H	α-helix	trans	-69.5	-38.5	177.8	57.8	0	0	0	0	111	Q521 A527 N528	Q521-T524 HydrophobicContact CB-CG2 4.45Å; Q521-T524 PolarHBondContact O-N 3.25Å; Q521-T524 PolarHBondContact O-OG1 3.06Å; T524-A527 PolarHBondContact O-N 2.96Å; T524-N528 WeakPolarHBondContact O-CB 3.4Å; T524-N528 VanDerWaalsContact O-CG 3.28Å; T524-N528 PolarHBondContact O-N 3.12Å; T524-N528 PolarHBondContact O-ND2 2.97Å
525	L	96.1	Very high	95.5	Very high	28 Å²	28	38.9 Å²	38.9	15%	0.147	24%	0.242	C	C	.	.	H	α-helix	trans	-57.7	-51.6	172.9	176.7	60	0	0	0	111.3	T516 Q521 A527 N528 V529	T516-L525 HydrophobicContact CG2-CD1 3.98Å; Q521-L525 WeakPolarHBondContact O-CB 3.37Å; Q521-L525 PolarHBondContact O-N 2.92Å; L525-A527 VanDerWaalsContact C-N 3.31Å; L525-A527 PolarHBondContact O-N 3.3Å; L525-N528 PolarHBondContact O-N 3.49Å; L525-V529 HydrophobicContact CD1-CG2 3.67Å; L525-V529 HydrophobicContact CG-CG2 4.15Å; L525-V529 VanDerWaalsContact O-CB 3.31Å; L525-V529 WeakPolarHBondContact O-CB 3.3Å; L525-V529 WeakPolarHBondContact O-CG2 3.48Å; L525-V529 PolarHBondContact O-N 3.34Å
526	A	96.6	Very high	95.6	Very high	2 Å²	2	38.9 Å²	38.9	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-39.8	-179.9	0	0	0	0	0	112.3	P522 A523 K530 L623 V626 A629	P522-A526 WeakPolarHBondContact O-CB 3.4Å; P522-A526 PolarHBondContact O-N 2.88Å; A523-A526 PolarHBondContact O-N 3.34Å; A526-K530 VanDerWaalsContact O-CB 3.31Å; A526-K530 WeakPolarHBondContact O-CB 3.35Å; A526-K530 PolarHBondContact O-N 3.47Å; A526-L623 HydrophobicContact CB-CD2 4.17Å; A526-L623 WeakPolarHBondContact O-CD2 3.45Å; A526-V626 HydrophobicContact CB-CB 3.88Å; A526-V626 HydrophobicContact CB-CG1 4.38Å; A526-V626 HydrophobicContact CB-CG2 3.57Å; A526-A629 HydrophobicContact CB-CB 4.28Å
527	A	96.2	Very high	95.7	Very high	58 Å²	58	36.2 Å²	36.2	48%	0.479	23%	0.226	S	C	.	.	H	α-helix	trans	-63.2	-46.7	176.4	0	0	0	0	0	112.2	A523 T524 L525 K530 A531	A523-A527 PolarHBondContact O-N 3.48Å; A523-A527 VanDerWaalsContact O-N 3.1Å; T524-A527 PolarHBondContact O-N 2.96Å; L525-A527 VanDerWaalsContact C-N 3.31Å; L525-A527 PolarHBondContact O-N 3.3Å; A527-K530 PolarHBondContact O-N 3.34Å; A527-A531 PolarHBondContact O-N 2.9Å
528	N	96.7	Very high	95.8	Very high	32 Å²	32	38.9 Å²	38.9	17%	0.171	24%	0.24	C	C	.	.	H	α-helix	trans	-68.1	-43.2	179.2	-70.2	-20.7	0	0	0	111.8	P449 C515 S519 T524 L525 K530 A531 I532	P449-N528 WeakPolarHBondContact CG-OD1 3.48Å; C515-N528 WeakPolarHBondContact SG-CB 3.26Å; S519-N528 PolarHBondContact OG-ND2 2.98Å; S519-N528 VanDerWaalsContact OG-ND2 3.16Å; T524-N528 WeakPolarHBondContact O-CB 3.4Å; T524-N528 VanDerWaalsContact O-CG 3.28Å; T524-N528 PolarHBondContact O-N 3.12Å; T524-N528 PolarHBondContact O-ND2 2.97Å; L525-N528 PolarHBondContact O-N 3.49Å; N528-K530 VanDerWaalsContact C-N 3.34Å; N528-K530 PolarHBondContact O-N 3.47Å; N528-A531 PolarHBondContact O-N 3.46Å; N528-I532 WeakPolarHBondContact O-CB 3.37Å; N528-I532 VanDerWaalsContact O-CG1 3.32Å; N528-I532 WeakPolarHBondContact O-CG1 3.4Å; N528-I532 PolarHBondContact O-N 3.48Å
529	V	97.8	Very high	95.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.1	-46.4	174.3	167.2	0	0	0	0	110.6	I512 L525 A531 I532 F533 I619 L622 L623	I512-V529 HydrophobicContact CD1-CB 4.18Å; I512-V529 HydrophobicContact CD1-CG1 3.92Å; I512-V529 HydrophobicContact CD1-CG2 4.04Å; L525-V529 HydrophobicContact CD1-CG2 3.67Å; L525-V529 HydrophobicContact CG-CG2 4.15Å; L525-V529 VanDerWaalsContact O-CB 3.31Å; L525-V529 WeakPolarHBondContact O-CB 3.3Å; L525-V529 WeakPolarHBondContact O-CG2 3.48Å; L525-V529 PolarHBondContact O-N 3.34Å; V529-A531 PolarHBondContact O-N 3.06Å; V529-I532 PolarHBondContact O-N 3.45Å; V529-F533 VanDerWaalsContact O-CB 3.27Å; V529-F533 WeakPolarHBondContact O-CB 3.39Å; V529-F533 PolarHBondContact O-N 3.25Å; V529-I619 HydrophobicContact CG1-CD1 4.33Å; V529-I619 HydrophobicContact CG1-CG2 3.94Å; V529-L622 HydrophobicContact CG1-CB 4.22Å; V529-L622 HydrophobicContact CG1-CD1 4.36Å; V529-L622 HydrophobicContact CG2-CB 4.23Å; V529-L622 HydrophobicContact CG2-CD1 3.94Å; V529-L623 HydrophobicContact CB-CD2 4.19Å; V529-L623 HydrophobicContact CG1-CD2 3.83Å; V529-L623 HydrophobicContact CG1-CG 4.25Å
530	K	97	Very high	96.1	Very high	60 Å²	60	38.4 Å²	38.4	26%	0.261	24%	0.237	S	C	.	.	H	α-helix	trans	-58.4	-48.7	175.3	177.9	177.6	178.6	-169.4	0	110.8	A526 A527 N528 I532 F533 T534 L623 S633	A526-K530 VanDerWaalsContact O-CB 3.31Å; A526-K530 WeakPolarHBondContact O-CB 3.35Å; A526-K530 PolarHBondContact O-N 3.47Å; A527-K530 PolarHBondContact O-N 3.34Å; N528-K530 VanDerWaalsContact C-N 3.34Å; N528-K530 PolarHBondContact O-N 3.47Å; K530-I532 PolarHBondContact O-N 3.43Å; K530-F533 PolarHBondContact O-N 3.03Å; K530-T534 WeakPolarHBondContact O-CB 3.39Å; K530-T534 PolarHBondContact O-N 3.09Å; K530-T534 PolarHBondContact O-OG1 2.63Å; K530-L623 HydrophobicContact CB-CD2 4.43Å; K530-S633 WeakPolarHBondContact CG-OG 3.36Å
531	A	97	Very high	96.6	Very high	28 Å²	28	33.6 Å²	33.6	23%	0.231	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-42.2	-179	0	0	0	0	0	113	A527 N528 V529 T534 C535	A527-A531 PolarHBondContact O-N 2.9Å; N528-A531 PolarHBondContact O-N 3.46Å; V529-A531 PolarHBondContact O-N 3.06Å; A531-T534 PolarHBondContact O-N 3.46Å; A531-C535 PolarHBondContact O-N 2.91Å
532	I	98.1	Very high	96.8	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-43.5	175.4	-71.4	166.6	0	0	0	110.6	E452 L456 N508 A511 I512 C515 N528 V529 K530 C535 L536	E452-I532 HydrophobicContact CG-CD1 3.88Å; E452-I532 HydrophobicContact CG-CG1 4.11Å; L456-I532 HydrophobicContact CD1-CG2 4Å; N508-I532 WeakPolarHBondContact ND2-CG2 3.45Å; N508-I532 PolarHBondContact ND2-O 3.06Å; A511-I532 HydrophobicContact CB-CG2 3.88Å; I512-I532 HydrophobicContact CD1-CB 4.05Å; I512-I532 HydrophobicContact CD1-CD1 4.47Å; I512-I532 HydrophobicContact CD1-CG2 3.65Å; I512-I532 HydrophobicContact CG1-CG2 4.11Å; C515-I532 HydrophobicContact CB-CD1 3.6Å; N528-I532 WeakPolarHBondContact O-CB 3.37Å; N528-I532 VanDerWaalsContact O-CG1 3.32Å; N528-I532 WeakPolarHBondContact O-CG1 3.4Å; N528-I532 PolarHBondContact O-N 3.48Å; V529-I532 PolarHBondContact O-N 3.45Å; K530-I532 PolarHBondContact O-N 3.43Å; I532-C535 WeakPolarHBondContact O-CB 3.42Å; I532-C535 PolarHBondContact O-N 2.71Å; I532-L536 PolarHBondContact O-N 3.45Å
533	F	98.2	Very high	96.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66	-39.2	177.6	-174.2	-114.5	0	0	0	112.2	V529 K530 C535 L536 L537 V611 Y614 F615 I619 M637	V529-F533 VanDerWaalsContact O-CB 3.27Å; V529-F533 WeakPolarHBondContact O-CB 3.39Å; V529-F533 PolarHBondContact O-N 3.25Å; K530-F533 PolarHBondContact O-N 3.03Å; F533-C535 VanDerWaalsContact C-N 3.26Å; F533-C535 PolarHBondContact O-N 3.02Å; F533-L536 HydrophobicContact CD2-CD2 4.12Å; F533-L536 HydrophobicContact CE2-CD2 3.97Å; F533-L536 WeakPolarHBondContact O-CB 3.16Å; F533-L536 PolarHBondContact O-N 3.38Å; F533-L537 HydrophobicContact CD1-CD1 3.83Å; F533-L537 HydrophobicContact CD1-CG 4.1Å; F533-L537 HydrophobicContact CE1-CD1 3.63Å; F533-L537 HydrophobicContact CE1-CD2 3.86Å; F533-L537 HydrophobicContact CE1-CG 3.8Å; F533-L537 HydrophobicContact CZ-CD1 4.41Å; F533-L537 HydrophobicContact CZ-CD2 3.81Å; F533-L537 HydrophobicContact CZ-CG 4.1Å; F533-L537 WeakPolarHBondContact O-CG 3.37Å; F533-L537 PolarHBondContact O-N 2.88Å; F533-V611 HydrophobicContact CE2-CG1 4.34Å; F533-V611 HydrophobicContact CZ-CG1 4.12Å; F533-Y614 HydrophobicContact CD2-CD1 4.46Å; F533-Y614 HydrophobicContact CD2-CE1 4.14Å; F533-Y614 HydrophobicContact CE2-CD1 4.05Å; F533-Y614 HydrophobicContact CE2-CE1 4.2Å; F533-F615 HydrophobicContact CD1-CD2 4.1Å; F533-F615 HydrophobicContact CD1-CE2 4.44Å; F533-F615 AromaticContact CE1-CD2 3.46Å; F533-F615 HydrophobicContact CE1-CD2 3.46Å; F533-F615 VanDerWaalsContact CE1-CD2 3.46Å; F533-F615 HydrophobicContact CE1-CE2 4.03Å; F533-F615 HydrophobicContact CE1-CG 4.31Å; F533-F615 HydrophobicContact CE2-CB 4.31Å; F533-F615 HydrophobicContact CE2-CD2 4.28Å; F533-F615 HydrophobicContact CZ-CB 3.83Å; F533-F615 AromaticContact CZ-CD2 3.58Å; F533-F615 HydrophobicContact CZ-CD2 3.58Å; F533-F615 HydrophobicContact CZ-CG 4.08Å; F533-I619 HydrophobicContact CB-CG2 4.49Å; F533-I619 HydrophobicContact CD1-CG2 4.5Å; F533-I619 HydrophobicContact CD2-CD1 4.17Å; F533-I619 HydrophobicContact CD2-CG1 3.77Å; F533-I619 HydrophobicContact CD2-CG2 4.49Å; F533-I619 HydrophobicContact CE2-CG1 4.08Å; F533-I619 HydrophobicContact CG-CG1 4.34Å; F533-I619 HydrophobicContact CG-CG2 4.24Å; F533-M637 HydrophobicContact CE1-CE 3.65Å; F533-M637 HydrophobicContact CZ-CE 3.54Å
534	T	97.2	Very high	97	Very high	45 Å²	45	23.4 Å²	23.4	28%	0.276	14%	0.141	S	C	.	.	H	α-helix	trans	-60	-34.9	173.6	-62.3	0	0	0	0	112.1	K530 A531 L537 D538	K530-T534 WeakPolarHBondContact O-CB 3.39Å; K530-T534 PolarHBondContact O-N 3.09Å; K530-T534 PolarHBondContact O-OG1 2.63Å; A531-T534 PolarHBondContact O-N 3.46Å; T534-L537 PolarHBondContact O-N 2.75Å; T534-D538 PolarHBondContact O-N 3.35Å
535	C	97.8	Very high	97.1	Very high	22 Å²	22	21.5 Å²	21.5	15%	0.149	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-42.3	172.4	-72.6	0	0	0	0	112.3	L456 A531 I532 F533 D538 Q539	L456-C535 HydrophobicContact CD1-CB 4.17Å; A531-C535 PolarHBondContact O-N 2.91Å; I532-C535 WeakPolarHBondContact O-CB 3.42Å; I532-C535 PolarHBondContact O-N 2.71Å; F533-C535 VanDerWaalsContact C-N 3.26Å; F533-C535 PolarHBondContact O-N 3.02Å; C535-D538 PolarHBondContact O-N 3.01Å; C535-Q539 WeakPolarHBondContact O-CB 3.46Å; C535-Q539 WeakPolarHBondContact O-CG 3.43Å; C535-Q539 PolarHBondContact O-N 3Å
536	L	98.3	Very high	97	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.2	-43.8	174.2	171.5	68.1	0	0	0	111.5	F504 V505 N508 I532 F533 D538 Q539 V540 Y614	F504-L536 HydrophobicContact CB-CD1 3.63Å; V505-L536 HydrophobicContact CG2-CD1 4.19Å; V505-L536 HydrophobicContact CG2-CD2 4.07Å; N508-L536 HydrophobicContact CB-CB 4.26Å; N508-L536 HydrophobicContact CB-CD2 3.99Å; N508-L536 HydrophobicContact CB-CG 4.49Å; N508-L536 WeakPolarHBondContact ND2-CB 3.49Å; I532-L536 PolarHBondContact O-N 3.45Å; F533-L536 HydrophobicContact CD2-CD2 4.12Å; F533-L536 HydrophobicContact CE2-CD2 3.97Å; F533-L536 WeakPolarHBondContact O-CB 3.16Å; F533-L536 PolarHBondContact O-N 3.38Å; L536-D538 VanDerWaalsContact C-N 3.34Å; L536-D538 PolarHBondContact O-N 3.37Å; L536-Q539 PolarHBondContact O-N 2.99Å; L536-V540 HydrophobicContact CD1-CG2 3.77Å; L536-V540 HydrophobicContact CG-CG2 4.31Å; L536-V540 WeakPolarHBondContact O-CB 3.49Å; L536-V540 WeakPolarHBondContact O-CG2 3.5Å; L536-V540 PolarHBondContact O-N 3.49Å; L536-Y614 HydrophobicContact CD2-CD1 3.75Å; L536-Y614 HydrophobicContact CD2-CE1 3.74Å
537	L	98	Very high	96.9	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-44.1	178.3	-68.4	176.6	0	0	0	112	F533 T534 S541 V611 E636 M637 A640	F533-L537 HydrophobicContact CD1-CD1 3.83Å; F533-L537 HydrophobicContact CD1-CG 4.1Å; F533-L537 HydrophobicContact CE1-CD1 3.63Å; F533-L537 HydrophobicContact CE1-CD2 3.86Å; F533-L537 HydrophobicContact CE1-CG 3.8Å; F533-L537 HydrophobicContact CZ-CD1 4.41Å; F533-L537 HydrophobicContact CZ-CD2 3.81Å; F533-L537 HydrophobicContact CZ-CG 4.1Å; F533-L537 WeakPolarHBondContact O-CG 3.37Å; F533-L537 PolarHBondContact O-N 2.88Å; T534-L537 PolarHBondContact O-N 2.75Å; L537-S541 WeakPolarHBondContact O-CB 3.48Å; L537-S541 PolarHBondContact O-N 3.34Å; L537-V611 HydrophobicContact CD2-CG1 3.88Å; L537-E636 HydrophobicContact CD1-CB 4.24Å; L537-M637 HydrophobicContact CD1-CB 4.03Å; L537-M637 HydrophobicContact CD2-CB 4.05Å; L537-M637 HydrophobicContact CD2-CG 3.8Å; L537-A640 HydrophobicContact CB-CB 3.93Å
538	D	96.9	Very high	96.9	Very high	91 Å²	91	21.7 Å²	21.7	49%	0.487	12%	0.12	S	C	.	.	H	α-helix	trans	-63.7	-47.6	176.9	-173.7	56.3	0	0	0	111.5	T534 C535 L536 V540 S541 V542	T534-D538 PolarHBondContact O-N 3.35Å; C535-D538 PolarHBondContact O-N 3.01Å; L536-D538 VanDerWaalsContact C-N 3.34Å; L536-D538 PolarHBondContact O-N 3.37Å; D538-V540 PolarHBondContact O-N 3.18Å; D538-S541 PolarHBondContact O-N 3.32Å; D538-V542 WeakPolarHBondContact O-CB 3.19Å; D538-V542 VanDerWaalsContact O-CG2 3.3Å; D538-V542 WeakPolarHBondContact O-CG2 3.42Å; D538-V542 PolarHBondContact O-N 3.37Å
539	Q	97.5	Very high	96.9	Very high	9 Å²	9	24 Å²	24	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-58.7	-48.5	178	-71.2	169.5	-5.7	0	0	112.2	L456 Y460 F504 C535 L536 Y543	L456-Q539 PolarHBondContact O-NE2 3.01Å; Y460-Q539 HydrophobicContact CD1-CG 4.27Å; Y460-Q539 HydrophobicContact CD2-CB 3.72Å; Y460-Q539 HydrophobicContact CD2-CG 3.66Å; Y460-Q539 HydrophobicContact CE2-CB 3.89Å; Y460-Q539 HydrophobicContact CE2-CG 4.19Å; Y460-Q539 HydrophobicContact CG-CB 4.29Å; Y460-Q539 HydrophobicContact CG-CG 3.7Å; F504-Q539 HydrophobicContact CD2-CB 4.48Å; C535-Q539 WeakPolarHBondContact O-CB 3.46Å; C535-Q539 WeakPolarHBondContact O-CG 3.43Å; C535-Q539 PolarHBondContact O-N 3Å; L536-Q539 PolarHBondContact O-N 2.99Å; Q539-Y543 WeakPolarHBondContact O-CB 3.45Å; Q539-Y543 PolarHBondContact O-N 2.81Å
540	V	97.8	Very high	96.6	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-45.3	179	173.2	0	0	0	0	110.5	V501 F504 L536 D538 V542 Y543 I544 V611	V501-V540 HydrophobicContact CG1-CG1 4.43Å; V501-V540 HydrophobicContact CG1-CG2 4.04Å; F504-V540 HydrophobicContact CD2-CG2 4.06Å; L536-V540 HydrophobicContact CD1-CG2 3.77Å; L536-V540 HydrophobicContact CG-CG2 4.31Å; L536-V540 WeakPolarHBondContact O-CB 3.49Å; L536-V540 WeakPolarHBondContact O-CG2 3.5Å; L536-V540 PolarHBondContact O-N 3.49Å; D538-V540 PolarHBondContact O-N 3.18Å; V540-V542 PolarHBondContact O-N 3.36Å; V540-Y543 PolarHBondContact O-N 3.37Å; V540-I544 HydrophobicContact CG1-CD1 4.15Å; V540-I544 HydrophobicContact CG1-CG2 4.24Å; V540-I544 VanDerWaalsContact O-CG1 3.23Å; V540-I544 WeakPolarHBondContact O-CG1 3.48Å; V540-I544 WeakPolarHBondContact O-CG2 3.17Å; V540-I544 PolarHBondContact O-N 3.19Å; V540-V611 HydrophobicContact CB-CG2 4.44Å; V540-V611 HydrophobicContact CG1-CG2 4.09Å; V540-V611 HydrophobicContact CG2-CG2 3.97Å
541	S	97.2	Very high	96.5	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	14%	0.136	C	C	.	.	H	α-helix	trans	-57.6	-49.6	178.8	177.5	0	0	0	0	111.8	L537 D538 T545 A640	L537-S541 WeakPolarHBondContact O-CB 3.48Å; L537-S541 PolarHBondContact O-N 3.34Å; D538-S541 PolarHBondContact O-N 3.32Å; S541-T545 WeakPolarHBondContact O-CB 3.33Å; S541-T545 PolarHBondContact O-N 2.99Å; S541-T545 PolarHBondContact O-OG1 3.32Å; S541-A640 WeakPolarHBondContact CB-O 3.08Å; S541-A640 PolarHBondContact OG-O 2.79Å
542	V	96	Very high	96.4	Very high	45 Å²	45	27 Å²	27	27%	0.273	14%	0.135	S	C	.	.	H	α-helix	trans	-62.1	-51.1	177.8	173	0	0	0	0	110.2	Y460 D538 V540 I544 T545 E546	Y460-V542 WeakPolarHBondContact OH-CG1 3.44Å; D538-V542 WeakPolarHBondContact O-CB 3.19Å; D538-V542 VanDerWaalsContact O-CG2 3.3Å; D538-V542 WeakPolarHBondContact O-CG2 3.42Å; D538-V542 PolarHBondContact O-N 3.37Å; V540-V542 PolarHBondContact O-N 3.36Å; V542-I544 PolarHBondContact O-N 2.81Å; V542-T545 PolarHBondContact O-N 3.44Å; V542-E546 HydrophobicContact CG1-CG 4.28Å; V542-E546 WeakPolarHBondContact O-CB 3.39Å; V542-E546 WeakPolarHBondContact O-CG 3.33Å; V542-E546 PolarHBondContact O-N 3.24Å
543	Y	96.4	Very high	96.2	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.016	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-48.1	-176.5	177.3	-109.8	0	0	0	113.2	M464 L467 I496 S497 F500 V501 F504 Q539 V540 G547	M464-Y543 HydrophobicContact CE-CD2 3.99Å; M464-Y543 HydrophobicContact CE-CE2 4.44Å; M464-Y543 HydrophobicContact SD-CD2 3.79Å; M464-Y543 HydrophobicContact SD-CE2 4.29Å; L467-Y543 HydrophobicContact CD1-CE2 4.21Å; I496-Y543 HydrophobicContact CG2-CE1 3.96Å; S497-Y543 PolarHBondContact N-OH 2.96Å; F500-Y543 HydrophobicContact CB-CE1 4.33Å; F500-Y543 HydrophobicContact CD2-CE2 4.39Å; F500-Y543 AromaticContact CD2-CZ 3.85Å; F500-Y543 VanDerWaalsContact CD2-OH 3.3Å; F500-Y543 WeakPolarHBondContact CD2-OH 3.32Å; V501-Y543 HydrophobicContact CG2-CD1 3.97Å; V501-Y543 HydrophobicContact CG2-CE1 4.18Å; F504-Y543 HydrophobicContact CE2-CD1 4.15Å; F504-Y543 HydrophobicContact CE2-CG 4.02Å; F504-Y543 HydrophobicContact CZ-CG 4.45Å; Q539-Y543 WeakPolarHBondContact O-CB 3.45Å; Q539-Y543 PolarHBondContact O-N 2.81Å; V540-Y543 PolarHBondContact O-N 3.37Å; Y543-G547 PolarHBondContact O-N 2.92Å
544	I	96.5	Very high	95.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-73.9	-34.7	-179.5	70.9	-169.8	0	0	0	112	I496 V540 V542 G547 L548 V608 L641 A644	I496-I544 HydrophobicContact CD1-CB 4.46Å; I496-I544 HydrophobicContact CG2-CG2 4.35Å; V540-I544 HydrophobicContact CG1-CD1 4.15Å; V540-I544 HydrophobicContact CG1-CG2 4.24Å; V540-I544 VanDerWaalsContact O-CG1 3.23Å; V540-I544 WeakPolarHBondContact O-CG1 3.48Å; V540-I544 WeakPolarHBondContact O-CG2 3.17Å; V540-I544 PolarHBondContact O-N 3.19Å; V542-I544 PolarHBondContact O-N 2.81Å; I544-G547 PolarHBondContact O-N 2.93Å; I544-L548 WeakPolarHBondContact O-CG 3.34Å; I544-L548 PolarHBondContact O-N 3.44Å; I544-V608 HydrophobicContact CD1-CG2 4.14Å; I544-L641 HydrophobicContact CD1-CD2 4.19Å; I544-A644 HydrophobicContact CD1-CB 3.61Å; I544-A644 HydrophobicContact CG1-CB 3.64Å
545	T	96.5	Very high	95.7	Very high	18 Å²	18	30.2 Å²	30.2	11%	0.11	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-49.4	177.6	-58.3	0	0	0	0	110.3	S541 V542 G547 L548 E549 A644 A647	S541-T545 WeakPolarHBondContact O-CB 3.33Å; S541-T545 PolarHBondContact O-N 2.99Å; S541-T545 PolarHBondContact O-OG1 3.32Å; V542-T545 PolarHBondContact O-N 3.44Å; T545-G547 VanDerWaalsContact C-N 3.27Å; T545-G547 PolarHBondContact O-N 3.46Å; T545-L548 PolarHBondContact O-N 3.06Å; T545-E549 WeakPolarHBondContact O-CG 3.47Å; T545-E549 PolarHBondContact O-N 3.37Å; T545-A644 PolarHBondContact OG1-N 3.33Å; T545-A647 HydrophobicContact CG2-CB 4.19Å
546	E	94.2	Very high	95.6	Very high	90 Å²	90	31.4 Å²	31.4	42%	0.421	16%	0.162	S	C	.	.	H	α-helix	trans	-62.7	-34.3	175.9	-71.2	-177.1	175.9	0	0	112	V542 R550	V542-E546 HydrophobicContact CG1-CG 4.28Å; V542-E546 WeakPolarHBondContact O-CB 3.39Å; V542-E546 WeakPolarHBondContact O-CG 3.33Å; V542-E546 PolarHBondContact O-N 3.24Å; E546-R550 WeakPolarHBondContact O-CB 3.08Å; E546-R550 VanDerWaalsContact O-CG 3.29Å; E546-R550 WeakPolarHBondContact O-CG 3.3Å; E546-R550 PolarHBondContact O-N 3.27Å; E546-R550 PolarHBondContact O-NE 2.98Å
547	G	94.1	Very high	95.2	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-64.6	-43.3	173.2	0	0	0	0	0	113.4	Y543 I544 T545 A551	Y543-G547 PolarHBondContact O-N 2.92Å; I544-G547 PolarHBondContact O-N 2.93Å; T545-G547 VanDerWaalsContact C-N 3.27Å; T545-G547 PolarHBondContact O-N 3.46Å; G547-A551 PolarHBondContact O-N 2.9Å; G547-A551 VanDerWaalsContact O-N 3.09Å
548	L	96.4	Very high	94.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.1	-40.8	175.5	-74.6	169.5	0	0	0	111.8	I496 I544 T545 A551 R552 F597 A600 V601 C604 A644 A647 A648	I496-L548 HydrophobicContact CD1-CD2 4.41Å; I496-L548 HydrophobicContact CD1-CG 4.08Å; I544-L548 WeakPolarHBondContact O-CG 3.34Å; I544-L548 PolarHBondContact O-N 3.44Å; T545-L548 PolarHBondContact O-N 3.06Å; L548-A551 PolarHBondContact O-N 3.5Å; L548-R552 WeakPolarHBondContact O-CB 3.04Å; L548-R552 PolarHBondContact O-N 3.45Å; L548-F597 HydrophobicContact CD2-CE2 4.28Å; L548-F597 HydrophobicContact CD2-CZ 4.26Å; L548-A600 HydrophobicContact CD2-CB 4.16Å; L548-V601 HydrophobicContact CD2-CG2 4.04Å; L548-C604 HydrophobicContact CD1-CB 4.38Å; L548-C604 HydrophobicContact CD2-CB 4.46Å; L548-A644 HydrophobicContact CD1-CB 4.42Å; L548-A644 WeakPolarHBondContact CD1-O 3.4Å; L548-A647 HydrophobicContact CB-CB 4.12Å; L548-A647 HydrophobicContact CD1-CB 4.25Å; L548-A648 HydrophobicContact CD1-CB 4.03Å
549	E	95.2	Very high	94.7	Very high	79 Å²	79	34.3 Å²	34.3	37%	0.369	18%	0.177	S	C	.	.	H	α-helix	trans	-64	-44.9	177.1	-72.7	-174.8	152.5	0	0	111.6	T545 A551 R552 D553 A647	T545-E549 WeakPolarHBondContact O-CG 3.47Å; T545-E549 PolarHBondContact O-N 3.37Å; E549-A551 PolarHBondContact O-N 3.46Å; E549-R552 CarbonylContact O-C 3.5Å; E549-R552 WeakPolarHBondContact O-CA 3.48Å; E549-R552 WeakPolarHBondContact O-CB 3.42Å; E549-R552 PolarHBondContact O-N 2.87Å; E549-R552 VanDerWaalsContact O-N 3.09Å; E549-D553 VanDerWaalsContact O-CG 3.25Å; E549-D553 PolarHBondContact O-N 2.89Å; E549-A647 HydrophobicContact CG-CB 4.42Å
550	R	92.7	Very high	94.3	Very high	90 Å²	90	36.6 Å²	36.6	34%	0.34	20%	0.198	S	C	.	.	H	α-helix	trans	-58.7	-44.4	173.2	-76.5	-176.6	-68.2	156.6	-0.7	112.6	Q494 E546 R552 D553 S554	Q494-R550 PolarHBondContact O-NH1 3.4Å; Q494-R550 VanDerWaalsContact O-NH1 3.16Å; E546-R550 WeakPolarHBondContact O-CB 3.08Å; E546-R550 VanDerWaalsContact O-CG 3.29Å; E546-R550 WeakPolarHBondContact O-CG 3.3Å; E546-R550 PolarHBondContact O-N 3.27Å; E546-R550 PolarHBondContact O-NE 2.98Å; R550-R552 VanDerWaalsContact C-N 3.27Å; R550-R552 PolarHBondContact O-N 3.24Å; R550-D553 PolarHBondContact O-N 3.26Å; R550-S554 PolarHBondContact O-N 3.29Å
551	A	94.2	Very high	93.8	Very high	9 Å²	9	40.1 Å²	40.1	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-63.9	-34.3	176.3	0	0	0	0	0	112.1	G547 L548 E549 F597 A600	G547-A551 PolarHBondContact O-N 2.9Å; G547-A551 VanDerWaalsContact O-N 3.09Å; L548-A551 PolarHBondContact O-N 3.5Å; E549-A551 PolarHBondContact O-N 3.46Å; A551-F597 HydrophobicContact CB-CD2 3.83Å; A551-A600 HydrophobicContact CB-CB 3.82Å
552	R	95.4	Very high	93.2	Very high	52 Å²	52	42 Å²	42	20%	0.196	22%	0.223	C	C	.	.	H	α-helix	trans	-71.3	-34.9	175	-171.6	-167.3	68.7	-165.2	-5.2	112.3	L548 E549 R550 S554 L555 S556 F597	L548-R552 WeakPolarHBondContact O-CB 3.04Å; L548-R552 PolarHBondContact O-N 3.45Å; E549-R552 CarbonylContact O-C 3.5Å; E549-R552 WeakPolarHBondContact O-CA 3.48Å; E549-R552 WeakPolarHBondContact O-CB 3.42Å; E549-R552 PolarHBondContact O-N 2.87Å; E549-R552 VanDerWaalsContact O-N 3.09Å; R550-R552 VanDerWaalsContact C-N 3.27Å; R550-R552 PolarHBondContact O-N 3.24Å; R552-S554 PolarHBondContact O-N 3.17Å; R552-L555 WeakPolarHBondContact O-CA 3.39Å; R552-L555 VanDerWaalsContact O-CB 3.28Å; R552-L555 WeakPolarHBondContact O-CB 3.41Å; R552-L555 PolarHBondContact O-N 3.13Å; R552-S556 PolarHBondContact O-N 3.3Å; R552-S556 PolarHBondContact O-OG 3.41Å; R552-F597 HydrophobicContact CB-CD2 4.35Å; R552-F597 HydrophobicContact CB-CE2 4.1Å
553	D	93.9	Very high	92.6	Very high	73 Å²	73	46.4 Å²	46.4	39%	0.39	24%	0.241	S	C	.	.	H	α-helix	trans	-61.3	-36.3	177	-67.2	-18.3	0	0	0	110.9	E549 R550 L555 S556 E557	E549-D553 VanDerWaalsContact O-CG 3.25Å; E549-D553 PolarHBondContact O-N 2.89Å; R550-D553 PolarHBondContact O-N 3.26Å; D553-L555 VanDerWaalsContact C-N 3.28Å; D553-L555 PolarHBondContact O-N 3.24Å; D553-S556 CarbonylContact O-C 3.55Å; D553-S556 WeakPolarHBondContact O-CA 3.2Å; D553-S556 WeakPolarHBondContact O-CB 3.35Å; D553-S556 PolarHBondContact O-N 3Å; D553-E557 WeakPolarHBondContact O-CG 3.37Å; D553-E557 PolarHBondContact O-N 2.93Å
554	S	91.8	Very high	91.7	Very high	43 Å²	43	55.7 Å²	55.7	30%	0.301	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-30.3	170.8	-52.5	0	0	0	0	113.8	R550 R552 A558 S593	R550-S554 PolarHBondContact O-N 3.29Å; R552-S554 PolarHBondContact O-N 3.17Å; S554-A558 WeakPolarHBondContact O-CB 3.46Å; S554-A558 PolarHBondContact O-N 3.35Å; S554-S593 VanDerWaalsContact C-OG 3.29Å; S554-S593 WeakPolarHBondContact O-CB 3.15Å; S554-S593 PolarHBondContact O-OG 2.9Å
555	L	93.5	Very high	90.3	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-70.6	-40.2	171.1	-68.5	165.2	0	0	0	111	R552 D553 A558 A559 F597 Q654 C655 T658	R552-L555 WeakPolarHBondContact O-CA 3.39Å; R552-L555 VanDerWaalsContact O-CB 3.28Å; R552-L555 WeakPolarHBondContact O-CB 3.41Å; R552-L555 PolarHBondContact O-N 3.13Å; D553-L555 VanDerWaalsContact C-N 3.28Å; D553-L555 PolarHBondContact O-N 3.24Å; L555-A558 PolarHBondContact O-N 3.35Å; L555-A559 WeakPolarHBondContact O-CB 3.46Å; L555-A559 PolarHBondContact O-N 3.01Å; L555-F597 HydrophobicContact CD1-CB 3.97Å; L555-F597 HydrophobicContact CD1-CD2 4.01Å; L555-F597 HydrophobicContact CD1-CG 3.89Å; L555-Q654 HydrophobicContact CB-CG 4.06Å; L555-Q654 HydrophobicContact CD1-CB 4.37Å; L555-Q654 HydrophobicContact CD1-CG 4.45Å; L555-C655 VanDerWaalsContact CD1-SG 3.56Å; L555-T658 HydrophobicContact CD2-CG2 4.48Å
556	S	94.4	Very high	88.7	Confident	47 Å²	47	64.2 Å²	64.2	33%	0.329	32%	0.321	S	S	.	.	H	α-helix	trans	-65.5	-41.6	178.4	-57	0	0	0	0	112	R552 D553 A559 A560 Q654	R552-S556 PolarHBondContact O-N 3.3Å; R552-S556 PolarHBondContact O-OG 3.41Å; D553-S556 CarbonylContact O-C 3.55Å; D553-S556 WeakPolarHBondContact O-CA 3.2Å; D553-S556 WeakPolarHBondContact O-CB 3.35Å; D553-S556 PolarHBondContact O-N 3Å; S556-A559 PolarHBondContact O-N 2.7Å; S556-A560 PolarHBondContact O-N 2.96Å; S556-Q654 PolarHBondContact OG-NE2 3.49Å
557	E	91.5	Very high	86.5	Confident	131 Å²	131	68 Å²	68	61%	0.612	34%	0.342	S	S	*	.	H	α-helix	trans	-62.3	-43.9	173.3	-71.8	-179.8	178.3	0	0	111.8	D553 A559 A560 L561	D553-E557 WeakPolarHBondContact O-CG 3.37Å; D553-E557 PolarHBondContact O-N 2.93Å; E557-A559 VanDerWaalsContact C-N 3.32Å; E557-A559 PolarHBondContact O-N 2.95Å; E557-A560 PolarHBondContact O-N 3.47Å; E557-L561 WeakPolarHBondContact O-CG 3.28Å; E557-L561 PolarHBondContact O-N 2.99Å
558	A	91	Very high	84.4	Confident	2 Å²	2	70.3 Å²	70.3	2%	0.017	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-37.7	175.7	0	0	0	0	0	112.3	S554 L555 R562 A589	S554-A558 WeakPolarHBondContact O-CB 3.46Å; S554-A558 PolarHBondContact O-N 3.35Å; L555-A558 PolarHBondContact O-N 3.35Å; A558-R562 PolarHBondContact O-N 2.86Å; A558-R562 VanDerWaalsContact O-N 3.12Å; A558-A589 HydrophobicContact CB-CB 4.33Å
559	A	91.8	Very high	82.1	Confident	24 Å²	24	77.3 Å²	77.3	20%	0.198	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-45.3	174.2	0	0	0	0	0	111.9	L555 S556 E557 L561 R562 E563	L555-A559 WeakPolarHBondContact O-CB 3.46Å; L555-A559 PolarHBondContact O-N 3.01Å; S556-A559 PolarHBondContact O-N 2.7Å; E557-A559 VanDerWaalsContact C-N 3.32Å; E557-A559 PolarHBondContact O-N 2.95Å; A559-L561 VanDerWaalsContact C-N 3.33Å; A559-L561 PolarHBondContact O-N 3.26Å; A559-R562 WeakPolarHBondContact O-CB 3.46Å; A559-R562 PolarHBondContact O-N 3.43Å; A559-R562 VanDerWaalsContact O-N 3.1Å; A559-E563 PolarHBondContact O-N 3.43Å
560	A	90.3	Very high	79.7	Confident	57 Å²	57	78.1 Å²	78.1	47%	0.471	42%	0.424	S	S	.	.	H	α-helix	trans	-62.7	-38.5	177.1	0	0	0	0	0	112.4	S556 E557 R562 E563 R564	S556-A560 PolarHBondContact O-N 2.96Å; E557-A560 PolarHBondContact O-N 3.47Å; A560-R562 VanDerWaalsContact C-N 3.33Å; A560-R562 PolarHBondContact O-N 2.65Å; A560-E563 PolarHBondContact O-N 2.89Å; A560-R564 PolarHBondContact O-N 3.5Å
561	L	85.9	Confident	77.8	Confident	76 Å²	76	78.9 Å²	78.9	40%	0.398	44%	0.439	S	S	.	.	H	α-helix	trans	-59.3	-44.9	172	-74.5	173.2	0	0	0	111	E557 A559 R564 F565 A586	E557-L561 WeakPolarHBondContact O-CG 3.28Å; E557-L561 PolarHBondContact O-N 2.99Å; A559-L561 VanDerWaalsContact C-N 3.33Å; A559-L561 PolarHBondContact O-N 3.26Å; L561-R564 PolarHBondContact O-N 3.48Å; L561-F565 HydrophobicContact CB-CE2 4.45Å; L561-F565 WeakPolarHBondContact O-CD2 3.5Å; L561-F565 WeakPolarHBondContact O-CE2 3.41Å; L561-A586 HydrophobicContact CB-CB 4.38Å
562	R	86.1	Confident	76.1	Confident	39 Å²	39	82.5 Å²	82.5	15%	0.147	46%	0.464	C	S	.	.	H	α-helix	trans	-60.6	-48	178	-173	-174.8	-65.7	119.7	-4	112.3	A558 A559 A560 R564 F565 A586 T658	A558-R562 PolarHBondContact O-N 2.86Å; A558-R562 VanDerWaalsContact O-N 3.12Å; A559-R562 WeakPolarHBondContact O-CB 3.46Å; A559-R562 PolarHBondContact O-N 3.43Å; A559-R562 VanDerWaalsContact O-N 3.1Å; A560-R562 VanDerWaalsContact C-N 3.33Å; A560-R562 PolarHBondContact O-N 2.65Å; R562-R564 VanDerWaalsContact C-N 3.32Å; R562-R564 PolarHBondContact O-N 3.45Å; R562-F565 PolarHBondContact O-N 3.37Å; R562-A586 HydrophobicContact CB-CB 4.47Å; R562-T658 PolarHBondContact NH2-O 3.15Å
563	E	82.9	Confident	75	Confident	139 Å²	139	91 Å²	91	65%	0.65	50%	0.496	S	S	*	.	H	α-helix	trans	-61.5	-39	-178.1	-72.3	-178.4	177.4	0	0	112.8	A559 A560 F565 V566	A559-E563 PolarHBondContact O-N 3.43Å; A560-E563 PolarHBondContact O-N 2.89Å; E563-F565 PolarHBondContact O-N 2.98Å; E563-F565 VanDerWaalsContact O-N 3.11Å; E563-V566 PolarHBondContact O-N 3.04Å
564	R	76.9	Confident	73.9	Confident	199 Å²	199	98.1 Å²	98.1	75%	0.751	52%	0.517	S	S	*	.	H	α-helix	trans	-58.1	-27.1	178.7	-170.5	177	180	-179.2	1.1	113.1	A560 L561 R562	A560-R564 PolarHBondContact O-N 3.5Å; L561-R564 PolarHBondContact O-N 3.48Å; R562-R564 VanDerWaalsContact C-N 3.32Å; R562-R564 PolarHBondContact O-N 3.45Å
565	F	68.5	Low	73	Confident	87 Å²	87	99.5 Å²	99.5	38%	0.382	52%	0.523	S	S	.	.	H	α-helix	trans	-92.9	-10.5	-176.5	-59.3	-55.9	0	0	0	114.7	L561 R562 E563 A582 A586	L561-F565 HydrophobicContact CB-CE2 4.45Å; L561-F565 WeakPolarHBondContact O-CD2 3.5Å; L561-F565 WeakPolarHBondContact O-CE2 3.41Å; R562-F565 PolarHBondContact O-N 3.37Å; E563-F565 PolarHBondContact O-N 2.98Å; E563-F565 VanDerWaalsContact O-N 3.11Å; F565-A582 HydrophobicContact CD1-CB 3.7Å; F565-A582 HydrophobicContact CD2-CB 4.19Å; F565-A582 HydrophobicContact CE1-CB 3.56Å; F565-A582 HydrophobicContact CE2-CB 4.07Å; F565-A582 HydrophobicContact CG-CB 4.04Å; F565-A582 HydrophobicContact CZ-CB 3.77Å; F565-A586 HydrophobicContact CD2-CB 4.21Å; F565-A586 HydrophobicContact CE2-CB 4.29Å
566	V	62.7	Low	72.1	Confident	110 Å²	110	102.3 Å²	102.3	67%	0.667	55%	0.546	S	S	*	.	H	α-helix	trans	-78.3	-26.7	178.8	178	0	0	0	0	112.4	E563 G568	E563-V566 PolarHBondContact O-N 3.04Å; V566-G568 VanDerWaalsContact C-N 3.32Å; V566-G568 PolarHBondContact O-N 3.11Å; V566-G568 VanDerWaalsContact O-N 3.08Å
567	L	48.1	Very low	71.3	Confident	168 Å²	168	103.2 Å²	103.2	88%	0.88	56%	0.557	S	S	*	*	S	Bend	trans	-80.9	24.7	-167.6	-92.4	153.3	0	0	0	117
568	G	49.9	Very low	70.7	Confident	52 Å²	52	99.9 Å²	99.9	54%	0.536	55%	0.552	S	S	.	*			trans	-145	56.7	-170.5	0	0	0	0	0	116.7	V566	V566-G568 VanDerWaalsContact C-N 3.32Å; V566-G568 PolarHBondContact O-N 3.11Å; V566-G568 VanDerWaalsContact O-N 3.08Å
569	T	47.9	Very low	70.1	Confident	146 Å²	146	101.9 Å²	101.9	90%	0.896	57%	0.568	S	S	*	*			trans	-108.3	66.7	172.8	55	0	0	0	0	112.9
570	S	44.4	Very low	69.7	Low	97 Å²	97	103.4 Å²	103.4	68%	0.678	58%	0.581	S	S	*	*	S	Bend	trans	-131.9	164.7	131.7	62.1	0	0	0	0	105.2
571	V	53.1	Low	69.4	Low	106 Å²	106	104.8 Å²	104.8	64%	0.642	59%	0.587	S	S	*	*	S	Bend	trans	106.8	124.8	170	-168.3	0	0	0	0	117.1	V575	V571-V575 HydrophobicContact CG1-CB 4.3Å; V571-V575 HydrophobicContact CG1-CG2 3.78Å
572	S	59	Low	69.3	Low	85 Å²	85	102.1 Å²	102.1	59%	0.594	58%	0.576	S	S	*	*			trans	15.4	143.5	161.5	-166	0	0	0	0	122.3	R574 V575 A576	S572-R574 VanDerWaalsContact C-N 3.27Å; S572-R574 PolarHBondContact O-N 3.29Å; S572-V575 WeakPolarHBondContact O-CB 3.46Å; S572-V575 PolarHBondContact O-N 3.13Å; S572-A576 PolarHBondContact O-N 2.96Å
573	R	70.6	Confident	69.3	Low	230 Å²	230	101.3 Å²	101.3	87%	0.868	58%	0.578	S	S	*	*	H	α-helix	trans	-49	-36.3	178.1	-166.8	-174.9	-65.2	-176.7	0.2	114.9	A577	R573-A577 PolarHBondContact O-N 3.29Å
574	R	70.5	Confident	69.5	Low	223 Å²	223	98.7 Å²	98.7	84%	0.842	57%	0.566	S	S	*	*	H	α-helix	trans	-70.1	-36.6	177.4	-73	-174.4	-171.5	164.5	2.8	112.6	S572 A577 A578	S572-R574 VanDerWaalsContact C-N 3.27Å; S572-R574 PolarHBondContact O-N 3.29Å; R574-A577 PolarHBondContact O-N 3.05Å; R574-A578 PolarHBondContact O-N 3.42Å
575	V	74.8	Confident	70	Confident	72 Å²	72	92.1 Å²	92.1	44%	0.436	55%	0.554	S	S	.	*	H	α-helix	trans	-70	-38	178	179.3	0	0	0	0	110	V571 S572 A577 A578 A579	V571-V575 HydrophobicContact CG1-CB 4.3Å; V571-V575 HydrophobicContact CG1-CG2 3.78Å; S572-V575 WeakPolarHBondContact O-CB 3.46Å; S572-V575 PolarHBondContact O-N 3.13Å; V575-A577 PolarHBondContact O-N 3.43Å; V575-A578 PolarHBondContact O-N 2.91Å; V575-A579 WeakPolarHBondContact O-CB 3.22Å; V575-A579 PolarHBondContact O-N 3.47Å
576	A	73.7	Confident	71	Confident	58 Å²	58	88.1 Å²	88.1	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-59.6	-43.2	174.2	0	0	0	0	0	113.1	S572 A579 A580	S572-A576 PolarHBondContact O-N 2.96Å; A576-A579 PolarHBondContact O-N 3.28Å; A576-A580 WeakPolarHBondContact O-CB 3.45Å; A576-A580 PolarHBondContact O-N 3.44Å
577	A	77.3	Confident	72.3	Confident	66 Å²	66	83.2 Å²	83.2	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-65.9	-40.5	176.8	0	0	0	0	0	112.4	R573 R574 V575 A580 S581	R573-A577 PolarHBondContact O-N 3.29Å; R574-A577 PolarHBondContact O-N 3.05Å; V575-A577 PolarHBondContact O-N 3.43Å; A577-A580 PolarHBondContact O-N 3.14Å; A577-S581 PolarHBondContact O-N 2.86Å
578	A	78.2	Confident	74.4	Confident	62 Å²	62	78 Å²	78	51%	0.512	49%	0.489	S	S	.	.	H	α-helix	trans	-65.5	-41.1	175.2	0	0	0	0	0	112.1	R574 V575 S581 A582	R574-A578 PolarHBondContact O-N 3.42Å; V575-A578 PolarHBondContact O-N 2.91Å; A578-S581 PolarHBondContact O-N 3.11Å; A578-A582 WeakPolarHBondContact O-CB 3.23Å; A578-A582 PolarHBondContact O-N 2.97Å
579	A	80.3	Confident	76.3	Confident	44 Å²	44	77 Å²	77	36%	0.364	48%	0.475	S	S	.	.	H	α-helix	trans	-64.1	-42.4	176	0	0	0	0	0	111.9	V575 A576 A582 A583	V575-A579 WeakPolarHBondContact O-CB 3.22Å; V575-A579 PolarHBondContact O-N 3.47Å; A576-A579 PolarHBondContact O-N 3.28Å; A579-A582 PolarHBondContact O-N 3.25Å; A579-A583 WeakPolarHBondContact O-CB 3.27Å; A579-A583 PolarHBondContact O-N 3.04Å
580	A	81.6	Confident	78.5	Confident	56 Å²	56	70 Å²	70	46%	0.463	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-47.2	174.5	0	0	0	0	0	111.6	A576 A577 A582 A583 E584	A576-A580 WeakPolarHBondContact O-CB 3.45Å; A576-A580 PolarHBondContact O-N 3.44Å; A577-A580 PolarHBondContact O-N 3.14Å; A580-A582 VanDerWaalsContact C-N 3.29Å; A580-A582 PolarHBondContact O-N 3.22Å; A580-A583 PolarHBondContact O-N 3.47Å; A580-E584 WeakPolarHBondContact O-CG 3.48Å; A580-E584 PolarHBondContact O-N 2.95Å
581	S	84.7	Confident	80.9	Confident	85 Å²	85	66.3 Å²	66.3	59%	0.594	41%	0.405	S	S	*	.	H	α-helix	trans	-61.3	-37.5	176.4	-175.1	0	0	0	0	112.7	A577 A578 A585	A577-S581 PolarHBondContact O-N 2.86Å; A578-S581 PolarHBondContact O-N 3.11Å; S581-A585 PolarHBondContact O-N 3.41Å; S581-A585 VanDerWaalsContact O-N 3.11Å
582	A	84.4	Confident	82.8	Confident	20 Å²	20	65 Å²	65	17%	0.165	40%	0.4	C	S	.	.	H	α-helix	trans	-70.5	-37.8	177.8	0	0	0	0	0	112.3	F565 A578 A579 A580 A585 A586	F565-A582 HydrophobicContact CD1-CB 3.7Å; F565-A582 HydrophobicContact CD2-CB 4.19Å; F565-A582 HydrophobicContact CE1-CB 3.56Å; F565-A582 HydrophobicContact CE2-CB 4.07Å; F565-A582 HydrophobicContact CG-CB 4.04Å; F565-A582 HydrophobicContact CZ-CB 3.77Å; A578-A582 WeakPolarHBondContact O-CB 3.23Å; A578-A582 PolarHBondContact O-N 2.97Å; A579-A582 PolarHBondContact O-N 3.25Å; A580-A582 VanDerWaalsContact C-N 3.29Å; A580-A582 PolarHBondContact O-N 3.22Å; A582-A585 PolarHBondContact O-N 3.3Å; A582-A586 PolarHBondContact O-N 3.18Å
583	A	85.4	Confident	84.5	Confident	23 Å²	23	61.6 Å²	61.6	19%	0.19	38%	0.377	C	S	.	.	H	α-helix	trans	-64	-42.1	174.5	0	0	0	0	0	112	A579 A580 A585 A586 A587	A579-A583 WeakPolarHBondContact O-CB 3.27Å; A579-A583 PolarHBondContact O-N 3.04Å; A580-A583 PolarHBondContact O-N 3.47Å; A583-A585 VanDerWaalsContact C-N 3.33Å; A583-A585 PolarHBondContact O-N 2.9Å; A583-A586 PolarHBondContact O-N 3.26Å; A583-A587 WeakPolarHBondContact O-CB 3.23Å; A583-A587 PolarHBondContact O-N 3.49Å
584	E	87.9	Confident	85.8	Confident	84 Å²	84	50.7 Å²	50.7	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-63.3	-37.9	173.5	-67.5	-59	139.3	0	0	112	A580 A587 A588 R665	A580-E584 WeakPolarHBondContact O-CG 3.48Å; A580-E584 PolarHBondContact O-N 2.95Å; E584-A587 PolarHBondContact O-N 3.13Å; E584-A588 WeakPolarHBondContact O-CB 3.3Å; E584-A588 PolarHBondContact O-N 3.4Å; E584-R665 IonicContact OE1-CZ 2.79Å; E584-R665 VanDerWaalsContact OE1-CZ 3.3Å; E584-R665 IonicContact OE1-NH1 2.78Å; E584-R665 PolarHBondContact OE1-NH1 3.38Å; E584-R665 IonicContact OE1-NH2 3.64Å; E584-R665 PolarHBondContact OE1-NH2 2.78Å; E584-R665 IonicContact OE2-NH2 2.85Å
585	A	87.6	Confident	86.9	Confident	61 Å²	61	43.5 Å²	43.5	50%	0.504	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-40.2	174.3	0	0	0	0	0	112.4	S581 A582 A583 A588 A589	S581-A585 PolarHBondContact O-N 3.41Å; S581-A585 VanDerWaalsContact O-N 3.11Å; A582-A585 PolarHBondContact O-N 3.3Å; A583-A585 VanDerWaalsContact C-N 3.33Å; A583-A585 PolarHBondContact O-N 2.9Å; A585-A588 PolarHBondContact O-N 3.2Å; A585-A589 WeakPolarHBondContact O-CB 3.45Å; A585-A589 PolarHBondContact O-N 3.1Å
586	A	89.1	Confident	87.8	Confident	3 Å²	3	41.2 Å²	41.2	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-66.3	-37.4	174.9	0	0	0	0	0	112.2	L561 R562 F565 A582 A583 A589 G590	L561-A586 HydrophobicContact CB-CB 4.38Å; R562-A586 HydrophobicContact CB-CB 4.47Å; F565-A586 HydrophobicContact CD2-CB 4.21Å; F565-A586 HydrophobicContact CE2-CB 4.29Å; A582-A586 PolarHBondContact O-N 3.18Å; A583-A586 PolarHBondContact O-N 3.26Å; A586-A589 PolarHBondContact O-N 2.98Å; A586-G590 PolarHBondContact O-N 3.19Å
587	A	89.5	Confident	88.9	Confident	7 Å²	7	38.4 Å²	38.4	6%	0.058	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-46.9	173.8	0	0	0	0	0	111.8	A583 E584 A589 G590 E591 E662	A583-A587 WeakPolarHBondContact O-CB 3.23Å; A583-A587 PolarHBondContact O-N 3.49Å; E584-A587 PolarHBondContact O-N 3.13Å; A587-A589 PolarHBondContact O-N 2.93Å; A587-G590 PolarHBondContact O-N 3.32Å; A587-E591 PolarHBondContact O-N 2.92Å; A587-E662 VanDerWaalsContact CB-CD 3.43Å; A587-E662 HydrophobicContact CB-CG 4.42Å; A587-E662 WeakPolarHBondContact CB-OE1 3.45Å; A587-E662 VanDerWaalsContact CB-OE2 3.24Å; A587-E662 WeakPolarHBondContact CB-OE2 3.14Å
588	A	91.4	Very high	89.9	Confident	58 Å²	58	35.3 Å²	35.3	48%	0.479	25%	0.248	S	C	.	.	H	α-helix	trans	-62.4	-40.4	176.3	0	0	0	0	0	112.4	E584 A585 E591 S592	E584-A588 WeakPolarHBondContact O-CB 3.3Å; E584-A588 PolarHBondContact O-N 3.4Å; A585-A588 PolarHBondContact O-N 3.2Å; A588-E591 PolarHBondContact O-N 2.84Å; A588-S592 WeakPolarHBondContact O-CB 3.33Å; A588-S592 PolarHBondContact O-N 3.36Å
589	A	91.3	Very high	90.7	Very high	31 Å²	31	34.5 Å²	34.5	26%	0.256	24%	0.237	S	C	.	.	H	α-helix	trans	-62.3	-46.8	173.8	0	0	0	0	0	111.5	A558 A585 A586 A587 E591 S592 S593	A558-A589 HydrophobicContact CB-CB 4.33Å; A585-A589 WeakPolarHBondContact O-CB 3.45Å; A585-A589 PolarHBondContact O-N 3.1Å; A586-A589 PolarHBondContact O-N 2.98Å; A587-A589 PolarHBondContact O-N 2.93Å; A589-E591 VanDerWaalsContact C-N 3.33Å; A589-E591 PolarHBondContact O-N 3.37Å; A589-S592 PolarHBondContact O-N 2.92Å; A589-S593 WeakPolarHBondContact O-CB 3.38Å; A589-S593 PolarHBondContact O-N 3.22Å; A589-S593 PolarHBondContact O-OG 3.16Å; A589-S593 VanDerWaalsContact O-OG 3.12Å
590	G	93.9	Very high	91.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-40.5	176.7	0	0	0	0	0	113	A586 A587 S593 F594	A586-G590 PolarHBondContact O-N 3.19Å; A587-G590 PolarHBondContact O-N 3.32Å; G590-S593 PolarHBondContact O-N 3.05Å; G590-F594 WeakPolarHBondContact O-CB 3.43Å; G590-F594 PolarHBondContact O-N 3.46Å
591	E	94.6	Very high	92.1	Very high	18 Å²	18	31 Å²	31	8%	0.084	21%	0.205	C	C	.	.	H	α-helix	trans	-66.7	-42.6	175.5	-171.8	-175.2	147.5	0	0	112.5	A587 A588 A589 S593 F594 K595 R702 V703	A587-E591 PolarHBondContact O-N 2.92Å; A588-E591 PolarHBondContact O-N 2.84Å; A589-E591 VanDerWaalsContact C-N 3.33Å; A589-E591 PolarHBondContact O-N 3.37Å; E591-S593 VanDerWaalsContact C-N 3.35Å; E591-F594 WeakPolarHBondContact O-CB 3.38Å; E591-F594 PolarHBondContact O-N 3.05Å; E591-K595 HydrophobicContact CG-CD 4.4Å; E591-K595 WeakPolarHBondContact O-CG 3.3Å; E591-K595 PolarHBondContact O-N 2.95Å; E591-K595 WeakPolarHBondContact OE1-CE 3.39Å; E591-K595 IonicContact OE1-NZ 3.62Å; E591-K595 PolarHBondContact OE1-NZ 2.85Å; E591-R702 IonicContact OE1-CZ 3.35Å; E591-R702 IonicContact OE1-NH1 2.87Å; E591-R702 PolarHBondContact OE1-NH1 3.43Å; E591-R702 IonicContact OE2-CZ 2.85Å; E591-R702 IonicContact OE2-NH1 3.83Å; E591-R702 PolarHBondContact OE2-NH1 3.05Å; E591-R702 IonicContact OE2-NH2 3.82Å; E591-R702 PolarHBondContact OE2-NH2 3.21Å; E591-V703 HydrophobicContact CG-CB 4.32Å; E591-V703 HydrophobicContact CG-CG2 3.94Å
592	S	93.5	Very high	92.6	Very high	79 Å²	79	30.5 Å²	30.5	55%	0.552	19%	0.194	S	C	*	.	H	α-helix	trans	-62	-43.7	175.4	-173.7	0	0	0	0	111.4	A588 A589 K595 S596	A588-S592 WeakPolarHBondContact O-CB 3.33Å; A588-S592 PolarHBondContact O-N 3.36Å; A589-S592 PolarHBondContact O-N 2.92Å; S592-K595 PolarHBondContact O-N 3.39Å; S592-S596 WeakPolarHBondContact O-CB 3.43Å; S592-S596 PolarHBondContact O-N 3.24Å
593	S	94.5	Very high	93.1	Very high	14 Å²	14	35 Å²	35	10%	0.098	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-39.6	176.7	-62.3	0	0	0	0	112	S554 A589 G590 E591 S596 F597	S554-S593 VanDerWaalsContact C-OG 3.29Å; S554-S593 WeakPolarHBondContact O-CB 3.15Å; S554-S593 PolarHBondContact O-OG 2.9Å; A589-S593 WeakPolarHBondContact O-CB 3.38Å; A589-S593 PolarHBondContact O-N 3.22Å; A589-S593 PolarHBondContact O-OG 3.16Å; A589-S593 VanDerWaalsContact O-OG 3.12Å; G590-S593 PolarHBondContact O-N 3.05Å; E591-S593 VanDerWaalsContact C-N 3.35Å; S593-S596 PolarHBondContact O-N 3.44Å; S593-F597 WeakPolarHBondContact O-CB 3.4Å; S593-F597 PolarHBondContact O-N 3.04Å
594	F	96.8	Very high	93.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-50	173	179.7	-82.9	0	0	0	111.4	G590 E591 S596 F597 M598 C655 V659 V703 L704 S706 A707 F719	G590-F594 WeakPolarHBondContact O-CB 3.43Å; G590-F594 PolarHBondContact O-N 3.46Å; E591-F594 WeakPolarHBondContact O-CB 3.38Å; E591-F594 PolarHBondContact O-N 3.05Å; F594-S596 PolarHBondContact O-N 3.34Å; F594-F597 PolarHBondContact O-N 2.89Å; F594-M598 HydrophobicContact CD1-CG 4.08Å; F594-M598 HydrophobicContact CD2-CE 4.34Å; F594-M598 HydrophobicContact CE1-CE 3.86Å; F594-M598 HydrophobicContact CE1-CG 3.78Å; F594-M598 HydrophobicContact CE2-CE 3.63Å; F594-M598 HydrophobicContact CZ-CE 3.35Å; F594-M598 HydrophobicContact CZ-CG 4.27Å; F594-M598 WeakPolarHBondContact O-CG 3.05Å; F594-M598 PolarHBondContact O-N 3.01Å; F594-C655 HydrophobicContact CD2-CB 3.57Å; F594-C655 HydrophobicContact CE2-CB 3.63Å; F594-V659 HydrophobicContact CD2-CG2 3.67Å; F594-V659 HydrophobicContact CE2-CG2 3.45Å; F594-V659 VanDerWaalsContact CE2-CG2 3.45Å; F594-V659 HydrophobicContact CZ-CG2 4.18Å; F594-V703 HydrophobicContact CB-CG2 4.36Å; F594-V703 HydrophobicContact CD1-CG2 3.59Å; F594-V703 HydrophobicContact CD2-CG2 4.43Å; F594-V703 HydrophobicContact CE1-CG2 3.9Å; F594-V703 WeakPolarHBondContact CE1-O 3.49Å; F594-V703 HydrophobicContact CG-CG2 3.89Å; F594-V703 HydrophobicContact CZ-CG2 4.42Å; F594-L704 HydrophobicContact CZ-CD2 3.94Å; F594-S706 WeakPolarHBondContact CE1-OG 3.28Å; F594-A707 HydrophobicContact CE1-CB 4.21Å; F594-A707 HydrophobicContact CZ-CB 4Å; F594-F719 HydrophobicContact CE2-CZ 4.07Å; F594-F719 HydrophobicContact CZ-CZ 4.15Å
595	K	95	Very high	94	Very high	73 Å²	73	32.5 Å²	32.5	32%	0.317	20%	0.204	S	C	.	.	H	α-helix	trans	-61.2	-44.6	178.2	-74.2	173.5	171.7	170.9	0	111.8	E591 S592 F597 M598 V599	E591-K595 HydrophobicContact CG-CD 4.4Å; E591-K595 WeakPolarHBondContact O-CG 3.3Å; E591-K595 PolarHBondContact O-N 2.95Å; E591-K595 WeakPolarHBondContact OE1-CE 3.39Å; E591-K595 IonicContact OE1-NZ 3.62Å; E591-K595 PolarHBondContact OE1-NZ 2.85Å; S592-K595 PolarHBondContact O-N 3.39Å; K595-F597 VanDerWaalsContact C-N 3.34Å; K595-F597 PolarHBondContact O-N 3.44Å; K595-M598 PolarHBondContact O-N 2.88Å; K595-V599 WeakPolarHBondContact O-CG2 3.5Å; K595-V599 PolarHBondContact O-N 2.88Å
596	S	93.9	Very high	94.4	Very high	23 Å²	23	31.9 Å²	31.9	16%	0.161	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-43.1	176.9	-167.4	0	0	0	0	112	Q495 S592 S593 F594 V599 A600	Q495-S596 PolarHBondContact NE2-OG 3.48Å; S592-S596 WeakPolarHBondContact O-CB 3.43Å; S592-S596 PolarHBondContact O-N 3.24Å; S593-S596 PolarHBondContact O-N 3.44Å; F594-S596 PolarHBondContact O-N 3.34Å; S596-V599 PolarHBondContact O-N 2.94Å; S596-A600 PolarHBondContact O-N 3.05Å
597	F	96.9	Very high	94.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.1	-40.8	177.5	-170.1	-91.3	0	0	0	112.4	L548 A551 R552 L555 S593 F594 K595 V599 A600 V601 L652 C655	L548-F597 HydrophobicContact CD2-CE2 4.28Å; L548-F597 HydrophobicContact CD2-CZ 4.26Å; A551-F597 HydrophobicContact CB-CD2 3.83Å; R552-F597 HydrophobicContact CB-CD2 4.35Å; R552-F597 HydrophobicContact CB-CE2 4.1Å; L555-F597 HydrophobicContact CD1-CB 3.97Å; L555-F597 HydrophobicContact CD1-CD2 4.01Å; L555-F597 HydrophobicContact CD1-CG 3.89Å; S593-F597 WeakPolarHBondContact O-CB 3.4Å; S593-F597 PolarHBondContact O-N 3.04Å; F594-F597 PolarHBondContact O-N 2.89Å; K595-F597 VanDerWaalsContact C-N 3.34Å; K595-F597 PolarHBondContact O-N 3.44Å; F597-V599 VanDerWaalsContact C-N 3.34Å; F597-V599 PolarHBondContact O-N 3.36Å; F597-A600 WeakPolarHBondContact O-CB 3.48Å; F597-A600 PolarHBondContact O-N 3.03Å; F597-A600 VanDerWaalsContact O-N 3.13Å; F597-V601 HydrophobicContact CD1-CG2 3.89Å; F597-V601 HydrophobicContact CE1-CG2 3.4Å; F597-V601 HydrophobicContact CZ-CG2 3.9Å; F597-V601 WeakPolarHBondContact O-CG2 3.42Å; F597-V601 PolarHBondContact O-N 3.17Å; F597-L652 HydrophobicContact CE1-CD2 4.07Å; F597-L652 HydrophobicContact CE1-CG 4.09Å; F597-C655 WeakPolarHBondContact CD1-SG 3.42Å
598	M	96.9	Very high	95.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.6	-44.1	174.8	-71	-57.5	165.4	0	0	111.8	F594 K595 A600 V601 Q602 L652 C655 A707 A710 L711 F719	F594-M598 HydrophobicContact CD1-CG 4.08Å; F594-M598 HydrophobicContact CD2-CE 4.34Å; F594-M598 HydrophobicContact CE1-CE 3.86Å; F594-M598 HydrophobicContact CE1-CG 3.78Å; F594-M598 HydrophobicContact CE2-CE 3.63Å; F594-M598 HydrophobicContact CZ-CE 3.35Å; F594-M598 HydrophobicContact CZ-CG 4.27Å; F594-M598 WeakPolarHBondContact O-CG 3.05Å; F594-M598 PolarHBondContact O-N 3.01Å; K595-M598 PolarHBondContact O-N 2.88Å; M598-A600 VanDerWaalsContact C-N 3.34Å; M598-A600 PolarHBondContact O-N 2.97Å; M598-V601 PolarHBondContact O-N 3.41Å; M598-Q602 PolarHBondContact O-N 3.02Å; M598-L652 HydrophobicContact CE-CD2 3.97Å; M598-L652 HydrophobicContact SD-CD2 4.19Å; M598-C655 HydrophobicContact CE-CB 4.08Å; M598-A707 HydrophobicContact CE-CB 3.97Å; M598-A707 HydrophobicContact CG-CB 4.48Å; M598-A707 HydrophobicContact SD-CB 4.09Å; M598-A710 HydrophobicContact CB-CB 3.82Å; M598-A710 WeakPolarHBondContact O-CB 3.18Å; M598-L711 HydrophobicContact CE-CD1 4.41Å; M598-L711 HydrophobicContact SD-CD1 4.14Å; M598-L711 HydrophobicContact SD-CD2 4.25Å; M598-L711 HydrophobicContact SD-CG 4.09Å; M598-F719 HydrophobicContact CE-CE1 4.12Å; M598-F719 HydrophobicContact CE-CE2 3.81Å; M598-F719 HydrophobicContact CE-CZ 3.5Å; M598-F719 VanDerWaalsContact CE-CZ 3.5Å
599	V	94.6	Very high	95.3	Very high	46 Å²	46	32.2 Å²	32.2	28%	0.279	20%	0.196	S	C	.	.	H	α-helix	trans	-61.2	-43.1	173.7	173.8	0	0	0	0	110.9	K595 S596 F597 V601 Q602 R603	K595-V599 WeakPolarHBondContact O-CG2 3.5Å; K595-V599 PolarHBondContact O-N 2.88Å; S596-V599 PolarHBondContact O-N 2.94Å; F597-V599 VanDerWaalsContact C-N 3.34Å; F597-V599 PolarHBondContact O-N 3.36Å; V599-V601 VanDerWaalsContact C-N 3.34Å; V599-V601 PolarHBondContact O-N 3.33Å; V599-Q602 PolarHBondContact O-N 3.31Å; V599-R603 HydrophobicContact CG1-CG 4.13Å; V599-R603 WeakPolarHBondContact O-CB 3.41Å; V599-R603 WeakPolarHBondContact O-CG 3.2Å; V599-R603 PolarHBondContact O-N 3.43Å
600	A	95.5	Very high	95.6	Very high	2 Å²	2	32.7 Å²	32.7	2%	0.017	19%	0.193	C	C	.	.	H	α-helix	trans	-60	-41.4	177.3	0	0	0	0	0	112.4	I496 L548 A551 S596 F597 M598 R603 C604	I496-A600 HydrophobicContact CD1-CB 4.31Å; L548-A600 HydrophobicContact CD2-CB 4.16Å; A551-A600 HydrophobicContact CB-CB 3.82Å; S596-A600 PolarHBondContact O-N 3.05Å; F597-A600 WeakPolarHBondContact O-CB 3.48Å; F597-A600 PolarHBondContact O-N 3.03Å; F597-A600 VanDerWaalsContact O-N 3.13Å; M598-A600 VanDerWaalsContact C-N 3.34Å; M598-A600 PolarHBondContact O-N 2.97Å; A600-R603 PolarHBondContact O-N 3.42Å; A600-C604 VanDerWaalsContact O-CB 3.31Å; A600-C604 WeakPolarHBondContact O-CB 3.31Å; A600-C604 PolarHBondContact O-N 3.37Å
601	V	96.6	Very high	95.8	Very high	23 Å²	23	32.8 Å²	32.8	14%	0.139	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-45.5	175.1	172.7	0	0	0	0	111.4	L548 F597 M598 V599 R603 C604 G605 L652 L711	L548-V601 HydrophobicContact CD2-CG2 4.04Å; F597-V601 HydrophobicContact CD1-CG2 3.89Å; F597-V601 HydrophobicContact CE1-CG2 3.4Å; F597-V601 HydrophobicContact CZ-CG2 3.9Å; F597-V601 WeakPolarHBondContact O-CG2 3.42Å; F597-V601 PolarHBondContact O-N 3.17Å; M598-V601 PolarHBondContact O-N 3.41Å; V599-V601 VanDerWaalsContact C-N 3.34Å; V599-V601 PolarHBondContact O-N 3.33Å; V601-R603 PolarHBondContact O-N 3.31Å; V601-C604 WeakPolarHBondContact O-CB 3.32Å; V601-C604 PolarHBondContact O-N 3.37Å; V601-G605 PolarHBondContact O-N 2.92Å; V601-L652 HydrophobicContact CG2-CD2 4.4Å; V601-L711 HydrophobicContact CG1-CD2 3.77Å
602	Q	95.3	Very high	95.9	Very high	76 Å²	76	36.6 Å²	36.6	36%	0.355	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-43.8	177.9	-172.3	-177.3	12	0	0	112	M598 V599 G605 S606 A710	M598-Q602 PolarHBondContact O-N 3.02Å; V599-Q602 PolarHBondContact O-N 3.31Å; Q602-G605 PolarHBondContact O-N 3.12Å; Q602-S606 PolarHBondContact O-N 3.15Å; Q602-S606 PolarHBondContact O-OG 3.23Å; Q602-A710 HydrophobicContact CB-CB 4.12Å
603	R	95.2	Very high	96.1	Very high	113 Å²	113	38.7 Å²	38.7	43%	0.426	21%	0.213	S	C	.	.	H	α-helix	trans	-65.7	-39.7	177	-64.2	-70.1	178.6	-163.5	3.6	111.4	I496 V498 V599 A600 V601 S606 S607	I496-R603 HydrophobicContact CB-CB 4.01Å; I496-R603 HydrophobicContact CG2-CB 3.98Å; I496-R603 WeakPolarHBondContact O-CG 3.28Å; V498-R603 HydrophobicContact CG2-CB 4.31Å; V599-R603 HydrophobicContact CG1-CG 4.13Å; V599-R603 WeakPolarHBondContact O-CB 3.41Å; V599-R603 WeakPolarHBondContact O-CG 3.2Å; V599-R603 PolarHBondContact O-N 3.43Å; A600-R603 PolarHBondContact O-N 3.42Å; V601-R603 PolarHBondContact O-N 3.31Å; R603-S606 PolarHBondContact O-N 3.41Å; R603-S607 WeakPolarHBondContact O-CB 3.14Å; R603-S607 PolarHBondContact O-N 3.43Å; R603-S607 PolarHBondContact O-OG 3.1Å; R603-S607 VanDerWaalsContact O-OG 3.06Å
604	C	96.1	Very high	96.3	Very high	13 Å²	13	38.5 Å²	38.5	9%	0.088	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-47.5	172.4	-175.8	0	0	0	0	111.5	I496 L548 A600 V601 S606 S607 V608	I496-C604 HydrophobicContact CD1-CB 4.3Å; L548-C604 HydrophobicContact CD1-CB 4.38Å; L548-C604 HydrophobicContact CD2-CB 4.46Å; A600-C604 VanDerWaalsContact O-CB 3.31Å; A600-C604 WeakPolarHBondContact O-CB 3.31Å; A600-C604 PolarHBondContact O-N 3.37Å; V601-C604 WeakPolarHBondContact O-CB 3.32Å; V601-C604 PolarHBondContact O-N 3.37Å; C604-S606 VanDerWaalsContact C-N 3.34Å; C604-S606 PolarHBondContact O-N 2.93Å; C604-S607 WeakPolarHBondContact O-CB 3.32Å; C604-S607 PolarHBondContact O-N 3.49Å; C604-V608 WeakPolarHBondContact O-CG2 3.43Å; C604-V608 PolarHBondContact O-N 3.36Å
605	G	94.9	Very high	96.4	Very high	43 Å²	43	39.2 Å²	39.2	44%	0.443	21%	0.213	S	C	.	.	H	α-helix	trans	-59.2	-43.9	176.7	0	0	0	0	0	112.7	V601 Q602 S607 V608 A609	V601-G605 PolarHBondContact O-N 2.92Å; Q602-G605 PolarHBondContact O-N 3.12Å; G605-S607 PolarHBondContact O-N 2.91Å; G605-V608 PolarHBondContact O-N 3.13Å; G605-A609 PolarHBondContact O-N 3.33Å
606	S	95.9	Very high	96.4	Very high	48 Å²	48	38.6 Å²	38.6	34%	0.336	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-44.2	175.8	-56.6	0	0	0	0	112.1	Q602 R603 C604 V608 A609 I610	Q602-S606 PolarHBondContact O-N 3.15Å; Q602-S606 PolarHBondContact O-OG 3.23Å; R603-S606 PolarHBondContact O-N 3.41Å; C604-S606 VanDerWaalsContact C-N 3.34Å; C604-S606 PolarHBondContact O-N 2.93Å; S606-V608 PolarHBondContact O-N 3.06Å; S606-A609 PolarHBondContact O-N 3.44Å; S606-I610 WeakPolarHBondContact O-CG1 3.36Å; S606-I610 PolarHBondContact O-N 3.32Å; S606-I610 VanDerWaalsContact O-N 3.08Å
607	S	97.1	Very high	96.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-43.2	176.6	-68.6	0	0	0	0	112.5	V501 R603 C604 G605 I610 V611	V501-S607 WeakPolarHBondContact CG2-OG 3.46Å; R603-S607 WeakPolarHBondContact O-CB 3.14Å; R603-S607 PolarHBondContact O-N 3.43Å; R603-S607 PolarHBondContact O-OG 3.1Å; R603-S607 VanDerWaalsContact O-OG 3.06Å; C604-S607 WeakPolarHBondContact O-CB 3.32Å; C604-S607 PolarHBondContact O-N 3.49Å; G605-S607 PolarHBondContact O-N 2.91Å; S607-I610 PolarHBondContact O-N 3.46Å; S607-V611 PolarHBondContact O-N 3.16Å
608	V	96.3	Very high	96.5	Very high	26 Å²	26	43.7 Å²	43.7	16%	0.158	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-42.8	176.4	171.3	0	0	0	0	111.1	I544 C604 G605 S606 I610 V611 Q612 L641	I544-V608 HydrophobicContact CD1-CG2 4.14Å; C604-V608 WeakPolarHBondContact O-CG2 3.43Å; C604-V608 PolarHBondContact O-N 3.36Å; G605-V608 PolarHBondContact O-N 3.13Å; S606-V608 PolarHBondContact O-N 3.06Å; V608-I610 VanDerWaalsContact C-N 3.32Å; V608-I610 PolarHBondContact O-N 3.26Å; V608-V611 PolarHBondContact O-N 3.03Å; V608-Q612 HydrophobicContact CG1-CG 4.27Å; V608-Q612 WeakPolarHBondContact O-CG 3.44Å; V608-Q612 PolarHBondContact O-N 3.38Å; V608-L641 HydrophobicContact CG1-CD1 3.67Å; V608-L641 HydrophobicContact CG2-CD1 4.35Å; V608-L641 HydrophobicContact CG2-CD2 3.74Å
609	A	96.4	Very high	96.5	Very high	48 Å²	48	43.7 Å²	43.7	40%	0.397	25%	0.25	S	C	.	.	H	α-helix	trans	-60	-40.6	177.7	0	0	0	0	0	112.3	G605 S606 V611 Q612 Q613	G605-A609 PolarHBondContact O-N 3.33Å; S606-A609 PolarHBondContact O-N 3.44Å; A609-V611 PolarHBondContact O-N 3.24Å; A609-Q612 PolarHBondContact O-N 3.26Å; A609-Q613 WeakPolarHBondContact O-CB 3.39Å; A609-Q613 PolarHBondContact O-N 3.48Å
610	I	97.9	Very high	96.6	Very high	41 Å²	41	42.3 Å²	42.3	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-45.7	175.9	-70.5	162.7	0	0	0	111.2	V498 T502 V505 S606 S607 V608 Q613 Y614	V498-I610 HydrophobicContact CG1-CD1 3.27Å; T502-I610 HydrophobicContact CG2-CD1 3.87Å; V505-I610 HydrophobicContact CG2-CG2 4.03Å; S606-I610 WeakPolarHBondContact O-CG1 3.36Å; S606-I610 PolarHBondContact O-N 3.32Å; S606-I610 VanDerWaalsContact O-N 3.08Å; S607-I610 PolarHBondContact O-N 3.46Å; V608-I610 VanDerWaalsContact C-N 3.32Å; V608-I610 PolarHBondContact O-N 3.26Å; I610-Q613 PolarHBondContact O-N 3.31Å; I610-Y614 WeakPolarHBondContact O-CB 3.47Å; I610-Y614 PolarHBondContact O-N 3.39Å
611	V	98	Very high	96.7	Very high	2 Å²	2	50 Å²	50	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-41.3	178.1	175	0	0	0	0	111.4	V501 F533 L537 V540 S607 V608 A609 Y614 F615	V501-V611 HydrophobicContact CG1-CG2 4.18Å; F533-V611 HydrophobicContact CE2-CG1 4.34Å; F533-V611 HydrophobicContact CZ-CG1 4.12Å; L537-V611 HydrophobicContact CD2-CG1 3.88Å; V540-V611 HydrophobicContact CB-CG2 4.44Å; V540-V611 HydrophobicContact CG1-CG2 4.09Å; V540-V611 HydrophobicContact CG2-CG2 3.97Å; S607-V611 PolarHBondContact O-N 3.16Å; V608-V611 PolarHBondContact O-N 3.03Å; A609-V611 PolarHBondContact O-N 3.24Å; V611-Y614 PolarHBondContact O-N 2.61Å; V611-F615 WeakPolarHBondContact O-CB 3.4Å; V611-F615 PolarHBondContact O-N 3.22Å
612	Q	97.1	Very high	96.7	Very high	98 Å²	98	50.2 Å²	50.2	46%	0.458	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-42.1	176.9	-73.2	175.2	-17.2	0	0	112.1	V608 A609 F615 A616 M637	V608-Q612 HydrophobicContact CG1-CG 4.27Å; V608-Q612 WeakPolarHBondContact O-CG 3.44Å; V608-Q612 PolarHBondContact O-N 3.38Å; A609-Q612 PolarHBondContact O-N 3.26Å; Q612-F615 PolarHBondContact O-N 2.97Å; Q612-A616 WeakPolarHBondContact O-CB 3.47Å; Q612-A616 PolarHBondContact O-N 3.3Å; Q612-M637 HydrophobicContact CG-SD 3.97Å
613	Q	97.6	Very high	96.7	Very high	123 Å²	123	46.6 Å²	46.6	58%	0.575	25%	0.254	S	S	*	.	H	α-helix	trans	-64.4	-44.7	176.1	-175.8	177.7	4.3	0	0	111.4	A609 I610 F615 A616 N617	A609-Q613 WeakPolarHBondContact O-CB 3.39Å; A609-Q613 PolarHBondContact O-N 3.48Å; I610-Q613 PolarHBondContact O-N 3.31Å; Q613-F615 VanDerWaalsContact C-N 3.33Å; Q613-F615 PolarHBondContact O-N 2.9Å; Q613-A616 PolarHBondContact O-N 2.91Å; Q613-N617 WeakPolarHBondContact CG-ND2 3.4Å; Q613-N617 WeakPolarHBondContact O-CB 3.38Å; Q613-N617 VanDerWaalsContact O-CG 3.29Å; Q613-N617 PolarHBondContact O-N 3.4Å
614	Y	98.1	Very high	96.7	Very high	10 Å²	10	46.4 Å²	46.4	4%	0.039	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-43.2	174.9	172.4	-122.8	0	0	0	111.8	V505 N508 E509 I512 F533 L536 I610 V611 S618 I619	V505-Y614 HydrophobicContact CG1-CD1 4Å; V505-Y614 HydrophobicContact CG1-CD2 3.95Å; V505-Y614 HydrophobicContact CG1-CE1 4.46Å; V505-Y614 HydrophobicContact CG1-CE2 4.45Å; V505-Y614 HydrophobicContact CG1-CG 3.71Å; N508-Y614 HydrophobicContact CB-CE1 4.17Å; N508-Y614 VanDerWaalsContact OD1-CE1 3.27Å; N508-Y614 WeakPolarHBondContact OD1-CE1 3.5Å; N508-Y614 PolarHBondContact OD1-OH 2.82Å; E509-Y614 HydrophobicContact CG-CD2 4.02Å; E509-Y614 HydrophobicContact CG-CE2 3.34Å; E509-Y614 PolarHBondContact N-OH 3.46Å; I512-Y614 WeakPolarHBondContact CG1-OH 3.39Å; F533-Y614 HydrophobicContact CD2-CD1 4.46Å; F533-Y614 HydrophobicContact CD2-CE1 4.14Å; F533-Y614 HydrophobicContact CE2-CD1 4.05Å; F533-Y614 HydrophobicContact CE2-CE1 4.2Å; L536-Y614 HydrophobicContact CD2-CD1 3.75Å; L536-Y614 HydrophobicContact CD2-CE1 3.74Å; I610-Y614 WeakPolarHBondContact O-CB 3.47Å; I610-Y614 PolarHBondContact O-N 3.39Å; V611-Y614 PolarHBondContact O-N 2.61Å; Y614-S618 WeakPolarHBondContact O-CB 3.47Å; Y614-S618 PolarHBondContact O-N 3.09Å; Y614-I619 HydrophobicContact CD1-CG1 4.22Å; Y614-I619 HydrophobicContact CE1-CD1 3.82Å; Y614-I619 HydrophobicContact CE1-CG1 3.81Å; Y614-I619 HydrophobicContact CE2-CD1 4.35Å; Y614-I619 HydrophobicContact CE2-CG1 4.46Å; Y614-I619 PolarHBondContact O-N 2.92Å; Y614-I619 WeakPolarHBondContact OH-CD1 3.4Å
615	F	98.1	Very high	96.7	Very high	15 Å²	15	50.2 Å²	50.2	7%	0.066	29%	0.285	C	S	.	.	I	π-helix	trans	-60.5	-48.5	175.7	178.6	-99.9	0	0	0	112.1	F533 V611 Q612 Q613 I619 S620 L623 H630 C634 M637	F533-F615 HydrophobicContact CD1-CD2 4.1Å; F533-F615 HydrophobicContact CD1-CE2 4.44Å; F533-F615 AromaticContact CE1-CD2 3.46Å; F533-F615 HydrophobicContact CE1-CD2 3.46Å; F533-F615 VanDerWaalsContact CE1-CD2 3.46Å; F533-F615 HydrophobicContact CE1-CE2 4.03Å; F533-F615 HydrophobicContact CE1-CG 4.31Å; F533-F615 HydrophobicContact CE2-CB 4.31Å; F533-F615 HydrophobicContact CE2-CD2 4.28Å; F533-F615 HydrophobicContact CZ-CB 3.83Å; F533-F615 AromaticContact CZ-CD2 3.58Å; F533-F615 HydrophobicContact CZ-CD2 3.58Å; F533-F615 HydrophobicContact CZ-CG 4.08Å; V611-F615 WeakPolarHBondContact O-CB 3.4Å; V611-F615 PolarHBondContact O-N 3.22Å; Q612-F615 PolarHBondContact O-N 2.97Å; Q613-F615 VanDerWaalsContact C-N 3.33Å; Q613-F615 PolarHBondContact O-N 2.9Å; F615-I619 HydrophobicContact CD2-CB 3.79Å; F615-I619 HydrophobicContact CD2-CG1 4.48Å; F615-I619 HydrophobicContact CD2-CG2 3.69Å; F615-I619 HydrophobicContact CE2-CB 4.34Å; F615-I619 HydrophobicContact CE2-CG2 3.83Å; F615-I619 HydrophobicContact CG-CB 4.47Å; F615-I619 PolarHBondContact O-N 3.09Å; F615-S620 WeakPolarHBondContact O-CB 3.45Å; F615-S620 PolarHBondContact O-N 2.97Å; F615-L623 HydrophobicContact CE2-CD1 4.06Å; F615-H630 AromaticContact CE1-CE1 3.52Å; F615-H630 AromaticContact CZ-CE1 3.66Å; F615-H630 AromaticContact CZ-ND1 3.79Å; F615-C634 WeakPolarHBondContact CE1-SG 3.36Å; F615-C634 WeakPolarHBondContact CZ-SG 3.32Å; F615-M637 HydrophobicContact CB-CE 3.57Å; F615-M637 HydrophobicContact CD1-CE 3.79Å; F615-M637 HydrophobicContact CD2-CE 3.72Å; F615-M637 HydrophobicContact CE1-CE 4.4Å; F615-M637 HydrophobicContact CE2-CE 4.35Å; F615-M637 HydrophobicContact CG-CE 3.4Å
616	A	96.8	Very high	96.7	Very high	61 Å²	61	50.1 Å²	50.1	50%	0.504	28%	0.276	S	S	.	.	I	π-helix	trans	-63	-44.4	-179.2	0	0	0	0	0	112.4	Q612 Q613	Q612-A616 WeakPolarHBondContact O-CB 3.47Å; Q612-A616 PolarHBondContact O-N 3.3Å; Q613-A616 PolarHBondContact O-N 2.91Å
617	N	95.7	Very high	96.6	Very high	101 Å²	101	55.6 Å²	55.6	54%	0.54	30%	0.302	S	S	.	.	I	π-helix	trans	-81	-36.7	-172.4	-68.6	-11.1	0	0	0	113.5	Q613	Q613-N617 WeakPolarHBondContact CG-ND2 3.4Å; Q613-N617 WeakPolarHBondContact O-CB 3.38Å; Q613-N617 VanDerWaalsContact O-CG 3.29Å; Q613-N617 PolarHBondContact O-N 3.4Å
618	S	95.4	Very high	96.5	Very high	29 Å²	29	58.1 Å²	58.1	20%	0.203	33%	0.327	C	S	.	.	I	π-helix	trans	-118.6	-44.9	-166.4	-62.8	0	0	0	0	113.7	Y614 R621	Y614-S618 WeakPolarHBondContact O-CB 3.47Å; Y614-S618 PolarHBondContact O-N 3.09Å; S618-R621 VanDerWaalsContact O-CG 3.25Å; S618-R621 WeakPolarHBondContact O-CG 3.34Å; S618-R621 PolarHBondContact O-NE 3.37Å
619	I	97.8	Very high	96.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.326	C	S	.	.	I	π-helix	trans	-81.1	-44.4	-173.9	-57.4	-60.5	0	0	0	111.5	I512 V529 F533 Y614 F615 R621 L622 L623	I512-I619 HydrophobicContact CD1-CD1 3.91Å; I512-I619 HydrophobicContact CG1-CD1 3.78Å; V529-I619 HydrophobicContact CG1-CD1 4.33Å; V529-I619 HydrophobicContact CG1-CG2 3.94Å; F533-I619 HydrophobicContact CB-CG2 4.49Å; F533-I619 HydrophobicContact CD1-CG2 4.5Å; F533-I619 HydrophobicContact CD2-CD1 4.17Å; F533-I619 HydrophobicContact CD2-CG1 3.77Å; F533-I619 HydrophobicContact CD2-CG2 4.49Å; F533-I619 HydrophobicContact CE2-CG1 4.08Å; F533-I619 HydrophobicContact CG-CG1 4.34Å; F533-I619 HydrophobicContact CG-CG2 4.24Å; Y614-I619 HydrophobicContact CD1-CG1 4.22Å; Y614-I619 HydrophobicContact CE1-CD1 3.82Å; Y614-I619 HydrophobicContact CE1-CG1 3.81Å; Y614-I619 HydrophobicContact CE2-CD1 4.35Å; Y614-I619 HydrophobicContact CE2-CG1 4.46Å; Y614-I619 PolarHBondContact O-N 2.92Å; Y614-I619 WeakPolarHBondContact OH-CD1 3.4Å; F615-I619 HydrophobicContact CD2-CB 3.79Å; F615-I619 HydrophobicContact CD2-CG1 4.48Å; F615-I619 HydrophobicContact CD2-CG2 3.69Å; F615-I619 HydrophobicContact CE2-CB 4.34Å; F615-I619 HydrophobicContact CE2-CG2 3.83Å; F615-I619 HydrophobicContact CG-CB 4.47Å; F615-I619 PolarHBondContact O-N 3.09Å; I619-R621 VanDerWaalsContact C-N 3.31Å; I619-R621 PolarHBondContact O-N 3.42Å; I619-L622 WeakPolarHBondContact O-CB 3.46Å; I619-L622 PolarHBondContact O-N 3.35Å; I619-L623 HydrophobicContact CG2-CD1 3.65Å; I619-L623 HydrophobicContact CG2-CG 4.09Å; I619-L623 PolarHBondContact O-N 3.46Å
620	S	97.5	Very high	96.4	Very high	17 Å²	17	58 Å²	58	12%	0.119	32%	0.32	C	S	.	.	H	α-helix	trans	-52.3	-47.5	-174.3	-178.9	0	0	0	0	112.3	F615 L622 L623 L624 H630	F615-S620 WeakPolarHBondContact O-CB 3.45Å; F615-S620 PolarHBondContact O-N 2.97Å; S620-L622 PolarHBondContact O-N 2.97Å; S620-L623 PolarHBondContact O-N 3.41Å; S620-L624 VanDerWaalsContact O-CG 3.31Å; S620-L624 WeakPolarHBondContact O-CG 3.26Å; S620-L624 PolarHBondContact O-N 2.89Å; S620-H630 PolarHBondContact OG-CE1 3.2Å; S620-H630 PolarHBondContact OG-ND1 2.99Å
621	R	96	Very high	96.4	Very high	164 Å²	164	59.1 Å²	59.1	62%	0.619	33%	0.334	S	S	*	.	H	α-helix	trans	-59.5	-28.1	178.7	65.8	-178.6	-175.8	174.2	2.7	114.5	S618 I619 P625	S618-R621 VanDerWaalsContact O-CG 3.25Å; S618-R621 WeakPolarHBondContact O-CG 3.34Å; S618-R621 PolarHBondContact O-NE 3.37Å; I619-R621 VanDerWaalsContact C-N 3.31Å; I619-R621 PolarHBondContact O-N 3.42Å; R621-P625 WeakPolarHBondContact O-CD 3.45Å
622	L	96.9	Very high	96.3	Very high	27 Å²	27	60.2 Å²	60.2	14%	0.141	34%	0.344	C	S	.	.	H	α-helix	trans	-84.2	-20.9	179.6	-60.1	177.7	0	0	0	112.1	I512 T516 V529 I619 S620	I512-L622 HydrophobicContact CG2-CD1 3.49Å; I512-L622 VanDerWaalsContact CG2-CD1 3.49Å; T516-L622 HydrophobicContact CG2-CD1 3.92Å; T516-L622 HydrophobicContact CG2-CD2 4.01Å; V529-L622 HydrophobicContact CG1-CB 4.22Å; V529-L622 HydrophobicContact CG1-CD1 4.36Å; V529-L622 HydrophobicContact CG2-CB 4.23Å; V529-L622 HydrophobicContact CG2-CD1 3.94Å; I619-L622 WeakPolarHBondContact O-CB 3.46Å; I619-L622 PolarHBondContact O-N 3.35Å; S620-L622 PolarHBondContact O-N 2.97Å
623	L	97	Very high	96.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-95	-30.5	-179.9	-61.2	179.3	0	0	0	112.9	A526 V529 K530 F615 I619 S620 P625 V626 A629 H630 S633	A526-L623 HydrophobicContact CB-CD2 4.17Å; A526-L623 WeakPolarHBondContact O-CD2 3.45Å; V529-L623 HydrophobicContact CB-CD2 4.19Å; V529-L623 HydrophobicContact CG1-CD2 3.83Å; V529-L623 HydrophobicContact CG1-CG 4.25Å; K530-L623 HydrophobicContact CB-CD2 4.43Å; F615-L623 HydrophobicContact CE2-CD1 4.06Å; I619-L623 HydrophobicContact CG2-CD1 3.65Å; I619-L623 HydrophobicContact CG2-CG 4.09Å; I619-L623 PolarHBondContact O-N 3.46Å; S620-L623 PolarHBondContact O-N 3.41Å; L623-P625 VanDerWaalsContact C-N 3.33Å; L623-V626 PolarHBondContact O-N 3.48Å; L623-V626 VanDerWaalsContact O-N 3.09Å; L623-V626 VanDerWaalsContact O-O 3.13Å; L623-A629 HydrophobicContact CB-CB 4.3Å; L623-A629 HydrophobicContact CD2-CB 4.34Å; L623-H630 HydrophobicContact CB-CB 4.14Å; L623-S633 VanDerWaalsContact CD1-OG 3.26Å; L623-S633 WeakPolarHBondContact CD1-OG 3.45Å
624	L	95.2	Very high	96.2	Very high	109 Å²	109	52 Å²	52	57%	0.571	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.8	-178.1	-77.5	169.5	0	0	0	115.6	S620 V626 H630	S620-L624 VanDerWaalsContact O-CG 3.31Å; S620-L624 WeakPolarHBondContact O-CG 3.26Å; S620-L624 PolarHBondContact O-N 2.89Å; L624-V626 PolarHBondContact O-N 3.21Å; L624-H630 HydrophobicContact CD2-CB 4.4Å
625	P	94.7	Very high	96.2	Very high	93 Å²	93	58.2 Å²	58.2	60%	0.604	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.2	176.6	-24.2	35.7	0	0	0	114.9	R621 L623	R621-P625 WeakPolarHBondContact O-CD 3.45Å; L623-P625 VanDerWaalsContact C-N 3.33Å
626	V	95.8	Very high	96	Very high	41 Å²	41	61.2 Å²	61.2	25%	0.248	35%	0.354	C	S	.	.	S	Bend	trans	-118	119	-178.1	-179.4	0	0	0	0	109.8	P522 A526 L623 L624 G628 A629	P522-V626 HydrophobicContact CB-CG2 4.44Å; P522-V626 WeakPolarHBondContact O-CG2 3.47Å; A526-V626 HydrophobicContact CB-CB 3.88Å; A526-V626 HydrophobicContact CB-CG1 4.38Å; A526-V626 HydrophobicContact CB-CG2 3.57Å; L623-V626 PolarHBondContact O-N 3.48Å; L623-V626 VanDerWaalsContact O-N 3.09Å; L623-V626 VanDerWaalsContact O-O 3.13Å; L624-V626 PolarHBondContact O-N 3.21Å; V626-G628 PolarHBondContact O-N 3.08Å; V626-A629 HydrophobicContact CB-CB 3.99Å; V626-A629 HydrophobicContact CG1-CB 4.09Å; V626-A629 WeakPolarHBondContact O-CB 3.1Å; V626-A629 PolarHBondContact O-N 3.27Å; V626-A629 VanDerWaalsContact O-N 3.16Å
627	D	93.5	Very high	96	Very high	163 Å²	163	59.1 Å²	59.1	87%	0.872	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	130	-177.5	-69.4	-28.1	0	0	0	112.1	A629	D627-A629 PolarHBondContact O-N 3.22Å; D627-A629 VanDerWaalsContact O-N 3.14Å
628	G	94.5	Very high	96	Very high	52 Å²	52	57.9 Å²	57.9	54%	0.536	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-15.2	178.3	0	0	0	0	0	115.7	V626 H630 A631 A632	V626-G628 PolarHBondContact O-N 3.08Å; G628-H630 PolarHBondContact O-N 3.47Å; G628-A631 PolarHBondContact O-N 3.01Å; G628-A632 WeakPolarHBondContact O-CB 3.45Å; G628-A632 PolarHBondContact O-N 3.24Å
629	A	95.7	Very high	96.1	Very high	15 Å²	15	60.3 Å²	60.3	12%	0.124	35%	0.347	C	S	.	.	H	α-helix	trans	-62.7	-45.4	-178.2	0	0	0	0	0	112.1	A526 L623 V626 D627 A632 S633	A526-A629 HydrophobicContact CB-CB 4.28Å; L623-A629 HydrophobicContact CB-CB 4.3Å; L623-A629 HydrophobicContact CD2-CB 4.34Å; V626-A629 HydrophobicContact CB-CB 3.99Å; V626-A629 HydrophobicContact CG1-CB 4.09Å; V626-A629 WeakPolarHBondContact O-CB 3.1Å; V626-A629 PolarHBondContact O-N 3.27Å; V626-A629 VanDerWaalsContact O-N 3.16Å; D627-A629 PolarHBondContact O-N 3.22Å; D627-A629 VanDerWaalsContact O-N 3.14Å; A629-A632 PolarHBondContact O-N 3.49Å; A629-S633 PolarHBondContact O-N 2.84Å; A629-S633 VanDerWaalsContact O-N 3.08Å; A629-S633 PolarHBondContact O-OG 2.88Å
630	H	96.3	Very high	95.9	Very high	58 Å²	58	61.1 Å²	61.1	27%	0.269	35%	0.353	S	S	.	.	H	α-helix	trans	-59.6	-49.7	176.3	178.8	89.2	0	0	0	112.1	F615 S620 L623 L624 G628 A632 S633 C634	F615-H630 AromaticContact CE1-CE1 3.52Å; F615-H630 AromaticContact CZ-CE1 3.66Å; F615-H630 AromaticContact CZ-ND1 3.79Å; S620-H630 PolarHBondContact OG-CE1 3.2Å; S620-H630 PolarHBondContact OG-ND1 2.99Å; L623-H630 HydrophobicContact CB-CB 4.14Å; L624-H630 HydrophobicContact CD2-CB 4.4Å; G628-H630 PolarHBondContact O-N 3.47Å; H630-A632 VanDerWaalsContact C-N 3.34Å; H630-A632 PolarHBondContact O-N 3.36Å; H630-S633 PolarHBondContact O-N 3.26Å; H630-C634 PolarHBondContact O-N 3.43Å; H630-C634 PolarHBondContact O-SG 2.84Å
631	A	96.6	Very high	95.7	Very high	63 Å²	63	60.9 Å²	60.9	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-42.7	-179.4	0	0	0	0	0	111.9	G628 S633 C634 E635	G628-A631 PolarHBondContact O-N 3.01Å; A631-S633 VanDerWaalsContact C-N 3.32Å; A631-S633 PolarHBondContact O-N 3.35Å; A631-C634 WeakPolarHBondContact O-CB 3.43Å; A631-C634 PolarHBondContact O-N 3.16Å; A631-E635 PolarHBondContact O-N 3.44Å
632	A	96.2	Very high	95.7	Very high	26 Å²	26	55.7 Å²	55.7	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-63.7	-36.1	177.2	0	0	0	0	0	112.3	G628 A629 H630 E635 E636	G628-A632 WeakPolarHBondContact O-CB 3.45Å; G628-A632 PolarHBondContact O-N 3.24Å; A629-A632 PolarHBondContact O-N 3.49Å; H630-A632 VanDerWaalsContact C-N 3.34Å; H630-A632 PolarHBondContact O-N 3.36Å; A632-E635 PolarHBondContact O-N 3.01Å; A632-E636 VanDerWaalsContact O-CG 3.29Å; A632-E636 WeakPolarHBondContact O-CG 3.42Å; A632-E636 PolarHBondContact O-N 2.92Å; A632-E636 VanDerWaalsContact O-N 3.09Å
633	S	96.8	Very high	95.5	Very high	0 Å²	0	60 Å²	60	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-70.1	-33.4	174.2	-71.4	0	0	0	0	113.3	K530 L623 A629 H630 A631 M637	K530-S633 WeakPolarHBondContact CG-OG 3.36Å; L623-S633 VanDerWaalsContact CD1-OG 3.26Å; L623-S633 WeakPolarHBondContact CD1-OG 3.45Å; A629-S633 PolarHBondContact O-N 2.84Å; A629-S633 VanDerWaalsContact O-N 3.08Å; A629-S633 PolarHBondContact O-OG 2.88Å; H630-S633 PolarHBondContact O-N 3.26Å; A631-S633 VanDerWaalsContact C-N 3.32Å; A631-S633 PolarHBondContact O-N 3.35Å; S633-M637 WeakPolarHBondContact O-CB 3.34Å; S633-M637 PolarHBondContact O-N 3.49Å
634	C	96.3	Very high	95.4	Very high	49 Å²	49	60.2 Å²	60.2	33%	0.331	36%	0.359	S	S	.	.	H	α-helix	trans	-65.3	-40.8	172.6	-68.9	0	0	0	0	111.9	F615 H630 A631 M637 S638	F615-C634 WeakPolarHBondContact CE1-SG 3.36Å; F615-C634 WeakPolarHBondContact CZ-SG 3.32Å; H630-C634 PolarHBondContact O-N 3.43Å; H630-C634 PolarHBondContact O-SG 2.84Å; A631-C634 WeakPolarHBondContact O-CB 3.43Å; A631-C634 PolarHBondContact O-N 3.16Å; C634-M637 WeakPolarHBondContact O-CB 3.38Å; C634-M637 PolarHBondContact O-N 3.35Å; C634-S638 PolarHBondContact O-N 3.14Å
635	E	96.6	Very high	95.5	Very high	140 Å²	140	60.8 Å²	60.8	65%	0.654	36%	0.359	S	S	*	.	H	α-helix	trans	-64.5	-43.3	176.3	-173.3	177.1	-175.9	0	0	111.9	A631 A632 M637 S638 T639	A631-E635 PolarHBondContact O-N 3.44Å; A632-E635 PolarHBondContact O-N 3.01Å; E635-M637 VanDerWaalsContact C-N 3.33Å; E635-M637 PolarHBondContact O-N 2.73Å; E635-S638 PolarHBondContact O-N 3Å; E635-T639 WeakPolarHBondContact O-CB 3.43Å; E635-T639 PolarHBondContact O-N 3.33Å; E635-T639 PolarHBondContact O-OG1 3.3Å
636	E	95.3	Very high	95.6	Very high	78 Å²	78	58.7 Å²	58.7	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-60.2	-41.8	173.1	-73	-72.6	173.6	0	0	111.8	L537 A632 T639 A640	L537-E636 HydrophobicContact CD1-CB 4.24Å; A632-E636 VanDerWaalsContact O-CG 3.29Å; A632-E636 WeakPolarHBondContact O-CG 3.42Å; A632-E636 PolarHBondContact O-N 2.92Å; A632-E636 VanDerWaalsContact O-N 3.09Å; E636-T639 PolarHBondContact O-N 3.3Å; E636-A640 WeakPolarHBondContact O-CB 3.42Å; E636-A640 PolarHBondContact O-N 3.04Å
637	M	96.9	Very high	95.6	Very high	16 Å²	16	57 Å²	57	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-47.9	175.6	-176.4	-174	-51.8	0	0	111.7	F533 L537 Q612 F615 S633 C634 E635 T639 A640 L641	F533-M637 HydrophobicContact CE1-CE 3.65Å; F533-M637 HydrophobicContact CZ-CE 3.54Å; L537-M637 HydrophobicContact CD1-CB 4.03Å; L537-M637 HydrophobicContact CD2-CB 4.05Å; L537-M637 HydrophobicContact CD2-CG 3.8Å; Q612-M637 HydrophobicContact CG-SD 3.97Å; F615-M637 HydrophobicContact CB-CE 3.57Å; F615-M637 HydrophobicContact CD1-CE 3.79Å; F615-M637 HydrophobicContact CD2-CE 3.72Å; F615-M637 HydrophobicContact CE1-CE 4.4Å; F615-M637 HydrophobicContact CE2-CE 4.35Å; F615-M637 HydrophobicContact CG-CE 3.4Å; S633-M637 WeakPolarHBondContact O-CB 3.34Å; S633-M637 PolarHBondContact O-N 3.49Å; C634-M637 WeakPolarHBondContact O-CB 3.38Å; C634-M637 PolarHBondContact O-N 3.35Å; E635-M637 VanDerWaalsContact C-N 3.33Å; E635-M637 PolarHBondContact O-N 2.73Å; M637-T639 VanDerWaalsContact C-N 3.31Å; M637-T639 PolarHBondContact O-N 2.98Å; M637-A640 PolarHBondContact O-N 3.33Å; M637-L641 HydrophobicContact CG-CD1 3.96Å; M637-L641 HydrophobicContact CG-CG 4.5Å; M637-L641 WeakPolarHBondContact O-CB 3.29Å; M637-L641 VanDerWaalsContact O-CG 3.3Å; M637-L641 WeakPolarHBondContact O-CG 3.41Å; M637-L641 PolarHBondContact O-N 3.43Å
638	S	95.9	Very high	95.8	Very high	75 Å²	75	50 Å²	50	52%	0.524	30%	0.304	S	S	.	.	H	α-helix	trans	-61.4	-42.3	177.8	-179.1	0	0	0	0	111.3	C634 E635 L641 S642	C634-S638 PolarHBondContact O-N 3.14Å; E635-S638 PolarHBondContact O-N 3Å; S638-L641 PolarHBondContact O-N 2.78Å; S638-S642 PolarHBondContact O-N 3.28Å
639	T	96.1	Very high	96	Very high	80 Å²	80	55.5 Å²	55.5	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-45.1	178.2	-58	0	0	0	0	111.5	E635 E636 M637 L641 S642	E635-T639 WeakPolarHBondContact O-CB 3.43Å; E635-T639 PolarHBondContact O-N 3.33Å; E635-T639 PolarHBondContact O-OG1 3.3Å; E636-T639 PolarHBondContact O-N 3.3Å; M637-T639 VanDerWaalsContact C-N 3.31Å; M637-T639 PolarHBondContact O-N 2.98Å; T639-L641 VanDerWaalsContact C-N 3.35Å; T639-L641 PolarHBondContact O-N 3.13Å; T639-S642 PolarHBondContact O-N 3.44Å; T639-S642 PolarHBondContact O-OG 3.24Å
640	A	93.8	Very high	96	Very high	17 Å²	17	60.8 Å²	60.8	14%	0.14	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-40.7	177.9	0	0	0	0	0	112	L537 S541 E636 M637	L537-A640 HydrophobicContact CB-CB 3.93Å; S541-A640 WeakPolarHBondContact CB-O 3.08Å; S541-A640 PolarHBondContact OG-O 2.79Å; E636-A640 WeakPolarHBondContact O-CB 3.42Å; E636-A640 PolarHBondContact O-N 3.04Å; M637-A640 PolarHBondContact O-N 3.33Å
641	L	94.5	Very high	96.1	Very high	13 Å²	13	58 Å²	58	7%	0.068	32%	0.317	C	S	.	.	H	α-helix	trans	-77	-23.8	-177.8	-65.8	178.8	0	0	0	113.9	I544 V608 M637 S638 T639 K643 A644 E645	I544-L641 HydrophobicContact CD1-CD2 4.19Å; V608-L641 HydrophobicContact CG1-CD1 3.67Å; V608-L641 HydrophobicContact CG2-CD1 4.35Å; V608-L641 HydrophobicContact CG2-CD2 3.74Å; M637-L641 HydrophobicContact CG-CD1 3.96Å; M637-L641 HydrophobicContact CG-CG 4.5Å; M637-L641 WeakPolarHBondContact O-CB 3.29Å; M637-L641 VanDerWaalsContact O-CG 3.3Å; M637-L641 WeakPolarHBondContact O-CG 3.41Å; M637-L641 PolarHBondContact O-N 3.43Å; S638-L641 PolarHBondContact O-N 2.78Å; T639-L641 VanDerWaalsContact C-N 3.35Å; T639-L641 PolarHBondContact O-N 3.13Å; L641-K643 PolarHBondContact O-N 2.83Å; L641-K643 VanDerWaalsContact O-N 3.09Å; L641-A644 WeakPolarHBondContact O-CB 3.26Å; L641-A644 PolarHBondContact O-N 3.1Å; L641-E645 PolarHBondContact O-N 3.49Å
642	S	96.1	Very high	96.2	Very high	54 Å²	54	56.3 Å²	56.3	38%	0.378	30%	0.3	S	S	.	.	H	α-helix	trans	-55.1	-30.8	179	72.3	0	0	0	0	114.4	S638 T639 A646	S638-S642 PolarHBondContact O-N 3.28Å; T639-S642 PolarHBondContact O-N 3.44Å; T639-S642 PolarHBondContact O-OG 3.24Å; S642-A646 WeakPolarHBondContact O-CB 3.32Å; S642-A646 PolarHBondContact O-N 2.86Å
643	K	92.1	Very high	96.3	Very high	119 Å²	119	57.6 Å²	57.6	52%	0.517	30%	0.301	S	S	.	.	H	α-helix	trans	-66.1	-45.2	176.2	-65	177.8	-175	169.4	0	111.7	L641 A646 A647	L641-K643 PolarHBondContact O-N 2.83Å; L641-K643 VanDerWaalsContact O-N 3.09Å; K643-A646 PolarHBondContact O-N 2.76Å; K643-A647 PolarHBondContact O-N 3.47Å
644	A	95.5	Very high	96.3	Very high	4 Å²	4	59 Å²	59	3%	0.033	31%	0.308	C	S	.	.	H	α-helix	trans	-67.1	-40.2	177.8	0	0	0	0	0	111	I544 T545 L548 L641 A646 A647 A648	I544-A644 HydrophobicContact CD1-CB 3.61Å; I544-A644 HydrophobicContact CG1-CB 3.64Å; T545-A644 PolarHBondContact OG1-N 3.33Å; L548-A644 HydrophobicContact CD1-CB 4.42Å; L548-A644 WeakPolarHBondContact CD1-O 3.4Å; L641-A644 WeakPolarHBondContact O-CB 3.26Å; L641-A644 PolarHBondContact O-N 3.1Å; A644-A646 PolarHBondContact O-N 3.37Å; A644-A647 PolarHBondContact O-N 3.4Å; A644-A648 WeakPolarHBondContact O-CB 3.46Å; A644-A648 PolarHBondContact O-N 3.49Å
645	E	96.2	Very high	96.4	Very high	120 Å²	120	56.7 Å²	56.7	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-58.8	-46	173.5	-68.2	173.2	179.2	0	0	111.7	L641 A647 A648 Y649	L641-E645 PolarHBondContact O-N 3.49Å; E645-A647 VanDerWaalsContact C-N 3.35Å; E645-A647 PolarHBondContact O-N 3.45Å; E645-A648 PolarHBondContact O-N 3.05Å; E645-Y649 WeakPolarHBondContact O-CB 3.5Å; E645-Y649 PolarHBondContact O-N 2.75Å
646	A	97.1	Very high	96.5	Very high	49 Å²	49	50.3 Å²	50.3	41%	0.405	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-38	177.3	0	0	0	0	0	112.6	S642 K643 A644 K650	S642-A646 WeakPolarHBondContact O-CB 3.32Å; S642-A646 PolarHBondContact O-N 2.86Å; K643-A646 PolarHBondContact O-N 2.76Å; A644-A646 PolarHBondContact O-N 3.37Å; A646-K650 WeakPolarHBondContact O-CG 3.36Å; A646-K650 PolarHBondContact O-N 3.21Å; A646-K650 VanDerWaalsContact O-N 3.17Å
647	A	96.6	Very high	96.6	Very high	6 Å²	6	51 Å²	51	5%	0.05	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-44.9	175	0	0	0	0	0	111.8	T545 L548 E549 K643 A644 E645 K650 G651	T545-A647 HydrophobicContact CG2-CB 4.19Å; L548-A647 HydrophobicContact CB-CB 4.12Å; L548-A647 HydrophobicContact CD1-CB 4.25Å; E549-A647 HydrophobicContact CG-CB 4.42Å; K643-A647 PolarHBondContact O-N 3.47Å; A644-A647 PolarHBondContact O-N 3.4Å; E645-A647 VanDerWaalsContact C-N 3.35Å; E645-A647 PolarHBondContact O-N 3.45Å; A647-K650 PolarHBondContact O-N 3.37Å; A647-G651 PolarHBondContact O-N 3.24Å
648	A	97.4	Very high	96.6	Very high	16 Å²	16	50.4 Å²	50.4	13%	0.132	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-48.1	176.3	0	0	0	0	0	111.3	L548 A644 E645 K650 G651 L652	L548-A648 HydrophobicContact CD1-CB 4.03Å; A644-A648 WeakPolarHBondContact O-CB 3.46Å; A644-A648 PolarHBondContact O-N 3.49Å; E645-A648 PolarHBondContact O-N 3.05Å; A648-K650 PolarHBondContact O-N 2.72Å; A648-G651 PolarHBondContact O-N 3.24Å; A648-L652 WeakPolarHBondContact O-CB 3.48Å; A648-L652 WeakPolarHBondContact O-CG 3.37Å; A648-L652 PolarHBondContact O-N 3.35Å
649	Y	97.2	Very high	96.7	Very high	167 Å²	167	46.8 Å²	46.8	66%	0.655	24%	0.238	S	C	*	.	H	α-helix	trans	-57.4	-48.4	178	176.6	-102.3	0	0	0	112.3	E645 G651 L652 Q653	E645-Y649 WeakPolarHBondContact O-CB 3.5Å; E645-Y649 PolarHBondContact O-N 2.75Å; Y649-G651 VanDerWaalsContact C-N 3.35Å; Y649-G651 PolarHBondContact O-N 3.02Å; Y649-L652 PolarHBondContact O-N 3.33Å; Y649-Q653 WeakPolarHBondContact O-CB 3.38Å; Y649-Q653 PolarHBondContact O-N 3.41Å
650	K	97.5	Very high	96.8	Very high	126 Å²	126	43.9 Å²	43.9	55%	0.548	22%	0.218	S	C	.	.	H	α-helix	trans	-60.5	-42.4	177.5	-74.3	175.4	-177	175.9	0	112.2	A646 A647 A648 Q653 Q654	A646-K650 WeakPolarHBondContact O-CG 3.36Å; A646-K650 PolarHBondContact O-N 3.21Å; A646-K650 VanDerWaalsContact O-N 3.17Å; A647-K650 PolarHBondContact O-N 3.37Å; A648-K650 PolarHBondContact O-N 2.72Å; K650-Q653 WeakPolarHBondContact O-CB 3.5Å; K650-Q653 PolarHBondContact O-N 3.03Å; K650-Q654 PolarHBondContact O-N 3.45Å; K650-Q654 VanDerWaalsContact O-N 3.13Å
651	G	97.7	Very high	96.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-73.8	-32.8	179.4	0	0	0	0	0	113.7	A647 A648 Y649 Q653 Q654 C655	A647-G651 PolarHBondContact O-N 3.24Å; A648-G651 PolarHBondContact O-N 3.24Å; Y649-G651 VanDerWaalsContact C-N 3.35Å; Y649-G651 PolarHBondContact O-N 3.02Å; G651-Q653 VanDerWaalsContact C-N 3.34Å; G651-Q654 PolarHBondContact O-N 3.42Å; G651-C655 PolarHBondContact O-N 3.47Å; G651-C655 PolarHBondContact O-SG 3.12Å
652	L	98.3	Very high	96.9	Very high	28 Å²	28	44.4 Å²	44.4	15%	0.147	22%	0.223	C	C	.	.	H	α-helix	trans	-63.4	-41.2	171.4	-73.6	175.6	0	0	0	111.5	F597 M598 V601 A648 Y649 Q654 C655 I656 L711 F719	F597-L652 HydrophobicContact CE1-CD2 4.07Å; F597-L652 HydrophobicContact CE1-CG 4.09Å; M598-L652 HydrophobicContact CE-CD2 3.97Å; M598-L652 HydrophobicContact SD-CD2 4.19Å; V601-L652 HydrophobicContact CG2-CD2 4.4Å; A648-L652 WeakPolarHBondContact O-CB 3.48Å; A648-L652 WeakPolarHBondContact O-CG 3.37Å; A648-L652 PolarHBondContact O-N 3.35Å; Y649-L652 PolarHBondContact O-N 3.33Å; L652-Q654 VanDerWaalsContact C-N 3.33Å; L652-Q654 PolarHBondContact O-N 3.2Å; L652-C655 VanDerWaalsContact O-CB 3.32Å; L652-C655 WeakPolarHBondContact O-CB 3.31Å; L652-C655 PolarHBondContact O-N 3.39Å; L652-I656 PolarHBondContact O-N 2.74Å; L652-I656 VanDerWaalsContact O-N 3.08Å; L652-L711 HydrophobicContact CD2-CD1 4.23Å; L652-L711 HydrophobicContact CD2-CD2 4.1Å; L652-F719 HydrophobicContact CB-CD2 4.19Å; L652-F719 HydrophobicContact CB-CE2 4.33Å; L652-F719 HydrophobicContact CD2-CD2 3.96Å; L652-F719 HydrophobicContact CD2-CE2 4Å
653	Q	98.2	Very high	97	Very high	52 Å²	52	41.8 Å²	41.8	24%	0.243	21%	0.205	C	C	.	.	H	α-helix	trans	-58.8	-44.9	173.2	172.6	62.7	25	0	0	111.7	Y649 K650 G651 C655 I656 E657	Y649-Q653 WeakPolarHBondContact O-CB 3.38Å; Y649-Q653 PolarHBondContact O-N 3.41Å; K650-Q653 WeakPolarHBondContact O-CB 3.5Å; K650-Q653 PolarHBondContact O-N 3.03Å; G651-Q653 VanDerWaalsContact C-N 3.34Å; Q653-C655 VanDerWaalsContact C-N 3.33Å; Q653-C655 PolarHBondContact O-N 2.99Å; Q653-I656 WeakPolarHBondContact O-CB 3.38Å; Q653-I656 PolarHBondContact O-N 3.5Å; Q653-E657 PolarHBondContact NE2-OE1 3.42Å; Q653-E657 WeakPolarHBondContact O-CG 3.44Å; Q653-E657 PolarHBondContact O-N 2.96Å; Q653-E657 VanDerWaalsContact O-N 3.1Å
654	Q	97.7	Very high	97.2	Very high	31 Å²	31	39 Å²	39	15%	0.145	20%	0.196	C	C	.	.	H	α-helix	trans	-69	-30.2	176.9	-166.6	173.9	14.3	0	0	112.9	L555 S556 K650 G651 L652 E657 T658	L555-Q654 HydrophobicContact CB-CG 4.06Å; L555-Q654 HydrophobicContact CD1-CB 4.37Å; L555-Q654 HydrophobicContact CD1-CG 4.45Å; S556-Q654 PolarHBondContact OG-NE2 3.49Å; K650-Q654 PolarHBondContact O-N 3.45Å; K650-Q654 VanDerWaalsContact O-N 3.13Å; G651-Q654 PolarHBondContact O-N 3.42Å; L652-Q654 VanDerWaalsContact C-N 3.33Å; L652-Q654 PolarHBondContact O-N 3.2Å; Q654-E657 PolarHBondContact O-N 3.43Å; Q654-T658 WeakPolarHBondContact O-CB 3.47Å; Q654-T658 PolarHBondContact O-N 2.91Å; Q654-T658 PolarHBondContact O-OG1 3.29Å
655	C	98.2	Very high	97	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-45.9	171	-76	0	0	0	0	111.1	L555 F594 F597 M598 G651 L652 Q653 E657 T658 V659 F719	L555-C655 VanDerWaalsContact CD1-SG 3.56Å; F594-C655 HydrophobicContact CD2-CB 3.57Å; F594-C655 HydrophobicContact CE2-CB 3.63Å; F597-C655 WeakPolarHBondContact CD1-SG 3.42Å; M598-C655 HydrophobicContact CE-CB 4.08Å; G651-C655 PolarHBondContact O-N 3.47Å; G651-C655 PolarHBondContact O-SG 3.12Å; L652-C655 VanDerWaalsContact O-CB 3.32Å; L652-C655 WeakPolarHBondContact O-CB 3.31Å; L652-C655 PolarHBondContact O-N 3.39Å; Q653-C655 VanDerWaalsContact C-N 3.33Å; Q653-C655 PolarHBondContact O-N 2.99Å; C655-E657 VanDerWaalsContact C-N 3.34Å; C655-E657 PolarHBondContact O-N 3.16Å; C655-T658 WeakPolarHBondContact O-CB 3.37Å; C655-T658 PolarHBondContact O-N 3.32Å; C655-V659 WeakPolarHBondContact O-CG2 3.47Å; C655-V659 PolarHBondContact O-N 3.41Å; C655-F719 HydrophobicContact CB-CE2 4.28Å; C655-F719 HydrophobicContact CB-CZ 4.45Å
656	I	98.4	Very high	97	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-59.9	-45.7	175.1	-66	176.9	0	0	0	110.4	L652 Q653 T658 V659 M660 F719 E722 L723 R726	L652-I656 PolarHBondContact O-N 2.74Å; L652-I656 VanDerWaalsContact O-N 3.08Å; Q653-I656 WeakPolarHBondContact O-CB 3.38Å; Q653-I656 PolarHBondContact O-N 3.5Å; I656-T658 VanDerWaalsContact C-N 3.3Å; I656-T658 PolarHBondContact O-N 3.44Å; I656-V659 PolarHBondContact O-N 2.94Å; I656-M660 HydrophobicContact CG2-CG 4.2Å; I656-M660 WeakPolarHBondContact O-CB 3.46Å; I656-M660 VanDerWaalsContact O-CG 3.26Å; I656-M660 WeakPolarHBondContact O-CG 3.48Å; I656-M660 PolarHBondContact O-N 3.48Å; I656-F719 HydrophobicContact CD1-CD2 3.94Å; I656-F719 HydrophobicContact CD1-CE2 3.94Å; I656-F719 HydrophobicContact CG1-CD2 4Å; I656-F719 HydrophobicContact CG1-CE2 3.46Å; I656-F719 VanDerWaalsContact CG1-CE2 3.46Å; I656-F719 HydrophobicContact CG1-CZ 3.82Å; I656-E722 HydrophobicContact CD1-CB 4Å; I656-E722 HydrophobicContact CD1-CG 3.74Å; I656-L723 HydrophobicContact CB-CD1 4.41Å; I656-L723 HydrophobicContact CG1-CD1 4.26Å; I656-L723 HydrophobicContact CG2-CD1 4.01Å; I656-R726 HydrophobicContact CG2-CG 4.46Å
657	E	97.3	Very high	97	Very high	94 Å²	94	33.3 Å²	33.3	44%	0.439	16%	0.158	S	C	.	.	H	α-helix	trans	-60.3	-40.1	177.1	-70.4	164.8	-167.3	0	0	112.2	Q653 Q654 C655 M660 A661	Q653-E657 PolarHBondContact NE2-OE1 3.42Å; Q653-E657 WeakPolarHBondContact O-CG 3.44Å; Q653-E657 PolarHBondContact O-N 2.96Å; Q653-E657 VanDerWaalsContact O-N 3.1Å; Q654-E657 PolarHBondContact O-N 3.43Å; C655-E657 VanDerWaalsContact C-N 3.34Å; C655-E657 PolarHBondContact O-N 3.16Å; E657-M660 PolarHBondContact O-N 2.88Å; E657-A661 VanDerWaalsContact O-CB 3.26Å; E657-A661 WeakPolarHBondContact O-CB 3.47Å; E657-A661 PolarHBondContact O-N 2.97Å
658	T	96.6	Very high	96.8	Very high	2 Å²	2	36 Å²	36	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-63.2	-45.1	177.7	-61.4	0	0	0	0	111.7	L555 R562 Q654 C655 I656 E662	L555-T658 HydrophobicContact CD2-CG2 4.48Å; R562-T658 PolarHBondContact NH2-O 3.15Å; Q654-T658 WeakPolarHBondContact O-CB 3.47Å; Q654-T658 PolarHBondContact O-N 2.91Å; Q654-T658 PolarHBondContact O-OG1 3.29Å; C655-T658 WeakPolarHBondContact O-CB 3.37Å; C655-T658 PolarHBondContact O-N 3.32Å; I656-T658 VanDerWaalsContact C-N 3.3Å; I656-T658 PolarHBondContact O-N 3.44Å; T658-E662 PolarHBondContact O-N 3.35Å
659	V	97.9	Very high	96.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-45.8	177.2	176.9	0	0	0	0	110.5	F594 C655 I656 A661 E662 V663 Y699 L700 V703 L723	F594-V659 HydrophobicContact CD2-CG2 3.67Å; F594-V659 HydrophobicContact CE2-CG2 3.45Å; F594-V659 VanDerWaalsContact CE2-CG2 3.45Å; F594-V659 HydrophobicContact CZ-CG2 4.18Å; C655-V659 WeakPolarHBondContact O-CG2 3.47Å; C655-V659 PolarHBondContact O-N 3.41Å; I656-V659 PolarHBondContact O-N 2.94Å; V659-A661 PolarHBondContact O-N 3.38Å; V659-E662 PolarHBondContact O-N 2.92Å; V659-V663 HydrophobicContact CG1-CG2 4.46Å; V659-V663 WeakPolarHBondContact O-CG2 3.39Å; V659-V663 PolarHBondContact O-N 3.48Å; V659-Y699 HydrophobicContact CG1-CE1 3.96Å; V659-L700 HydrophobicContact CG1-CD2 3.47Å; V659-L700 VanDerWaalsContact CG1-CD2 3.47Å; V659-V703 HydrophobicContact CG1-CG1 4.25Å; V659-V703 HydrophobicContact CG2-CG1 4.22Å; V659-V703 HydrophobicContact CG2-CG2 4.21Å; V659-L723 HydrophobicContact CB-CD1 4.3Å; V659-L723 HydrophobicContact CG1-CD1 4.15Å
660	M	97.8	Very high	96.3	Very high	18 Å²	18	32.7 Å²	32.7	9%	0.089	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-37.5	-178.8	-69.8	-62.4	100.4	0	0	112.8	I656 E657 E662 V663 D664 L723 R726 L727 L730	I656-M660 HydrophobicContact CG2-CG 4.2Å; I656-M660 WeakPolarHBondContact O-CB 3.46Å; I656-M660 VanDerWaalsContact O-CG 3.26Å; I656-M660 WeakPolarHBondContact O-CG 3.48Å; I656-M660 PolarHBondContact O-N 3.48Å; E657-M660 PolarHBondContact O-N 2.88Å; M660-E662 VanDerWaalsContact C-N 3.28Å; M660-E662 PolarHBondContact O-N 3.39Å; M660-V663 HydrophobicContact CE-CG2 4.21Å; M660-V663 PolarHBondContact O-N 2.89Å; M660-D664 PolarHBondContact O-N 3.21Å; M660-L723 HydrophobicContact CE-CD1 3.63Å; M660-L723 HydrophobicContact CE-CG 4.28Å; M660-R726 HydrophobicContact CG-CB 3.91Å; M660-R726 HydrophobicContact SD-CB 3.79Å; M660-L727 HydrophobicContact CE-CB 4.25Å; M660-L727 HydrophobicContact CE-CD1 4.42Å; M660-L727 HydrophobicContact SD-CB 4.28Å; M660-L730 HydrophobicContact SD-CD2 4.16Å
661	A	95.4	Very high	96.1	Very high	34 Å²	34	27.4 Å²	27.4	28%	0.281	15%	0.15	S	C	.	.	H	α-helix	trans	-63.4	-35.8	175.2	0	0	0	0	0	112.2	E657 V659 R665	E657-A661 VanDerWaalsContact O-CB 3.26Å; E657-A661 WeakPolarHBondContact O-CB 3.47Å; E657-A661 PolarHBondContact O-N 2.97Å; V659-A661 PolarHBondContact O-N 3.38Å; A661-R665 WeakPolarHBondContact O-CB 3.44Å; A661-R665 PolarHBondContact O-N 3.46Å; A661-R665 VanDerWaalsContact O-N 3.12Å
662	E	95.7	Very high	95.9	Very high	7 Å²	7	34 Å²	34	3%	0.033	18%	0.179	C	C	.	.	H	α-helix	trans	-73.8	-38.6	175.8	-179.3	55.4	-164	0	0	112.3	A587 T658 V659 M660 R665 L666 Y699	A587-E662 VanDerWaalsContact CB-CD 3.43Å; A587-E662 HydrophobicContact CB-CG 4.42Å; A587-E662 WeakPolarHBondContact CB-OE1 3.45Å; A587-E662 VanDerWaalsContact CB-OE2 3.24Å; A587-E662 WeakPolarHBondContact CB-OE2 3.14Å; T658-E662 PolarHBondContact O-N 3.35Å; V659-E662 PolarHBondContact O-N 2.92Å; M660-E662 VanDerWaalsContact C-N 3.28Å; M660-E662 PolarHBondContact O-N 3.39Å; E662-R665 WeakPolarHBondContact O-CB 3.45Å; E662-R665 PolarHBondContact O-N 3.13Å; E662-R665 IonicContact OE1-CZ 3.85Å; E662-R665 VanDerWaalsContact OE1-CZ 3.32Å; E662-R665 IonicContact OE1-NE 3.64Å; E662-R665 PolarHBondContact OE1-NE 3.08Å; E662-R665 IonicContact OE1-NH2 3.88Å; E662-R665 PolarHBondContact OE1-NH2 2.93Å; E662-R665 IonicContact OE2-CZ 3.57Å; E662-R665 IonicContact OE2-NE 3.46Å; E662-R665 PolarHBondContact OE2-NE 3.07Å; E662-R665 IonicContact OE2-NH2 3.79Å; E662-L666 HydrophobicContact CG-CD1 4.35Å; E662-L666 WeakPolarHBondContact O-CG 3.26Å; E662-L666 PolarHBondContact O-N 3.34Å; E662-Y699 HydrophobicContact CB-CE1 3.77Å; E662-Y699 HydrophobicContact CB-CE2 4.43Å; E662-Y699 HydrophobicContact CG-CD1 4.07Å; E662-Y699 HydrophobicContact CG-CD2 4.1Å; E662-Y699 HydrophobicContact CG-CE1 3.57Å; E662-Y699 HydrophobicContact CG-CE2 3.64Å; E662-Y699 HydrophobicContact CG-CG 4.31Å
663	V	97.6	Very high	95.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-46	172.4	174.6	0	0	0	0	111.1	V659 M660 R665 L666 L667 V696 Y699 L700 L727 L730	V659-V663 HydrophobicContact CG1-CG2 4.46Å; V659-V663 WeakPolarHBondContact O-CG2 3.39Å; V659-V663 PolarHBondContact O-N 3.48Å; M660-V663 HydrophobicContact CE-CG2 4.21Å; M660-V663 PolarHBondContact O-N 2.89Å; V663-R665 VanDerWaalsContact C-N 3.3Å; V663-R665 PolarHBondContact O-N 3.48Å; V663-L666 PolarHBondContact O-N 2.89Å; V663-L667 HydrophobicContact CG1-CD1 3.83Å; V663-L667 HydrophobicContact CG1-CG 4.22Å; V663-L667 WeakPolarHBondContact O-CB 3.47Å; V663-L667 VanDerWaalsContact O-CG 3.26Å; V663-L667 WeakPolarHBondContact O-CG 3.33Å; V663-L667 PolarHBondContact O-N 3.25Å; V663-V696 HydrophobicContact CG1-CG1 3.77Å; V663-V696 HydrophobicContact CG1-CG2 4.2Å; V663-V696 HydrophobicContact CG2-CG1 4.19Å; V663-Y699 HydrophobicContact CG2-CD1 4.14Å; V663-Y699 HydrophobicContact CG2-CE1 4.2Å; V663-L700 HydrophobicContact CG2-CD1 4.44Å; V663-L700 HydrophobicContact CG2-CD2 3.77Å; V663-L700 HydrophobicContact CG2-CG 4.14Å; V663-L727 HydrophobicContact CG1-CD1 3.96Å; V663-L730 HydrophobicContact CB-CD2 3.9Å; V663-L730 HydrophobicContact CG1-CD2 3.64Å
664	D	96	Very high	95	Very high	60 Å²	60	38.9 Å²	38.9	32%	0.321	22%	0.217	S	C	.	.	H	α-helix	trans	-62.4	-38.6	178.2	-174.6	48.9	0	0	0	112	M660 S668 L730	M660-D664 PolarHBondContact O-N 3.21Å; D664-S668 VanDerWaalsContact O-CB 3.23Å; D664-S668 WeakPolarHBondContact O-CB 3.47Å; D664-S668 PolarHBondContact O-N 3.32Å; D664-S668 PolarHBondContact O-OG 3.18Å; D664-L730 HydrophobicContact CB-CD1 3.83Å; D664-L730 HydrophobicContact CB-CD2 4.14Å
665	R	93	Very high	94.6	Very high	48 Å²	48	38.2 Å²	38.2	18%	0.181	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-52.3	173.9	-172.5	-166.9	72.8	89.7	-7.9	111.2	E584 A661 E662 V663 L667 S668 S669	E584-R665 IonicContact OE1-CZ 2.79Å; E584-R665 VanDerWaalsContact OE1-CZ 3.3Å; E584-R665 IonicContact OE1-NH1 2.78Å; E584-R665 PolarHBondContact OE1-NH1 3.38Å; E584-R665 IonicContact OE1-NH2 3.64Å; E584-R665 PolarHBondContact OE1-NH2 2.78Å; E584-R665 IonicContact OE2-NH2 2.85Å; A661-R665 WeakPolarHBondContact O-CB 3.44Å; A661-R665 PolarHBondContact O-N 3.46Å; A661-R665 VanDerWaalsContact O-N 3.12Å; E662-R665 WeakPolarHBondContact O-CB 3.45Å; E662-R665 PolarHBondContact O-N 3.13Å; E662-R665 IonicContact OE1-CZ 3.85Å; E662-R665 VanDerWaalsContact OE1-CZ 3.32Å; E662-R665 IonicContact OE1-NE 3.64Å; E662-R665 PolarHBondContact OE1-NE 3.08Å; E662-R665 IonicContact OE1-NH2 3.88Å; E662-R665 PolarHBondContact OE1-NH2 2.93Å; E662-R665 IonicContact OE2-CZ 3.57Å; E662-R665 IonicContact OE2-NE 3.46Å; E662-R665 PolarHBondContact OE2-NE 3.07Å; E662-R665 IonicContact OE2-NH2 3.79Å; V663-R665 VanDerWaalsContact C-N 3.3Å; V663-R665 PolarHBondContact O-N 3.48Å; R665-L667 VanDerWaalsContact C-N 3.35Å; R665-L667 PolarHBondContact O-N 2.98Å; R665-S668 PolarHBondContact O-N 3.03Å; R665-S668 VanDerWaalsContact O-N 3.17Å; R665-S669 WeakPolarHBondContact O-CB 3.35Å; R665-S669 PolarHBondContact O-N 3.41Å; R665-S669 PolarHBondContact O-OG 2.79Å
666	L	95.3	Very high	94.3	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-59.6	-45.3	-179.8	-73.3	173.2	0	0	0	111.6	E662 V663 S668 S669 E670 V696 Y699	E662-L666 HydrophobicContact CG-CD1 4.35Å; E662-L666 WeakPolarHBondContact O-CG 3.26Å; E662-L666 PolarHBondContact O-N 3.34Å; V663-L666 PolarHBondContact O-N 2.89Å; L666-S668 VanDerWaalsContact C-N 3.35Å; L666-S668 PolarHBondContact O-N 3.32Å; L666-S669 PolarHBondContact O-N 2.95Å; L666-S669 PolarHBondContact O-OG 3.4Å; L666-E670 WeakPolarHBondContact O-CB 3.25Å; L666-E670 WeakPolarHBondContact O-CG 3.22Å; L666-E670 PolarHBondContact O-N 3.33Å; L666-V696 HydrophobicContact CB-CG2 3.95Å; L666-V696 HydrophobicContact CD1-CG2 4.46Å; L666-Y699 HydrophobicContact CD1-CD1 4.17Å; L666-Y699 HydrophobicContact CD1-CG 3.97Å
667	L	96.8	Very high	93.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-47.4	174.6	-73.5	174.2	0	0	0	110.9	V663 R665 S669 Q671 A692 V696 L730 L731 H734	V663-L667 HydrophobicContact CG1-CD1 3.83Å; V663-L667 HydrophobicContact CG1-CG 4.22Å; V663-L667 WeakPolarHBondContact O-CB 3.47Å; V663-L667 VanDerWaalsContact O-CG 3.26Å; V663-L667 WeakPolarHBondContact O-CG 3.33Å; V663-L667 PolarHBondContact O-N 3.25Å; R665-L667 VanDerWaalsContact C-N 3.35Å; R665-L667 PolarHBondContact O-N 2.98Å; L667-S669 PolarHBondContact O-N 2.9Å; L667-Q671 WeakPolarHBondContact O-CB 3.38Å; L667-Q671 PolarHBondContact O-N 3.24Å; L667-Q671 VanDerWaalsContact O-N 3.14Å; L667-A692 HydrophobicContact CD2-CB 4.41Å; L667-V696 HydrophobicContact CD2-CG2 3.89Å; L667-V696 HydrophobicContact CG-CG2 3.93Å; L667-L730 HydrophobicContact CD1-CG 4.33Å; L667-L731 HydrophobicContact CD1-CD2 3.98Å; L667-L731 HydrophobicContact CD2-CD2 4.31Å; L667-H734 VanDerWaalsContact C-CE1 3.43Å; L667-H734 HydrophobicContact CD1-CB 4.12Å; L667-H734 PolarHBondContact O-CE1 3.43Å; L667-H734 VanDerWaalsContact O-CE1 3.27Å
668	S	93.1	Very high	92.5	Very high	64 Å²	64	41.2 Å²	41.2	45%	0.448	23%	0.229	S	C	.	.	H	α-helix	trans	-69.4	-30.3	-178.6	-61.8	0	0	0	0	113.8	D664 R665 L666	D664-S668 VanDerWaalsContact O-CB 3.23Å; D664-S668 WeakPolarHBondContact O-CB 3.47Å; D664-S668 PolarHBondContact O-N 3.32Å; D664-S668 PolarHBondContact O-OG 3.18Å; R665-S668 PolarHBondContact O-N 3.03Å; R665-S668 VanDerWaalsContact O-N 3.17Å; L666-S668 VanDerWaalsContact C-N 3.35Å; L666-S668 PolarHBondContact O-N 3.32Å
669	S	90.8	Very high	91.1	Very high	70 Å²	70	45.2 Å²	45.2	49%	0.49	26%	0.255	S	S	.	.	H	α-helix	trans	-88.7	-33.8	-179.2	61.1	0	0	0	0	114	R665 L666 L667	R665-S669 WeakPolarHBondContact O-CB 3.35Å; R665-S669 PolarHBondContact O-N 3.41Å; R665-S669 PolarHBondContact O-OG 2.79Å; L666-S669 PolarHBondContact O-N 2.95Å; L666-S669 PolarHBondContact O-OG 3.4Å; L667-S669 PolarHBondContact O-N 2.9Å
670	E	93	Very high	89	Confident	43 Å²	43	52.1 Å²	52.1	20%	0.201	29%	0.291	C	S	.	.	H	α-helix	trans	-100.5	-21.5	-171.3	-60.8	-69.3	171.2	0	0	113.3	L666 N691 A692 R695	L666-E670 WeakPolarHBondContact O-CB 3.25Å; L666-E670 WeakPolarHBondContact O-CG 3.22Å; L666-E670 PolarHBondContact O-N 3.33Å; E670-N691 PolarHBondContact OE2-ND2 3.14Å; E670-A692 HydrophobicContact CB-CB 3.91Å; E670-R695 VanDerWaalsContact CD-NH1 3.32Å; E670-R695 HydrophobicContact CG-CG 4.46Å; E670-R695 IonicContact OE1-CZ 2.73Å; E670-R695 IonicContact OE1-NH1 3.24Å; E670-R695 PolarHBondContact OE1-NH1 3.41Å; E670-R695 IonicContact OE1-NH2 3.86Å; E670-R695 PolarHBondContact OE1-NH2 3.44Å; E670-R695 IonicContact OE2-NH1 2.81Å
671	Q	94.5	Very high	86.6	Confident	15 Å²	15	56.7 Å²	56.7	7%	0.07	32%	0.316	C	S	.	.			trans	-85.2	114.5	-179.1	-164.9	81.8	79.6	0	0	110.9	L667 D675 Y676 T690 A692 F738	L667-Q671 WeakPolarHBondContact O-CB 3.38Å; L667-Q671 PolarHBondContact O-N 3.24Å; L667-Q671 VanDerWaalsContact O-N 3.14Å; Q671-D675 PolarHBondContact NE2-OD2 3.3Å; Q671-Y676 VanDerWaalsContact CD-OH 3.31Å; Q671-Y676 HydrophobicContact CG-CE2 3.94Å; Q671-Y676 PolarHBondContact OE1-OH 3.02Å; Q671-T690 VanDerWaalsContact NE2-CB 3.32Å; Q671-T690 PolarHBondContact NE2-OG1 3.32Å; Q671-A692 HydrophobicContact CB-CB 3.8Å; Q671-A692 HydrophobicContact CG-CB 4.41Å; Q671-F738 HydrophobicContact CB-CE1 4.47Å; Q671-F738 HydrophobicContact CB-CZ 3.89Å; Q671-F738 HydrophobicContact CG-CE1 3.68Å; Q671-F738 HydrophobicContact CG-CE2 4.06Å; Q671-F738 HydrophobicContact CG-CZ 3.32Å
672	K	92.1	Very high	84.6	Confident	139 Å²	139	59.4 Å²	59.4	60%	0.604	35%	0.348	S	S	*	.			trans	-82.7	145.2	179.1	-59.1	175.8	-177.1	173.4	0	110.4	T674 D675 F738	K672-T674 PolarHBondContact O-N 2.87Å; K672-D675 PolarHBondContact N-OD2 2.95Å; K672-D675 WeakPolarHBondContact O-CB 3.49Å; K672-D675 PolarHBondContact O-N 3.36Å; K672-F738 WeakPolarHBondContact O-CE1 3.17Å
673	S	88	Confident	82.5	Confident	96 Å²	96	66.2 Å²	66.2	67%	0.671	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.3	176.5	57	0	0	0	0	114
674	T	89.2	Confident	80.5	Confident	86 Å²	86	70.6 Å²	70.6	53%	0.528	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-10.3	177.4	54.7	0	0	0	0	114.1	K672 Y676 R677	K672-T674 PolarHBondContact O-N 2.87Å; T674-Y676 PolarHBondContact O-N 3.04Å; T674-Y676 VanDerWaalsContact O-N 3.12Å; T674-R677 CarbonylContact O-C 3.53Å; T674-R677 PolarHBondContact O-N 3.47Å
675	D	89.4	Confident	78.8	Confident	16 Å²	16	70.7 Å²	70.7	9%	0.086	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.5	-173	-76.7	-23.4	0	0	0	112.6	Q671 K672 T690 R747	Q671-D675 PolarHBondContact NE2-OD2 3.3Å; K672-D675 PolarHBondContact N-OD2 2.95Å; K672-D675 WeakPolarHBondContact O-CB 3.49Å; K672-D675 PolarHBondContact O-N 3.36Å; D675-T690 HydrophobicContact CB-CG2 4.07Å; D675-R747 VanDerWaalsContact O-CD 3.29Å; D675-R747 WeakPolarHBondContact O-CD 3.47Å; D675-R747 PolarHBondContact O-NH1 3.47Å; D675-R747 IonicContact OD1-NH1 3.25Å
676	Y	92	Very high	77.6	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	10.2	178.1	-53	-62.2	0	0	0	114.1	Q671 T674 T690 W735 F738 F740 N741 G744 L748 D751	Q671-Y676 VanDerWaalsContact CD-OH 3.31Å; Q671-Y676 HydrophobicContact CG-CE2 3.94Å; Q671-Y676 PolarHBondContact OE1-OH 3.02Å; T674-Y676 PolarHBondContact O-N 3.04Å; T674-Y676 VanDerWaalsContact O-N 3.12Å; Y676-T690 HydrophobicContact CE1-CG2 4.25Å; Y676-W735 PolarHBondContact OH-NE1 2.85Å; Y676-F738 HydrophobicContact CD2-CB 3.9Å; Y676-F738 AromaticContact CD2-CD1 3.73Å; Y676-F738 HydrophobicContact CD2-CD1 3.73Å; Y676-F738 HydrophobicContact CD2-CD2 4.34Å; Y676-F738 HydrophobicContact CD2-CE1 4.37Å; Y676-F738 AromaticContact CD2-CG 3.72Å; Y676-F738 HydrophobicContact CD2-CG 3.72Å; Y676-F738 HydrophobicContact CE2-CD1 4.17Å; Y676-F738 HydrophobicContact CE2-CD2 4.25Å; Y676-F738 HydrophobicContact CE2-CE1 4.44Å; Y676-F738 HydrophobicContact CE2-CG 4.07Å; Y676-F740 VanDerWaalsContact CB-CD1 3.47Å; Y676-F740 HydrophobicContact CD1-CD1 4.04Å; Y676-F740 AromaticContact CD1-CE1 3.58Å; Y676-F740 HydrophobicContact CD1-CE1 3.58Å; Y676-F740 HydrophobicContact CD2-CD1 4.46Å; Y676-F740 AromaticContact CD2-CE1 3.67Å; Y676-F740 HydrophobicContact CD2-CE1 3.67Å; Y676-F740 AromaticContact CD2-CZ 3.95Å; Y676-F740 HydrophobicContact CD2-CZ 3.95Å; Y676-F740 HydrophobicContact CE1-CE1 4.14Å; Y676-F740 HydrophobicContact CE2-CE1 4.23Å; Y676-F740 HydrophobicContact CE2-CZ 4.4Å; Y676-F740 AromaticContact CG-CD1 3.75Å; Y676-F740 HydrophobicContact CG-CD1 3.75Å; Y676-F740 AromaticContact CG-CE1 3.31Å; Y676-F740 HydrophobicContact CG-CE1 3.31Å; Y676-F740 HydrophobicContact CG-CZ 4.06Å; Y676-F740 WeakPolarHBondContact O-CA 3.43Å; Y676-N741 PolarHBondContact O-N 3.31Å; Y676-N741 VanDerWaalsContact O-N 3.16Å; Y676-N741 PolarHBondContact O-OD1 3.28Å; Y676-G744 WeakPolarHBondContact O-CA 3.41Å; Y676-L748 HydrophobicContact CD1-CB 4.22Å; Y676-L748 HydrophobicContact CE1-CB 3.98Å; Y676-L748 HydrophobicContact CE1-CD1 4.26Å; Y676-D751 PolarHBondContact OH-OD2 3.3Å
677	R	86.2	Confident	76.6	Confident	118 Å²	118	77.4 Å²	77.4	45%	0.445	46%	0.459	S	S	.	.			trans	-130.7	56.8	172	-65.9	-169.3	-175.9	167.7	4.5	110.3	T674 P679 T739	T674-R677 CarbonylContact O-C 3.53Å; T674-R677 PolarHBondContact O-N 3.47Å; R677-P679 WeakPolarHBondContact O-CD 3.43Å; R677-T739 WeakPolarHBondContact CG-O 3.49Å; R677-T739 VanDerWaalsContact NE-CB 3.29Å; R677-T739 VanDerWaalsContact NH2-CG2 3.31Å; R677-T739 PolarHBondContact NH2-OG1 2.88Å
678	S	72	Confident	76.1	Confident	45 Å²	45	85.3 Å²	85.3	32%	0.315	49%	0.489	S	S	.	.			trans	-62.5	127.7	173.7	-171.1	0	0	0	0	108.5	D680 N741	S678-D680 PolarHBondContact O-N 3.11Å; S678-N741 PolarHBondContact O-ND2 3.42Å
679	P	66.4	Low	76.1	Confident	86 Å²	86	83.2 Å²	83.2	56%	0.558	47%	0.474	S	S	*	.			trans	-54.1	134.1	169.6	-20.9	31.7	0	0	0	108.6	R677 D681	R677-P679 WeakPolarHBondContact O-CD 3.43Å; P679-D681 PolarHBondContact O-N 3.43Å
680	D	55.2	Low	76.2	Confident	144 Å²	144	79.9 Å²	79.9	77%	0.77	45%	0.451	S	S	*	.			trans	-75.6	45.6	174.2	-153.5	27.7	0	0	0	109.8	S678	S678-D680 PolarHBondContact O-N 3.11Å
681	D	47.9	Very low	76.3	Confident	115 Å²	115	81.7 Å²	81.7	62%	0.615	46%	0.462	S	S	*	.			trans	-77.9	123.6	169.8	-71	-29.8	0	0	0	105.2	P679 I683	P679-D681 PolarHBondContact O-N 3.43Å; D681-I683 PolarHBondContact O-N 3.44Å
682	G	51.9	Low	76.4	Confident	91 Å²	91	81 Å²	81	94%	0.938	46%	0.458	S	S	*	.	S	Bend	trans	-60	26	-171.9	0	0	0	0	0	117.6
683	I	52	Low	76.6	Confident	149 Å²	149	74.4 Å²	74.4	76%	0.764	43%	0.43	S	S	*	.	S	Bend	trans	-92.3	120.3	168.8	-56.6	171.4	0	0	0	106.9	D681 S685	D681-I683 PolarHBondContact O-N 3.44Å; I683-S685 PolarHBondContact O-N 3.39Å
684	A	56	Low	77.1	Confident	93 Å²	93	73.9 Å²	73.9	77%	0.769	42%	0.419	S	S	*	.			trans	-16.7	116.9	-178.2	0	0	0	0	0	115.2	D686	A684-D686 PolarHBondContact O-N 3.45Å
685	S	61	Low	77.4	Confident	62 Å²	62	74.1 Å²	74.1	43%	0.434	41%	0.41	S	S	.	.			trans	-52.4	123.4	174.7	22.4	0	0	0	0	110.1	I683 H687	I683-S685 PolarHBondContact O-N 3.39Å; S685-H687 PolarHBondContact O-CD2 3.38Å; S685-H687 PolarHBondContact O-N 3.18Å; S685-H687 PolarHBondContact O-NE2 2.88Å; S685-H687 PolarHBondContact OG-CE1 3.27Å; S685-H687 PolarHBondContact OG-NE2 3.43Å
686	D	67.1	Low	77.9	Confident	60 Å²	60	73.3 Å²	73.3	32%	0.321	41%	0.406	S	S	.	.			trans	-67.8	97.4	176.7	-172.6	0.9	0	0	0	109.2	A684 R688 R747	A684-D686 PolarHBondContact O-N 3.45Å; D686-R688 PolarHBondContact O-N 2.98Å; D686-R688 WeakPolarHBondContact OD1-CB 3.35Å; D686-R688 IonicContact OD1-CZ 3.83Å; D686-R688 PolarHBondContact OD1-N 3.31Å; D686-R688 IonicContact OD1-NE 3.83Å; D686-R688 PolarHBondContact OD1-NE 3.01Å; D686-R688 IonicContact OD1-NH2 3.19Å; D686-R688 PolarHBondContact OD1-NH2 2.68Å; D686-R688 IonicContact OD2-CZ 2.76Å; D686-R688 IonicContact OD2-NE 2.72Å; D686-R688 IonicContact OD2-NH2 3.38Å; D686-R688 PolarHBondContact OD2-NH2 3.21Å; D686-R747 IonicContact OD2-NH2 3.3Å; D686-R747 PolarHBondContact OD2-NH2 2.88Å
687	H	73.2	Confident	78.1	Confident	133 Å²	133	74.5 Å²	74.5	62%	0.616	41%	0.413	S	S	*	.			trans	-79.7	5.7	-176.6	-62.6	-56	0	0	0	114.2	S685	S685-H687 PolarHBondContact O-CD2 3.38Å; S685-H687 PolarHBondContact O-N 3.18Å; S685-H687 PolarHBondContact O-NE2 2.88Å; S685-H687 PolarHBondContact OG-CE1 3.27Å; S685-H687 PolarHBondContact OG-NE2 3.43Å
688	R	87.4	Confident	78.7	Confident	167 Å²	167	71.6 Å²	71.6	63%	0.63	41%	0.414	S	S	*	.	S	Bend	trans	-80.9	148.9	179.8	-65.2	174.6	-62.8	171	6.6	111.3	D686 R747	D686-R688 PolarHBondContact O-N 2.98Å; D686-R688 WeakPolarHBondContact OD1-CB 3.35Å; D686-R688 IonicContact OD1-CZ 3.83Å; D686-R688 PolarHBondContact OD1-N 3.31Å; D686-R688 IonicContact OD1-NE 3.83Å; D686-R688 PolarHBondContact OD1-NE 3.01Å; D686-R688 IonicContact OD1-NH2 3.19Å; D686-R688 PolarHBondContact OD1-NH2 2.68Å; D686-R688 IonicContact OD2-CZ 2.76Å; D686-R688 IonicContact OD2-NE 2.72Å; D686-R688 IonicContact OD2-NH2 3.38Å; D686-R688 PolarHBondContact OD2-NH2 3.21Å; R688-R747 PolarHBondContact O-NE 2.9Å
689	P	91.8	Very high	79.9	Confident	20 Å²	20	69.9 Å²	69.9	13%	0.13	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-57.2	152.7	169.9	25.2	-31.9	0	0	0	110.5	C693 I694 R750 D751 E754	P689-C693 HydrophobicContact CB-CB 4.36Å; P689-I694 HydrophobicContact CB-CG1 4.26Å; P689-I694 HydrophobicContact CG-CD1 4.1Å; P689-I694 HydrophobicContact CG-CG1 3.87Å; P689-R750 HydrophobicContact CB-CG 4.2Å; P689-D751 WeakPolarHBondContact CA-OD1 3.41Å; P689-D751 VanDerWaalsContact CB-OD1 3.29Å; P689-D751 WeakPolarHBondContact CB-OD1 3.25Å; P689-E754 HydrophobicContact CB-CG 3.87Å; P689-E754 HydrophobicContact CG-CG 4Å
690	T	94.4	Very high	81.4	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-65.7	154.6	179.7	66	0	0	0	0	110.7	Q671 D675 Y676 A692 C693 I694 R747 D751	Q671-T690 VanDerWaalsContact NE2-CB 3.32Å; Q671-T690 PolarHBondContact NE2-OG1 3.32Å; D675-T690 HydrophobicContact CB-CG2 4.07Å; Y676-T690 HydrophobicContact CE1-CG2 4.25Å; T690-A692 PolarHBondContact O-N 3.28Å; T690-C693 WeakPolarHBondContact O-CB 3.47Å; T690-C693 PolarHBondContact O-N 3.27Å; T690-C693 VanDerWaalsContact O-N 3.13Å; T690-C693 PolarHBondContact OG1-N 3.18Å; T690-I694 WeakPolarHBondContact O-CG1 3.41Å; T690-I694 PolarHBondContact O-N 3.16Å; T690-R747 HydrophobicContact CG2-CG 4.12Å; T690-D751 WeakPolarHBondContact CB-OD2 3.33Å; T690-D751 WeakPolarHBondContact CG2-OD2 3.48Å; T690-D751 PolarHBondContact N-OD1 3.45Å; T690-D751 PolarHBondContact OG1-OD2 2.78Å
691	N	94.7	Very high	83.4	Confident	81 Å²	81	61.6 Å²	61.6	43%	0.433	36%	0.356	S	S	.	.	H	α-helix	trans	-59.4	-36.2	177.9	-167.3	54.7	0	0	0	111.5	E670 I694 R695	E670-N691 PolarHBondContact OE2-ND2 3.14Å; N691-I694 PolarHBondContact O-N 3.23Å; N691-R695 WeakPolarHBondContact O-CB 3.35Å; N691-R695 WeakPolarHBondContact O-CG 3.49Å; N691-R695 PolarHBondContact O-N 2.94Å
692	A	96	Very high	85.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59.3	-48.7	174.4	0	0	0	0	0	111.8	L667 E670 Q671 T690 I694 R695 V696	L667-A692 HydrophobicContact CD2-CB 4.41Å; E670-A692 HydrophobicContact CB-CB 3.91Å; Q671-A692 HydrophobicContact CB-CB 3.8Å; Q671-A692 HydrophobicContact CG-CB 4.41Å; T690-A692 PolarHBondContact O-N 3.28Å; A692-I694 PolarHBondContact O-N 3.45Å; A692-R695 PolarHBondContact O-N 2.92Å; A692-V696 WeakPolarHBondContact O-CB 3.41Å; A692-V696 VanDerWaalsContact O-CG2 3.26Å; A692-V696 WeakPolarHBondContact O-CG2 3.47Å; A692-V696 PolarHBondContact O-N 3.45Å
693	C	97.4	Very high	87.8	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58	-50.7	176.7	178.7	0	0	0	0	112.1	P689 T690 R695 V696 V697 D751 Y755	P689-C693 HydrophobicContact CB-CB 4.36Å; T690-C693 WeakPolarHBondContact O-CB 3.47Å; T690-C693 PolarHBondContact O-N 3.27Å; T690-C693 VanDerWaalsContact O-N 3.13Å; T690-C693 PolarHBondContact OG1-N 3.18Å; C693-R695 VanDerWaalsContact C-N 3.32Å; C693-R695 PolarHBondContact O-N 3.07Å; C693-V696 PolarHBondContact O-N 3.49Å; C693-V697 WeakPolarHBondContact O-CG2 3.41Å; C693-V697 PolarHBondContact O-N 3.21Å; C693-D751 HydrophobicContact CB-CB 3.9Å; C693-D751 VanDerWaalsContact CB-CG 3.44Å; C693-D751 WeakPolarHBondContact CB-OD1 3.5Å; C693-Y755 WeakPolarHBondContact CA-OH 3.37Å; C693-Y755 HydrophobicContact CB-CE2 4.3Å
694	I	97.2	Very high	89.9	Confident	86 Å²	86	50.3 Å²	50.3	44%	0.441	27%	0.267	S	S	.	.	H	α-helix	trans	-56.5	-46.6	178.8	-64	169.1	0	0	0	110.8	P689 T690 N691 A692 A698	P689-I694 HydrophobicContact CB-CG1 4.26Å; P689-I694 HydrophobicContact CG-CD1 4.1Å; P689-I694 HydrophobicContact CG-CG1 3.87Å; T690-I694 WeakPolarHBondContact O-CG1 3.41Å; T690-I694 PolarHBondContact O-N 3.16Å; N691-I694 PolarHBondContact O-N 3.23Å; A692-I694 PolarHBondContact O-N 3.45Å; I694-A698 VanDerWaalsContact O-CB 3.24Å; I694-A698 WeakPolarHBondContact O-CB 3.47Å; I694-A698 PolarHBondContact O-N 3.05Å
695	R	97	Very high	91.8	Very high	90 Å²	90	51.9 Å²	51.9	34%	0.34	26%	0.258	S	S	.	.	H	α-helix	trans	-68	-39.3	-178.3	-68.5	-72.8	-69.5	-72.2	-4.5	112.3	E670 N691 A692 C693 Y699	E670-R695 VanDerWaalsContact CD-NH1 3.32Å; E670-R695 HydrophobicContact CG-CG 4.46Å; E670-R695 IonicContact OE1-CZ 2.73Å; E670-R695 IonicContact OE1-NH1 3.24Å; E670-R695 PolarHBondContact OE1-NH1 3.41Å; E670-R695 IonicContact OE1-NH2 3.86Å; E670-R695 PolarHBondContact OE1-NH2 3.44Å; E670-R695 IonicContact OE2-NH1 2.81Å; N691-R695 WeakPolarHBondContact O-CB 3.35Å; N691-R695 WeakPolarHBondContact O-CG 3.49Å; N691-R695 PolarHBondContact O-N 2.94Å; A692-R695 PolarHBondContact O-N 2.92Å; C693-R695 VanDerWaalsContact C-N 3.32Å; C693-R695 PolarHBondContact O-N 3.07Å; R695-Y699 WeakPolarHBondContact O-CB 3.39Å; R695-Y699 PolarHBondContact O-N 2.72Å
696	V	98.2	Very high	93.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-48.8	176.1	170.9	0	0	0	0	111	V663 L666 L667 A692 C693 A698 Y699 L700 Y755	V663-V696 HydrophobicContact CG1-CG1 3.77Å; V663-V696 HydrophobicContact CG1-CG2 4.2Å; V663-V696 HydrophobicContact CG2-CG1 4.19Å; L666-V696 HydrophobicContact CB-CG2 3.95Å; L666-V696 HydrophobicContact CD1-CG2 4.46Å; L667-V696 HydrophobicContact CD2-CG2 3.89Å; L667-V696 HydrophobicContact CG-CG2 3.93Å; A692-V696 WeakPolarHBondContact O-CB 3.41Å; A692-V696 VanDerWaalsContact O-CG2 3.26Å; A692-V696 WeakPolarHBondContact O-CG2 3.47Å; A692-V696 PolarHBondContact O-N 3.45Å; C693-V696 PolarHBondContact O-N 3.49Å; V696-A698 VanDerWaalsContact C-N 3.33Å; V696-A698 PolarHBondContact O-N 3.02Å; V696-Y699 PolarHBondContact O-N 3.31Å; V696-L700 HydrophobicContact CG1-CD1 3.81Å; V696-L700 HydrophobicContact CG1-CG 4.25Å; V696-L700 WeakPolarHBondContact O-CB 3.44Å; V696-L700 WeakPolarHBondContact O-CG 3.48Å; V696-L700 PolarHBondContact O-N 3.45Å; V696-Y755 HydrophobicContact CB-CE1 4.11Å; V696-Y755 HydrophobicContact CG1-CE1 3.7Å
697	V	98	Very high	94.8	Very high	25 Å²	25	47 Å²	47	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-41.9	179.3	173.3	0	0	0	0	110.9	C693 Y699 L700 S701 E754 Y755 F758	C693-V697 WeakPolarHBondContact O-CG2 3.41Å; C693-V697 PolarHBondContact O-N 3.21Å; V697-Y699 PolarHBondContact O-N 2.83Å; V697-L700 PolarHBondContact O-N 3.05Å; V697-S701 WeakPolarHBondContact O-CB 3.26Å; V697-S701 PolarHBondContact O-N 3.47Å; V697-S701 PolarHBondContact O-OG 2.65Å; V697-E754 HydrophobicContact CG2-CB 4.41Å; V697-Y755 HydrophobicContact CG2-CD1 3.88Å; V697-Y755 HydrophobicContact CG2-CE1 4Å; V697-F758 HydrophobicContact CG1-CB 4.22Å; V697-F758 HydrophobicContact CG1-CD2 4.36Å; V697-F758 HydrophobicContact CG1-CG 4.39Å
698	A	97.4	Very high	95.9	Very high	56 Å²	56	43.1 Å²	43.1	46%	0.463	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-40.6	175.9	0	0	0	0	0	112.5	I694 V696 R702	I694-A698 VanDerWaalsContact O-CB 3.24Å; I694-A698 WeakPolarHBondContact O-CB 3.47Å; I694-A698 PolarHBondContact O-N 3.05Å; V696-A698 VanDerWaalsContact C-N 3.33Å; V696-A698 PolarHBondContact O-N 3.02Å; A698-R702 WeakPolarHBondContact O-CB 3.41Å; A698-R702 PolarHBondContact O-N 2.72Å
699	Y	96.9	Very high	96.2	Very high	10 Å²	10	39.5 Å²	39.5	4%	0.039	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-52.4	174.4	168.8	-108.6	0	0	0	111.6	V659 E662 V663 L666 R695 V696 V697 S701 R702 V703	V659-Y699 HydrophobicContact CG1-CE1 3.96Å; E662-Y699 HydrophobicContact CB-CE1 3.77Å; E662-Y699 HydrophobicContact CB-CE2 4.43Å; E662-Y699 HydrophobicContact CG-CD1 4.07Å; E662-Y699 HydrophobicContact CG-CD2 4.1Å; E662-Y699 HydrophobicContact CG-CE1 3.57Å; E662-Y699 HydrophobicContact CG-CE2 3.64Å; E662-Y699 HydrophobicContact CG-CG 4.31Å; V663-Y699 HydrophobicContact CG2-CD1 4.14Å; V663-Y699 HydrophobicContact CG2-CE1 4.2Å; L666-Y699 HydrophobicContact CD1-CD1 4.17Å; L666-Y699 HydrophobicContact CD1-CG 3.97Å; R695-Y699 WeakPolarHBondContact O-CB 3.39Å; R695-Y699 PolarHBondContact O-N 2.72Å; V696-Y699 PolarHBondContact O-N 3.31Å; V697-Y699 PolarHBondContact O-N 2.83Å; Y699-S701 VanDerWaalsContact C-N 3.35Å; Y699-S701 PolarHBondContact O-N 2.85Å; Y699-R702 PolarHBondContact O-N 2.96Å; Y699-R702 VanDerWaalsContact O-N 3.15Å; Y699-V703 HydrophobicContact CD1-CG1 4.37Å; Y699-V703 HydrophobicContact CE1-CG1 3.96Å; Y699-V703 HydrophobicContact CE2-CB 4.05Å; Y699-V703 HydrophobicContact CE2-CG1 4.16Å; Y699-V703 WeakPolarHBondContact O-CG1 3.28Å; Y699-V703 PolarHBondContact O-N 2.97Å
700	L	98.1	Very high	96.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-44.2	-178.6	-71.8	175.7	0	0	0	111.8	V659 V663 V696 V697 R702 V703 L704 L727 F758	V659-L700 HydrophobicContact CG1-CD2 3.47Å; V659-L700 VanDerWaalsContact CG1-CD2 3.47Å; V663-L700 HydrophobicContact CG2-CD1 4.44Å; V663-L700 HydrophobicContact CG2-CD2 3.77Å; V663-L700 HydrophobicContact CG2-CG 4.14Å; V696-L700 HydrophobicContact CG1-CD1 3.81Å; V696-L700 HydrophobicContact CG1-CG 4.25Å; V696-L700 WeakPolarHBondContact O-CB 3.44Å; V696-L700 WeakPolarHBondContact O-CG 3.48Å; V696-L700 PolarHBondContact O-N 3.45Å; V697-L700 PolarHBondContact O-N 3.05Å; L700-R702 VanDerWaalsContact C-N 3.26Å; L700-R702 PolarHBondContact O-N 3.24Å; L700-V703 PolarHBondContact O-N 3.24Å; L700-L704 HydrophobicContact CD2-CD1 4.45Å; L700-L704 VanDerWaalsContact O-CB 3.22Å; L700-L704 WeakPolarHBondContact O-CB 3.45Å; L700-L704 VanDerWaalsContact O-CG 3.25Å; L700-L704 WeakPolarHBondContact O-CG 3.39Å; L700-L704 PolarHBondContact O-N 2.94Å; L700-L727 HydrophobicContact CD1-CD1 4.27Å; L700-L727 HydrophobicContact CD1-CD2 3.87Å; L700-F758 HydrophobicContact CB-CD1 4.29Å; L700-F758 HydrophobicContact CB-CE1 3.46Å; L700-F758 VanDerWaalsContact CB-CE1 3.46Å; L700-F758 HydrophobicContact CB-CE2 4.33Å; L700-F758 HydrophobicContact CB-CZ 3.49Å; L700-F758 VanDerWaalsContact CB-CZ 3.49Å; L700-F758 HydrophobicContact CD1-CD1 4.19Å; L700-F758 HydrophobicContact CD1-CE1 3.85Å; L700-F758 HydrophobicContact CG-CE1 4.24Å
701	S	96.9	Very high	96.5	Very high	56 Å²	56	39.3 Å²	39.3	39%	0.392	21%	0.206	S	C	.	.	H	α-helix	trans	-58	-41	177.3	-56.7	0	0	0	0	112	V697 Y699 E705 F758	V697-S701 WeakPolarHBondContact O-CB 3.26Å; V697-S701 PolarHBondContact O-N 3.47Å; V697-S701 PolarHBondContact O-OG 2.65Å; Y699-S701 VanDerWaalsContact C-N 3.35Å; Y699-S701 PolarHBondContact O-N 2.85Å; S701-E705 PolarHBondContact O-N 3.41Å; S701-F758 WeakPolarHBondContact OG-CD2 3.29Å; S701-F758 VanDerWaalsContact OG-CE2 3.26Å; S701-F758 WeakPolarHBondContact OG-CE2 3.08Å
702	R	96.2	Very high	96.4	Very high	118 Å²	118	42.2 Å²	42.2	45%	0.445	22%	0.217	S	C	.	.	H	α-helix	trans	-79.6	-37.3	-176.9	-175.5	171.2	59.2	80.8	15	113.9	E591 A698 Y699 L700	E591-R702 IonicContact OE1-CZ 3.35Å; E591-R702 IonicContact OE1-NH1 2.87Å; E591-R702 PolarHBondContact OE1-NH1 3.43Å; E591-R702 IonicContact OE2-CZ 2.85Å; E591-R702 IonicContact OE2-NH1 3.83Å; E591-R702 PolarHBondContact OE2-NH1 3.05Å; E591-R702 IonicContact OE2-NH2 3.82Å; E591-R702 PolarHBondContact OE2-NH2 3.21Å; A698-R702 WeakPolarHBondContact O-CB 3.41Å; A698-R702 PolarHBondContact O-N 2.72Å; Y699-R702 PolarHBondContact O-N 2.96Å; Y699-R702 VanDerWaalsContact O-N 3.15Å; L700-R702 VanDerWaalsContact C-N 3.26Å; L700-R702 PolarHBondContact O-N 3.24Å
703	V	96	Very high	96.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-79.1	-38.7	179.4	69.6	0	0	0	0	111.6	E591 F594 V659 Y699 L700 E705 S706	E591-V703 HydrophobicContact CG-CB 4.32Å; E591-V703 HydrophobicContact CG-CG2 3.94Å; F594-V703 HydrophobicContact CB-CG2 4.36Å; F594-V703 HydrophobicContact CD1-CG2 3.59Å; F594-V703 HydrophobicContact CD2-CG2 4.43Å; F594-V703 HydrophobicContact CE1-CG2 3.9Å; F594-V703 WeakPolarHBondContact CE1-O 3.49Å; F594-V703 HydrophobicContact CG-CG2 3.89Å; F594-V703 HydrophobicContact CZ-CG2 4.42Å; V659-V703 HydrophobicContact CG1-CG1 4.25Å; V659-V703 HydrophobicContact CG2-CG1 4.22Å; V659-V703 HydrophobicContact CG2-CG2 4.21Å; Y699-V703 HydrophobicContact CD1-CG1 4.37Å; Y699-V703 HydrophobicContact CE1-CG1 3.96Å; Y699-V703 HydrophobicContact CE2-CB 4.05Å; Y699-V703 HydrophobicContact CE2-CG1 4.16Å; Y699-V703 WeakPolarHBondContact O-CG1 3.28Å; Y699-V703 PolarHBondContact O-N 2.97Å; L700-V703 PolarHBondContact O-N 3.24Å; V703-E705 VanDerWaalsContact C-N 3.3Å; V703-E705 PolarHBondContact O-N 2.93Å; V703-S706 PolarHBondContact O-OG 2.91Å; V703-S706 VanDerWaalsContact O-OG 3.1Å
704	L	97.3	Very high	96.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-78.4	-13	-176.9	-61.4	-176.4	0	0	0	113.5	F594 L700 S706 A707 F708 L723 F758 F762	F594-L704 HydrophobicContact CZ-CD2 3.94Å; L700-L704 HydrophobicContact CD2-CD1 4.45Å; L700-L704 VanDerWaalsContact O-CB 3.22Å; L700-L704 WeakPolarHBondContact O-CB 3.45Å; L700-L704 VanDerWaalsContact O-CG 3.25Å; L700-L704 WeakPolarHBondContact O-CG 3.39Å; L700-L704 PolarHBondContact O-N 2.94Å; L704-S706 PolarHBondContact O-N 3.26Å; L704-A707 CarbonylContact O-C 3.47Å; L704-A707 WeakPolarHBondContact O-CA 3.48Å; L704-A707 WeakPolarHBondContact O-CB 3.49Å; L704-A707 PolarHBondContact O-N 2.87Å; L704-F708 HydrophobicContact CB-CD2 4.09Å; L704-F708 HydrophobicContact CB-CE2 3.88Å; L704-F708 WeakPolarHBondContact O-CD2 3.43Å; L704-F708 PolarHBondContact O-N 3.27Å; L704-L723 HydrophobicContact CD1-CD2 3.34Å; L704-L723 HydrophobicContact CD2-CD2 3.55Å; L704-L723 HydrophobicContact CG-CD2 4.08Å; L704-F758 HydrophobicContact CD1-CE1 4.06Å; L704-F758 HydrophobicContact CD1-CZ 3.85Å; L704-F762 HydrophobicContact CD1-CE1 3.7Å; L704-F762 HydrophobicContact CD1-CZ 3.71Å
705	E	96.3	Very high	96	Very high	126 Å²	126	52.7 Å²	52.7	59%	0.589	29%	0.285	S	S	*	.	H	α-helix	trans	-48.8	-45.2	171.9	-173.7	176.7	-171.3	0	0	111.5	S701 V703 A707 F708 T709	S701-E705 PolarHBondContact O-N 3.41Å; V703-E705 VanDerWaalsContact C-N 3.3Å; V703-E705 PolarHBondContact O-N 2.93Å; E705-A707 VanDerWaalsContact C-N 3.34Å; E705-A707 PolarHBondContact O-N 2.93Å; E705-F708 PolarHBondContact O-N 3.12Å; E705-T709 PolarHBondContact O-N 2.77Å; E705-T709 VanDerWaalsContact O-N 3.14Å; E705-T709 PolarHBondContact O-OG1 3.2Å
706	S	94.6	Very high	96	Very high	19 Å²	19	51.4 Å²	51.4	13%	0.133	28%	0.282	C	S	.	.	H	α-helix	trans	-67.6	-31.1	177.3	60.5	0	0	0	0	113.6	F594 V703 L704 T709 A710	F594-S706 WeakPolarHBondContact CE1-OG 3.28Å; V703-S706 PolarHBondContact O-OG 2.91Å; V703-S706 VanDerWaalsContact O-OG 3.1Å; L704-S706 PolarHBondContact O-N 3.26Å; S706-T709 PolarHBondContact O-OG1 3.17Å; S706-T709 VanDerWaalsContact O-OG1 3.13Å; S706-A710 WeakPolarHBondContact O-CB 3.17Å; S706-A710 PolarHBondContact O-N 3.35Å
707	A	96.5	Very high	95.9	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-72.3	-36.6	174.2	0	0	0	0	0	111.5	F594 M598 L704 E705 T709 L711 F719	F594-A707 HydrophobicContact CE1-CB 4.21Å; F594-A707 HydrophobicContact CZ-CB 4Å; M598-A707 HydrophobicContact CE-CB 3.97Å; M598-A707 HydrophobicContact CG-CB 4.48Å; M598-A707 HydrophobicContact SD-CB 4.09Å; L704-A707 CarbonylContact O-C 3.47Å; L704-A707 WeakPolarHBondContact O-CA 3.48Å; L704-A707 WeakPolarHBondContact O-CB 3.49Å; L704-A707 PolarHBondContact O-N 2.87Å; E705-A707 VanDerWaalsContact C-N 3.34Å; E705-A707 PolarHBondContact O-N 2.93Å; A707-T709 VanDerWaalsContact C-N 3.29Å; A707-T709 PolarHBondContact O-N 2.92Å; A707-L711 HydrophobicContact CB-CD1 4.44Å; A707-L711 WeakPolarHBondContact O-CB 3.24Å; A707-L711 PolarHBondContact O-N 3.4Å; A707-L711 VanDerWaalsContact O-N 3.11Å; A707-F719 HydrophobicContact CB-CD1 4.49Å; A707-F719 HydrophobicContact CB-CE1 3.96Å
708	F	96.4	Very high	95.8	Very high	51 Å²	51	58.4 Å²	58.4	22%	0.224	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-33.3	176.4	-78.3	-67.5	0	0	0	112.6	L704 E705 K716 L720 S761 F762	L704-F708 HydrophobicContact CB-CD2 4.09Å; L704-F708 HydrophobicContact CB-CE2 3.88Å; L704-F708 WeakPolarHBondContact O-CD2 3.43Å; L704-F708 PolarHBondContact O-N 3.27Å; E705-F708 PolarHBondContact O-N 3.12Å; F708-K716 PolarHBondContact O-NZ 2.92Å; F708-L720 HydrophobicContact CD1-CD1 4.15Å; F708-L720 HydrophobicContact CE1-CD1 3.63Å; F708-L720 HydrophobicContact CE1-CD2 4.3Å; F708-L720 HydrophobicContact CZ-CD1 4.35Å; F708-L720 HydrophobicContact CZ-CD2 4.3Å; F708-S761 WeakPolarHBondContact CE1-O 3.09Å; F708-F762 AromaticContact CZ-CD1 3.98Å; F708-F762 HydrophobicContact CZ-CD1 3.98Å; F708-F762 HydrophobicContact CZ-CE1 4.25Å
709	T	93.6	Very high	95.9	Very high	91 Å²	91	56.2 Å²	56.2	56%	0.558	30%	0.304	S	S	*	.	H	α-helix	trans	-89.3	-29.9	179.1	57.7	0	0	0	0	113.8	E705 S706 A707	E705-T709 PolarHBondContact O-N 2.77Å; E705-T709 VanDerWaalsContact O-N 3.14Å; E705-T709 PolarHBondContact O-OG1 3.2Å; S706-T709 PolarHBondContact O-OG1 3.17Å; S706-T709 VanDerWaalsContact O-OG1 3.13Å; A707-T709 VanDerWaalsContact C-N 3.29Å; A707-T709 PolarHBondContact O-N 2.92Å
710	A	94.7	Very high	95.9	Very high	8 Å²	8	55.9 Å²	55.9	7%	0.066	30%	0.303	C	S	.	.	H	α-helix	trans	-91.3	-29.8	-174.5	0	0	0	0	0	114.3	M598 Q602 S706	M598-A710 HydrophobicContact CB-CB 3.82Å; M598-A710 WeakPolarHBondContact O-CB 3.18Å; Q602-A710 HydrophobicContact CB-CB 4.12Å; S706-A710 WeakPolarHBondContact O-CB 3.17Å; S706-A710 PolarHBondContact O-N 3.35Å
711	L	96.2	Very high	95.9	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.037	31%	0.314	C	S	.	.			trans	-99.6	142.6	-178.2	-56.3	179.4	0	0	0	110.7	M598 V601 L652 A707 K716 F719	M598-L711 HydrophobicContact CE-CD1 4.41Å; M598-L711 HydrophobicContact SD-CD1 4.14Å; M598-L711 HydrophobicContact SD-CD2 4.25Å; M598-L711 HydrophobicContact SD-CG 4.09Å; V601-L711 HydrophobicContact CG1-CD2 3.77Å; L652-L711 HydrophobicContact CD2-CD1 4.23Å; L652-L711 HydrophobicContact CD2-CD2 4.1Å; A707-L711 HydrophobicContact CB-CD1 4.44Å; A707-L711 WeakPolarHBondContact O-CB 3.24Å; A707-L711 PolarHBondContact O-N 3.4Å; A707-L711 VanDerWaalsContact O-N 3.11Å; L711-K716 HydrophobicContact CB-CB 3.93Å; L711-K716 HydrophobicContact CB-CG 4.32Å; L711-K716 WeakPolarHBondContact O-CD 3.2Å; L711-F719 HydrophobicContact CD1-CB 3.77Å; L711-F719 HydrophobicContact CD1-CD1 3.74Å; L711-F719 HydrophobicContact CD1-CD2 4.06Å; L711-F719 HydrophobicContact CD1-CE1 4.36Å; L711-F719 HydrophobicContact CD1-CG 3.58Å
712	E	92.6	Very high	96	Very high	143 Å²	143	58.3 Å²	58.3	67%	0.668	31%	0.311	S	S	*	.			trans	-130.7	158.6	-176.8	-64.8	179.6	-173.6	0	0	112.4	L714 N715 K716	E712-L714 PolarHBondContact O-N 2.87Å; E712-N715 PolarHBondContact O-N 3.48Å; E712-K716 PolarHBondContact O-N 3.01Å
713	G	94.3	Very high	96.1	Very high	53 Å²	53	52.8 Å²	52.8	55%	0.546	29%	0.29	S	S	.	.	H	α-helix	trans	52.1	-134.3	172.3	0	0	0	0	0	114.8	N715 K716 Q717	G713-N715 VanDerWaalsContact C-N 3.26Å; G713-N715 PolarHBondContact O-N 3.4Å; G713-K716 WeakPolarHBondContact O-CB 3.46Å; G713-K716 PolarHBondContact O-N 3.38Å; G713-Q717 PolarHBondContact O-N 3Å; G713-Q717 VanDerWaalsContact O-N 3.13Å
714	L	94.8	Very high	96.2	Very high	136 Å²	136	52.8 Å²	52.8	71%	0.712	29%	0.29	S	S	*	.	H	α-helix	trans	-64.3	-29.5	-178.1	-62.6	179.8	0	0	0	112.8	E712 Q717 A718	E712-L714 PolarHBondContact O-N 2.87Å; L714-Q717 PolarHBondContact O-N 3.32Å; L714-A718 VanDerWaalsContact O-CB 3.3Å; L714-A718 WeakPolarHBondContact O-CB 3.42Å; L714-A718 PolarHBondContact O-N 3.21Å
715	N	94.4	Very high	96.2	Very high	116 Å²	116	53.8 Å²	53.8	62%	0.62	30%	0.296	S	S	*	.	H	α-helix	trans	-67	-44	177.3	-68.9	-28.8	0	0	0	110.9	E712 G713 A718 F719	E712-N715 PolarHBondContact O-N 3.48Å; G713-N715 VanDerWaalsContact C-N 3.26Å; G713-N715 PolarHBondContact O-N 3.4Å; N715-A718 PolarHBondContact O-N 3.33Å; N715-F719 WeakPolarHBondContact O-CB 3.43Å; N715-F719 PolarHBondContact O-N 3.32Å
716	K	96.2	Very high	96.3	Very high	64 Å²	64	50.3 Å²	50.3	28%	0.278	28%	0.277	S	S	.	.	H	α-helix	trans	-59.9	-48.2	173.7	-174.5	-179.5	-173.8	156.5	0	111.3	F708 L711 E712 G713 A718 F719 L720	F708-K716 PolarHBondContact O-NZ 2.92Å; L711-K716 HydrophobicContact CB-CB 3.93Å; L711-K716 HydrophobicContact CB-CG 4.32Å; L711-K716 WeakPolarHBondContact O-CD 3.2Å; E712-K716 PolarHBondContact O-N 3.01Å; G713-K716 WeakPolarHBondContact O-CB 3.46Å; G713-K716 PolarHBondContact O-N 3.38Å; K716-A718 PolarHBondContact O-N 3.46Å; K716-F719 PolarHBondContact O-N 2.9Å; K716-L720 HydrophobicContact CG-CD1 3.77Å; K716-L720 HydrophobicContact CG-CG 4.46Å; K716-L720 WeakPolarHBondContact O-CB 3.4Å; K716-L720 VanDerWaalsContact O-CG 3.32Å; K716-L720 WeakPolarHBondContact O-CG 3.24Å; K716-L720 PolarHBondContact O-N 3.45Å
717	Q	96.4	Very high	96.5	Very high	108 Å²	108	49.5 Å²	49.5	51%	0.505	27%	0.271	S	S	.	.	H	α-helix	trans	-60.7	-46.4	179.3	-72.8	-176.6	-19.6	0	0	112	G713 L714 T721	G713-Q717 PolarHBondContact O-N 3Å; G713-Q717 VanDerWaalsContact O-N 3.13Å; L714-Q717 PolarHBondContact O-N 3.32Å; Q717-T721 VanDerWaalsContact O-CB 3.23Å; Q717-T721 WeakPolarHBondContact O-CB 3.5Å; Q717-T721 PolarHBondContact O-N 2.97Å; Q717-T721 PolarHBondContact O-OG1 3.43Å
718	A	96.9	Very high	96.5	Very high	63 Å²	63	50.5 Å²	50.5	52%	0.521	28%	0.275	S	S	.	.	H	α-helix	trans	-63.2	-45.6	179.2	0	0	0	0	0	112	L714 N715 K716 T721 E722	L714-A718 VanDerWaalsContact O-CB 3.3Å; L714-A718 WeakPolarHBondContact O-CB 3.42Å; L714-A718 PolarHBondContact O-N 3.21Å; N715-A718 PolarHBondContact O-N 3.33Å; K716-A718 PolarHBondContact O-N 3.46Å; A718-T721 PolarHBondContact O-N 3.34Å; A718-E722 PolarHBondContact O-N 3.1Å
719	F	98.2	Very high	96.5	Very high	10 Å²	10	53.9 Å²	53.9	4%	0.044	29%	0.29	C	S	.	.	H	α-helix	trans	-60.8	-49.8	178.6	-179.7	-92.1	0	0	0	112.2	F594 M598 L652 C655 I656 A707 L711 N715 K716 E722 L723	F594-F719 HydrophobicContact CE2-CZ 4.07Å; F594-F719 HydrophobicContact CZ-CZ 4.15Å; M598-F719 HydrophobicContact CE-CE1 4.12Å; M598-F719 HydrophobicContact CE-CE2 3.81Å; M598-F719 HydrophobicContact CE-CZ 3.5Å; M598-F719 VanDerWaalsContact CE-CZ 3.5Å; L652-F719 HydrophobicContact CB-CD2 4.19Å; L652-F719 HydrophobicContact CB-CE2 4.33Å; L652-F719 HydrophobicContact CD2-CD2 3.96Å; L652-F719 HydrophobicContact CD2-CE2 4Å; C655-F719 HydrophobicContact CB-CE2 4.28Å; C655-F719 HydrophobicContact CB-CZ 4.45Å; I656-F719 HydrophobicContact CD1-CD2 3.94Å; I656-F719 HydrophobicContact CD1-CE2 3.94Å; I656-F719 HydrophobicContact CG1-CD2 4Å; I656-F719 HydrophobicContact CG1-CE2 3.46Å; I656-F719 VanDerWaalsContact CG1-CE2 3.46Å; I656-F719 HydrophobicContact CG1-CZ 3.82Å; A707-F719 HydrophobicContact CB-CD1 4.49Å; A707-F719 HydrophobicContact CB-CE1 3.96Å; L711-F719 HydrophobicContact CD1-CB 3.77Å; L711-F719 HydrophobicContact CD1-CD1 3.74Å; L711-F719 HydrophobicContact CD1-CD2 4.06Å; L711-F719 HydrophobicContact CD1-CE1 4.36Å; L711-F719 HydrophobicContact CD1-CG 3.58Å; N715-F719 WeakPolarHBondContact O-CB 3.43Å; N715-F719 PolarHBondContact O-N 3.32Å; K716-F719 PolarHBondContact O-N 2.9Å; F719-E722 PolarHBondContact O-N 3.31Å; F719-L723 WeakPolarHBondContact O-CB 3.43Å; F719-L723 PolarHBondContact O-N 2.9Å
720	L	97.9	Very high	96.7	Very high	4 Å²	4	51 Å²	51	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-68.9	-34.7	-178.7	-66.6	174.1	0	0	0	112.2	F708 K716 G724 F762	F708-L720 HydrophobicContact CD1-CD1 4.15Å; F708-L720 HydrophobicContact CE1-CD1 3.63Å; F708-L720 HydrophobicContact CE1-CD2 4.3Å; F708-L720 HydrophobicContact CZ-CD1 4.35Å; F708-L720 HydrophobicContact CZ-CD2 4.3Å; K716-L720 HydrophobicContact CG-CD1 3.77Å; K716-L720 HydrophobicContact CG-CG 4.46Å; K716-L720 WeakPolarHBondContact O-CB 3.4Å; K716-L720 VanDerWaalsContact O-CG 3.32Å; K716-L720 WeakPolarHBondContact O-CG 3.24Å; K716-L720 PolarHBondContact O-N 3.45Å; L720-G724 PolarHBondContact O-N 3.3Å; L720-F762 HydrophobicContact CB-CB 4Å; L720-F762 HydrophobicContact CB-CD2 4.35Å; L720-F762 HydrophobicContact CB-CG 4.12Å; L720-F762 HydrophobicContact CD2-CD1 4.12Å; L720-F762 HydrophobicContact CD2-CE1 4.31Å; L720-F762 HydrophobicContact CD2-CG 4.38Å; L720-F762 WeakPolarHBondContact O-CD2 3.41Å
721	T	98	Very high	96.8	Very high	36 Å²	36	50.6 Å²	50.6	22%	0.221	27%	0.268	C	S	.	.	H	α-helix	trans	-63.1	-47.5	174.2	-60.7	0	0	0	0	111.1	Q717 A718 G724 N725 A764 V767	Q717-T721 VanDerWaalsContact O-CB 3.23Å; Q717-T721 WeakPolarHBondContact O-CB 3.5Å; Q717-T721 PolarHBondContact O-N 2.97Å; Q717-T721 PolarHBondContact O-OG1 3.43Å; A718-T721 PolarHBondContact O-N 3.34Å; T721-G724 PolarHBondContact O-N 3.37Å; T721-N725 WeakPolarHBondContact O-CB 3.47Å; T721-N725 PolarHBondContact O-N 2.92Å; T721-N725 PolarHBondContact O-ND2 3.12Å; T721-A764 WeakPolarHBondContact OG1-CB 3.38Å; T721-V767 HydrophobicContact CG2-CG2 4.17Å; T721-V767 WeakPolarHBondContact O-CG2 3.48Å
722	E	98.3	Very high	96.7	Very high	71 Å²	71	50.8 Å²	50.8	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-65.8	-42.8	178.3	179.2	57.9	-163.4	0	0	111.8	I656 A718 F719 G724 N725 R726	I656-E722 HydrophobicContact CD1-CB 4Å; I656-E722 HydrophobicContact CD1-CG 3.74Å; A718-E722 PolarHBondContact O-N 3.1Å; F719-E722 PolarHBondContact O-N 3.31Å; E722-G724 PolarHBondContact O-N 2.89Å; E722-N725 PolarHBondContact O-N 3.26Å; E722-R726 WeakPolarHBondContact O-CG 3.26Å; E722-R726 PolarHBondContact O-N 3.08Å; E722-R726 IonicContact OE1-CZ 3.58Å; E722-R726 VanDerWaalsContact OE1-CZ 3.25Å; E722-R726 IonicContact OE1-NE 2.64Å; E722-R726 PolarHBondContact OE1-NE 2.79Å; E722-R726 IonicContact OE1-NH2 2.8Å; E722-R726 PolarHBondContact OE1-NH2 3.03Å
723	L	98.4	Very high	96.8	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-58.2	-47.4	174.8	-175.5	77.7	0	0	0	111.5	I656 V659 M660 L704 F719 N725 R726 L727 F762	I656-L723 HydrophobicContact CB-CD1 4.41Å; I656-L723 HydrophobicContact CG1-CD1 4.26Å; I656-L723 HydrophobicContact CG2-CD1 4.01Å; V659-L723 HydrophobicContact CB-CD1 4.3Å; V659-L723 HydrophobicContact CG1-CD1 4.15Å; M660-L723 HydrophobicContact CE-CD1 3.63Å; M660-L723 HydrophobicContact CE-CG 4.28Å; L704-L723 HydrophobicContact CD1-CD2 3.34Å; L704-L723 HydrophobicContact CD2-CD2 3.55Å; L704-L723 HydrophobicContact CG-CD2 4.08Å; F719-L723 WeakPolarHBondContact O-CB 3.43Å; F719-L723 PolarHBondContact O-N 2.9Å; L723-N725 PolarHBondContact O-N 3.34Å; L723-R726 PolarHBondContact O-N 3.1Å; L723-L727 WeakPolarHBondContact O-CB 3.35Å; L723-L727 PolarHBondContact O-N 3.2Å; L723-F762 HydrophobicContact CD2-CE2 4.13Å; L723-F762 HydrophobicContact CD2-CZ 3.85Å
724	G	98.1	Very high	96.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-41.7	177.5	0	0	0	0	0	112.8	L720 T721 E722 R726 L727 E728	L720-G724 PolarHBondContact O-N 3.3Å; T721-G724 PolarHBondContact O-N 3.37Å; E722-G724 PolarHBondContact O-N 2.89Å; G724-R726 VanDerWaalsContact C-N 3.32Å; G724-R726 PolarHBondContact O-N 3.2Å; G724-L727 PolarHBondContact O-N 3.36Å; G724-E728 WeakPolarHBondContact O-CB 3.47Å; G724-E728 PolarHBondContact O-N 2.83Å
725	N	97.9	Very high	96.9	Very high	22 Å²	22	39.1 Å²	39.1	12%	0.118	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-35.8	174.7	-74.1	-38.9	0	0	0	112.9	T721 E722 L723 K729 K770	T721-N725 WeakPolarHBondContact O-CB 3.47Å; T721-N725 PolarHBondContact O-N 2.92Å; T721-N725 PolarHBondContact O-ND2 3.12Å; E722-N725 PolarHBondContact O-N 3.26Å; L723-N725 PolarHBondContact O-N 3.34Å; N725-K729 WeakPolarHBondContact O-CG 3.14Å; N725-K729 PolarHBondContact O-N 3.05Å; N725-K770 PolarHBondContact OD1-NZ 2.63Å
726	R	98.2	Very high	96.9	Very high	53 Å²	53	36.6 Å²	36.6	20%	0.2	19%	0.187	C	C	.	.	H	α-helix	trans	-75.8	-37.4	175.8	-68.1	-162.9	-166.4	167.4	11.7	112.6	I656 M660 E722 L723 G724 E728 K729 L730	I656-R726 HydrophobicContact CG2-CG 4.46Å; M660-R726 HydrophobicContact CG-CB 3.91Å; M660-R726 HydrophobicContact SD-CB 3.79Å; E722-R726 WeakPolarHBondContact O-CG 3.26Å; E722-R726 PolarHBondContact O-N 3.08Å; E722-R726 IonicContact OE1-CZ 3.58Å; E722-R726 VanDerWaalsContact OE1-CZ 3.25Å; E722-R726 IonicContact OE1-NE 2.64Å; E722-R726 PolarHBondContact OE1-NE 2.79Å; E722-R726 IonicContact OE1-NH2 2.8Å; E722-R726 PolarHBondContact OE1-NH2 3.03Å; L723-R726 PolarHBondContact O-N 3.1Å; G724-R726 VanDerWaalsContact C-N 3.32Å; G724-R726 PolarHBondContact O-N 3.2Å; R726-E728 VanDerWaalsContact C-N 3.34Å; R726-K729 PolarHBondContact O-N 3.49Å; R726-L730 VanDerWaalsContact O-CB 3.24Å; R726-L730 WeakPolarHBondContact O-CB 3.42Å; R726-L730 PolarHBondContact O-N 3.03Å
727	L	98.3	Very high	96.9	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-46.1	175.1	-179.7	61.4	0	0	0	110.7	M660 V663 L700 L723 G724 L730 L731 V759 F771	M660-L727 HydrophobicContact CE-CB 4.25Å; M660-L727 HydrophobicContact CE-CD1 4.42Å; M660-L727 HydrophobicContact SD-CB 4.28Å; V663-L727 HydrophobicContact CG1-CD1 3.96Å; L700-L727 HydrophobicContact CD1-CD1 4.27Å; L700-L727 HydrophobicContact CD1-CD2 3.87Å; L723-L727 WeakPolarHBondContact O-CB 3.35Å; L723-L727 PolarHBondContact O-N 3.2Å; G724-L727 PolarHBondContact O-N 3.36Å; L727-L730 PolarHBondContact O-N 3.5Å; L727-L731 HydrophobicContact CD1-CD1 4.2Å; L727-L731 HydrophobicContact CD1-CG 4.2Å; L727-L731 HydrophobicContact CG-CD1 4.05Å; L727-L731 HydrophobicContact CG-CG 4.46Å; L727-L731 WeakPolarHBondContact O-CB 3.46Å; L727-L731 VanDerWaalsContact O-CG 3.28Å; L727-L731 WeakPolarHBondContact O-CG 3.36Å; L727-L731 PolarHBondContact O-N 3.25Å; L727-V759 HydrophobicContact CD2-CG2 4Å; L727-F771 HydrophobicContact CD2-CZ 4.06Å; L727-F771 HydrophobicContact CG-CZ 4.08Å
728	E	96.5	Very high	96.8	Very high	22 Å²	22	35.5 Å²	35.5	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-57.4	-51.6	176.4	179.1	-95.1	167.7	0	0	112.4	G724 R726 L730 L731 L732 K770 F771 L774	G724-E728 WeakPolarHBondContact O-CB 3.47Å; G724-E728 PolarHBondContact O-N 2.83Å; R726-E728 VanDerWaalsContact C-N 3.34Å; E728-L730 VanDerWaalsContact C-N 3.31Å; E728-L730 PolarHBondContact O-N 2.84Å; E728-L731 PolarHBondContact O-N 3.31Å; E728-L732 PolarHBondContact O-N 2.96Å; E728-L732 WeakPolarHBondContact OE1-CD1 3.38Å; E728-K770 HydrophobicContact CG-CB 4.06Å; E728-F771 HydrophobicContact CB-CD2 4.43Å; E728-F771 HydrophobicContact CB-CE2 3.79Å; E728-F771 HydrophobicContact CB-CZ 4.17Å; E728-L774 HydrophobicContact CG-CD1 4Å; E728-L774 HydrophobicContact CG-CD2 4.43Å; E728-L774 HydrophobicContact CG-CG 4.33Å
729	K	96.3	Very high	96.6	Very high	122 Å²	122	34.3 Å²	34.3	53%	0.53	17%	0.166	S	C	.	.	H	α-helix	trans	-60.3	-39.6	176.4	-70.8	174.8	-176	173.4	0	112.9	N725 R726 T733	N725-K729 WeakPolarHBondContact O-CG 3.14Å; N725-K729 PolarHBondContact O-N 3.05Å; R726-K729 PolarHBondContact O-N 3.49Å; K729-T733 WeakPolarHBondContact O-CB 3.26Å; K729-T733 PolarHBondContact O-N 3.46Å; K729-T733 PolarHBondContact O-OG1 3.13Å
730	L	97.7	Very high	96.4	Very high	30 Å²	30	34 Å²	34	16%	0.157	17%	0.165	C	C	.	.	H	α-helix	trans	-65.5	-46	178.7	177.6	59.7	0	0	0	110.9	M660 V663 D664 L667 R726 L727 E728 T733 H734	M660-L730 HydrophobicContact SD-CD2 4.16Å; V663-L730 HydrophobicContact CB-CD2 3.9Å; V663-L730 HydrophobicContact CG1-CD2 3.64Å; D664-L730 HydrophobicContact CB-CD1 3.83Å; D664-L730 HydrophobicContact CB-CD2 4.14Å; L667-L730 HydrophobicContact CD1-CG 4.33Å; R726-L730 VanDerWaalsContact O-CB 3.24Å; R726-L730 WeakPolarHBondContact O-CB 3.42Å; R726-L730 PolarHBondContact O-N 3.03Å; L727-L730 PolarHBondContact O-N 3.5Å; E728-L730 VanDerWaalsContact C-N 3.31Å; E728-L730 PolarHBondContact O-N 2.84Å; L730-T733 PolarHBondContact O-N 3.25Å; L730-H734 WeakPolarHBondContact O-CB 3.44Å; L730-H734 PolarHBondContact O-N 2.89Å
731	L	97.1	Very high	96.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-45.8	176.7	-70.8	171.9	0	0	0	111.7	L667 L727 E728 T733 H734 W735 Y755 F771	L667-L731 HydrophobicContact CD1-CD2 3.98Å; L667-L731 HydrophobicContact CD2-CD2 4.31Å; L727-L731 HydrophobicContact CD1-CD1 4.2Å; L727-L731 HydrophobicContact CD1-CG 4.2Å; L727-L731 HydrophobicContact CG-CD1 4.05Å; L727-L731 HydrophobicContact CG-CG 4.46Å; L727-L731 WeakPolarHBondContact O-CB 3.46Å; L727-L731 VanDerWaalsContact O-CG 3.28Å; L727-L731 WeakPolarHBondContact O-CG 3.36Å; L727-L731 PolarHBondContact O-N 3.25Å; E728-L731 PolarHBondContact O-N 3.31Å; L731-T733 VanDerWaalsContact C-N 3.3Å; L731-T733 PolarHBondContact O-N 3.45Å; L731-H734 PolarHBondContact O-N 3Å; L731-W735 HydrophobicContact CB-CE3 4.25Å; L731-W735 HydrophobicContact CB-CH2 3.84Å; L731-W735 HydrophobicContact CB-CZ2 4.14Å; L731-W735 HydrophobicContact CB-CZ3 3.91Å; L731-W735 HydrophobicContact CD1-CH2 4.13Å; L731-W735 HydrophobicContact CD1-CZ2 4.49Å; L731-W735 HydrophobicContact CD2-CH2 4.42Å; L731-W735 HydrophobicContact CD2-CZ2 4.02Å; L731-W735 HydrophobicContact CG-CH2 4.36Å; L731-W735 HydrophobicContact CG-CZ2 4.45Å; L731-W735 PolarHBondContact O-N 3.43Å; L731-Y755 HydrophobicContact CD1-CD1 4.38Å; L731-Y755 HydrophobicContact CD1-CD2 4.02Å; L731-Y755 HydrophobicContact CD1-CE2 4.22Å; L731-Y755 HydrophobicContact CD1-CG 4.1Å; L731-Y755 HydrophobicContact CD2-CD2 4.4Å; L731-Y755 HydrophobicContact CD2-CE1 4.33Å; L731-Y755 HydrophobicContact CD2-CE2 3.77Å; L731-F771 HydrophobicContact CD1-CE1 3.8Å; L731-F771 HydrophobicContact CD1-CZ 4.09Å
732	L	94.2	Very high	95.7	Very high	12 Å²	12	36.2 Å²	36.2	6%	0.063	18%	0.179	C	C	.	.	H	α-helix	trans	-56.6	-44.3	174.7	-81.5	177.2	0	0	0	112.3	E728 Q736 L774 I777 F805	E728-L732 PolarHBondContact O-N 2.96Å; E728-L732 WeakPolarHBondContact OE1-CD1 3.38Å; L732-Q736 VanDerWaalsContact O-CG 3.31Å; L732-Q736 WeakPolarHBondContact O-CG 3.48Å; L732-Q736 PolarHBondContact O-N 3.24Å; L732-Q736 PolarHBondContact O-NE2 3.01Å; L732-L774 HydrophobicContact CD1-CD2 4.08Å; L732-L774 HydrophobicContact CD2-CD2 3.34Å; L732-L774 HydrophobicContact CG-CD2 3.59Å; L732-I777 HydrophobicContact CD2-CD1 4.26Å; L732-F805 HydrophobicContact CB-CZ 4.48Å; L732-F805 HydrophobicContact CD2-CE1 4.33Å; L732-F805 HydrophobicContact CD2-CE2 3.57Å; L732-F805 HydrophobicContact CD2-CZ 3.38Å
733	T	95.4	Very high	95.3	Very high	80 Å²	80	34.4 Å²	34.4	49%	0.491	18%	0.175	S	C	.	.	H	α-helix	trans	-69.4	-37.6	179.5	-55.8	0	0	0	0	111.4	K729 L730 L731	K729-T733 WeakPolarHBondContact O-CB 3.26Å; K729-T733 PolarHBondContact O-N 3.46Å; K729-T733 PolarHBondContact O-OG1 3.13Å; L730-T733 PolarHBondContact O-N 3.25Å; L731-T733 VanDerWaalsContact C-N 3.3Å; L731-T733 PolarHBondContact O-N 3.45Å
734	H	96.3	Very high	94.9	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.014	17%	0.174	C	C	.	.	H	α-helix	trans	-66.5	-48.4	177.6	-179.2	76	0	0	0	111.6	L667 L730 L731 Q736 K737 F738	L667-H734 VanDerWaalsContact C-CE1 3.43Å; L667-H734 HydrophobicContact CD1-CB 4.12Å; L667-H734 PolarHBondContact O-CE1 3.43Å; L667-H734 VanDerWaalsContact O-CE1 3.27Å; L730-H734 WeakPolarHBondContact O-CB 3.44Å; L730-H734 PolarHBondContact O-N 2.89Å; L731-H734 PolarHBondContact O-N 3Å; H734-Q736 PolarHBondContact O-N 3.36Å; H734-K737 VanDerWaalsContact O-CB 3.29Å; H734-K737 WeakPolarHBondContact O-CB 3.45Å; H734-K737 WeakPolarHBondContact O-CG 3.34Å; H734-K737 PolarHBondContact O-N 3.31Å; H734-F738 AromaticContact CD2-CE2 3.81Å; H734-F738 AromaticContact CE1-CE2 3.71Å; H734-F738 AromaticContact CE1-CZ 3.97Å; H734-F738 AromaticContact NE2-CE2 3.33Å; H734-F738 VanDerWaalsContact NE2-CE2 3.33Å; H734-F738 WeakPolarHBondContact NE2-CE2 3.49Å; H734-F738 AromaticContact NE2-CZ 3.67Å; H734-F738 WeakPolarHBondContact O-CD2 3.21Å; H734-F738 WeakPolarHBondContact O-CE2 3.46Å
735	W	95.3	Very high	94.6	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.011	17%	0.174	C	C	.	.	H	α-helix	trans	-65.5	-24.8	-179.5	-66.7	-36.6	0	0	0	113.7	Y676 L731 K737 F738 F740 L748 L752 Y755 L774 F805	Y676-W735 PolarHBondContact OH-NE1 2.85Å; L731-W735 HydrophobicContact CB-CE3 4.25Å; L731-W735 HydrophobicContact CB-CH2 3.84Å; L731-W735 HydrophobicContact CB-CZ2 4.14Å; L731-W735 HydrophobicContact CB-CZ3 3.91Å; L731-W735 HydrophobicContact CD1-CH2 4.13Å; L731-W735 HydrophobicContact CD1-CZ2 4.49Å; L731-W735 HydrophobicContact CD2-CH2 4.42Å; L731-W735 HydrophobicContact CD2-CZ2 4.02Å; L731-W735 HydrophobicContact CG-CH2 4.36Å; L731-W735 HydrophobicContact CG-CZ2 4.45Å; L731-W735 PolarHBondContact O-N 3.43Å; W735-K737 PolarHBondContact O-N 2.81Å; W735-K737 VanDerWaalsContact O-N 3.09Å; W735-F738 PolarHBondContact O-N 3.42Å; W735-F738 VanDerWaalsContact O-N 3.1Å; W735-F740 HydrophobicContact CB-CZ 4.17Å; W735-L748 HydrophobicContact CD2-CD1 3.68Å; W735-L748 HydrophobicContact CE3-CD1 4.18Å; W735-L748 HydrophobicContact CG-CD1 4.18Å; W735-L748 HydrophobicContact CH2-CD1 4.03Å; W735-L748 HydrophobicContact CZ2-CD1 3.48Å; W735-L748 VanDerWaalsContact CZ2-CD1 3.48Å; W735-L748 HydrophobicContact CZ3-CD1 4.33Å; W735-L752 HydrophobicContact CH2-CD2 3.43Å; W735-L752 VanDerWaalsContact CH2-CD2 3.43Å; W735-L752 HydrophobicContact CH2-CG 3.84Å; W735-L752 HydrophobicContact CZ2-CD2 4.44Å; W735-L752 HydrophobicContact CZ2-CG 4.49Å; W735-L752 HydrophobicContact CZ3-CD2 3.93Å; W735-L752 HydrophobicContact CZ3-CG 4.43Å; W735-Y755 HydrophobicContact CZ2-CD2 4.26Å; W735-Y755 HydrophobicContact CZ2-CE2 4.02Å; W735-L774 HydrophobicContact CH2-CD1 4.47Å; W735-L774 HydrophobicContact CZ3-CD1 4.1Å; W735-F805 HydrophobicContact CB-CE1 4.01Å; W735-F805 HydrophobicContact CB-CZ 4.28Å; W735-F805 HydrophobicContact CE3-CE1 4.48Å
736	Q	94	Very high	94.3	Very high	64 Å²	64	37.5 Å²	37.5	30%	0.299	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.4	172	-77.4	171.8	48.3	0	0	114.4	L732 H734 F738 F805 L808	L732-Q736 VanDerWaalsContact O-CG 3.31Å; L732-Q736 WeakPolarHBondContact O-CG 3.48Å; L732-Q736 PolarHBondContact O-N 3.24Å; L732-Q736 PolarHBondContact O-NE2 3.01Å; H734-Q736 PolarHBondContact O-N 3.36Å; Q736-F738 VanDerWaalsContact C-N 3.31Å; Q736-F805 HydrophobicContact CG-CD2 4.48Å; Q736-F805 HydrophobicContact CG-CE2 3.88Å; Q736-F805 HydrophobicContact CG-CZ 4.18Å; Q736-L808 HydrophobicContact CB-CD1 4.46Å; Q736-L808 HydrophobicContact CG-CD1 4.25Å
737	K	94.7	Very high	94	Very high	127 Å²	127	37 Å²	37	55%	0.552	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.2	176.5	-55.9	174.3	-174.5	175	0	113.2	H734 W735	H734-K737 VanDerWaalsContact O-CB 3.29Å; H734-K737 WeakPolarHBondContact O-CB 3.45Å; H734-K737 WeakPolarHBondContact O-CG 3.34Å; H734-K737 PolarHBondContact O-N 3.31Å; W735-K737 PolarHBondContact O-N 2.81Å; W735-K737 VanDerWaalsContact O-N 3.09Å
738	F	94.9	Very high	93.8	Very high	22 Å²	22	37 Å²	37	10%	0.096	19%	0.189	C	C	.	.			trans	-112.9	169.3	-173.1	-62.2	-93.6	0	0	0	112.3	Q671 K672 Y676 H734 W735 Q736 F740	Q671-F738 HydrophobicContact CB-CE1 4.47Å; Q671-F738 HydrophobicContact CB-CZ 3.89Å; Q671-F738 HydrophobicContact CG-CE1 3.68Å; Q671-F738 HydrophobicContact CG-CE2 4.06Å; Q671-F738 HydrophobicContact CG-CZ 3.32Å; K672-F738 WeakPolarHBondContact O-CE1 3.17Å; Y676-F738 HydrophobicContact CD2-CB 3.9Å; Y676-F738 AromaticContact CD2-CD1 3.73Å; Y676-F738 HydrophobicContact CD2-CD1 3.73Å; Y676-F738 HydrophobicContact CD2-CD2 4.34Å; Y676-F738 HydrophobicContact CD2-CE1 4.37Å; Y676-F738 AromaticContact CD2-CG 3.72Å; Y676-F738 HydrophobicContact CD2-CG 3.72Å; Y676-F738 HydrophobicContact CE2-CD1 4.17Å; Y676-F738 HydrophobicContact CE2-CD2 4.25Å; Y676-F738 HydrophobicContact CE2-CE1 4.44Å; Y676-F738 HydrophobicContact CE2-CG 4.07Å; H734-F738 AromaticContact CD2-CE2 3.81Å; H734-F738 AromaticContact CE1-CE2 3.71Å; H734-F738 AromaticContact CE1-CZ 3.97Å; H734-F738 AromaticContact NE2-CE2 3.33Å; H734-F738 VanDerWaalsContact NE2-CE2 3.33Å; H734-F738 WeakPolarHBondContact NE2-CE2 3.49Å; H734-F738 AromaticContact NE2-CZ 3.67Å; H734-F738 WeakPolarHBondContact O-CD2 3.21Å; H734-F738 WeakPolarHBondContact O-CE2 3.46Å; W735-F738 PolarHBondContact O-N 3.42Å; W735-F738 VanDerWaalsContact O-N 3.1Å; Q736-F738 VanDerWaalsContact C-N 3.31Å; F738-F740 HydrophobicContact CB-CE2 3.78Å; F738-F740 HydrophobicContact CB-CZ 3.9Å
739	T	93.5	Very high	93.7	Very high	38 Å²	38	39.8 Å²	39.8	23%	0.233	20%	0.201	C	C	.	.			trans	-125.7	144.4	168.3	-55.5	0	0	0	0	107.9	R677 L808 E810	R677-T739 WeakPolarHBondContact CG-O 3.49Å; R677-T739 VanDerWaalsContact NE-CB 3.29Å; R677-T739 VanDerWaalsContact NH2-CG2 3.31Å; R677-T739 PolarHBondContact NH2-OG1 2.88Å; T739-L808 CarbonylContact C-O 3.58Å; T739-L808 WeakPolarHBondContact CA-O 3.24Å; T739-L808 VanDerWaalsContact CG2-O 3.24Å; T739-L808 WeakPolarHBondContact CG2-O 3.16Å; T739-E810 HydrophobicContact CG2-CB 4.16Å
740	F	93.9	Very high	93.5	Very high	2 Å²	2	39 Å²	39	1%	0.009	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-121.4	138.5	-166.8	-63	-100.3	0	0	0	111.4	Y676 W735 F738 L748 F781 L808 E810	Y676-F740 VanDerWaalsContact CB-CD1 3.47Å; Y676-F740 HydrophobicContact CD1-CD1 4.04Å; Y676-F740 AromaticContact CD1-CE1 3.58Å; Y676-F740 HydrophobicContact CD1-CE1 3.58Å; Y676-F740 HydrophobicContact CD2-CD1 4.46Å; Y676-F740 AromaticContact CD2-CE1 3.67Å; Y676-F740 HydrophobicContact CD2-CE1 3.67Å; Y676-F740 AromaticContact CD2-CZ 3.95Å; Y676-F740 HydrophobicContact CD2-CZ 3.95Å; Y676-F740 HydrophobicContact CE1-CE1 4.14Å; Y676-F740 HydrophobicContact CE2-CE1 4.23Å; Y676-F740 HydrophobicContact CE2-CZ 4.4Å; Y676-F740 AromaticContact CG-CD1 3.75Å; Y676-F740 HydrophobicContact CG-CD1 3.75Å; Y676-F740 AromaticContact CG-CE1 3.31Å; Y676-F740 HydrophobicContact CG-CE1 3.31Å; Y676-F740 HydrophobicContact CG-CZ 4.06Å; Y676-F740 WeakPolarHBondContact O-CA 3.43Å; W735-F740 HydrophobicContact CB-CZ 4.17Å; F738-F740 HydrophobicContact CB-CE2 3.78Å; F738-F740 HydrophobicContact CB-CZ 3.9Å; F740-L748 HydrophobicContact CD1-CD2 4.35Å; F740-L748 HydrophobicContact CE1-CB 4.26Å; F740-L748 HydrophobicContact CE1-CD2 3.8Å; F740-L748 HydrophobicContact CE1-CG 4.46Å; F740-L748 HydrophobicContact CZ-CD2 4.35Å; F740-F781 HydrophobicContact CB-CB 3.94Å; F740-F781 HydrophobicContact CB-CD1 3.34Å; F740-F781 HydrophobicContact CB-CD2 4.14Å; F740-F781 HydrophobicContact CB-CE1 3.75Å; F740-F781 HydrophobicContact CB-CE2 4.48Å; F740-F781 HydrophobicContact CB-CG 3.54Å; F740-F781 HydrophobicContact CB-CZ 4.29Å; F740-F781 AromaticContact CD1-CD2 3.89Å; F740-F781 HydrophobicContact CD1-CD2 3.89Å; F740-F781 AromaticContact CD1-CE2 3.99Å; F740-F781 HydrophobicContact CD1-CE2 3.99Å; F740-F781 HydrophobicContact CD1-CG 4.16Å; F740-F781 HydrophobicContact CD1-CZ 4.36Å; F740-F781 HydrophobicContact CD2-CD1 4.01Å; F740-F781 HydrophobicContact CD2-CD2 4.33Å; F740-F781 AromaticContact CD2-CE1 3.5Å; F740-F781 HydrophobicContact CD2-CE1 3.5Å; F740-F781 VanDerWaalsContact CD2-CE1 3.5Å; F740-F781 AromaticContact CD2-CE2 3.84Å; F740-F781 HydrophobicContact CD2-CE2 3.84Å; F740-F781 HydrophobicContact CD2-CG 4.39Å; F740-F781 AromaticContact CD2-CZ 3.38Å; F740-F781 HydrophobicContact CD2-CZ 3.38Å; F740-F781 HydrophobicContact CE1-CD2 4.43Å; F740-F781 HydrophobicContact CE1-CE2 4.2Å; F740-F781 HydrophobicContact CE2-CE1 4.3Å; F740-F781 HydrophobicContact CE2-CE2 4.05Å; F740-F781 AromaticContact CE2-CZ 3.73Å; F740-F781 HydrophobicContact CE2-CZ 3.73Å; F740-F781 AromaticContact CG-CD1 3.74Å; F740-F781 HydrophobicContact CG-CD1 3.74Å; F740-F781 AromaticContact CG-CD2 3.86Å; F740-F781 HydrophobicContact CG-CD2 3.86Å; F740-F781 AromaticContact CG-CE1 3.72Å; F740-F781 HydrophobicContact CG-CE1 3.72Å; F740-F781 AromaticContact CG-CE2 3.84Å; F740-F781 HydrophobicContact CG-CE2 3.84Å; F740-F781 AromaticContact CG-CG 3.79Å; F740-F781 HydrophobicContact CG-CG 3.79Å; F740-F781 AromaticContact CG-CZ 3.76Å; F740-F781 HydrophobicContact CG-CZ 3.76Å; F740-F781 HydrophobicContact CZ-CE2 4.23Å; F740-F781 HydrophobicContact CZ-CZ 4.37Å; F740-L808 HydrophobicContact CD2-CB 4.02Å; F740-L808 HydrophobicContact CE2-CB 4.37Å; F740-L808 HydrophobicContact CE2-CD1 4.28Å; F740-L808 PolarHBondContact N-O 3.21Å; F740-E810 WeakPolarHBondContact O-CB 3.19Å; F740-E810 PolarHBondContact O-N 2.81Å
741	N	91	Very high	93.4	Very high	14 Å²	14	37.6 Å²	37.6	8%	0.075	19%	0.187	C	C	.	.			trans	-105.8	171.4	161.7	73.9	-1.6	0	0	0	110.2	Y676 S678 S743 G744 G745 E810	Y676-N741 PolarHBondContact O-N 3.31Å; Y676-N741 VanDerWaalsContact O-N 3.16Å; Y676-N741 PolarHBondContact O-OD1 3.28Å; S678-N741 PolarHBondContact O-ND2 3.42Å; N741-S743 VanDerWaalsContact C-N 3.29Å; N741-S743 PolarHBondContact O-N 3.22Å; N741-G744 CarbonylContact O-C 3.36Å; N741-G744 WeakPolarHBondContact O-CA 3.31Å; N741-G744 PolarHBondContact O-N 3.2Å; N741-G744 PolarHBondContact OD1-N 3.43Å; N741-G745 PolarHBondContact O-N 3.2Å; N741-E810 HydrophobicContact CB-CB 4.46Å; N741-E810 WeakPolarHBondContact CB-OE2 3.05Å
742	P	89.9	Confident	93.4	Very high	73 Å²	73	37.7 Å²	37.7	47%	0.474	19%	0.188	S	C	.	.	H	α-helix	trans	-54.9	-41.5	-177.4	-28.9	36.8	0	0	0	114	G745 L746 F781	P742-G745 PolarHBondContact O-N 3.31Å; P742-L746 PolarHBondContact O-N 3.34Å; P742-F781 WeakPolarHBondContact CA-O 3.22Å
743	S	89.4	Confident	93.5	Very high	33 Å²	33	41.2 Å²	41.2	23%	0.231	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-41.2	175.8	-58.6	0	0	0	0	112.2	N741 G745 L746 R747	N741-S743 VanDerWaalsContact C-N 3.29Å; N741-S743 PolarHBondContact O-N 3.22Å; S743-G745 VanDerWaalsContact C-N 3.35Å; S743-L746 PolarHBondContact O-N 2.98Å; S743-R747 PolarHBondContact O-N 2.98Å; S743-R747 VanDerWaalsContact O-N 3.08Å
744	G	90.8	Very high	93.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-34.7	172.4	0	0	0	0	0	113.4	Y676 N741 R747 L748	Y676-G744 WeakPolarHBondContact O-CA 3.41Å; N741-G744 CarbonylContact O-C 3.36Å; N741-G744 WeakPolarHBondContact O-CA 3.31Å; N741-G744 PolarHBondContact O-N 3.2Å; N741-G744 PolarHBondContact OD1-N 3.43Å; G744-R747 PolarHBondContact O-N 3.43Å; G744-L748 PolarHBondContact O-N 3.43Å
745	G	91.8	Very high	93.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-42.6	171.7	0	0	0	0	0	112.6	N741 P742 S743 R747 L748 K749	N741-G745 PolarHBondContact O-N 3.2Å; P742-G745 PolarHBondContact O-N 3.31Å; S743-G745 VanDerWaalsContact C-N 3.35Å; G745-R747 VanDerWaalsContact C-N 3.32Å; G745-R747 PolarHBondContact O-N 3.29Å; G745-L748 PolarHBondContact O-N 3.33Å; G745-K749 PolarHBondContact O-N 2.96Å
746	L	91.6	Very high	93.7	Very high	88 Å²	88	41.4 Å²	41.4	46%	0.461	20%	0.204	S	C	.	.	H	α-helix	trans	-63.3	-38.3	173.5	-70.3	171.5	0	0	0	111.9	P742 S743 K749 R750 I782	P742-L746 PolarHBondContact O-N 3.34Å; S743-L746 PolarHBondContact O-N 2.98Å; L746-K749 WeakPolarHBondContact O-CB 3.46Å; L746-K749 PolarHBondContact O-N 3.44Å; L746-R750 PolarHBondContact O-N 3.38Å; L746-R750 VanDerWaalsContact O-N 3.17Å; L746-I782 HydrophobicContact CD2-CD1 3.84Å; L746-I782 HydrophobicContact CD2-CG1 4.26Å; L746-I782 HydrophobicContact CD2-CG2 4.13Å; L746-I782 HydrophobicContact CG-CD1 4.32Å; L746-I782 HydrophobicContact CG-CG1 4.29Å; L746-I782 HydrophobicContact CG-CG2 4.46Å
747	R	92	Very high	93.7	Very high	43 Å²	43	40.7 Å²	40.7	16%	0.162	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-43.3	176.1	-159	179.2	-165.7	172.1	5.9	112.3	D675 D686 R688 T690 S743 G744 G745 K749 R750 D751	D675-R747 VanDerWaalsContact O-CD 3.29Å; D675-R747 WeakPolarHBondContact O-CD 3.47Å; D675-R747 PolarHBondContact O-NH1 3.47Å; D675-R747 IonicContact OD1-NH1 3.25Å; D686-R747 IonicContact OD2-NH2 3.3Å; D686-R747 PolarHBondContact OD2-NH2 2.88Å; R688-R747 PolarHBondContact O-NE 2.9Å; T690-R747 HydrophobicContact CG2-CG 4.12Å; S743-R747 PolarHBondContact O-N 2.98Å; S743-R747 VanDerWaalsContact O-N 3.08Å; G744-R747 PolarHBondContact O-N 3.43Å; G745-R747 VanDerWaalsContact C-N 3.32Å; G745-R747 PolarHBondContact O-N 3.29Å; R747-K749 VanDerWaalsContact C-N 3.28Å; R747-K749 PolarHBondContact O-N 3.47Å; R747-R750 WeakPolarHBondContact O-CA 3.27Å; R747-R750 WeakPolarHBondContact O-CB 3.48Å; R747-R750 PolarHBondContact O-N 2.9Å; R747-D751 PolarHBondContact O-N 3.07Å
748	L	94	Very high	93.8	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-57.8	-41.3	172.3	174.8	63.3	0	0	0	111.6	Y676 W735 F740 G744 G745 R750 D751 L752 A778 F781	Y676-L748 HydrophobicContact CD1-CB 4.22Å; Y676-L748 HydrophobicContact CE1-CB 3.98Å; Y676-L748 HydrophobicContact CE1-CD1 4.26Å; W735-L748 HydrophobicContact CD2-CD1 3.68Å; W735-L748 HydrophobicContact CE3-CD1 4.18Å; W735-L748 HydrophobicContact CG-CD1 4.18Å; W735-L748 HydrophobicContact CH2-CD1 4.03Å; W735-L748 HydrophobicContact CZ2-CD1 3.48Å; W735-L748 VanDerWaalsContact CZ2-CD1 3.48Å; W735-L748 HydrophobicContact CZ3-CD1 4.33Å; F740-L748 HydrophobicContact CD1-CD2 4.35Å; F740-L748 HydrophobicContact CE1-CB 4.26Å; F740-L748 HydrophobicContact CE1-CD2 3.8Å; F740-L748 HydrophobicContact CE1-CG 4.46Å; F740-L748 HydrophobicContact CZ-CD2 4.35Å; G744-L748 PolarHBondContact O-N 3.43Å; G745-L748 PolarHBondContact O-N 3.33Å; L748-R750 PolarHBondContact O-N 3.41Å; L748-D751 PolarHBondContact O-N 3.5Å; L748-L752 HydrophobicContact CG-CD1 4.19Å; L748-L752 WeakPolarHBondContact O-CB 3.43Å; L748-L752 PolarHBondContact O-N 2.62Å; L748-A778 HydrophobicContact CD2-CB 3.96Å; L748-A778 HydrophobicContact CG-CB 4.15Å; L748-F781 HydrophobicContact CD2-CD2 3.81Å; L748-F781 HydrophobicContact CD2-CE2 3.74Å
749	K	93.4	Very high	93.9	Very high	79 Å²	79	34.5 Å²	34.5	34%	0.343	19%	0.187	S	C	.	.	H	α-helix	trans	-61.7	-32.2	175.6	-168.7	169.5	-174.3	164	0	112.2	G745 L746 R747 N753 N779 I782	G745-K749 PolarHBondContact O-N 2.96Å; L746-K749 WeakPolarHBondContact O-CB 3.46Å; L746-K749 PolarHBondContact O-N 3.44Å; R747-K749 VanDerWaalsContact C-N 3.28Å; R747-K749 PolarHBondContact O-N 3.47Å; K749-N753 PolarHBondContact O-N 3.3Å; K749-N753 VanDerWaalsContact O-N 3.07Å; K749-N753 PolarHBondContact O-ND2 2.65Å; K749-N779 PolarHBondContact NZ-OD1 3.09Å; K749-I782 HydrophobicContact CB-CD1 4.44Å; K749-I782 HydrophobicContact CD-CD1 4.05Å
750	R	93	Very high	94	Very high	106 Å²	106	38.9 Å²	38.9	40%	0.4	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-45.9	173.6	-174.1	64.9	-168.2	174.1	9.6	111.7	P689 L746 R747 L748 L752 N753 E754	P689-R750 HydrophobicContact CB-CG 4.2Å; L746-R750 PolarHBondContact O-N 3.38Å; L746-R750 VanDerWaalsContact O-N 3.17Å; R747-R750 WeakPolarHBondContact O-CA 3.27Å; R747-R750 WeakPolarHBondContact O-CB 3.48Å; R747-R750 PolarHBondContact O-N 2.9Å; L748-R750 PolarHBondContact O-N 3.41Å; R750-L752 VanDerWaalsContact C-N 3.28Å; R750-L752 PolarHBondContact O-N 2.75Å; R750-N753 WeakPolarHBondContact O-CB 3.4Å; R750-N753 PolarHBondContact O-N 3.13Å; R750-N753 VanDerWaalsContact O-N 3.08Å; R750-E754 IonicContact CZ-OE1 3.45Å; R750-E754 VanDerWaalsContact CZ-OE1 3.32Å; R750-E754 IonicContact NE-OE1 3.67Å; R750-E754 PolarHBondContact NE-OE1 2.91Å; R750-E754 IonicContact NH2-OE1 2.75Å; R750-E754 PolarHBondContact NH2-OE1 3.27Å; R750-E754 PolarHBondContact O-N 2.82Å
751	D	96.1	Very high	94.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-57.8	-44.1	174.7	-72	0.1	0	0	0	111.1	Y676 P689 T690 C693 R747 L748 N753 E754 Y755	Y676-D751 PolarHBondContact OH-OD2 3.3Å; P689-D751 WeakPolarHBondContact CA-OD1 3.41Å; P689-D751 VanDerWaalsContact CB-OD1 3.29Å; P689-D751 WeakPolarHBondContact CB-OD1 3.25Å; T690-D751 WeakPolarHBondContact CB-OD2 3.33Å; T690-D751 WeakPolarHBondContact CG2-OD2 3.48Å; T690-D751 PolarHBondContact N-OD1 3.45Å; T690-D751 PolarHBondContact OG1-OD2 2.78Å; C693-D751 HydrophobicContact CB-CB 3.9Å; C693-D751 VanDerWaalsContact CB-CG 3.44Å; C693-D751 WeakPolarHBondContact CB-OD1 3.5Å; R747-D751 PolarHBondContact O-N 3.07Å; L748-D751 PolarHBondContact O-N 3.5Å; D751-N753 VanDerWaalsContact C-N 3.31Å; D751-N753 PolarHBondContact O-N 3.27Å; D751-E754 PolarHBondContact O-N 2.84Å; D751-E754 VanDerWaalsContact O-N 3.13Å; D751-Y755 HydrophobicContact CB-CD2 4.46Å; D751-Y755 HydrophobicContact CB-CE2 4.21Å; D751-Y755 WeakPolarHBondContact O-CD2 3.43Å; D751-Y755 PolarHBondContact O-N 2.94Å
752	L	96.4	Very high	94.3	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-39	174.3	-82.9	167.1	0	0	0	112.8	W735 L748 R750 E754 Y755 V756 L774 A778	W735-L752 HydrophobicContact CH2-CD2 3.43Å; W735-L752 VanDerWaalsContact CH2-CD2 3.43Å; W735-L752 HydrophobicContact CH2-CG 3.84Å; W735-L752 HydrophobicContact CZ2-CD2 4.44Å; W735-L752 HydrophobicContact CZ2-CG 4.49Å; W735-L752 HydrophobicContact CZ3-CD2 3.93Å; W735-L752 HydrophobicContact CZ3-CG 4.43Å; L748-L752 HydrophobicContact CG-CD1 4.19Å; L748-L752 WeakPolarHBondContact O-CB 3.43Å; L748-L752 PolarHBondContact O-N 2.62Å; R750-L752 VanDerWaalsContact C-N 3.28Å; R750-L752 PolarHBondContact O-N 2.75Å; L752-E754 VanDerWaalsContact C-N 3.31Å; L752-E754 PolarHBondContact O-N 3.22Å; L752-Y755 PolarHBondContact O-N 3.08Å; L752-V756 VanDerWaalsContact O-CB 3.26Å; L752-V756 WeakPolarHBondContact O-CB 3.16Å; L752-V756 WeakPolarHBondContact O-CG2 3.5Å; L752-V756 PolarHBondContact O-N 3.26Å; L752-L774 HydrophobicContact CD1-CB 4.44Å; L752-L774 WeakPolarHBondContact CD1-O 3.31Å; L752-L774 HydrophobicContact CD2-CB 3.62Å; L752-L774 HydrophobicContact CD2-CD1 3.96Å; L752-L774 HydrophobicContact CD2-CG 4.47Å; L752-A778 HydrophobicContact CD1-CB 3.46Å; L752-A778 VanDerWaalsContact CD1-CB 3.46Å
753	N	95.4	Very high	94.5	Very high	85 Å²	85	40.3 Å²	40.3	46%	0.455	22%	0.222	S	C	.	.	H	α-helix	trans	-63.6	-37.8	175.9	-70.7	-30.4	0	0	0	112.2	K749 R750 D751 G757	K749-N753 PolarHBondContact O-N 3.3Å; K749-N753 VanDerWaalsContact O-N 3.07Å; K749-N753 PolarHBondContact O-ND2 2.65Å; R750-N753 WeakPolarHBondContact O-CB 3.4Å; R750-N753 PolarHBondContact O-N 3.13Å; R750-N753 VanDerWaalsContact O-N 3.08Å; D751-N753 VanDerWaalsContact C-N 3.31Å; D751-N753 PolarHBondContact O-N 3.27Å; N753-G757 PolarHBondContact O-N 3.04Å
754	E	96.5	Very high	94.7	Very high	61 Å²	61	38.8 Å²	38.8	29%	0.285	21%	0.212	S	C	.	.	H	α-helix	trans	-68.2	-44.5	175.2	-58.3	-61.4	156.5	0	0	110.8	P689 V697 R750 D751 L752 G757 F758	P689-E754 HydrophobicContact CB-CG 3.87Å; P689-E754 HydrophobicContact CG-CG 4Å; V697-E754 HydrophobicContact CG2-CB 4.41Å; R750-E754 IonicContact CZ-OE1 3.45Å; R750-E754 VanDerWaalsContact CZ-OE1 3.32Å; R750-E754 IonicContact NE-OE1 3.67Å; R750-E754 PolarHBondContact NE-OE1 2.91Å; R750-E754 IonicContact NH2-OE1 2.75Å; R750-E754 PolarHBondContact NH2-OE1 3.27Å; R750-E754 PolarHBondContact O-N 2.82Å; D751-E754 PolarHBondContact O-N 2.84Å; D751-E754 VanDerWaalsContact O-N 3.13Å; L752-E754 VanDerWaalsContact C-N 3.31Å; L752-E754 PolarHBondContact O-N 3.22Å; E754-G757 PolarHBondContact O-N 2.87Å; E754-F758 PolarHBondContact O-N 2.78Å
755	Y	97.7	Very high	94.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-46.5	175.9	-70	-54.1	0	0	0	112.7	C693 V696 V697 L731 W735 D751 L752 G757 F758 V759	C693-Y755 WeakPolarHBondContact CA-OH 3.37Å; C693-Y755 HydrophobicContact CB-CE2 4.3Å; V696-Y755 HydrophobicContact CB-CE1 4.11Å; V696-Y755 HydrophobicContact CG1-CE1 3.7Å; V697-Y755 HydrophobicContact CG2-CD1 3.88Å; V697-Y755 HydrophobicContact CG2-CE1 4Å; L731-Y755 HydrophobicContact CD1-CD1 4.38Å; L731-Y755 HydrophobicContact CD1-CD2 4.02Å; L731-Y755 HydrophobicContact CD1-CE2 4.22Å; L731-Y755 HydrophobicContact CD1-CG 4.1Å; L731-Y755 HydrophobicContact CD2-CD2 4.4Å; L731-Y755 HydrophobicContact CD2-CE1 4.33Å; L731-Y755 HydrophobicContact CD2-CE2 3.77Å; W735-Y755 HydrophobicContact CZ2-CD2 4.26Å; W735-Y755 HydrophobicContact CZ2-CE2 4.02Å; D751-Y755 HydrophobicContact CB-CD2 4.46Å; D751-Y755 HydrophobicContact CB-CE2 4.21Å; D751-Y755 WeakPolarHBondContact O-CD2 3.43Å; D751-Y755 PolarHBondContact O-N 2.94Å; L752-Y755 PolarHBondContact O-N 3.08Å; Y755-G757 VanDerWaalsContact C-N 3.32Å; Y755-G757 PolarHBondContact O-N 3.3Å; Y755-F758 PolarHBondContact O-N 3.29Å; Y755-V759 WeakPolarHBondContact O-CB 3.42Å; Y755-V759 VanDerWaalsContact O-CG2 3.25Å; Y755-V759 WeakPolarHBondContact O-CG2 3.45Å; Y755-V759 PolarHBondContact O-N 3.46Å
756	V	96.8	Very high	95.1	Very high	29 Å²	29	45.7 Å²	45.7	18%	0.176	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-44.8	174.4	169.4	0	0	0	0	110.2	L752 F758 V759 K760 F771	L752-V756 VanDerWaalsContact O-CB 3.26Å; L752-V756 WeakPolarHBondContact O-CB 3.16Å; L752-V756 WeakPolarHBondContact O-CG2 3.5Å; L752-V756 PolarHBondContact O-N 3.26Å; V756-F758 VanDerWaalsContact C-N 3.28Å; V756-F758 PolarHBondContact O-N 2.9Å; V756-V759 PolarHBondContact O-N 3.32Å; V756-K760 HydrophobicContact CG1-CD 4.32Å; V756-K760 VanDerWaalsContact O-CG 3.28Å; V756-K760 WeakPolarHBondContact O-CG 3.46Å; V756-K760 PolarHBondContact O-N 3.33Å; V756-F771 HydrophobicContact CG2-CB 3.88Å; V756-F771 HydrophobicContact CG2-CD1 4.29Å
757	G	95.3	Very high	95.3	Very high	49 Å²	49	41.5 Å²	41.5	51%	0.505	24%	0.236	S	C	.	.	H	α-helix	trans	-57.4	-42.8	177.5	0	0	0	0	0	112.2	N753 E754 Y755	N753-G757 PolarHBondContact O-N 3.04Å; E754-G757 PolarHBondContact O-N 2.87Å; Y755-G757 VanDerWaalsContact C-N 3.32Å; Y755-G757 PolarHBondContact O-N 3.3Å
758	F	96.3	Very high	95.5	Very high	20 Å²	20	41.3 Å²	41.3	9%	0.088	24%	0.238	C	C	.	.	H	α-helix	trans	-70	-50.2	175.7	179.2	-105.1	0	0	0	112.8	V697 L700 S701 L704 E754 Y755 V756 K760 S761 F762	V697-F758 HydrophobicContact CG1-CB 4.22Å; V697-F758 HydrophobicContact CG1-CD2 4.36Å; V697-F758 HydrophobicContact CG1-CG 4.39Å; L700-F758 HydrophobicContact CB-CD1 4.29Å; L700-F758 HydrophobicContact CB-CE1 3.46Å; L700-F758 VanDerWaalsContact CB-CE1 3.46Å; L700-F758 HydrophobicContact CB-CE2 4.33Å; L700-F758 HydrophobicContact CB-CZ 3.49Å; L700-F758 VanDerWaalsContact CB-CZ 3.49Å; L700-F758 HydrophobicContact CD1-CD1 4.19Å; L700-F758 HydrophobicContact CD1-CE1 3.85Å; L700-F758 HydrophobicContact CG-CE1 4.24Å; S701-F758 WeakPolarHBondContact OG-CD2 3.29Å; S701-F758 VanDerWaalsContact OG-CE2 3.26Å; S701-F758 WeakPolarHBondContact OG-CE2 3.08Å; L704-F758 HydrophobicContact CD1-CE1 4.06Å; L704-F758 HydrophobicContact CD1-CZ 3.85Å; E754-F758 PolarHBondContact O-N 2.78Å; Y755-F758 PolarHBondContact O-N 3.29Å; V756-F758 VanDerWaalsContact C-N 3.28Å; V756-F758 PolarHBondContact O-N 2.9Å; F758-K760 PolarHBondContact O-N 3.41Å; F758-S761 VanDerWaalsContact O-CB 3.26Å; F758-S761 WeakPolarHBondContact O-CB 3.49Å; F758-S761 PolarHBondContact O-N 3.49Å; F758-S761 PolarHBondContact O-OG 3.3Å; F758-F762 HydrophobicContact CD1-CE1 4.24Å; F758-F762 HydrophobicContact CD1-CZ 4.32Å; F758-F762 AromaticContact CE1-CE1 3.57Å; F758-F762 HydrophobicContact CE1-CE1 3.57Å; F758-F762 AromaticContact CE1-CZ 3.68Å; F758-F762 HydrophobicContact CE1-CZ 3.68Å; F758-F762 AromaticContact CZ-CE1 3.98Å; F758-F762 HydrophobicContact CZ-CE1 3.98Å; F758-F762 HydrophobicContact CZ-CZ 4.44Å
759	V	96.9	Very high	95.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-28.1	-175.2	167.4	0	0	0	0	112.4	L727 Y755 V756 S761 F762 V767 F771	L727-V759 HydrophobicContact CD2-CG2 4Å; Y755-V759 WeakPolarHBondContact O-CB 3.42Å; Y755-V759 VanDerWaalsContact O-CG2 3.25Å; Y755-V759 WeakPolarHBondContact O-CG2 3.45Å; Y755-V759 PolarHBondContact O-N 3.46Å; V756-V759 PolarHBondContact O-N 3.32Å; V759-S761 PolarHBondContact O-N 2.9Å; V759-S761 VanDerWaalsContact O-N 3.1Å; V759-F762 HydrophobicContact CG1-CD2 4.23Å; V759-F762 HydrophobicContact CG2-CE2 4.37Å; V759-F762 WeakPolarHBondContact O-CB 3.45Å; V759-F762 WeakPolarHBondContact O-CG 3.37Å; V759-F762 PolarHBondContact O-N 2.92Å; V759-V767 HydrophobicContact CG1-CB 4.38Å; V759-V767 HydrophobicContact CG1-CG1 3.47Å; V759-V767 VanDerWaalsContact CG1-CG1 3.47Å; V759-F771 HydrophobicContact CB-CE2 4.47Å; V759-F771 HydrophobicContact CG1-CD2 3.93Å; V759-F771 HydrophobicContact CG1-CE2 4.01Å; V759-F771 HydrophobicContact CG1-CG 4.45Å; V759-F771 HydrophobicContact CG2-CD2 4.4Å; V759-F771 HydrophobicContact CG2-CE1 4.07Å; V759-F771 HydrophobicContact CG2-CE2 3.9Å; V759-F771 HydrophobicContact CG2-CZ 3.73Å
760	K	95.9	Very high	95.5	Very high	130 Å²	130	46.5 Å²	46.5	57%	0.565	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-55.4	-27.9	171.2	-81.1	176	176.9	-174.4	0	113.7	V756 F758 F762 G763	V756-K760 HydrophobicContact CG1-CD 4.32Å; V756-K760 VanDerWaalsContact O-CG 3.28Å; V756-K760 WeakPolarHBondContact O-CG 3.46Å; V756-K760 PolarHBondContact O-N 3.33Å; F758-K760 PolarHBondContact O-N 3.41Å; K760-F762 PolarHBondContact O-N 3.41Å; K760-G763 PolarHBondContact O-N 3.12Å
761	S	95.2	Very high	95.6	Very high	61 Å²	61	41.6 Å²	41.6	43%	0.427	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-64.9	-14.8	174.1	71	0	0	0	0	113.4	F708 F758 V759 G763	F708-S761 WeakPolarHBondContact CE1-O 3.09Å; F758-S761 VanDerWaalsContact O-CB 3.26Å; F758-S761 WeakPolarHBondContact O-CB 3.49Å; F758-S761 PolarHBondContact O-N 3.49Å; F758-S761 PolarHBondContact O-OG 3.3Å; V759-S761 PolarHBondContact O-N 2.9Å; V759-S761 VanDerWaalsContact O-N 3.1Å; S761-G763 VanDerWaalsContact C-N 3.3Å; S761-G763 PolarHBondContact O-N 3.5Å
762	F	96.2	Very high	95.4	Very high	7 Å²	7	47.6 Å²	47.6	3%	0.031	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-74.9	-22.2	180	-66.7	4.7	0	0	0	112.4	L704 F708 L720 L723 F758 V759 K760 A764	L704-F762 HydrophobicContact CD1-CE1 3.7Å; L704-F762 HydrophobicContact CD1-CZ 3.71Å; F708-F762 AromaticContact CZ-CD1 3.98Å; F708-F762 HydrophobicContact CZ-CD1 3.98Å; F708-F762 HydrophobicContact CZ-CE1 4.25Å; L720-F762 HydrophobicContact CB-CB 4Å; L720-F762 HydrophobicContact CB-CD2 4.35Å; L720-F762 HydrophobicContact CB-CG 4.12Å; L720-F762 HydrophobicContact CD2-CD1 4.12Å; L720-F762 HydrophobicContact CD2-CE1 4.31Å; L720-F762 HydrophobicContact CD2-CG 4.38Å; L720-F762 WeakPolarHBondContact O-CD2 3.41Å; L723-F762 HydrophobicContact CD2-CE2 4.13Å; L723-F762 HydrophobicContact CD2-CZ 3.85Å; F758-F762 HydrophobicContact CD1-CE1 4.24Å; F758-F762 HydrophobicContact CD1-CZ 4.32Å; F758-F762 AromaticContact CE1-CE1 3.57Å; F758-F762 HydrophobicContact CE1-CE1 3.57Å; F758-F762 AromaticContact CE1-CZ 3.68Å; F758-F762 HydrophobicContact CE1-CZ 3.68Å; F758-F762 AromaticContact CZ-CE1 3.98Å; F758-F762 HydrophobicContact CZ-CE1 3.98Å; F758-F762 HydrophobicContact CZ-CZ 4.44Å; V759-F762 HydrophobicContact CG1-CD2 4.23Å; V759-F762 HydrophobicContact CG2-CE2 4.37Å; V759-F762 WeakPolarHBondContact O-CB 3.45Å; V759-F762 WeakPolarHBondContact O-CG 3.37Å; V759-F762 PolarHBondContact O-N 2.92Å; K760-F762 PolarHBondContact O-N 3.41Å; F762-A764 VanDerWaalsContact C-N 3.26Å; F762-A764 HydrophobicContact CB-CB 4.21Å; F762-A764 PolarHBondContact O-N 3.33Å
763	G	93.2	Very high	95.2	Very high	50 Å²	50	49.9 Å²	49.9	52%	0.515	28%	0.284	S	S	.	.			trans	59.8	36.9	-175.5	0	0	0	0	0	112.6	K760 S761 P765	K760-G763 PolarHBondContact O-N 3.12Å; S761-G763 VanDerWaalsContact C-N 3.3Å; S761-G763 PolarHBondContact O-N 3.5Å; G763-P765 WeakPolarHBondContact O-CD 3.43Å
764	A	94.7	Very high	95	Very high	2 Å²	2	46 Å²	46	2%	0.017	26%	0.263	C	S	.	.			trans	-118.8	91.1	-174.3	0	0	0	0	0	110.6	T721 F762 S766 V767 D768	T721-A764 WeakPolarHBondContact OG1-CB 3.38Å; F762-A764 VanDerWaalsContact C-N 3.26Å; F762-A764 HydrophobicContact CB-CB 4.21Å; F762-A764 PolarHBondContact O-N 3.33Å; A764-S766 VanDerWaalsContact C-N 3.27Å; A764-S766 PolarHBondContact O-N 3.1Å; A764-S766 VanDerWaalsContact O-N 3.16Å; A764-V767 HydrophobicContact CB-CB 4.07Å; A764-V767 HydrophobicContact CB-CG2 3.81Å; A764-V767 WeakPolarHBondContact O-CA 3.35Å; A764-V767 WeakPolarHBondContact O-CB 3.24Å; A764-V767 PolarHBondContact O-N 3.12Å; A764-D768 PolarHBondContact O-N 2.96Å
765	P	94.7	Very high	94.8	Very high	90 Å²	90	44 Å²	44	58%	0.584	26%	0.26	S	S	*	.	H	α-helix	trans	-56.7	-37	-172.6	-27.6	34.7	0	0	0	114.3	G763 V767 D768 E769	G763-P765 WeakPolarHBondContact O-CD 3.43Å; P765-V767 PolarHBondContact O-N 3.42Å; P765-D768 PolarHBondContact O-N 3.21Å; P765-E769 WeakPolarHBondContact O-CG 3.14Å; P765-E769 PolarHBondContact O-N 3.46Å
766	S	95	Very high	94.4	Very high	54 Å²	54	46.1 Å²	46.1	38%	0.378	27%	0.271	S	S	.	.	H	α-helix	trans	-67.4	-24.4	178.1	60.9	0	0	0	0	113.4	A764 K770	A764-S766 VanDerWaalsContact C-N 3.27Å; A764-S766 PolarHBondContact O-N 3.1Å; A764-S766 VanDerWaalsContact O-N 3.16Å; S766-K770 WeakPolarHBondContact O-CG 3.48Å
767	V	96.9	Very high	94.1	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-81	-44.3	172.2	-177.5	0	0	0	0	109.2	T721 V759 A764 P765 E769 K770 F771	T721-V767 HydrophobicContact CG2-CG2 4.17Å; T721-V767 WeakPolarHBondContact O-CG2 3.48Å; V759-V767 HydrophobicContact CG1-CB 4.38Å; V759-V767 HydrophobicContact CG1-CG1 3.47Å; V759-V767 VanDerWaalsContact CG1-CG1 3.47Å; A764-V767 HydrophobicContact CB-CB 4.07Å; A764-V767 HydrophobicContact CB-CG2 3.81Å; A764-V767 WeakPolarHBondContact O-CA 3.35Å; A764-V767 WeakPolarHBondContact O-CB 3.24Å; A764-V767 PolarHBondContact O-N 3.12Å; P765-V767 PolarHBondContact O-N 3.42Å; V767-E769 VanDerWaalsContact C-N 3.32Å; V767-E769 PolarHBondContact O-N 3.31Å; V767-K770 WeakPolarHBondContact O-CB 3.26Å; V767-K770 PolarHBondContact O-N 3.03Å; V767-F771 HydrophobicContact CG1-CD2 3.72Å; V767-F771 HydrophobicContact CG1-CE2 3.69Å; V767-F771 WeakPolarHBondContact O-CD2 3.36Å; V767-F771 PolarHBondContact O-N 2.84Å
768	D	95.7	Very high	94	Very high	39 Å²	39	42.7 Å²	42.7	21%	0.209	24%	0.24	C	C	.	.	H	α-helix	trans	-54.9	-47.5	177.5	-65.9	-33.5	0	0	0	111.4	A764 P765 K770 F771 E772	A764-D768 PolarHBondContact O-N 2.96Å; P765-D768 PolarHBondContact O-N 3.21Å; D768-K770 VanDerWaalsContact C-N 3.29Å; D768-K770 PolarHBondContact O-N 3.02Å; D768-F771 PolarHBondContact O-N 2.83Å; D768-F771 VanDerWaalsContact O-N 3.14Å; D768-E772 WeakPolarHBondContact O-CG 3.23Å; D768-E772 PolarHBondContact O-N 3.28Å
769	E	94	Very high	93.8	Very high	124 Å²	124	43.4 Å²	43.4	58%	0.579	24%	0.244	S	C	*	.	H	α-helix	trans	-55.5	-41.9	175.3	-74.9	176	-171.8	0	0	112.3	P765 V767 E772 L773	P765-E769 WeakPolarHBondContact O-CG 3.14Å; P765-E769 PolarHBondContact O-N 3.46Å; V767-E769 VanDerWaalsContact C-N 3.32Å; V767-E769 PolarHBondContact O-N 3.31Å; E769-E772 WeakPolarHBondContact O-CB 3.35Å; E769-E772 PolarHBondContact O-N 2.77Å; E769-L773 VanDerWaalsContact O-CG 3.31Å; E769-L773 WeakPolarHBondContact O-CG 3.39Å; E769-L773 PolarHBondContact O-N 2.75Å
770	K	93.9	Very high	93.6	Very high	67 Å²	67	43.4 Å²	43.4	29%	0.291	24%	0.244	S	C	.	.	H	α-helix	trans	-67.5	-41.1	178.2	-69.8	176.4	-179.7	-178.9	0	111.9	N725 E728 S766 V767 D768 E772 L773 L774	N725-K770 PolarHBondContact OD1-NZ 2.63Å; E728-K770 HydrophobicContact CG-CB 4.06Å; S766-K770 WeakPolarHBondContact O-CG 3.48Å; V767-K770 WeakPolarHBondContact O-CB 3.26Å; V767-K770 PolarHBondContact O-N 3.03Å; D768-K770 VanDerWaalsContact C-N 3.29Å; D768-K770 PolarHBondContact O-N 3.02Å; K770-E772 VanDerWaalsContact C-N 3.31Å; K770-E772 PolarHBondContact O-N 3.26Å; K770-L773 WeakPolarHBondContact O-CB 3.37Å; K770-L773 PolarHBondContact O-N 3.18Å; K770-L774 WeakPolarHBondContact O-CG 3.49Å; K770-L774 PolarHBondContact O-N 3.2Å
771	F	95.2	Very high	93.4	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-68.1	-31	176.3	-85.9	-95	0	0	0	112.3	L727 E728 L731 V756 V759 V767 D768 L774 G775	L727-F771 HydrophobicContact CD2-CZ 4.06Å; L727-F771 HydrophobicContact CG-CZ 4.08Å; E728-F771 HydrophobicContact CB-CD2 4.43Å; E728-F771 HydrophobicContact CB-CE2 3.79Å; E728-F771 HydrophobicContact CB-CZ 4.17Å; L731-F771 HydrophobicContact CD1-CE1 3.8Å; L731-F771 HydrophobicContact CD1-CZ 4.09Å; V756-F771 HydrophobicContact CG2-CB 3.88Å; V756-F771 HydrophobicContact CG2-CD1 4.29Å; V759-F771 HydrophobicContact CB-CE2 4.47Å; V759-F771 HydrophobicContact CG1-CD2 3.93Å; V759-F771 HydrophobicContact CG1-CE2 4.01Å; V759-F771 HydrophobicContact CG1-CG 4.45Å; V759-F771 HydrophobicContact CG2-CD2 4.4Å; V759-F771 HydrophobicContact CG2-CE1 4.07Å; V759-F771 HydrophobicContact CG2-CE2 3.9Å; V759-F771 HydrophobicContact CG2-CZ 3.73Å; V767-F771 HydrophobicContact CG1-CD2 3.72Å; V767-F771 HydrophobicContact CG1-CE2 3.69Å; V767-F771 WeakPolarHBondContact O-CD2 3.36Å; V767-F771 PolarHBondContact O-N 2.84Å; D768-F771 PolarHBondContact O-N 2.83Å; D768-F771 VanDerWaalsContact O-N 3.14Å; F771-L774 HydrophobicContact CD1-CD1 3.93Å; F771-L774 HydrophobicContact CE1-CD1 4.13Å; F771-L774 HydrophobicContact CG-CD1 4.3Å; F771-L774 WeakPolarHBondContact O-CB 3.48Å; F771-L774 PolarHBondContact O-N 3.24Å; F771-G775 PolarHBondContact O-N 2.77Å; F771-G775 VanDerWaalsContact O-N 3.16Å
772	E	91.7	Very high	93.2	Very high	127 Å²	127	36.6 Å²	36.6	59%	0.593	21%	0.209	S	C	*	.	H	α-helix	trans	-63.9	-43	168.7	-71.5	-177.2	172.1	0	0	111.8	D768 E769 K770 L774 G775 I776	D768-E772 WeakPolarHBondContact O-CG 3.23Å; D768-E772 PolarHBondContact O-N 3.28Å; E769-E772 WeakPolarHBondContact O-CB 3.35Å; E769-E772 PolarHBondContact O-N 2.77Å; K770-E772 VanDerWaalsContact C-N 3.31Å; K770-E772 PolarHBondContact O-N 3.26Å; E772-L774 VanDerWaalsContact C-N 3.32Å; E772-L774 PolarHBondContact O-N 3.1Å; E772-G775 WeakPolarHBondContact O-CA 3.33Å; E772-G775 PolarHBondContact O-N 3.09Å; E772-I776 PolarHBondContact O-N 3.06Å
773	L	91.4	Very high	92.9	Very high	50 Å²	50	37.8 Å²	37.8	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-62.1	-36.7	173.7	-69.7	178.8	0	0	0	112.3	E769 K770 G775 I776 I777 I798	E769-L773 VanDerWaalsContact O-CG 3.31Å; E769-L773 WeakPolarHBondContact O-CG 3.39Å; E769-L773 PolarHBondContact O-N 2.75Å; K770-L773 WeakPolarHBondContact O-CB 3.37Å; K770-L773 PolarHBondContact O-N 3.18Å; L773-G775 PolarHBondContact O-N 3.31Å; L773-I776 HydrophobicContact CD2-CD1 4.04Å; L773-I776 WeakPolarHBondContact O-CB 3.38Å; L773-I776 PolarHBondContact O-N 3.23Å; L773-I776 VanDerWaalsContact O-N 3.11Å; L773-I777 PolarHBondContact O-N 2.97Å; L773-I798 HydrophobicContact CB-CG2 3.8Å; L773-I798 HydrophobicContact CD1-CG2 3.96Å; L773-I798 HydrophobicContact CD2-CG2 3.88Å; L773-I798 HydrophobicContact CG-CG2 4.08Å
774	L	92.7	Very high	92.8	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-60.8	-35.4	170.8	-64.3	-177.8	0	0	0	112	E728 L732 W735 L752 K770 F771 E772 I776 I777 A778	E728-L774 HydrophobicContact CG-CD1 4Å; E728-L774 HydrophobicContact CG-CD2 4.43Å; E728-L774 HydrophobicContact CG-CG 4.33Å; L732-L774 HydrophobicContact CD1-CD2 4.08Å; L732-L774 HydrophobicContact CD2-CD2 3.34Å; L732-L774 HydrophobicContact CG-CD2 3.59Å; W735-L774 HydrophobicContact CH2-CD1 4.47Å; W735-L774 HydrophobicContact CZ3-CD1 4.1Å; L752-L774 HydrophobicContact CD1-CB 4.44Å; L752-L774 WeakPolarHBondContact CD1-O 3.31Å; L752-L774 HydrophobicContact CD2-CB 3.62Å; L752-L774 HydrophobicContact CD2-CD1 3.96Å; L752-L774 HydrophobicContact CD2-CG 4.47Å; K770-L774 WeakPolarHBondContact O-CG 3.49Å; K770-L774 PolarHBondContact O-N 3.2Å; F771-L774 HydrophobicContact CD1-CD1 3.93Å; F771-L774 HydrophobicContact CE1-CD1 4.13Å; F771-L774 HydrophobicContact CG-CD1 4.3Å; F771-L774 WeakPolarHBondContact O-CB 3.48Å; F771-L774 PolarHBondContact O-N 3.24Å; E772-L774 VanDerWaalsContact C-N 3.32Å; E772-L774 PolarHBondContact O-N 3.1Å; L774-I776 VanDerWaalsContact C-N 3.3Å; L774-I776 PolarHBondContact O-N 3.27Å; L774-I777 HydrophobicContact CD2-CD1 4.3Å; L774-I777 CarbonylContact O-C 3.57Å; L774-I777 WeakPolarHBondContact O-CB 3.18Å; L774-I777 PolarHBondContact O-N 3.23Å; L774-A778 PolarHBondContact O-N 3Å
775	G	91.7	Very high	92.4	Very high	21 Å²	21	39.2 Å²	39.2	22%	0.216	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-38.2	172.7	0	0	0	0	0	113	F771 E772 L773 A778 N779	F771-G775 PolarHBondContact O-N 2.77Å; F771-G775 VanDerWaalsContact O-N 3.16Å; E772-G775 WeakPolarHBondContact O-CA 3.33Å; E772-G775 PolarHBondContact O-N 3.09Å; L773-G775 PolarHBondContact O-N 3.31Å; G775-A778 PolarHBondContact O-N 3.31Å; G775-N779 PolarHBondContact O-N 2.7Å; G775-N779 PolarHBondContact O-ND2 3.41Å
776	I	89.6	Confident	92	Very high	43 Å²	43	40.6 Å²	40.6	22%	0.221	22%	0.224	C	C	.	.	H	α-helix	trans	-68.1	-43	173.5	-55.9	176.9	0	0	0	110.3	E772 L773 L774 A778 N779 S795 I798	E772-I776 PolarHBondContact O-N 3.06Å; L773-I776 HydrophobicContact CD2-CD1 4.04Å; L773-I776 WeakPolarHBondContact O-CB 3.38Å; L773-I776 PolarHBondContact O-N 3.23Å; L773-I776 VanDerWaalsContact O-N 3.11Å; L774-I776 VanDerWaalsContact C-N 3.3Å; L774-I776 PolarHBondContact O-N 3.27Å; I776-A778 VanDerWaalsContact C-N 3.29Å; I776-A778 PolarHBondContact O-N 3.28Å; I776-N779 WeakPolarHBondContact O-CB 3.29Å; I776-N779 PolarHBondContact O-N 3.12Å; I776-N779 VanDerWaalsContact O-N 3.1Å; I776-S795 WeakPolarHBondContact CD1-OG 3.37Å; I776-I798 HydrophobicContact CB-CD1 4.05Å; I776-I798 HydrophobicContact CG2-CD1 3.58Å
777	I	90.5	Very high	91.7	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-38.2	175.7	-67.6	172.3	0	0	0	111	L732 L773 L774 N779 V780 I798 D801 F805	L732-I777 HydrophobicContact CD2-CD1 4.26Å; L773-I777 PolarHBondContact O-N 2.97Å; L774-I777 HydrophobicContact CD2-CD1 4.3Å; L774-I777 CarbonylContact O-C 3.57Å; L774-I777 WeakPolarHBondContact O-CB 3.18Å; L774-I777 PolarHBondContact O-N 3.23Å; I777-N779 VanDerWaalsContact C-N 3.29Å; I777-N779 PolarHBondContact O-N 3.26Å; I777-V780 WeakPolarHBondContact O-CB 3.45Å; I777-V780 WeakPolarHBondContact O-CG2 3.23Å; I777-V780 PolarHBondContact O-N 2.82Å; I777-V780 VanDerWaalsContact O-N 3.08Å; I777-I798 HydrophobicContact CD1-CB 4.42Å; I777-I798 HydrophobicContact CD1-CG2 4.4Å; I777-I798 HydrophobicContact CG1-CB 4.42Å; I777-I798 HydrophobicContact CG1-CD1 4.23Å; I777-D801 HydrophobicContact CD1-CB 4.03Å; I777-F805 HydrophobicContact CG2-CB 3.99Å; I777-F805 HydrophobicContact CG2-CD1 3.35Å; I777-F805 HydrophobicContact CG2-CD2 4.17Å; I777-F805 HydrophobicContact CG2-CE1 3.85Å; I777-F805 HydrophobicContact CG2-CG 3.56Å; I777-F805 HydrophobicContact CG2-CZ 4.43Å
778	A	92.4	Very high	91.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-31.4	176.5	0	0	0	0	0	113.5	L748 L752 L774 G775 I776 V780 F781	L748-A778 HydrophobicContact CD2-CB 3.96Å; L748-A778 HydrophobicContact CG-CB 4.15Å; L752-A778 HydrophobicContact CD1-CB 3.46Å; L752-A778 VanDerWaalsContact CD1-CB 3.46Å; L774-A778 PolarHBondContact O-N 3Å; G775-A778 PolarHBondContact O-N 3.31Å; I776-A778 VanDerWaalsContact C-N 3.29Å; I776-A778 PolarHBondContact O-N 3.28Å; A778-V780 PolarHBondContact O-N 3.21Å; A778-F781 PolarHBondContact O-N 3.29Å; A778-F781 VanDerWaalsContact O-N 3.1Å
779	N	92.2	Very high	90.7	Very high	35 Å²	35	40.6 Å²	40.6	19%	0.187	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-21.4	175.5	-63.5	-38	0	0	0	112.2	K749 G775 I776 I777 F781 I782 V783 L791	K749-N779 PolarHBondContact NZ-OD1 3.09Å; G775-N779 PolarHBondContact O-N 2.7Å; G775-N779 PolarHBondContact O-ND2 3.41Å; I776-N779 WeakPolarHBondContact O-CB 3.29Å; I776-N779 PolarHBondContact O-N 3.12Å; I776-N779 VanDerWaalsContact O-N 3.1Å; I777-N779 VanDerWaalsContact C-N 3.29Å; I777-N779 PolarHBondContact O-N 3.26Å; N779-F781 PolarHBondContact O-N 2.87Å; N779-F781 VanDerWaalsContact O-N 3.12Å; N779-I782 PolarHBondContact O-N 3.45Å; N779-V783 WeakPolarHBondContact O-CG2 3.45Å; N779-V783 PolarHBondContact O-N 2.75Å; N779-L791 HydrophobicContact CB-CD1 4.04Å; N779-L791 HydrophobicContact CB-CD2 4.24Å
780	V	92.3	Very high	90.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-54.1	-29.5	172.1	172.4	0	0	0	0	112	I777 A778 L788 F792 I806 R809	I777-V780 WeakPolarHBondContact O-CB 3.45Å; I777-V780 WeakPolarHBondContact O-CG2 3.23Å; I777-V780 PolarHBondContact O-N 2.82Å; I777-V780 VanDerWaalsContact O-N 3.08Å; A778-V780 PolarHBondContact O-N 3.21Å; V780-L788 HydrophobicContact CB-CD2 4.44Å; V780-L788 HydrophobicContact CG1-CD2 4.09Å; V780-F792 HydrophobicContact CG2-CE1 3.99Å; V780-F792 HydrophobicContact CG2-CZ 3.7Å; V780-I806 HydrophobicContact CG1-CB 4.31Å; V780-I806 HydrophobicContact CG1-CD1 4.3Å; V780-I806 HydrophobicContact CG1-CG1 3.31Å; V780-R809 WeakPolarHBondContact O-CD 3.47Å; V780-R809 PolarHBondContact O-NH1 3.37Å
781	F	92.4	Very high	89.9	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-89.5	-18	-179.6	-57.5	-57.4	0	0	0	113.6	F740 P742 L748 A778 N779 F805 L808 R809	F740-F781 HydrophobicContact CB-CB 3.94Å; F740-F781 HydrophobicContact CB-CD1 3.34Å; F740-F781 HydrophobicContact CB-CD2 4.14Å; F740-F781 HydrophobicContact CB-CE1 3.75Å; F740-F781 HydrophobicContact CB-CE2 4.48Å; F740-F781 HydrophobicContact CB-CG 3.54Å; F740-F781 HydrophobicContact CB-CZ 4.29Å; F740-F781 AromaticContact CD1-CD2 3.89Å; F740-F781 HydrophobicContact CD1-CD2 3.89Å; F740-F781 AromaticContact CD1-CE2 3.99Å; F740-F781 HydrophobicContact CD1-CE2 3.99Å; F740-F781 HydrophobicContact CD1-CG 4.16Å; F740-F781 HydrophobicContact CD1-CZ 4.36Å; F740-F781 HydrophobicContact CD2-CD1 4.01Å; F740-F781 HydrophobicContact CD2-CD2 4.33Å; F740-F781 AromaticContact CD2-CE1 3.5Å; F740-F781 HydrophobicContact CD2-CE1 3.5Å; F740-F781 VanDerWaalsContact CD2-CE1 3.5Å; F740-F781 AromaticContact CD2-CE2 3.84Å; F740-F781 HydrophobicContact CD2-CE2 3.84Å; F740-F781 HydrophobicContact CD2-CG 4.39Å; F740-F781 AromaticContact CD2-CZ 3.38Å; F740-F781 HydrophobicContact CD2-CZ 3.38Å; F740-F781 HydrophobicContact CE1-CD2 4.43Å; F740-F781 HydrophobicContact CE1-CE2 4.2Å; F740-F781 HydrophobicContact CE2-CE1 4.3Å; F740-F781 HydrophobicContact CE2-CE2 4.05Å; F740-F781 AromaticContact CE2-CZ 3.73Å; F740-F781 HydrophobicContact CE2-CZ 3.73Å; F740-F781 AromaticContact CG-CD1 3.74Å; F740-F781 HydrophobicContact CG-CD1 3.74Å; F740-F781 AromaticContact CG-CD2 3.86Å; F740-F781 HydrophobicContact CG-CD2 3.86Å; F740-F781 AromaticContact CG-CE1 3.72Å; F740-F781 HydrophobicContact CG-CE1 3.72Å; F740-F781 AromaticContact CG-CE2 3.84Å; F740-F781 HydrophobicContact CG-CE2 3.84Å; F740-F781 AromaticContact CG-CG 3.79Å; F740-F781 HydrophobicContact CG-CG 3.79Å; F740-F781 AromaticContact CG-CZ 3.76Å; F740-F781 HydrophobicContact CG-CZ 3.76Å; F740-F781 HydrophobicContact CZ-CE2 4.23Å; F740-F781 HydrophobicContact CZ-CZ 4.37Å; P742-F781 WeakPolarHBondContact CA-O 3.22Å; L748-F781 HydrophobicContact CD2-CD2 3.81Å; L748-F781 HydrophobicContact CD2-CE2 3.74Å; A778-F781 PolarHBondContact O-N 3.29Å; A778-F781 VanDerWaalsContact O-N 3.1Å; N779-F781 PolarHBondContact O-N 2.87Å; N779-F781 VanDerWaalsContact O-N 3.12Å; F781-F805 WeakPolarHBondContact CE1-O 3.34Å; F781-F805 AromaticContact CE2-CD1 3.76Å; F781-F805 HydrophobicContact CE2-CD1 3.76Å; F781-F805 HydrophobicContact CE2-CE1 4.47Å; F781-F805 HydrophobicContact CZ-CB 4.05Å; F781-F805 AromaticContact CZ-CD1 3.56Å; F781-F805 HydrophobicContact CZ-CD1 3.56Å; F781-F805 HydrophobicContact CZ-CE1 4.47Å; F781-F805 HydrophobicContact CZ-CG 4.26Å; F781-L808 HydrophobicContact CE1-CB 4.01Å; F781-L808 HydrophobicContact CZ-CB 4.28Å; F781-L808 HydrophobicContact CZ-CD1 4.46Å; F781-R809 HydrophobicContact CD1-CG 3.81Å; F781-R809 HydrophobicContact CE1-CG 4.23Å
782	I	90.6	Very high	89.2	Confident	46 Å²	46	37.2 Å²	37.2	24%	0.236	22%	0.218	C	C	.	.	H	α-helix	trans	-96.2	-41.7	-172	-58.4	165.9	0	0	0	111	L746 K749 N779	L746-I782 HydrophobicContact CD2-CD1 3.84Å; L746-I782 HydrophobicContact CD2-CG1 4.26Å; L746-I782 HydrophobicContact CD2-CG2 4.13Å; L746-I782 HydrophobicContact CG-CD1 4.32Å; L746-I782 HydrophobicContact CG-CG1 4.29Å; L746-I782 HydrophobicContact CG-CG2 4.46Å; K749-I782 HydrophobicContact CB-CD1 4.44Å; K749-I782 HydrophobicContact CD-CD1 4.05Å; N779-I782 PolarHBondContact O-N 3.45Å
783	V	91.3	Very high	88.6	Confident	33 Å²	33	38.1 Å²	38.1	20%	0.2	22%	0.222	C	C	.	.	S	Bend	trans	-71.3	154.5	-174.1	-58.6	0	0	0	0	112.2	N779 L788 L791 R809	N779-V783 WeakPolarHBondContact O-CG2 3.45Å; N779-V783 PolarHBondContact O-N 2.75Å; V783-L788 HydrophobicContact CG2-CD2 3.58Å; V783-L788 HydrophobicContact CG2-CG 4.03Å; V783-L791 HydrophobicContact CB-CD1 4.39Å; V783-L791 HydrophobicContact CG1-CD1 3.99Å; V783-L791 HydrophobicContact CG1-CD2 4.29Å; V783-L791 HydrophobicContact CG1-CG 4.44Å; V783-L791 HydrophobicContact CG2-CD1 3.52Å; V783-L791 HydrophobicContact CG2-CG 4.34Å; V783-R809 PolarHBondContact O-NH1 2.83Å; V783-R809 PolarHBondContact O-NH2 2.87Å
784	A	90	Very high	87.9	Confident	56 Å²	56	39.1 Å²	39.1	46%	0.463	24%	0.244	S	C	.	.			trans	-63.6	149.9	171.2	0	0	0	0	0	111	D786 S787	A784-D786 PolarHBondContact O-N 3.11Å; A784-S787 PolarHBondContact O-N 3.48Å
785	P	86.3	Confident	87.3	Confident	25 Å²	25	40 Å²	40	16%	0.162	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-44.5	-38.5	177.4	-37.8	41.1	0	0	0	115.8	S787 L788 D811 A815 L817	P785-S787 VanDerWaalsContact C-N 3.33Å; P785-S787 PolarHBondContact O-N 3.29Å; P785-L788 PolarHBondContact O-N 3.37Å; P785-D811 WeakPolarHBondContact CG-OD2 3.44Å; P785-A815 HydrophobicContact CB-CB 4.28Å; P785-A815 HydrophobicContact CG-CB 3.81Å; P785-L817 HydrophobicContact CB-CD2 3.63Å; P785-L817 HydrophobicContact CG-CD2 4.12Å
786	D	87	Confident	86.6	Confident	120 Å²	120	42.9 Å²	42.9	64%	0.642	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-77.6	-18.1	-175.3	-58.4	-34.3	0	0	0	113.1	A784 P789 K820	A784-D786 PolarHBondContact O-N 3.11Å; D786-P789 WeakPolarHBondContact O-CD 3.2Å; D786-K820 IonicContact OD1-NZ 3.72Å; D786-K820 PolarHBondContact OD1-NZ 2.78Å
787	S	88.9	Confident	86.1	Confident	52 Å²	52	45 Å²	45	36%	0.364	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-90.4	-11	177	-55.2	0	0	0	0	113.3	A784 P785 P789 T790	A784-S787 PolarHBondContact O-N 3.48Å; P785-S787 VanDerWaalsContact C-N 3.33Å; P785-S787 PolarHBondContact O-N 3.29Å; S787-P789 VanDerWaalsContact C-CD 3.42Å; S787-T790 PolarHBondContact O-N 3.22Å; S787-T790 PolarHBondContact O-OG1 2.85Å
788	L	87.2	Confident	85.7	Confident	0 Å²	0	45 Å²	45	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-53.8	-42.6	-179.9	-73.3	170.7	0	0	0	114	V780 V783 P785 T790 L791 F792 I806 L817 L821	V780-L788 HydrophobicContact CB-CD2 4.44Å; V780-L788 HydrophobicContact CG1-CD2 4.09Å; V783-L788 HydrophobicContact CG2-CD2 3.58Å; V783-L788 HydrophobicContact CG2-CG 4.03Å; P785-L788 PolarHBondContact O-N 3.37Å; L788-T790 VanDerWaalsContact C-N 3.29Å; L788-T790 PolarHBondContact O-N 3.43Å; L788-L791 HydrophobicContact CD2-CD1 4.37Å; L788-L791 PolarHBondContact O-N 3.02Å; L788-F792 WeakPolarHBondContact O-CD2 3.38Å; L788-F792 WeakPolarHBondContact O-CE2 3.41Å; L788-I806 HydrophobicContact CD2-CG1 4.49Å; L788-L817 HydrophobicContact CD1-CD1 4.05Å; L788-L817 HydrophobicContact CD1-CD2 4.16Å; L788-L821 HydrophobicContact CB-CD1 4.42Å; L788-L821 HydrophobicContact CB-CD2 4.05Å; L788-L821 HydrophobicContact CD1-CD1 3.9Å
789	P	84.3	Confident	85.2	Confident	40 Å²	40	49.9 Å²	49.9	26%	0.26	30%	0.303	S	S	.	.	H	α-helix	trans	-56.9	-41.6	178.3	-24.4	33.9	0	0	0	113.4	D786 S787 L791 F792 L821 L824	D786-P789 WeakPolarHBondContact O-CD 3.2Å; S787-P789 VanDerWaalsContact C-CD 3.42Å; P789-L791 VanDerWaalsContact C-N 3.26Å; P789-L791 PolarHBondContact O-N 3.26Å; P789-F792 PolarHBondContact O-N 2.91Å; P789-L821 HydrophobicContact CG-CD2 3.9Å; P789-L824 HydrophobicContact CB-CD1 3.88Å; P789-L824 HydrophobicContact CB-CD2 4.32Å; P789-L824 HydrophobicContact CG-CD1 4.03Å
790	T	86	Confident	84.7	Confident	84 Å²	84	54.6 Å²	54.6	52%	0.515	32%	0.322	S	S	.	.	H	α-helix	trans	-65.8	-26.4	-176.4	65.8	0	0	0	0	113.1	S787 L788 F792	S787-T790 PolarHBondContact O-N 3.22Å; S787-T790 PolarHBondContact O-OG1 2.85Å; L788-T790 VanDerWaalsContact C-N 3.29Å; L788-T790 PolarHBondContact O-N 3.43Å; T790-F792 PolarHBondContact O-N 2.76Å
791	L	83.8	Confident	84.2	Confident	36 Å²	36	57 Å²	57	19%	0.188	33%	0.334	C	S	.	.	H	α-helix	trans	-65.7	-24.3	178.1	-70	-178.3	0	0	0	113.2	N779 V783 L788 P789	N779-L791 HydrophobicContact CB-CD1 4.04Å; N779-L791 HydrophobicContact CB-CD2 4.24Å; V783-L791 HydrophobicContact CB-CD1 4.39Å; V783-L791 HydrophobicContact CG1-CD1 3.99Å; V783-L791 HydrophobicContact CG1-CD2 4.29Å; V783-L791 HydrophobicContact CG1-CG 4.44Å; V783-L791 HydrophobicContact CG2-CD1 3.52Å; V783-L791 HydrophobicContact CG2-CG 4.34Å; L788-L791 HydrophobicContact CD2-CD1 4.37Å; L788-L791 PolarHBondContact O-N 3.02Å; P789-L791 VanDerWaalsContact C-N 3.26Å; P789-L791 PolarHBondContact O-N 3.26Å
792	F	80.4	Confident	83.9	Confident	3 Å²	3	56.9 Å²	56.9	1%	0.013	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	2.1	-172.9	-49.5	-59.5	0	0	0	114.1	V780 L788 P789 T790 I798 R799 A802 I806	V780-F792 HydrophobicContact CG2-CE1 3.99Å; V780-F792 HydrophobicContact CG2-CZ 3.7Å; L788-F792 WeakPolarHBondContact O-CD2 3.38Å; L788-F792 WeakPolarHBondContact O-CE2 3.41Å; P789-F792 PolarHBondContact O-N 2.91Å; T790-F792 PolarHBondContact O-N 2.76Å; F792-I798 HydrophobicContact CD1-CD1 3.91Å; F792-I798 HydrophobicContact CD1-CG1 4.26Å; F792-I798 HydrophobicContact CE1-CD1 4.14Å; F792-R799 HydrophobicContact CB-CG 4.3Å; F792-A802 HydrophobicContact CD1-CB 3.87Å; F792-A802 HydrophobicContact CE1-CB 3.18Å; F792-A802 HydrophobicContact CE2-CB 4.42Å; F792-A802 HydrophobicContact CZ-CB 3.5Å; F792-I806 HydrophobicContact CE2-CD1 3.75Å; F792-I806 HydrophobicContact CZ-CD1 3.77Å
793	E	80	Confident	83.7	Confident	145 Å²	145	58 Å²	58	68%	0.678	34%	0.338	S	S	*	.	S	Bend	trans	-65.2	-41.4	177.5	-71.9	179.9	-176.5	0	0	111.4
794	G	77.3	Confident	83.6	Confident	71 Å²	71	63.2 Å²	63.2	73%	0.732	36%	0.355	S	S	*	.	S	Bend	trans	-87.6	-10.1	-178.3	0	0	0	0	0	116.1
795	S	80.2	Confident	83.7	Confident	22 Å²	22	60.6 Å²	60.6	15%	0.154	33%	0.333	C	S	.	.			trans	-139.6	73.9	-173.5	-54.5	0	0	0	0	111.3	I776 S797 I798	I776-S795 WeakPolarHBondContact CD1-OG 3.37Å; S795-S797 PolarHBondContact O-N 3.37Å; S795-I798 WeakPolarHBondContact O-CG1 3.29Å; S795-I798 PolarHBondContact O-N 2.8Å
796	P	75.4	Confident	84	Confident	82 Å²	82	59.4 Å²	59.4	53%	0.532	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-65.1	-23.8	-177.6	24.3	-32.6	0	0	0	113.6	I798 R799	P796-I798 VanDerWaalsContact C-N 3.31Å; P796-I798 PolarHBondContact O-N 3.04Å; P796-R799 WeakPolarHBondContact O-CG 3.05Å; P796-R799 PolarHBondContact O-N 2.79Å
797	S	80.1	Confident	84.2	Confident	88 Å²	88	58.6 Å²	58.6	62%	0.615	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-61.1	-34.3	179.9	50.7	0	0	0	0	113.5	S795 R799	S795-S797 PolarHBondContact O-N 3.37Å; S797-R799 VanDerWaalsContact C-N 3.34Å; S797-R799 PolarHBondContact O-N 2.79Å
798	I	81.5	Confident	84.4	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.031	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-84.2	-3.3	-176.9	60.2	162.1	0	0	0	113.7	L773 I776 I777 F792 S795 P796 K800 D801 A802	L773-I798 HydrophobicContact CB-CG2 3.8Å; L773-I798 HydrophobicContact CD1-CG2 3.96Å; L773-I798 HydrophobicContact CD2-CG2 3.88Å; L773-I798 HydrophobicContact CG-CG2 4.08Å; I776-I798 HydrophobicContact CB-CD1 4.05Å; I776-I798 HydrophobicContact CG2-CD1 3.58Å; I777-I798 HydrophobicContact CD1-CB 4.42Å; I777-I798 HydrophobicContact CD1-CG2 4.4Å; I777-I798 HydrophobicContact CG1-CB 4.42Å; I777-I798 HydrophobicContact CG1-CD1 4.23Å; F792-I798 HydrophobicContact CD1-CD1 3.91Å; F792-I798 HydrophobicContact CD1-CG1 4.26Å; F792-I798 HydrophobicContact CE1-CD1 4.14Å; S795-I798 WeakPolarHBondContact O-CG1 3.29Å; S795-I798 PolarHBondContact O-N 2.8Å; P796-I798 VanDerWaalsContact C-N 3.31Å; P796-I798 PolarHBondContact O-N 3.04Å; I798-K800 PolarHBondContact O-N 3.12Å; I798-K800 VanDerWaalsContact O-N 3.14Å; I798-D801 PolarHBondContact O-N 2.97Å; I798-D801 VanDerWaalsContact O-N 3.16Å; I798-A802 WeakPolarHBondContact O-CB 2.86Å; I798-A802 PolarHBondContact O-N 3.05Å
799	R	81.3	Confident	84.7	Confident	101 Å²	101	58 Å²	58	38%	0.381	31%	0.309	S	S	.	.	H	α-helix	trans	-57.3	-35.4	-171.6	-74.6	-177.8	-171.2	173.4	5.4	113.7	F792 P796 S797 Q803	F792-R799 HydrophobicContact CB-CG 4.3Å; P796-R799 WeakPolarHBondContact O-CG 3.05Å; P796-R799 PolarHBondContact O-N 2.79Å; S797-R799 VanDerWaalsContact C-N 3.34Å; S797-R799 PolarHBondContact O-N 2.79Å; R799-Q803 WeakPolarHBondContact O-CB 3.49Å; R799-Q803 PolarHBondContact O-N 3.14Å
800	K	81.7	Confident	85	Confident	135 Å²	135	61.5 Å²	61.5	59%	0.587	32%	0.322	S	S	*	.	H	α-helix	trans	-67.3	-47.8	178.3	-72	-174	178.9	-179.3	0	111.9	I798 Q803 R804	I798-K800 PolarHBondContact O-N 3.12Å; I798-K800 VanDerWaalsContact O-N 3.14Å; K800-Q803 PolarHBondContact O-N 3.27Å; K800-R804 PolarHBondContact O-N 3.02Å
801	D	83.4	Confident	85.3	Confident	49 Å²	49	59.4 Å²	59.4	26%	0.262	31%	0.308	S	S	.	.	H	α-helix	trans	-69.6	-42.9	177.8	-63.3	-45.9	0	0	0	110.4	I777 I798 Q803 R804 F805	I777-D801 HydrophobicContact CD1-CB 4.03Å; I798-D801 PolarHBondContact O-N 2.97Å; I798-D801 VanDerWaalsContact O-N 3.16Å; D801-Q803 VanDerWaalsContact C-N 3.28Å; D801-Q803 PolarHBondContact O-N 3.47Å; D801-R804 WeakPolarHBondContact O-CA 3.44Å; D801-R804 WeakPolarHBondContact O-CB 3.11Å; D801-R804 PolarHBondContact O-N 2.84Å; D801-F805 VanDerWaalsContact O-CD2 3.22Å; D801-F805 WeakPolarHBondContact O-CD2 3.45Å; D801-F805 PolarHBondContact O-N 2.9Å
802	A	85.9	Confident	85.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-53.9	-41.9	174.2	0	0	0	0	0	113.1	F792 I798 R804 F805 I806	F792-A802 HydrophobicContact CD1-CB 3.87Å; F792-A802 HydrophobicContact CE1-CB 3.18Å; F792-A802 HydrophobicContact CE2-CB 4.42Å; F792-A802 HydrophobicContact CZ-CB 3.5Å; I798-A802 WeakPolarHBondContact O-CB 2.86Å; I798-A802 PolarHBondContact O-N 3.05Å; A802-R804 VanDerWaalsContact C-N 3.34Å; A802-R804 PolarHBondContact O-N 3.17Å; A802-F805 PolarHBondContact O-N 3.39Å; A802-I806 WeakPolarHBondContact O-CB 3.17Å; A802-I806 WeakPolarHBondContact O-CD1 3.41Å; A802-I806 VanDerWaalsContact O-CG1 3.27Å; A802-I806 WeakPolarHBondContact O-CG1 3.42Å; A802-I806 PolarHBondContact O-N 3.2Å
803	Q	86.6	Confident	86.1	Confident	70 Å²	70	69.1 Å²	69.1	33%	0.327	35%	0.347	S	S	.	.	H	α-helix	trans	-59.2	-44.9	175.7	-173.4	-179.5	7.4	0	0	111.7	R799 K800 D801 W825	R799-Q803 WeakPolarHBondContact O-CB 3.49Å; R799-Q803 PolarHBondContact O-N 3.14Å; K800-Q803 PolarHBondContact O-N 3.27Å; D801-Q803 VanDerWaalsContact C-N 3.28Å; D801-Q803 PolarHBondContact O-N 3.47Å; Q803-W825 HydrophobicContact CB-CD2 4.1Å; Q803-W825 HydrophobicContact CB-CG 4.38Å; Q803-W825 HydrophobicContact CB-CZ2 3.97Å; Q803-W825 HydrophobicContact CG-CD2 3.7Å; Q803-W825 HydrophobicContact CG-CE3 3.95Å; Q803-W825 HydrophobicContact CG-CG 4.12Å; Q803-W825 HydrophobicContact CG-CH2 4.25Å; Q803-W825 HydrophobicContact CG-CZ2 4.07Å; Q803-W825 HydrophobicContact CG-CZ3 4.19Å
804	R	89.2	Confident	86.5	Confident	143 Å²	143	66.9 Å²	66.9	54%	0.54	35%	0.347	S	S	.	.	H	α-helix	trans	-64	-43.2	176.4	-67	177.6	176.8	176.9	-2.6	110.9	K800 D801 A802 Q807	K800-R804 PolarHBondContact O-N 3.02Å; D801-R804 WeakPolarHBondContact O-CA 3.44Å; D801-R804 WeakPolarHBondContact O-CB 3.11Å; D801-R804 PolarHBondContact O-N 2.84Å; A802-R804 VanDerWaalsContact C-N 3.34Å; A802-R804 PolarHBondContact O-N 3.17Å; R804-Q807 WeakPolarHBondContact O-CB 3.46Å; R804-Q807 PolarHBondContact O-N 3.26Å
805	F	91.7	Very high	87	Confident	1 Å²	1	64.5 Å²	64.5	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-69.5	-32.9	-179	-83.3	-110.9	0	0	0	112.9	L732 W735 Q736 I777 F781 D801 A802 Q807 L808	L732-F805 HydrophobicContact CB-CZ 4.48Å; L732-F805 HydrophobicContact CD2-CE1 4.33Å; L732-F805 HydrophobicContact CD2-CE2 3.57Å; L732-F805 HydrophobicContact CD2-CZ 3.38Å; W735-F805 HydrophobicContact CB-CE1 4.01Å; W735-F805 HydrophobicContact CB-CZ 4.28Å; W735-F805 HydrophobicContact CE3-CE1 4.48Å; Q736-F805 HydrophobicContact CG-CD2 4.48Å; Q736-F805 HydrophobicContact CG-CE2 3.88Å; Q736-F805 HydrophobicContact CG-CZ 4.18Å; I777-F805 HydrophobicContact CG2-CB 3.99Å; I777-F805 HydrophobicContact CG2-CD1 3.35Å; I777-F805 HydrophobicContact CG2-CD2 4.17Å; I777-F805 HydrophobicContact CG2-CE1 3.85Å; I777-F805 HydrophobicContact CG2-CG 3.56Å; I777-F805 HydrophobicContact CG2-CZ 4.43Å; F781-F805 WeakPolarHBondContact CE1-O 3.34Å; F781-F805 AromaticContact CE2-CD1 3.76Å; F781-F805 HydrophobicContact CE2-CD1 3.76Å; F781-F805 HydrophobicContact CE2-CE1 4.47Å; F781-F805 HydrophobicContact CZ-CB 4.05Å; F781-F805 AromaticContact CZ-CD1 3.56Å; F781-F805 HydrophobicContact CZ-CD1 3.56Å; F781-F805 HydrophobicContact CZ-CE1 4.47Å; F781-F805 HydrophobicContact CZ-CG 4.26Å; D801-F805 VanDerWaalsContact O-CD2 3.22Å; D801-F805 WeakPolarHBondContact O-CD2 3.45Å; D801-F805 PolarHBondContact O-N 2.9Å; A802-F805 PolarHBondContact O-N 3.39Å; F805-Q807 PolarHBondContact O-N 3.37Å; F805-L808 HydrophobicContact CD1-CD1 4.29Å; F805-L808 HydrophobicContact CG-CD1 4.33Å; F805-L808 VanDerWaalsContact O-CB 3.31Å; F805-L808 WeakPolarHBondContact O-CB 3.49Å; F805-L808 PolarHBondContact O-N 3.16Å
806	I	91.5	Very high	87.3	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.7	-34	174.8	-76	160.5	0	0	0	112	V780 L788 F792 A802 L808 R809 Y812 L817 L821 W825	V780-I806 HydrophobicContact CG1-CB 4.31Å; V780-I806 HydrophobicContact CG1-CD1 4.3Å; V780-I806 HydrophobicContact CG1-CG1 3.31Å; L788-I806 HydrophobicContact CD2-CG1 4.49Å; F792-I806 HydrophobicContact CE2-CD1 3.75Å; F792-I806 HydrophobicContact CZ-CD1 3.77Å; A802-I806 WeakPolarHBondContact O-CB 3.17Å; A802-I806 WeakPolarHBondContact O-CD1 3.41Å; A802-I806 VanDerWaalsContact O-CG1 3.27Å; A802-I806 WeakPolarHBondContact O-CG1 3.42Å; A802-I806 PolarHBondContact O-N 3.2Å; I806-L808 PolarHBondContact O-N 3.11Å; I806-R809 WeakPolarHBondContact O-CB 3.26Å; I806-R809 PolarHBondContact O-N 3.49Å; I806-Y812 HydrophobicContact CG2-CD2 4.05Å; I806-Y812 HydrophobicContact CG2-CE2 4.2Å; I806-Y812 WeakPolarHBondContact O-CD2 3.39Å; I806-L817 HydrophobicContact CG2-CB 4.28Å; I806-L817 HydrophobicContact CG2-CD1 3.9Å; I806-L821 HydrophobicContact CD1-CD1 3.96Å; I806-L821 HydrophobicContact CG2-CD1 3.87Å; I806-W825 HydrophobicContact CB-CH2 4.3Å; I806-W825 HydrophobicContact CD1-CH2 3.63Å; I806-W825 HydrophobicContact CD1-CZ2 3.42Å; I806-W825 VanDerWaalsContact CD1-CZ2 3.42Å; I806-W825 HydrophobicContact CG2-CH2 4.15Å
807	Q	91.9	Very high	87.8	Confident	103 Å²	103	67 Å²	67	48%	0.481	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.9	175.8	-61.5	177.7	14.6	0	0	112.9	R804 F805 R809 Y812	R804-Q807 WeakPolarHBondContact O-CB 3.46Å; R804-Q807 PolarHBondContact O-N 3.26Å; F805-Q807 PolarHBondContact O-N 3.37Å; Q807-R809 VanDerWaalsContact C-N 3.33Å; Q807-Y812 HydrophobicContact CB-CE2 4.36Å; Q807-Y812 HydrophobicContact CG-CE1 4.41Å; Q807-Y812 HydrophobicContact CG-CE2 3.89Å
808	L	93.6	Very high	88	Confident	27 Å²	27	65.2 Å²	65.2	14%	0.141	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-1.1	178.9	-47.9	174.8	0	0	0	112.6	Q736 T739 F740 F781 F805 I806	Q736-L808 HydrophobicContact CB-CD1 4.46Å; Q736-L808 HydrophobicContact CG-CD1 4.25Å; T739-L808 CarbonylContact C-O 3.58Å; T739-L808 WeakPolarHBondContact CA-O 3.24Å; T739-L808 VanDerWaalsContact CG2-O 3.24Å; T739-L808 WeakPolarHBondContact CG2-O 3.16Å; F740-L808 HydrophobicContact CD2-CB 4.02Å; F740-L808 HydrophobicContact CE2-CB 4.37Å; F740-L808 HydrophobicContact CE2-CD1 4.28Å; F740-L808 PolarHBondContact N-O 3.21Å; F781-L808 HydrophobicContact CE1-CB 4.01Å; F781-L808 HydrophobicContact CZ-CB 4.28Å; F781-L808 HydrophobicContact CZ-CD1 4.46Å; F805-L808 HydrophobicContact CD1-CD1 4.29Å; F805-L808 HydrophobicContact CG-CD1 4.33Å; F805-L808 VanDerWaalsContact O-CB 3.31Å; F805-L808 WeakPolarHBondContact O-CB 3.49Å; F805-L808 PolarHBondContact O-N 3.16Å; I806-L808 PolarHBondContact O-N 3.11Å
809	R	94	Very high	88	Confident	11 Å²	11	69.9 Å²	69.9	4%	0.042	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-69.9	138.5	173.3	-68.2	177.5	59.9	114.1	0.7	110.7	V780 F781 V783 I806 Q807 D811 Y812	V780-R809 WeakPolarHBondContact O-CD 3.47Å; V780-R809 PolarHBondContact O-NH1 3.37Å; F781-R809 HydrophobicContact CD1-CG 3.81Å; F781-R809 HydrophobicContact CE1-CG 4.23Å; V783-R809 PolarHBondContact O-NH1 2.83Å; V783-R809 PolarHBondContact O-NH2 2.87Å; I806-R809 WeakPolarHBondContact O-CB 3.26Å; I806-R809 PolarHBondContact O-N 3.49Å; Q807-R809 VanDerWaalsContact C-N 3.33Å; R809-D811 VanDerWaalsContact CB-OD1 3.23Å; R809-D811 WeakPolarHBondContact CB-OD1 3.25Å; R809-D811 IonicContact CZ-OD1 2.81Å; R809-D811 IonicContact CZ-OD2 2.71Å; R809-D811 IonicContact NE-OD1 2.68Å; R809-D811 PolarHBondContact NE-OD1 2.84Å; R809-D811 IonicContact NE-OD2 2.77Å; R809-D811 IonicContact NH2-OD1 3.53Å; R809-D811 PolarHBondContact NH2-OD1 3.15Å; R809-D811 IonicContact NH2-OD2 3.39Å; R809-D811 PolarHBondContact NH2-OD2 3.18Å; R809-D811 PolarHBondContact O-N 3.17Å; R809-Y812 WeakPolarHBondContact O-CB 3.35Å; R809-Y812 PolarHBondContact O-N 3.31Å; R809-Y812 VanDerWaalsContact O-N 3.1Å
810	E	90.1	Very high	87.9	Confident	115 Å²	115	69.9 Å²	69.9	54%	0.537	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-37.2	174.4	-178	174.4	-157.9	0	0	112	T739 F740 N741 Y812	T739-E810 HydrophobicContact CG2-CB 4.16Å; F740-E810 WeakPolarHBondContact O-CB 3.19Å; F740-E810 PolarHBondContact O-N 2.81Å; N741-E810 HydrophobicContact CB-CB 4.46Å; N741-E810 WeakPolarHBondContact CB-OE2 3.05Å; E810-Y812 VanDerWaalsContact C-N 3.29Å; E810-Y812 PolarHBondContact O-N 2.64Å
811	D	91.5	Very high	87.9	Confident	40 Å²	40	63.6 Å²	63.6	21%	0.214	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	6.2	179.2	71.5	-16.8	0	0	0	114.1	P785 R809 K813 S814 A815	P785-D811 WeakPolarHBondContact CG-OD2 3.44Å; R809-D811 VanDerWaalsContact CB-OD1 3.23Å; R809-D811 WeakPolarHBondContact CB-OD1 3.25Å; R809-D811 IonicContact CZ-OD1 2.81Å; R809-D811 IonicContact CZ-OD2 2.71Å; R809-D811 IonicContact NE-OD1 2.68Å; R809-D811 PolarHBondContact NE-OD1 2.84Å; R809-D811 IonicContact NE-OD2 2.77Å; R809-D811 IonicContact NH2-OD1 3.53Å; R809-D811 PolarHBondContact NH2-OD1 3.15Å; R809-D811 IonicContact NH2-OD2 3.39Å; R809-D811 PolarHBondContact NH2-OD2 3.18Å; R809-D811 PolarHBondContact O-N 3.17Å; D811-K813 VanDerWaalsContact C-N 3.29Å; D811-K813 PolarHBondContact O-N 3.1Å; D811-S814 VanDerWaalsContact CA-OG 3.25Å; D811-S814 WeakPolarHBondContact CA-OG 3.44Å; D811-S814 PolarHBondContact O-N 3.41Å; D811-S814 PolarHBondContact O-OG 3.31Å; D811-A815 HydrophobicContact CB-CB 4.36Å; D811-A815 VanDerWaalsContact O-CB 3.26Å; D811-A815 WeakPolarHBondContact O-CB 3.47Å; D811-A815 PolarHBondContact O-N 3.43Å
812	Y	90.6	Very high	87.5	Confident	57 Å²	57	64.9 Å²	64.9	22%	0.224	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-45.5	-174.5	175.3	-106.9	0	0	0	113.1	I806 Q807 R809 E810 L817	I806-Y812 HydrophobicContact CG2-CD2 4.05Å; I806-Y812 HydrophobicContact CG2-CE2 4.2Å; I806-Y812 WeakPolarHBondContact O-CD2 3.39Å; Q807-Y812 HydrophobicContact CB-CE2 4.36Å; Q807-Y812 HydrophobicContact CG-CE1 4.41Å; Q807-Y812 HydrophobicContact CG-CE2 3.89Å; R809-Y812 WeakPolarHBondContact O-CB 3.35Å; R809-Y812 PolarHBondContact O-N 3.31Å; R809-Y812 VanDerWaalsContact O-N 3.1Å; E810-Y812 VanDerWaalsContact C-N 3.29Å; E810-Y812 PolarHBondContact O-N 2.64Å; Y812-L817 HydrophobicContact CD2-CB 3.86Å; Y812-L817 HydrophobicContact CD2-CD1 4.18Å; Y812-L817 HydrophobicContact CD2-CG 4.44Å; Y812-L817 HydrophobicContact CE2-CB 4.14Å; Y812-L817 PolarHBondContact O-N 2.94Å
813	K	89.7	Confident	86.9	Confident	186 Å²	186	69.7 Å²	69.7	81%	0.809	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-42.5	178.3	-67.2	-176.5	-179.3	176.8	0	112.5	D811 K816	D811-K813 VanDerWaalsContact C-N 3.29Å; D811-K813 PolarHBondContact O-N 3.1Å; K813-K816 PolarHBondContact O-N 3.31Å
814	S	89.4	Confident	86.1	Confident	97 Å²	97	68.2 Å²	68.2	68%	0.678	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-38.2	-175.7	55	0	0	0	0	112.3	D811 K816	D811-S814 VanDerWaalsContact CA-OG 3.25Å; D811-S814 WeakPolarHBondContact CA-OG 3.44Å; D811-S814 PolarHBondContact O-N 3.41Å; D811-S814 PolarHBondContact O-OG 3.31Å; S814-K816 VanDerWaalsContact C-N 3.27Å; S814-K816 PolarHBondContact O-N 2.92Å
815	A	87.7	Confident	85.2	Confident	22 Å²	22	63.1 Å²	63.1	18%	0.182	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-0.1	176.4	0	0	0	0	0	113.8	P785 D811 L817	P785-A815 HydrophobicContact CB-CB 4.28Å; P785-A815 HydrophobicContact CG-CB 3.81Å; D811-A815 HydrophobicContact CB-CB 4.36Å; D811-A815 VanDerWaalsContact O-CB 3.26Å; D811-A815 WeakPolarHBondContact O-CB 3.47Å; D811-A815 PolarHBondContact O-N 3.43Å; A815-L817 VanDerWaalsContact C-N 3.26Å; A815-L817 HydrophobicContact CB-CD2 3.7Å; A815-L817 HydrophobicContact CB-CG 3.96Å; A815-L817 PolarHBondContact O-N 2.84Å
816	K	87	Confident	83.7	Confident	155 Å²	155	68.1 Å²	68.1	67%	0.674	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	42.1	-178.8	-57.5	-180	-178.9	177.7	0	112.7	K813 S814 A818 T819 K820	K813-K816 PolarHBondContact O-N 3.31Å; S814-K816 VanDerWaalsContact C-N 3.27Å; S814-K816 PolarHBondContact O-N 2.92Å; K816-A818 VanDerWaalsContact C-N 3.29Å; K816-A818 PolarHBondContact O-N 3.4Å; K816-T819 PolarHBondContact O-N 3.01Å; K816-T819 VanDerWaalsContact O-N 3.12Å; K816-K820 PolarHBondContact O-N 3.47Å
817	L	86.2	Confident	81.6	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-61.7	-33.7	-170.8	-63.4	-173.3	0	0	0	113.5	P785 L788 I806 Y812 A815 T819 K820 L821	P785-L817 HydrophobicContact CB-CD2 3.63Å; P785-L817 HydrophobicContact CG-CD2 4.12Å; L788-L817 HydrophobicContact CD1-CD1 4.05Å; L788-L817 HydrophobicContact CD1-CD2 4.16Å; I806-L817 HydrophobicContact CG2-CB 4.28Å; I806-L817 HydrophobicContact CG2-CD1 3.9Å; Y812-L817 HydrophobicContact CD2-CB 3.86Å; Y812-L817 HydrophobicContact CD2-CD1 4.18Å; Y812-L817 HydrophobicContact CD2-CG 4.44Å; Y812-L817 HydrophobicContact CE2-CB 4.14Å; Y812-L817 PolarHBondContact O-N 2.94Å; A815-L817 VanDerWaalsContact C-N 3.26Å; A815-L817 HydrophobicContact CB-CD2 3.7Å; A815-L817 HydrophobicContact CB-CG 3.96Å; A815-L817 PolarHBondContact O-N 2.84Å; L817-T819 PolarHBondContact O-N 3.41Å; L817-K820 PolarHBondContact O-N 2.86Å; L817-L821 HydrophobicContact CB-CD1 4.22Å; L817-L821 WeakPolarHBondContact O-CB 3.34Å; L817-L821 WeakPolarHBondContact O-CG 3.21Å; L817-L821 PolarHBondContact O-N 3.35Å
818	A	83.2	Confident	79.2	Confident	51 Å²	51	75.1 Å²	75.1	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-54.6	-40.5	176.2	0	0	0	0	0	112.5	K816 S822	K816-A818 VanDerWaalsContact C-N 3.29Å; K816-A818 PolarHBondContact O-N 3.4Å; A818-S822 PolarHBondContact O-N 3.08Å
819	T	81.7	Confident	76.5	Confident	105 Å²	105	82.4 Å²	82.4	64%	0.644	47%	0.472	S	S	*	.	H	α-helix	trans	-75.4	-45.9	177.9	-46.3	0	0	0	0	111.2	K816 L817 L821 S822	K816-T819 PolarHBondContact O-N 3.01Å; K816-T819 VanDerWaalsContact O-N 3.12Å; L817-T819 PolarHBondContact O-N 3.41Å; T819-L821 VanDerWaalsContact C-N 3.27Å; T819-L821 PolarHBondContact O-N 2.99Å; T819-S822 PolarHBondContact O-N 3.31Å; T819-S822 PolarHBondContact O-OG 3.45Å
820	K	79.7	Confident	75.6	Confident	101 Å²	101	86 Å²	86	44%	0.439	49%	0.493	S	S	.	.	H	α-helix	trans	-60.5	-34.2	-178.1	-73.7	-168.7	172.5	-167.2	0	113.5	D786 K816 L817	D786-K820 IonicContact OD1-NZ 3.72Å; D786-K820 PolarHBondContact OD1-NZ 2.78Å; K816-K820 PolarHBondContact O-N 3.47Å; L817-K820 PolarHBondContact O-N 2.86Å
821	L	81.2	Confident	74.9	Confident	2 Å²	2	84.5 Å²	84.5	1%	0.01	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	4.5	-172.6	-56.7	170.1	0	0	0	112.9	L788 P789 I806 L817 T819 S823 L824 W825	L788-L821 HydrophobicContact CB-CD1 4.42Å; L788-L821 HydrophobicContact CB-CD2 4.05Å; L788-L821 HydrophobicContact CD1-CD1 3.9Å; P789-L821 HydrophobicContact CG-CD2 3.9Å; I806-L821 HydrophobicContact CD1-CD1 3.96Å; I806-L821 HydrophobicContact CG2-CD1 3.87Å; L817-L821 HydrophobicContact CB-CD1 4.22Å; L817-L821 WeakPolarHBondContact O-CB 3.34Å; L817-L821 WeakPolarHBondContact O-CG 3.21Å; L817-L821 PolarHBondContact O-N 3.35Å; T819-L821 VanDerWaalsContact C-N 3.27Å; T819-L821 PolarHBondContact O-N 2.99Å; L821-S823 PolarHBondContact O-N 3.48Å; L821-S823 VanDerWaalsContact O-N 3.13Å; L821-L824 HydrophobicContact CB-CD1 4.19Å; L821-L824 HydrophobicContact CD2-CD1 3.47Å; L821-L824 VanDerWaalsContact CD2-CD1 3.47Å; L821-L824 HydrophobicContact CG-CD1 4.4Å; L821-L824 WeakPolarHBondContact O-CB 3.46Å; L821-L824 PolarHBondContact O-N 3.19Å; L821-W825 HydrophobicContact CB-CE3 3.98Å; L821-W825 HydrophobicContact CB-CH2 3.45Å; L821-W825 VanDerWaalsContact CB-CH2 3.45Å; L821-W825 HydrophobicContact CB-CZ2 4.24Å; L821-W825 HydrophobicContact CB-CZ3 3.29Å; L821-W825 HydrophobicContact CD1-CH2 3.5Å; L821-W825 HydrophobicContact CD1-CZ2 4.3Å; L821-W825 HydrophobicContact CD1-CZ3 4.12Å; L821-W825 HydrophobicContact CG-CH2 4.11Å; L821-W825 HydrophobicContact CG-CZ3 4.36Å
822	S	75.4	Confident	73.9	Confident	76 Å²	76	86.9 Å²	86.9	53%	0.531	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-53.1	-32.7	177	58.6	0	0	0	0	113.5	A818 T819 L824	A818-S822 PolarHBondContact O-N 3.08Å; T819-S822 PolarHBondContact O-N 3.31Å; T819-S822 PolarHBondContact O-OG 3.45Å; S822-L824 VanDerWaalsContact C-N 3.31Å; S822-L824 PolarHBondContact O-N 3.28Å
823	S	73.5	Confident	73	Confident	102 Å²	102	88.7 Å²	88.7	71%	0.713	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-70.8	-21.9	177.1	57.4	0	0	0	0	114.3	L821	L821-S823 PolarHBondContact O-N 3.48Å; L821-S823 VanDerWaalsContact O-N 3.13Å
824	L	69.8	Low	71.9	Confident	38 Å²	38	82.6 Å²	82.6	20%	0.199	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-84.4	-21	-178.4	-68.5	166.5	0	0	0	113	P789 L821 S822	P789-L824 HydrophobicContact CB-CD1 3.88Å; P789-L824 HydrophobicContact CB-CD2 4.32Å; P789-L824 HydrophobicContact CG-CD1 4.03Å; L821-L824 HydrophobicContact CB-CD1 4.19Å; L821-L824 HydrophobicContact CD2-CD1 3.47Å; L821-L824 VanDerWaalsContact CD2-CD1 3.47Å; L821-L824 HydrophobicContact CG-CD1 4.4Å; L821-L824 WeakPolarHBondContact O-CB 3.46Å; L821-L824 PolarHBondContact O-N 3.19Å; S822-L824 VanDerWaalsContact C-N 3.31Å; S822-L824 PolarHBondContact O-N 3.28Å
825	W	69.5	Low	70.7	Confident	37 Å²	37	81.7 Å²	81.7	14%	0.14	49%	0.494	C	S	.	.	S	Bend	trans	-124.8	83.1	-177.8	-50.3	-58.7	0	0	0	110.6	Q803 I806 L821 S827	Q803-W825 HydrophobicContact CB-CD2 4.1Å; Q803-W825 HydrophobicContact CB-CG 4.38Å; Q803-W825 HydrophobicContact CB-CZ2 3.97Å; Q803-W825 HydrophobicContact CG-CD2 3.7Å; Q803-W825 HydrophobicContact CG-CE3 3.95Å; Q803-W825 HydrophobicContact CG-CG 4.12Å; Q803-W825 HydrophobicContact CG-CH2 4.25Å; Q803-W825 HydrophobicContact CG-CZ2 4.07Å; Q803-W825 HydrophobicContact CG-CZ3 4.19Å; I806-W825 HydrophobicContact CB-CH2 4.3Å; I806-W825 HydrophobicContact CD1-CH2 3.63Å; I806-W825 HydrophobicContact CD1-CZ2 3.42Å; I806-W825 VanDerWaalsContact CD1-CZ2 3.42Å; I806-W825 HydrophobicContact CG2-CH2 4.15Å; L821-W825 HydrophobicContact CB-CE3 3.98Å; L821-W825 HydrophobicContact CB-CH2 3.45Å; L821-W825 VanDerWaalsContact CB-CH2 3.45Å; L821-W825 HydrophobicContact CB-CZ2 4.24Å; L821-W825 HydrophobicContact CB-CZ3 3.29Å; L821-W825 HydrophobicContact CD1-CH2 3.5Å; L821-W825 HydrophobicContact CD1-CZ2 4.3Å; L821-W825 HydrophobicContact CD1-CZ3 4.12Å; L821-W825 HydrophobicContact CG-CH2 4.11Å; L821-W825 HydrophobicContact CG-CZ3 4.36Å; W825-S827 PolarHBondContact O-N 3.19Å
826	P	60.4	Low	69.5	Low	106 Å²	106	85.9 Å²	85.9	69%	0.688	52%	0.516	S	S	*	.			trans	-57.1	128.6	169.2	-12.8	25.6	0	0	0	107.8	L828	P826-L828 PolarHBondContact O-N 3.07Å
827	S	48	Very low	68.2	Low	111 Å²	111	80.6 Å²	80.6	78%	0.776	50%	0.504	S	S	*	.			trans	-45.1	106.3	178.4	49.2	0	0	0	0	111.4	W825 S829	W825-S827 PolarHBondContact O-N 3.19Å; S827-S829 PolarHBondContact O-N 2.91Å
828	L	41.6	Very low	66.7	Low	139 Å²	139	87.3 Å²	87.3	73%	0.728	55%	0.546	S	S	*	.			trans	-70.7	87.5	157.2	-81.6	138.7	0	0	0	106.4	P826	P826-L828 PolarHBondContact O-N 3.07Å
829	S	36.4	Very low	65.2	Low	180 Å²	180	90.6 Å²	90.6	100%	1.259	56%	0.557	S	S	*	*			trans	-70.5	0	157.5	58.1	0	0	0	0	110.1	S827	S827-S829 PolarHBondContact O-N 2.91Å

Retrieved 829 of 829 residues in 273.1 ms (Link to these results)

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