ASB9_HUMAN Loading...

Ankyrin repeat and SOCS box protein 9

Substrate-recognition component of a cullin-5-RING E3 ubiquitin-protein ligase complex (ECS complex, also named CRL5 complex), which mediates the ubiquitination and subsequent proteasomal degradation of target proteins^1,2. The ECS(ASB9) complex catalyzes ubiquitination of creatine kinases CKB and CKMT1A^3,4,5,6. Does not interact with the Elongin BC complex, likely to be a negative regulator of isoform 1.

AlphaFold DB , UniProt , Accession Q96DX5, Species HUMAN (Homo sapiens, Human), Gene ASB9, Length 294 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	41.6	Very low	225 Å²	225	142.8 Å²	142.8	100%	1.108	87%	0.871	S	S	*	*				0	58.4	0	-56.6	-161	-162.4	0	0	107.8
2	D	44.8	Very low	41	Very low	162 Å²	162	147 Å²	147	87%	0.866	87%	0.868	S	S	*	*				75.8	112.2	72.6	-61.5	-52.3	0	0	0	113.8
3	G	42.8	Very low	40.6	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	86%	0.863	S	S	*	*			trans	102.4	129.2	152.3	0	0	0	0	0	114.8
4	K	43.9	Very low	40.3	Very low	209 Å²	209	140.6 Å²	140.6	91%	0.909	85%	0.85	S	S	*	*			cis	-161.2	133.2	4.6	-99.3	174.1	172.9	176.3	0	106.3
5	Q	40.7	Very low	39.9	Very low	200 Å²	200	134.8 Å²	134.8	94%	0.935	83%	0.83	S	S	*	*			trans	-72.9	128.5	165.1	-77.6	159.2	-30.6	0	0	108.9
6	G	40.4	Very low	39.9	Very low	79 Å²	79	133.3 Å²	133.3	81%	0.814	82%	0.823	S	S	*	*			trans	-96.3	107.4	165.2	0	0	0	0	0	108.6
7	G	36.5	Very low	40.2	Very low	76 Å²	76	138.3 Å²	138.3	78%	0.784	82%	0.823	S	S	*	*			trans	-68.4	129	176.1	0	0	0	0	0	111.1
8	M	43.2	Very low	40.9	Very low	194 Å²	194	139.8 Å²	139.8	96%	0.956	83%	0.826	S	S	*	*			trans	-81	113.5	158.6	-83.2	-177.1	166.6	0	0	107.6	G10	M8-G10 PolarHBondContact O-N 3.39Å; M8-G10 VanDerWaalsContact O-N 3.11Å
9	D	40.4	Very low	42.2	Very low	160 Å²	160	134.7 Å²	134.7	86%	0.856	79%	0.793	S	S	*	*			trans	-61.2	109	166.2	-86.8	-33	0	0	0	109.2	S11	D9-S11 PolarHBondContact O-N 3.47Å; D9-S11 VanDerWaalsContact O-N 3.15Å
10	G	39.7	Very low	43.7	Very low	74 Å²	74	133.4 Å²	133.4	76%	0.763	79%	0.788	S	S	*	*			trans	-72.5	96.5	166.5	0	0	0	0	0	109.5	M8 K12	M8-G10 PolarHBondContact O-N 3.39Å; M8-G10 VanDerWaalsContact O-N 3.11Å; G10-K12 PolarHBondContact O-N 3.09Å
11	S	43.5	Very low	45.2	Very low	117 Å²	117	128.5 Å²	128.5	82%	0.818	77%	0.766	S	S	*	*			trans	-57.1	106.7	166.2	-61.2	0	0	0	0	109.3	D9	D9-S11 PolarHBondContact O-N 3.47Å; D9-S11 VanDerWaalsContact O-N 3.15Å
12	K	34.2	Very low	47	Very low	193 Å²	193	122.3 Å²	122.3	84%	0.839	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-51.6	140.3	168.2	-84.7	176.4	172.1	176.1	0	109.8	G10 A14	G10-K12 PolarHBondContact O-N 3.09Å; K12-A14 PolarHBondContact O-N 3.03Å
13	P	36.1	Very low	48.7	Very low	122 Å²	122	119.6 Å²	119.6	79%	0.792	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-61.1	131.1	168.2	27.9	-32	0	0	0	108.1	G15	P13-G15 PolarHBondContact O-N 2.93Å
14	A	36.7	Very low	50.2	Low	83 Å²	83	117.7 Å²	117.7	69%	0.686	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-56.1	125.3	172.4	0	0	0	0	0	108	K12	K12-A14 PolarHBondContact O-N 3.03Å
15	G	34	Very low	51.6	Low	53 Å²	53	114.4 Å²	114.4	55%	0.546	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-54.9	166.2	172.4	0	0	0	0	0	111.3	P13 R17	P13-G15 PolarHBondContact O-N 2.93Å; G15-R17 PolarHBondContact O-N 3.28Å
16	P	40.2	Very low	53.1	Low	111 Å²	111	107.8 Å²	107.8	72%	0.721	65%	0.653	S	S	*	*			trans	-57.4	110.3	-172.7	25.3	-31.9	0	0	0	108.5	D18	P16-D18 PolarHBondContact O-N 3.31Å
17	R	44.9	Very low	54.6	Low	218 Å²	218	107.1 Å²	107.1	82%	0.823	63%	0.631	S	S	*	*			trans	-54.3	130.8	168.5	-70.1	-178.7	-179	172.6	3.1	106.5	G15 F19	G15-R17 PolarHBondContact O-N 3.28Å; R17-F19 PolarHBondContact O-N 3.07Å
18	D	52.3	Low	56.4	Low	166 Å²	166	109.5 Å²	109.5	89%	0.888	63%	0.633	S	S	*	*			trans	-46.7	110.5	-179.8	-78.3	-37.8	0	0	0	109.9	P16 P20	P16-D18 PolarHBondContact O-N 3.31Å; D18-P20 VanDerWaalsContact O-CD 3.28Å; D18-P20 WeakPolarHBondContact O-CD 3.21Å
19	F	65.1	Low	57.9	Low	43 Å²	43	108.4 Å²	108.4	19%	0.189	63%	0.63	C	S	.	*			trans	-82.8	114.6	176.8	173.2	-96.2	0	0	0	107.8	R17 G21 R23 N63 I65 Q94	R17-F19 PolarHBondContact O-N 3.07Å; F19-G21 PolarHBondContact O-N 2.94Å; F19-R23 HydrophobicContact CD1-CG 4.49Å; F19-N63 HydrophobicContact CE1-CB 4.5Å; F19-N63 HydrophobicContact CZ-CB 3.97Å; F19-I65 HydrophobicContact CD1-CD1 4.03Å; F19-I65 HydrophobicContact CE1-CD1 3.85Å; F19-I65 HydrophobicContact CE1-CG1 3.93Å; F19-I65 HydrophobicContact CE1-CG2 4.18Å; F19-I65 HydrophobicContact CE2-CD1 4.45Å; F19-I65 HydrophobicContact CE2-CG2 4.16Å; F19-I65 HydrophobicContact CG-CD1 4.4Å; F19-I65 HydrophobicContact CZ-CD1 4.1Å; F19-I65 HydrophobicContact CZ-CG1 4.22Å; F19-I65 HydrophobicContact CZ-CG2 3.6Å; F19-Q94 VanDerWaalsContact CD2-NE2 3.3Å
20	P	72.3	Confident	59.1	Low	107 Å²	107	106 Å²	106	70%	0.695	62%	0.615	S	S	*	*			trans	-80.9	62	-178.1	34.1	-37.5	0	0	0	111.5	D18	D18-P20 VanDerWaalsContact O-CD 3.28Å; D18-P20 WeakPolarHBondContact O-CD 3.21Å
21	G	75.2	Confident	60.6	Low	31 Å²	31	106.1 Å²	106.1	32%	0.32	62%	0.615	S	S	.	*	S	Bend	trans	-159	174.6	-178.9	0	0	0	0	0	114.4	F19 N63	F19-G21 PolarHBondContact O-N 2.94Å; G21-N63 CarbonylContact C-O 3.54Å; G21-N63 VanDerWaalsContact CA-O 3.24Å; G21-N63 WeakPolarHBondContact CA-O 3.35Å
22	I	80.1	Confident	61.8	Low	95 Å²	95	108.1 Å²	108.1	49%	0.487	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.4	132.5	-177	-60.8	-178.3	0	0	0	109.1	A61 N63 I64 I65	I22-A61 HydrophobicContact CD1-CB 3.54Å; I22-A61 HydrophobicContact CG1-CB 3.95Å; I22-N63 PolarHBondContact N-O 3.08Å; I22-I64 HydrophobicContact CB-CG1 4.35Å; I22-I64 HydrophobicContact CG2-CD1 4.35Å; I22-I64 HydrophobicContact CG2-CG1 4.29Å; I22-I64 CarbonylContact O-C 3.46Å; I22-I64 VanDerWaalsContact O-CA 3.29Å; I22-I64 WeakPolarHBondContact O-CA 3.3Å; I22-I65 PolarHBondContact O-N 2.67Å
23	R	80.2	Confident	63.6	Low	105 Å²	105	100.5 Å²	100.5	40%	0.396	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.3	131.4	174.6	-57.1	-164.2	175.2	-179.2	-3.5	110.5	F19 L25 I65	F19-R23 HydrophobicContact CD1-CG 4.49Å; R23-L25 HydrophobicContact CB-CD2 4.2Å; R23-I65 HydrophobicContact CB-CG1 4.25Å; R23-I65 HydrophobicContact CG-CD1 3.85Å; R23-I65 HydrophobicContact CG-CG1 3.83Å
24	L	75.3	Confident	65.5	Low	36 Å²	36	99.3 Å²	99.3	19%	0.188	58%	0.58	C	S	.	*	P	Polyproline II helix	trans	-83.7	121.3	165.1	-62.4	166.1	0	0	0	107.4	S35 W37 I64 I65 T66 A67	L24-S35 VanDerWaalsContact CB-O 3.27Å; L24-S35 WeakPolarHBondContact CB-O 3.47Å; L24-W37 VanDerWaalsContact CD1-O 3.3Å; L24-W37 WeakPolarHBondContact CD1-O 3.36Å; L24-I64 HydrophobicContact CD1-CD1 4.21Å; L24-I64 HydrophobicContact CD1-CG1 4.26Å; L24-I64 HydrophobicContact CD2-CD1 4.13Å; L24-I64 HydrophobicContact CG-CD1 4.09Å; L24-I64 HydrophobicContact CG-CG1 4.14Å; L24-I65 WeakPolarHBondContact CB-O 3.48Å; L24-I65 PolarHBondContact N-O 2.71Å; L24-T66 HydrophobicContact CD1-CG2 4.48Å; L24-A67 PolarHBondContact O-N 3.28Å
25	L	72.1	Confident	67.4	Low	140 Å²	140	95.8 Å²	95.8	73%	0.733	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-100.6	127.7	-176.3	-59.6	177.9	0	0	0	109.3	R23	R23-L25 HydrophobicContact CB-CD2 4.2Å
26	S	72.7	Confident	69.6	Low	60 Å²	60	98.1 Å²	98.1	42%	0.42	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-64.9	136.9	167.7	-60.2	0	0	0	0	110.3	P28 S35 A67	S26-P28 WeakPolarHBondContact O-CD 3.49Å; S26-S35 WeakPolarHBondContact OG-CB 3.47Å; S26-S35 PolarHBondContact OG-OG 3.42Å; S26-A67 WeakPolarHBondContact OG-CB 3.47Å
27	N	73.1	Confident	71.9	Confident	66 Å²	66	97.8 Å²	97.8	35%	0.353	54%	0.535	S	S	.	.			trans	-106.2	101	166.5	-173.4	-11	0	0	0	108.5	L29 M30 A33	N27-L29 PolarHBondContact O-N 3.01Å; N27-L29 PolarHBondContact OD1-N 3.37Å; N27-L29 VanDerWaalsContact OD1-N 3.15Å; N27-M30 HydrophobicContact CB-CB 4.34Å; N27-M30 CarbonylContact O-C 3.59Å; N27-M30 VanDerWaalsContact O-C 3.23Å; N27-M30 PolarHBondContact O-N 2.84Å; N27-A33 HydrophobicContact CB-CB 4.42Å
28	P	74.4	Confident	74.1	Confident	126 Å²	126	87.6 Å²	87.6	82%	0.818	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.1	-178.4	-24.2	34	0	0	0	113.9	S26	S26-P28 WeakPolarHBondContact O-CD 3.49Å
29	L	73.1	Confident	76.2	Confident	170 Å²	170	81.8 Å²	81.8	89%	0.89	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-10.9	178.4	-60.8	175.9	0	0	0	113.1	N27	N27-L29 PolarHBondContact O-N 3.01Å; N27-L29 PolarHBondContact OD1-N 3.37Å; N27-L29 VanDerWaalsContact OD1-N 3.15Å
30	M	67	Low	77.7	Confident	111 Å²	111	79.8 Å²	79.8	55%	0.547	46%	0.459	S	S	.	.			trans	-145.5	77.1	-177.3	-162.6	161.3	76.7	0	0	109.3	N27 D32 A33	N27-M30 HydrophobicContact CB-CB 4.34Å; N27-M30 CarbonylContact O-C 3.59Å; N27-M30 VanDerWaalsContact O-C 3.23Å; N27-M30 PolarHBondContact O-N 2.84Å; M30-D32 PolarHBondContact O-N 3.11Å; M30-D32 VanDerWaalsContact O-N 3.15Å; M30-A33 HydrophobicContact CE-CB 4.16Å; M30-A33 VanDerWaalsContact O-CB 3.28Å; M30-A33 WeakPolarHBondContact O-CB 3.5Å; M30-A33 PolarHBondContact O-N 3.43Å
31	G	70.1	Confident	78.9	Confident	75 Å²	75	74.8 Å²	74.8	77%	0.773	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.7	-177.3	0	0	0	0	0	114.6	A33	G31-A33 PolarHBondContact O-N 3.46Å
32	D	69.5	Low	79.9	Confident	160 Å²	160	76.4 Å²	76.4	86%	0.856	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.9	174	-64.6	-22.8	0	0	0	113	M30 V34	M30-D32 PolarHBondContact O-N 3.11Å; M30-D32 VanDerWaalsContact O-N 3.15Å; D32-V34 PolarHBondContact O-N 3.39Å
33	A	71.6	Confident	80.8	Confident	32 Å²	32	72 Å²	72	26%	0.264	40%	0.404	S	S	.	.	S	Bend	trans	-71.3	117.2	175.6	0	0	0	0	0	109.8	N27 M30 G31 S35	N27-A33 HydrophobicContact CB-CB 4.42Å; M30-A33 HydrophobicContact CE-CB 4.16Å; M30-A33 VanDerWaalsContact O-CB 3.28Å; M30-A33 WeakPolarHBondContact O-CB 3.5Å; M30-A33 PolarHBondContact O-N 3.43Å; G31-A33 PolarHBondContact O-N 3.46Å; A33-S35 PolarHBondContact O-N 3.05Å
34	V	76.1	Confident	81.6	Confident	97 Å²	97	67 Å²	67	59%	0.588	39%	0.385	S	S	*	.			trans	-60.8	103.1	-176.1	-174.9	0	0	0	0	111.1	D32 W37	D32-V34 PolarHBondContact O-N 3.39Å; V34-W37 HydrophobicContact CG1-CB 4.1Å; V34-W37 HydrophobicContact CG1-CE3 4.14Å; V34-W37 WeakPolarHBondContact CG1-O 3.48Å
35	S	76.4	Confident	82.7	Confident	10 Å²	10	68 Å²	68	7%	0.07	39%	0.39	C	S	.	.			trans	-110.2	-22.2	172.7	58.6	0	0	0	0	114.1	L24 S26 A33 T66 A67	L24-S35 VanDerWaalsContact CB-O 3.27Å; L24-S35 WeakPolarHBondContact CB-O 3.47Å; S26-S35 WeakPolarHBondContact OG-CB 3.47Å; S26-S35 PolarHBondContact OG-OG 3.42Å; A33-S35 PolarHBondContact O-N 3.05Å; S35-T66 WeakPolarHBondContact O-CA 3.37Å; S35-A67 PolarHBondContact O-N 3.2Å
36	D	80.7	Confident	83.9	Confident	101 Å²	101	66 Å²	66	54%	0.54	38%	0.377	S	S	.	.	S	Bend	trans	-103.8	6.2	-166.2	-53	-16.8	0	0	0	111.8	T66	D36-T66 VanDerWaalsContact C-CG2 3.49Å; D36-T66 WeakPolarHBondContact O-CG2 3.41Å
37	W	87.5	Confident	85.1	Confident	105 Å²	105	63.7 Å²	63.7	40%	0.398	36%	0.362	S	S	.	.			trans	-156.3	155	-172.4	-176.3	89.6	0	0	0	113.1	L24 V34 P39 E42	L24-W37 VanDerWaalsContact CD1-O 3.3Å; L24-W37 WeakPolarHBondContact CD1-O 3.36Å; V34-W37 HydrophobicContact CG1-CB 4.1Å; V34-W37 HydrophobicContact CG1-CE3 4.14Å; V34-W37 WeakPolarHBondContact CG1-O 3.48Å; W37-P39 HydrophobicContact CH2-CG 4.37Å; W37-P39 HydrophobicContact CZ3-CG 4.27Å; W37-E42 HydrophobicContact CH2-CB 4.41Å; W37-E42 HydrophobicContact CZ2-CB 3.39Å; W37-E42 HydrophobicContact CZ2-CG 3.66Å; W37-E42 PolarHBondContact NE1-OE2 3.35Å
38	S	91.9	Very high	86.4	Confident	4 Å²	4	64.7 Å²	64.7	3%	0.028	37%	0.365	C	S	.	.			trans	-149.5	164.3	165.1	76.8	0	0	0	0	111	M40 H41 E42	S38-M40 PolarHBondContact O-N 3.37Å; S38-M40 VanDerWaalsContact O-N 3.11Å; S38-M40 PolarHBondContact OG-N 3.48Å; S38-H41 PolarHBondContact N-ND1 2.72Å; S38-H41 WeakPolarHBondContact O-CA 3.49Å; S38-H41 WeakPolarHBondContact O-CB 3.39Å; S38-H41 PolarHBondContact O-N 3.46Å; S38-H41 PolarHBondContact OG-N 3.01Å; S38-H41 PolarHBondContact OG-ND1 3.17Å; S38-E42 PolarHBondContact O-N 3.47Å
39	P	95.3	Very high	87.5	Confident	44 Å²	44	62.5 Å²	62.5	29%	0.286	34%	0.343	S	S	.	.	H	α-helix	trans	-55.2	-30.2	173.3	-27.4	36	0	0	0	113.7	W37 A43 L55 W60	W37-P39 HydrophobicContact CH2-CG 4.37Å; W37-P39 HydrophobicContact CZ3-CG 4.27Å; P39-A43 WeakPolarHBondContact O-CB 3.33Å; P39-A43 PolarHBondContact O-N 3.03Å; P39-A43 VanDerWaalsContact O-N 3.08Å; P39-L55 HydrophobicContact CB-CD1 4.03Å; P39-L55 HydrophobicContact CB-CD2 4.01Å; P39-L55 VanDerWaalsContact O-CD1 3.29Å; P39-L55 WeakPolarHBondContact O-CD1 3.25Å; P39-W60 HydrophobicContact CG-CH2 3.96Å; P39-W60 HydrophobicContact CG-CZ2 4.27Å; P39-W60 HydrophobicContact CG-CZ3 4.43Å
40	M	96.8	Very high	88.6	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.2	-38.7	173.9	-80.1	-69.1	-76.1	0	0	112.1	S38 A44 L52 L55 I56 W60 V62 I64 P72 L88	S38-M40 PolarHBondContact O-N 3.37Å; S38-M40 VanDerWaalsContact O-N 3.11Å; S38-M40 PolarHBondContact OG-N 3.48Å; M40-A44 WeakPolarHBondContact O-CB 3.46Å; M40-A44 PolarHBondContact O-N 3.39Å; M40-L52 HydrophobicContact CE-CD2 3.77Å; M40-L52 HydrophobicContact SD-CD2 3.57Å; M40-L52 VanDerWaalsContact SD-CD2 3.57Å; M40-L55 HydrophobicContact CG-CB 4.28Å; M40-L55 HydrophobicContact CG-CD1 4.11Å; M40-L55 HydrophobicContact SD-CB 3.5Å; M40-L55 WeakPolarHBondContact SD-CB 3.41Å; M40-L55 HydrophobicContact SD-CD1 3.8Å; M40-L55 HydrophobicContact SD-CG 4.3Å; M40-I56 HydrophobicContact CE-CD1 4.27Å; M40-I56 HydrophobicContact CE-CG1 3.88Å; M40-I56 HydrophobicContact SD-CG1 4.29Å; M40-W60 HydrophobicContact CG-CB 4Å; M40-W60 HydrophobicContact CG-CE3 4.5Å; M40-W60 HydrophobicContact SD-CB 4.36Å; M40-V62 HydrophobicContact CE-CG2 4.05Å; M40-I64 HydrophobicContact CB-CG2 4.07Å; M40-P72 HydrophobicContact CB-CG 3.82Å; M40-L88 HydrophobicContact CE-CD2 3.95Å
41	H	97.2	Very high	90.1	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.009	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-48.6	172.8	-68.1	94.7	0	0	0	110.6	S38 A43 A44 I45 V70 S71 P72	S38-H41 PolarHBondContact N-ND1 2.72Å; S38-H41 WeakPolarHBondContact O-CA 3.49Å; S38-H41 WeakPolarHBondContact O-CB 3.39Å; S38-H41 PolarHBondContact O-N 3.46Å; S38-H41 PolarHBondContact OG-N 3.01Å; S38-H41 PolarHBondContact OG-ND1 3.17Å; H41-A43 VanDerWaalsContact C-N 3.33Å; H41-A43 PolarHBondContact O-N 3.23Å; H41-A44 CarbonylContact O-C 3.58Å; H41-A44 WeakPolarHBondContact O-CA 3.45Å; H41-A44 WeakPolarHBondContact O-CB 3.37Å; H41-A44 PolarHBondContact O-N 3.07Å; H41-I45 HydrophobicContact CB-CD1 4.46Å; H41-I45 VanDerWaalsContact O-CG1 3.26Å; H41-I45 WeakPolarHBondContact O-CG1 3.38Å; H41-I45 PolarHBondContact O-N 3.19Å; H41-V70 PolarHBondContact NE2-O 3.08Å; H41-S71 WeakPolarHBondContact NE2-CA 3.4Å; H41-P72 WeakPolarHBondContact NE2-CD 3.4Å
42	E	97.2	Very high	91.4	Very high	65 Å²	65	53.6 Å²	53.6	30%	0.304	29%	0.285	S	S	.	.	H	α-helix	trans	-53.5	-49.1	178.4	-171.5	63.2	-167.7	0	0	112.9	W37 S38 A44 I45 H46	W37-E42 HydrophobicContact CH2-CB 4.41Å; W37-E42 HydrophobicContact CZ2-CB 3.39Å; W37-E42 HydrophobicContact CZ2-CG 3.66Å; W37-E42 PolarHBondContact NE1-OE2 3.35Å; S38-E42 PolarHBondContact O-N 3.47Å; E42-A44 PolarHBondContact O-N 3.11Å; E42-I45 PolarHBondContact O-N 3.31Å; E42-H46 PolarHBondContact O-N 3.22Å; E42-H46 VanDerWaalsContact O-N 3.15Å; E42-H46 IonicContact OE1-CD2 3.34Å; E42-H46 PolarHBondContact OE1-CD2 2.91Å; E42-H46 IonicContact OE1-NE2 4Å; E42-H46 PolarHBondContact OE1-NE2 3.18Å
43	A	98	Very high	92.8	Very high	3 Å²	3	53.1 Å²	53.1	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-31.9	179.1	0	0	0	0	0	111.9	P39 H41 G47 H48 L52 L55	P39-A43 WeakPolarHBondContact O-CB 3.33Å; P39-A43 PolarHBondContact O-N 3.03Å; P39-A43 VanDerWaalsContact O-N 3.08Å; H41-A43 VanDerWaalsContact C-N 3.33Å; H41-A43 PolarHBondContact O-N 3.23Å; A43-G47 PolarHBondContact O-N 3.3Å; A43-H48 HydrophobicContact CB-CB 4.28Å; A43-H48 PolarHBondContact O-N 2.87Å; A43-L52 HydrophobicContact CB-CD2 3.82Å; A43-L52 HydrophobicContact CB-CG 3.73Å; A43-L55 HydrophobicContact CB-CD1 4.12Å
44	A	98.2	Very high	94	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-75	-44.3	175.7	0	0	0	0	0	113.1	M40 H41 E42 H46 G47 L52 P72 E75 A76 H81	M40-A44 WeakPolarHBondContact O-CB 3.46Å; M40-A44 PolarHBondContact O-N 3.39Å; H41-A44 CarbonylContact O-C 3.58Å; H41-A44 WeakPolarHBondContact O-CA 3.45Å; H41-A44 WeakPolarHBondContact O-CB 3.37Å; H41-A44 PolarHBondContact O-N 3.07Å; E42-A44 PolarHBondContact O-N 3.11Å; A44-H46 VanDerWaalsContact C-N 3.3Å; A44-H46 PolarHBondContact O-N 3.3Å; A44-G47 PolarHBondContact O-N 3.28Å; A44-L52 HydrophobicContact CB-CD1 4.5Å; A44-P72 HydrophobicContact CB-CB 3.94Å; A44-P72 WeakPolarHBondContact CB-O 3.23Å; A44-E75 HydrophobicContact CB-CB 4.07Å; A44-A76 HydrophobicContact CB-CB 4.16Å; A44-H81 PolarHBondContact O-CD2 2.94Å
45	I	97.9	Very high	95.1	Very high	56 Å²	56	52.4 Å²	52.4	29%	0.287	26%	0.259	S	S	.	.	H	α-helix	trans	-57.7	-44.7	179.1	-65.4	164.9	0	0	0	110.2	H41 E42 E75 H81	H41-I45 HydrophobicContact CB-CD1 4.46Å; H41-I45 VanDerWaalsContact O-CG1 3.26Å; H41-I45 WeakPolarHBondContact O-CG1 3.38Å; H41-I45 PolarHBondContact O-N 3.19Å; E42-I45 PolarHBondContact O-N 3.31Å; I45-E75 HydrophobicContact CD1-CG 4.24Å; I45-E75 HydrophobicContact CG1-CB 3.62Å; I45-E75 HydrophobicContact CG1-CG 3.63Å; I45-H81 PolarHBondContact O-NE2 2.83Å
46	H	98.2	Very high	96.1	Very high	100 Å²	100	53.2 Å²	53.2	46%	0.463	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	4.5	-176.9	-66.2	-6.2	0	0	0	114.2	E42 A44 H48	E42-H46 PolarHBondContact O-N 3.22Å; E42-H46 VanDerWaalsContact O-N 3.15Å; E42-H46 IonicContact OE1-CD2 3.34Å; E42-H46 PolarHBondContact OE1-CD2 2.91Å; E42-H46 IonicContact OE1-NE2 4Å; E42-H46 PolarHBondContact OE1-NE2 3.18Å; A44-H46 VanDerWaalsContact C-N 3.3Å; A44-H46 PolarHBondContact O-N 3.3Å; H46-H48 VanDerWaalsContact C-N 3.26Å; H46-H48 VanDerWaalsContact CB-CE1 3.48Å; H46-H48 WeakPolarHBondContact CB-CE1 3.4Å; H46-H48 PolarHBondContact O-CD2 3.28Å; H46-H48 PolarHBondContact O-N 3.04Å
47	G	98	Very high	96.9	Very high	11 Å²	11	53 Å²	53	11%	0.113	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	23.5	177.5	0	0	0	0	0	114	A43 A44 Q49 H81	A43-G47 PolarHBondContact O-N 3.3Å; A44-G47 PolarHBondContact O-N 3.28Å; G47-Q49 VanDerWaalsContact C-N 3.35Å; G47-Q49 PolarHBondContact O-N 3.12Å; G47-Q49 PolarHBondContact O-OE1 3.48Å; G47-H81 PolarHBondContact N-CD2 3.06Å; G47-H81 PolarHBondContact N-NE2 2.8Å
48	H	98.5	Very high	97.3	Very high	87 Å²	87	54.4 Å²	54.4	40%	0.403	28%	0.28	S	S	.	.			trans	-78.7	76	-177.6	-62.7	161.7	0	0	0	112	A43 H46 L50 S51 L52	A43-H48 HydrophobicContact CB-CB 4.28Å; A43-H48 PolarHBondContact O-N 2.87Å; H46-H48 VanDerWaalsContact C-N 3.26Å; H46-H48 VanDerWaalsContact CB-CE1 3.48Å; H46-H48 WeakPolarHBondContact CB-CE1 3.4Å; H46-H48 PolarHBondContact O-CD2 3.28Å; H46-H48 PolarHBondContact O-N 3.04Å; H48-L50 PolarHBondContact O-N 3.4Å; H48-L50 VanDerWaalsContact O-N 3.17Å; H48-S51 PolarHBondContact O-N 2.84Å; H48-S51 VanDerWaalsContact O-N 3.09Å; H48-L52 PolarHBondContact O-N 3.32Å
49	Q	97.8	Very high	97.5	Very high	79 Å²	79	57.4 Å²	57.4	37%	0.369	31%	0.311	S	S	.	.	H	α-helix	trans	-59.1	-30.5	-177.1	74.2	-78.2	5.7	0	0	114.1	G47 R53 I87	G47-Q49 VanDerWaalsContact C-N 3.35Å; G47-Q49 PolarHBondContact O-N 3.12Å; G47-Q49 PolarHBondContact O-OE1 3.48Å; Q49-R53 WeakPolarHBondContact O-CG 3.37Å; Q49-R53 PolarHBondContact O-N 3.24Å; Q49-R53 VanDerWaalsContact O-N 3.16Å; Q49-I87 HydrophobicContact CB-CD1 3.68Å
50	L	98	Very high	97.5	Very high	117 Å²	117	60.2 Å²	60.2	61%	0.613	32%	0.317	S	S	*	.	H	α-helix	trans	-72.4	-43.4	176.4	-63.6	179.9	0	0	0	111.1	H48 R53 N54	H48-L50 PolarHBondContact O-N 3.4Å; H48-L50 VanDerWaalsContact O-N 3.17Å; L50-R53 PolarHBondContact O-N 2.93Å; L50-N54 PolarHBondContact O-N 3Å
51	S	98.1	Very high	97.5	Very high	52 Å²	52	61.8 Å²	61.8	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-62.4	-43.5	175.4	-55.9	0	0	0	0	111.2	H48 R53 N54 L55	H48-S51 PolarHBondContact O-N 2.84Å; H48-S51 VanDerWaalsContact O-N 3.09Å; S51-R53 PolarHBondContact O-N 3.19Å; S51-N54 PolarHBondContact O-N 3.4Å; S51-L55 VanDerWaalsContact O-CG 3.3Å; S51-L55 WeakPolarHBondContact O-CG 3.48Å; S51-L55 PolarHBondContact O-N 3.17Å
52	L	97.6	Very high	97.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-57.8	-45.6	173.5	-82.3	179	0	0	0	112.4	M40 A43 A44 H48 N54 L55 I56 C84 L88	M40-L52 HydrophobicContact CE-CD2 3.77Å; M40-L52 HydrophobicContact SD-CD2 3.57Å; M40-L52 VanDerWaalsContact SD-CD2 3.57Å; A43-L52 HydrophobicContact CB-CD2 3.82Å; A43-L52 HydrophobicContact CB-CG 3.73Å; A44-L52 HydrophobicContact CB-CD1 4.5Å; H48-L52 PolarHBondContact O-N 3.32Å; L52-N54 VanDerWaalsContact C-N 3.31Å; L52-N54 PolarHBondContact O-N 3.15Å; L52-L55 PolarHBondContact O-N 3.02Å; L52-I56 WeakPolarHBondContact O-CB 3.47Å; L52-I56 VanDerWaalsContact O-CG1 3.24Å; L52-I56 WeakPolarHBondContact O-CG1 3.42Å; L52-I56 PolarHBondContact O-N 2.93Å; L52-C84 HydrophobicContact CD1-CB 3.55Å; L52-L88 HydrophobicContact CD1-CD1 4.43Å; L52-L88 HydrophobicContact CD1-CD2 4.43Å; L52-L88 HydrophobicContact CD1-CG 4.32Å; L52-L88 HydrophobicContact CD2-CD2 4.25Å
53	R	97.9	Very high	97.4	Very high	150 Å²	150	60.7 Å²	60.7	57%	0.566	33%	0.326	S	S	*	.	H	α-helix	trans	-61	-41	177	-75.5	176.2	-178	-142.9	3.3	112.2	Q49 L50 S51 S57 I87	Q49-R53 WeakPolarHBondContact O-CG 3.37Å; Q49-R53 PolarHBondContact O-N 3.24Å; Q49-R53 VanDerWaalsContact O-N 3.16Å; L50-R53 PolarHBondContact O-N 2.93Å; S51-R53 PolarHBondContact O-N 3.19Å; R53-S57 WeakPolarHBondContact O-CB 3.29Å; R53-S57 PolarHBondContact O-N 3.45Å; R53-S57 PolarHBondContact O-OG 3.28Å; R53-I87 HydrophobicContact CG-CD1 3.89Å; R53-I87 HydrophobicContact CG-CG1 4.39Å; R53-I87 HydrophobicContact CG-CG2 4.39Å
54	N	97.8	Very high	97.3	Very high	93 Å²	93	60.9 Å²	60.9	50%	0.497	33%	0.327	S	S	.	.	H	α-helix	trans	-67.3	-41.7	178.3	-70.8	-8.4	0	0	0	112	L50 S51 L52 S57 Q58	L50-N54 PolarHBondContact O-N 3Å; S51-N54 PolarHBondContact O-N 3.4Å; L52-N54 VanDerWaalsContact C-N 3.31Å; L52-N54 PolarHBondContact O-N 3.15Å; N54-S57 PolarHBondContact O-N 3.29Å; N54-S57 PolarHBondContact O-OG 3.01Å; N54-Q58 WeakPolarHBondContact O-CB 3.47Å; N54-Q58 WeakPolarHBondContact O-CG 3.1Å; N54-Q58 PolarHBondContact O-N 3.09Å
55	L	97.7	Very high	97.2	Very high	22 Å²	22	61.2 Å²	61.2	12%	0.115	33%	0.328	C	S	.	.	H	α-helix	trans	-63.9	-45.2	176.4	-69.3	168.7	0	0	0	110.9	P39 M40 A43 S51 L52 S57 Q58 G59 W60	P39-L55 HydrophobicContact CB-CD1 4.03Å; P39-L55 HydrophobicContact CB-CD2 4.01Å; P39-L55 VanDerWaalsContact O-CD1 3.29Å; P39-L55 WeakPolarHBondContact O-CD1 3.25Å; M40-L55 HydrophobicContact CG-CB 4.28Å; M40-L55 HydrophobicContact CG-CD1 4.11Å; M40-L55 HydrophobicContact SD-CB 3.5Å; M40-L55 WeakPolarHBondContact SD-CB 3.41Å; M40-L55 HydrophobicContact SD-CD1 3.8Å; M40-L55 HydrophobicContact SD-CG 4.3Å; A43-L55 HydrophobicContact CB-CD1 4.12Å; S51-L55 VanDerWaalsContact O-CG 3.3Å; S51-L55 WeakPolarHBondContact O-CG 3.48Å; S51-L55 PolarHBondContact O-N 3.17Å; L52-L55 PolarHBondContact O-N 3.02Å; L55-S57 PolarHBondContact O-N 2.94Å; L55-Q58 PolarHBondContact O-N 3.41Å; L55-G59 PolarHBondContact O-N 3.39Å; L55-W60 HydrophobicContact CB-CB 4.18Å; L55-W60 HydrophobicContact CB-CG 4.13Å; L55-W60 HydrophobicContact CD2-CD2 4.39Å; L55-W60 HydrophobicContact CD2-CG 4.21Å; L55-W60 VanDerWaalsContact O-CB 3.31Å; L55-W60 WeakPolarHBondContact O-CB 3.48Å; L55-W60 PolarHBondContact O-N 3.01Å; L55-W60 VanDerWaalsContact O-N 3.07Å
56	I	97.5	Very high	97.1	Very high	26 Å²	26	58.9 Å²	58.9	13%	0.133	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-42	177.3	-66.7	166.9	0	0	0	111.2	M40 L52 Q58 G59 V62 I87	M40-I56 HydrophobicContact CE-CD1 4.27Å; M40-I56 HydrophobicContact CE-CG1 3.88Å; M40-I56 HydrophobicContact SD-CG1 4.29Å; L52-I56 WeakPolarHBondContact O-CB 3.47Å; L52-I56 VanDerWaalsContact O-CG1 3.24Å; L52-I56 WeakPolarHBondContact O-CG1 3.42Å; L52-I56 PolarHBondContact O-N 2.93Å; I56-Q58 PolarHBondContact O-N 3.3Å; I56-G59 PolarHBondContact O-N 3.01Å; I56-V62 HydrophobicContact CD1-CG2 3.84Å; I56-V62 HydrophobicContact CG1-CG2 3.83Å; I56-I87 HydrophobicContact CD1-CG2 3.57Å
57	S	97.5	Very high	96.9	Very high	96 Å²	96	55.6 Å²	55.6	67%	0.671	31%	0.307	S	S	*	.	H	α-helix	trans	-68	-23.8	178.1	69.6	0	0	0	0	113.4	R53 N54 L55 G59	R53-S57 WeakPolarHBondContact O-CB 3.29Å; R53-S57 PolarHBondContact O-N 3.45Å; R53-S57 PolarHBondContact O-OG 3.28Å; N54-S57 PolarHBondContact O-N 3.29Å; N54-S57 PolarHBondContact O-OG 3.01Å; L55-S57 PolarHBondContact O-N 2.94Å; S57-G59 PolarHBondContact O-N 3.03Å
58	Q	97.2	Very high	96.7	Very high	135 Å²	135	59 Å²	59	63%	0.631	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	0.4	171.7	-69.1	165.3	21.4	0	0	113.3	N54 L55 I56	N54-Q58 WeakPolarHBondContact O-CB 3.47Å; N54-Q58 WeakPolarHBondContact O-CG 3.1Å; N54-Q58 PolarHBondContact O-N 3.09Å; L55-Q58 PolarHBondContact O-N 3.41Å; I56-Q58 PolarHBondContact O-N 3.3Å
59	G	94.9	Very high	96.5	Very high	67 Å²	67	58.4 Å²	58.4	69%	0.691	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	11	176.7	0	0	0	0	0	115	L55 I56 S57 A61	L55-G59 PolarHBondContact O-N 3.39Å; I56-G59 PolarHBondContact O-N 3.01Å; S57-G59 PolarHBondContact O-N 3.03Å; G59-A61 PolarHBondContact O-N 2.88Å
60	W	96.2	Very high	96.5	Very high	104 Å²	104	55.9 Å²	55.9	39%	0.394	31%	0.31	S	S	.	.			trans	-64.2	134.2	172.9	-73	80.4	0	0	0	110.9	P39 M40 L55	P39-W60 HydrophobicContact CG-CH2 3.96Å; P39-W60 HydrophobicContact CG-CZ2 4.27Å; P39-W60 HydrophobicContact CG-CZ3 4.43Å; M40-W60 HydrophobicContact CG-CB 4Å; M40-W60 HydrophobicContact CG-CE3 4.5Å; M40-W60 HydrophobicContact SD-CB 4.36Å; L55-W60 HydrophobicContact CB-CB 4.18Å; L55-W60 HydrophobicContact CB-CG 4.13Å; L55-W60 HydrophobicContact CD2-CD2 4.39Å; L55-W60 HydrophobicContact CD2-CG 4.21Å; L55-W60 VanDerWaalsContact O-CB 3.31Å; L55-W60 WeakPolarHBondContact O-CB 3.48Å; L55-W60 PolarHBondContact O-N 3.01Å; L55-W60 VanDerWaalsContact O-N 3.07Å
61	A	96.1	Very high	96.5	Very high	33 Å²	33	50.7 Å²	50.7	27%	0.273	28%	0.283	S	S	.	.			trans	-70.4	137.2	177.6	0	0	0	0	0	111.4	I22 G59	I22-A61 HydrophobicContact CD1-CB 3.54Å; I22-A61 HydrophobicContact CG1-CB 3.95Å; G59-A61 PolarHBondContact O-N 2.88Å
62	V	96.2	Very high	96.5	Very high	14 Å²	14	48.2 Å²	48.2	9%	0.085	27%	0.266	C	S	.	.	S	Bend	trans	-76.9	-38.5	176.2	171.6	0	0	0	0	111.6	M40 I56 I64 L88 H91 A93	M40-V62 HydrophobicContact CE-CG2 4.05Å; I56-V62 HydrophobicContact CD1-CG2 3.84Å; I56-V62 HydrophobicContact CG1-CG2 3.83Å; V62-I64 PolarHBondContact O-N 3.37Å; V62-I64 VanDerWaalsContact O-N 3.08Å; V62-L88 HydrophobicContact CG1-CB 4.29Å; V62-L88 HydrophobicContact CG1-CD2 3.81Å; V62-H91 HydrophobicContact CG2-CB 3.76Å; V62-A93 HydrophobicContact CG1-CB 3.63Å
63	N	97.1	Very high	96.5	Very high	29 Å²	29	48.2 Å²	48.2	16%	0.155	27%	0.266	C	S	.	.	S	Bend	trans	-86.2	57.1	174.5	-66.3	-47.1	0	0	0	110.5	F19 G21 I22 G92 A93 Q94	F19-N63 HydrophobicContact CE1-CB 4.5Å; F19-N63 HydrophobicContact CZ-CB 3.97Å; G21-N63 CarbonylContact C-O 3.54Å; G21-N63 VanDerWaalsContact CA-O 3.24Å; G21-N63 WeakPolarHBondContact CA-O 3.35Å; I22-N63 PolarHBondContact N-O 3.08Å; N63-G92 PolarHBondContact ND2-O 3.3Å; N63-A93 WeakPolarHBondContact OD1-CA 3.21Å; N63-Q94 PolarHBondContact OD1-N 2.95Å
64	I	95.4	Very high	96.6	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.036	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	138.7	165.7	-172.8	164.6	0	0	0	108.6	I22 L24 M40 V62 S71 P72	I22-I64 HydrophobicContact CB-CG1 4.35Å; I22-I64 HydrophobicContact CG2-CD1 4.35Å; I22-I64 HydrophobicContact CG2-CG1 4.29Å; I22-I64 CarbonylContact O-C 3.46Å; I22-I64 VanDerWaalsContact O-CA 3.29Å; I22-I64 WeakPolarHBondContact O-CA 3.3Å; L24-I64 HydrophobicContact CD1-CD1 4.21Å; L24-I64 HydrophobicContact CD1-CG1 4.26Å; L24-I64 HydrophobicContact CD2-CD1 4.13Å; L24-I64 HydrophobicContact CG-CD1 4.09Å; L24-I64 HydrophobicContact CG-CG1 4.14Å; M40-I64 HydrophobicContact CB-CG2 4.07Å; V62-I64 PolarHBondContact O-N 3.37Å; V62-I64 VanDerWaalsContact O-N 3.08Å; I64-S71 WeakPolarHBondContact O-CA 3.21Å; I64-P72 HydrophobicContact CG2-CG 3.67Å; I64-P72 WeakPolarHBondContact O-CD 3.5Å
65	I	96.1	Very high	96.6	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.036	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146	175.7	57.5	174.9	0	0	0	112.7	F19 I22 R23 L24 H69 V70	F19-I65 HydrophobicContact CD1-CD1 4.03Å; F19-I65 HydrophobicContact CE1-CD1 3.85Å; F19-I65 HydrophobicContact CE1-CG1 3.93Å; F19-I65 HydrophobicContact CE1-CG2 4.18Å; F19-I65 HydrophobicContact CE2-CD1 4.45Å; F19-I65 HydrophobicContact CE2-CG2 4.16Å; F19-I65 HydrophobicContact CG-CD1 4.4Å; F19-I65 HydrophobicContact CZ-CD1 4.1Å; F19-I65 HydrophobicContact CZ-CG1 4.22Å; F19-I65 HydrophobicContact CZ-CG2 3.6Å; I22-I65 PolarHBondContact O-N 2.67Å; R23-I65 HydrophobicContact CB-CG1 4.25Å; R23-I65 HydrophobicContact CG-CD1 3.85Å; R23-I65 HydrophobicContact CG-CG1 3.83Å; L24-I65 WeakPolarHBondContact CB-O 3.48Å; L24-I65 PolarHBondContact N-O 2.71Å; I65-H69 HydrophobicContact CD1-CB 4.44Å; I65-V70 CarbonylContact C-O 3.56Å; I65-V70 WeakPolarHBondContact CA-O 3.29Å
66	T	95.1	Very high	96.7	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.043	22%	0.22	C	C	.	.			trans	-70	174.9	169.2	66.8	0	0	0	0	111.5	L24 S35 D36 D68 H69 V70	L24-T66 HydrophobicContact CD1-CG2 4.48Å; S35-T66 WeakPolarHBondContact O-CA 3.37Å; D36-T66 VanDerWaalsContact C-CG2 3.49Å; D36-T66 WeakPolarHBondContact O-CG2 3.41Å; T66-D68 PolarHBondContact O-N 3.28Å; T66-D68 PolarHBondContact OG1-N 3.47Å; T66-H69 WeakPolarHBondContact O-CA 3.41Å; T66-H69 PolarHBondContact O-N 3.49Å; T66-V70 HydrophobicContact CG2-CB 4.24Å; T66-V70 PolarHBondContact N-O 3.39Å; T66-V70 WeakPolarHBondContact OG1-CB 3.12Å; T66-V70 PolarHBondContact OG1-N 3.38Å; T66-V70 VanDerWaalsContact OG1-N 3.13Å
67	A	93.3	Very high	96.7	Very high	31 Å²	31	36.5 Å²	36.5	26%	0.256	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-32.4	172.1	0	0	0	0	0	113	L24 S26 S35 H69	L24-A67 PolarHBondContact O-N 3.28Å; S26-A67 WeakPolarHBondContact OG-CB 3.47Å; S35-A67 PolarHBondContact O-N 3.2Å; A67-H69 PolarHBondContact O-N 3.19Å; A67-H69 PolarHBondContact O-ND1 2.97Å
68	D	94	Very high	96.8	Very high	82 Å²	82	35.4 Å²	35.4	44%	0.439	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	14.6	174.5	-62.3	-38.3	0	0	0	113.4	T66 V70 T99 A100	T66-D68 PolarHBondContact O-N 3.28Å; T66-D68 PolarHBondContact OG1-N 3.47Å; D68-V70 HydrophobicContact CB-CG2 4.12Å; D68-V70 PolarHBondContact O-N 3.36Å; D68-V70 VanDerWaalsContact O-N 3.17Å; D68-T99 CarbonylContact O-C 3.48Å; D68-T99 WeakPolarHBondContact O-CA 3.2Å; D68-A100 HydrophobicContact CB-CB 4.11Å; D68-A100 PolarHBondContact O-N 3.02Å
69	H	95.3	Very high	96.8	Very high	75 Å²	75	30.9 Å²	30.9	35%	0.347	19%	0.189	S	C	.	.			trans	60.1	21.5	-179.6	-56.9	81.1	0	0	0	114.4	I65 T66 A67 V98	I65-H69 HydrophobicContact CD1-CB 4.44Å; T66-H69 WeakPolarHBondContact O-CA 3.41Å; T66-H69 PolarHBondContact O-N 3.49Å; A67-H69 PolarHBondContact O-N 3.19Å; A67-H69 PolarHBondContact O-ND1 2.97Å; H69-V98 WeakPolarHBondContact CB-O 3.23Å
70	V	97.4	Very high	97	Very high	26 Å²	26	28.8 Å²	28.8	16%	0.158	17%	0.167	C	C	.	.			trans	-77.3	136.2	174.6	-172.6	0	0	0	0	108.9	H41 I65 T66 D68 H74 E75 T99	H41-V70 PolarHBondContact NE2-O 3.08Å; I65-V70 CarbonylContact C-O 3.56Å; I65-V70 WeakPolarHBondContact CA-O 3.29Å; T66-V70 HydrophobicContact CG2-CB 4.24Å; T66-V70 PolarHBondContact N-O 3.39Å; T66-V70 WeakPolarHBondContact OG1-CB 3.12Å; T66-V70 PolarHBondContact OG1-N 3.38Å; T66-V70 VanDerWaalsContact OG1-N 3.13Å; D68-V70 HydrophobicContact CB-CG2 4.12Å; D68-V70 PolarHBondContact O-N 3.36Å; D68-V70 VanDerWaalsContact O-N 3.17Å; V70-H74 HydrophobicContact CG1-CB 3.87Å; V70-E75 HydrophobicContact CG1-CG 4.11Å; V70-E75 WeakPolarHBondContact CG1-OE1 3.46Å; V70-T99 HydrophobicContact CB-CG2 4.43Å; V70-T99 HydrophobicContact CG2-CG2 3.9Å
71	S	97.9	Very high	97.1	Very high	8 Å²	8	26.4 Å²	26.4	6%	0.056	16%	0.16	C	C	.	.			trans	-115.1	163	177.2	78.5	0	0	0	0	111.1	H41 I64 L73 H74 E75	H41-S71 WeakPolarHBondContact NE2-CA 3.4Å; I64-S71 WeakPolarHBondContact O-CA 3.21Å; S71-L73 PolarHBondContact O-N 3.21Å; S71-L73 PolarHBondContact OG-N 2.87Å; S71-H74 PolarHBondContact N-ND1 3.11Å; S71-H74 VanDerWaalsContact N-ND1 3.16Å; S71-H74 WeakPolarHBondContact O-CB 3.4Å; S71-H74 PolarHBondContact O-N 3.31Å; S71-H74 PolarHBondContact OG-N 2.96Å; S71-H74 PolarHBondContact OG-ND1 3.33Å; S71-E75 PolarHBondContact O-N 3.5Å
72	P	98.2	Very high	97.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-55.5	-27.8	173.5	-26.9	35	0	0	0	113.2	M40 H41 A44 I64 E75 A76 L88	M40-P72 HydrophobicContact CB-CG 3.82Å; H41-P72 WeakPolarHBondContact NE2-CD 3.4Å; A44-P72 HydrophobicContact CB-CB 3.94Å; A44-P72 WeakPolarHBondContact CB-O 3.23Å; I64-P72 HydrophobicContact CG2-CG 3.67Å; I64-P72 WeakPolarHBondContact O-CD 3.5Å; P72-E75 PolarHBondContact O-N 2.8Å; P72-A76 WeakPolarHBondContact O-CB 3.2Å; P72-A76 PolarHBondContact O-N 3.02Å; P72-L88 HydrophobicContact CB-CD1 4.14Å; P72-L88 HydrophobicContact CB-CD2 3.98Å; P72-L88 WeakPolarHBondContact O-CD1 3.43Å
73	L	98.7	Very high	97.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-68.7	-39.4	176.2	-174.9	65.1	0	0	0	111.8	S71 E75 A76 C77 V85 L88 L89 A93 Q94 P105 L121	S71-L73 PolarHBondContact O-N 3.21Å; S71-L73 PolarHBondContact OG-N 2.87Å; L73-E75 VanDerWaalsContact C-N 3.3Å; L73-E75 PolarHBondContact O-N 2.9Å; L73-A76 PolarHBondContact O-N 3.08Å; L73-C77 WeakPolarHBondContact O-CB 3.34Å; L73-C77 PolarHBondContact O-N 3Å; L73-C77 PolarHBondContact O-SG 2.88Å; L73-V85 HydrophobicContact CD1-CB 4.45Å; L73-V85 HydrophobicContact CD1-CG1 3.98Å; L73-V85 HydrophobicContact CD1-CG2 4.45Å; L73-L88 HydrophobicContact CB-CD1 4.34Å; L73-L88 HydrophobicContact CD1-CB 4.17Å; L73-L88 HydrophobicContact CD1-CD1 4.28Å; L73-L89 HydrophobicContact CD1-CD2 4.22Å; L73-L89 HydrophobicContact CD1-CG 4.29Å; L73-L89 HydrophobicContact CD2-CD2 3.89Å; L73-A93 HydrophobicContact CB-CB 4.24Å; L73-A93 HydrophobicContact CD2-CB 3.97Å; L73-A93 HydrophobicContact CG-CB 4.49Å; L73-Q94 WeakPolarHBondContact CD2-O 3.16Å; L73-P105 HydrophobicContact CD2-CB 4.02Å; L73-P105 HydrophobicContact CD2-CG 3.86Å; L73-P105 HydrophobicContact CG-CB 4.01Å; L73-P105 HydrophobicContact CG-CG 4.08Å; L73-L121 HydrophobicContact CD2-CD2 4.37Å
74	H	98.7	Very high	97.4	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-45.4	174.9	-70	92.3	0	0	0	111.1	V70 S71 C77 L78 G97 H103 P105 N108	V70-H74 HydrophobicContact CG1-CB 3.87Å; S71-H74 PolarHBondContact N-ND1 3.11Å; S71-H74 VanDerWaalsContact N-ND1 3.16Å; S71-H74 WeakPolarHBondContact O-CB 3.4Å; S71-H74 PolarHBondContact O-N 3.31Å; S71-H74 PolarHBondContact OG-N 2.96Å; S71-H74 PolarHBondContact OG-ND1 3.33Å; H74-C77 PolarHBondContact O-N 3.5Å; H74-L78 WeakPolarHBondContact O-CB 3.31Å; H74-L78 PolarHBondContact O-N 3.15Å; H74-G97 PolarHBondContact NE2-O 3.04Å; H74-H103 PolarHBondContact NE2-O 2.98Å; H74-P105 WeakPolarHBondContact NE2-CD 3.38Å; H74-N108 PolarHBondContact O-ND2 3.13Å
75	E	98.4	Very high	97.6	Very high	42 Å²	42	27.5 Å²	27.5	20%	0.196	17%	0.166	C	C	.	.	H	α-helix	trans	-68.5	-45.3	-179.1	-62.6	-62.4	176.1	0	0	112.6	A44 I45 V70 S71 P72 L73 C77 L78 G79	A44-E75 HydrophobicContact CB-CB 4.07Å; I45-E75 HydrophobicContact CD1-CG 4.24Å; I45-E75 HydrophobicContact CG1-CB 3.62Å; I45-E75 HydrophobicContact CG1-CG 3.63Å; V70-E75 HydrophobicContact CG1-CG 4.11Å; V70-E75 WeakPolarHBondContact CG1-OE1 3.46Å; S71-E75 PolarHBondContact O-N 3.5Å; P72-E75 PolarHBondContact O-N 2.8Å; L73-E75 VanDerWaalsContact C-N 3.3Å; L73-E75 PolarHBondContact O-N 2.9Å; E75-C77 VanDerWaalsContact C-N 3.26Å; E75-C77 PolarHBondContact O-N 2.95Å; E75-L78 PolarHBondContact O-N 3.18Å; E75-G79 PolarHBondContact O-N 3.46Å
76	A	98.7	Very high	97.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-38.7	176.3	0	0	0	0	0	111.7	A44 P72 L73 G80 H81 C84 V85 L88	A44-A76 HydrophobicContact CB-CB 4.16Å; P72-A76 WeakPolarHBondContact O-CB 3.2Å; P72-A76 PolarHBondContact O-N 3.02Å; L73-A76 PolarHBondContact O-N 3.08Å; A76-G80 PolarHBondContact O-N 2.76Å; A76-H81 PolarHBondContact O-N 3.16Å; A76-C84 HydrophobicContact CB-CB 3.83Å; A76-V85 HydrophobicContact CB-CG2 3.85Å; A76-L88 HydrophobicContact CB-CD1 3.82Å
77	C	98.8	Very high	97.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.9	-40.2	176.5	-69.4	0	0	0	0	112.5	L73 H74 E75 G79 G80 P105 N108 A109 S112	L73-C77 WeakPolarHBondContact O-CB 3.34Å; L73-C77 PolarHBondContact O-N 3Å; L73-C77 PolarHBondContact O-SG 2.88Å; H74-C77 PolarHBondContact O-N 3.5Å; E75-C77 VanDerWaalsContact C-N 3.26Å; E75-C77 PolarHBondContact O-N 2.95Å; C77-G79 VanDerWaalsContact C-N 3.3Å; C77-G79 PolarHBondContact O-N 2.91Å; C77-G80 PolarHBondContact O-N 3.29Å; C77-G80 VanDerWaalsContact O-N 3.09Å; C77-P105 WeakPolarHBondContact CB-O 3.5Å; C77-N108 HydrophobicContact CB-CB 4.03Å; C77-A109 HydrophobicContact CB-CB 4.15Å; C77-S112 VanDerWaalsContact O-CB 3.31Å; C77-S112 WeakPolarHBondContact O-CB 3.32Å; C77-S112 PolarHBondContact O-OG 3.11Å
78	L	98.6	Very high	98.1	Very high	74 Å²	74	31.3 Å²	31.3	39%	0.387	18%	0.177	S	C	.	.	H	α-helix	trans	-64.4	-35.7	177.6	-173	62.6	0	0	0	112	H74 E75 G80 N108 V111 S112	H74-L78 WeakPolarHBondContact O-CB 3.31Å; H74-L78 PolarHBondContact O-N 3.15Å; E75-L78 PolarHBondContact O-N 3.18Å; L78-G80 VanDerWaalsContact C-N 3.34Å; L78-N108 HydrophobicContact CB-CB 4.01Å; L78-N108 HydrophobicContact CD1-CB 4.32Å; L78-V111 HydrophobicContact CD1-CB 4.01Å; L78-V111 HydrophobicContact CD1-CG1 3.69Å; L78-S112 WeakPolarHBondContact O-CB 3.42Å
79	G	98.3	Very high	98.4	Very high	40 Å²	40	28.1 Å²	28.1	41%	0.412	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.5	172.9	0	0	0	0	0	115	E75 C77 H81	E75-G79 PolarHBondContact O-N 3.46Å; C77-G79 VanDerWaalsContact C-N 3.3Å; C77-G79 PolarHBondContact O-N 2.91Å; G79-H81 VanDerWaalsContact C-N 3.27Å; G79-H81 PolarHBondContact O-N 2.95Å
80	G	98.5	Very high	98.5	Very high	22 Å²	22	33 Å²	33	23%	0.227	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	21.7	-176.4	0	0	0	0	0	114.3	A76 C77 L78 L82	A76-G80 PolarHBondContact O-N 2.76Å; C77-G80 PolarHBondContact O-N 3.29Å; C77-G80 VanDerWaalsContact O-N 3.09Å; L78-G80 VanDerWaalsContact C-N 3.34Å; G80-L82 PolarHBondContact O-N 3.35Å
81	H	98.8	Very high	98.5	Very high	54 Å²	54	36.2 Å²	36.2	25%	0.25	19%	0.193	C	C	.	.			trans	-82	75.1	-171.2	-61	-53.4	0	0	0	112.3	A44 I45 G47 A76 G79 S83 C84 V85	A44-H81 PolarHBondContact O-CD2 2.94Å; I45-H81 PolarHBondContact O-NE2 2.83Å; G47-H81 PolarHBondContact N-CD2 3.06Å; G47-H81 PolarHBondContact N-NE2 2.8Å; A76-H81 PolarHBondContact O-N 3.16Å; G79-H81 VanDerWaalsContact C-N 3.27Å; G79-H81 PolarHBondContact O-N 2.95Å; H81-S83 VanDerWaalsContact C-N 3.25Å; H81-S83 PolarHBondContact O-N 3.28Å; H81-S83 VanDerWaalsContact O-N 3.09Å; H81-C84 HydrophobicContact CB-CB 3.96Å; H81-C84 WeakPolarHBondContact O-CA 3.27Å; H81-C84 WeakPolarHBondContact O-CB 3.5Å; H81-C84 PolarHBondContact O-N 3.05Å; H81-V85 PolarHBondContact O-N 3.33Å
82	L	98.7	Very high	98.5	Very high	39 Å²	39	38 Å²	38	20%	0.204	21%	0.213	C	C	.	.	H	α-helix	trans	-49.1	-41.4	-175.3	-179.9	64.1	0	0	0	114.2	G80 C84 V85 K86 D116 L120	G80-L82 PolarHBondContact O-N 3.35Å; L82-C84 VanDerWaalsContact C-N 3.33Å; L82-C84 PolarHBondContact O-N 3.08Å; L82-V85 PolarHBondContact O-N 2.92Å; L82-K86 HydrophobicContact CD1-CG 4.42Å; L82-K86 HydrophobicContact CG-CD 4.33Å; L82-K86 WeakPolarHBondContact O-CG 3.36Å; L82-K86 PolarHBondContact O-N 3.15Å; L82-D116 HydrophobicContact CD1-CB 3.81Å; L82-D116 HydrophobicContact CD2-CB 3.64Å; L82-D116 HydrophobicContact CG-CB 4.2Å; L82-L120 HydrophobicContact CD1-CD2 3.87Å
83	S	98.6	Very high	98.5	Very high	66 Å²	66	38.4 Å²	38.4	46%	0.462	22%	0.216	S	C	.	.	H	α-helix	trans	-61.6	-41.6	178.7	-67.4	0	0	0	0	112.1	H81 I87	H81-S83 VanDerWaalsContact C-N 3.25Å; H81-S83 PolarHBondContact O-N 3.28Å; H81-S83 VanDerWaalsContact O-N 3.09Å; S83-I87 WeakPolarHBondContact O-CD1 3.42Å; S83-I87 VanDerWaalsContact O-CG1 3.28Å; S83-I87 WeakPolarHBondContact O-CG1 3.28Å; S83-I87 PolarHBondContact O-N 2.87Å; S83-I87 VanDerWaalsContact O-N 3.13Å
84	C	98.8	Very high	98.4	Very high	1 Å²	1	41 Å²	41	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-68.6	-45.6	177	-62.7	0	0	0	0	110.6	L52 A76 H81 L82 K86 I87 L88	L52-C84 HydrophobicContact CD1-CB 3.55Å; A76-C84 HydrophobicContact CB-CB 3.83Å; H81-C84 HydrophobicContact CB-CB 3.96Å; H81-C84 WeakPolarHBondContact O-CA 3.27Å; H81-C84 WeakPolarHBondContact O-CB 3.5Å; H81-C84 PolarHBondContact O-N 3.05Å; L82-C84 VanDerWaalsContact C-N 3.33Å; L82-C84 PolarHBondContact O-N 3.08Å; C84-K86 VanDerWaalsContact C-N 3.33Å; C84-K86 PolarHBondContact O-N 3.09Å; C84-I87 PolarHBondContact O-N 3.31Å; C84-I87 VanDerWaalsContact O-N 3.11Å; C84-L88 WeakPolarHBondContact O-CB 3.34Å; C84-L88 VanDerWaalsContact O-CG 3.24Å; C84-L88 WeakPolarHBondContact O-CG 3.46Å; C84-L88 PolarHBondContact O-N 2.96Å
85	V	98.8	Very high	98.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-54.9	-48.5	174.7	177.7	0	0	0	0	110.8	L73 A76 H81 L82 I87 L88 L89 L120 L121	L73-V85 HydrophobicContact CD1-CB 4.45Å; L73-V85 HydrophobicContact CD1-CG1 3.98Å; L73-V85 HydrophobicContact CD1-CG2 4.45Å; A76-V85 HydrophobicContact CB-CG2 3.85Å; H81-V85 PolarHBondContact O-N 3.33Å; L82-V85 PolarHBondContact O-N 2.92Å; V85-I87 VanDerWaalsContact C-N 3.35Å; V85-I87 PolarHBondContact O-N 3.4Å; V85-L88 PolarHBondContact O-N 3.1Å; V85-L89 HydrophobicContact CG1-CD1 3.79Å; V85-L89 HydrophobicContact CG1-CG 4.25Å; V85-L89 WeakPolarHBondContact O-CB 3.11Å; V85-L89 VanDerWaalsContact O-CG 3.29Å; V85-L89 WeakPolarHBondContact O-CG 3.3Å; V85-L89 PolarHBondContact O-N 3.49Å; V85-L120 HydrophobicContact CG1-CD2 3.87Å; V85-L121 HydrophobicContact CG1-CD2 4.47Å
86	K	98.7	Very high	98.3	Very high	115 Å²	115	43.5 Å²	43.5	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-57.5	-44	176.2	-76.6	177.7	178.5	175.1	0	112.7	L82 C84 K90 L120	L82-K86 HydrophobicContact CD1-CG 4.42Å; L82-K86 HydrophobicContact CG-CD 4.33Å; L82-K86 WeakPolarHBondContact O-CG 3.36Å; L82-K86 PolarHBondContact O-N 3.15Å; C84-K86 VanDerWaalsContact C-N 3.33Å; C84-K86 PolarHBondContact O-N 3.09Å; K86-K90 WeakPolarHBondContact O-CB 3.25Å; K86-K90 PolarHBondContact O-N 3.1Å; K86-L120 HydrophobicContact CB-CD2 4.4Å; K86-L120 HydrophobicContact CG-CD2 3.42Å; K86-L120 VanDerWaalsContact CG-CD2 3.42Å
87	I	98.5	Very high	98.2	Very high	11 Å²	11	44.2 Å²	44.2	6%	0.056	25%	0.251	C	S	.	.	H	α-helix	trans	-65.4	-46.2	179.7	-70.6	159.4	0	0	0	110.7	Q49 R53 I56 S83 C84 V85 K90 H91	Q49-I87 HydrophobicContact CB-CD1 3.68Å; R53-I87 HydrophobicContact CG-CD1 3.89Å; R53-I87 HydrophobicContact CG-CG1 4.39Å; R53-I87 HydrophobicContact CG-CG2 4.39Å; I56-I87 HydrophobicContact CD1-CG2 3.57Å; S83-I87 WeakPolarHBondContact O-CD1 3.42Å; S83-I87 VanDerWaalsContact O-CG1 3.28Å; S83-I87 WeakPolarHBondContact O-CG1 3.28Å; S83-I87 PolarHBondContact O-N 2.87Å; S83-I87 VanDerWaalsContact O-N 3.13Å; C84-I87 PolarHBondContact O-N 3.31Å; C84-I87 VanDerWaalsContact O-N 3.11Å; V85-I87 VanDerWaalsContact C-N 3.35Å; V85-I87 PolarHBondContact O-N 3.4Å; I87-K90 PolarHBondContact O-N 2.78Å; I87-H91 PolarHBondContact O-N 3.14Å; I87-H91 PolarHBondContact O-ND1 3.34Å
88	L	98.5	Very high	98.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.8	-48.4	-178.7	-66.9	168.2	0	0	0	110.9	M40 L52 V62 P72 L73 A76 C84 V85 K90 H91 G92 A93	M40-L88 HydrophobicContact CE-CD2 3.95Å; L52-L88 HydrophobicContact CD1-CD1 4.43Å; L52-L88 HydrophobicContact CD1-CD2 4.43Å; L52-L88 HydrophobicContact CD1-CG 4.32Å; L52-L88 HydrophobicContact CD2-CD2 4.25Å; V62-L88 HydrophobicContact CG1-CB 4.29Å; V62-L88 HydrophobicContact CG1-CD2 3.81Å; P72-L88 HydrophobicContact CB-CD1 4.14Å; P72-L88 HydrophobicContact CB-CD2 3.98Å; P72-L88 WeakPolarHBondContact O-CD1 3.43Å; L73-L88 HydrophobicContact CB-CD1 4.34Å; L73-L88 HydrophobicContact CD1-CB 4.17Å; L73-L88 HydrophobicContact CD1-CD1 4.28Å; A76-L88 HydrophobicContact CB-CD1 3.82Å; C84-L88 WeakPolarHBondContact O-CB 3.34Å; C84-L88 VanDerWaalsContact O-CG 3.24Å; C84-L88 WeakPolarHBondContact O-CG 3.46Å; C84-L88 PolarHBondContact O-N 2.96Å; V85-L88 PolarHBondContact O-N 3.1Å; L88-K90 PolarHBondContact O-N 3.4Å; L88-H91 CarbonylContact O-C 3.47Å; L88-H91 PolarHBondContact O-N 3.31Å; L88-H91 VanDerWaalsContact O-N 3.12Å; L88-G92 PolarHBondContact O-N 3.41Å; L88-A93 VanDerWaalsContact C-CB 3.45Å; L88-A93 HydrophobicContact CB-CB 3.86Å; L88-A93 VanDerWaalsContact O-CB 3.23Å; L88-A93 WeakPolarHBondContact O-CB 3.27Å; L88-A93 PolarHBondContact O-N 3.45Å
89	L	98.5	Very high	98.1	Very high	15 Å²	15	44.3 Å²	44.3	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-41.9	177.4	-67.5	178.4	0	0	0	112.5	L73 V85 H91 G92 A93 V95 L120 L121	L73-L89 HydrophobicContact CD1-CD2 4.22Å; L73-L89 HydrophobicContact CD1-CG 4.29Å; L73-L89 HydrophobicContact CD2-CD2 3.89Å; V85-L89 HydrophobicContact CG1-CD1 3.79Å; V85-L89 HydrophobicContact CG1-CG 4.25Å; V85-L89 WeakPolarHBondContact O-CB 3.11Å; V85-L89 VanDerWaalsContact O-CG 3.29Å; V85-L89 WeakPolarHBondContact O-CG 3.3Å; V85-L89 PolarHBondContact O-N 3.49Å; L89-H91 PolarHBondContact O-N 3.31Å; L89-H91 VanDerWaalsContact O-N 3.13Å; L89-G92 PolarHBondContact O-N 3.04Å; L89-A93 HydrophobicContact CD2-CB 4.43Å; L89-V95 HydrophobicContact CD2-CG2 3.5Å; L89-V95 VanDerWaalsContact CD2-CG2 3.5Å; L89-L120 HydrophobicContact CD1-CD2 4Å; L89-L120 HydrophobicContact CD1-CG 3.83Å; L89-L121 HydrophobicContact CD1-CD2 4.43Å
90	K	98.1	Very high	97.9	Very high	177 Å²	177	44.9 Å²	44.9	77%	0.77	26%	0.255	S	S	*	.	H	α-helix	trans	-57.2	-29.3	176.1	179.7	176.2	177.4	-179.2	0	112.8	K86 I87 L88	K86-K90 WeakPolarHBondContact O-CB 3.25Å; K86-K90 PolarHBondContact O-N 3.1Å; I87-K90 PolarHBondContact O-N 2.78Å; L88-K90 PolarHBondContact O-N 3.4Å
91	H	98	Very high	97.8	Very high	93 Å²	93	49 Å²	49	43%	0.431	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	23.2	179.6	-63.7	88.5	0	0	0	112.6	V62 I87 L88 L89	V62-H91 HydrophobicContact CG2-CB 3.76Å; I87-H91 PolarHBondContact O-N 3.14Å; I87-H91 PolarHBondContact O-ND1 3.34Å; L88-H91 CarbonylContact O-C 3.47Å; L88-H91 PolarHBondContact O-N 3.31Å; L88-H91 VanDerWaalsContact O-N 3.12Å; L89-H91 PolarHBondContact O-N 3.31Å; L89-H91 VanDerWaalsContact O-N 3.13Å
92	G	96.9	Very high	97.7	Very high	46 Å²	46	52.1 Å²	52.1	47%	0.474	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	26.2	168.8	0	0	0	0	0	115.2	N63 L88 L89 Q94	N63-G92 PolarHBondContact ND2-O 3.3Å; L88-G92 PolarHBondContact O-N 3.41Å; L89-G92 PolarHBondContact O-N 3.04Å; G92-Q94 PolarHBondContact O-N 3.1Å
93	A	98.2	Very high	97.7	Very high	9 Å²	9	53 Å²	53	7%	0.074	29%	0.285	C	S	.	.			trans	-57.6	135.5	171.8	0	0	0	0	0	111.8	V62 N63 L73 L88 L89 V95	V62-A93 HydrophobicContact CG1-CB 3.63Å; N63-A93 WeakPolarHBondContact OD1-CA 3.21Å; L73-A93 HydrophobicContact CB-CB 4.24Å; L73-A93 HydrophobicContact CD2-CB 3.97Å; L73-A93 HydrophobicContact CG-CB 4.49Å; L88-A93 VanDerWaalsContact C-CB 3.45Å; L88-A93 HydrophobicContact CB-CB 3.86Å; L88-A93 VanDerWaalsContact O-CB 3.23Å; L88-A93 WeakPolarHBondContact O-CB 3.27Å; L88-A93 PolarHBondContact O-N 3.45Å; L89-A93 HydrophobicContact CD2-CB 4.43Å; A93-V95 PolarHBondContact O-N 2.97Å
94	Q	97.8	Very high	97.7	Very high	54 Å²	54	50.2 Å²	50.2	25%	0.252	27%	0.265	S	S	.	.			trans	-72.7	114	178.2	-69.6	177	39.9	0	0	111.5	F19 N63 L73 G92 N96	F19-Q94 VanDerWaalsContact CD2-NE2 3.3Å; N63-Q94 PolarHBondContact OD1-N 2.95Å; L73-Q94 WeakPolarHBondContact CD2-O 3.16Å; G92-Q94 PolarHBondContact O-N 3.1Å; Q94-N96 PolarHBondContact O-N 2.71Å
95	V	98	Very high	97.6	Very high	17 Å²	17	50.2 Å²	50.2	10%	0.103	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-27.9	-174.5	-177	0	0	0	0	113.2	L89 A93 P105 L121 H124 A126	L89-V95 HydrophobicContact CD2-CG2 3.5Å; L89-V95 VanDerWaalsContact CD2-CG2 3.5Å; A93-V95 PolarHBondContact O-N 2.97Å; V95-P105 VanDerWaalsContact O-CD 3.26Å; V95-P105 WeakPolarHBondContact O-CD 3.48Å; V95-P105 VanDerWaalsContact O-CG 3.26Å; V95-P105 WeakPolarHBondContact O-CG 3.42Å; V95-L121 HydrophobicContact CG1-CD2 4.01Å; V95-H124 HydrophobicContact CG2-CB 3.87Å; V95-A126 HydrophobicContact CG1-CB 3.56Å
96	N	97.7	Very high	97.6	Very high	80 Å²	80	50.2 Å²	50.2	43%	0.428	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	25	-174.6	-68.5	-49.4	0	0	0	112.6	Q94 G125 A126 S127	Q94-N96 PolarHBondContact O-N 2.71Å; N96-G125 PolarHBondContact ND2-O 3.38Å; N96-A126 WeakPolarHBondContact OD1-CA 3.46Å; N96-S127 PolarHBondContact OD1-N 3.14Å
97	G	96	Very high	97.6	Very high	15 Å²	15	45.4 Å²	45.4	16%	0.155	24%	0.244	C	C	.	.			trans	-58.5	147	169.6	0	0	0	0	0	110.6	H74 T104 P105	H74-G97 PolarHBondContact NE2-O 3.04Å; G97-T104 WeakPolarHBondContact O-CA 3.41Å; G97-P105 WeakPolarHBondContact O-CD 3.42Å
98	V	97.2	Very high	97.6	Very high	67 Å²	67	45.3 Å²	45.3	41%	0.406	24%	0.243	S	C	.	.			trans	-124.6	126	-179.8	-175.7	0	0	0	0	107.9	H69 W102 H103 T104	H69-V98 WeakPolarHBondContact CB-O 3.23Å; V98-W102 HydrophobicContact CG1-CE3 3.94Å; V98-H103 WeakPolarHBondContact CA-O 3.38Å; V98-T104 HydrophobicContact CG2-CG2 4.14Å
99	T	97	Very high	97.7	Very high	10 Å²	10	45.3 Å²	45.3	6%	0.061	24%	0.243	C	C	.	.			trans	-76.3	171.6	175.7	71.5	0	0	0	0	111.5	D68 V70 D101 W102 H103	D68-T99 CarbonylContact O-C 3.48Å; D68-T99 WeakPolarHBondContact O-CA 3.2Å; V70-T99 HydrophobicContact CB-CG2 4.43Å; V70-T99 HydrophobicContact CG2-CG2 3.9Å; T99-D101 PolarHBondContact O-N 2.88Å; T99-D101 PolarHBondContact OG1-N 3.29Å; T99-W102 PolarHBondContact O-N 3.24Å; T99-H103 HydrophobicContact CG2-CB 4.15Å; T99-H103 PolarHBondContact N-O 3.48Å; T99-H103 WeakPolarHBondContact OG1-CB 3.23Å; T99-H103 PolarHBondContact OG1-N 3.37Å; T99-H103 VanDerWaalsContact OG1-N 3.08Å
100	A	95.6	Very high	97.7	Very high	51 Å²	51	44.6 Å²	44.6	42%	0.421	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.1	172.3	0	0	0	0	0	112.9	D68 W102	D68-A100 HydrophobicContact CB-CB 4.11Å; D68-A100 PolarHBondContact O-N 3.02Å; A100-W102 VanDerWaalsContact C-N 3.29Å; A100-W102 PolarHBondContact O-N 2.96Å
101	D	95.6	Very high	97.7	Very high	109 Å²	109	37.6 Å²	37.6	58%	0.583	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	15.2	175.7	-62.6	-39.9	0	0	0	113.7	T99 H103	T99-D101 PolarHBondContact O-N 2.88Å; T99-D101 PolarHBondContact OG1-N 3.29Å; D101-H103 PolarHBondContact O-CD2 3.33Å; D101-H103 PolarHBondContact O-N 3.4Å
102	W	96.7	Very high	97.7	Very high	119 Å²	119	35 Å²	35	45%	0.451	20%	0.204	S	C	.	.			trans	67.5	8.4	-179	-55.1	95.5	0	0	0	116.2	V98 T99 A100 A135	V98-W102 HydrophobicContact CG1-CE3 3.94Å; T99-W102 PolarHBondContact O-N 3.24Å; A100-W102 VanDerWaalsContact C-N 3.29Å; A100-W102 PolarHBondContact O-N 2.96Å; W102-A135 HydrophobicContact CB-CB 4.18Å; W102-A135 VanDerWaalsContact O-CB 3.23Å; W102-A135 WeakPolarHBondContact O-CB 3.49Å
103	H	98	Very high	97.8	Very high	59 Å²	59	34 Å²	34	27%	0.273	19%	0.194	S	C	.	.			trans	-71.4	141.4	178.5	-60.3	160.2	0	0	0	110.9	H74 V98 T99 D101 F107	H74-H103 PolarHBondContact NE2-O 2.98Å; V98-H103 WeakPolarHBondContact CA-O 3.38Å; T99-H103 HydrophobicContact CG2-CB 4.15Å; T99-H103 PolarHBondContact N-O 3.48Å; T99-H103 WeakPolarHBondContact OG1-CB 3.23Å; T99-H103 PolarHBondContact OG1-N 3.37Å; T99-H103 VanDerWaalsContact OG1-N 3.08Å; D101-H103 PolarHBondContact O-CD2 3.33Å; D101-H103 PolarHBondContact O-N 3.4Å; H103-F107 HydrophobicContact CB-CD1 3.95Å; H103-F107 AromaticContact CD2-CD1 3.41Å; H103-F107 VanDerWaalsContact CD2-CD1 3.41Å; H103-F107 WeakPolarHBondContact CD2-CD1 3.36Å; H103-F107 AromaticContact CD2-CE1 3.19Å; H103-F107 WeakPolarHBondContact CD2-CE1 3.5Å; H103-F107 AromaticContact CD2-CZ 3.99Å; H103-F107 AromaticContact CG-CD1 3.69Å; H103-F107 AromaticContact CG-CE1 3.8Å; H103-F107 AromaticContact NE2-CE1 3.35Å; H103-F107 WeakPolarHBondContact NE2-CE1 3.37Å; H103-F107 AromaticContact NE2-CZ 4Å
104	T	98.3	Very high	97.8	Very high	7 Å²	7	34.7 Å²	34.7	4%	0.043	20%	0.198	C	C	.	.			trans	-111.6	163.4	169.8	58.8	0	0	0	0	109.6	G97 V98 L106 F107 N108 P130	G97-T104 WeakPolarHBondContact O-CA 3.41Å; V98-T104 HydrophobicContact CG2-CG2 4.14Å; T104-L106 PolarHBondContact O-N 3.12Å; T104-F107 WeakPolarHBondContact O-CB 3.4Å; T104-F107 PolarHBondContact O-N 3.31Å; T104-F107 VanDerWaalsContact O-N 3.1Å; T104-F107 PolarHBondContact OG1-N 3.04Å; T104-F107 VanDerWaalsContact OG1-N 3.14Å; T104-N108 PolarHBondContact O-N 3.24Å; T104-P130 HydrophobicContact CG2-CB 4.24Å; T104-P130 HydrophobicContact CG2-CG 4.14Å
105	P	98.6	Very high	97.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54.2	-36.8	171.5	-29.3	38.5	0	0	0	113	L73 H74 C77 V95 G97 N108 A109 L121	L73-P105 HydrophobicContact CD2-CB 4.02Å; L73-P105 HydrophobicContact CD2-CG 3.86Å; L73-P105 HydrophobicContact CG-CB 4.01Å; L73-P105 HydrophobicContact CG-CG 4.08Å; H74-P105 WeakPolarHBondContact NE2-CD 3.38Å; C77-P105 WeakPolarHBondContact CB-O 3.5Å; V95-P105 VanDerWaalsContact O-CD 3.26Å; V95-P105 WeakPolarHBondContact O-CD 3.48Å; V95-P105 VanDerWaalsContact O-CG 3.26Å; V95-P105 WeakPolarHBondContact O-CG 3.42Å; G97-P105 WeakPolarHBondContact O-CD 3.42Å; P105-N108 PolarHBondContact O-N 3.43Å; P105-A109 WeakPolarHBondContact O-CB 3.27Å; P105-A109 PolarHBondContact O-N 3.11Å; P105-L121 HydrophobicContact CB-CD1 4.22Å; P105-L121 HydrophobicContact CB-CD2 4.01Å; P105-L121 WeakPolarHBondContact O-CD1 3.43Å
106	L	98.7	Very high	97.9	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-67.5	-41.4	177.3	-175.8	63.5	0	0	0	112.2	T104 A109 C110 V118 L121 L122 A126 S127 P137 L153	T104-L106 PolarHBondContact O-N 3.12Å; L106-A109 PolarHBondContact O-N 3.36Å; L106-C110 PolarHBondContact O-N 3.31Å; L106-C110 PolarHBondContact O-SG 3.22Å; L106-V118 HydrophobicContact CD1-CB 4.48Å; L106-V118 HydrophobicContact CD1-CG1 4.03Å; L106-L121 HydrophobicContact CB-CD1 4.43Å; L106-L121 HydrophobicContact CD1-CB 4.28Å; L106-L121 HydrophobicContact CD1-CD1 4.37Å; L106-L122 HydrophobicContact CD1-CD2 4.25Å; L106-L122 HydrophobicContact CD1-CG 4.12Å; L106-L122 HydrophobicContact CD2-CD2 3.95Å; L106-A126 HydrophobicContact CB-CB 4.16Å; L106-A126 HydrophobicContact CD2-CB 4.07Å; L106-A126 HydrophobicContact CG-CB 4.49Å; L106-S127 VanDerWaalsContact CD2-O 3.32Å; L106-S127 WeakPolarHBondContact CD2-O 3.41Å; L106-P137 HydrophobicContact CD2-CB 4.43Å; L106-P137 HydrophobicContact CD2-CG 4.17Å; L106-P137 HydrophobicContact CG-CB 4.2Å; L106-P137 HydrophobicContact CG-CG 4.17Å; L106-L153 HydrophobicContact CD1-CD2 4.23Å; L106-L153 HydrophobicContact CD2-CD2 3.89Å; L106-L153 HydrophobicContact CG-CD2 4.25Å
107	F	98.6	Very high	97.9	Very high	14 Å²	14	36.5 Å²	36.5	6%	0.061	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-48.8	173.1	178	-94.8	0	0	0	111.1	H103 T104 A109 C110 V111 A135 P137 E140	H103-F107 HydrophobicContact CB-CD1 3.95Å; H103-F107 AromaticContact CD2-CD1 3.41Å; H103-F107 VanDerWaalsContact CD2-CD1 3.41Å; H103-F107 WeakPolarHBondContact CD2-CD1 3.36Å; H103-F107 AromaticContact CD2-CE1 3.19Å; H103-F107 WeakPolarHBondContact CD2-CE1 3.5Å; H103-F107 AromaticContact CD2-CZ 3.99Å; H103-F107 AromaticContact CG-CD1 3.69Å; H103-F107 AromaticContact CG-CE1 3.8Å; H103-F107 AromaticContact NE2-CE1 3.35Å; H103-F107 WeakPolarHBondContact NE2-CE1 3.37Å; H103-F107 AromaticContact NE2-CZ 4Å; T104-F107 WeakPolarHBondContact O-CB 3.4Å; T104-F107 PolarHBondContact O-N 3.31Å; T104-F107 VanDerWaalsContact O-N 3.1Å; T104-F107 PolarHBondContact OG1-N 3.04Å; T104-F107 VanDerWaalsContact OG1-N 3.14Å; F107-A109 VanDerWaalsContact C-N 3.32Å; F107-A109 PolarHBondContact O-N 3.38Å; F107-C110 CarbonylContact O-C 3.54Å; F107-C110 WeakPolarHBondContact O-CA 3.41Å; F107-C110 WeakPolarHBondContact O-CB 3.46Å; F107-C110 PolarHBondContact O-N 3.4Å; F107-V111 HydrophobicContact CD1-CG2 4.06Å; F107-V111 HydrophobicContact CE1-CG2 3.65Å; F107-V111 HydrophobicContact CZ-CG2 4.05Å; F107-V111 PolarHBondContact O-N 2.97Å; F107-A135 HydrophobicContact CD1-CB 4.47Å; F107-A135 HydrophobicContact CD2-CB 3.89Å; F107-A135 VanDerWaalsContact CD2-O 3.26Å; F107-A135 WeakPolarHBondContact CD2-O 3.49Å; F107-A135 HydrophobicContact CE2-CB 4.05Å; F107-A135 HydrophobicContact CG-CB 4.1Å; F107-A135 HydrophobicContact CZ-CB 4.42Å; F107-P137 HydrophobicContact CB-CG 4.39Å; F107-E140 HydrophobicContact CD2-CB 4.29Å; F107-E140 HydrophobicContact CE2-CB 3.7Å; F107-E140 HydrophobicContact CE2-CG 3.93Å; F107-E140 HydrophobicContact CZ-CB 4.31Å; F107-E140 HydrophobicContact CZ-CG 4.04Å
108	N	98.7	Very high	98	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.043	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-37.5	178.8	-75.8	9.3	0	0	0	112.8	H74 C77 L78 T104 P105 C110 V111 S112	H74-N108 PolarHBondContact O-ND2 3.13Å; C77-N108 HydrophobicContact CB-CB 4.03Å; L78-N108 HydrophobicContact CB-CB 4.01Å; L78-N108 HydrophobicContact CD1-CB 4.32Å; T104-N108 PolarHBondContact O-N 3.24Å; P105-N108 PolarHBondContact O-N 3.43Å; N108-C110 VanDerWaalsContact C-N 3.28Å; N108-C110 PolarHBondContact O-N 3.41Å; N108-V111 WeakPolarHBondContact O-CB 3.46Å; N108-V111 PolarHBondContact O-N 3.12Å; N108-S112 PolarHBondContact O-N 3.15Å
109	A	98.8	Very high	98.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.8	-32.6	172.8	0	0	0	0	0	112.5	C77 P105 L106 F107 S112 G113 S114 C117 V118 L121	C77-A109 HydrophobicContact CB-CB 4.15Å; P105-A109 WeakPolarHBondContact O-CB 3.27Å; P105-A109 PolarHBondContact O-N 3.11Å; L106-A109 PolarHBondContact O-N 3.36Å; F107-A109 VanDerWaalsContact C-N 3.32Å; F107-A109 PolarHBondContact O-N 3.38Å; A109-S112 PolarHBondContact O-N 3.5Å; A109-S112 PolarHBondContact O-OG 3.32Å; A109-G113 PolarHBondContact O-N 2.9Å; A109-G113 VanDerWaalsContact O-N 3.09Å; A109-S114 PolarHBondContact O-N 3.48Å; A109-C117 HydrophobicContact CB-CB 3.95Å; A109-V118 HydrophobicContact CB-CG2 3.73Å; A109-L121 HydrophobicContact CB-CD1 3.74Å
110	C	98.7	Very high	98.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-72.9	-33.2	174	-65.9	0	0	0	0	112.3	L106 F107 N108 G113 P137 A141 H146	L106-C110 PolarHBondContact O-N 3.31Å; L106-C110 PolarHBondContact O-SG 3.22Å; F107-C110 CarbonylContact O-C 3.54Å; F107-C110 WeakPolarHBondContact O-CA 3.41Å; F107-C110 WeakPolarHBondContact O-CB 3.46Å; F107-C110 PolarHBondContact O-N 3.4Å; N108-C110 VanDerWaalsContact C-N 3.28Å; N108-C110 PolarHBondContact O-N 3.41Å; C110-G113 PolarHBondContact O-N 3.1Å; C110-P137 HydrophobicContact CB-CB 4.41Å; C110-A141 HydrophobicContact CB-CB 4.13Å; C110-H146 PolarHBondContact O-CE1 2.98Å; C110-H146 PolarHBondContact O-ND1 3.35Å
111	V	98.6	Very high	98.3	Very high	30 Å²	30	31.8 Å²	31.8	18%	0.182	16%	0.162	C	C	.	.	H	α-helix	trans	-62.5	-43.9	170.3	174.6	0	0	0	0	110.8	L78 F107 N108 G113 E140 H146	L78-V111 HydrophobicContact CD1-CB 4.01Å; L78-V111 HydrophobicContact CD1-CG1 3.69Å; F107-V111 HydrophobicContact CD1-CG2 4.06Å; F107-V111 HydrophobicContact CE1-CG2 3.65Å; F107-V111 HydrophobicContact CZ-CG2 4.05Å; F107-V111 PolarHBondContact O-N 2.97Å; N108-V111 WeakPolarHBondContact O-CB 3.46Å; N108-V111 PolarHBondContact O-N 3.12Å; V111-G113 VanDerWaalsContact C-N 3.33Å; V111-G113 PolarHBondContact O-N 3.1Å; V111-E140 HydrophobicContact CG2-CG 3.7Å; V111-H146 PolarHBondContact O-CE1 3.42Å
112	S	98.4	Very high	98.5	Very high	39 Å²	39	27 Å²	27	27%	0.273	14%	0.137	S	C	.	.	H	α-helix	trans	-73.4	-22.6	-179.1	74.5	0	0	0	0	114.1	C77 L78 N108 A109 S114	C77-S112 VanDerWaalsContact O-CB 3.31Å; C77-S112 WeakPolarHBondContact O-CB 3.32Å; C77-S112 PolarHBondContact O-OG 3.11Å; L78-S112 WeakPolarHBondContact O-CB 3.42Å; N108-S112 PolarHBondContact O-N 3.15Å; A109-S112 PolarHBondContact O-N 3.5Å; A109-S112 PolarHBondContact O-OG 3.32Å; S112-S114 PolarHBondContact O-N 3.39Å; S112-S114 PolarHBondContact OG-N 3.47Å
113	G	98.2	Very high	98.5	Very high	26 Å²	26	27.4 Å²	27.4	27%	0.268	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	8.7	-176	0	0	0	0	0	114.2	A109 C110 V111 W115 H146	A109-G113 PolarHBondContact O-N 2.9Å; A109-G113 VanDerWaalsContact O-N 3.09Å; C110-G113 PolarHBondContact O-N 3.1Å; V111-G113 VanDerWaalsContact C-N 3.33Å; V111-G113 PolarHBondContact O-N 3.1Å; G113-W115 PolarHBondContact O-N 3.08Å; G113-H146 WeakPolarHBondContact CA-CE1 3.41Å; G113-H146 WeakPolarHBondContact CA-ND1 3.06Å; G113-H146 PolarHBondContact N-CE1 3.41Å
114	S	98.6	Very high	98.6	Very high	22 Å²	22	29.1 Å²	29.1	15%	0.154	15%	0.152	C	C	.	.			trans	-74.5	91.5	177.7	-174.1	0	0	0	0	110.8	A109 S112 D116 C117 V118	A109-S114 PolarHBondContact O-N 3.48Å; S112-S114 PolarHBondContact O-N 3.39Å; S112-S114 PolarHBondContact OG-N 3.47Å; S114-D116 PolarHBondContact O-N 3.06Å; S114-C117 WeakPolarHBondContact O-CB 3.38Å; S114-C117 PolarHBondContact O-N 2.85Å; S114-C117 PolarHBondContact OG-N 3.27Å; S114-C117 PolarHBondContact OG-SG 3.11Å; S114-V118 PolarHBondContact O-N 3.24Å
115	W	98.4	Very high	98.5	Very high	110 Å²	110	31.1 Å²	31.1	42%	0.417	17%	0.174	S	C	.	.	H	α-helix	trans	-52.9	-38.9	175.1	168.7	78.1	0	0	0	112.7	G113 C117 V118 N119 E148 S152	G113-W115 PolarHBondContact O-N 3.08Å; W115-C117 PolarHBondContact O-N 3.2Å; W115-V118 PolarHBondContact O-N 3.23Å; W115-N119 WeakPolarHBondContact CZ2-ND2 3.27Å; W115-N119 PolarHBondContact NE1-ND2 2.98Å; W115-N119 WeakPolarHBondContact O-CB 3.34Å; W115-N119 PolarHBondContact O-N 3.28Å; W115-E148 HydrophobicContact CB-CB 4.19Å; W115-E148 VanDerWaalsContact CD1-CB 3.48Å; W115-E148 HydrophobicContact CG-CB 3.89Å; W115-S152 PolarHBondContact NE1-OG 3.39Å
116	D	98.7	Very high	98.5	Very high	79 Å²	79	31.5 Å²	31.5	42%	0.422	18%	0.176	S	C	.	.	H	α-helix	trans	-62.1	-41.4	176.1	-70.7	-58.1	0	0	0	112.2	L82 S114 L120	L82-D116 HydrophobicContact CD1-CB 3.81Å; L82-D116 HydrophobicContact CD2-CB 3.64Å; L82-D116 HydrophobicContact CG-CB 4.2Å; S114-D116 PolarHBondContact O-N 3.06Å; D116-L120 VanDerWaalsContact O-CB 3.27Å; D116-L120 WeakPolarHBondContact O-CB 3.27Å; D116-L120 PolarHBondContact O-N 3.1Å
117	C	98.8	Very high	98.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.1	-44.6	176	-67.8	0	0	0	0	111	A109 S114 W115 N119 L120 L121	A109-C117 HydrophobicContact CB-CB 3.95Å; S114-C117 WeakPolarHBondContact O-CB 3.38Å; S114-C117 PolarHBondContact O-N 2.85Å; S114-C117 PolarHBondContact OG-N 3.27Å; S114-C117 PolarHBondContact OG-SG 3.11Å; W115-C117 PolarHBondContact O-N 3.2Å; C117-N119 PolarHBondContact O-N 3.38Å; C117-L120 PolarHBondContact O-N 3.21Å; C117-L121 WeakPolarHBondContact O-CB 3.4Å; C117-L121 WeakPolarHBondContact O-CG 3.35Å; C117-L121 PolarHBondContact O-N 3.35Å
118	V	98.8	Very high	98.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.3	-51.4	176.8	169.3	0	0	0	0	110.8	L106 A109 S114 W115 L120 L121 L122 C149	L106-V118 HydrophobicContact CD1-CB 4.48Å; L106-V118 HydrophobicContact CD1-CG1 4.03Å; A109-V118 HydrophobicContact CB-CG2 3.73Å; S114-V118 PolarHBondContact O-N 3.24Å; W115-V118 PolarHBondContact O-N 3.23Å; V118-L120 PolarHBondContact O-N 2.9Å; V118-L121 PolarHBondContact O-N 3.43Å; V118-L122 HydrophobicContact CG1-CD1 3.79Å; V118-L122 HydrophobicContact CG1-CG 4.48Å; V118-L122 WeakPolarHBondContact O-CB 3.4Å; V118-L122 VanDerWaalsContact O-CG 3.27Å; V118-L122 WeakPolarHBondContact O-CG 3.49Å; V118-L122 PolarHBondContact O-N 2.99Å; V118-C149 HydrophobicContact CG2-CB 4.23Å
119	N	98.6	Very high	98	Very high	23 Å²	23	37.1 Å²	37.1	12%	0.123	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-43.3	178.6	-81.2	-21.4	0	0	0	112.9	W115 C117 L121 L122 Q123 S152	W115-N119 WeakPolarHBondContact CZ2-ND2 3.27Å; W115-N119 PolarHBondContact NE1-ND2 2.98Å; W115-N119 WeakPolarHBondContact O-CB 3.34Å; W115-N119 PolarHBondContact O-N 3.28Å; C117-N119 PolarHBondContact O-N 3.38Å; N119-L121 VanDerWaalsContact C-N 3.33Å; N119-L121 PolarHBondContact O-N 3.07Å; N119-L122 PolarHBondContact O-N 3.29Å; N119-Q123 WeakPolarHBondContact O-CB 3.46Å; N119-Q123 VanDerWaalsContact O-CG 3.25Å; N119-Q123 WeakPolarHBondContact O-CG 3.31Å; N119-Q123 PolarHBondContact O-N 3.46Å; N119-S152 WeakPolarHBondContact OD1-CB 3.46Å; N119-S152 PolarHBondContact OD1-OG 2.87Å
120	L	98.7	Very high	97.4	Very high	21 Å²	21	37.9 Å²	37.9	11%	0.11	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-40.6	-179.2	-176.8	62.8	0	0	0	111.5	L82 V85 K86 L89 D116 C117 V118 Q123 H124	L82-L120 HydrophobicContact CD1-CD2 3.87Å; V85-L120 HydrophobicContact CG1-CD2 3.87Å; K86-L120 HydrophobicContact CB-CD2 4.4Å; K86-L120 HydrophobicContact CG-CD2 3.42Å; K86-L120 VanDerWaalsContact CG-CD2 3.42Å; L89-L120 HydrophobicContact CD1-CD2 4Å; L89-L120 HydrophobicContact CD1-CG 3.83Å; D116-L120 VanDerWaalsContact O-CB 3.27Å; D116-L120 WeakPolarHBondContact O-CB 3.27Å; D116-L120 PolarHBondContact O-N 3.1Å; C117-L120 PolarHBondContact O-N 3.21Å; V118-L120 PolarHBondContact O-N 2.9Å; L120-Q123 PolarHBondContact O-N 2.94Å; L120-H124 PolarHBondContact O-N 3.17Å; L120-H124 PolarHBondContact O-ND1 2.96Å
121	L	98.7	Very high	96.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.8	-44.9	175.6	-69.7	168.8	0	0	0	111.6	L73 V85 L89 V95 P105 L106 A109 C117 V118 N119 Q123 H124 G125 A126	L73-L121 HydrophobicContact CD2-CD2 4.37Å; V85-L121 HydrophobicContact CG1-CD2 4.47Å; L89-L121 HydrophobicContact CD1-CD2 4.43Å; V95-L121 HydrophobicContact CG1-CD2 4.01Å; P105-L121 HydrophobicContact CB-CD1 4.22Å; P105-L121 HydrophobicContact CB-CD2 4.01Å; P105-L121 WeakPolarHBondContact O-CD1 3.43Å; L106-L121 HydrophobicContact CB-CD1 4.43Å; L106-L121 HydrophobicContact CD1-CB 4.28Å; L106-L121 HydrophobicContact CD1-CD1 4.37Å; A109-L121 HydrophobicContact CB-CD1 3.74Å; C117-L121 WeakPolarHBondContact O-CB 3.4Å; C117-L121 WeakPolarHBondContact O-CG 3.35Å; C117-L121 PolarHBondContact O-N 3.35Å; V118-L121 PolarHBondContact O-N 3.43Å; N119-L121 VanDerWaalsContact C-N 3.33Å; N119-L121 PolarHBondContact O-N 3.07Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; L121-Q123 PolarHBondContact O-N 2.98Å; L121-H124 CarbonylContact O-C 3.45Å; L121-H124 WeakPolarHBondContact O-CA 3.36Å; L121-H124 PolarHBondContact O-N 3.01Å; L121-G125 PolarHBondContact O-N 3.16Å; L121-A126 HydrophobicContact CB-CB 3.95Å; L121-A126 VanDerWaalsContact O-CB 3.27Å; L121-A126 WeakPolarHBondContact O-CB 3.38Å; L121-A126 PolarHBondContact O-N 3.16Å
122	L	98.5	Very high	96.5	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-40.3	176.5	-70.8	170.5	0	0	0	112	L106 V118 N119 H124 G125 V128 L153 Y156	L106-L122 HydrophobicContact CD1-CD2 4.25Å; L106-L122 HydrophobicContact CD1-CG 4.12Å; L106-L122 HydrophobicContact CD2-CD2 3.95Å; V118-L122 HydrophobicContact CG1-CD1 3.79Å; V118-L122 HydrophobicContact CG1-CG 4.48Å; V118-L122 WeakPolarHBondContact O-CB 3.4Å; V118-L122 VanDerWaalsContact O-CG 3.27Å; V118-L122 WeakPolarHBondContact O-CG 3.49Å; V118-L122 PolarHBondContact O-N 2.99Å; N119-L122 PolarHBondContact O-N 3.29Å; L122-H124 PolarHBondContact O-N 3Å; L122-G125 PolarHBondContact O-N 3.23Å; L122-V128 HydrophobicContact CD2-CG2 3.78Å; L122-L153 HydrophobicContact CD1-CD2 4.43Å; L122-L153 HydrophobicContact CD2-CD2 4.45Å; L122-Y156 HydrophobicContact CB-CD1 3.77Å; L122-Y156 HydrophobicContact CB-CD2 4.05Å; L122-Y156 HydrophobicContact CB-CE1 3.75Å; L122-Y156 HydrophobicContact CB-CE2 4.03Å; L122-Y156 HydrophobicContact CB-CG 3.91Å; L122-Y156 HydrophobicContact CD1-CD2 3.69Å; L122-Y156 HydrophobicContact CD1-CE2 4.14Å; L122-Y156 HydrophobicContact CD1-CG 3.97Å; L122-Y156 HydrophobicContact CD2-CD1 4.48Å; L122-Y156 HydrophobicContact CD2-CG 4.2Å; L122-Y156 HydrophobicContact CG-CD2 4.37Å; L122-Y156 HydrophobicContact CG-CG 4.25Å
123	Q	98.2	Very high	96	Very high	128 Å²	128	47.6 Å²	47.6	60%	0.598	26%	0.259	S	S	*	.	H	α-helix	trans	-61.7	-28.6	172.7	-73.6	171.5	2.9	0	0	113	N119 L120 L121 G125 Y156	N119-Q123 WeakPolarHBondContact O-CB 3.46Å; N119-Q123 VanDerWaalsContact O-CG 3.25Å; N119-Q123 WeakPolarHBondContact O-CG 3.31Å; N119-Q123 PolarHBondContact O-N 3.46Å; L120-Q123 PolarHBondContact O-N 2.94Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; L121-Q123 PolarHBondContact O-N 2.98Å; Q123-G125 VanDerWaalsContact C-N 3.31Å; Q123-Y156 WeakPolarHBondContact CG-OH 3.49Å
124	H	98.3	Very high	95.7	Very high	96 Å²	96	51.7 Å²	51.7	44%	0.444	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	15.6	175.8	-71	72.3	0	0	0	113.1	V95 L120 L121 L122	V95-H124 HydrophobicContact CG2-CB 3.87Å; L120-H124 PolarHBondContact O-N 3.17Å; L120-H124 PolarHBondContact O-ND1 2.96Å; L121-H124 CarbonylContact O-C 3.45Å; L121-H124 WeakPolarHBondContact O-CA 3.36Å; L121-H124 PolarHBondContact O-N 3.01Å; L122-H124 PolarHBondContact O-N 3Å
125	G	97.1	Very high	95.5	Very high	49 Å²	49	50.6 Å²	50.6	51%	0.505	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	30.3	174.5	0	0	0	0	0	114.3	N96 L121 L122 Q123 S127	N96-G125 PolarHBondContact ND2-O 3.38Å; L121-G125 PolarHBondContact O-N 3.16Å; L122-G125 PolarHBondContact O-N 3.23Å; Q123-G125 VanDerWaalsContact C-N 3.31Å; G125-S127 PolarHBondContact O-N 3.5Å
126	A	97.9	Very high	95.4	Very high	7 Å²	7	45.5 Å²	45.5	6%	0.058	25%	0.248	C	C	.	.			trans	-57.7	132.5	166.6	0	0	0	0	0	110.6	V95 N96 L106 L121 V128	V95-A126 HydrophobicContact CG1-CB 3.56Å; N96-A126 WeakPolarHBondContact OD1-CA 3.46Å; L106-A126 HydrophobicContact CB-CB 4.16Å; L106-A126 HydrophobicContact CD2-CB 4.07Å; L106-A126 HydrophobicContact CG-CB 4.49Å; L121-A126 HydrophobicContact CB-CB 3.95Å; L121-A126 VanDerWaalsContact O-CB 3.27Å; L121-A126 WeakPolarHBondContact O-CB 3.38Å; L121-A126 PolarHBondContact O-N 3.16Å; A126-V128 PolarHBondContact O-N 3.16Å
127	S	96.9	Very high	95.4	Very high	60 Å²	60	41.8 Å²	41.8	42%	0.42	23%	0.228	S	C	.	.			trans	-66.6	119.4	175.4	-174.2	0	0	0	0	109.8	N96 L106 G125 Q129	N96-S127 PolarHBondContact OD1-N 3.14Å; L106-S127 VanDerWaalsContact CD2-O 3.32Å; L106-S127 WeakPolarHBondContact CD2-O 3.41Å; G125-S127 PolarHBondContact O-N 3.5Å; S127-Q129 PolarHBondContact O-N 3.02Å; S127-Q129 PolarHBondContact OG-O 2.94Å
128	V	96.4	Very high	95.4	Very high	23 Å²	23	41.9 Å²	41.9	14%	0.139	23%	0.228	C	C	.	.	S	Bend	trans	-64.7	-30.9	-178.5	-169.6	0	0	0	0	111.8	L122 A126 L153 G158	L122-V128 HydrophobicContact CD2-CG2 3.78Å; A126-V128 PolarHBondContact O-N 3.16Å; V128-L153 HydrophobicContact CG1-CB 4.29Å; V128-L153 HydrophobicContact CG1-CD2 3.99Å; V128-L153 WeakPolarHBondContact CG1-O 3.31Å; V128-G158 VanDerWaalsContact CG1-CA 3.44Å
129	Q	92.8	Very high	95.3	Very high	58 Å²	58	42 Å²	42	27%	0.271	23%	0.229	S	C	.	.	S	Bend	trans	-124.2	96.5	-179.8	-167.7	70.7	52.6	0	0	109.1	S127 H162	S127-Q129 PolarHBondContact O-N 3.02Å; S127-Q129 PolarHBondContact OG-O 2.94Å; Q129-H162 PolarHBondContact NE2-CD2 3.47Å; Q129-H162 PolarHBondContact NE2-NE2 2.91Å
130	P	87.1	Confident	95.3	Very high	17 Å²	17	41.8 Å²	41.8	11%	0.11	23%	0.227	C	C	.	.			trans	-61.4	160.4	171.4	-22.6	35	0	0	0	111.9	T104 S132 P137	T104-P130 HydrophobicContact CG2-CB 4.24Å; T104-P130 HydrophobicContact CG2-CG 4.14Å; P130-S132 VanDerWaalsContact C-N 3.3Å; P130-S132 PolarHBondContact O-N 3.23Å; P130-P137 HydrophobicContact CG-CG 3.9Å
131	E	87.1	Confident	95.3	Very high	187 Å²	187	40.8 Å²	40.8	87%	0.874	22%	0.222	S	C	*	.	S	Bend	trans	-68.3	-27.3	-176.9	-64	-179.3	172.1	0	0	113.3
132	S	90.3	Very high	95.3	Very high	17 Å²	17	40.8 Å²	40.8	12%	0.119	22%	0.222	C	C	.	.			trans	-93.5	126.7	-176	-175.5	0	0	0	0	112.3	P130 L134 A135	P130-S132 VanDerWaalsContact C-N 3.3Å; P130-S132 PolarHBondContact O-N 3.23Å; S132-L134 PolarHBondContact O-N 3.21Å; S132-L134 VanDerWaalsContact O-N 3.17Å; S132-L134 WeakPolarHBondContact OG-CB 3.36Å; S132-L134 PolarHBondContact OG-N 3Å; S132-A135 PolarHBondContact O-N 3.01Å
133	D	88.8	Confident	95.3	Very high	68 Å²	68	44.1 Å²	44.1	36%	0.364	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-62.4	-15.4	170.1	-81.1	-2.8	0	0	0	113	A135 H162 I164	D133-A135 VanDerWaalsContact C-N 3.35Å; D133-H162 IonicContact OD1-NE2 2.67Å; D133-I164 HydrophobicContact CB-CD1 4.38Å; D133-I164 HydrophobicContact CB-CG1 4.37Å; D133-I164 HydrophobicContact CB-CG2 3.79Å
134	L	91.2	Very high	95.3	Very high	112 Å²	112	43.6 Å²	43.6	59%	0.586	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-76	-22.8	179.8	-60.3	175.1	0	0	0	112.8	S132	S132-L134 PolarHBondContact O-N 3.21Å; S132-L134 VanDerWaalsContact O-N 3.17Å; S132-L134 WeakPolarHBondContact OG-CB 3.36Å; S132-L134 PolarHBondContact OG-N 3Å
135	A	93.7	Very high	95.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-133.7	49.1	-170.6	0	0	0	0	0	112.5	W102 F107 S132 D133 P137	W102-A135 HydrophobicContact CB-CB 4.18Å; W102-A135 VanDerWaalsContact O-CB 3.23Å; W102-A135 WeakPolarHBondContact O-CB 3.49Å; F107-A135 HydrophobicContact CD1-CB 4.47Å; F107-A135 HydrophobicContact CD2-CB 3.89Å; F107-A135 VanDerWaalsContact CD2-O 3.26Å; F107-A135 WeakPolarHBondContact CD2-O 3.49Å; F107-A135 HydrophobicContact CE2-CB 4.05Å; F107-A135 HydrophobicContact CG-CB 4.1Å; F107-A135 HydrophobicContact CZ-CB 4.42Å; S132-A135 PolarHBondContact O-N 3.01Å; D133-A135 VanDerWaalsContact C-N 3.35Å; A135-P137 VanDerWaalsContact O-CD 3.29Å; A135-P137 WeakPolarHBondContact O-CD 3.35Å
136	S	97.1	Very high	95.4	Very high	3 Å²	3	40 Å²	40	2%	0.021	20%	0.201	C	C	.	.			trans	-76.1	116.1	178	-179.3	0	0	0	0	111.8	I138 H139 E140	S136-I138 VanDerWaalsContact C-N 3.34Å; S136-I138 PolarHBondContact O-N 2.99Å; S136-H139 WeakPolarHBondContact CB-ND1 3.41Å; S136-H139 PolarHBondContact O-N 3.26Å; S136-H139 PolarHBondContact OG-ND1 2.99Å; S136-E140 PolarHBondContact O-N 3.24Å; S136-E140 VanDerWaalsContact O-N 3.15Å
137	P	98.1	Very high	95.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-39.7	-175.7	-25.2	34.9	0	0	0	113.5	L106 F107 C110 P130 A135 E140 A141 L153	L106-P137 HydrophobicContact CD2-CB 4.43Å; L106-P137 HydrophobicContact CD2-CG 4.17Å; L106-P137 HydrophobicContact CG-CB 4.2Å; L106-P137 HydrophobicContact CG-CG 4.17Å; F107-P137 HydrophobicContact CB-CG 4.39Å; C110-P137 HydrophobicContact CB-CB 4.41Å; P130-P137 HydrophobicContact CG-CG 3.9Å; A135-P137 VanDerWaalsContact O-CD 3.29Å; A135-P137 WeakPolarHBondContact O-CD 3.35Å; P137-E140 PolarHBondContact O-N 2.86Å; P137-A141 WeakPolarHBondContact O-CB 3.45Å; P137-A141 PolarHBondContact O-N 3.11Å; P137-L153 HydrophobicContact CB-CD1 4.07Å; P137-L153 HydrophobicContact CB-CD2 4.14Å
138	I	98.3	Very high	95.5	Very high	2 Å²	2	43 Å²	43	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-35.3	-178.8	-167.3	170	0	0	0	112.2	S136 A142 V150 L153 I154 P170	S136-I138 VanDerWaalsContact C-N 3.34Å; S136-I138 PolarHBondContact O-N 2.99Å; I138-A142 WeakPolarHBondContact O-CB 3.24Å; I138-A142 PolarHBondContact O-N 3.37Å; I138-V150 HydrophobicContact CG1-CG1 4.5Å; I138-L153 HydrophobicContact CB-CD1 3.92Å; I138-L153 HydrophobicContact CG1-CD1 4.37Å; I138-I154 HydrophobicContact CD1-CG1 3.93Å; I138-P170 HydrophobicContact CD1-CG 4.17Å; I138-P170 HydrophobicContact CG1-CB 4.21Å; I138-P170 HydrophobicContact CG1-CG 3.97Å; I138-P170 HydrophobicContact CG2-CG 3.91Å
139	H	98.5	Very high	95.6	Very high	4 Å²	4	42 Å²	42	2%	0.019	20%	0.203	C	C	.	.	H	α-helix	trans	-67.7	-43.8	175.4	-76.4	85.9	0	0	0	111.5	S136 A142 R143 H162 I164 G168 L173	S136-H139 WeakPolarHBondContact CB-ND1 3.41Å; S136-H139 PolarHBondContact O-N 3.26Å; S136-H139 PolarHBondContact OG-ND1 2.99Å; H139-A142 PolarHBondContact O-N 3.09Å; H139-R143 VanDerWaalsContact O-CB 3.31Å; H139-R143 WeakPolarHBondContact O-CB 3.46Å; H139-R143 PolarHBondContact O-N 3.38Å; H139-H162 AromaticContact CE1-CD2 3.59Å; H139-H162 PolarHBondContact CE1-O 2.84Å; H139-H162 PolarHBondContact NE2-O 3.19Å; H139-I164 VanDerWaalsContact CE1-CD1 3.5Å; H139-I164 WeakPolarHBondContact CE1-CD1 3.09Å; H139-G168 PolarHBondContact NE2-O 3.07Å; H139-L173 HydrophobicContact CB-CD1 3.78Å
140	E	98.4	Very high	95.9	Very high	18 Å²	18	39.2 Å²	39.2	8%	0.084	19%	0.191	C	C	.	.	H	α-helix	trans	-68.2	-43.3	-179.7	-169.9	61.9	-167.3	0	0	111.6	F107 V111 S136 P137 A142 R143 R144	F107-E140 HydrophobicContact CD2-CB 4.29Å; F107-E140 HydrophobicContact CE2-CB 3.7Å; F107-E140 HydrophobicContact CE2-CG 3.93Å; F107-E140 HydrophobicContact CZ-CB 4.31Å; F107-E140 HydrophobicContact CZ-CG 4.04Å; V111-E140 HydrophobicContact CG2-CG 3.7Å; S136-E140 PolarHBondContact O-N 3.24Å; S136-E140 VanDerWaalsContact O-N 3.15Å; P137-E140 PolarHBondContact O-N 2.86Å; E140-A142 VanDerWaalsContact C-N 3.33Å; E140-A142 PolarHBondContact O-N 3.44Å; E140-R143 IonicContact OE2-NH1 2.67Å; E140-R143 PolarHBondContact OE2-NH1 2.95Å; E140-R144 WeakPolarHBondContact O-CB 3.3Å; E140-R144 WeakPolarHBondContact O-CG 3.15Å; E140-R144 PolarHBondContact O-N 2.82Å; E140-R144 VanDerWaalsContact O-N 3.13Å; E140-R144 IonicContact OE1-CZ 3.39Å; E140-R144 VanDerWaalsContact OE1-CZ 3.22Å; E140-R144 IonicContact OE1-NE 3.26Å; E140-R144 PolarHBondContact OE1-NE 3.16Å; E140-R144 IonicContact OE1-NH2 3.51Å; E140-R144 PolarHBondContact OE1-NH2 2.96Å
141	A	98.6	Very high	96.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-41.4	173.3	0	0	0	0	0	111.9	C110 P137 G145 H146 C149 V150 L153	C110-A141 HydrophobicContact CB-CB 4.13Å; P137-A141 WeakPolarHBondContact O-CB 3.45Å; P137-A141 PolarHBondContact O-N 3.11Å; A141-G145 PolarHBondContact O-N 2.99Å; A141-G145 VanDerWaalsContact O-N 3.1Å; A141-H146 HydrophobicContact CB-CB 4.29Å; A141-H146 PolarHBondContact O-N 3.25Å; A141-C149 HydrophobicContact CB-CB 3.99Å; A141-V150 HydrophobicContact CB-CG2 3.64Å; A141-L153 HydrophobicContact CB-CD1 4.33Å
142	A	98.7	Very high	97	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-69	-44.4	179.7	0	0	0	0	0	112.9	I138 H139 E140 R144 G145 V150 P170 A174 L186	I138-A142 WeakPolarHBondContact O-CB 3.24Å; I138-A142 PolarHBondContact O-N 3.37Å; H139-A142 PolarHBondContact O-N 3.09Å; E140-A142 VanDerWaalsContact C-N 3.33Å; E140-A142 PolarHBondContact O-N 3.44Å; A142-R144 VanDerWaalsContact C-N 3.28Å; A142-R144 PolarHBondContact O-N 2.75Å; A142-G145 PolarHBondContact O-N 3.23Å; A142-G145 VanDerWaalsContact O-N 3.14Å; A142-V150 HydrophobicContact CB-CG2 4.13Å; A142-P170 HydrophobicContact CB-CB 3.83Å; A142-P170 WeakPolarHBondContact CB-O 3.36Å; A142-A174 HydrophobicContact CB-CB 4.46Å; A142-L186 HydrophobicContact CB-CD1 4.49Å
143	R	98.1	Very high	97.3	Very high	78 Å²	78	30.3 Å²	30.3	29%	0.294	15%	0.147	S	C	.	.	H	α-helix	trans	-57.2	-41.1	175.6	179	-174	-72	158.6	-8.3	112.1	H139 E140 G145 L173 N177 Q179	H139-R143 VanDerWaalsContact O-CB 3.31Å; H139-R143 WeakPolarHBondContact O-CB 3.46Å; H139-R143 PolarHBondContact O-N 3.38Å; E140-R143 IonicContact OE2-NH1 2.67Å; E140-R143 PolarHBondContact OE2-NH1 2.95Å; R143-G145 VanDerWaalsContact C-N 3.35Å; R143-L173 HydrophobicContact CB-CB 4.25Å; R143-L173 HydrophobicContact CB-CD1 4.37Å; R143-N177 HydrophobicContact CG-CB 4.39Å; R143-N177 WeakPolarHBondContact O-CB 3.35Å; R143-Q179 VanDerWaalsContact O-CG 3.27Å; R143-Q179 WeakPolarHBondContact O-CG 3.42Å; R143-Q179 PolarHBondContact O-NE2 3.41Å; R143-Q179 VanDerWaalsContact O-NE2 3.07Å
144	R	98.5	Very high	97.8	Very high	116 Å²	116	27.5 Å²	27.5	44%	0.438	13%	0.132	S	C	.	.	H	α-helix	trans	-83.2	-8.1	180	-67.3	-177.4	-178.5	-91.4	-8.6	114.2	E140 A142	E140-R144 WeakPolarHBondContact O-CB 3.3Å; E140-R144 WeakPolarHBondContact O-CG 3.15Å; E140-R144 PolarHBondContact O-N 2.82Å; E140-R144 VanDerWaalsContact O-N 3.13Å; E140-R144 IonicContact OE1-CZ 3.39Å; E140-R144 VanDerWaalsContact OE1-CZ 3.22Å; E140-R144 IonicContact OE1-NE 3.26Å; E140-R144 PolarHBondContact OE1-NE 3.16Å; E140-R144 IonicContact OE1-NH2 3.51Å; E140-R144 PolarHBondContact OE1-NH2 2.96Å; A142-R144 VanDerWaalsContact C-N 3.28Å; A142-R144 PolarHBondContact O-N 2.75Å
145	G	98.3	Very high	98.1	Very high	18 Å²	18	25.3 Å²	25.3	19%	0.186	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	22.2	-178.6	0	0	0	0	0	114.4	A141 A142 R143 V147	A141-G145 PolarHBondContact O-N 2.99Å; A141-G145 VanDerWaalsContact O-N 3.1Å; A142-G145 PolarHBondContact O-N 3.23Å; A142-G145 VanDerWaalsContact O-N 3.14Å; R143-G145 VanDerWaalsContact C-N 3.35Å; G145-V147 WeakPolarHBondContact O-CG2 3.38Å; G145-V147 PolarHBondContact O-N 3.3Å
146	H	98.7	Very high	98.3	Very high	51 Å²	51	30.2 Å²	30.2	24%	0.236	15%	0.15	C	C	.	.			trans	-77	71.7	177.3	-61.3	159.6	0	0	0	110.9	C110 V111 G113 A141 E148 C149 V150	C110-H146 PolarHBondContact O-CE1 2.98Å; C110-H146 PolarHBondContact O-ND1 3.35Å; V111-H146 PolarHBondContact O-CE1 3.42Å; G113-H146 WeakPolarHBondContact CA-CE1 3.41Å; G113-H146 WeakPolarHBondContact CA-ND1 3.06Å; G113-H146 PolarHBondContact N-CE1 3.41Å; A141-H146 HydrophobicContact CB-CB 4.29Å; A141-H146 PolarHBondContact O-N 3.25Å; H146-E148 VanDerWaalsContact C-N 3.31Å; H146-E148 PolarHBondContact O-N 3.17Å; H146-C149 HydrophobicContact CB-CB 3.98Å; H146-C149 WeakPolarHBondContact O-CB 3.23Å; H146-C149 PolarHBondContact O-N 2.88Å; H146-V150 PolarHBondContact O-N 3.32Å
147	V	98.6	Very high	98.2	Very high	24 Å²	24	33.3 Å²	33.3	15%	0.145	18%	0.182	C	C	.	.	H	α-helix	trans	-51.8	-45.6	-171.5	-174.7	0	0	0	0	112.8	G145 C149 V150 N151 A181 C182 K185	G145-V147 WeakPolarHBondContact O-CG2 3.38Å; G145-V147 PolarHBondContact O-N 3.3Å; V147-C149 VanDerWaalsContact C-N 3.34Å; V147-C149 PolarHBondContact O-N 2.9Å; V147-V150 PolarHBondContact O-N 3.25Å; V147-N151 VanDerWaalsContact O-CG 3.23Å; V147-N151 PolarHBondContact O-N 3.35Å; V147-N151 PolarHBondContact O-ND2 3.34Å; V147-A181 HydrophobicContact CG2-CB 3.72Å; V147-C182 HydrophobicContact CG2-CB 4.15Å; V147-K185 HydrophobicContact CG1-CB 3.65Å; V147-K185 HydrophobicContact CG1-CD 4.29Å; V147-K185 HydrophobicContact CG1-CG 3.63Å
148	E	98.5	Very high	98.1	Very high	106 Å²	106	33.8 Å²	33.8	50%	0.495	19%	0.186	S	C	.	.	H	α-helix	trans	-69.9	-32.3	-178.5	-58.2	-50	144.6	0	0	112.7	W115 H146 N151 S152	W115-E148 HydrophobicContact CB-CB 4.19Å; W115-E148 VanDerWaalsContact CD1-CB 3.48Å; W115-E148 HydrophobicContact CG-CB 3.89Å; H146-E148 VanDerWaalsContact C-N 3.31Å; H146-E148 PolarHBondContact O-N 3.17Å; E148-N151 PolarHBondContact O-N 2.88Å; E148-N151 PolarHBondContact OE2-ND2 3.2Å; E148-N151 VanDerWaalsContact OE2-ND2 3.11Å; E148-S152 PolarHBondContact O-N 3.04Å; E148-S152 PolarHBondContact O-OG 3.4Å
149	C	98.7	Very high	98.1	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.014	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-44.8	172.9	-63.7	0	0	0	0	110.6	V118 A141 H146 V147 N151 S152 L153	V118-C149 HydrophobicContact CG2-CB 4.23Å; A141-C149 HydrophobicContact CB-CB 3.99Å; H146-C149 HydrophobicContact CB-CB 3.98Å; H146-C149 WeakPolarHBondContact O-CB 3.23Å; H146-C149 PolarHBondContact O-N 2.88Å; V147-C149 VanDerWaalsContact C-N 3.34Å; V147-C149 PolarHBondContact O-N 2.9Å; C149-N151 VanDerWaalsContact C-N 3.32Å; C149-N151 PolarHBondContact O-N 2.94Å; C149-S152 PolarHBondContact O-N 2.93Å; C149-L153 VanDerWaalsContact O-CG 3.28Å; C149-L153 WeakPolarHBondContact O-CG 3.31Å; C149-L153 PolarHBondContact O-N 3.16Å
150	V	98.7	Very high	98	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-58	-45.3	174.6	172.5	0	0	0	0	110.9	I138 A141 A142 H146 V147 S152 L153 I154 L186	I138-V150 HydrophobicContact CG1-CG1 4.5Å; A141-V150 HydrophobicContact CB-CG2 3.64Å; A142-V150 HydrophobicContact CB-CG2 4.13Å; H146-V150 PolarHBondContact O-N 3.32Å; V147-V150 PolarHBondContact O-N 3.25Å; V150-S152 PolarHBondContact O-N 3.46Å; V150-L153 PolarHBondContact O-N 3.33Å; V150-I154 HydrophobicContact CG1-CD1 3.68Å; V150-I154 HydrophobicContact CG1-CG1 4.47Å; V150-I154 WeakPolarHBondContact O-CD1 3.49Å; V150-I154 VanDerWaalsContact O-CG1 3.29Å; V150-I154 WeakPolarHBondContact O-CG1 3.41Å; V150-I154 PolarHBondContact O-N 3.03Å; V150-L186 HydrophobicContact CG1-CD2 3.66Å; V150-L186 HydrophobicContact CG1-CG 4.26Å
151	N	98.1	Very high	98	Very high	21 Å²	21	39.1 Å²	39.1	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-47.4	177.4	-72.5	-24.1	0	0	0	112.6	V147 E148 C149 I154 A155 K185 Q273	V147-N151 VanDerWaalsContact O-CG 3.23Å; V147-N151 PolarHBondContact O-N 3.35Å; V147-N151 PolarHBondContact O-ND2 3.34Å; E148-N151 PolarHBondContact O-N 2.88Å; E148-N151 PolarHBondContact OE2-ND2 3.2Å; E148-N151 VanDerWaalsContact OE2-ND2 3.11Å; C149-N151 VanDerWaalsContact C-N 3.32Å; C149-N151 PolarHBondContact O-N 2.94Å; N151-I154 PolarHBondContact O-N 3.36Å; N151-A155 WeakPolarHBondContact O-CB 3.36Å; N151-A155 PolarHBondContact O-N 2.97Å; N151-K185 VanDerWaalsContact CG-CE 3.44Å; N151-K185 WeakPolarHBondContact ND2-CE 3.41Å; N151-K185 WeakPolarHBondContact OD1-CD 3.46Å; N151-K185 WeakPolarHBondContact OD1-CE 3.16Å; N151-K185 WeakPolarHBondContact OD1-CG 3.36Å; N151-Q273 PolarHBondContact O-NE2 3.32Å
152	S	98.3	Very high	97.9	Very high	12 Å²	12	40.7 Å²	40.7	8%	0.084	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-45	178.3	-69.9	0	0	0	0	111.8	W115 N119 E148 C149 V150 I154 A155 Y156	W115-S152 PolarHBondContact NE1-OG 3.39Å; N119-S152 WeakPolarHBondContact OD1-CB 3.46Å; N119-S152 PolarHBondContact OD1-OG 2.87Å; E148-S152 PolarHBondContact O-N 3.04Å; E148-S152 PolarHBondContact O-OG 3.4Å; C149-S152 PolarHBondContact O-N 2.93Å; V150-S152 PolarHBondContact O-N 3.46Å; S152-I154 VanDerWaalsContact C-N 3.31Å; S152-I154 PolarHBondContact O-N 3.43Å; S152-A155 PolarHBondContact O-N 3.48Å; S152-A155 VanDerWaalsContact O-N 3.15Å; S152-Y156 VanDerWaalsContact O-CD2 3.31Å; S152-Y156 WeakPolarHBondContact O-CD2 3.29Å; S152-Y156 PolarHBondContact O-N 3.07Å
153	L	98.4	Very high	97.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.8	-43.6	177.9	-68.4	167.6	0	0	0	111.6	L106 L122 V128 P137 I138 A141 C149 V150 Y156 G158	L106-L153 HydrophobicContact CD1-CD2 4.23Å; L106-L153 HydrophobicContact CD2-CD2 3.89Å; L106-L153 HydrophobicContact CG-CD2 4.25Å; L122-L153 HydrophobicContact CD1-CD2 4.43Å; L122-L153 HydrophobicContact CD2-CD2 4.45Å; V128-L153 HydrophobicContact CG1-CB 4.29Å; V128-L153 HydrophobicContact CG1-CD2 3.99Å; V128-L153 WeakPolarHBondContact CG1-O 3.31Å; P137-L153 HydrophobicContact CB-CD1 4.07Å; P137-L153 HydrophobicContact CB-CD2 4.14Å; I138-L153 HydrophobicContact CB-CD1 3.92Å; I138-L153 HydrophobicContact CG1-CD1 4.37Å; A141-L153 HydrophobicContact CB-CD1 4.33Å; C149-L153 VanDerWaalsContact O-CG 3.28Å; C149-L153 WeakPolarHBondContact O-CG 3.31Å; C149-L153 PolarHBondContact O-N 3.16Å; V150-L153 PolarHBondContact O-N 3.33Å; L153-Y156 PolarHBondContact O-N 3.25Å; L153-G158 WeakPolarHBondContact O-CA 3.44Å; L153-G158 PolarHBondContact O-N 3.28Å
154	I	98	Very high	97.8	Very high	10 Å²	10	40.9 Å²	40.9	5%	0.051	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-43.5	176.1	-62.6	160.6	0	0	0	110.8	I138 V150 N151 S152 Y156 G157 I160 L186 I272 Q273	I138-I154 HydrophobicContact CD1-CG1 3.93Å; V150-I154 HydrophobicContact CG1-CD1 3.68Å; V150-I154 HydrophobicContact CG1-CG1 4.47Å; V150-I154 WeakPolarHBondContact O-CD1 3.49Å; V150-I154 VanDerWaalsContact O-CG1 3.29Å; V150-I154 WeakPolarHBondContact O-CG1 3.41Å; V150-I154 PolarHBondContact O-N 3.03Å; N151-I154 PolarHBondContact O-N 3.36Å; S152-I154 VanDerWaalsContact C-N 3.31Å; S152-I154 PolarHBondContact O-N 3.43Å; I154-Y156 PolarHBondContact O-N 2.74Å; I154-G157 PolarHBondContact O-N 3Å; I154-I160 HydrophobicContact CD1-CB 4.45Å; I154-I160 HydrophobicContact CD1-CD1 3.7Å; I154-I160 HydrophobicContact CD1-CG1 3.87Å; I154-I160 HydrophobicContact CG1-CB 4.27Å; I154-I160 HydrophobicContact CG1-CD1 4.38Å; I154-I160 HydrophobicContact CG1-CG1 4.22Å; I154-L186 HydrophobicContact CD1-CD2 4.09Å; I154-I272 HydrophobicContact CG2-CG2 3.56Å; I154-Q273 HydrophobicContact CG2-CG 3.85Å
155	A	97.7	Very high	97.6	Very high	65 Å²	65	40.4 Å²	40.4	54%	0.537	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-29.4	-179.2	0	0	0	0	0	113.1	N151 S152 G157	N151-A155 WeakPolarHBondContact O-CB 3.36Å; N151-A155 PolarHBondContact O-N 2.97Å; S152-A155 PolarHBondContact O-N 3.48Å; S152-A155 VanDerWaalsContact O-N 3.15Å; A155-G157 VanDerWaalsContact C-N 3.28Å
156	Y	97.8	Very high	97.3	Very high	104 Å²	104	43.8 Å²	43.8	41%	0.408	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	13.3	174.4	-79.9	-101.3	0	0	0	113.5	L122 Q123 S152 L153 I154	L122-Y156 HydrophobicContact CB-CD1 3.77Å; L122-Y156 HydrophobicContact CB-CD2 4.05Å; L122-Y156 HydrophobicContact CB-CE1 3.75Å; L122-Y156 HydrophobicContact CB-CE2 4.03Å; L122-Y156 HydrophobicContact CB-CG 3.91Å; L122-Y156 HydrophobicContact CD1-CD2 3.69Å; L122-Y156 HydrophobicContact CD1-CE2 4.14Å; L122-Y156 HydrophobicContact CD1-CG 3.97Å; L122-Y156 HydrophobicContact CD2-CD1 4.48Å; L122-Y156 HydrophobicContact CD2-CG 4.2Å; L122-Y156 HydrophobicContact CG-CD2 4.37Å; L122-Y156 HydrophobicContact CG-CG 4.25Å; Q123-Y156 WeakPolarHBondContact CG-OH 3.49Å; S152-Y156 VanDerWaalsContact O-CD2 3.31Å; S152-Y156 WeakPolarHBondContact O-CD2 3.29Å; S152-Y156 PolarHBondContact O-N 3.07Å; L153-Y156 PolarHBondContact O-N 3.25Å; I154-Y156 PolarHBondContact O-N 2.74Å
157	G	95.7	Very high	97.2	Very high	68 Å²	68	42.7 Å²	42.7	70%	0.701	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	93	14.2	173	0	0	0	0	0	115.1	I154 A155	I154-G157 PolarHBondContact O-N 3Å; A155-G157 VanDerWaalsContact C-N 3.28Å
158	G	95.9	Very high	97.2	Very high	9 Å²	9	41.6 Å²	41.6	9%	0.093	24%	0.24	C	C	.	.			trans	-61.2	137.2	172.4	0	0	0	0	0	111.6	V128 L153 I160	V128-G158 VanDerWaalsContact CG1-CA 3.44Å; L153-G158 WeakPolarHBondContact O-CA 3.44Å; L153-G158 PolarHBondContact O-N 3.28Å; G158-I160 PolarHBondContact O-N 2.9Å; G158-I160 VanDerWaalsContact O-N 3.11Å
159	N	97.3	Very high	97.2	Very high	84 Å²	84	36.6 Å²	36.6	45%	0.449	22%	0.217	S	C	.	.			trans	-73.7	105.7	177.4	177.2	13.1	0	0	0	110	D161 H162	N159-D161 PolarHBondContact O-N 2.98Å; N159-D161 PolarHBondContact OD1-N 3.15Å; N159-D161 VanDerWaalsContact OD1-N 3.08Å; N159-H162 HydrophobicContact CB-CB 4.02Å; N159-H162 WeakPolarHBondContact ND2-CA 3.46Å; N159-H162 PolarHBondContact ND2-N 3.28Å; N159-H162 VanDerWaalsContact O-CB 3.27Å; N159-H162 WeakPolarHBondContact O-CB 3.46Å; N159-H162 PolarHBondContact O-N 2.93Å; N159-H162 VanDerWaalsContact O-N 3.15Å; N159-H162 PolarHBondContact OD1-N 3.42Å
160	I	97.6	Very high	97.2	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.5	-179.9	-166.7	173.2	0	0	0	113.3	I154 G158 P170 L186 A191 I272	I154-I160 HydrophobicContact CD1-CB 4.45Å; I154-I160 HydrophobicContact CD1-CD1 3.7Å; I154-I160 HydrophobicContact CD1-CG1 3.87Å; I154-I160 HydrophobicContact CG1-CB 4.27Å; I154-I160 HydrophobicContact CG1-CD1 4.38Å; I154-I160 HydrophobicContact CG1-CG1 4.22Å; G158-I160 PolarHBondContact O-N 2.9Å; G158-I160 VanDerWaalsContact O-N 3.11Å; I160-P170 WeakPolarHBondContact O-CD 3.44Å; I160-P170 WeakPolarHBondContact O-CG 3.49Å; I160-L186 HydrophobicContact CD1-CD2 3.99Å; I160-L186 HydrophobicContact CG1-CD2 3.69Å; I160-A191 HydrophobicContact CD1-CB 3.72Å; I160-A191 HydrophobicContact CG1-CB 3.87Å; I160-I272 HydrophobicContact CB-CG2 4.49Å; I160-I272 HydrophobicContact CD1-CG2 4.3Å; I160-I272 HydrophobicContact CG2-CD1 3.7Å; I160-I272 HydrophobicContact CG2-CG1 3.92Å; I160-I272 HydrophobicContact CG2-CG2 4.12Å
161	D	98	Very high	97.2	Very high	48 Å²	48	36.5 Å²	36.5	26%	0.257	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	18.3	-178.8	-60.5	-43.1	0	0	0	112	N159 K163 A191 D192	N159-D161 PolarHBondContact O-N 2.98Å; N159-D161 PolarHBondContact OD1-N 3.15Å; N159-D161 VanDerWaalsContact OD1-N 3.08Å; D161-K163 PolarHBondContact O-N 3.41Å; D161-A191 WeakPolarHBondContact OD1-CA 3.35Å; D161-D192 PolarHBondContact OD1-N 3.03Å
162	H	97.4	Very high	97.2	Very high	34 Å²	34	36.2 Å²	36.2	16%	0.157	21%	0.214	C	C	.	.			trans	-58.1	116.9	178.6	179.3	51.4	0	0	0	110	Q129 D133 H139 N159 I164 P170	Q129-H162 PolarHBondContact NE2-CD2 3.47Å; Q129-H162 PolarHBondContact NE2-NE2 2.91Å; D133-H162 IonicContact OD1-NE2 2.67Å; H139-H162 AromaticContact CE1-CD2 3.59Å; H139-H162 PolarHBondContact CE1-O 2.84Å; H139-H162 PolarHBondContact NE2-O 3.19Å; N159-H162 HydrophobicContact CB-CB 4.02Å; N159-H162 WeakPolarHBondContact ND2-CA 3.46Å; N159-H162 PolarHBondContact ND2-N 3.28Å; N159-H162 VanDerWaalsContact O-CB 3.27Å; N159-H162 WeakPolarHBondContact O-CB 3.46Å; N159-H162 PolarHBondContact O-N 2.93Å; N159-H162 VanDerWaalsContact O-N 3.15Å; N159-H162 PolarHBondContact OD1-N 3.42Å; H162-I164 WeakPolarHBondContact NE2-CG1 3.33Å; H162-P170 WeakPolarHBondContact O-CD 3.37Å
163	K	97.1	Very high	97.2	Very high	82 Å²	82	35.8 Å²	35.8	36%	0.357	21%	0.21	S	C	.	.			trans	-106.2	110.2	-174.2	-173.6	174	-177.3	167.1	0	110	D161 G168 T169 Q195 G196 G198	D161-K163 PolarHBondContact O-N 3.41Å; K163-G168 WeakPolarHBondContact CA-O 3.29Å; K163-T169 HydrophobicContact CB-CG2 4.07Å; K163-T169 HydrophobicContact CG-CG2 4.26Å; K163-Q195 VanDerWaalsContact NZ-OE1 3.15Å; K163-G196 WeakPolarHBondContact CE-O 3.21Å; K163-G198 PolarHBondContact NZ-O 3.13Å
164	I	96.4	Very high	97.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-93.2	128.9	175.5	-66.6	172.9	0	0	0	108.8	D133 H139 H162 H166 L167 G168	D133-I164 HydrophobicContact CB-CD1 4.38Å; D133-I164 HydrophobicContact CB-CG1 4.37Å; D133-I164 HydrophobicContact CB-CG2 3.79Å; H139-I164 VanDerWaalsContact CE1-CD1 3.5Å; H139-I164 WeakPolarHBondContact CE1-CD1 3.09Å; H162-I164 WeakPolarHBondContact NE2-CG1 3.33Å; I164-H166 VanDerWaalsContact C-N 3.27Å; I164-H166 VanDerWaalsContact CG2-CE1 3.41Å; I164-H166 WeakPolarHBondContact CG2-CE1 3.48Å; I164-H166 WeakPolarHBondContact CG2-ND1 3.38Å; I164-H166 PolarHBondContact O-N 3.04Å; I164-H166 VanDerWaalsContact O-N 3.08Å; I164-L167 HydrophobicContact CB-CB 4.13Å; I164-L167 HydrophobicContact CB-CD1 4.44Å; I164-L167 HydrophobicContact CB-CG 4.49Å; I164-L167 HydrophobicContact CD1-CD1 4.19Å; I164-L167 HydrophobicContact CG2-CB 4.14Å; I164-L167 HydrophobicContact CG2-CD1 4.11Å; I164-L167 HydrophobicContact CG2-CG 4.03Å; I164-L167 PolarHBondContact O-N 3.21Å; I164-G168 PolarHBondContact N-O 3.2Å; I164-G168 PolarHBondContact O-N 2.66Å
165	S	94.2	Very high	97.2	Very high	106 Å²	106	35.3 Å²	35.3	74%	0.741	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-39.9	-168.5	-61.7	0	0	0	0	114.6
166	H	93.3	Very high	97.3	Very high	89 Å²	89	36.6 Å²	36.6	41%	0.412	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-11.2	-177	65.3	-82.4	0	0	0	114.1	I164 K197	I164-H166 VanDerWaalsContact C-N 3.27Å; I164-H166 VanDerWaalsContact CG2-CE1 3.41Å; I164-H166 WeakPolarHBondContact CG2-CE1 3.48Å; I164-H166 WeakPolarHBondContact CG2-ND1 3.38Å; I164-H166 PolarHBondContact O-N 3.04Å; I164-H166 VanDerWaalsContact O-N 3.08Å; H166-K197 WeakPolarHBondContact O-CE 2.93Å; H166-K197 PolarHBondContact O-NZ 3.17Å
167	L	95.9	Very high	97.3	Very high	28 Å²	28	34.8 Å²	34.8	15%	0.147	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-38	-177.7	-63.4	-179.6	0	0	0	113.3	I164 Y172 L173	I164-L167 HydrophobicContact CB-CB 4.13Å; I164-L167 HydrophobicContact CB-CD1 4.44Å; I164-L167 HydrophobicContact CB-CG 4.49Å; I164-L167 HydrophobicContact CD1-CD1 4.19Å; I164-L167 HydrophobicContact CG2-CB 4.14Å; I164-L167 HydrophobicContact CG2-CD1 4.11Å; I164-L167 HydrophobicContact CG2-CG 4.03Å; I164-L167 PolarHBondContact O-N 3.21Å; L167-Y172 VanDerWaalsContact O-CD1 3.27Å; L167-Y172 WeakPolarHBondContact O-CD1 3.35Å; L167-L173 HydrophobicContact CB-CD1 4.29Å; L167-L173 HydrophobicContact CB-CD2 4.37Å; L167-L173 HydrophobicContact CD1-CD1 4.47Å
168	G	97.7	Very high	97.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	96.2	-150.2	-166.1	0	0	0	0	0	111.8	H139 K163 I164 G196	H139-G168 PolarHBondContact NE2-O 3.07Å; K163-G168 WeakPolarHBondContact CA-O 3.29Å; I164-G168 PolarHBondContact N-O 3.2Å; I164-G168 PolarHBondContact O-N 2.66Å; G168-G196 WeakPolarHBondContact CA-O 2.88Å
169	T	98.5	Very high	97.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	19%	0.192	C	C	.	.			trans	-95.6	167.4	176	56.6	0	0	0	0	111.2	K163 L171 Y172 L173 Q195	K163-T169 HydrophobicContact CB-CG2 4.07Å; K163-T169 HydrophobicContact CG-CG2 4.26Å; T169-L171 PolarHBondContact O-N 3.17Å; T169-Y172 WeakPolarHBondContact O-CB 3.45Å; T169-Y172 PolarHBondContact O-N 2.91Å; T169-Y172 VanDerWaalsContact O-N 3.11Å; T169-Y172 WeakPolarHBondContact OG1-CB 3.37Å; T169-Y172 PolarHBondContact OG1-N 2.81Å; T169-Y172 VanDerWaalsContact OG1-N 3.13Å; T169-L173 PolarHBondContact O-N 2.67Å; T169-L173 VanDerWaalsContact O-N 3.12Å; T169-Q195 HydrophobicContact CG2-CB 3.84Å; T169-Q195 WeakPolarHBondContact CG2-O 3.28Å; T169-Q195 PolarHBondContact OG1-O 3.37Å
170	P	98.6	Very high	97.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-55.8	-39.1	170.3	-27.4	36.9	0	0	0	112.4	I138 A142 I160 H162 L173 A174 L186	I138-P170 HydrophobicContact CD1-CG 4.17Å; I138-P170 HydrophobicContact CG1-CB 4.21Å; I138-P170 HydrophobicContact CG1-CG 3.97Å; I138-P170 HydrophobicContact CG2-CG 3.91Å; A142-P170 HydrophobicContact CB-CB 3.83Å; A142-P170 WeakPolarHBondContact CB-O 3.36Å; I160-P170 WeakPolarHBondContact O-CD 3.44Å; I160-P170 WeakPolarHBondContact O-CG 3.49Å; H162-P170 WeakPolarHBondContact O-CD 3.37Å; P170-L173 PolarHBondContact O-N 3.22Å; P170-A174 WeakPolarHBondContact O-CB 3.37Å; P170-A174 PolarHBondContact O-N 3.08Å; P170-L186 HydrophobicContact CB-CD1 4.3Å; P170-L186 HydrophobicContact CB-CD2 4.43Å
171	L	98.8	Very high	97.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-43.7	175.6	179.4	62.7	0	0	0	111.7	T169 A174 C175 V183 L186 L187 A191 P202 L218	T169-L171 PolarHBondContact O-N 3.17Å; L171-A174 PolarHBondContact O-N 2.73Å; L171-C175 WeakPolarHBondContact O-CB 3.23Å; L171-C175 PolarHBondContact O-N 3.32Å; L171-C175 PolarHBondContact O-SG 3.46Å; L171-C175 VanDerWaalsContact O-SG 3.38Å; L171-V183 HydrophobicContact CD1-CB 4.4Å; L171-V183 HydrophobicContact CD1-CG1 3.9Å; L171-V183 HydrophobicContact CD1-CG2 4.46Å; L171-L186 HydrophobicContact CB-CD1 4.2Å; L171-L186 HydrophobicContact CD1-CB 4.23Å; L171-L186 HydrophobicContact CD1-CD1 4.34Å; L171-L187 HydrophobicContact CD1-CD2 4.18Å; L171-L187 HydrophobicContact CD1-CG 4.14Å; L171-L187 HydrophobicContact CD2-CD2 3.79Å; L171-A191 HydrophobicContact CD2-CB 4.48Å; L171-P202 HydrophobicContact CD2-CB 4.37Å; L171-P202 HydrophobicContact CD2-CG 3.95Å; L171-P202 HydrophobicContact CG-CB 4.31Å; L171-P202 HydrophobicContact CG-CG 4.13Å; L171-L218 HydrophobicContact CD2-CD2 4.49Å
172	Y	98.8	Very high	97.6	Very high	16 Å²	16	40.4 Å²	40.4	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-47.4	177.7	-174.4	-89.5	0	0	0	112.2	L167 T169 C175 E176 K197 D200 A205	L167-Y172 VanDerWaalsContact O-CD1 3.27Å; L167-Y172 WeakPolarHBondContact O-CD1 3.35Å; T169-Y172 WeakPolarHBondContact O-CB 3.45Å; T169-Y172 PolarHBondContact O-N 2.91Å; T169-Y172 VanDerWaalsContact O-N 3.11Å; T169-Y172 WeakPolarHBondContact OG1-CB 3.37Å; T169-Y172 PolarHBondContact OG1-N 2.81Å; T169-Y172 VanDerWaalsContact OG1-N 3.13Å; Y172-C175 WeakPolarHBondContact O-CB 3.46Å; Y172-C175 PolarHBondContact O-N 3Å; Y172-E176 PolarHBondContact O-N 3.25Å; Y172-K197 HydrophobicContact CD1-CB 3.92Å; Y172-K197 HydrophobicContact CD2-CB 4.11Å; Y172-K197 HydrophobicContact CE1-CB 3.68Å; Y172-K197 HydrophobicContact CE1-CD 4.05Å; Y172-K197 HydrophobicContact CE2-CB 3.83Å; Y172-K197 HydrophobicContact CG-CB 4.14Å; Y172-D200 HydrophobicContact CE2-CB 4.28Å; Y172-D200 WeakPolarHBondContact CE2-OD2 3.27Å; Y172-D200 PolarHBondContact OH-OD2 3.49Å; Y172-A205 HydrophobicContact CD2-CB 4.27Å; Y172-A205 HydrophobicContact CE2-CB 3.74Å
173	L	98.5	Very high	97.7	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-66	-39.1	178.1	-68.2	-174.3	0	0	0	112.4	H139 R143 L167 T169 P170 C175 E176 N177	H139-L173 HydrophobicContact CB-CD1 3.78Å; R143-L173 HydrophobicContact CB-CB 4.25Å; R143-L173 HydrophobicContact CB-CD1 4.37Å; L167-L173 HydrophobicContact CB-CD1 4.29Å; L167-L173 HydrophobicContact CB-CD2 4.37Å; L167-L173 HydrophobicContact CD1-CD1 4.47Å; T169-L173 PolarHBondContact O-N 2.67Å; T169-L173 VanDerWaalsContact O-N 3.12Å; P170-L173 PolarHBondContact O-N 3.22Å; L173-C175 VanDerWaalsContact C-N 3.28Å; L173-C175 PolarHBondContact O-N 2.68Å; L173-E176 PolarHBondContact O-N 3.42Å; L173-N177 WeakPolarHBondContact O-CB 3.27Å; L173-N177 PolarHBondContact O-N 3.15Å; L173-N177 PolarHBondContact O-ND2 3.45Å
174	A	98.7	Very high	97.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-39.7	174.3	0	0	0	0	0	111.4	A142 P170 L171 Q178 Q179 C182 V183 L186	A142-A174 HydrophobicContact CB-CB 4.46Å; P170-A174 WeakPolarHBondContact O-CB 3.37Å; P170-A174 PolarHBondContact O-N 3.08Å; L171-A174 PolarHBondContact O-N 2.73Å; A174-Q178 PolarHBondContact O-N 2.97Å; A174-Q178 VanDerWaalsContact O-N 3.16Å; A174-Q179 HydrophobicContact CB-CB 4.21Å; A174-Q179 PolarHBondContact O-N 3.48Å; A174-C182 HydrophobicContact CB-CB 4.22Å; A174-V183 HydrophobicContact CB-CG2 3.68Å; A174-L186 HydrophobicContact CB-CD1 4.19Å
175	C	98.6	Very high	97.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-49.3	173.6	-76.1	0	0	0	0	112.6	L171 Y172 L173 N177 Q178 V206	L171-C175 WeakPolarHBondContact O-CB 3.23Å; L171-C175 PolarHBondContact O-N 3.32Å; L171-C175 PolarHBondContact O-SG 3.46Å; L171-C175 VanDerWaalsContact O-SG 3.38Å; Y172-C175 WeakPolarHBondContact O-CB 3.46Å; Y172-C175 PolarHBondContact O-N 3Å; L173-C175 VanDerWaalsContact C-N 3.28Å; L173-C175 PolarHBondContact O-N 2.68Å; C175-N177 PolarHBondContact O-N 3.13Å; C175-Q178 PolarHBondContact O-N 2.87Å; C175-Q178 VanDerWaalsContact O-N 3.11Å; C175-Q178 PolarHBondContact O-NE2 2.95Å; C175-V206 HydrophobicContact CB-CG2 3.78Å
176	E	97.8	Very high	98	Very high	92 Å²	92	37.1 Å²	37.1	43%	0.43	18%	0.178	S	C	.	.	H	α-helix	trans	-58.4	-35.6	179.3	-172.5	178.4	-133	0	0	111.9	Y172 L173	Y172-E176 PolarHBondContact O-N 3.25Å; L173-E176 PolarHBondContact O-N 3.42Å
177	N	98.2	Very high	98.3	Very high	66 Å²	66	33 Å²	33	35%	0.353	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	13.5	-178.8	-65.8	-97.9	0	0	0	113.3	R143 L173 C175 Q179	R143-N177 HydrophobicContact CG-CB 4.39Å; R143-N177 WeakPolarHBondContact O-CB 3.35Å; L173-N177 WeakPolarHBondContact O-CB 3.27Å; L173-N177 PolarHBondContact O-N 3.15Å; L173-N177 PolarHBondContact O-ND2 3.45Å; C175-N177 PolarHBondContact O-N 3.13Å; N177-Q179 HydrophobicContact CB-CG 4.07Å; N177-Q179 PolarHBondContact O-N 3.36Å
178	Q	98.2	Very high	98.4	Very high	75 Å²	75	33.9 Å²	33.9	35%	0.35	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	29.7	175.1	-58.3	-63.6	-61.2	0	0	115.1	A174 C175 R180 T209 S211	A174-Q178 PolarHBondContact O-N 2.97Å; A174-Q178 VanDerWaalsContact O-N 3.16Å; C175-Q178 PolarHBondContact O-N 2.87Å; C175-Q178 VanDerWaalsContact O-N 3.11Å; C175-Q178 PolarHBondContact O-NE2 2.95Å; Q178-R180 VanDerWaalsContact C-N 3.29Å; Q178-R180 PolarHBondContact O-N 3.1Å; Q178-T209 PolarHBondContact NE2-OG1 2.98Å; Q178-S211 PolarHBondContact OE1-OG 3.14Å
179	Q	98.5	Very high	98.4	Very high	57 Å²	57	34 Å²	34	27%	0.266	16%	0.164	S	C	.	.			trans	-81.2	70.4	-176.8	-58.7	-62.7	-9.6	0	0	111.6	R143 A174 N177 A181 C182 V183	R143-Q179 VanDerWaalsContact O-CG 3.27Å; R143-Q179 WeakPolarHBondContact O-CG 3.42Å; R143-Q179 PolarHBondContact O-NE2 3.41Å; R143-Q179 VanDerWaalsContact O-NE2 3.07Å; A174-Q179 HydrophobicContact CB-CB 4.21Å; A174-Q179 PolarHBondContact O-N 3.48Å; N177-Q179 HydrophobicContact CB-CG 4.07Å; N177-Q179 PolarHBondContact O-N 3.36Å; Q179-A181 VanDerWaalsContact C-N 3.35Å; Q179-A181 PolarHBondContact O-N 3.21Å; Q179-C182 HydrophobicContact CB-CB 3.87Å; Q179-C182 WeakPolarHBondContact O-CA 3.19Å; Q179-C182 WeakPolarHBondContact O-CB 3.26Å; Q179-C182 PolarHBondContact O-N 2.97Å; Q179-V183 WeakPolarHBondContact O-CG2 3.41Å; Q179-V183 PolarHBondContact O-N 3.39Å
180	R	98	Very high	98.3	Very high	135 Å²	135	35.1 Å²	35.1	51%	0.509	18%	0.175	S	C	.	.	H	α-helix	trans	-48.2	-49.1	-173.7	177.9	-179.1	171	174.2	1.5	114.5	Q178 C182 V183 K184 E213 L214	Q178-R180 VanDerWaalsContact C-N 3.29Å; Q178-R180 PolarHBondContact O-N 3.1Å; R180-C182 VanDerWaalsContact C-N 3.28Å; R180-C182 PolarHBondContact O-N 2.93Å; R180-V183 PolarHBondContact O-N 3.21Å; R180-K184 PolarHBondContact O-N 2.95Å; R180-E213 WeakPolarHBondContact CD-OE2 3.43Å; R180-E213 IonicContact CZ-OE1 3.22Å; R180-E213 IonicContact CZ-OE2 2.68Å; R180-E213 IonicContact NE-OE2 2.73Å; R180-E213 IonicContact NH1-OE1 2.87Å; R180-E213 PolarHBondContact NH1-OE1 3.29Å; R180-E213 IonicContact NH1-OE2 3.96Å; R180-E213 PolarHBondContact NH1-OE2 3.05Å; R180-L214 HydrophobicContact CB-CD2 4Å; R180-L214 HydrophobicContact CG-CD2 4.2Å
181	A	98.3	Very high	98.3	Very high	64 Å²	64	35.6 Å²	35.6	53%	0.529	18%	0.179	S	C	.	.	H	α-helix	trans	-64.5	-36.3	-179	0	0	0	0	0	111.8	V147 Q179 K185	V147-A181 HydrophobicContact CG2-CB 3.72Å; Q179-A181 VanDerWaalsContact C-N 3.35Å; Q179-A181 PolarHBondContact O-N 3.21Å; A181-K185 WeakPolarHBondContact O-CB 3.46Å; A181-K185 PolarHBondContact O-N 3.18Å
182	C	98.4	Very high	98.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-71.4	-43.9	177.4	-165.6	0	0	0	0	111.9	V147 A174 Q179 R180 K184 K185 L186	V147-C182 HydrophobicContact CG2-CB 4.15Å; A174-C182 HydrophobicContact CB-CB 4.22Å; Q179-C182 HydrophobicContact CB-CB 3.87Å; Q179-C182 WeakPolarHBondContact O-CA 3.19Å; Q179-C182 WeakPolarHBondContact O-CB 3.26Å; Q179-C182 PolarHBondContact O-N 2.97Å; R180-C182 VanDerWaalsContact C-N 3.28Å; R180-C182 PolarHBondContact O-N 2.93Å; C182-K184 PolarHBondContact O-N 3.14Å; C182-K185 PolarHBondContact O-N 3.29Å; C182-L186 WeakPolarHBondContact O-CB 3.46Å; C182-L186 WeakPolarHBondContact O-CG 3.36Å; C182-L186 PolarHBondContact O-N 3.23Å
183	V	98.7	Very high	98.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-56	-51.1	173.5	174.4	0	0	0	0	110.3	L171 A174 Q179 R180 K185 L186 L187 L214 L217 L218	L171-V183 HydrophobicContact CD1-CB 4.4Å; L171-V183 HydrophobicContact CD1-CG1 3.9Å; L171-V183 HydrophobicContact CD1-CG2 4.46Å; A174-V183 HydrophobicContact CB-CG2 3.68Å; Q179-V183 WeakPolarHBondContact O-CG2 3.41Å; Q179-V183 PolarHBondContact O-N 3.39Å; R180-V183 PolarHBondContact O-N 3.21Å; V183-K185 VanDerWaalsContact C-N 3.3Å; V183-K185 PolarHBondContact O-N 3.04Å; V183-L186 PolarHBondContact O-N 3.02Å; V183-L187 HydrophobicContact CG1-CD1 3.84Å; V183-L187 VanDerWaalsContact O-CG 3.27Å; V183-L187 WeakPolarHBondContact O-CG 3.47Å; V183-L187 PolarHBondContact O-N 2.93Å; V183-L187 VanDerWaalsContact O-N 3.11Å; V183-L214 HydrophobicContact CB-CD2 4.21Å; V183-L214 HydrophobicContact CG1-CD2 4.29Å; V183-L214 HydrophobicContact CG2-CD2 4.23Å; V183-L217 HydrophobicContact CB-CD2 4.3Å; V183-L217 HydrophobicContact CG1-CD2 3.76Å; V183-L217 HydrophobicContact CG1-CG 4.47Å; V183-L218 HydrophobicContact CG1-CD2 4.45Å
184	K	98.5	Very high	98.3	Very high	89 Å²	89	41.3 Å²	41.3	39%	0.387	21%	0.211	S	C	.	.	H	α-helix	trans	-56.1	-47	177.8	-173.7	174.8	-177.1	-175.5	0	111	R180 C182 L187 E188 L217	R180-K184 PolarHBondContact O-N 2.95Å; C182-K184 PolarHBondContact O-N 3.14Å; K184-L187 PolarHBondContact O-N 2.83Å; K184-E188 WeakPolarHBondContact CE-OE1 3.41Å; K184-E188 HydrophobicContact CG-CG 4.42Å; K184-E188 IonicContact NZ-OE1 2.71Å; K184-E188 WeakPolarHBondContact O-CB 3.42Å; K184-E188 WeakPolarHBondContact O-CG 3.49Å; K184-E188 PolarHBondContact O-N 3.1Å; K184-L217 HydrophobicContact CB-CD2 3.9Å; K184-L217 HydrophobicContact CG-CD1 4.35Å
185	K	98.2	Very high	98.3	Very high	64 Å²	64	44.9 Å²	44.9	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-67.2	-39.6	-176.7	-171.5	68.6	-162.6	173.9	0	113.8	V147 N151 A181 C182 V183 S189	V147-K185 HydrophobicContact CG1-CB 3.65Å; V147-K185 HydrophobicContact CG1-CD 4.29Å; V147-K185 HydrophobicContact CG1-CG 3.63Å; N151-K185 VanDerWaalsContact CG-CE 3.44Å; N151-K185 WeakPolarHBondContact ND2-CE 3.41Å; N151-K185 WeakPolarHBondContact OD1-CD 3.46Å; N151-K185 WeakPolarHBondContact OD1-CE 3.16Å; N151-K185 WeakPolarHBondContact OD1-CG 3.36Å; A181-K185 WeakPolarHBondContact O-CB 3.46Å; A181-K185 PolarHBondContact O-N 3.18Å; C182-K185 PolarHBondContact O-N 3.29Å; V183-K185 VanDerWaalsContact C-N 3.3Å; V183-K185 PolarHBondContact O-N 3.04Å; K185-S189 VanDerWaalsContact O-CB 3.28Å; K185-S189 WeakPolarHBondContact O-CB 3.34Å; K185-S189 PolarHBondContact O-N 3.05Å; K185-S189 PolarHBondContact O-OG 3.37Å
186	L	98.6	Very high	98.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-46.3	175.9	-75.8	167.8	0	0	0	110.9	A142 V150 I154 I160 P170 L171 A174 C182 V183 S189 G190 A191	A142-L186 HydrophobicContact CB-CD1 4.49Å; V150-L186 HydrophobicContact CG1-CD2 3.66Å; V150-L186 HydrophobicContact CG1-CG 4.26Å; I154-L186 HydrophobicContact CD1-CD2 4.09Å; I160-L186 HydrophobicContact CD1-CD2 3.99Å; I160-L186 HydrophobicContact CG1-CD2 3.69Å; P170-L186 HydrophobicContact CB-CD1 4.3Å; P170-L186 HydrophobicContact CB-CD2 4.43Å; L171-L186 HydrophobicContact CB-CD1 4.2Å; L171-L186 HydrophobicContact CD1-CB 4.23Å; L171-L186 HydrophobicContact CD1-CD1 4.34Å; A174-L186 HydrophobicContact CB-CD1 4.19Å; C182-L186 WeakPolarHBondContact O-CB 3.46Å; C182-L186 WeakPolarHBondContact O-CG 3.36Å; C182-L186 PolarHBondContact O-N 3.23Å; V183-L186 PolarHBondContact O-N 3.02Å; L186-S189 WeakPolarHBondContact O-CB 3.46Å; L186-S189 PolarHBondContact O-N 3.29Å; L186-G190 PolarHBondContact O-N 3.11Å; L186-G190 VanDerWaalsContact O-N 3.1Å; L186-A191 HydrophobicContact CB-CB 4.07Å; L186-A191 VanDerWaalsContact O-CB 3.31Å; L186-A191 WeakPolarHBondContact O-CB 3.33Å; L186-A191 PolarHBondContact O-N 3.47Å
187	L	98.5	Very high	98.2	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-43.4	178.4	-65.7	171.1	0	0	0	112.6	L171 V183 K184 S189 G190 V193 L217 L218 F221 R267	L171-L187 HydrophobicContact CD1-CD2 4.18Å; L171-L187 HydrophobicContact CD1-CG 4.14Å; L171-L187 HydrophobicContact CD2-CD2 3.79Å; V183-L187 HydrophobicContact CG1-CD1 3.84Å; V183-L187 VanDerWaalsContact O-CG 3.27Å; V183-L187 WeakPolarHBondContact O-CG 3.47Å; V183-L187 PolarHBondContact O-N 2.93Å; V183-L187 VanDerWaalsContact O-N 3.11Å; K184-L187 PolarHBondContact O-N 2.83Å; L187-S189 PolarHBondContact O-N 3.3Å; L187-G190 PolarHBondContact O-N 2.91Å; L187-V193 HydrophobicContact CD2-CB 3.9Å; L187-V193 HydrophobicContact CD2-CG2 3.8Å; L187-L217 HydrophobicContact CD1-CD1 4.46Å; L187-L217 HydrophobicContact CD1-CD2 4.4Å; L187-L217 HydrophobicContact CD1-CG 3.93Å; L187-L218 HydrophobicContact CD1-CD2 4.04Å; L187-L218 HydrophobicContact CD2-CD2 4.31Å; L187-F221 VanDerWaalsContact C-CE1 3.43Å; L187-F221 HydrophobicContact CB-CB 4.39Å; L187-F221 HydrophobicContact CB-CD1 3.62Å; L187-F221 HydrophobicContact CB-CD2 3.93Å; L187-F221 HydrophobicContact CB-CE1 3.71Å; L187-F221 HydrophobicContact CB-CE2 4.02Å; L187-F221 HydrophobicContact CB-CG 3.72Å; L187-F221 HydrophobicContact CB-CZ 3.9Å; L187-F221 HydrophobicContact CD1-CB 4.22Å; L187-F221 HydrophobicContact CD1-CD2 3.83Å; L187-F221 HydrophobicContact CD1-CE2 4.36Å; L187-F221 HydrophobicContact CD1-CG 4.04Å; L187-F221 HydrophobicContact CD2-CB 4.08Å; L187-F221 HydrophobicContact CD2-CG 4.33Å; L187-F221 HydrophobicContact CG-CB 4.47Å; L187-F221 HydrophobicContact CG-CD2 4.43Å; L187-F221 HydrophobicContact CG-CG 4.25Å; L187-F221 WeakPolarHBondContact O-CE1 3.35Å; L187-R267 PolarHBondContact O-NH2 2.97Å
188	E	98	Very high	98.2	Very high	46 Å²	46	43.7 Å²	43.7	22%	0.215	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-39	173	-77.8	176.6	175.7	0	0	111.9	K184 G190 F221 R267 H275	K184-E188 WeakPolarHBondContact CE-OE1 3.41Å; K184-E188 HydrophobicContact CG-CG 4.42Å; K184-E188 IonicContact NZ-OE1 2.71Å; K184-E188 WeakPolarHBondContact O-CB 3.42Å; K184-E188 WeakPolarHBondContact O-CG 3.49Å; K184-E188 PolarHBondContact O-N 3.1Å; E188-G190 PolarHBondContact O-N 3.41Å; E188-F221 HydrophobicContact CG-CZ 4.1Å; E188-R267 PolarHBondContact O-NH2 3.43Å; E188-H275 PolarHBondContact O-ND1 3.29Å
189	S	97.8	Very high	98.1	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.028	25%	0.245	C	C	.	.	H	α-helix	trans	-72.5	-15.1	178.3	-59.5	0	0	0	0	113	K185 L186 L187 I272 Q273	K185-S189 VanDerWaalsContact O-CB 3.28Å; K185-S189 WeakPolarHBondContact O-CB 3.34Å; K185-S189 PolarHBondContact O-N 3.05Å; K185-S189 PolarHBondContact O-OG 3.37Å; L186-S189 WeakPolarHBondContact O-CB 3.46Å; L186-S189 PolarHBondContact O-N 3.29Å; L187-S189 PolarHBondContact O-N 3.3Å; S189-I272 CarbonylContact O-C 3.58Å; S189-I272 WeakPolarHBondContact O-CA 3.4Å; S189-Q273 PolarHBondContact O-N 3.43Å
190	G	97.8	Very high	98.1	Very high	23 Å²	23	44.5 Å²	44.5	24%	0.237	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.9	20.2	175.4	0	0	0	0	0	115.4	L186 L187 E188 I272	L186-G190 PolarHBondContact O-N 3.11Å; L186-G190 VanDerWaalsContact O-N 3.1Å; L187-G190 PolarHBondContact O-N 2.91Å; E188-G190 PolarHBondContact O-N 3.41Å; G190-I272 VanDerWaalsContact O-CD1 3.25Å; G190-I272 WeakPolarHBondContact O-CD1 3.33Å
191	A	98.4	Very high	98.1	Very high	10 Å²	10	38.3 Å²	38.3	8%	0.083	21%	0.214	C	C	.	.			trans	-56.9	144.9	172.4	0	0	0	0	0	111	I160 D161 L171 L186 V193	I160-A191 HydrophobicContact CD1-CB 3.72Å; I160-A191 HydrophobicContact CG1-CB 3.87Å; D161-A191 WeakPolarHBondContact OD1-CA 3.35Å; L171-A191 HydrophobicContact CD2-CB 4.48Å; L186-A191 HydrophobicContact CB-CB 4.07Å; L186-A191 VanDerWaalsContact O-CB 3.31Å; L186-A191 WeakPolarHBondContact O-CB 3.33Å; L186-A191 PolarHBondContact O-N 3.47Å; A191-V193 PolarHBondContact O-N 3.01Å; A191-V193 VanDerWaalsContact O-N 3.08Å
192	D	98.4	Very high	98.1	Very high	64 Å²	64	35.3 Å²	35.3	34%	0.342	19%	0.189	S	C	.	.			trans	-69.2	107.1	175	-171.2	-22.3	0	0	0	110	D161 N194 Q195	D161-D192 PolarHBondContact OD1-N 3.03Å; D192-N194 PolarHBondContact O-N 3.43Å; D192-N194 PolarHBondContact OD1-N 3.02Å; D192-Q195 HydrophobicContact CB-CB 4.11Å; D192-Q195 HydrophobicContact CB-CG 3.78Å; D192-Q195 PolarHBondContact O-N 3.31Å; D192-Q195 VanDerWaalsContact O-N 3.16Å; D192-Q195 WeakPolarHBondContact OD2-CG 3.32Å
193	V	98.4	Very high	98.1	Very high	13 Å²	13	35.3 Å²	35.3	8%	0.079	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.8	-178.2	69.4	0	0	0	0	113.6	L187 A191 P202 L218 F221 A223	L187-V193 HydrophobicContact CD2-CB 3.9Å; L187-V193 HydrophobicContact CD2-CG2 3.8Å; A191-V193 PolarHBondContact O-N 3.01Å; A191-V193 VanDerWaalsContact O-N 3.08Å; V193-P202 WeakPolarHBondContact O-CD 3.4Å; V193-P202 WeakPolarHBondContact O-CG 3.35Å; V193-L218 HydrophobicContact CG2-CB 4.44Å; V193-L218 HydrophobicContact CG2-CD2 3.8Å; V193-F221 HydrophobicContact CG2-CB 4.22Å; V193-A223 HydrophobicContact CG2-CB 3.71Å
194	N	98.5	Very high	98.1	Very high	62 Å²	62	35.3 Å²	35.3	33%	0.332	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-10.3	-176.2	-66.9	-51.4	0	0	0	113.6	D192 G196 A223 D224	D192-N194 PolarHBondContact O-N 3.43Å; D192-N194 PolarHBondContact OD1-N 3.02Å; N194-G196 PolarHBondContact O-N 2.87Å; N194-A223 WeakPolarHBondContact OD1-CA 3.28Å; N194-D224 PolarHBondContact OD1-N 3.37Å
195	Q	98.1	Very high	98.1	Very high	75 Å²	75	31.3 Å²	31.3	35%	0.35	17%	0.173	S	C	.	.			trans	-84.5	111	178.7	-70.3	-68.7	-11.3	0	0	111.2	K163 T169 D192 P202	K163-Q195 VanDerWaalsContact NZ-OE1 3.15Å; T169-Q195 HydrophobicContact CG2-CB 3.84Å; T169-Q195 WeakPolarHBondContact CG2-O 3.28Å; T169-Q195 PolarHBondContact OG1-O 3.37Å; D192-Q195 HydrophobicContact CB-CB 4.11Å; D192-Q195 HydrophobicContact CB-CG 3.78Å; D192-Q195 PolarHBondContact O-N 3.31Å; D192-Q195 VanDerWaalsContact O-N 3.16Å; D192-Q195 WeakPolarHBondContact OD2-CG 3.32Å; Q195-P202 WeakPolarHBondContact O-CG 3.44Å
196	G	97.7	Very high	98	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.01	16%	0.159	C	C	.	.			trans	-118.7	-133.6	175.9	0	0	0	0	0	113.5	K163 G168 N194 D200	K163-G196 WeakPolarHBondContact CE-O 3.21Å; G168-G196 WeakPolarHBondContact CA-O 2.88Å; N194-G196 PolarHBondContact O-N 2.87Å; G196-D200 CarbonylContact C-O 3.37Å; G196-D200 WeakPolarHBondContact CA-O 3.41Å
197	K	98	Very high	98	Very high	84 Å²	84	28.3 Å²	28.3	37%	0.365	16%	0.159	S	C	.	.	B	Isolated β-bridge	trans	-103.8	113.1	178.2	-179.5	176.8	167.4	170.7	0	110.5	H166 Y172 Q199 D200	H166-K197 WeakPolarHBondContact O-CE 2.93Å; H166-K197 PolarHBondContact O-NZ 3.17Å; Y172-K197 HydrophobicContact CD1-CB 3.92Å; Y172-K197 HydrophobicContact CD2-CB 4.11Å; Y172-K197 HydrophobicContact CE1-CB 3.68Å; Y172-K197 HydrophobicContact CE1-CD 4.05Å; Y172-K197 HydrophobicContact CE2-CB 3.83Å; Y172-K197 HydrophobicContact CG-CB 4.14Å; K197-Q199 PolarHBondContact O-N 2.97Å; K197-D200 PolarHBondContact N-O 3.26Å; K197-D200 VanDerWaalsContact O-CB 3.29Å; K197-D200 WeakPolarHBondContact O-CB 3.38Å; K197-D200 PolarHBondContact O-N 3.48Å
198	G	96.9	Very high	97.8	Very high	48 Å²	48	33.1 Å²	33.1	50%	0.495	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	-121.3	-173.4	0	0	0	0	0	111.3	K163	K163-G198 PolarHBondContact NZ-O 3.13Å
199	Q	97.2	Very high	97.7	Very high	132 Å²	132	33.7 Å²	33.7	62%	0.617	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-5.7	173.2	-69.2	178.3	-37.8	0	0	113.3	K197 S201	K197-Q199 PolarHBondContact O-N 2.97Å; Q199-S201 PolarHBondContact O-N 2.98Å
200	D	98.1	Very high	97.5	Very high	17 Å²	17	35.1 Å²	35.1	9%	0.091	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-82.6	109.7	178.9	-156.9	62.3	0	0	0	110.2	Y172 G196 K197 H204 R208 N229	Y172-D200 HydrophobicContact CE2-CB 4.28Å; Y172-D200 WeakPolarHBondContact CE2-OD2 3.27Å; Y172-D200 PolarHBondContact OH-OD2 3.49Å; G196-D200 CarbonylContact C-O 3.37Å; G196-D200 WeakPolarHBondContact CA-O 3.41Å; K197-D200 PolarHBondContact N-O 3.26Å; K197-D200 VanDerWaalsContact O-CB 3.29Å; K197-D200 WeakPolarHBondContact O-CB 3.38Å; K197-D200 PolarHBondContact O-N 3.48Å; D200-H204 WeakPolarHBondContact OD1-CB 3.28Å; D200-H204 IonicContact OD1-CD2 3.89Å; D200-H204 IonicContact OD1-CG 3.44Å; D200-R208 VanDerWaalsContact CG-NH2 3.29Å; D200-R208 IonicContact OD1-CZ 3.01Å; D200-R208 IonicContact OD1-NH1 3.37Å; D200-R208 PolarHBondContact OD1-NH1 3.41Å; D200-R208 IonicContact OD1-NH2 3.47Å; D200-R208 PolarHBondContact OD1-NH2 3.47Å; D200-R208 IonicContact OD2-CZ 3.88Å; D200-R208 IonicContact OD2-NH1 3.48Å; D200-R208 PolarHBondContact OD2-NH1 2.9Å; D200-R208 IonicContact OD2-NH2 3.94Å; D200-R208 PolarHBondContact OD2-NH2 2.91Å; D200-N229 PolarHBondContact OD1-ND2 3.2Å
201	S	98.3	Very high	97.4	Very high	6 Å²	6	34.9 Å²	34.9	4%	0.042	19%	0.191	C	C	.	.			trans	-76.9	161.7	-179.6	78.2	0	0	0	0	111.6	Q199 L203 H204 A205	Q199-S201 PolarHBondContact O-N 2.98Å; S201-L203 PolarHBondContact O-N 3.26Å; S201-L203 VanDerWaalsContact O-N 3.11Å; S201-H204 PolarHBondContact N-ND1 2.88Å; S201-H204 WeakPolarHBondContact O-CB 3.31Å; S201-H204 PolarHBondContact O-N 2.93Å; S201-H204 PolarHBondContact OG-ND1 3.16Å; S201-A205 PolarHBondContact O-N 3.41Å
202	P	98.6	Very high	97.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-53.6	-33.2	175.3	-28	38	0	0	0	113.2	L171 V193 Q195 H204 A205 V206 L218	L171-P202 HydrophobicContact CD2-CB 4.37Å; L171-P202 HydrophobicContact CD2-CG 3.95Å; L171-P202 HydrophobicContact CG-CB 4.31Å; L171-P202 HydrophobicContact CG-CG 4.13Å; V193-P202 WeakPolarHBondContact O-CD 3.4Å; V193-P202 WeakPolarHBondContact O-CG 3.35Å; Q195-P202 WeakPolarHBondContact O-CG 3.44Å; P202-H204 PolarHBondContact O-N 3.38Å; P202-A205 PolarHBondContact O-N 3.43Å; P202-V206 WeakPolarHBondContact O-CG2 3.49Å; P202-V206 PolarHBondContact O-N 2.98Å; P202-L218 HydrophobicContact CB-CD1 4.04Å; P202-L218 HydrophobicContact CB-CD2 4.14Å
203	L	98.1	Very high	97.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-68.9	-31.6	177.9	-167.3	59.5	0	0	0	113	S201 A207 A215 L218 M219 A223 T225 P235 F249	S201-L203 PolarHBondContact O-N 3.26Å; S201-L203 VanDerWaalsContact O-N 3.11Å; L203-A207 WeakPolarHBondContact O-CB 3.42Å; L203-A207 PolarHBondContact O-N 2.98Å; L203-A215 HydrophobicContact CD1-CB 4.44Å; L203-L218 HydrophobicContact CB-CD1 4.29Å; L203-L218 HydrophobicContact CD1-CB 4.14Å; L203-L218 HydrophobicContact CD1-CD1 4.09Å; L203-M219 HydrophobicContact CD1-CE 4.34Å; L203-A223 HydrophobicContact CB-CB 4.26Å; L203-A223 HydrophobicContact CD2-CB 3.84Å; L203-A223 HydrophobicContact CG-CB 4.47Å; L203-T225 HydrophobicContact CD2-CG2 4.04Å; L203-P235 HydrophobicContact CB-CG 4.28Å; L203-P235 HydrophobicContact CD2-CB 4.32Å; L203-P235 HydrophobicContact CD2-CG 4.11Å; L203-P235 HydrophobicContact CG-CB 3.96Å; L203-P235 HydrophobicContact CG-CG 4.05Å; L203-F249 HydrophobicContact CD1-CE1 4.21Å; L203-F249 HydrophobicContact CD1-CZ 3.98Å; L203-F249 HydrophobicContact CD2-CE1 3.8Å; L203-F249 HydrophobicContact CD2-CZ 4.24Å; L203-F249 HydrophobicContact CG-CE1 4.02Å; L203-F249 HydrophobicContact CG-CZ 3.93Å
204	H	98.3	Very high	97.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-44.8	172.1	-68.5	88	0	0	0	111.3	D200 S201 P202 V206 A207 R208 A227 N229 K233 P235 L238	D200-H204 WeakPolarHBondContact OD1-CB 3.28Å; D200-H204 IonicContact OD1-CD2 3.89Å; D200-H204 IonicContact OD1-CG 3.44Å; S201-H204 PolarHBondContact N-ND1 2.88Å; S201-H204 WeakPolarHBondContact O-CB 3.31Å; S201-H204 PolarHBondContact O-N 2.93Å; S201-H204 PolarHBondContact OG-ND1 3.16Å; P202-H204 PolarHBondContact O-N 3.38Å; H204-V206 VanDerWaalsContact C-N 3.34Å; H204-V206 PolarHBondContact O-N 2.83Å; H204-A207 PolarHBondContact O-N 3.49Å; H204-R208 VanDerWaalsContact C-NH1 3.34Å; H204-R208 PolarHBondContact O-N 2.87Å; H204-R208 PolarHBondContact O-NH1 3.49Å; H204-A227 PolarHBondContact CE1-O 2.94Å; H204-A227 VanDerWaalsContact CE1-O 3.31Å; H204-A227 PolarHBondContact NE2-O 3.32Å; H204-N229 PolarHBondContact NE2-N 3.04Å; H204-K233 PolarHBondContact NE2-O 2.95Å; H204-K233 VanDerWaalsContact NE2-O 3.07Å; H204-P235 WeakPolarHBondContact NE2-CD 3.47Å; H204-L238 HydrophobicContact CB-CD1 3.92Å
205	A	97.6	Very high	97	Very high	5 Å²	5	37.4 Å²	37.4	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-47.3	176	0	0	0	0	0	111.4	Y172 S201 P202 A207 R208 T209	Y172-A205 HydrophobicContact CD2-CB 4.27Å; Y172-A205 HydrophobicContact CE2-CB 3.74Å; S201-A205 PolarHBondContact O-N 3.41Å; P202-A205 PolarHBondContact O-N 3.43Å; A205-A207 PolarHBondContact O-N 3.07Å; A205-R208 PolarHBondContact O-N 3.45Å; A205-T209 PolarHBondContact O-N 3.44Å
206	V	97.6	Very high	96.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-41	177	165.3	0	0	0	0	112.5	C175 P202 H204 R208 T209 A210 S211 L214 A215 L218	C175-V206 HydrophobicContact CB-CG2 3.78Å; P202-V206 WeakPolarHBondContact O-CG2 3.49Å; P202-V206 PolarHBondContact O-N 2.98Å; H204-V206 VanDerWaalsContact C-N 3.34Å; H204-V206 PolarHBondContact O-N 2.83Å; V206-R208 VanDerWaalsContact C-N 3.33Å; V206-R208 PolarHBondContact O-N 3.09Å; V206-T209 WeakPolarHBondContact CA-OG1 3.25Å; V206-T209 CarbonylContact O-C 3.5Å; V206-T209 PolarHBondContact O-N 2.99Å; V206-T209 VanDerWaalsContact O-N 3.14Å; V206-T209 PolarHBondContact O-OG1 2.94Å; V206-A210 PolarHBondContact O-N 3.21Å; V206-A210 VanDerWaalsContact O-N 3.14Å; V206-S211 WeakPolarHBondContact CG1-O 3.2Å; V206-S211 PolarHBondContact O-N 3.45Å; V206-L214 HydrophobicContact CB-CB 4.44Å; V206-L214 HydrophobicContact CG1-CB 3.8Å; V206-L214 HydrophobicContact CG2-CB 3.71Å; V206-L214 HydrophobicContact CG2-CD1 4.17Å; V206-A215 HydrophobicContact CG1-CB 3.8Å; V206-L218 HydrophobicContact CB-CD1 4.13Å; V206-L218 HydrophobicContact CG2-CD1 3.61Å
207	A	97	Very high	96.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-41.1	177.7	0	0	0	0	0	112.5	L203 H204 A205 T209 A210 P235 L238 V239 F249	L203-A207 WeakPolarHBondContact O-CB 3.42Å; L203-A207 PolarHBondContact O-N 2.98Å; H204-A207 PolarHBondContact O-N 3.49Å; A205-A207 PolarHBondContact O-N 3.07Å; A207-T209 VanDerWaalsContact C-N 3.29Å; A207-T209 PolarHBondContact O-N 3.35Å; A207-A210 PolarHBondContact O-N 2.98Å; A207-A210 VanDerWaalsContact O-N 3.1Å; A207-P235 HydrophobicContact CB-CB 4.27Å; A207-P235 WeakPolarHBondContact CB-O 3.44Å; A207-L238 HydrophobicContact CB-CB 4.18Å; A207-V239 HydrophobicContact CB-CG2 3.86Å; A207-F249 HydrophobicContact CB-CE2 4.28Å; A207-F249 HydrophobicContact CB-CZ 4.49Å
208	R	95.8	Very high	96.9	Very high	104 Å²	104	33.3 Å²	33.3	39%	0.392	18%	0.184	S	C	.	.	H	α-helix	trans	-63.5	-34.6	175.6	-65.8	-176.2	-165.5	89.1	-1.2	112.9	D200 H204 A205 V206 A210 N229 L238	D200-R208 VanDerWaalsContact CG-NH2 3.29Å; D200-R208 IonicContact OD1-CZ 3.01Å; D200-R208 IonicContact OD1-NH1 3.37Å; D200-R208 PolarHBondContact OD1-NH1 3.41Å; D200-R208 IonicContact OD1-NH2 3.47Å; D200-R208 PolarHBondContact OD1-NH2 3.47Å; D200-R208 IonicContact OD2-CZ 3.88Å; D200-R208 IonicContact OD2-NH1 3.48Å; D200-R208 PolarHBondContact OD2-NH1 2.9Å; D200-R208 IonicContact OD2-NH2 3.94Å; D200-R208 PolarHBondContact OD2-NH2 2.91Å; H204-R208 VanDerWaalsContact C-NH1 3.34Å; H204-R208 PolarHBondContact O-N 2.87Å; H204-R208 PolarHBondContact O-NH1 3.49Å; A205-R208 PolarHBondContact O-N 3.45Å; V206-R208 VanDerWaalsContact C-N 3.33Å; V206-R208 PolarHBondContact O-N 3.09Å; R208-A210 PolarHBondContact O-N 3.36Å; R208-N229 PolarHBondContact NH2-ND2 3.44Å; R208-L238 HydrophobicContact CG-CB 4.15Å; R208-L238 HydrophobicContact CG-CD1 4.09Å
209	T	94.5	Very high	96.8	Very high	58 Å²	58	31.8 Å²	31.8	36%	0.356	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-3.8	177.1	61.4	0	0	0	0	113.6	Q178 A205 V206 A207 S211	Q178-T209 PolarHBondContact NE2-OG1 2.98Å; A205-T209 PolarHBondContact O-N 3.44Å; V206-T209 WeakPolarHBondContact CA-OG1 3.25Å; V206-T209 CarbonylContact O-C 3.5Å; V206-T209 PolarHBondContact O-N 2.99Å; V206-T209 VanDerWaalsContact O-N 3.14Å; V206-T209 PolarHBondContact O-OG1 2.94Å; A207-T209 VanDerWaalsContact C-N 3.29Å; A207-T209 PolarHBondContact O-N 3.35Å; T209-S211 PolarHBondContact O-N 3.32Å
210	A	94.5	Very high	96.8	Very high	35 Å²	35	28.2 Å²	28.2	29%	0.289	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	34.3	-175.4	0	0	0	0	0	113.8	V206 A207 R208 E212 P240	V206-A210 PolarHBondContact O-N 3.21Å; V206-A210 VanDerWaalsContact O-N 3.14Å; A207-A210 PolarHBondContact O-N 2.98Å; A207-A210 VanDerWaalsContact O-N 3.1Å; R208-A210 PolarHBondContact O-N 3.36Å; A210-E212 PolarHBondContact O-N 3.05Å; A210-P240 HydrophobicContact CB-CG 4.11Å
211	S	95.5	Very high	96.8	Very high	17 Å²	17	28.2 Å²	28.2	12%	0.119	15%	0.148	C	C	.	.			trans	-87.9	93.5	-175.9	-172.2	0	0	0	0	111.3	Q178 V206 T209 E213 L214 A215	Q178-S211 PolarHBondContact OE1-OG 3.14Å; V206-S211 WeakPolarHBondContact CG1-O 3.2Å; V206-S211 PolarHBondContact O-N 3.45Å; T209-S211 PolarHBondContact O-N 3.32Å; S211-E213 VanDerWaalsContact C-N 3.29Å; S211-E213 PolarHBondContact O-N 3.3Å; S211-L214 PolarHBondContact O-N 3.27Å; S211-L214 WeakPolarHBondContact OG-CG 3.42Å; S211-A215 WeakPolarHBondContact O-CB 3.33Å; S211-A215 PolarHBondContact O-N 3.01Å
212	E	94.5	Very high	96.7	Very high	88 Å²	88	29 Å²	29	41%	0.411	16%	0.157	S	C	.	.	H	α-helix	trans	-57.2	-42.3	180	-66.7	174.9	-161.7	0	0	112	A210 L214 A215 C216 P244 L245	A210-E212 PolarHBondContact O-N 3.05Å; E212-L214 PolarHBondContact O-N 3.27Å; E212-A215 PolarHBondContact O-N 3.44Å; E212-C216 PolarHBondContact O-N 2.92Å; E212-C216 PolarHBondContact O-SG 3.46Å; E212-C216 VanDerWaalsContact O-SG 3.4Å; E212-P244 WeakPolarHBondContact OE1-CB 3.35Å; E212-P244 VanDerWaalsContact OE1-CD 3.23Å; E212-P244 WeakPolarHBondContact OE1-CD 3.39Å; E212-P244 WeakPolarHBondContact OE1-CG 3.37Å; E212-L245 HydrophobicContact CG-CB 4.15Å; E212-L245 HydrophobicContact CG-CD1 4.43Å; E212-L245 HydrophobicContact CG-CG 4.28Å
213	E	95.7	Very high	96.6	Very high	112 Å²	112	29.5 Å²	29.5	52%	0.523	16%	0.161	S	C	.	.	H	α-helix	trans	-62.8	-44.8	-179.3	-63.2	-163.7	139.4	0	0	112.3	R180 S211 L217	R180-E213 WeakPolarHBondContact CD-OE2 3.43Å; R180-E213 IonicContact CZ-OE1 3.22Å; R180-E213 IonicContact CZ-OE2 2.68Å; R180-E213 IonicContact NE-OE2 2.73Å; R180-E213 IonicContact NH1-OE1 2.87Å; R180-E213 PolarHBondContact NH1-OE1 3.29Å; R180-E213 IonicContact NH1-OE2 3.96Å; R180-E213 PolarHBondContact NH1-OE2 3.05Å; S211-E213 VanDerWaalsContact C-N 3.29Å; S211-E213 PolarHBondContact O-N 3.3Å; E213-L217 WeakPolarHBondContact O-CB 3.42Å; E213-L217 PolarHBondContact O-N 3.3Å; E213-L217 VanDerWaalsContact O-N 3.1Å
214	L	97.9	Very high	96.6	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-72.5	-32	178.4	-63.1	-175.7	0	0	0	111.8	R180 V183 V206 S211 E212 L217 L218	R180-L214 HydrophobicContact CB-CD2 4Å; R180-L214 HydrophobicContact CG-CD2 4.2Å; V183-L214 HydrophobicContact CB-CD2 4.21Å; V183-L214 HydrophobicContact CG1-CD2 4.29Å; V183-L214 HydrophobicContact CG2-CD2 4.23Å; V206-L214 HydrophobicContact CB-CB 4.44Å; V206-L214 HydrophobicContact CG1-CB 3.8Å; V206-L214 HydrophobicContact CG2-CB 3.71Å; V206-L214 HydrophobicContact CG2-CD1 4.17Å; S211-L214 PolarHBondContact O-N 3.27Å; S211-L214 WeakPolarHBondContact OG-CG 3.42Å; E212-L214 PolarHBondContact O-N 3.27Å; L214-L217 HydrophobicContact CD2-CD2 4.45Å; L214-L217 PolarHBondContact O-N 3.35Å; L214-L218 WeakPolarHBondContact O-CB 3.34Å; L214-L218 VanDerWaalsContact O-CG 3.32Å; L214-L218 WeakPolarHBondContact O-CG 3.42Å; L214-L218 PolarHBondContact O-N 2.92Å
215	A	97	Very high	96.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65	-50	177.3	0	0	0	0	0	110.5	L203 V206 S211 E212 L217 L218 M219 L245 L248	L203-A215 HydrophobicContact CD1-CB 4.44Å; V206-A215 HydrophobicContact CG1-CB 3.8Å; S211-A215 WeakPolarHBondContact O-CB 3.33Å; S211-A215 PolarHBondContact O-N 3.01Å; E212-A215 PolarHBondContact O-N 3.44Å; A215-L217 VanDerWaalsContact C-N 3.31Å; A215-L217 PolarHBondContact O-N 3.47Å; A215-L218 PolarHBondContact O-N 3.15Å; A215-M219 HydrophobicContact CB-CE 4.39Å; A215-M219 WeakPolarHBondContact O-CB 3.26Å; A215-M219 VanDerWaalsContact O-CG 3.27Å; A215-M219 WeakPolarHBondContact O-CG 3.26Å; A215-M219 PolarHBondContact O-N 2.89Å; A215-L245 HydrophobicContact CB-CD1 4.03Å; A215-L245 HydrophobicContact CB-CD2 3.95Å; A215-L245 HydrophobicContact CB-CG 4.06Å; A215-L248 HydrophobicContact CB-CD2 4.46Å
216	C	95.7	Very high	96.3	Very high	49 Å²	49	37.3 Å²	37.3	33%	0.331	20%	0.201	S	C	.	.	H	α-helix	trans	-54.8	-48.1	173.5	-73.9	0	0	0	0	111.4	E212 L218 M219 D220 L248	E212-C216 PolarHBondContact O-N 2.92Å; E212-C216 PolarHBondContact O-SG 3.46Å; E212-C216 VanDerWaalsContact O-SG 3.4Å; C216-L218 PolarHBondContact O-N 3.03Å; C216-M219 PolarHBondContact O-N 3.47Å; C216-D220 PolarHBondContact O-N 3.41Å; C216-L248 WeakPolarHBondContact SG-CD2 3.48Å
217	L	97.5	Very high	96.3	Very high	26 Å²	26	38.5 Å²	38.5	14%	0.136	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-47.1	-180	-179.3	61.2	0	0	0	112.2	V183 K184 L187 E213 L214 A215 M219 D220 F221	V183-L217 HydrophobicContact CB-CD2 4.3Å; V183-L217 HydrophobicContact CG1-CD2 3.76Å; V183-L217 HydrophobicContact CG1-CG 4.47Å; K184-L217 HydrophobicContact CB-CD2 3.9Å; K184-L217 HydrophobicContact CG-CD1 4.35Å; L187-L217 HydrophobicContact CD1-CD1 4.46Å; L187-L217 HydrophobicContact CD1-CD2 4.4Å; L187-L217 HydrophobicContact CD1-CG 3.93Å; E213-L217 WeakPolarHBondContact O-CB 3.42Å; E213-L217 PolarHBondContact O-N 3.3Å; E213-L217 VanDerWaalsContact O-N 3.1Å; L214-L217 HydrophobicContact CD2-CD2 4.45Å; L214-L217 PolarHBondContact O-N 3.35Å; A215-L217 VanDerWaalsContact C-N 3.31Å; A215-L217 PolarHBondContact O-N 3.47Å; L217-M219 PolarHBondContact O-N 3.01Å; L217-D220 PolarHBondContact O-N 2.82Å; L217-F221 HydrophobicContact CD1-CD2 4.08Å; L217-F221 HydrophobicContact CD1-CE2 3.8Å; L217-F221 WeakPolarHBondContact O-CD2 3.45Å; L217-F221 PolarHBondContact O-N 2.62Å
218	L	98.1	Very high	96.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.9	-42.6	177.2	-74.4	175.6	0	0	0	111.8	L171 V183 L187 V193 P202 L203 V206 L214 A215 C216 D220 F221 G222 A223	L171-L218 HydrophobicContact CD2-CD2 4.49Å; V183-L218 HydrophobicContact CG1-CD2 4.45Å; L187-L218 HydrophobicContact CD1-CD2 4.04Å; L187-L218 HydrophobicContact CD2-CD2 4.31Å; V193-L218 HydrophobicContact CG2-CB 4.44Å; V193-L218 HydrophobicContact CG2-CD2 3.8Å; P202-L218 HydrophobicContact CB-CD1 4.04Å; P202-L218 HydrophobicContact CB-CD2 4.14Å; L203-L218 HydrophobicContact CB-CD1 4.29Å; L203-L218 HydrophobicContact CD1-CB 4.14Å; L203-L218 HydrophobicContact CD1-CD1 4.09Å; V206-L218 HydrophobicContact CB-CD1 4.13Å; V206-L218 HydrophobicContact CG2-CD1 3.61Å; L214-L218 WeakPolarHBondContact O-CB 3.34Å; L214-L218 VanDerWaalsContact O-CG 3.32Å; L214-L218 WeakPolarHBondContact O-CG 3.42Å; L214-L218 PolarHBondContact O-N 2.92Å; A215-L218 PolarHBondContact O-N 3.15Å; C216-L218 PolarHBondContact O-N 3.03Å; L218-D220 VanDerWaalsContact C-N 3.34Å; L218-D220 PolarHBondContact O-N 2.95Å; L218-F221 CarbonylContact O-C 3.43Å; L218-F221 PolarHBondContact O-N 3.27Å; L218-G222 PolarHBondContact O-N 3.38Å; L218-G222 VanDerWaalsContact O-N 3.15Å; L218-A223 HydrophobicContact CB-CB 3.86Å; L218-A223 VanDerWaalsContact O-CB 3.31Å; L218-A223 WeakPolarHBondContact O-CB 3.21Å; L218-A223 PolarHBondContact O-N 3.05Å
219	M	96	Very high	96.4	Very high	16 Å²	16	40.2 Å²	40.2	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-63.3	-38.2	177	-69.7	-179.8	-160.9	0	0	112.4	L203 A215 C216 L217 F221 G222 T225 L248 F249 R252	L203-M219 HydrophobicContact CD1-CE 4.34Å; A215-M219 HydrophobicContact CB-CE 4.39Å; A215-M219 WeakPolarHBondContact O-CB 3.26Å; A215-M219 VanDerWaalsContact O-CG 3.27Å; A215-M219 WeakPolarHBondContact O-CG 3.26Å; A215-M219 PolarHBondContact O-N 2.89Å; C216-M219 PolarHBondContact O-N 3.47Å; L217-M219 PolarHBondContact O-N 3.01Å; M219-F221 PolarHBondContact O-N 3.46Å; M219-G222 PolarHBondContact O-N 2.96Å; M219-T225 HydrophobicContact CE-CG2 4.3Å; M219-T225 HydrophobicContact CG-CG2 4.33Å; M219-T225 HydrophobicContact SD-CG2 4.45Å; M219-L248 HydrophobicContact CE-CD2 4.35Å; M219-F249 HydrophobicContact CE-CD1 3.37Å; M219-F249 HydrophobicContact CE-CE1 3.23Å; M219-F249 HydrophobicContact CE-CE2 4.46Å; M219-F249 HydrophobicContact CE-CG 4.05Å; M219-F249 HydrophobicContact CE-CZ 3.81Å; M219-R252 HydrophobicContact SD-CB 4.18Å; M219-R252 HydrophobicContact SD-CG 4.03Å
220	D	96.2	Very high	96.6	Very high	56 Å²	56	40.7 Å²	40.7	30%	0.299	23%	0.231	S	C	.	.	H	α-helix	trans	-63.8	-27.4	176.5	-77.1	-15.9	0	0	0	112.8	C216 L217 L218 Q260 R263 H293	C216-D220 PolarHBondContact O-N 3.41Å; L217-D220 PolarHBondContact O-N 2.82Å; L218-D220 VanDerWaalsContact C-N 3.34Å; L218-D220 PolarHBondContact O-N 2.95Å; D220-Q260 PolarHBondContact O-NE2 3.37Å; D220-R263 PolarHBondContact O-NH2 3.35Å; D220-R263 VanDerWaalsContact O-NH2 3.15Å; D220-H293 PolarHBondContact O-NE2 2.93Å; D220-H293 VanDerWaalsContact O-NE2 3.09Å
221	F	97.9	Very high	96.7	Very high	17 Å²	17	45.1 Å²	45.1	8%	0.075	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5	172.6	-78	-95.4	0	0	0	113.9	L187 E188 V193 L217 L218 M219 L264 H293	L187-F221 VanDerWaalsContact C-CE1 3.43Å; L187-F221 HydrophobicContact CB-CB 4.39Å; L187-F221 HydrophobicContact CB-CD1 3.62Å; L187-F221 HydrophobicContact CB-CD2 3.93Å; L187-F221 HydrophobicContact CB-CE1 3.71Å; L187-F221 HydrophobicContact CB-CE2 4.02Å; L187-F221 HydrophobicContact CB-CG 3.72Å; L187-F221 HydrophobicContact CB-CZ 3.9Å; L187-F221 HydrophobicContact CD1-CB 4.22Å; L187-F221 HydrophobicContact CD1-CD2 3.83Å; L187-F221 HydrophobicContact CD1-CE2 4.36Å; L187-F221 HydrophobicContact CD1-CG 4.04Å; L187-F221 HydrophobicContact CD2-CB 4.08Å; L187-F221 HydrophobicContact CD2-CG 4.33Å; L187-F221 HydrophobicContact CG-CB 4.47Å; L187-F221 HydrophobicContact CG-CD2 4.43Å; L187-F221 HydrophobicContact CG-CG 4.25Å; L187-F221 WeakPolarHBondContact O-CE1 3.35Å; E188-F221 HydrophobicContact CG-CZ 4.1Å; V193-F221 HydrophobicContact CG2-CB 4.22Å; L217-F221 HydrophobicContact CD1-CD2 4.08Å; L217-F221 HydrophobicContact CD1-CE2 3.8Å; L217-F221 WeakPolarHBondContact O-CD2 3.45Å; L217-F221 PolarHBondContact O-N 2.62Å; L218-F221 CarbonylContact O-C 3.43Å; L218-F221 PolarHBondContact O-N 3.27Å; M219-F221 PolarHBondContact O-N 3.46Å; F221-L264 VanDerWaalsContact O-CD2 3.28Å; F221-L264 WeakPolarHBondContact O-CD2 3.3Å; F221-H293 AromaticContact CD1-CE1 3.77Å; F221-H293 AromaticContact CD1-NE2 3.95Å; F221-H293 AromaticContact CD2-CD2 3.87Å; F221-H293 AromaticContact CD2-NE2 3.7Å; F221-H293 AromaticContact CE1-CE1 3.55Å; F221-H293 AromaticContact CE1-ND1 3.64Å; F221-H293 AromaticContact CE1-NE2 3.9Å; F221-H293 HydrophobicContact CE2-CB 4.26Å; F221-H293 AromaticContact CE2-CD2 3.4Å; F221-H293 VanDerWaalsContact CE2-CD2 3.4Å; F221-H293 WeakPolarHBondContact CE2-CD2 3.43Å; F221-H293 AromaticContact CE2-CG 3.76Å; F221-H293 AromaticContact CE2-NE2 3.65Å; F221-H293 AromaticContact CG-NE2 3.87Å; F221-H293 HydrophobicContact CZ-CB 3.9Å; F221-H293 AromaticContact CZ-CD2 3.59Å; F221-H293 AromaticContact CZ-CE1 3.74Å; F221-H293 AromaticContact CZ-CG 3.46Å; F221-H293 VanDerWaalsContact CZ-CG 3.46Å; F221-H293 AromaticContact CZ-ND1 3.59Å; F221-H293 AromaticContact CZ-NE2 3.76Å
222	G	96.8	Very high	96.8	Very high	23 Å²	23	46 Å²	46	24%	0.237	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	31.9	170.8	0	0	0	0	0	114.8	L218 M219	L218-G222 PolarHBondContact O-N 3.38Å; L218-G222 VanDerWaalsContact O-N 3.15Å; M219-G222 PolarHBondContact O-N 2.96Å
223	A	97.5	Very high	96.9	Very high	10 Å²	10	46.3 Å²	46.3	8%	0.083	26%	0.258	C	S	.	.			trans	-58.7	136.4	169.2	0	0	0	0	0	111.6	V193 N194 L203 L218 T225	V193-A223 HydrophobicContact CG2-CB 3.71Å; N194-A223 WeakPolarHBondContact OD1-CA 3.28Å; L203-A223 HydrophobicContact CB-CB 4.26Å; L203-A223 HydrophobicContact CD2-CB 3.84Å; L203-A223 HydrophobicContact CG-CB 4.47Å; L218-A223 HydrophobicContact CB-CB 3.86Å; L218-A223 VanDerWaalsContact O-CB 3.31Å; L218-A223 WeakPolarHBondContact O-CB 3.21Å; L218-A223 PolarHBondContact O-N 3.05Å; A223-T225 PolarHBondContact O-N 3.35Å
224	D	96.4	Very high	97	Very high	71 Å²	71	43.8 Å²	43.8	38%	0.38	24%	0.244	S	C	.	.			trans	-76.7	110.5	179	-175.8	2.3	0	0	0	110.8	N194 Q226 A227	N194-D224 PolarHBondContact OD1-N 3.37Å; D224-Q226 PolarHBondContact O-N 3.48Å; D224-Q226 WeakPolarHBondContact OD1-CA 3.45Å; D224-Q226 WeakPolarHBondContact OD1-CB 3.5Å; D224-Q226 PolarHBondContact OD1-N 3.43Å; D224-A227 HydrophobicContact CB-CB 4.13Å; D224-A227 PolarHBondContact OD1-N 3.49Å
225	T	95.7	Very high	96.9	Very high	22 Å²	22	43.7 Å²	43.7	14%	0.135	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.3	177.7	59.5	0	0	0	0	113	L203 M219 A223 F249	L203-T225 HydrophobicContact CD2-CG2 4.04Å; M219-T225 HydrophobicContact CE-CG2 4.3Å; M219-T225 HydrophobicContact CG-CG2 4.33Å; M219-T225 HydrophobicContact SD-CG2 4.45Å; A223-T225 PolarHBondContact O-N 3.35Å; T225-F249 HydrophobicContact CG2-CD1 4.07Å; T225-F249 HydrophobicContact CG2-CE1 4.09Å
226	Q	95	Very high	96.8	Very high	77 Å²	77	45.3 Å²	45.3	36%	0.36	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-6.8	-176.6	-53.9	-53.4	-43.2	0	0	113.5	D224	D224-Q226 PolarHBondContact O-N 3.48Å; D224-Q226 WeakPolarHBondContact OD1-CA 3.45Å; D224-Q226 WeakPolarHBondContact OD1-CB 3.5Å; D224-Q226 PolarHBondContact OD1-N 3.43Å
227	A	96.4	Very high	96.8	Very high	25 Å²	25	47.4 Å²	47.4	21%	0.207	26%	0.258	C	S	.	.			trans	-55.7	141.2	175.8	0	0	0	0	0	110.6	H204 D224 P235	H204-A227 PolarHBondContact CE1-O 2.94Å; H204-A227 VanDerWaalsContact CE1-O 3.31Å; H204-A227 PolarHBondContact NE2-O 3.32Å; D224-A227 HydrophobicContact CB-CB 4.13Å; D224-A227 PolarHBondContact OD1-N 3.49Å; A227-P235 WeakPolarHBondContact O-CD 3Å
228	K	97.8	Very high	96.7	Very high	134 Å²	134	47.8 Å²	47.8	58%	0.583	26%	0.26	S	S	*	.			trans	-111	134.6	176.3	-67.8	-178	175.3	-169.8	0	110.2	G232 K233 R234	K228-G232 WeakPolarHBondContact CD-O 3.45Å; K228-K233 WeakPolarHBondContact CA-O 3.25Å; K228-R234 HydrophobicContact CG-CG 4.02Å
229	N	97.9	Very high	96.6	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.032	27%	0.265	C	S	.	.			trans	-80.1	-172.3	174.5	73.9	1.2	0	0	0	112.2	D200 H204 R208 E231 G232 K233	D200-N229 PolarHBondContact OD1-ND2 3.2Å; H204-N229 PolarHBondContact NE2-N 3.04Å; R208-N229 PolarHBondContact NH2-ND2 3.44Å; N229-E231 VanDerWaalsContact CG-OE2 3.23Å; N229-E231 PolarHBondContact ND2-OE2 3.35Å; N229-E231 PolarHBondContact O-N 3.48Å; N229-E231 PolarHBondContact OD1-N 3.15Å; N229-E231 PolarHBondContact OD1-OE2 3.09Å; N229-G232 WeakPolarHBondContact O-CA 3.27Å; N229-G232 PolarHBondContact O-N 3.2Å; N229-G232 PolarHBondContact OD1-N 3.47Å; N229-K233 PolarHBondContact N-O 2.96Å; N229-K233 PolarHBondContact OD1-N 2.96Å; N229-K233 PolarHBondContact OD1-O 3.02Å
230	A	97.7	Very high	96.4	Very high	69 Å²	69	50.4 Å²	50.4	57%	0.57	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.5	-178.5	0	0	0	0	0	114.1	G232	A230-G232 PolarHBondContact O-N 3.32Å
231	E	97.3	Very high	96	Very high	127 Å²	127	53.6 Å²	53.6	59%	0.593	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	3.6	173.1	-58.1	79.4	-134.9	0	0	112.6	N229 K233	N229-E231 VanDerWaalsContact CG-OE2 3.23Å; N229-E231 PolarHBondContact ND2-OE2 3.35Å; N229-E231 PolarHBondContact O-N 3.48Å; N229-E231 PolarHBondContact OD1-N 3.15Å; N229-E231 PolarHBondContact OD1-OE2 3.09Å; E231-K233 HydrophobicContact CB-CD 4.45Å; E231-K233 HydrophobicContact CB-CG 4.24Å; E231-K233 PolarHBondContact O-N 2.91Å
232	G	97.5	Very high	95.6	Very high	37 Å²	37	61.4 Å²	61.4	38%	0.381	34%	0.338	S	S	.	.	S	Bend	trans	74.2	10.8	-178.3	0	0	0	0	0	114.3	K228 N229 A230	K228-G232 WeakPolarHBondContact CD-O 3.45Å; N229-G232 WeakPolarHBondContact O-CA 3.27Å; N229-G232 PolarHBondContact O-N 3.2Å; N229-G232 PolarHBondContact OD1-N 3.47Å; A230-G232 PolarHBondContact O-N 3.32Å
233	K	97.7	Very high	95.4	Very high	94 Å²	94	61 Å²	61	41%	0.409	33%	0.332	S	S	.	.			trans	-90.7	142.4	-176.8	-62.9	-175.9	178.5	-175.5	0	111.5	H204 K228 N229 E231 E237 L238	H204-K233 PolarHBondContact NE2-O 2.95Å; H204-K233 VanDerWaalsContact NE2-O 3.07Å; K228-K233 WeakPolarHBondContact CA-O 3.25Å; N229-K233 PolarHBondContact N-O 2.96Å; N229-K233 PolarHBondContact OD1-N 2.96Å; N229-K233 PolarHBondContact OD1-O 3.02Å; E231-K233 HydrophobicContact CB-CD 4.45Å; E231-K233 HydrophobicContact CB-CG 4.24Å; E231-K233 PolarHBondContact O-N 2.91Å; K233-E237 WeakPolarHBondContact CA-OE2 2.96Å; K233-E237 HydrophobicContact CB-CB 4.38Å; K233-L238 HydrophobicContact CB-CD2 4.24Å; K233-L238 HydrophobicContact CD-CD2 3.66Å
234	R	96.6	Very high	95.1	Very high	58 Å²	58	63.9 Å²	63.9	22%	0.219	35%	0.35	C	S	.	.			trans	-82.2	160.6	168.4	-66.1	-176.3	-65.5	156.5	6.9	111	K228 V236 E237 E253	K228-R234 HydrophobicContact CG-CG 4.02Å; R234-V236 VanDerWaalsContact C-N 3.28Å; R234-V236 HydrophobicContact CB-CG1 4.15Å; R234-V236 PolarHBondContact O-N 3.08Å; R234-E237 HydrophobicContact CB-CG 4.37Å; R234-E237 WeakPolarHBondContact CB-OE1 3.35Å; R234-E237 IonicContact CZ-OE1 3.65Å; R234-E237 PolarHBondContact N-OE2 3.02Å; R234-E237 VanDerWaalsContact N-OE2 3.09Å; R234-E237 IonicContact NE-OE1 3.72Å; R234-E237 PolarHBondContact NE-OE1 3.01Å; R234-E237 IonicContact NH2-OE1 3.21Å; R234-E237 WeakPolarHBondContact O-CB 3.36Å; R234-E237 PolarHBondContact O-N 2.93Å; R234-E253 IonicContact CZ-OE1 3.73Å; R234-E253 IonicContact NH1-OE1 2.94Å; R234-E253 PolarHBondContact NH1-OE1 3.3Å; R234-E253 IonicContact NH2-OE1 3.6Å
235	P	96.3	Very high	94.9	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-53.1	-42.6	177	-28.2	35.2	0	0	0	113.6	L203 H204 A207 A227 E237 L238 F249	L203-P235 HydrophobicContact CB-CG 4.28Å; L203-P235 HydrophobicContact CD2-CB 4.32Å; L203-P235 HydrophobicContact CD2-CG 4.11Å; L203-P235 HydrophobicContact CG-CB 3.96Å; L203-P235 HydrophobicContact CG-CG 4.05Å; H204-P235 WeakPolarHBondContact NE2-CD 3.47Å; A207-P235 HydrophobicContact CB-CB 4.27Å; A207-P235 WeakPolarHBondContact CB-O 3.44Å; A227-P235 WeakPolarHBondContact O-CD 3Å; P235-E237 PolarHBondContact O-N 3.47Å; P235-L238 WeakPolarHBondContact O-CB 3.4Å; P235-L238 PolarHBondContact O-N 3.25Å; P235-F249 HydrophobicContact CB-CE1 3.86Å; P235-F249 HydrophobicContact CB-CE2 4.29Å; P235-F249 HydrophobicContact CB-CZ 3.54Å
236	V	95.5	Very high	94.6	Very high	34 Å²	34	61 Å²	61	21%	0.206	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-59.1	-29.9	179	66.1	0	0	0	0	113.1	R234 L238 V239 F249	R234-V236 VanDerWaalsContact C-N 3.28Å; R234-V236 HydrophobicContact CB-CG1 4.15Å; R234-V236 PolarHBondContact O-N 3.08Å; V236-L238 PolarHBondContact O-N 2.86Å; V236-V239 PolarHBondContact O-N 2.95Å; V236-F249 HydrophobicContact CB-CB 3.82Å; V236-F249 HydrophobicContact CB-CD1 4.37Å; V236-F249 HydrophobicContact CB-CD2 3.9Å; V236-F249 HydrophobicContact CB-CG 3.82Å; V236-F249 HydrophobicContact CG2-CB 3.56Å; V236-F249 HydrophobicContact CG2-CD2 4.06Å; V236-F249 HydrophobicContact CG2-CG 4.02Å
237	E	95.5	Very high	94.4	Very high	93 Å²	93	63.7 Å²	63.7	44%	0.435	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-79.3	-8.4	-178.7	-61.9	159.9	-154.6	0	0	112.7	K233 R234 P235	K233-E237 WeakPolarHBondContact CA-OE2 2.96Å; K233-E237 HydrophobicContact CB-CB 4.38Å; R234-E237 HydrophobicContact CB-CG 4.37Å; R234-E237 WeakPolarHBondContact CB-OE1 3.35Å; R234-E237 IonicContact CZ-OE1 3.65Å; R234-E237 PolarHBondContact N-OE2 3.02Å; R234-E237 VanDerWaalsContact N-OE2 3.09Å; R234-E237 IonicContact NE-OE1 3.72Å; R234-E237 PolarHBondContact NE-OE1 3.01Å; R234-E237 IonicContact NH2-OE1 3.21Å; R234-E237 WeakPolarHBondContact O-CB 3.36Å; R234-E237 PolarHBondContact O-N 2.93Å; P235-E237 PolarHBondContact O-N 3.47Å
238	L	95.7	Very high	94.2	Very high	34 Å²	34	63.9 Å²	63.9	18%	0.178	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-98.2	-7.5	176.1	-60	179.4	0	0	0	113.1	H204 A207 R208 K233 P235 V236	H204-L238 HydrophobicContact CB-CD1 3.92Å; A207-L238 HydrophobicContact CB-CB 4.18Å; R208-L238 HydrophobicContact CG-CB 4.15Å; R208-L238 HydrophobicContact CG-CD1 4.09Å; K233-L238 HydrophobicContact CB-CD2 4.24Å; K233-L238 HydrophobicContact CD-CD2 3.66Å; P235-L238 WeakPolarHBondContact O-CB 3.4Å; P235-L238 PolarHBondContact O-N 3.25Å; V236-L238 PolarHBondContact O-N 2.86Å
239	V	95.3	Very high	93.8	Very high	16 Å²	16	57.7 Å²	57.7	10%	0.097	32%	0.321	C	S	.	.	S	Bend	trans	-76.6	137.9	-177.5	-179.6	0	0	0	0	110	A207 V236 L245 A246 F249	A207-V239 HydrophobicContact CB-CG2 3.86Å; V236-V239 PolarHBondContact O-N 2.95Å; V239-L245 HydrophobicContact CG1-CB 3.93Å; V239-L245 HydrophobicContact CG2-CD2 4.02Å; V239-A246 HydrophobicContact CG1-CB 4.17Å; V239-F249 HydrophobicContact CG2-CD2 3.83Å; V239-F249 HydrophobicContact CG2-CE2 3.59Å
240	P	92.7	Very high	93.3	Very high	55 Å²	55	63 Å²	63	36%	0.357	35%	0.349	S	S	.	.			trans	-58.2	139.5	171.6	-23.6	34.2	0	0	0	111.4	A210 E242 S243	A210-P240 HydrophobicContact CB-CG 4.11Å; P240-E242 PolarHBondContact O-N 3.04Å; P240-E242 VanDerWaalsContact O-N 3.1Å; P240-S243 VanDerWaalsContact O-CB 3.29Å; P240-S243 WeakPolarHBondContact O-CB 3.27Å; P240-S243 PolarHBondContact O-N 3.47Å
241	P	87.7	Confident	92.9	Very high	123 Å²	123	66.5 Å²	66.5	80%	0.799	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.4	-173.6	24.1	-34.4	0	0	0	114	S243	P241-S243 VanDerWaalsContact C-N 3.32Å
242	E	89.3	Confident	92.3	Very high	181 Å²	181	66.4 Å²	66.4	85%	0.846	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-5.5	178.7	-55.9	-61.4	156.9	0	0	113.3	P240	P240-E242 PolarHBondContact O-N 3.04Å; P240-E242 VanDerWaalsContact O-N 3.1Å
243	S	92	Very high	91.5	Very high	15 Å²	15	68.8 Å²	68.8	11%	0.105	35%	0.349	C	S	.	.			trans	-82.7	131.5	-174	-179	0	0	0	0	111.5	P240 P241 L245 A246	P240-S243 VanDerWaalsContact O-CB 3.29Å; P240-S243 WeakPolarHBondContact O-CB 3.27Å; P240-S243 PolarHBondContact O-N 3.47Å; P241-S243 VanDerWaalsContact C-N 3.32Å; S243-L245 PolarHBondContact O-N 3Å; S243-L245 VanDerWaalsContact OG-CB 3.23Å; S243-L245 WeakPolarHBondContact OG-CB 3.38Å; S243-L245 PolarHBondContact OG-N 2.82Å; S243-A246 PolarHBondContact O-N 3.13Å; S243-A246 VanDerWaalsContact O-N 3.1Å
244	P	91.3	Very high	91	Very high	71 Å²	71	66.4 Å²	66.4	46%	0.461	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-22.2	170.8	-24.3	33.1	0	0	0	113.7	E212 A246 Q247 L248	E212-P244 WeakPolarHBondContact OE1-CB 3.35Å; E212-P244 VanDerWaalsContact OE1-CD 3.23Å; E212-P244 WeakPolarHBondContact OE1-CD 3.39Å; E212-P244 WeakPolarHBondContact OE1-CG 3.37Å; P244-A246 PolarHBondContact O-N 3.19Å; P244-Q247 WeakPolarHBondContact O-CB 3.31Å; P244-Q247 PolarHBondContact O-N 3.15Å; P244-L248 PolarHBondContact O-N 3.38Å; P244-L248 VanDerWaalsContact O-N 3.08Å
245	L	91.9	Very high	90.7	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-59.7	-28.6	178.3	-149.1	173.5	0	0	0	112	E212 A215 V239 S243 L248 F249	E212-L245 HydrophobicContact CG-CB 4.15Å; E212-L245 HydrophobicContact CG-CD1 4.43Å; E212-L245 HydrophobicContact CG-CG 4.28Å; A215-L245 HydrophobicContact CB-CD1 4.03Å; A215-L245 HydrophobicContact CB-CD2 3.95Å; A215-L245 HydrophobicContact CB-CG 4.06Å; V239-L245 HydrophobicContact CG1-CB 3.93Å; V239-L245 HydrophobicContact CG2-CD2 4.02Å; S243-L245 PolarHBondContact O-N 3Å; S243-L245 VanDerWaalsContact OG-CB 3.23Å; S243-L245 WeakPolarHBondContact OG-CB 3.38Å; S243-L245 PolarHBondContact OG-N 2.82Å; L245-L248 WeakPolarHBondContact O-CB 3.14Å; L245-L248 PolarHBondContact O-N 3.28Å; L245-F249 HydrophobicContact CD2-CD2 3.22Å; L245-F249 HydrophobicContact CD2-CE2 2.99Å; L245-F249 HydrophobicContact CD2-CG 4.28Å; L245-F249 HydrophobicContact CD2-CZ 3.89Å; L245-F249 HydrophobicContact CG-CE2 4.48Å; L245-F249 VanDerWaalsContact O-CD2 3.3Å; L245-F249 WeakPolarHBondContact O-CD2 3.45Å; L245-F249 PolarHBondContact O-N 2.94Å
246	A	90.6	Very high	90.6	Very high	32 Å²	32	72.9 Å²	72.9	26%	0.264	40%	0.401	S	S	.	.	H	α-helix	trans	-65.2	-40.7	174	0	0	0	0	0	112	V239 S243 P244 F249 L250	V239-A246 HydrophobicContact CG1-CB 4.17Å; S243-A246 PolarHBondContact O-N 3.13Å; S243-A246 VanDerWaalsContact O-N 3.1Å; P244-A246 PolarHBondContact O-N 3.19Å; A246-F249 PolarHBondContact O-N 3.48Å; A246-L250 PolarHBondContact O-N 2.82Å; A246-L250 VanDerWaalsContact O-N 3.17Å
247	Q	89.9	Confident	90.6	Very high	134 Å²	134	74.8 Å²	74.8	63%	0.626	42%	0.415	S	S	*	.	H	α-helix	trans	-66.3	-43.3	174.6	-64.1	-179.3	-4.7	0	0	110.5	P244 F249 L250 E251	P244-Q247 WeakPolarHBondContact O-CB 3.31Å; P244-Q247 PolarHBondContact O-N 3.15Å; Q247-F249 VanDerWaalsContact C-N 3.34Å; Q247-F249 PolarHBondContact O-N 2.96Å; Q247-L250 WeakPolarHBondContact O-CB 3.12Å; Q247-L250 PolarHBondContact O-N 2.91Å; Q247-L250 VanDerWaalsContact O-N 3.11Å; Q247-E251 WeakPolarHBondContact O-CG 3.29Å; Q247-E251 PolarHBondContact O-N 2.99Å
248	L	91.2	Very high	90.6	Very high	29 Å²	29	76.7 Å²	76.7	15%	0.152	43%	0.428	C	S	.	.	H	α-helix	trans	-57.2	-44.9	176.5	-178.9	72.1	0	0	0	112.4	A215 C216 M219 P244 L245 L250 E251 R252	A215-L248 HydrophobicContact CB-CD2 4.46Å; C216-L248 WeakPolarHBondContact SG-CD2 3.48Å; M219-L248 HydrophobicContact CE-CD2 4.35Å; P244-L248 PolarHBondContact O-N 3.38Å; P244-L248 VanDerWaalsContact O-N 3.08Å; L245-L248 WeakPolarHBondContact O-CB 3.14Å; L245-L248 PolarHBondContact O-N 3.28Å; L248-L250 VanDerWaalsContact C-N 3.34Å; L248-E251 PolarHBondContact O-N 3.38Å; L248-R252 WeakPolarHBondContact O-CB 3.16Å; L248-R252 VanDerWaalsContact O-CG 3.23Å; L248-R252 WeakPolarHBondContact O-CG 3.43Å; L248-R252 PolarHBondContact O-N 3.39Å; L248-R252 VanDerWaalsContact O-N 3.12Å
249	F	90.4	Very high	90.7	Very high	4 Å²	4	80 Å²	80	2%	0.018	44%	0.444	C	S	.	.	H	α-helix	trans	-61.6	-42.8	175.7	-87.5	-63.8	0	0	0	112	L203 A207 M219 T225 P235 V236 V239 L245 A246 Q247 R252 E253	L203-F249 HydrophobicContact CD1-CE1 4.21Å; L203-F249 HydrophobicContact CD1-CZ 3.98Å; L203-F249 HydrophobicContact CD2-CE1 3.8Å; L203-F249 HydrophobicContact CD2-CZ 4.24Å; L203-F249 HydrophobicContact CG-CE1 4.02Å; L203-F249 HydrophobicContact CG-CZ 3.93Å; A207-F249 HydrophobicContact CB-CE2 4.28Å; A207-F249 HydrophobicContact CB-CZ 4.49Å; M219-F249 HydrophobicContact CE-CD1 3.37Å; M219-F249 HydrophobicContact CE-CE1 3.23Å; M219-F249 HydrophobicContact CE-CE2 4.46Å; M219-F249 HydrophobicContact CE-CG 4.05Å; M219-F249 HydrophobicContact CE-CZ 3.81Å; T225-F249 HydrophobicContact CG2-CD1 4.07Å; T225-F249 HydrophobicContact CG2-CE1 4.09Å; P235-F249 HydrophobicContact CB-CE1 3.86Å; P235-F249 HydrophobicContact CB-CE2 4.29Å; P235-F249 HydrophobicContact CB-CZ 3.54Å; V236-F249 HydrophobicContact CB-CB 3.82Å; V236-F249 HydrophobicContact CB-CD1 4.37Å; V236-F249 HydrophobicContact CB-CD2 3.9Å; V236-F249 HydrophobicContact CB-CG 3.82Å; V236-F249 HydrophobicContact CG2-CB 3.56Å; V236-F249 HydrophobicContact CG2-CD2 4.06Å; V236-F249 HydrophobicContact CG2-CG 4.02Å; V239-F249 HydrophobicContact CG2-CD2 3.83Å; V239-F249 HydrophobicContact CG2-CE2 3.59Å; L245-F249 HydrophobicContact CD2-CD2 3.22Å; L245-F249 HydrophobicContact CD2-CE2 2.99Å; L245-F249 HydrophobicContact CD2-CG 4.28Å; L245-F249 HydrophobicContact CD2-CZ 3.89Å; L245-F249 HydrophobicContact CG-CE2 4.48Å; L245-F249 VanDerWaalsContact O-CD2 3.3Å; L245-F249 WeakPolarHBondContact O-CD2 3.45Å; L245-F249 PolarHBondContact O-N 2.94Å; A246-F249 PolarHBondContact O-N 3.48Å; Q247-F249 VanDerWaalsContact C-N 3.34Å; Q247-F249 PolarHBondContact O-N 2.96Å; F249-R252 CarbonylContact O-C 3.41Å; F249-R252 PolarHBondContact O-N 3.31Å; F249-E253 WeakPolarHBondContact O-CG 3.34Å; F249-E253 PolarHBondContact O-N 3.33Å
250	L	87.8	Confident	90.7	Very high	116 Å²	116	80.2 Å²	80.2	61%	0.607	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-42.5	179.8	-169.7	63.1	0	0	0	111.8	A246 Q247 L248 R252 E253	A246-L250 PolarHBondContact O-N 2.82Å; A246-L250 VanDerWaalsContact O-N 3.17Å; Q247-L250 WeakPolarHBondContact O-CB 3.12Å; Q247-L250 PolarHBondContact O-N 2.91Å; Q247-L250 VanDerWaalsContact O-N 3.11Å; L248-L250 VanDerWaalsContact C-N 3.34Å; L250-R252 PolarHBondContact O-N 2.85Å; L250-E253 WeakPolarHBondContact CD1-OE2 3.35Å; L250-E253 PolarHBondContact O-N 3.36Å
251	E	88.2	Confident	90.9	Very high	143 Å²	143	81.6 Å²	81.6	67%	0.668	45%	0.448	S	S	*	.	H	α-helix	trans	-61.6	-29.8	174.1	-72.5	176.8	-176.3	0	0	112.5	Q247 L248	Q247-E251 WeakPolarHBondContact O-CG 3.29Å; Q247-E251 PolarHBondContact O-N 2.99Å; L248-E251 PolarHBondContact O-N 3.38Å
252	R	86.2	Confident	91.4	Very high	125 Å²	125	78.6 Å²	78.6	47%	0.472	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	10.6	-178.7	-62	-72.7	-176	127	3.3	113.6	M219 L248 F249 L250 G254	M219-R252 HydrophobicContact SD-CB 4.18Å; M219-R252 HydrophobicContact SD-CG 4.03Å; L248-R252 WeakPolarHBondContact O-CB 3.16Å; L248-R252 VanDerWaalsContact O-CG 3.23Å; L248-R252 WeakPolarHBondContact O-CG 3.43Å; L248-R252 PolarHBondContact O-N 3.39Å; L248-R252 VanDerWaalsContact O-N 3.12Å; F249-R252 CarbonylContact O-C 3.41Å; F249-R252 PolarHBondContact O-N 3.31Å; L250-R252 PolarHBondContact O-N 2.85Å; R252-G254 VanDerWaalsContact C-N 3.25Å; R252-G254 PolarHBondContact O-N 2.98Å
253	E	80.8	Confident	91.8	Very high	87 Å²	87	71 Å²	71	41%	0.407	39%	0.392	S	S	.	.	S	Bend	trans	-68.8	-25.7	174.2	-81.3	-162.4	145.7	0	0	112.6	R234 F249 L250	R234-E253 IonicContact CZ-OE1 3.73Å; R234-E253 IonicContact NH1-OE1 2.94Å; R234-E253 PolarHBondContact NH1-OE1 3.3Å; R234-E253 IonicContact NH2-OE1 3.6Å; F249-E253 WeakPolarHBondContact O-CG 3.34Å; F249-E253 PolarHBondContact O-N 3.33Å; L250-E253 WeakPolarHBondContact CD1-OE2 3.35Å; L250-E253 PolarHBondContact O-N 3.36Å
254	G	86.9	Confident	92.1	Very high	45 Å²	45	72.6 Å²	72.6	46%	0.464	40%	0.4	S	S	.	.	S	Bend	trans	-66.9	163	176.3	0	0	0	0	0	113.5	R252	R252-G254 VanDerWaalsContact C-N 3.25Å; R252-G254 PolarHBondContact O-N 2.98Å
255	P	90.3	Very high	92.4	Very high	123 Å²	123	76.6 Å²	76.6	80%	0.799	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-59.4	139.9	174.7	25.8	-33.7	0	0	0	110.6
256	P	92.9	Very high	92.7	Very high	71 Å²	71	79.3 Å²	79.3	46%	0.461	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-58.2	155.5	174.7	-22.7	32.1	0	0	0	112	Q260 L261	P256-Q260 HydrophobicContact CB-CB 3.95Å; P256-Q260 HydrophobicContact CB-CG 3.72Å; P256-L261 HydrophobicContact CB-CD2 4.1Å; P256-L261 HydrophobicContact CB-CG 4.35Å; P256-L261 HydrophobicContact CG-CD2 4.16Å
257	S	95.3	Very high	93	Very high	73 Å²	73	78.6 Å²	78.6	51%	0.51	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-57.6	152.1	173.6	72.7	0	0	0	0	111.3	M259 Q260 L261	S257-M259 PolarHBondContact O-N 3.16Å; S257-Q260 WeakPolarHBondContact O-CA 3.24Å; S257-Q260 WeakPolarHBondContact O-CB 3.23Å; S257-Q260 PolarHBondContact O-N 3.45Å; S257-Q260 PolarHBondContact OG-N 3.18Å; S257-L261 PolarHBondContact O-N 2.87Å
258	L	96.9	Very high	93.3	Very high	133 Å²	133	80.7 Å²	80.7	70%	0.696	42%	0.417	S	S	*	.	H	α-helix	trans	-55.9	-37	177.1	-179.7	60.8	0	0	0	111.9	Q260 L261 C262	L258-Q260 VanDerWaalsContact C-N 3.33Å; L258-Q260 PolarHBondContact O-N 3.42Å; L258-L261 PolarHBondContact O-N 3.01Å; L258-C262 WeakPolarHBondContact O-CB 3.32Å; L258-C262 PolarHBondContact O-N 3.11Å; L258-C262 PolarHBondContact O-SG 3.21Å
259	M	96.9	Very high	93.6	Very high	105 Å²	105	83.4 Å²	83.4	52%	0.517	44%	0.438	S	S	.	.	H	α-helix	trans	-59.8	-42.7	174.1	-72.4	-176.8	66.8	0	0	112.1	S257 C262 R263 L287 F290	S257-M259 PolarHBondContact O-N 3.16Å; M259-C262 PolarHBondContact O-N 3.37Å; M259-R263 PolarHBondContact O-N 3.46Å; M259-L287 HydrophobicContact CE-CD2 4.33Å; M259-F290 HydrophobicContact CB-CE1 4.26Å; M259-F290 HydrophobicContact CB-CZ 4.1Å; M259-F290 HydrophobicContact CE-CD1 4.46Å; M259-F290 HydrophobicContact CE-CE1 4.31Å; M259-F290 HydrophobicContact CE-CZ 4.45Å
260	Q	96.4	Very high	93.9	Very high	20 Å²	20	85.4 Å²	85.4	9%	0.093	45%	0.446	C	S	.	.	H	α-helix	trans	-65	-43.9	176.6	177.1	59	4	0	0	111.7	D220 P256 S257 L258 C262 R263 L264	D220-Q260 PolarHBondContact O-NE2 3.37Å; P256-Q260 HydrophobicContact CB-CB 3.95Å; P256-Q260 HydrophobicContact CB-CG 3.72Å; S257-Q260 WeakPolarHBondContact O-CA 3.24Å; S257-Q260 WeakPolarHBondContact O-CB 3.23Å; S257-Q260 PolarHBondContact O-N 3.45Å; S257-Q260 PolarHBondContact OG-N 3.18Å; L258-Q260 VanDerWaalsContact C-N 3.33Å; L258-Q260 PolarHBondContact O-N 3.42Å; Q260-C262 VanDerWaalsContact C-N 3.31Å; Q260-C262 PolarHBondContact O-N 2.89Å; Q260-R263 WeakPolarHBondContact O-CB 3.48Å; Q260-R263 PolarHBondContact O-N 2.9Å; Q260-L264 HydrophobicContact CG-CD1 4.37Å; Q260-L264 WeakPolarHBondContact O-CG 3.36Å; Q260-L264 PolarHBondContact O-N 2.98Å
261	L	96.9	Very high	94.3	Very high	83 Å²	83	81.9 Å²	81.9	44%	0.435	44%	0.438	S	S	.	.	H	α-helix	trans	-59.4	-43.1	175.9	-63.5	177.8	0	0	0	111.6	P256 S257 L258 R265	P256-L261 HydrophobicContact CB-CD2 4.1Å; P256-L261 HydrophobicContact CB-CG 4.35Å; P256-L261 HydrophobicContact CG-CD2 4.16Å; S257-L261 PolarHBondContact O-N 2.87Å; L258-L261 PolarHBondContact O-N 3.01Å; L261-R265 WeakPolarHBondContact O-CB 3.27Å; L261-R265 PolarHBondContact O-N 3.31Å
262	C	97.6	Very high	94.7	Very high	60 Å²	60	78.2 Å²	78.2	41%	0.405	42%	0.422	S	S	.	.	H	α-helix	trans	-61.5	-44.3	174.3	-71.6	0	0	0	0	111.9	L258 M259 Q260 R265 I266	L258-C262 WeakPolarHBondContact O-CB 3.32Å; L258-C262 PolarHBondContact O-N 3.11Å; L258-C262 PolarHBondContact O-SG 3.21Å; M259-C262 PolarHBondContact O-N 3.37Å; Q260-C262 VanDerWaalsContact C-N 3.31Å; Q260-C262 PolarHBondContact O-N 2.89Å; C262-R265 PolarHBondContact O-N 3.44Å; C262-I266 WeakPolarHBondContact O-CB 3.49Å; C262-I266 VanDerWaalsContact O-CG1 3.25Å; C262-I266 WeakPolarHBondContact O-CG1 3.41Å; C262-I266 PolarHBondContact O-N 2.93Å
263	R	98	Very high	95.1	Very high	21 Å²	21	75 Å²	75	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-57.5	-52.4	177.2	176.4	164.4	70.5	171.4	4.1	112	D220 M259 Q260 R265 I266 R267 F290 L291 H293	D220-R263 PolarHBondContact O-NH2 3.35Å; D220-R263 VanDerWaalsContact O-NH2 3.15Å; M259-R263 PolarHBondContact O-N 3.46Å; Q260-R263 WeakPolarHBondContact O-CB 3.48Å; Q260-R263 PolarHBondContact O-N 2.9Å; R263-R265 VanDerWaalsContact C-N 3.3Å; R263-R265 PolarHBondContact O-N 3.45Å; R263-I266 PolarHBondContact O-N 3.09Å; R263-R267 HydrophobicContact CG-CG 4.47Å; R263-R267 WeakPolarHBondContact O-CB 3.29Å; R263-R267 WeakPolarHBondContact O-CG 3.44Å; R263-R267 PolarHBondContact O-N 2.92Å; R263-F290 HydrophobicContact CB-CD1 4.46Å; R263-F290 HydrophobicContact CB-CE1 3.65Å; R263-F290 HydrophobicContact CB-CZ 3.97Å; R263-F290 WeakPolarHBondContact CD-O 3.28Å; R263-F290 HydrophobicContact CG-CE1 4.27Å; R263-F290 HydrophobicContact CG-CZ 4.49Å; R263-F290 PolarHBondContact NH1-O 3.41Å; R263-L291 HydrophobicContact CB-CD2 4.01Å; R263-L291 HydrophobicContact CG-CD2 4.09Å; R263-H293 PolarHBondContact NH1-CD2 3.34Å
264	L	97	Very high	95.9	Very high	50 Å²	50	74.1 Å²	74.1	26%	0.262	41%	0.408	S	S	.	.	H	α-helix	trans	-59.1	-43.6	178.7	-63.1	177	0	0	0	111.1	F221 Q260 K268	F221-L264 VanDerWaalsContact O-CD2 3.28Å; F221-L264 WeakPolarHBondContact O-CD2 3.3Å; Q260-L264 HydrophobicContact CG-CD1 4.37Å; Q260-L264 WeakPolarHBondContact O-CG 3.36Å; Q260-L264 PolarHBondContact O-N 2.98Å; L264-K268 WeakPolarHBondContact O-CB 3.2Å; L264-K268 PolarHBondContact O-N 3.12Å; L264-K268 VanDerWaalsContact O-N 3.09Å
265	R	97.8	Very high	96.4	Very high	155 Å²	155	72.6 Å²	72.6	59%	0.585	39%	0.389	S	S	*	.	H	α-helix	trans	-66.1	-41	-179.9	-176.9	62.6	-168.2	88.3	-2.9	113	L261 C262 R263 C269	L261-R265 WeakPolarHBondContact O-CB 3.27Å; L261-R265 PolarHBondContact O-N 3.31Å; C262-R265 PolarHBondContact O-N 3.44Å; R263-R265 VanDerWaalsContact C-N 3.3Å; R263-R265 PolarHBondContact O-N 3.45Å; R265-C269 PolarHBondContact NH1-SG 3.04Å
266	I	97.8	Very high	96.7	Very high	56 Å²	56	71.8 Å²	71.8	29%	0.287	38%	0.375	S	S	.	.	H	α-helix	trans	-68.8	-47.1	179.1	-70.2	164.9	0	0	0	110.3	C262 R263 K268 C269 F270 L291	C262-I266 WeakPolarHBondContact O-CB 3.49Å; C262-I266 VanDerWaalsContact O-CG1 3.25Å; C262-I266 WeakPolarHBondContact O-CG1 3.41Å; C262-I266 PolarHBondContact O-N 2.93Å; R263-I266 PolarHBondContact O-N 3.09Å; I266-K268 VanDerWaalsContact C-N 3.28Å; I266-K268 PolarHBondContact O-N 3.38Å; I266-C269 VanDerWaalsContact O-CB 3.27Å; I266-C269 WeakPolarHBondContact O-CB 3.41Å; I266-C269 PolarHBondContact O-N 3.26Å; I266-F270 HydrophobicContact CG2-CE2 4.01Å; I266-F270 VanDerWaalsContact O-CD2 3.3Å; I266-F270 WeakPolarHBondContact O-CD2 3.26Å; I266-L291 HydrophobicContact CB-CD2 4.15Å; I266-L291 HydrophobicContact CD1-CD1 4.27Å; I266-L291 HydrophobicContact CD1-CD2 3.9Å; I266-L291 HydrophobicContact CG2-CD1 4.13Å; I266-L291 HydrophobicContact CG2-CD2 4.2Å
267	R	98	Very high	96.9	Very high	17 Å²	17	72.5 Å²	72.5	6%	0.064	37%	0.37	C	S	.	.	H	α-helix	trans	-58.7	-40.4	178.3	-71.4	179.9	64.1	78	8.7	111.8	L187 E188 R263 C269 F270 H275 L291	L187-R267 PolarHBondContact O-NH2 2.97Å; E188-R267 PolarHBondContact O-NH2 3.43Å; R263-R267 HydrophobicContact CG-CG 4.47Å; R263-R267 WeakPolarHBondContact O-CB 3.29Å; R263-R267 WeakPolarHBondContact O-CG 3.44Å; R263-R267 PolarHBondContact O-N 2.92Å; R267-C269 PolarHBondContact O-N 3.11Å; R267-F270 PolarHBondContact O-N 2.91Å; R267-H275 PolarHBondContact O-NE2 3.3Å; R267-L291 WeakPolarHBondContact CD-O 3.43Å; R267-L291 PolarHBondContact NH1-O 2.8Å
268	K	96.8	Very high	97	Very high	178 Å²	178	69 Å²	69	77%	0.774	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.5	175.5	-165.4	173.1	-174.5	175.6	0	114.4	L264 I266 F270	L264-K268 WeakPolarHBondContact O-CB 3.2Å; L264-K268 PolarHBondContact O-N 3.12Å; L264-K268 VanDerWaalsContact O-N 3.09Å; I266-K268 VanDerWaalsContact C-N 3.28Å; I266-K268 PolarHBondContact O-N 3.38Å; K268-F270 VanDerWaalsContact C-N 3.32Å
269	C	97.4	Very high	97	Very high	87 Å²	87	66.2 Å²	66.2	59%	0.588	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-14.7	174.1	-63.1	0	0	0	0	113.7	R265 I266 R267	R265-C269 PolarHBondContact NH1-SG 3.04Å; I266-C269 VanDerWaalsContact O-CB 3.27Å; I266-C269 WeakPolarHBondContact O-CB 3.41Å; I266-C269 PolarHBondContact O-N 3.26Å; R267-C269 PolarHBondContact O-N 3.11Å
270	F	96.9	Very high	97	Very high	45 Å²	45	69.2 Å²	69.2	20%	0.197	35%	0.345	C	S	.	.	S	Bend	trans	-99.8	139.2	-179.8	-63.6	-88.1	0	0	0	109.9	I266 R267 K268 Q274 K277 I278 L281	I266-F270 HydrophobicContact CG2-CE2 4.01Å; I266-F270 VanDerWaalsContact O-CD2 3.3Å; I266-F270 WeakPolarHBondContact O-CD2 3.26Å; R267-F270 PolarHBondContact O-N 2.91Å; K268-F270 VanDerWaalsContact C-N 3.32Å; F270-Q274 HydrophobicContact CB-CB 4.24Å; F270-Q274 WeakPolarHBondContact CD1-O 3.17Å; F270-K277 HydrophobicContact CD1-CB 4.23Å; F270-K277 HydrophobicContact CE1-CB 3.86Å; F270-I278 HydrophobicContact CD2-CD1 4.31Å; F270-I278 HydrophobicContact CD2-CG1 4.16Å; F270-I278 HydrophobicContact CE1-CG1 4.23Å; F270-I278 HydrophobicContact CE2-CD1 4.05Å; F270-I278 HydrophobicContact CE2-CG1 3.52Å; F270-I278 HydrophobicContact CZ-CG1 3.57Å; F270-L281 HydrophobicContact CZ-CD1 4.34Å
271	G	95.8	Very high	97	Very high	42 Å²	42	71.3 Å²	71.3	43%	0.433	36%	0.356	S	S	.	.			trans	-73.2	178.3	170.7	0	0	0	0	0	112.5	Q273 Q274	G271-Q273 PolarHBondContact O-N 3.34Å; G271-Q274 VanDerWaalsContact O-CB 3.31Å; G271-Q274 WeakPolarHBondContact O-CB 3.45Å; G271-Q274 PolarHBondContact O-N 3.15Å
272	I	95.9	Very high	97	Very high	67 Å²	67	74.5 Å²	74.5	34%	0.344	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	131.9	179.6	-54.3	-50.8	0	0	0	111.2	I154 I160 S189 G190 Q274	I154-I272 HydrophobicContact CG2-CG2 3.56Å; I160-I272 HydrophobicContact CB-CG2 4.49Å; I160-I272 HydrophobicContact CD1-CG2 4.3Å; I160-I272 HydrophobicContact CG2-CD1 3.7Å; I160-I272 HydrophobicContact CG2-CG1 3.92Å; I160-I272 HydrophobicContact CG2-CG2 4.12Å; S189-I272 CarbonylContact O-C 3.58Å; S189-I272 WeakPolarHBondContact O-CA 3.4Å; G190-I272 VanDerWaalsContact O-CD1 3.25Å; G190-I272 WeakPolarHBondContact O-CD1 3.33Å; I272-Q274 WeakPolarHBondContact O-CG 3.39Å; I272-Q274 PolarHBondContact O-N 2.95Å; I272-Q274 PolarHBondContact O-NE2 2.72Å
273	Q	94.1	Very high	97	Very high	58 Å²	58	74.5 Å²	74.5	27%	0.271	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	18.8	-174.8	-67.9	-175.4	-17.7	0	0	115.1	N151 I154 S189 G271 H276	N151-Q273 PolarHBondContact O-NE2 3.32Å; I154-Q273 HydrophobicContact CG2-CG 3.85Å; S189-Q273 PolarHBondContact O-N 3.43Å; G271-Q273 PolarHBondContact O-N 3.34Å; Q273-H276 PolarHBondContact O-CD2 3.39Å
274	Q	97.3	Very high	97	Very high	67 Å²	67	77.4 Å²	77.4	31%	0.313	40%	0.396	S	S	.	.			trans	-98.6	-3.3	178.6	-55.3	-52.7	-62.6	0	0	114	F270 G271 I272 H276 K277	F270-Q274 HydrophobicContact CB-CB 4.24Å; F270-Q274 WeakPolarHBondContact CD1-O 3.17Å; G271-Q274 VanDerWaalsContact O-CB 3.31Å; G271-Q274 WeakPolarHBondContact O-CB 3.45Å; G271-Q274 PolarHBondContact O-N 3.15Å; I272-Q274 WeakPolarHBondContact O-CG 3.39Å; I272-Q274 PolarHBondContact O-N 2.95Å; I272-Q274 PolarHBondContact O-NE2 2.72Å; Q274-H276 PolarHBondContact O-N 3.37Å; Q274-H276 VanDerWaalsContact O-N 3.16Å; Q274-K277 HydrophobicContact CB-CD 4.4Å; Q274-K277 VanDerWaalsContact O-CB 3.3Å; Q274-K277 WeakPolarHBondContact O-CB 3.43Å; Q274-K277 WeakPolarHBondContact O-CG 3.37Å; Q274-K277 PolarHBondContact O-N 3.32Å
275	H	97.5	Very high	97	Very high	13 Å²	13	79.8 Å²	79.8	6%	0.06	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-59.1	-28.2	-176.5	-60.5	93.5	0	0	0	113.4	E188 R267 K277 I278 L292	E188-H275 PolarHBondContact O-ND1 3.29Å; R267-H275 PolarHBondContact O-NE2 3.3Å; H275-K277 PolarHBondContact O-N 3.08Å; H275-I278 HydrophobicContact CB-CD1 4.36Å; H275-I278 VanDerWaalsContact O-CB 3.24Å; H275-I278 WeakPolarHBondContact O-CB 3.48Å; H275-I278 WeakPolarHBondContact O-CD1 3.48Å; H275-I278 WeakPolarHBondContact O-CG1 3.45Å; H275-I278 PolarHBondContact O-N 2.96Å; H275-L292 HydrophobicContact CB-CD2 4.27Å; H275-L292 WeakPolarHBondContact O-CD2 3.46Å
276	H	96.2	Very high	97	Very high	106 Å²	106	78.3 Å²	78.3	49%	0.491	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-57.2	-21.7	175.2	72.9	93.9	0	0	0	113.2	Q273 Q274 I278 T279	Q273-H276 PolarHBondContact O-CD2 3.39Å; Q274-H276 PolarHBondContact O-N 3.37Å; Q274-H276 VanDerWaalsContact O-N 3.16Å; H276-I278 PolarHBondContact O-N 2.85Å; H276-T279 WeakPolarHBondContact O-CB 3.24Å; H276-T279 WeakPolarHBondContact O-CG2 3.48Å; H276-T279 PolarHBondContact O-N 3.07Å; H276-T279 PolarHBondContact O-OG1 3.43Å
277	K	97.4	Very high	96.9	Very high	86 Å²	86	79 Å²	79	37%	0.374	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-66.9	-12.9	175.1	-64.3	178.2	179.5	171.3	0	113.4	F270 Q274 H275 T279 K280	F270-K277 HydrophobicContact CD1-CB 4.23Å; F270-K277 HydrophobicContact CE1-CB 3.86Å; Q274-K277 HydrophobicContact CB-CD 4.4Å; Q274-K277 VanDerWaalsContact O-CB 3.3Å; Q274-K277 WeakPolarHBondContact O-CB 3.43Å; Q274-K277 WeakPolarHBondContact O-CG 3.37Å; Q274-K277 PolarHBondContact O-N 3.32Å; H275-K277 PolarHBondContact O-N 3.08Å; K277-T279 PolarHBondContact O-N 3.19Å; K277-K280 WeakPolarHBondContact O-CB 3.39Å; K277-K280 PolarHBondContact O-N 2.8Å
278	I	97.3	Very high	96.9	Very high	0 Å²	0	79.5 Å²	79.5	0%	0	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-55.4	-31.3	170.8	-70.2	167	0	0	0	111.3	F270 H275 H276 K280 L281 K288 L291 L292	F270-I278 HydrophobicContact CD2-CD1 4.31Å; F270-I278 HydrophobicContact CD2-CG1 4.16Å; F270-I278 HydrophobicContact CE1-CG1 4.23Å; F270-I278 HydrophobicContact CE2-CD1 4.05Å; F270-I278 HydrophobicContact CE2-CG1 3.52Å; F270-I278 HydrophobicContact CZ-CG1 3.57Å; H275-I278 HydrophobicContact CB-CD1 4.36Å; H275-I278 VanDerWaalsContact O-CB 3.24Å; H275-I278 WeakPolarHBondContact O-CB 3.48Å; H275-I278 WeakPolarHBondContact O-CD1 3.48Å; H275-I278 WeakPolarHBondContact O-CG1 3.45Å; H275-I278 PolarHBondContact O-N 2.96Å; H276-I278 PolarHBondContact O-N 2.85Å; I278-K280 PolarHBondContact O-N 3.31Å; I278-K280 VanDerWaalsContact O-N 3.09Å; I278-L281 HydrophobicContact CB-CD1 4.47Å; I278-L281 HydrophobicContact CG1-CD1 4.44Å; I278-L281 HydrophobicContact CG2-CD1 4.27Å; I278-L281 WeakPolarHBondContact O-CB 3.22Å; I278-L281 WeakPolarHBondContact O-CG 3.29Å; I278-L281 PolarHBondContact O-N 3.47Å; I278-K288 HydrophobicContact CG2-CB 4.24Å; I278-K288 HydrophobicContact CG2-CG 4.3Å; I278-L291 HydrophobicContact CD1-CB 4.11Å; I278-L291 HydrophobicContact CG2-CB 4.12Å; I278-L291 HydrophobicContact CG2-CD1 3.97Å; I278-L292 HydrophobicContact CB-CD2 4.36Å; I278-L292 HydrophobicContact CB-CG 4.47Å; I278-L292 HydrophobicContact CD1-CD2 4.05Å; I278-L292 HydrophobicContact CD1-CG 4.49Å; I278-L292 HydrophobicContact CG2-CG 4.42Å
279	T	96.7	Very high	96.9	Very high	74 Å²	74	74.9 Å²	74.9	45%	0.454	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-55	-28.6	174.9	54.8	0	0	0	0	113.6	H276 K277 K288 L292	H276-T279 WeakPolarHBondContact O-CB 3.24Å; H276-T279 WeakPolarHBondContact O-CG2 3.48Å; H276-T279 PolarHBondContact O-N 3.07Å; H276-T279 PolarHBondContact O-OG1 3.43Å; K277-T279 PolarHBondContact O-N 3.19Å; T279-K288 PolarHBondContact O-NZ 2.97Å; T279-L292 HydrophobicContact CG2-CD1 4.41Å
280	K	96.9	Very high	96.9	Very high	168 Å²	168	73.4 Å²	73.4	73%	0.73	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-83.1	-8.3	-179.6	-56.8	-174.9	176.6	-173.9	0	113.9	K277 I278	K277-K280 WeakPolarHBondContact O-CB 3.39Å; K277-K280 PolarHBondContact O-N 2.8Å; I278-K280 PolarHBondContact O-N 3.31Å; I278-K280 VanDerWaalsContact O-N 3.09Å
281	L	96.9	Very high	96.9	Very high	64 Å²	64	71.6 Å²	71.6	34%	0.335	37%	0.373	S	S	.	.	S	Bend	trans	-75	148.9	178.8	-56.9	177.4	0	0	0	110.9	F270 I278 L283 K288	F270-L281 HydrophobicContact CZ-CD1 4.34Å; I278-L281 HydrophobicContact CB-CD1 4.47Å; I278-L281 HydrophobicContact CG1-CD1 4.44Å; I278-L281 HydrophobicContact CG2-CD1 4.27Å; I278-L281 WeakPolarHBondContact O-CB 3.22Å; I278-L281 WeakPolarHBondContact O-CG 3.29Å; I278-L281 PolarHBondContact O-N 3.47Å; L281-L283 VanDerWaalsContact C-N 3.26Å; L281-L283 HydrophobicContact CB-CD1 3.94Å; L281-L283 PolarHBondContact O-N 3.36Å; L281-K288 WeakPolarHBondContact O-CE 3.34Å; L281-K288 PolarHBondContact O-NZ 3.13Å
282	V	97.9	Very high	97	Very high	151 Å²	151	71 Å²	71	92%	0.915	36%	0.36	S	S	*	.	S	Bend	trans	-81.5	73.5	174.4	-172.6	0	0	0	0	109.3
283	L	96.9	Very high	97	Very high	60 Å²	60	69 Å²	69	31%	0.314	35%	0.35	S	S	.	.	S	Bend	trans	-130	154.6	177.8	-94.1	73.9	0	0	0	110.5	L281 L287 K288 L291	L281-L283 VanDerWaalsContact C-N 3.26Å; L281-L283 HydrophobicContact CB-CD1 3.94Å; L281-L283 PolarHBondContact O-N 3.36Å; L283-L287 HydrophobicContact CD2-CB 4.11Å; L283-K288 HydrophobicContact CB-CG 4.12Å; L283-K288 VanDerWaalsContact O-CE 3.23Å; L283-K288 WeakPolarHBondContact O-CE 3.28Å; L283-L291 HydrophobicContact CD2-CD1 3.85Å
284	P	97.7	Very high	96.9	Very high	82 Å²	82	74 Å²	74	53%	0.532	38%	0.377	S	S	.	.			trans	-52.3	145.6	163.7	-24.8	33.4	0	0	0	112.4	D286 L287 K288	P284-D286 PolarHBondContact O-N 3.34Å; P284-L287 HydrophobicContact CB-CG 4.37Å; P284-L287 HydrophobicContact CG-CD1 4.23Å; P284-L287 PolarHBondContact O-N 3.17Å; P284-L287 VanDerWaalsContact O-N 3.16Å; P284-K288 PolarHBondContact O-N 3.09Å; P284-K288 VanDerWaalsContact O-N 3.16Å
285	E	97.3	Very high	96.9	Very high	100 Å²	100	74.4 Å²	74.4	47%	0.467	38%	0.381	S	S	.	.	H	α-helix	trans	-62.6	-40.8	-175.3	-165.7	57.9	-147.7	0	0	112.3	L287 K288 Q289	E285-L287 PolarHBondContact O-N 2.97Å; E285-K288 WeakPolarHBondContact O-CA 3.31Å; E285-K288 WeakPolarHBondContact O-CB 3.41Å; E285-K288 PolarHBondContact O-N 3.17Å; E285-K288 WeakPolarHBondContact OE2-CD 3.49Å; E285-K288 IonicContact OE2-NZ 3.7Å; E285-Q289 PolarHBondContact O-N 3.44Å
286	D	97.4	Very high	96.9	Very high	123 Å²	123	77.6 Å²	77.6	66%	0.658	40%	0.397	S	S	*	.	H	α-helix	trans	-57.7	-37.5	176.9	-54.2	-23.2	0	0	0	112	P284 Q289 F290	P284-D286 PolarHBondContact O-N 3.34Å; D286-Q289 PolarHBondContact O-N 3.01Å; D286-F290 WeakPolarHBondContact O-CB 3.18Å; D286-F290 PolarHBondContact O-N 3.07Å
287	L	97.4	Very high	96.9	Very high	71 Å²	71	76.1 Å²	76.1	37%	0.372	39%	0.392	S	S	.	.	H	α-helix	trans	-72.3	-35.1	176.1	-64.2	-172.9	0	0	0	111.6	M259 L283 P284 E285 F290 L291	M259-L287 HydrophobicContact CE-CD2 4.33Å; L283-L287 HydrophobicContact CD2-CB 4.11Å; P284-L287 HydrophobicContact CB-CG 4.37Å; P284-L287 HydrophobicContact CG-CD1 4.23Å; P284-L287 PolarHBondContact O-N 3.17Å; P284-L287 VanDerWaalsContact O-N 3.16Å; E285-L287 PolarHBondContact O-N 2.97Å; L287-F290 PolarHBondContact O-N 2.94Å; L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 WeakPolarHBondContact O-CG 3.32Å; L287-L291 PolarHBondContact O-N 3.2Å
288	K	97.7	Very high	96.9	Very high	28 Å²	28	75.5 Å²	75.5	12%	0.122	39%	0.393	C	S	.	.	H	α-helix	trans	-64.2	-43.3	174	-65.8	174.6	-178.4	175.7	0	111.1	I278 T279 L281 L283 P284 E285 L291 L292	I278-K288 HydrophobicContact CG2-CB 4.24Å; I278-K288 HydrophobicContact CG2-CG 4.3Å; T279-K288 PolarHBondContact O-NZ 2.97Å; L281-K288 WeakPolarHBondContact O-CE 3.34Å; L281-K288 PolarHBondContact O-NZ 3.13Å; L283-K288 HydrophobicContact CB-CG 4.12Å; L283-K288 VanDerWaalsContact O-CE 3.23Å; L283-K288 WeakPolarHBondContact O-CE 3.28Å; P284-K288 PolarHBondContact O-N 3.09Å; P284-K288 VanDerWaalsContact O-N 3.16Å; E285-K288 WeakPolarHBondContact O-CA 3.31Å; E285-K288 WeakPolarHBondContact O-CB 3.41Å; E285-K288 PolarHBondContact O-N 3.17Å; E285-K288 WeakPolarHBondContact OE2-CD 3.49Å; E285-K288 IonicContact OE2-NZ 3.7Å; K288-L291 PolarHBondContact O-N 2.99Å; K288-L292 WeakPolarHBondContact O-CB 3.24Å; K288-L292 WeakPolarHBondContact O-CG 3.5Å; K288-L292 PolarHBondContact O-N 3.42Å
289	Q	96.9	Very high	96.9	Very high	80 Å²	80	80.2 Å²	80.2	37%	0.374	42%	0.418	S	S	.	.	H	α-helix	trans	-61.8	-46.8	175.7	-69.4	-179.9	-3.2	0	0	111.2	E285 D286 L291 L292 H293 L294	E285-Q289 PolarHBondContact O-N 3.44Å; D286-Q289 PolarHBondContact O-N 3.01Å; Q289-L291 VanDerWaalsContact C-N 3.3Å; Q289-L291 PolarHBondContact O-N 3.36Å; Q289-L292 CarbonylContact O-C 3.23Å; Q289-L292 WeakPolarHBondContact O-CA 3.3Å; Q289-L292 PolarHBondContact O-N 2.88Å; Q289-H293 PolarHBondContact O-N 3.16Å; Q289-L294 HydrophobicContact CB-CB 4.23Å; Q289-L294 PolarHBondContact O-N 2.97Å; Q289-L294 VanDerWaalsContact O-N 3.07Å
290	F	97.3	Very high	96.9	Very high	57 Å²	57	80.6 Å²	80.6	25%	0.25	42%	0.415	C	S	.	.	H	α-helix	trans	-55.4	-41.9	174.1	170.9	-107	0	0	0	113.2	M259 R263 D286 L287 L292 H293	M259-F290 HydrophobicContact CB-CE1 4.26Å; M259-F290 HydrophobicContact CB-CZ 4.1Å; M259-F290 HydrophobicContact CE-CD1 4.46Å; M259-F290 HydrophobicContact CE-CE1 4.31Å; M259-F290 HydrophobicContact CE-CZ 4.45Å; R263-F290 HydrophobicContact CB-CD1 4.46Å; R263-F290 HydrophobicContact CB-CE1 3.65Å; R263-F290 HydrophobicContact CB-CZ 3.97Å; R263-F290 WeakPolarHBondContact CD-O 3.28Å; R263-F290 HydrophobicContact CG-CE1 4.27Å; R263-F290 HydrophobicContact CG-CZ 4.49Å; R263-F290 PolarHBondContact NH1-O 3.41Å; D286-F290 WeakPolarHBondContact O-CB 3.18Å; D286-F290 PolarHBondContact O-N 3.07Å; L287-F290 PolarHBondContact O-N 2.94Å; F290-L292 VanDerWaalsContact C-N 3.33Å; F290-H293 PolarHBondContact O-N 3.49Å
291	L	97.2	Very high	96.9	Very high	6 Å²	6	74.4 Å²	74.4	3%	0.031	39%	0.393	C	S	.	.	H	α-helix	trans	-70.4	-27.1	177.1	-68	173	0	0	0	113.4	R263 I266 R267 I278 L283 L287 K288 Q289	R263-L291 HydrophobicContact CB-CD2 4.01Å; R263-L291 HydrophobicContact CG-CD2 4.09Å; I266-L291 HydrophobicContact CB-CD2 4.15Å; I266-L291 HydrophobicContact CD1-CD1 4.27Å; I266-L291 HydrophobicContact CD1-CD2 3.9Å; I266-L291 HydrophobicContact CG2-CD1 4.13Å; I266-L291 HydrophobicContact CG2-CD2 4.2Å; R267-L291 WeakPolarHBondContact CD-O 3.43Å; R267-L291 PolarHBondContact NH1-O 2.8Å; I278-L291 HydrophobicContact CD1-CB 4.11Å; I278-L291 HydrophobicContact CG2-CB 4.12Å; I278-L291 HydrophobicContact CG2-CD1 3.97Å; L283-L291 HydrophobicContact CD2-CD1 3.85Å; L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 WeakPolarHBondContact O-CG 3.32Å; L287-L291 PolarHBondContact O-N 3.2Å; K288-L291 PolarHBondContact O-N 2.99Å; Q289-L291 VanDerWaalsContact C-N 3.3Å; Q289-L291 PolarHBondContact O-N 3.36Å
292	L	96.6	Very high	96.9	Very high	31 Å²	31	75.2 Å²	75.2	16%	0.162	40%	0.397	C	S	.	.	H	α-helix	trans	-90.6	-2	177.8	-71.8	172	0	0	0	113.5	H275 I278 T279 K288 Q289 F290 L294	H275-L292 HydrophobicContact CB-CD2 4.27Å; H275-L292 WeakPolarHBondContact O-CD2 3.46Å; I278-L292 HydrophobicContact CB-CD2 4.36Å; I278-L292 HydrophobicContact CB-CG 4.47Å; I278-L292 HydrophobicContact CD1-CD2 4.05Å; I278-L292 HydrophobicContact CD1-CG 4.49Å; I278-L292 HydrophobicContact CG2-CG 4.42Å; T279-L292 HydrophobicContact CG2-CD1 4.41Å; K288-L292 WeakPolarHBondContact O-CB 3.24Å; K288-L292 WeakPolarHBondContact O-CG 3.5Å; K288-L292 PolarHBondContact O-N 3.42Å; Q289-L292 CarbonylContact O-C 3.23Å; Q289-L292 WeakPolarHBondContact O-CA 3.3Å; Q289-L292 PolarHBondContact O-N 2.88Å; F290-L292 VanDerWaalsContact C-N 3.33Å; L292-L294 VanDerWaalsContact C-N 3.27Å; L292-L294 HydrophobicContact CB-CD1 4.02Å; L292-L294 HydrophobicContact CB-CG 3.86Å; L292-L294 HydrophobicContact CD1-CD1 4.24Å; L292-L294 PolarHBondContact O-N 3.26Å
293	H	96.2	Very high	96.8	Very high	25 Å²	25	68.8 Å²	68.8	12%	0.116	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	38.9	-175.2	-64.6	78	0	0	0	112.8	D220 F221 R263 Q289 F290	D220-H293 PolarHBondContact O-NE2 2.93Å; D220-H293 VanDerWaalsContact O-NE2 3.09Å; F221-H293 AromaticContact CD1-CE1 3.77Å; F221-H293 AromaticContact CD1-NE2 3.95Å; F221-H293 AromaticContact CD2-CD2 3.87Å; F221-H293 AromaticContact CD2-NE2 3.7Å; F221-H293 AromaticContact CE1-CE1 3.55Å; F221-H293 AromaticContact CE1-ND1 3.64Å; F221-H293 AromaticContact CE1-NE2 3.9Å; F221-H293 HydrophobicContact CE2-CB 4.26Å; F221-H293 AromaticContact CE2-CD2 3.4Å; F221-H293 VanDerWaalsContact CE2-CD2 3.4Å; F221-H293 WeakPolarHBondContact CE2-CD2 3.43Å; F221-H293 AromaticContact CE2-CG 3.76Å; F221-H293 AromaticContact CE2-NE2 3.65Å; F221-H293 AromaticContact CG-NE2 3.87Å; F221-H293 HydrophobicContact CZ-CB 3.9Å; F221-H293 AromaticContact CZ-CD2 3.59Å; F221-H293 AromaticContact CZ-CE1 3.74Å; F221-H293 AromaticContact CZ-CG 3.46Å; F221-H293 VanDerWaalsContact CZ-CG 3.46Å; F221-H293 AromaticContact CZ-ND1 3.59Å; F221-H293 AromaticContact CZ-NE2 3.76Å; R263-H293 PolarHBondContact NH1-CD2 3.34Å; Q289-H293 PolarHBondContact O-N 3.16Å; F290-H293 PolarHBondContact O-N 3.49Å
294	L	93.2	Very high	96.8	Very high	163 Å²	163	69.6 Å²	69.6	85%	0.853	36%	0.358	S	S	*	.			trans	-98.6	0	174.1	-58.2	-179.4	0	0	0	112	Q289 L292	Q289-L294 HydrophobicContact CB-CB 4.23Å; Q289-L294 PolarHBondContact O-N 2.97Å; Q289-L294 VanDerWaalsContact O-N 3.07Å; L292-L294 VanDerWaalsContact C-N 3.27Å; L292-L294 HydrophobicContact CB-CD1 4.02Å; L292-L294 HydrophobicContact CB-CG 3.86Å; L292-L294 HydrophobicContact CD1-CD1 4.24Å; L292-L294 PolarHBondContact O-N 3.26Å

Retrieved 294 of 294 residues in 715.5 ms (Link to these results)

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