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Cytochrome b

Component of the ubiquinol-cytochrome c reductase complex (complex III or cytochrome b-c1 complex) that is part of the mitochondrial respiratory chain. The b-c1 complex mediates electron transfer from ubiquinol to cytochrome c. Contributes to the generation of a proton gradient across the mitochondrial membrane that is then used for ATP synthesis.

AlphaFold DB , UniProt , Accession A0A023NCR8, Species MOUSE (Mus musculus, Mouse), Gene cytB, Length 233 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	H	91	Very high	92.6	Very high	143 Å²	143	102.5 Å²	102.5	66%	0.662	51%	0.505	S	S	*	.				0	134.4	0	-171.1	-91	0	0	0	109.1	L3 F4 K5	H1-L3 VanDerWaalsContact C-N 3.31Å; H1-L3 PolarHBondContact ND1-N 3.39Å; H1-L3 PolarHBondContact O-N 3.37Å; H1-F4 HydrophobicContact CB-CB 4.17Å; H1-F4 HydrophobicContact CB-CD2 3.52Å; H1-F4 HydrophobicContact CB-CE2 4.2Å; H1-F4 HydrophobicContact CB-CG 4.06Å; H1-F4 PolarHBondContact O-N 3.16Å; H1-F4 VanDerWaalsContact O-N 3.1Å; H1-K5 PolarHBondContact O-N 3.03Å
2	P	92.1	Very high	92.9	Very high	102 Å²	102	99.3 Å²	99.3	66%	0.662	49%	0.491	S	S	*	.	H	α-helix	trans	-53.8	-40.7	-176.2	-28.7	36.2	0	0	0	114.5	K5 I6	P2-K5 WeakPolarHBondContact O-CB 3.46Å; P2-K5 PolarHBondContact O-N 3.39Å; P2-I6 PolarHBondContact O-N 3.47Å
3	L	91.4	Very high	93.2	Very high	113 Å²	113	98.5 Å²	98.5	59%	0.592	49%	0.489	S	S	*	.	H	α-helix	trans	-66.4	-44.3	175.5	-62.1	177.5	0	0	0	112.8	H1 K5 I6 I7	H1-L3 VanDerWaalsContact C-N 3.31Å; H1-L3 PolarHBondContact ND1-N 3.39Å; H1-L3 PolarHBondContact O-N 3.37Å; L3-K5 PolarHBondContact O-N 3.43Å; L3-I6 PolarHBondContact O-N 3.33Å; L3-I7 PolarHBondContact O-N 3.4Å
4	F	93.2	Very high	93.4	Very high	140 Å²	140	93.6 Å²	93.6	61%	0.614	47%	0.466	S	S	*	.	H	α-helix	trans	-66.2	-26.2	178	-63.8	-32.8	0	0	0	112.2	H1 I7 N8	H1-F4 HydrophobicContact CB-CB 4.17Å; H1-F4 HydrophobicContact CB-CD2 3.52Å; H1-F4 HydrophobicContact CB-CE2 4.2Å; H1-F4 HydrophobicContact CB-CG 4.06Å; H1-F4 PolarHBondContact O-N 3.16Å; H1-F4 VanDerWaalsContact O-N 3.1Å; F4-I7 HydrophobicContact CD1-CD1 4.35Å; F4-I7 PolarHBondContact O-N 2.99Å; F4-N8 WeakPolarHBondContact O-CB 3.46Å; F4-N8 PolarHBondContact O-N 3.23Å
5	K	93.5	Very high	93.7	Very high	134 Å²	134	91.9 Å²	91.9	58%	0.583	46%	0.464	S	S	*	.	H	α-helix	trans	-62	-44.4	174	-175.6	175.7	-179.4	-175.1	0	111.3	H1 P2 L3 N8 H9	H1-K5 PolarHBondContact O-N 3.03Å; P2-K5 WeakPolarHBondContact O-CB 3.46Å; P2-K5 PolarHBondContact O-N 3.39Å; L3-K5 PolarHBondContact O-N 3.43Å; K5-N8 PolarHBondContact O-N 3Å; K5-H9 PolarHBondContact O-CD2 3.5Å; K5-H9 PolarHBondContact O-N 2.56Å; K5-H9 VanDerWaalsContact O-N 3.08Å
6	I	94.3	Very high	93.9	Very high	118 Å²	118	86.4 Å²	86.4	61%	0.605	44%	0.438	S	S	*	.	H	α-helix	trans	-61.3	-53	177.4	-61	172	0	0	0	109.4	P2 L3 N8 H9 S10	P2-I6 PolarHBondContact O-N 3.47Å; L3-I6 PolarHBondContact O-N 3.33Å; I6-N8 VanDerWaalsContact C-N 3.3Å; I6-N8 PolarHBondContact O-N 3.44Å; I6-H9 PolarHBondContact O-N 2.75Å; I6-S10 WeakPolarHBondContact O-CB 3.34Å; I6-S10 PolarHBondContact O-N 2.98Å; I6-S10 PolarHBondContact O-OG 3.46Å
7	I	93.4	Very high	94.1	Very high	83 Å²	83	81.4 Å²	81.4	43%	0.426	41%	0.412	S	S	.	.	H	α-helix	trans	-57.4	-43.6	179.7	-64.2	171.4	0	0	0	111.3	L3 F4 S10 F11 I12	L3-I7 PolarHBondContact O-N 3.4Å; F4-I7 HydrophobicContact CD1-CD1 4.35Å; F4-I7 PolarHBondContact O-N 2.99Å; I7-S10 PolarHBondContact O-N 3.35Å; I7-F11 WeakPolarHBondContact O-CB 3.37Å; I7-F11 PolarHBondContact O-N 3.07Å; I7-I12 HydrophobicContact CG2-CD1 4.46Å
8	N	95.2	Very high	94.4	Very high	49 Å²	49	79.2 Å²	79.2	26%	0.262	41%	0.405	S	S	.	.	I	π-helix	trans	-63	-48.2	-177.9	-166.5	69.5	0	0	0	111.4	F4 K5 I6 S10 I12 D13	F4-N8 WeakPolarHBondContact O-CB 3.46Å; F4-N8 PolarHBondContact O-N 3.23Å; K5-N8 PolarHBondContact O-N 3Å; I6-N8 VanDerWaalsContact C-N 3.3Å; I6-N8 PolarHBondContact O-N 3.44Å; N8-S10 PolarHBondContact O-N 3.3Å; N8-I12 PolarHBondContact O-N 3.43Å; N8-I12 VanDerWaalsContact O-N 3.08Å; N8-D13 PolarHBondContact ND2-OD2 3.45Å; N8-D13 PolarHBondContact O-N 2.89Å
9	H	93.8	Very high	94.5	Very high	106 Å²	106	78.4 Å²	78.4	49%	0.491	40%	0.402	S	S	.	.	I	π-helix	trans	-73.6	-24	-179.1	-70	-61.4	0	0	0	114	K5 I6 L14	K5-H9 PolarHBondContact O-CD2 3.5Å; K5-H9 PolarHBondContact O-N 2.56Å; K5-H9 VanDerWaalsContact O-N 3.08Å; I6-H9 PolarHBondContact O-N 2.75Å; H9-L14 WeakPolarHBondContact O-CB 3.38Å
10	S	90.6	Very high	94.7	Very high	20 Å²	20	75.4 Å²	75.4	14%	0.14	39%	0.387	C	S	.	.	I	π-helix	trans	-96.6	-21.8	-179	60.2	0	0	0	0	114.8	I6 I7 N8	I6-S10 WeakPolarHBondContact O-CB 3.34Å; I6-S10 PolarHBondContact O-N 2.98Å; I6-S10 PolarHBondContact O-OG 3.46Å; I7-S10 PolarHBondContact O-N 3.35Å; N8-S10 PolarHBondContact O-N 3.3Å
11	F	90.6	Very high	94.9	Very high	119 Å²	119	73.4 Å²	73.4	52%	0.522	38%	0.38	S	S	.	.	I	π-helix	trans	-134.3	-18.3	-173.5	-72.5	-77.7	0	0	0	115.8	I7 F213	I7-F11 WeakPolarHBondContact O-CB 3.37Å; I7-F11 PolarHBondContact O-N 3.07Å; F11-F213 VanDerWaalsContact O-CD1 3.25Å; F11-F213 WeakPolarHBondContact O-CD1 3.13Å
12	I	95.9	Very high	95.2	Very high	65 Å²	65	70.4 Å²	70.4	33%	0.333	37%	0.374	S	S	.	.	I	π-helix	trans	-108	-69.3	-175.5	-54	179.8	0	0	0	109.9	I7 N8 L14 F213 H214	I7-I12 HydrophobicContact CG2-CD1 4.46Å; N8-I12 PolarHBondContact O-N 3.43Å; N8-I12 VanDerWaalsContact O-N 3.08Å; I12-L14 VanDerWaalsContact C-N 3.3Å; I12-L14 PolarHBondContact O-N 3.35Å; I12-F213 PolarHBondContact O-N 2.96Å; I12-H214 HydrophobicContact CG2-CB 4.02Å; I12-H214 PolarHBondContact O-N 3.49Å
13	D	96.1	Very high	95.5	Very high	88 Å²	88	70.3 Å²	70.3	47%	0.471	36%	0.361	S	S	.	.	S	Bend	trans	-92.2	12.1	-176.1	-67.6	-16.5	0	0	0	112.5	N8 P15	N8-D13 PolarHBondContact ND2-OD2 3.45Å; N8-D13 PolarHBondContact O-N 2.89Å; D13-P15 VanDerWaalsContact O-CD 3.26Å; D13-P15 WeakPolarHBondContact O-CD 3.39Å
14	L	96.8	Very high	95.9	Very high	30 Å²	30	66.1 Å²	66.1	16%	0.157	34%	0.337	C	S	.	.			trans	-58.2	118.7	175.6	175.6	71.8	0	0	0	109.1	H9 I12 A16 F213	H9-L14 WeakPolarHBondContact O-CB 3.38Å; I12-L14 VanDerWaalsContact C-N 3.3Å; I12-L14 PolarHBondContact O-N 3.35Å; L14-A16 PolarHBondContact O-N 2.96Å; L14-F213 HydrophobicContact CB-CB 3.96Å; L14-F213 HydrophobicContact CD2-CD2 4.14Å; L14-F213 WeakPolarHBondContact O-CB 3.36Å; L14-F213 PolarHBondContact O-N 2.77Å
15	P	96.9	Very high	96.1	Very high	69 Å²	69	60 Å²	60	45%	0.448	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113.5	-179.1	32.5	-35.6	0	0	0	109.8	D13 K210	D13-P15 VanDerWaalsContact O-CD 3.26Å; D13-P15 WeakPolarHBondContact O-CD 3.39Å; P15-K210 HydrophobicContact CB-CB 4.14Å; P15-K210 HydrophobicContact CB-CD 3.86Å
16	A	97.6	Very high	96.4	Very high	4 Å²	4	55.2 Å²	55.2	3%	0.033	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	145.8	-178.1	0	0	0	0	0	110.8	L14 S18 K210 I211 Y217	L14-A16 PolarHBondContact O-N 2.96Å; A16-S18 PolarHBondContact O-N 3.27Å; A16-K210 VanDerWaalsContact O-CA 3.31Å; A16-K210 WeakPolarHBondContact O-CA 3.24Å; A16-I211 PolarHBondContact N-O 3.49Å; A16-I211 PolarHBondContact O-N 2.99Å; A16-Y217 HydrophobicContact CB-CD2 3.58Å; A16-Y217 HydrophobicContact CB-CE2 3.42Å; A16-Y217 VanDerWaalsContact CB-CE2 3.42Å
17	P	98.1	Very high	96.5	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	137.7	175.2	-16.8	26.5	0	0	0	110.3	N19 I20 S198 N200 S206 Y217	P17-N19 PolarHBondContact O-N 3.49Å; P17-I20 HydrophobicContact CB-CG2 4.07Å; P17-I20 HydrophobicContact CG-CG2 4.09Å; P17-S198 WeakPolarHBondContact CG-O 3.44Å; P17-N200 HydrophobicContact CB-CB 3.74Å; P17-N200 HydrophobicContact CG-CB 4.05Å; P17-S206 WeakPolarHBondContact CG-OG 3.44Å; P17-Y217 PolarHBondContact O-OH 3.05Å
18	S	97.9	Very high	96.8	Very high	41 Å²	41	48.8 Å²	48.8	29%	0.287	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.9	-176.3	65.8	0	0	0	0	114.7	A16 D209 Y217	A16-S18 PolarHBondContact O-N 3.27Å; S18-D209 VanDerWaalsContact CB-OD2 3.3Å; S18-D209 WeakPolarHBondContact CB-OD2 3.3Å; S18-D209 PolarHBondContact N-O 3.49Å; S18-D209 VanDerWaalsContact OG-CG 3.24Å; S18-D209 PolarHBondContact OG-OD2 3.33Å; S18-Y217 VanDerWaalsContact C-OH 3.3Å; S18-Y217 PolarHBondContact O-OH 3.29Å
19	N	98	Very high	96.9	Very high	65 Å²	65	47 Å²	47	35%	0.348	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	15.4	-166.1	69	-26.7	0	0	0	114.7	P17 S21 N200 P201	P17-N19 PolarHBondContact O-N 3.49Å; N19-S21 PolarHBondContact O-N 2.86Å; N19-N200 PolarHBondContact ND2-OD1 3.01Å; N19-N200 VanDerWaalsContact ND2-OD1 3.14Å; N19-N200 WeakPolarHBondContact OD1-CB 3.38Å; N19-P201 VanDerWaalsContact O-CD 3.28Å; N19-P201 WeakPolarHBondContact O-CD 3.47Å; N19-P201 WeakPolarHBondContact O-CG 3.49Å
20	I	97.8	Very high	97.2	Very high	18 Å²	18	43.1 Å²	43.1	9%	0.092	24%	0.241	C	C	.	.			trans	-67.7	129.6	178.2	55.6	167.9	0	0	0	111.5	P17 W24 N199 N200 Y217 K220	P17-I20 HydrophobicContact CB-CG2 4.07Å; P17-I20 HydrophobicContact CG-CG2 4.09Å; I20-W24 HydrophobicContact CB-CB 4.01Å; I20-W24 HydrophobicContact CB-CD2 3.76Å; I20-W24 HydrophobicContact CB-CE3 4.27Å; I20-W24 HydrophobicContact CB-CG 3.61Å; I20-W24 HydrophobicContact CD1-CB 3.87Å; I20-W24 HydrophobicContact CD1-CG 3.95Å; I20-W24 HydrophobicContact CG1-CB 4.34Å; I20-W24 HydrophobicContact CG1-CG 4.31Å; I20-W24 HydrophobicContact CG2-CD2 3.81Å; I20-W24 HydrophobicContact CG2-CG 3.84Å; I20-W24 HydrophobicContact CG2-CZ2 4.36Å; I20-N199 WeakPolarHBondContact CG2-O 3.28Å; I20-N200 HydrophobicContact CG2-CB 4.05Å; I20-Y217 HydrophobicContact CD1-CD1 3.82Å; I20-Y217 HydrophobicContact CD1-CD2 4.3Å; I20-Y217 HydrophobicContact CD1-CE1 3.52Å; I20-Y217 HydrophobicContact CD1-CE2 3.97Å; I20-Y217 HydrophobicContact CD1-CG 4.24Å; I20-Y217 HydrophobicContact CG1-CD1 4.07Å; I20-Y217 HydrophobicContact CG1-CE1 3.25Å; I20-Y217 HydrophobicContact CG1-CE2 4.06Å; I20-Y217 WeakPolarHBondContact CG1-OH 3.46Å; I20-K220 PolarHBondContact O-NZ 3.23Å
21	S	98.1	Very high	97.6	Very high	34 Å²	34	43.9 Å²	43.9	24%	0.238	25%	0.252	C	S	.	.			trans	-83.1	-176.3	-174.9	63.6	0	0	0	0	112.8	N19 W23 W24 K220	N19-S21 PolarHBondContact O-N 2.86Å; S21-W23 PolarHBondContact O-N 3.12Å; S21-W23 VanDerWaalsContact O-N 3.16Å; S21-W24 PolarHBondContact O-N 3.43Å; S21-W24 VanDerWaalsContact O-N 3.15Å; S21-K220 VanDerWaalsContact C-NZ 3.26Å; S21-K220 PolarHBondContact O-NZ 2.77Å
22	S	97.9	Very high	97.9	Very high	79 Å²	79	39.1 Å²	39.1	55%	0.552	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-58.4	-24.5	177.3	52.3	0	0	0	0	113.5	W24 N25	S22-W24 PolarHBondContact O-N 2.84Å; S22-W24 VanDerWaalsContact O-N 3.16Å; S22-N25 VanDerWaalsContact CA-OD1 3.28Å; S22-N25 WeakPolarHBondContact CA-OD1 3.25Å; S22-N25 VanDerWaalsContact O-CB 3.32Å; S22-N25 WeakPolarHBondContact O-CB 3.3Å; S22-N25 PolarHBondContact O-N 2.8Å; S22-N25 PolarHBondContact O-OD1 2.92Å; S22-N25 VanDerWaalsContact O-OD1 3.06Å
23	W	98.6	Very high	98.1	Very high	101 Å²	101	36.3 Å²	36.3	38%	0.383	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-61.6	-21.9	177.1	-62	110.8	0	0	0	113.6	S21 F26 L89 R93 Y97	S21-W23 PolarHBondContact O-N 3.12Å; S21-W23 VanDerWaalsContact O-N 3.16Å; W23-F26 HydrophobicContact CE3-CD2 4.22Å; W23-F26 AromaticContact CE3-CE2 3.72Å; W23-F26 HydrophobicContact CE3-CE2 3.72Å; W23-F26 HydrophobicContact CZ3-CE2 4.11Å; W23-F26 WeakPolarHBondContact O-CD2 3.28Å; W23-L89 HydrophobicContact CH2-CD2 4.42Å; W23-L89 HydrophobicContact CZ3-CB 4.4Å; W23-L89 HydrophobicContact CZ3-CD2 3.85Å; W23-R93 HydrophobicContact CB-CB 4.1Å; W23-R93 HydrophobicContact CB-CG 3.58Å; W23-Y97 HydrophobicContact CB-CE2 4.32Å; W23-Y97 HydrophobicContact CG-CE2 4.26Å
24	W	98.6	Very high	98.2	Very high	24 Å²	24	33 Å²	33	9%	0.091	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-77.7	-19.5	175.9	-88.9	-113.3	0	0	0	113.6	I20 S21 S22 F26 G27 R93 Y97 N199 P201	I20-W24 HydrophobicContact CB-CB 4.01Å; I20-W24 HydrophobicContact CB-CD2 3.76Å; I20-W24 HydrophobicContact CB-CE3 4.27Å; I20-W24 HydrophobicContact CB-CG 3.61Å; I20-W24 HydrophobicContact CD1-CB 3.87Å; I20-W24 HydrophobicContact CD1-CG 3.95Å; I20-W24 HydrophobicContact CG1-CB 4.34Å; I20-W24 HydrophobicContact CG1-CG 4.31Å; I20-W24 HydrophobicContact CG2-CD2 3.81Å; I20-W24 HydrophobicContact CG2-CG 3.84Å; I20-W24 HydrophobicContact CG2-CZ2 4.36Å; S21-W24 PolarHBondContact O-N 3.43Å; S21-W24 VanDerWaalsContact O-N 3.15Å; S22-W24 PolarHBondContact O-N 2.84Å; S22-W24 VanDerWaalsContact O-N 3.16Å; W24-F26 PolarHBondContact O-N 3.11Å; W24-G27 PolarHBondContact O-N 3.28Å; W24-R93 HydrophobicContact CE3-CG 4.29Å; W24-R93 HydrophobicContact CZ3-CG 4.15Å; W24-Y97 HydrophobicContact CH2-CD1 4.21Å; W24-Y97 AromaticContact CH2-CD2 3.61Å; W24-Y97 HydrophobicContact CH2-CD2 3.61Å; W24-Y97 HydrophobicContact CH2-CE2 4.07Å; W24-Y97 AromaticContact CH2-CG 3.67Å; W24-Y97 HydrophobicContact CH2-CG 3.67Å; W24-Y97 AromaticContact CZ3-CD2 3.64Å; W24-Y97 HydrophobicContact CZ3-CD2 3.64Å; W24-Y97 AromaticContact CZ3-CE2 3.64Å; W24-Y97 HydrophobicContact CZ3-CE2 3.64Å; W24-Y97 HydrophobicContact CZ3-CG 4.12Å; W24-N199 VanDerWaalsContact CE2-O 3.23Å; W24-N199 HydrophobicContact CZ2-CB 4.35Å; W24-N199 WeakPolarHBondContact CZ2-O 3.44Å; W24-N199 PolarHBondContact NE1-O 2.86Å; W24-P201 HydrophobicContact CH2-CG 4.2Å; W24-P201 HydrophobicContact CZ3-CG 3.93Å
25	N	98.6	Very high	98.3	Very high	11 Å²	11	36.8 Å²	36.8	6%	0.059	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-66.8	-23.6	179.1	-64.3	81.9	0	0	0	112.6	S22 G27 S28 L29 K220 D221	S22-N25 VanDerWaalsContact CA-OD1 3.28Å; S22-N25 WeakPolarHBondContact CA-OD1 3.25Å; S22-N25 VanDerWaalsContact O-CB 3.32Å; S22-N25 WeakPolarHBondContact O-CB 3.3Å; S22-N25 PolarHBondContact O-N 2.8Å; S22-N25 PolarHBondContact O-OD1 2.92Å; S22-N25 VanDerWaalsContact O-OD1 3.06Å; N25-G27 PolarHBondContact O-N 2.91Å; N25-S28 PolarHBondContact O-N 3.38Å; N25-S28 VanDerWaalsContact O-N 3.08Å; N25-S28 PolarHBondContact O-OG 3.47Å; N25-L29 WeakPolarHBondContact O-CG 3.24Å; N25-L29 PolarHBondContact O-N 2.97Å; N25-K220 PolarHBondContact ND2-O 3.34Å; N25-K220 WeakPolarHBondContact OD1-CE 3.5Å; N25-K220 PolarHBondContact OD1-NZ 3.42Å; N25-D221 PolarHBondContact ND2-OD1 3.42Å
26	F	98.7	Very high	98.4	Very high	35 Å²	35	34.6 Å²	34.6	15%	0.154	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-20.1	-179	-69.1	-68.9	0	0	0	113.5	W23 W24 L29 L30 C86 L89 H90	W23-F26 HydrophobicContact CE3-CD2 4.22Å; W23-F26 AromaticContact CE3-CE2 3.72Å; W23-F26 HydrophobicContact CE3-CE2 3.72Å; W23-F26 HydrophobicContact CZ3-CE2 4.11Å; W23-F26 WeakPolarHBondContact O-CD2 3.28Å; W24-F26 PolarHBondContact O-N 3.11Å; F26-L29 HydrophobicContact CD1-CD1 3.84Å; F26-L29 HydrophobicContact CE1-CD1 4.02Å; F26-L30 WeakPolarHBondContact O-CB 3.27Å; F26-L30 WeakPolarHBondContact O-CD1 3.31Å; F26-L30 WeakPolarHBondContact O-CG 3.23Å; F26-L30 PolarHBondContact O-N 3.21Å; F26-L30 VanDerWaalsContact O-N 3.11Å; F26-C86 HydrophobicContact CD1-CB 4.15Å; F26-L89 HydrophobicContact CD1-CB 4.03Å; F26-L89 HydrophobicContact CD1-CD1 4.31Å; F26-L89 HydrophobicContact CD2-CB 3.9Å; F26-L89 HydrophobicContact CE1-CB 3.9Å; F26-L89 HydrophobicContact CE1-CD1 3.44Å; F26-L89 VanDerWaalsContact CE1-CD1 3.44Å; F26-L89 HydrophobicContact CE1-CG 4.3Å; F26-L89 HydrophobicContact CE2-CB 3.76Å; F26-L89 HydrophobicContact CE2-CD1 4.18Å; F26-L89 HydrophobicContact CE2-CG 4.5Å; F26-L89 HydrophobicContact CG-CB 4.06Å; F26-L89 HydrophobicContact CZ-CB 3.77Å; F26-L89 HydrophobicContact CZ-CD1 3.37Å; F26-L89 HydrophobicContact CZ-CG 4.14Å; F26-H90 HydrophobicContact CB-CB 3.9Å
27	G	98.2	Very high	98.4	Very high	33 Å²	33	35.5 Å²	35.5	34%	0.34	21%	0.208	S	C	.	.	H	α-helix	trans	-64.7	-49.7	171.3	0	0	0	0	0	112.7	W24 N25 L30 G31 H90	W24-G27 PolarHBondContact O-N 3.28Å; N25-G27 PolarHBondContact O-N 2.91Å; G27-L30 PolarHBondContact O-N 3.27Å; G27-G31 PolarHBondContact O-N 2.93Å; G27-H90 PolarHBondContact N-ND1 3.26Å
28	S	98.1	Very high	98.5	Very high	32 Å²	32	37.3 Å²	37.3	22%	0.224	22%	0.218	C	C	.	.	H	α-helix	trans	-70.9	-37.1	177.9	47.8	0	0	0	0	112.2	N25 L30 G31 V32 D221	N25-S28 PolarHBondContact O-N 3.38Å; N25-S28 VanDerWaalsContact O-N 3.08Å; N25-S28 PolarHBondContact O-OG 3.47Å; S28-L30 VanDerWaalsContact C-N 3.31Å; S28-L30 PolarHBondContact O-N 3.48Å; S28-G31 PolarHBondContact O-N 3.25Å; S28-G31 VanDerWaalsContact O-N 3.12Å; S28-V32 PolarHBondContact O-N 2.94Å; S28-D221 WeakPolarHBondContact CB-OD2 3.41Å; S28-D221 PolarHBondContact OG-OD1 3.21Å; S28-D221 PolarHBondContact OG-OD2 3.18Å
29	L	98.8	Very high	98.5	Very high	13 Å²	13	40 Å²	40	7%	0.068	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-40.5	173.7	-63	-178.6	0	0	0	112.3	N25 F26 G31 V32 C33 I225 M228	N25-L29 WeakPolarHBondContact O-CG 3.24Å; N25-L29 PolarHBondContact O-N 2.97Å; F26-L29 HydrophobicContact CD1-CD1 3.84Å; F26-L29 HydrophobicContact CE1-CD1 4.02Å; L29-G31 VanDerWaalsContact C-N 3.34Å; L29-G31 PolarHBondContact O-N 3.07Å; L29-V32 PolarHBondContact O-N 2.76Å; L29-C33 PolarHBondContact O-N 3.3Å; L29-C33 PolarHBondContact O-SG 3.06Å; L29-C33 VanDerWaalsContact O-SG 3.34Å; L29-I225 HydrophobicContact CD2-CB 4.45Å; L29-I225 HydrophobicContact CD2-CG1 3.85Å; L29-M228 HydrophobicContact CB-SD 4.05Å; L29-M228 HydrophobicContact CD2-CB 4Å; L29-M228 HydrophobicContact CD2-CE 4.48Å; L29-M228 HydrophobicContact CD2-SD 3.9Å; L29-M228 HydrophobicContact CG-SD 4.41Å
30	L	98.9	Very high	98.6	Very high	24 Å²	24	37.3 Å²	37.3	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-39.5	174.6	-74.7	169.8	0	0	0	112.6	F26 G27 S28 V32 C33 L34 F83 C86 L87 H90	F26-L30 WeakPolarHBondContact O-CB 3.27Å; F26-L30 WeakPolarHBondContact O-CD1 3.31Å; F26-L30 WeakPolarHBondContact O-CG 3.23Å; F26-L30 PolarHBondContact O-N 3.21Å; F26-L30 VanDerWaalsContact O-N 3.11Å; G27-L30 PolarHBondContact O-N 3.27Å; S28-L30 VanDerWaalsContact C-N 3.31Å; S28-L30 PolarHBondContact O-N 3.48Å; L30-V32 VanDerWaalsContact C-N 3.34Å; L30-C33 PolarHBondContact O-N 3.28Å; L30-L34 PolarHBondContact O-N 3.48Å; L30-F83 HydrophobicContact CD2-CD2 3.57Å; L30-F83 HydrophobicContact CD2-CE2 3.54Å; L30-C86 HydrophobicContact CD2-CB 3.63Å; L30-C86 HydrophobicContact CG-CB 3.99Å; L30-L87 HydrophobicContact CD1-CD2 4.01Å; L30-L87 HydrophobicContact CD2-CB 4.3Å; L30-L87 HydrophobicContact CD2-CD2 3.86Å; L30-L87 HydrophobicContact CD2-CG 3.6Å; L30-H90 HydrophobicContact CD1-CB 3.78Å
31	G	98.6	Very high	98.6	Very high	36 Å²	36	37.2 Å²	37.2	37%	0.371	22%	0.217	S	C	.	.	H	α-helix	trans	-60.2	-43.1	172.8	0	0	0	0	0	112.3	G27 S28 L29 L34 M35	G27-G31 PolarHBondContact O-N 2.93Å; S28-G31 PolarHBondContact O-N 3.25Å; S28-G31 VanDerWaalsContact O-N 3.12Å; L29-G31 VanDerWaalsContact C-N 3.34Å; L29-G31 PolarHBondContact O-N 3.07Å; G31-L34 PolarHBondContact O-N 2.78Å; G31-M35 WeakPolarHBondContact O-CG 3.42Å; G31-M35 PolarHBondContact O-N 3.19Å; G31-M35 VanDerWaalsContact O-N 3.1Å
32	V	98.6	Very high	98.6	Very high	19 Å²	19	39.2 Å²	39.2	12%	0.115	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-44.2	175.9	178.3	0	0	0	0	111.7	S28 L29 L30 L34 M35 V36 I225 M228 F229	S28-V32 PolarHBondContact O-N 2.94Å; L29-V32 PolarHBondContact O-N 2.76Å; L30-V32 VanDerWaalsContact C-N 3.34Å; V32-L34 VanDerWaalsContact C-N 3.29Å; V32-L34 PolarHBondContact O-N 2.71Å; V32-M35 HydrophobicContact CB-CE 4.43Å; V32-M35 HydrophobicContact CG2-CE 4.01Å; V32-M35 PolarHBondContact O-N 2.58Å; V32-V36 HydrophobicContact CG1-CG2 4.27Å; V32-V36 WeakPolarHBondContact O-CG2 3.5Å; V32-V36 PolarHBondContact O-N 3.15Å; V32-I225 HydrophobicContact CG2-CD1 3.78Å; V32-I225 HydrophobicContact CG2-CG1 3.98Å; V32-M228 HydrophobicContact CB-CE 4.19Å; V32-M228 HydrophobicContact CG1-CE 3.7Å; V32-F229 HydrophobicContact CG1-CE2 3.93Å; V32-F229 HydrophobicContact CG1-CZ 3.86Å
33	C	98.8	Very high	98.7	Very high	6 Å²	6	40.3 Å²	40.3	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-54.5	-46.2	173.8	-74.3	0	0	0	0	111.1	L29 L30 M35 V36 Q37 F83 M228	L29-C33 PolarHBondContact O-N 3.3Å; L29-C33 PolarHBondContact O-SG 3.06Å; L29-C33 VanDerWaalsContact O-SG 3.34Å; L30-C33 PolarHBondContact O-N 3.28Å; C33-M35 PolarHBondContact O-N 3.2Å; C33-V36 PolarHBondContact O-N 3.16Å; C33-Q37 VanDerWaalsContact O-CG 3.31Å; C33-Q37 WeakPolarHBondContact O-CG 3.24Å; C33-Q37 PolarHBondContact O-N 3.39Å; C33-F83 HydrophobicContact CB-CB 4.14Å; C33-F83 HydrophobicContact CB-CD1 3.69Å; C33-F83 HydrophobicContact CB-CD2 4.44Å; C33-F83 HydrophobicContact CB-CE1 4.18Å; C33-F83 HydrophobicContact CB-CG 3.83Å; C33-M228 VanDerWaalsContact SG-SD 3.65Å
34	L	98.8	Very high	98.7	Very high	18 Å²	18	36.7 Å²	36.7	9%	0.094	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-45.6	177.1	-177.7	62.2	0	0	0	112.4	L30 G31 V32 Q37 I38 F83 I182 A183	L30-L34 PolarHBondContact O-N 3.48Å; G31-L34 PolarHBondContact O-N 2.78Å; V32-L34 VanDerWaalsContact C-N 3.29Å; V32-L34 PolarHBondContact O-N 2.71Å; L34-Q37 PolarHBondContact O-N 3.14Å; L34-I38 HydrophobicContact CD1-CD1 3.96Å; L34-I38 HydrophobicContact CD1-CG1 4.28Å; L34-I38 HydrophobicContact CG-CD1 3.91Å; L34-I38 WeakPolarHBondContact O-CG1 3.28Å; L34-I38 PolarHBondContact O-N 2.81Å; L34-F83 HydrophobicContact CB-CE1 3.97Å; L34-F83 HydrophobicContact CB-CZ 4.18Å; L34-F83 HydrophobicContact CD1-CE1 4.17Å; L34-F83 HydrophobicContact CD1-CZ 4.47Å; L34-I182 HydrophobicContact CD1-CB 4.37Å; L34-I182 HydrophobicContact CD1-CG2 3.89Å; L34-I182 HydrophobicContact CD2-CG2 3.97Å; L34-A183 HydrophobicContact CD2-CB 4.02Å
35	M	98.7	Very high	98.7	Very high	109 Å²	109	36.6 Å²	36.6	54%	0.537	21%	0.212	S	C	.	.	H	α-helix	trans	-61.8	-45	176.5	-70	-171.9	-66.5	0	0	111.9	G31 V32 C33 Q37 I38 I39	G31-M35 WeakPolarHBondContact O-CG 3.42Å; G31-M35 PolarHBondContact O-N 3.19Å; G31-M35 VanDerWaalsContact O-N 3.1Å; V32-M35 HydrophobicContact CB-CE 4.43Å; V32-M35 HydrophobicContact CG2-CE 4.01Å; V32-M35 PolarHBondContact O-N 2.58Å; C33-M35 PolarHBondContact O-N 3.2Å; M35-Q37 VanDerWaalsContact C-N 3.34Å; M35-Q37 PolarHBondContact O-N 3.19Å; M35-I38 PolarHBondContact O-N 2.88Å; M35-I39 WeakPolarHBondContact O-CB 3.19Å; M35-I39 VanDerWaalsContact O-CG1 3.26Å; M35-I39 WeakPolarHBondContact O-CG1 3.17Å; M35-I39 PolarHBondContact O-N 3.14Å
36	V	98.6	Very high	98.7	Very high	23 Å²	23	41.8 Å²	41.8	14%	0.139	24%	0.237	C	C	.	.	H	α-helix	trans	-58.6	-46.3	176.5	170.5	0	0	0	0	110.6	V32 C33 I39 T40 F229	V32-V36 HydrophobicContact CG1-CG2 4.27Å; V32-V36 WeakPolarHBondContact O-CG2 3.5Å; V32-V36 PolarHBondContact O-N 3.15Å; C33-V36 PolarHBondContact O-N 3.16Å; V36-I39 PolarHBondContact O-N 3.46Å; V36-T40 HydrophobicContact CG1-CG2 4.28Å; V36-T40 WeakPolarHBondContact O-CB 3.39Å; V36-T40 WeakPolarHBondContact O-CG2 3.33Å; V36-T40 PolarHBondContact O-N 3.31Å; V36-T40 PolarHBondContact O-OG1 3.08Å; V36-F229 HydrophobicContact CG2-CE1 4.05Å; V36-F229 HydrophobicContact CG2-CZ 3.92Å
37	Q	98.8	Very high	98.7	Very high	23 Å²	23	44 Å²	44	11%	0.107	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-42.8	179.5	-67.8	-50.1	102.9	0	0	112.5	C33 L34 M35 T40 G41 H76 G79 F83	C33-Q37 VanDerWaalsContact O-CG 3.31Å; C33-Q37 WeakPolarHBondContact O-CG 3.24Å; C33-Q37 PolarHBondContact O-N 3.39Å; L34-Q37 PolarHBondContact O-N 3.14Å; M35-Q37 VanDerWaalsContact C-N 3.34Å; M35-Q37 PolarHBondContact O-N 3.19Å; Q37-T40 PolarHBondContact O-OG1 3.48Å; Q37-G41 WeakPolarHBondContact O-CA 3.2Å; Q37-G41 PolarHBondContact O-N 3.33Å; Q37-H76 PolarHBondContact NE2-O 3.34Å; Q37-H76 PolarHBondContact O-CE1 2.88Å; Q37-H76 VanDerWaalsContact O-CE1 3.25Å; Q37-H76 PolarHBondContact O-ND1 3.31Å; Q37-H76 PolarHBondContact OE1-O 2.91Å; Q37-G79 VanDerWaalsContact OE1-C 3.31Å; Q37-F83 HydrophobicContact CG-CD1 4Å
38	I	98.9	Very high	98.7	Very high	40 Å²	40	43.7 Å²	43.7	21%	0.205	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-47.8	178.4	-69.7	169.6	0	0	0	110.6	L34 M35 L42 P179 F180	L34-I38 HydrophobicContact CD1-CD1 3.96Å; L34-I38 HydrophobicContact CD1-CG1 4.28Å; L34-I38 HydrophobicContact CG-CD1 3.91Å; L34-I38 WeakPolarHBondContact O-CG1 3.28Å; L34-I38 PolarHBondContact O-N 2.81Å; M35-I38 PolarHBondContact O-N 2.88Å; I38-L42 VanDerWaalsContact O-CB 3.29Å; I38-L42 WeakPolarHBondContact O-CB 3.46Å; I38-L42 PolarHBondContact O-N 3.19Å; I38-P179 HydrophobicContact CD1-CB 4.23Å; I38-P179 HydrophobicContact CG1-CB 3.72Å; I38-F180 HydrophobicContact CG2-CE1 4.08Å; I38-F180 HydrophobicContact CG2-CZ 4.25Å
39	I	98.8	Very high	98.8	Very high	97 Å²	97	45.1 Å²	45.1	50%	0.497	24%	0.244	S	C	.	.	H	α-helix	trans	-64.4	-56	-178.4	-66.3	166.6	0	0	0	109.8	M35 V36 G41 L42 F43	M35-I39 WeakPolarHBondContact O-CB 3.19Å; M35-I39 VanDerWaalsContact O-CG1 3.26Å; M35-I39 WeakPolarHBondContact O-CG1 3.17Å; M35-I39 PolarHBondContact O-N 3.14Å; V36-I39 PolarHBondContact O-N 3.46Å; I39-G41 VanDerWaalsContact C-N 3.31Å; I39-G41 PolarHBondContact O-N 2.9Å; I39-L42 PolarHBondContact O-N 3.42Å; I39-F43 HydrophobicContact CG2-CD2 4.13Å; I39-F43 HydrophobicContact CG2-CE2 4.13Å; I39-F43 WeakPolarHBondContact O-CD2 3.26Å; I39-F43 PolarHBondContact O-N 2.82Å
40	T	98.8	Very high	98.7	Very high	8 Å²	8	46 Å²	46	5%	0.049	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-40.8	-179.4	54.6	0	0	0	0	111.8	V36 Q37 L42 F43 L44 I72 M75 H76	V36-T40 HydrophobicContact CG1-CG2 4.28Å; V36-T40 WeakPolarHBondContact O-CB 3.39Å; V36-T40 WeakPolarHBondContact O-CG2 3.33Å; V36-T40 PolarHBondContact O-N 3.31Å; V36-T40 PolarHBondContact O-OG1 3.08Å; Q37-T40 PolarHBondContact O-OG1 3.48Å; T40-L42 PolarHBondContact O-N 3.06Å; T40-F43 PolarHBondContact O-N 2.86Å; T40-L44 VanDerWaalsContact O-CG 3.26Å; T40-L44 WeakPolarHBondContact O-CG 3.28Å; T40-L44 PolarHBondContact O-N 3.29Å; T40-I72 HydrophobicContact CG2-CG2 4.22Å; T40-M75 HydrophobicContact CG2-CB 4.19Å; T40-M75 HydrophobicContact CG2-CE 4.15Å; T40-H76 PolarHBondContact OG1-ND1 3.08Å
41	G	98.8	Very high	98.7	Very high	17 Å²	17	46.7 Å²	46.7	18%	0.175	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-40.9	178	0	0	0	0	0	112.8	Q37 I39 L44 A45 H76	Q37-G41 WeakPolarHBondContact O-CA 3.2Å; Q37-G41 PolarHBondContact O-N 3.33Å; I39-G41 VanDerWaalsContact C-N 3.31Å; I39-G41 PolarHBondContact O-N 2.9Å; G41-L44 PolarHBondContact O-N 3.08Å; G41-A45 WeakPolarHBondContact O-CB 3.48Å; G41-A45 PolarHBondContact O-N 3.46Å; G41-H76 VanDerWaalsContact CA-CE1 3.44Å; G41-H76 WeakPolarHBondContact CA-CE1 3.14Å; G41-H76 PolarHBondContact N-ND1 3.43Å
42	L	98.8	Very high	98.7	Very high	75 Å²	75	46.4 Å²	46.4	39%	0.393	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-46.7	175.4	179.4	64.7	0	0	0	111.7	I38 I39 T40 L44 A45 M46 F176	I38-L42 VanDerWaalsContact O-CB 3.29Å; I38-L42 WeakPolarHBondContact O-CB 3.46Å; I38-L42 PolarHBondContact O-N 3.19Å; I39-L42 PolarHBondContact O-N 3.42Å; T40-L42 PolarHBondContact O-N 3.06Å; L42-L44 VanDerWaalsContact C-N 3.35Å; L42-L44 PolarHBondContact O-N 3.44Å; L42-A45 PolarHBondContact O-N 3.31Å; L42-M46 HydrophobicContact CD1-CE 4.42Å; L42-M46 HydrophobicContact CD2-CE 4.42Å; L42-M46 HydrophobicContact CG-CE 4Å; L42-M46 WeakPolarHBondContact O-CG 3.03Å; L42-M46 PolarHBondContact O-N 2.9Å; L42-F176 HydrophobicContact CD1-CE2 4.23Å; L42-F176 HydrophobicContact CD1-CZ 3.99Å
43	F	98.8	Very high	98.6	Very high	102 Å²	102	53.1 Å²	53.1	45%	0.447	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-36.9	177.5	-83.2	-84.8	0	0	0	112.5	I39 T40 M46 H47 I72	I39-F43 HydrophobicContact CG2-CD2 4.13Å; I39-F43 HydrophobicContact CG2-CE2 4.13Å; I39-F43 WeakPolarHBondContact O-CD2 3.26Å; I39-F43 PolarHBondContact O-N 2.82Å; T40-F43 PolarHBondContact O-N 2.86Å; F43-M46 PolarHBondContact O-N 3.34Å; F43-H47 PolarHBondContact O-CD2 3Å; F43-I72 HydrophobicContact CB-CD1 4.27Å; F43-I72 HydrophobicContact CB-CG2 4.27Å
44	L	98.9	Very high	98.6	Very high	25 Å²	25	55.4 Å²	55.4	13%	0.131	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-41.8	173	-67.8	170.6	0	0	0	111.7	T40 G41 L42 M46 H47 Y48 I62 I72 R73 H76	T40-L44 VanDerWaalsContact O-CG 3.26Å; T40-L44 WeakPolarHBondContact O-CG 3.28Å; T40-L44 PolarHBondContact O-N 3.29Å; G41-L44 PolarHBondContact O-N 3.08Å; L42-L44 VanDerWaalsContact C-N 3.35Å; L42-L44 PolarHBondContact O-N 3.44Å; L44-M46 PolarHBondContact O-N 2.85Å; L44-H47 PolarHBondContact O-N 3.42Å; L44-Y48 WeakPolarHBondContact O-CB 3.42Å; L44-Y48 PolarHBondContact O-N 3.04Å; L44-Y48 VanDerWaalsContact O-N 3.1Å; L44-I62 HydrophobicContact CD2-CD1 4.38Å; L44-I62 HydrophobicContact CD2-CG2 3.58Å; L44-I72 HydrophobicContact CD1-CG2 4.45Å; L44-I72 HydrophobicContact CD2-CB 4.44Å; L44-I72 HydrophobicContact CD2-CG2 3.94Å; L44-I72 HydrophobicContact CG-CG2 3.83Å; L44-R73 HydrophobicContact CD2-CB 3.99Å; L44-H76 HydrophobicContact CD1-CB 3.5Å; L44-H76 VanDerWaalsContact CD1-CB 3.5Å
45	A	98.8	Very high	98.6	Very high	22 Å²	22	54.5 Å²	54.5	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-28.4	-179.4	0	0	0	0	0	113.1	G41 L42 H47 F172 F176	G41-A45 WeakPolarHBondContact O-CB 3.48Å; G41-A45 PolarHBondContact O-N 3.46Å; L42-A45 PolarHBondContact O-N 3.31Å; A45-H47 PolarHBondContact O-N 3.33Å; A45-F172 HydrophobicContact CB-CE2 4.28Å; A45-F172 HydrophobicContact CB-CZ 4.06Å; A45-F176 HydrophobicContact CB-CD2 4.25Å; A45-F176 HydrophobicContact CB-CE2 3.93Å
46	M	98.7	Very high	98.6	Very high	120 Å²	120	55 Å²	55	59%	0.591	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.5	175.2	-64.2	-177.5	-168.7	0	0	113.6	L42 F43 L44	L42-M46 HydrophobicContact CD1-CE 4.42Å; L42-M46 HydrophobicContact CD2-CE 4.42Å; L42-M46 HydrophobicContact CG-CE 4Å; L42-M46 WeakPolarHBondContact O-CG 3.03Å; L42-M46 PolarHBondContact O-N 2.9Å; F43-M46 PolarHBondContact O-N 3.34Å; L44-M46 PolarHBondContact O-N 2.85Å
47	H	98.6	Very high	98.6	Very high	81 Å²	81	56.6 Å²	56.6	38%	0.375	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-4.2	-175.8	-62.3	-67.2	0	0	0	113.7	F43 L44 A45 I62 V66	F43-H47 PolarHBondContact O-CD2 3Å; L44-H47 PolarHBondContact O-N 3.42Å; A45-H47 PolarHBondContact O-N 3.33Å; H47-I62 HydrophobicContact CB-CD1 3.99Å; H47-I62 HydrophobicContact CB-CG1 3.54Å; H47-V66 HydrophobicContact CB-CG2 4.37Å
48	Y	98.8	Very high	98.6	Very high	28 Å²	28	56 Å²	56	11%	0.11	30%	0.297	C	S	.	.			trans	-91.5	145.8	-178.1	173.8	-104.6	0	0	0	111.9	L44 A55 S58 V59 L126 F172	L44-Y48 WeakPolarHBondContact O-CB 3.42Å; L44-Y48 PolarHBondContact O-N 3.04Å; L44-Y48 VanDerWaalsContact O-N 3.1Å; Y48-A55 HydrophobicContact CE2-CB 4.06Å; Y48-S58 VanDerWaalsContact CD2-OG 3.32Å; Y48-S58 WeakPolarHBondContact CD2-OG 3.28Å; Y48-V59 HydrophobicContact CD2-CG2 3.86Å; Y48-V59 HydrophobicContact CE2-CG2 4.04Å; Y48-L126 HydrophobicContact CE2-CB 4.46Å; Y48-L126 WeakPolarHBondContact CE2-O 3.3Å; Y48-L126 PolarHBondContact OH-O 3.12Å; Y48-F172 AromaticContact CD1-CD2 3.72Å; Y48-F172 HydrophobicContact CD1-CD2 3.72Å; Y48-F172 AromaticContact CD1-CE2 3.61Å; Y48-F172 HydrophobicContact CD1-CE2 3.61Å; Y48-F172 HydrophobicContact CD1-CG 4.34Å; Y48-F172 HydrophobicContact CD1-CZ 4.15Å; Y48-F172 HydrophobicContact CE1-CB 4.38Å; Y48-F172 AromaticContact CE1-CD2 3.59Å; Y48-F172 HydrophobicContact CE1-CD2 3.59Å; Y48-F172 HydrophobicContact CE1-CE2 4.01Å; Y48-F172 AromaticContact CE1-CG 3.97Å; Y48-F172 HydrophobicContact CE1-CG 3.97Å
49	T	98.6	Very high	98.6	Very high	61 Å²	61	55.1 Å²	55.1	37%	0.374	29%	0.294	S	S	.	.			trans	-120.6	123.6	173.6	56.9	0	0	0	0	111.5	D51 T54 A55 S58	T49-D51 VanDerWaalsContact C-N 3.26Å; T49-D51 PolarHBondContact O-N 3.02Å; T49-D51 VanDerWaalsContact O-N 3.09Å; T49-T54 WeakPolarHBondContact OG1-CB 3.38Å; T49-T54 PolarHBondContact OG1-O 2.8Å; T49-T54 PolarHBondContact OG1-OG1 2.65Å; T49-A55 VanDerWaalsContact O-CA 3.28Å; T49-A55 WeakPolarHBondContact O-CA 3.41Å; T49-S58 PolarHBondContact N-OG 3.38Å; T49-S58 WeakPolarHBondContact OG1-CB 3.38Å; T49-S58 PolarHBondContact OG1-OG 3.44Å
50	S	97.9	Very high	98.6	Very high	31 Å²	31	52.5 Å²	52.5	22%	0.217	28%	0.283	C	S	.	.			trans	-87.2	49	-178.2	69.3	0	0	0	0	113.3	T169	S50-T169 PolarHBondContact O-OG1 2.88Å
51	D	98.4	Very high	98.6	Very high	39 Å²	39	56 Å²	56	21%	0.209	30%	0.298	C	S	.	.	S	Bend	trans	-122.2	136.6	175.1	179.8	-81	0	0	0	109.7	T49 M53 T54 A55 K165	T49-D51 VanDerWaalsContact C-N 3.26Å; T49-D51 PolarHBondContact O-N 3.02Å; T49-D51 VanDerWaalsContact O-N 3.09Å; D51-M53 PolarHBondContact O-N 2.93Å; D51-M53 VanDerWaalsContact O-N 3.09Å; D51-M53 WeakPolarHBondContact OD1-CB 3.37Å; D51-M53 PolarHBondContact OD1-N 3.29Å; D51-T54 CarbonylContact O-C 3.56Å; D51-T54 PolarHBondContact O-N 3.05Å; D51-A55 WeakPolarHBondContact O-CB 3.32Å; D51-A55 PolarHBondContact O-N 3.08Å; D51-K165 WeakPolarHBondContact OD2-CE 3.15Å; D51-K165 IonicContact OD2-NZ 2.68Å; D51-K165 PolarHBondContact OD2-NZ 3.08Å
52	T	97.9	Very high	98.6	Very high	31 Å²	31	55.5 Å²	55.5	19%	0.19	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.5	-171.6	48.3	0	0	0	0	113.8	W128 K165 L168	T52-W128 HydrophobicContact CG2-CH2 4.22Å; T52-W128 HydrophobicContact CG2-CZ2 3.49Å; T52-W128 VanDerWaalsContact CG2-CZ2 3.49Å; T52-K165 HydrophobicContact CG2-CB 4.04Å; T52-L168 HydrophobicContact CG2-CB 4.42Å; T52-L168 HydrophobicContact CG2-CD2 3.93Å
53	M	98.3	Very high	98.6	Very high	159 Å²	159	53.3 Å²	53.3	78%	0.783	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-22	176.6	-59.2	-58.6	-64.2	0	0	112.9	D51	D51-M53 PolarHBondContact O-N 2.93Å; D51-M53 VanDerWaalsContact O-N 3.09Å; D51-M53 WeakPolarHBondContact OD1-CB 3.37Å; D51-M53 PolarHBondContact OD1-N 3.29Å
54	T	98.6	Very high	98.6	Very high	54 Å²	54	57.9 Å²	57.9	33%	0.331	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-9.5	-171.2	60.6	0	0	0	0	115	T49 D51 F56 S57 S58	T49-T54 WeakPolarHBondContact OG1-CB 3.38Å; T49-T54 PolarHBondContact OG1-O 2.8Å; T49-T54 PolarHBondContact OG1-OG1 2.65Å; D51-T54 CarbonylContact O-C 3.56Å; D51-T54 PolarHBondContact O-N 3.05Å; T54-F56 PolarHBondContact O-N 3.05Å; T54-S57 WeakPolarHBondContact CA-OG 3.41Å; T54-S57 PolarHBondContact O-N 3.43Å; T54-S57 PolarHBondContact O-OG 2.91Å; T54-S57 VanDerWaalsContact O-OG 3.04Å; T54-S58 VanDerWaalsContact O-CB 3.32Å; T54-S58 WeakPolarHBondContact O-CB 3.32Å; T54-S58 PolarHBondContact O-N 2.81Å; T54-S58 PolarHBondContact O-OG 3.33Å
55	A	98.6	Very high	98.6	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-51.4	-176.4	0	0	0	0	0	112.5	Y48 T49 D51 S57 S58 V59 W128 L168	Y48-A55 HydrophobicContact CE2-CB 4.06Å; T49-A55 VanDerWaalsContact O-CA 3.28Å; T49-A55 WeakPolarHBondContact O-CA 3.41Å; D51-A55 WeakPolarHBondContact O-CB 3.32Å; D51-A55 PolarHBondContact O-N 3.08Å; A55-S57 PolarHBondContact O-N 2.79Å; A55-S58 PolarHBondContact O-N 3.08Å; A55-S58 PolarHBondContact O-OG 3.1Å; A55-V59 PolarHBondContact O-N 3.4Å; A55-W128 HydrophobicContact CB-CB 3.88Å; A55-W128 HydrophobicContact CB-CG 4.47Å; A55-L168 HydrophobicContact CB-CD2 3.68Å
56	F	98.7	Very high	98.6	Very high	120 Å²	120	62.2 Å²	62.2	53%	0.526	32%	0.317	S	S	.	.	H	α-helix	trans	-61.7	-46	177.5	-174.6	-91	0	0	0	111.8	T54 S58 V59 T60 P127	T54-F56 PolarHBondContact O-N 3.05Å; F56-S58 PolarHBondContact O-N 2.81Å; F56-V59 PolarHBondContact O-N 3.21Å; F56-T60 HydrophobicContact CD1-CG2 4.12Å; F56-T60 HydrophobicContact CE1-CG2 3.74Å; F56-T60 HydrophobicContact CZ-CG2 4.26Å; F56-T60 PolarHBondContact O-N 3.3Å; F56-T60 VanDerWaalsContact O-N 3.07Å; F56-P127 WeakPolarHBondContact CA-O 3.49Å; F56-P127 VanDerWaalsContact CD2-O 3.31Å; F56-P127 WeakPolarHBondContact CD2-O 3.44Å
57	S	98.6	Very high	98.6	Very high	56 Å²	56	63.3 Å²	63.3	39%	0.392	33%	0.326	S	S	.	.	H	α-helix	trans	-67.2	-36.1	-178.7	58.3	0	0	0	0	112.5	T54 A55 V59 T60 H61	T54-S57 WeakPolarHBondContact CA-OG 3.41Å; T54-S57 PolarHBondContact O-N 3.43Å; T54-S57 PolarHBondContact O-OG 2.91Å; T54-S57 VanDerWaalsContact O-OG 3.04Å; A55-S57 PolarHBondContact O-N 2.79Å; S57-V59 PolarHBondContact O-N 3.06Å; S57-T60 WeakPolarHBondContact CA-OG1 3.18Å; S57-T60 PolarHBondContact O-N 3.29Å; S57-T60 VanDerWaalsContact O-N 3.13Å; S57-T60 PolarHBondContact O-OG1 3.16Å; S57-H61 WeakPolarHBondContact O-CB 3.5Å; S57-H61 PolarHBondContact O-N 3.26Å
58	S	98.8	Very high	98.6	Very high	9 Å²	9	67.4 Å²	67.4	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-63.2	-39	174.9	72	0	0	0	0	112.2	Y48 T49 T54 A55 F56 H61 I62	Y48-S58 VanDerWaalsContact CD2-OG 3.32Å; Y48-S58 WeakPolarHBondContact CD2-OG 3.28Å; T49-S58 PolarHBondContact N-OG 3.38Å; T49-S58 WeakPolarHBondContact OG1-CB 3.38Å; T49-S58 PolarHBondContact OG1-OG 3.44Å; T54-S58 VanDerWaalsContact O-CB 3.32Å; T54-S58 WeakPolarHBondContact O-CB 3.32Å; T54-S58 PolarHBondContact O-N 2.81Å; T54-S58 PolarHBondContact O-OG 3.33Å; A55-S58 PolarHBondContact O-N 3.08Å; A55-S58 PolarHBondContact O-OG 3.1Å; F56-S58 PolarHBondContact O-N 2.81Å; S58-H61 WeakPolarHBondContact O-CB 3.21Å; S58-H61 PolarHBondContact O-N 2.97Å; S58-I62 WeakPolarHBondContact O-CG1 3.26Å; S58-I62 PolarHBondContact O-N 3.27Å
59	V	98.8	Very high	98.6	Very high	22 Å²	22	66.1 Å²	66.1	13%	0.133	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-38.3	172.2	176.2	0	0	0	0	111.5	Y48 A55 F56 S57 I62 C63	Y48-V59 HydrophobicContact CD2-CG2 3.86Å; Y48-V59 HydrophobicContact CE2-CG2 4.04Å; A55-V59 PolarHBondContact O-N 3.4Å; F56-V59 PolarHBondContact O-N 3.21Å; S57-V59 PolarHBondContact O-N 3.06Å; V59-I62 PolarHBondContact O-N 3.19Å; V59-C63 PolarHBondContact O-N 3.3Å; V59-C63 PolarHBondContact O-SG 3.13Å
60	T	98.7	Very high	98.6	Very high	43 Å²	43	69.7 Å²	69.7	26%	0.264	34%	0.341	S	S	.	.	H	α-helix	trans	-67.6	-37.5	174.3	63.1	0	0	0	0	112.8	F56 S57 C63 R64	F56-T60 HydrophobicContact CD1-CG2 4.12Å; F56-T60 HydrophobicContact CE1-CG2 3.74Å; F56-T60 HydrophobicContact CZ-CG2 4.26Å; F56-T60 PolarHBondContact O-N 3.3Å; F56-T60 VanDerWaalsContact O-N 3.07Å; S57-T60 WeakPolarHBondContact CA-OG1 3.18Å; S57-T60 PolarHBondContact O-N 3.29Å; S57-T60 VanDerWaalsContact O-N 3.13Å; S57-T60 PolarHBondContact O-OG1 3.16Å; T60-C63 PolarHBondContact O-N 3.5Å; T60-R64 WeakPolarHBondContact O-CB 3.38Å; T60-R64 WeakPolarHBondContact O-CG 3.43Å; T60-R64 PolarHBondContact O-N 2.82Å
61	H	98.8	Very high	98.6	Very high	82 Å²	82	70.5 Å²	70.5	38%	0.38	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-44	174.6	165.4	-90	0	0	0	111	S57 S58 C63 R64 D65 V66	S57-H61 WeakPolarHBondContact O-CB 3.5Å; S57-H61 PolarHBondContact O-N 3.26Å; S58-H61 WeakPolarHBondContact O-CB 3.21Å; S58-H61 PolarHBondContact O-N 2.97Å; H61-C63 VanDerWaalsContact C-N 3.27Å; H61-C63 PolarHBondContact O-N 3.36Å; H61-R64 PolarHBondContact O-N 3Å; H61-D65 IonicContact CD2-OD2 3.27Å; H61-D65 PolarHBondContact CD2-OD2 3.1Å; H61-D65 VanDerWaalsContact CD2-OD2 3.27Å; H61-D65 IonicContact CG-OD2 3.87Å; H61-D65 PolarHBondContact O-N 3.37Å; H61-V66 PolarHBondContact O-N 2.92Å
62	I	98.8	Very high	98.6	Very high	5 Å²	5	70.4 Å²	70.4	3%	0.026	34%	0.342	C	S	.	.	H	α-helix	trans	-52.8	-47.7	172.2	-73.3	159.3	0	0	0	110.9	L44 H47 S58 V59 R64 G69 R73	L44-I62 HydrophobicContact CD2-CD1 4.38Å; L44-I62 HydrophobicContact CD2-CG2 3.58Å; H47-I62 HydrophobicContact CB-CD1 3.99Å; H47-I62 HydrophobicContact CB-CG1 3.54Å; S58-I62 WeakPolarHBondContact O-CG1 3.26Å; S58-I62 PolarHBondContact O-N 3.27Å; V59-I62 PolarHBondContact O-N 3.19Å; I62-R64 PolarHBondContact O-N 3.09Å; I62-G69 CarbonylContact O-C 3.54Å; I62-G69 VanDerWaalsContact O-CA 3.25Å; I62-G69 WeakPolarHBondContact O-CA 3.4Å; I62-R73 HydrophobicContact CG2-CB 4.37Å
63	C	98.8	Very high	98.6	Very high	29 Å²	29	72.7 Å²	72.7	20%	0.196	35%	0.347	C	S	.	.	H	α-helix	trans	-71.4	-28.6	-177	-68.5	0	0	0	0	113.8	V59 T60 H61	V59-C63 PolarHBondContact O-N 3.3Å; V59-C63 PolarHBondContact O-SG 3.13Å; T60-C63 PolarHBondContact O-N 3.5Å; H61-C63 VanDerWaalsContact C-N 3.27Å; H61-C63 PolarHBondContact O-N 3.36Å
64	R	98.6	Very high	98.6	Very high	198 Å²	198	70.5 Å²	70.5	75%	0.747	33%	0.331	S	S	*	.	H	α-helix	trans	-103.8	-36.1	-169.1	-69.8	178.8	173.5	172	-1.6	113.8	T60 H61 I62	T60-R64 WeakPolarHBondContact O-CB 3.38Å; T60-R64 WeakPolarHBondContact O-CG 3.43Å; T60-R64 PolarHBondContact O-N 2.82Å; H61-R64 PolarHBondContact O-N 3Å; I62-R64 PolarHBondContact O-N 3.09Å
65	D	98.6	Very high	98.6	Very high	111 Å²	111	70.3 Å²	70.3	59%	0.594	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-23.8	-164.7	-52.1	-46.3	0	0	0	112.5	H61	H61-D65 IonicContact CD2-OD2 3.27Å; H61-D65 PolarHBondContact CD2-OD2 3.1Å; H61-D65 VanDerWaalsContact CD2-OD2 3.27Å; H61-D65 IonicContact CG-OD2 3.87Å; H61-D65 PolarHBondContact O-N 3.37Å
66	V	98.7	Very high	98.6	Very high	27 Å²	27	71.8 Å²	71.8	16%	0.164	33%	0.334	C	S	.	.	S	Bend	trans	-82.4	129.6	175.1	-179.9	0	0	0	0	110.1	H47 H61 Y68 G69	H47-V66 HydrophobicContact CB-CG2 4.37Å; H61-V66 PolarHBondContact O-N 2.92Å; V66-Y68 PolarHBondContact O-N 3.37Å; V66-G69 PolarHBondContact O-N 3.26Å
67	N	98.6	Very high	98.6	Very high	143 Å²	143	68 Å²	68	77%	0.765	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	121.7	177.2	-68.8	-39.1	0	0	0	111.2	G69	N67-G69 PolarHBondContact O-N 2.96Å
68	Y	98.4	Very high	98.6	Very high	167 Å²	167	69.4 Å²	69.4	66%	0.655	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	14	-173.7	-55.7	-80.8	0	0	0	115	V66 W70 L71 I72	V66-Y68 PolarHBondContact O-N 3.37Å; Y68-W70 VanDerWaalsContact C-N 3.3Å; Y68-W70 PolarHBondContact O-N 3.17Å; Y68-L71 WeakPolarHBondContact O-CB 3.44Å; Y68-L71 PolarHBondContact O-N 2.83Å; Y68-I72 PolarHBondContact O-N 3.23Å; Y68-I72 VanDerWaalsContact O-N 3.08Å
69	G	98.7	Very high	98.6	Very high	1 Å²	1	69.1 Å²	69.1	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-64.9	-32.9	-177.7	0	0	0	0	0	112.8	I62 V66 N67 L71 I72 R73	I62-G69 CarbonylContact O-C 3.54Å; I62-G69 VanDerWaalsContact O-CA 3.25Å; I62-G69 WeakPolarHBondContact O-CA 3.4Å; V66-G69 PolarHBondContact O-N 3.26Å; N67-G69 PolarHBondContact O-N 2.96Å; G69-L71 VanDerWaalsContact C-N 3.34Å; G69-L71 PolarHBondContact O-N 3.48Å; G69-I72 PolarHBondContact O-N 3.23Å; G69-R73 VanDerWaalsContact O-CB 3.26Å; G69-R73 WeakPolarHBondContact O-CB 3.26Å; G69-R73 PolarHBondContact O-N 3.46Å
70	W	98.5	Very high	98.6	Very high	136 Å²	136	69.5 Å²	69.5	52%	0.515	33%	0.332	S	S	.	.	H	α-helix	trans	-57.1	-46.7	169.7	66.5	-90.4	0	0	0	111.7	Y68 R73 Y74	Y68-W70 VanDerWaalsContact C-N 3.3Å; Y68-W70 PolarHBondContact O-N 3.17Å; W70-R73 PolarHBondContact O-N 3.36Å; W70-Y74 HydrophobicContact CB-CD2 4.4Å; W70-Y74 HydrophobicContact CB-CE2 4.39Å; W70-Y74 HydrophobicContact CE3-CD2 4.19Å; W70-Y74 WeakPolarHBondContact O-CD2 3.32Å; W70-Y74 PolarHBondContact O-N 3.45Å
71	L	98.4	Very high	98.6	Very high	49 Å²	49	70.8 Å²	70.8	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-47.3	-177.9	177.5	63.9	0	0	0	110	Y68 G69 R73 Y74 M75 M233	Y68-L71 WeakPolarHBondContact O-CB 3.44Å; Y68-L71 PolarHBondContact O-N 2.83Å; G69-L71 VanDerWaalsContact C-N 3.34Å; G69-L71 PolarHBondContact O-N 3.48Å; L71-R73 VanDerWaalsContact C-N 3.33Å; L71-R73 PolarHBondContact O-N 3.2Å; L71-Y74 PolarHBondContact O-N 3.03Å; L71-M75 HydrophobicContact CD1-CG 4.2Å; L71-M75 HydrophobicContact CD1-SD 4.39Å; L71-M75 HydrophobicContact CG-CE 4.04Å; L71-M75 HydrophobicContact CG-CG 4.48Å; L71-M75 HydrophobicContact CG-SD 4.35Å; L71-M75 WeakPolarHBondContact O-CB 3.46Å; L71-M75 VanDerWaalsContact O-CG 3.3Å; L71-M75 WeakPolarHBondContact O-CG 3.37Å; L71-M75 PolarHBondContact O-N 3.3Å; L71-M233 HydrophobicContact CD1-CE 3.99Å
72	I	98.6	Very high	98.6	Very high	37 Å²	37	67.8 Å²	67.8	19%	0.19	33%	0.329	C	S	.	.	H	α-helix	trans	-60	-44.6	177.1	-59.8	172.2	0	0	0	110.5	T40 F43 L44 Y68 G69 M75 H76	T40-I72 HydrophobicContact CG2-CG2 4.22Å; F43-I72 HydrophobicContact CB-CD1 4.27Å; F43-I72 HydrophobicContact CB-CG2 4.27Å; L44-I72 HydrophobicContact CD1-CG2 4.45Å; L44-I72 HydrophobicContact CD2-CB 4.44Å; L44-I72 HydrophobicContact CD2-CG2 3.94Å; L44-I72 HydrophobicContact CG-CG2 3.83Å; Y68-I72 PolarHBondContact O-N 3.23Å; Y68-I72 VanDerWaalsContact O-N 3.08Å; G69-I72 PolarHBondContact O-N 3.23Å; I72-M75 HydrophobicContact CG1-CE 4.49Å; I72-M75 PolarHBondContact O-N 2.89Å; I72-H76 WeakPolarHBondContact O-CB 3.41Å; I72-H76 PolarHBondContact O-N 2.93Å
73	R	98.6	Very high	98.6	Very high	78 Å²	78	68.3 Å²	68.3	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-45.5	178.9	-177.2	-88.9	178.7	155.1	0.1	111.9	L44 I62 G69 W70 L71 H76 A77	L44-R73 HydrophobicContact CD2-CB 3.99Å; I62-R73 HydrophobicContact CG2-CB 4.37Å; G69-R73 VanDerWaalsContact O-CB 3.26Å; G69-R73 WeakPolarHBondContact O-CB 3.26Å; G69-R73 PolarHBondContact O-N 3.46Å; W70-R73 PolarHBondContact O-N 3.36Å; L71-R73 VanDerWaalsContact C-N 3.33Å; L71-R73 PolarHBondContact O-N 3.2Å; R73-H76 PolarHBondContact O-N 2.85Å; R73-A77 WeakPolarHBondContact O-CB 3.25Å; R73-A77 PolarHBondContact O-N 3.46Å
74	Y	98.5	Very high	98.6	Very high	114 Å²	114	68.9 Å²	68.9	45%	0.447	33%	0.33	S	S	.	.	H	α-helix	trans	-72.8	-35.7	-179.6	-74.3	-64.4	0	0	0	112.4	W70 L71 H76 A77 N78	W70-Y74 HydrophobicContact CB-CD2 4.4Å; W70-Y74 HydrophobicContact CB-CE2 4.39Å; W70-Y74 HydrophobicContact CE3-CD2 4.19Å; W70-Y74 WeakPolarHBondContact O-CD2 3.32Å; W70-Y74 PolarHBondContact O-N 3.45Å; L71-Y74 PolarHBondContact O-N 3.03Å; Y74-H76 VanDerWaalsContact C-N 3.33Å; Y74-H76 PolarHBondContact O-N 3.42Å; Y74-A77 PolarHBondContact O-N 3.17Å; Y74-N78 WeakPolarHBondContact O-CB 3.45Å; Y74-N78 PolarHBondContact O-N 3.1Å; Y74-N78 PolarHBondContact O-ND2 2.65Å
75	M	98.5	Very high	98.6	Very high	49 Å²	49	63.8 Å²	63.8	24%	0.241	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-42.8	170.2	-74.9	-168.5	-56.7	0	0	111.3	T40 L71 I72 G79 M233	T40-M75 HydrophobicContact CG2-CB 4.19Å; T40-M75 HydrophobicContact CG2-CE 4.15Å; L71-M75 HydrophobicContact CD1-CG 4.2Å; L71-M75 HydrophobicContact CD1-SD 4.39Å; L71-M75 HydrophobicContact CG-CE 4.04Å; L71-M75 HydrophobicContact CG-CG 4.48Å; L71-M75 HydrophobicContact CG-SD 4.35Å; L71-M75 WeakPolarHBondContact O-CB 3.46Å; L71-M75 VanDerWaalsContact O-CG 3.3Å; L71-M75 WeakPolarHBondContact O-CG 3.37Å; L71-M75 PolarHBondContact O-N 3.3Å; I72-M75 HydrophobicContact CG1-CE 4.49Å; I72-M75 PolarHBondContact O-N 2.89Å; M75-G79 WeakPolarHBondContact O-CA 3.26Å; M75-G79 PolarHBondContact O-N 3.41Å; M75-M233 HydrophobicContact SD-CE 4.16Å
76	H	98.8	Very high	98.6	Very high	32 Å²	32	58.6 Å²	58.6	15%	0.148	29%	0.289	C	S	.	.	H	α-helix	trans	-66.7	-41.3	177.7	-165.4	80.1	0	0	0	112.6	Q37 T40 G41 L44 I72 R73 Y74 A80	Q37-H76 PolarHBondContact NE2-O 3.34Å; Q37-H76 PolarHBondContact O-CE1 2.88Å; Q37-H76 VanDerWaalsContact O-CE1 3.25Å; Q37-H76 PolarHBondContact O-ND1 3.31Å; Q37-H76 PolarHBondContact OE1-O 2.91Å; T40-H76 PolarHBondContact OG1-ND1 3.08Å; G41-H76 VanDerWaalsContact CA-CE1 3.44Å; G41-H76 WeakPolarHBondContact CA-CE1 3.14Å; G41-H76 PolarHBondContact N-ND1 3.43Å; L44-H76 HydrophobicContact CD1-CB 3.5Å; L44-H76 VanDerWaalsContact CD1-CB 3.5Å; I72-H76 WeakPolarHBondContact O-CB 3.41Å; I72-H76 PolarHBondContact O-N 2.93Å; R73-H76 PolarHBondContact O-N 2.85Å; Y74-H76 VanDerWaalsContact C-N 3.33Å; Y74-H76 PolarHBondContact O-N 3.42Å; H76-A80 PolarHBondContact O-N 3.39Å
77	A	98.5	Very high	98.6	Very high	41 Å²	41	58 Å²	58	34%	0.339	29%	0.285	S	S	.	.	H	α-helix	trans	-70.7	-52.1	-179.3	0	0	0	0	0	112.3	R73 Y74 G79 A80	R73-A77 WeakPolarHBondContact O-CB 3.25Å; R73-A77 PolarHBondContact O-N 3.46Å; Y74-A77 PolarHBondContact O-N 3.17Å; A77-G79 VanDerWaalsContact C-N 3.32Å; A77-A80 WeakPolarHBondContact O-CB 3.36Å; A77-A80 PolarHBondContact O-N 3.21Å
78	N	98.6	Very high	98.6	Very high	85 Å²	85	57.2 Å²	57.2	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-71.8	-30.4	178.2	-66.4	-40	0	0	0	111.6	Y74 A80 S81 M82 L232	Y74-N78 WeakPolarHBondContact O-CB 3.45Å; Y74-N78 PolarHBondContact O-N 3.1Å; Y74-N78 PolarHBondContact O-ND2 2.65Å; N78-A80 VanDerWaalsContact C-N 3.28Å; N78-A80 PolarHBondContact O-N 3.47Å; N78-S81 WeakPolarHBondContact O-CB 3.36Å; N78-S81 PolarHBondContact O-N 3.31Å; N78-S81 VanDerWaalsContact O-N 3.09Å; N78-M82 PolarHBondContact O-N 3.36Å; N78-L232 HydrophobicContact CB-CD1 3.96Å
79	G	98.7	Very high	98.6	Very high	3 Å²	3	52 Å²	52	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-35.4	174.1	0	0	0	0	0	112.2	Q37 M75 A77 M82 F83	Q37-G79 VanDerWaalsContact OE1-C 3.31Å; M75-G79 WeakPolarHBondContact O-CA 3.26Å; M75-G79 PolarHBondContact O-N 3.41Å; A77-G79 VanDerWaalsContact C-N 3.32Å; G79-M82 PolarHBondContact O-N 2.95Å; G79-F83 WeakPolarHBondContact O-CB 3.42Å; G79-F83 PolarHBondContact O-N 2.83Å
80	A	98.6	Very high	98.6	Very high	30 Å²	30	53.7 Å²	53.7	25%	0.248	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-43.1	171.2	0	0	0	0	0	111.9	H76 A77 N78 F83 F84	H76-A80 PolarHBondContact O-N 3.39Å; A77-A80 WeakPolarHBondContact O-CB 3.36Å; A77-A80 PolarHBondContact O-N 3.21Å; N78-A80 VanDerWaalsContact C-N 3.28Å; N78-A80 PolarHBondContact O-N 3.47Å; A80-F83 VanDerWaalsContact O-CB 3.31Å; A80-F83 WeakPolarHBondContact O-CB 3.4Å; A80-F83 PolarHBondContact O-N 3.39Å; A80-F84 WeakPolarHBondContact O-CD2 3.12Å; A80-F84 PolarHBondContact O-N 3.49Å
81	S	98.4	Very high	98.7	Very high	70 Å²	70	49.3 Å²	49.3	49%	0.49	25%	0.254	S	S	.	.	H	α-helix	trans	-63.7	-44.2	174.5	-61.7	0	0	0	0	112.1	N78 F83 F84 I85	N78-S81 WeakPolarHBondContact O-CB 3.36Å; N78-S81 PolarHBondContact O-N 3.31Å; N78-S81 VanDerWaalsContact O-N 3.09Å; S81-F83 VanDerWaalsContact C-N 3.27Å; S81-F83 PolarHBondContact O-N 2.98Å; S81-F84 PolarHBondContact O-N 3.44Å; S81-F84 VanDerWaalsContact O-N 3.15Å; S81-I85 WeakPolarHBondContact O-CG1 3.31Å; S81-I85 PolarHBondContact O-N 3.31Å
82	M	98.6	Very high	98.7	Very high	18 Å²	18	48.6 Å²	48.6	9%	0.089	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-37.4	175.4	-175.5	60.3	82	0	0	111.9	N78 G79 F84 I85 C86 M228 I231 L232	N78-M82 PolarHBondContact O-N 3.36Å; G79-M82 PolarHBondContact O-N 2.95Å; M82-F84 PolarHBondContact O-N 2.82Å; M82-I85 PolarHBondContact O-N 3.2Å; M82-C86 WeakPolarHBondContact O-CB 3.32Å; M82-C86 PolarHBondContact O-N 2.87Å; M82-C86 PolarHBondContact O-SG 2.88Å; M82-M228 HydrophobicContact CE-CG 4.11Å; M82-M228 HydrophobicContact CG-CG 3.84Å; M82-M228 HydrophobicContact CG-SD 4.11Å; M82-M228 HydrophobicContact SD-CG 3.91Å; M82-I231 HydrophobicContact CE-CB 3.85Å; M82-I231 HydrophobicContact CE-CG2 3.64Å; M82-L232 HydrophobicContact CB-CD1 4.15Å; M82-L232 HydrophobicContact CE-CB 4.35Å
83	F	98.7	Very high	98.7	Very high	16 Å²	16	48 Å²	48	7%	0.07	25%	0.253	C	S	.	.	H	α-helix	trans	-57.2	-50.3	173.4	-154.4	139.2	0	0	0	110.5	L30 C33 L34 Q37 G79 A80 S81 I85 C86 L87 V116	L30-F83 HydrophobicContact CD2-CD2 3.57Å; L30-F83 HydrophobicContact CD2-CE2 3.54Å; C33-F83 HydrophobicContact CB-CB 4.14Å; C33-F83 HydrophobicContact CB-CD1 3.69Å; C33-F83 HydrophobicContact CB-CD2 4.44Å; C33-F83 HydrophobicContact CB-CE1 4.18Å; C33-F83 HydrophobicContact CB-CG 3.83Å; L34-F83 HydrophobicContact CB-CE1 3.97Å; L34-F83 HydrophobicContact CB-CZ 4.18Å; L34-F83 HydrophobicContact CD1-CE1 4.17Å; L34-F83 HydrophobicContact CD1-CZ 4.47Å; Q37-F83 HydrophobicContact CG-CD1 4Å; G79-F83 WeakPolarHBondContact O-CB 3.42Å; G79-F83 PolarHBondContact O-N 2.83Å; A80-F83 VanDerWaalsContact O-CB 3.31Å; A80-F83 WeakPolarHBondContact O-CB 3.4Å; A80-F83 PolarHBondContact O-N 3.39Å; S81-F83 VanDerWaalsContact C-N 3.27Å; S81-F83 PolarHBondContact O-N 2.98Å; F83-I85 PolarHBondContact O-N 3.41Å; F83-C86 PolarHBondContact O-N 2.86Å; F83-L87 HydrophobicContact CD2-CD1 3.7Å; F83-L87 HydrophobicContact CD2-CG 3.85Å; F83-L87 HydrophobicContact CE2-CD1 3.88Å; F83-L87 HydrophobicContact CE2-CD2 4.41Å; F83-L87 HydrophobicContact CE2-CG 3.98Å; F83-L87 WeakPolarHBondContact O-CB 3.34Å; F83-L87 PolarHBondContact O-N 3.34Å; F83-V116 HydrophobicContact CD2-CG1 4.12Å; F83-V116 HydrophobicContact CE2-CG1 4.1Å; F83-V116 HydrophobicContact CE2-CG2 3.86Å; F83-V116 HydrophobicContact CG-CG1 4.49Å; F83-V116 HydrophobicContact CZ-CG1 4.43Å; F83-V116 HydrophobicContact CZ-CG2 3.86Å
84	F	98.8	Very high	98.7	Very high	42 Å²	42	44.4 Å²	44.4	18%	0.184	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-37.8	178.3	-82.8	-79.2	0	0	0	113.5	A80 S81 M82 C86 L87 F88 V116 M117 A120	A80-F84 WeakPolarHBondContact O-CD2 3.12Å; A80-F84 PolarHBondContact O-N 3.49Å; S81-F84 PolarHBondContact O-N 3.44Å; S81-F84 VanDerWaalsContact O-N 3.15Å; M82-F84 PolarHBondContact O-N 2.82Å; F84-C86 VanDerWaalsContact C-N 3.34Å; F84-C86 PolarHBondContact O-N 3.34Å; F84-L87 HydrophobicContact CD1-CD1 4.27Å; F84-L87 HydrophobicContact CE1-CD1 4.39Å; F84-L87 PolarHBondContact O-N 3.43Å; F84-F88 HydrophobicContact CB-CD2 4.41Å; F84-F88 HydrophobicContact CB-CE2 3.96Å; F84-F88 HydrophobicContact CB-CZ 4.43Å; F84-F88 HydrophobicContact CD1-CE1 4.31Å; F84-F88 HydrophobicContact CD1-CE2 4.15Å; F84-F88 AromaticContact CD1-CZ 3.75Å; F84-F88 HydrophobicContact CD1-CZ 3.75Å; F84-F88 HydrophobicContact CG-CE2 4.49Å; F84-F88 WeakPolarHBondContact O-CD2 3.17Å; F84-F88 VanDerWaalsContact O-CG 3.27Å; F84-F88 WeakPolarHBondContact O-CG 3.43Å; F84-F88 PolarHBondContact O-N 3.41Å; F84-V116 HydrophobicContact CE1-CG1 4.46Å; F84-V116 HydrophobicContact CE2-CG1 4.18Å; F84-V116 HydrophobicContact CZ-CG1 3.92Å; F84-M117 HydrophobicContact CE1-CG 3.85Å; F84-M117 HydrophobicContact CZ-CG 4.19Å; F84-A120 HydrophobicContact CE2-CB 3.49Å; F84-A120 VanDerWaalsContact CE2-CB 3.49Å; F84-A120 HydrophobicContact CZ-CB 3.88Å
85	I	98.7	Very high	98.7	Very high	91 Å²	91	43.7 Å²	43.7	47%	0.467	24%	0.244	S	C	.	.	H	α-helix	trans	-58	-50.2	173.5	-66.9	169.3	0	0	0	109.6	S81 M82 F83 L87 F88 L89	S81-I85 WeakPolarHBondContact O-CG1 3.31Å; S81-I85 PolarHBondContact O-N 3.31Å; M82-I85 PolarHBondContact O-N 3.2Å; F83-I85 PolarHBondContact O-N 3.41Å; I85-L87 VanDerWaalsContact C-N 3.33Å; I85-L87 PolarHBondContact O-N 3.11Å; I85-F88 PolarHBondContact O-N 3.36Å; I85-L89 HydrophobicContact CG2-CD1 3.75Å; I85-L89 VanDerWaalsContact O-CG 3.26Å; I85-L89 WeakPolarHBondContact O-CG 3.42Å; I85-L89 PolarHBondContact O-N 2.97Å
86	C	98.8	Very high	98.7	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-40.3	177.1	-67.4	0	0	0	0	112	F26 L30 M82 F83 F84 L89 H90	F26-C86 HydrophobicContact CD1-CB 4.15Å; L30-C86 HydrophobicContact CD2-CB 3.63Å; L30-C86 HydrophobicContact CG-CB 3.99Å; M82-C86 WeakPolarHBondContact O-CB 3.32Å; M82-C86 PolarHBondContact O-N 2.87Å; M82-C86 PolarHBondContact O-SG 2.88Å; F83-C86 PolarHBondContact O-N 2.86Å; F84-C86 VanDerWaalsContact C-N 3.34Å; F84-C86 PolarHBondContact O-N 3.34Å; C86-L89 PolarHBondContact O-N 2.78Å; C86-H90 WeakPolarHBondContact O-CB 3.43Å; C86-H90 PolarHBondContact O-N 3.43Å
87	L	98.8	Very high	98.7	Very high	13 Å²	13	51 Å²	51	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-49.7	178.5	-87.4	170.9	0	0	0	111	L30 F83 F84 I85 L89 H90 V91 L113 V116	L30-L87 HydrophobicContact CD1-CD2 4.01Å; L30-L87 HydrophobicContact CD2-CB 4.3Å; L30-L87 HydrophobicContact CD2-CD2 3.86Å; L30-L87 HydrophobicContact CD2-CG 3.6Å; F83-L87 HydrophobicContact CD2-CD1 3.7Å; F83-L87 HydrophobicContact CD2-CG 3.85Å; F83-L87 HydrophobicContact CE2-CD1 3.88Å; F83-L87 HydrophobicContact CE2-CD2 4.41Å; F83-L87 HydrophobicContact CE2-CG 3.98Å; F83-L87 WeakPolarHBondContact O-CB 3.34Å; F83-L87 PolarHBondContact O-N 3.34Å; F84-L87 HydrophobicContact CD1-CD1 4.27Å; F84-L87 HydrophobicContact CE1-CD1 4.39Å; F84-L87 PolarHBondContact O-N 3.43Å; I85-L87 VanDerWaalsContact C-N 3.33Å; I85-L87 PolarHBondContact O-N 3.11Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 2.99Å; L87-H90 WeakPolarHBondContact O-CB 3.5Å; L87-H90 PolarHBondContact O-N 2.91Å; L87-V91 VanDerWaalsContact O-CG2 3.32Å; L87-V91 WeakPolarHBondContact O-CG2 3.39Å; L87-V91 PolarHBondContact O-N 3.31Å; L87-L113 HydrophobicContact CD1-CD1 4.25Å; L87-V116 HydrophobicContact CD1-CB 3.97Å; L87-V116 HydrophobicContact CD1-CG1 3.65Å; L87-V116 HydrophobicContact CD1-CG2 4.29Å
88	F	98.8	Very high	98.7	Very high	127 Å²	127	50 Å²	50	56%	0.557	26%	0.262	S	S	*	.	H	α-helix	trans	-65	-39.1	-178.6	-62.9	-39.2	0	0	0	111.9	F84 I85 G92	F84-F88 HydrophobicContact CB-CD2 4.41Å; F84-F88 HydrophobicContact CB-CE2 3.96Å; F84-F88 HydrophobicContact CB-CZ 4.43Å; F84-F88 HydrophobicContact CD1-CE1 4.31Å; F84-F88 HydrophobicContact CD1-CE2 4.15Å; F84-F88 AromaticContact CD1-CZ 3.75Å; F84-F88 HydrophobicContact CD1-CZ 3.75Å; F84-F88 HydrophobicContact CG-CE2 4.49Å; F84-F88 WeakPolarHBondContact O-CD2 3.17Å; F84-F88 VanDerWaalsContact O-CG 3.27Å; F84-F88 WeakPolarHBondContact O-CG 3.43Å; F84-F88 PolarHBondContact O-N 3.41Å; I85-F88 PolarHBondContact O-N 3.36Å; F88-G92 PolarHBondContact O-N 3.31Å
89	L	98.8	Very high	98.7	Very high	59 Å²	59	46.8 Å²	46.8	31%	0.309	25%	0.247	S	C	.	.	H	α-helix	trans	-67.7	-37.9	174.7	-64.1	168.3	0	0	0	111.6	W23 F26 I85 C86 L87 G92 R93	W23-L89 HydrophobicContact CH2-CD2 4.42Å; W23-L89 HydrophobicContact CZ3-CB 4.4Å; W23-L89 HydrophobicContact CZ3-CD2 3.85Å; F26-L89 HydrophobicContact CD1-CB 4.03Å; F26-L89 HydrophobicContact CD1-CD1 4.31Å; F26-L89 HydrophobicContact CD2-CB 3.9Å; F26-L89 HydrophobicContact CE1-CB 3.9Å; F26-L89 HydrophobicContact CE1-CD1 3.44Å; F26-L89 VanDerWaalsContact CE1-CD1 3.44Å; F26-L89 HydrophobicContact CE1-CG 4.3Å; F26-L89 HydrophobicContact CE2-CB 3.76Å; F26-L89 HydrophobicContact CE2-CD1 4.18Å; F26-L89 HydrophobicContact CE2-CG 4.5Å; F26-L89 HydrophobicContact CG-CB 4.06Å; F26-L89 HydrophobicContact CZ-CB 3.77Å; F26-L89 HydrophobicContact CZ-CD1 3.37Å; F26-L89 HydrophobicContact CZ-CG 4.14Å; I85-L89 HydrophobicContact CG2-CD1 3.75Å; I85-L89 VanDerWaalsContact O-CG 3.26Å; I85-L89 WeakPolarHBondContact O-CG 3.42Å; I85-L89 PolarHBondContact O-N 2.97Å; C86-L89 PolarHBondContact O-N 2.78Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 2.99Å; L89-G92 PolarHBondContact O-N 3.5Å; L89-R93 WeakPolarHBondContact O-CB 3.38Å; L89-R93 PolarHBondContact O-N 3.09Å
90	H	98.8	Very high	98.6	Very high	36 Å²	36	51.9 Å²	51.9	17%	0.167	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-44.9	175.8	-169.3	97.9	0	0	0	112.4	F26 G27 L30 C86 L87 R93 G94	F26-H90 HydrophobicContact CB-CB 3.9Å; G27-H90 PolarHBondContact N-ND1 3.26Å; L30-H90 HydrophobicContact CD1-CB 3.78Å; C86-H90 WeakPolarHBondContact O-CB 3.43Å; C86-H90 PolarHBondContact O-N 3.43Å; L87-H90 WeakPolarHBondContact O-CB 3.5Å; L87-H90 PolarHBondContact O-N 2.91Å; H90-R93 PolarHBondContact CE1-NH2 3.49Å; H90-R93 PolarHBondContact ND1-NH2 2.97Å; H90-R93 PolarHBondContact NE2-NH2 3.37Å; H90-G94 PolarHBondContact O-N 3.33Å; H90-G94 VanDerWaalsContact O-N 3.09Å
91	V	98.9	Very high	98.6	Very high	44 Å²	44	54.6 Å²	54.6	27%	0.267	28%	0.279	S	S	.	.	H	α-helix	trans	-65	-45.5	174.9	172.3	0	0	0	0	110.2	L87 R93 G94 L95 W106	L87-V91 VanDerWaalsContact O-CG2 3.32Å; L87-V91 WeakPolarHBondContact O-CG2 3.39Å; L87-V91 PolarHBondContact O-N 3.31Å; V91-R93 VanDerWaalsContact C-N 3.33Å; V91-R93 PolarHBondContact O-N 3.24Å; V91-G94 WeakPolarHBondContact O-CA 3.1Å; V91-G94 PolarHBondContact O-N 2.85Å; V91-L95 HydrophobicContact CG1-CD1 4.24Å; V91-L95 HydrophobicContact CG1-CG 4.47Å; V91-L95 WeakPolarHBondContact O-CG 3.27Å; V91-L95 PolarHBondContact O-N 3.28Å; V91-W106 HydrophobicContact CG1-CH2 4.23Å
92	G	98.8	Very high	98.6	Very high	33 Å²	33	53.7 Å²	53.7	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-57.9	-43.5	177.4	0	0	0	0	0	112.6	F88 L89 G94 L95 Y96	F88-G92 PolarHBondContact O-N 3.31Å; L89-G92 PolarHBondContact O-N 3.5Å; G92-G94 VanDerWaalsContact C-N 3.33Å; G92-G94 PolarHBondContact O-N 3.49Å; G92-L95 PolarHBondContact O-N 2.93Å; G92-Y96 WeakPolarHBondContact O-CB 3.19Å; G92-Y96 PolarHBondContact O-N 3.15Å
93	R	98.8	Very high	98.6	Very high	24 Å²	24	58 Å²	58	9%	0.091	29%	0.288	C	S	.	.	H	α-helix	trans	-55.7	-48.4	169.9	177	-78.3	-67.4	-97.3	-5.2	111	W23 W24 L89 H90 V91 L95 Y96 Y97	W23-R93 HydrophobicContact CB-CB 4.1Å; W23-R93 HydrophobicContact CB-CG 3.58Å; W24-R93 HydrophobicContact CE3-CG 4.29Å; W24-R93 HydrophobicContact CZ3-CG 4.15Å; L89-R93 WeakPolarHBondContact O-CB 3.38Å; L89-R93 PolarHBondContact O-N 3.09Å; H90-R93 PolarHBondContact CE1-NH2 3.49Å; H90-R93 PolarHBondContact ND1-NH2 2.97Å; H90-R93 PolarHBondContact NE2-NH2 3.37Å; V91-R93 VanDerWaalsContact C-N 3.33Å; V91-R93 PolarHBondContact O-N 3.24Å; R93-L95 VanDerWaalsContact C-N 3.3Å; R93-L95 PolarHBondContact O-N 2.84Å; R93-Y96 PolarHBondContact O-N 3.42Å; R93-Y97 HydrophobicContact CG-CD2 3.81Å; R93-Y97 HydrophobicContact CG-CE2 4.18Å; R93-Y97 WeakPolarHBondContact O-CD2 3.5Å; R93-Y97 PolarHBondContact O-N 3.48Å
94	G	98.7	Very high	98.6	Very high	3 Å²	3	62.4 Å²	62.4	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-63.8	-35.2	-176.9	0	0	0	0	0	113.3	H90 V91 G92 G98 S99	H90-G94 PolarHBondContact O-N 3.33Å; H90-G94 VanDerWaalsContact O-N 3.09Å; V91-G94 WeakPolarHBondContact O-CA 3.1Å; V91-G94 PolarHBondContact O-N 2.85Å; G92-G94 VanDerWaalsContact C-N 3.33Å; G92-G94 PolarHBondContact O-N 3.49Å; G94-G98 CarbonylContact O-C 3.59Å; G94-G98 PolarHBondContact O-N 3.37Å; G94-S99 PolarHBondContact O-N 3.22Å
95	L	98.7	Very high	98.6	Very high	99 Å²	99	61 Å²	61	52%	0.518	30%	0.304	S	S	.	.	H	α-helix	trans	-68.8	-51	172	-66.3	173.6	0	0	0	111.5	V91 G92 R93 Y97 G98 Y100 W106	V91-L95 HydrophobicContact CG1-CD1 4.24Å; V91-L95 HydrophobicContact CG1-CG 4.47Å; V91-L95 WeakPolarHBondContact O-CG 3.27Å; V91-L95 PolarHBondContact O-N 3.28Å; G92-L95 PolarHBondContact O-N 2.93Å; R93-L95 VanDerWaalsContact C-N 3.3Å; R93-L95 PolarHBondContact O-N 2.84Å; L95-Y97 PolarHBondContact O-N 2.89Å; L95-G98 PolarHBondContact O-N 3.09Å; L95-Y100 HydrophobicContact CD2-CD1 4.38Å; L95-W106 HydrophobicContact CD2-CH2 3.75Å; L95-W106 HydrophobicContact CD2-CZ2 3.94Å; L95-W106 HydrophobicContact CG-CH2 4.01Å
96	Y	98.7	Very high	98.6	Very high	189 Å²	189	59.9 Å²	59.9	74%	0.741	29%	0.294	S	S	*	.	H	α-helix	trans	-63	-41.6	-174.2	-174.8	-92.2	0	0	0	112.9	G92 R93	G92-Y96 WeakPolarHBondContact O-CB 3.19Å; G92-Y96 PolarHBondContact O-N 3.15Å; R93-Y96 PolarHBondContact O-N 3.42Å
97	Y	98.5	Very high	98.6	Very high	46 Å²	46	63.4 Å²	63.4	18%	0.18	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	12.6	-178.9	-63.4	-72.8	0	0	0	113.7	W23 W24 R93 L95 S99 N199 P201	W23-Y97 HydrophobicContact CB-CE2 4.32Å; W23-Y97 HydrophobicContact CG-CE2 4.26Å; W24-Y97 HydrophobicContact CH2-CD1 4.21Å; W24-Y97 AromaticContact CH2-CD2 3.61Å; W24-Y97 HydrophobicContact CH2-CD2 3.61Å; W24-Y97 HydrophobicContact CH2-CE2 4.07Å; W24-Y97 AromaticContact CH2-CG 3.67Å; W24-Y97 HydrophobicContact CH2-CG 3.67Å; W24-Y97 AromaticContact CZ3-CD2 3.64Å; W24-Y97 HydrophobicContact CZ3-CD2 3.64Å; W24-Y97 AromaticContact CZ3-CE2 3.64Å; W24-Y97 HydrophobicContact CZ3-CE2 3.64Å; W24-Y97 HydrophobicContact CZ3-CG 4.12Å; R93-Y97 HydrophobicContact CG-CD2 3.81Å; R93-Y97 HydrophobicContact CG-CE2 4.18Å; R93-Y97 WeakPolarHBondContact O-CD2 3.5Å; R93-Y97 PolarHBondContact O-N 3.48Å; L95-Y97 PolarHBondContact O-N 2.89Å; Y97-S99 PolarHBondContact O-N 3.46Å; Y97-N199 PolarHBondContact O-ND2 2.99Å; Y97-P201 HydrophobicContact CD1-CB 4.28Å; Y97-P201 HydrophobicContact CE1-CB 3.7Å; Y97-P201 HydrophobicContact CE1-CG 4.46Å
98	G	98.3	Very high	98.6	Very high	19 Å²	19	63.9 Å²	63.9	20%	0.196	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	21.3	176.4	0	0	0	0	0	115	G94 L95 Y100 T101	G94-G98 CarbonylContact O-C 3.59Å; G94-G98 PolarHBondContact O-N 3.37Å; L95-G98 PolarHBondContact O-N 3.09Å; G98-Y100 PolarHBondContact O-N 3.05Å; G98-T101 WeakPolarHBondContact O-CG2 3.48Å; G98-T101 PolarHBondContact O-N 3.4Å; G98-T101 PolarHBondContact O-OG1 3.44Å
99	S	98.3	Very high	98.6	Very high	19 Å²	19	59 Å²	59	13%	0.133	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-67	-14.7	179.5	-52.6	0	0	0	0	113.3	G94 Y97 T101 F102	G94-S99 PolarHBondContact O-N 3.22Å; Y97-S99 PolarHBondContact O-N 3.46Å; S99-T101 PolarHBondContact O-N 2.83Å; S99-T101 VanDerWaalsContact O-N 3.15Å; S99-F102 PolarHBondContact O-N 2.83Å; S99-F102 VanDerWaalsContact O-N 3.13Å
100	Y	98.2	Very high	98.6	Very high	110 Å²	110	58.5 Å²	58.5	43%	0.431	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-61.9	-15.2	172.8	61.2	-100.9	0	0	0	113.5	L95 G98 F102	L95-Y100 HydrophobicContact CD2-CD1 4.38Å; G98-Y100 PolarHBondContact O-N 3.05Å; Y100-F102 PolarHBondContact O-N 2.9Å
101	T	98	Very high	98.6	Very high	86 Å²	86	61.2 Å²	61.2	53%	0.528	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-64.5	-20.8	173	54.7	0	0	0	0	113	G98 S99 M103	G98-T101 WeakPolarHBondContact O-CG2 3.48Å; G98-T101 PolarHBondContact O-N 3.4Å; G98-T101 PolarHBondContact O-OG1 3.44Å; S99-T101 PolarHBondContact O-N 2.83Å; S99-T101 VanDerWaalsContact O-N 3.15Å; T101-M103 PolarHBondContact O-N 3.46Å
102	F	98.1	Very high	98.6	Very high	52 Å²	52	60.1 Å²	60.1	23%	0.228	31%	0.308	C	S	.	.	S	Bend	trans	-78.5	75.5	167.2	-57.1	-30.9	0	0	0	109.7	S99 Y100 E104 T105 W106 T196 N199	S99-F102 PolarHBondContact O-N 2.83Å; S99-F102 VanDerWaalsContact O-N 3.13Å; Y100-F102 PolarHBondContact O-N 2.9Å; F102-E104 PolarHBondContact O-N 3.41Å; F102-T105 PolarHBondContact O-N 3.4Å; F102-W106 WeakPolarHBondContact O-CB 3.36Å; F102-W106 PolarHBondContact O-N 3.36Å; F102-T196 HydrophobicContact CD1-CG2 4.31Å; F102-N199 HydrophobicContact CE2-CB 3.73Å; F102-N199 HydrophobicContact CZ-CB 4.01Å
103	M	98.3	Very high	98.6	Very high	109 Å²	109	60.3 Å²	60.3	54%	0.537	30%	0.3	S	S	.	.	H	α-helix	trans	-54.1	-45	-165	-64.3	-63.5	-79	0	0	113.7	T101 W106 N107	T101-M103 PolarHBondContact O-N 3.46Å; M103-W106 PolarHBondContact O-N 2.91Å; M103-N107 VanDerWaalsContact O-CB 3.3Å; M103-N107 WeakPolarHBondContact O-CB 3.4Å; M103-N107 PolarHBondContact O-N 3.31Å; M103-N107 PolarHBondContact O-ND2 2.97Å; M103-N107 VanDerWaalsContact O-ND2 3.12Å
104	E	98.4	Very high	98.6	Very high	108 Å²	108	64.9 Å²	64.9	51%	0.505	32%	0.321	S	S	.	.	H	α-helix	trans	-65.9	-49.9	-179.7	-55.6	-51.2	151.1	0	0	111.6	F102 W106 N107 I108 F192	F102-E104 PolarHBondContact O-N 3.41Å; E104-W106 VanDerWaalsContact C-N 3.3Å; E104-W106 PolarHBondContact O-N 3.31Å; E104-N107 PolarHBondContact O-N 2.99Å; E104-I108 WeakPolarHBondContact O-CG1 3.46Å; E104-I108 PolarHBondContact O-N 3.43Å; E104-F192 HydrophobicContact CB-CB 4.18Å; E104-F192 HydrophobicContact CB-CD1 3.66Å; E104-F192 HydrophobicContact CB-CD2 4.03Å; E104-F192 HydrophobicContact CB-CE1 3.94Å; E104-F192 HydrophobicContact CB-CE2 4.28Å; E104-F192 HydrophobicContact CB-CG 3.71Å; E104-F192 HydrophobicContact CB-CZ 4.24Å; E104-F192 HydrophobicContact CG-CD1 4.2Å; E104-F192 HydrophobicContact CG-CE1 4.14Å
105	T	98.7	Very high	98.6	Very high	13 Å²	13	65.5 Å²	65.5	8%	0.08	33%	0.326	C	S	.	.	H	α-helix	trans	-56.1	-45.8	174.7	-54	0	0	0	0	110.9	F102 G109 H189 F192 L193	F102-T105 PolarHBondContact O-N 3.4Å; T105-G109 PolarHBondContact O-N 3.2Å; T105-H189 VanDerWaalsContact CG2-CE1 3.42Å; T105-H189 WeakPolarHBondContact CG2-CE1 3.47Å; T105-H189 PolarHBondContact O-CE1 3.43Å; T105-H189 PolarHBondContact O-ND1 3.13Å; T105-F192 VanDerWaalsContact OG1-C 3.31Å; T105-F192 WeakPolarHBondContact OG1-CB 3.24Å; T105-L193 HydrophobicContact CG2-CB 4.1Å; T105-L193 HydrophobicContact CG2-CD1 4.42Å; T105-L193 PolarHBondContact OG1-N 3.45Å
106	W	98.8	Very high	98.6	Very high	66 Å²	66	61.2 Å²	61.2	25%	0.25	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-47.9	179.6	-176.7	-100.9	0	0	0	112.7	V91 L95 F102 M103 E104 I108 G109 V110	V91-W106 HydrophobicContact CG1-CH2 4.23Å; L95-W106 HydrophobicContact CD2-CH2 3.75Å; L95-W106 HydrophobicContact CD2-CZ2 3.94Å; L95-W106 HydrophobicContact CG-CH2 4.01Å; F102-W106 WeakPolarHBondContact O-CB 3.36Å; F102-W106 PolarHBondContact O-N 3.36Å; M103-W106 PolarHBondContact O-N 2.91Å; E104-W106 VanDerWaalsContact C-N 3.3Å; E104-W106 PolarHBondContact O-N 3.31Å; W106-I108 PolarHBondContact O-N 3.27Å; W106-G109 CarbonylContact O-C 3.52Å; W106-G109 VanDerWaalsContact O-CA 3.3Å; W106-G109 WeakPolarHBondContact O-CA 3.49Å; W106-G109 PolarHBondContact O-N 3.26Å; W106-V110 PolarHBondContact O-N 3.27Å
107	N	98.7	Very high	98.6	Very high	76 Å²	76	56.5 Å²	56.5	41%	0.406	29%	0.29	S	S	.	.	H	α-helix	trans	-64.7	-40.5	-179.7	-72.5	-29.7	0	0	0	111.8	M103 E104 G109 V110 L111	M103-N107 VanDerWaalsContact O-CB 3.3Å; M103-N107 WeakPolarHBondContact O-CB 3.4Å; M103-N107 PolarHBondContact O-N 3.31Å; M103-N107 PolarHBondContact O-ND2 2.97Å; M103-N107 VanDerWaalsContact O-ND2 3.12Å; E104-N107 PolarHBondContact O-N 2.99Å; N107-G109 VanDerWaalsContact C-N 3.27Å; N107-G109 PolarHBondContact O-N 3.48Å; N107-V110 PolarHBondContact O-N 3.31Å; N107-L111 PolarHBondContact O-N 3.19Å
108	I	98.8	Very high	98.6	Very high	23 Å²	23	56.2 Å²	56.2	12%	0.118	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-36.7	170.6	-61.2	-61	0	0	0	110.8	E104 W106 V110 L111 L112 V188 H189 F192	E104-I108 WeakPolarHBondContact O-CG1 3.46Å; E104-I108 PolarHBondContact O-N 3.43Å; W106-I108 PolarHBondContact O-N 3.27Å; I108-V110 VanDerWaalsContact C-N 3.33Å; I108-V110 PolarHBondContact O-N 3.39Å; I108-L111 HydrophobicContact CD1-CD1 4.19Å; I108-L111 PolarHBondContact O-N 3.05Å; I108-L112 HydrophobicContact CG2-CD1 4.26Å; I108-L112 HydrophobicContact CG2-CG 4.49Å; I108-L112 WeakPolarHBondContact O-CG 3.26Å; I108-L112 PolarHBondContact O-N 3.25Å; I108-V188 HydrophobicContact CD1-CG1 4.19Å; I108-V188 HydrophobicContact CG1-CG1 4.25Å; I108-H189 HydrophobicContact CB-CB 4.44Å; I108-H189 HydrophobicContact CG2-CB 3.66Å; I108-F192 HydrophobicContact CG1-CD2 4Å; I108-F192 HydrophobicContact CG1-CE2 4.12Å
109	G	98.8	Very high	98.6	Very high	24 Å²	24	55.9 Å²	55.9	25%	0.247	29%	0.291	C	S	.	.	H	α-helix	trans	-59.4	-39.8	173	0	0	0	0	0	113.3	T105 W106 N107 L112 L113 H189	T105-G109 PolarHBondContact O-N 3.2Å; W106-G109 CarbonylContact O-C 3.52Å; W106-G109 VanDerWaalsContact O-CA 3.3Å; W106-G109 WeakPolarHBondContact O-CA 3.49Å; W106-G109 PolarHBondContact O-N 3.26Å; N107-G109 VanDerWaalsContact C-N 3.27Å; N107-G109 PolarHBondContact O-N 3.48Å; G109-L112 WeakPolarHBondContact O-CB 3.32Å; G109-L112 PolarHBondContact O-N 2.88Å; G109-L113 PolarHBondContact O-N 3.32Å; G109-H189 PolarHBondContact N-ND1 3.05Å
110	V	98.8	Very high	98.6	Very high	50 Å²	50	56.5 Å²	56.5	30%	0.303	30%	0.297	S	S	.	.	H	α-helix	trans	-65.5	-42.5	173.8	174.3	0	0	0	0	111.3	W106 N107 I108 L112 L113 F114	W106-V110 PolarHBondContact O-N 3.27Å; N107-V110 PolarHBondContact O-N 3.31Å; I108-V110 VanDerWaalsContact C-N 3.33Å; I108-V110 PolarHBondContact O-N 3.39Å; V110-L112 VanDerWaalsContact C-N 3.34Å; V110-L112 PolarHBondContact O-N 3.48Å; V110-L113 WeakPolarHBondContact O-CB 3.29Å; V110-L113 PolarHBondContact O-N 3.47Å; V110-F114 HydrophobicContact CG1-CD2 3.83Å; V110-F114 HydrophobicContact CG1-CE2 3.45Å; V110-F114 VanDerWaalsContact CG1-CE2 3.45Å; V110-F114 HydrophobicContact CG1-CZ 4.4Å; V110-F114 VanDerWaalsContact O-CD2 3.29Å; V110-F114 WeakPolarHBondContact O-CD2 3.34Å; V110-F114 PolarHBondContact O-N 2.94Å; V110-F114 VanDerWaalsContact O-N 3.08Å
111	L	98.8	Very high	98.7	Very high	93 Å²	93	54.2 Å²	54.2	49%	0.487	29%	0.29	S	S	.	.	H	α-helix	trans	-62.2	-41.8	174.5	-66.4	179.9	0	0	0	112	N107 I108 F114 A115	N107-L111 PolarHBondContact O-N 3.19Å; I108-L111 HydrophobicContact CD1-CD1 4.19Å; I108-L111 PolarHBondContact O-N 3.05Å; L111-F114 PolarHBondContact O-N 3.1Å; L111-A115 WeakPolarHBondContact O-CB 3.45Å; L111-A115 PolarHBondContact O-N 3.28Å
112	L	98.9	Very high	98.7	Very high	21 Å²	21	51 Å²	51	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-44.5	174.2	-79.7	167.3	0	0	0	111.6	I108 G109 V110 F114 A115 V116 I182 L185 A186 H189	I108-L112 HydrophobicContact CG2-CD1 4.26Å; I108-L112 HydrophobicContact CG2-CG 4.49Å; I108-L112 WeakPolarHBondContact O-CG 3.26Å; I108-L112 PolarHBondContact O-N 3.25Å; G109-L112 WeakPolarHBondContact O-CB 3.32Å; G109-L112 PolarHBondContact O-N 2.88Å; V110-L112 VanDerWaalsContact C-N 3.34Å; V110-L112 PolarHBondContact O-N 3.48Å; L112-F114 PolarHBondContact O-N 3.35Å; L112-A115 PolarHBondContact O-N 2.97Å; L112-V116 WeakPolarHBondContact O-CG2 3.46Å; L112-V116 PolarHBondContact O-N 3.22Å; L112-I182 HydrophobicContact CD2-CG2 3.84Å; L112-L185 HydrophobicContact CD2-CB 3.55Å; L112-L185 HydrophobicContact CD2-CD1 4.49Å; L112-L185 HydrophobicContact CG-CB 4.06Å; L112-A186 HydrophobicContact CD2-CB 4.44Å; L112-H189 HydrophobicContact CD1-CB 3.81Å
113	L	98.8	Very high	98.7	Very high	36 Å²	36	49.4 Å²	49.4	19%	0.188	27%	0.267	C	S	.	.	H	α-helix	trans	-57.2	-51	176.4	176.3	62.3	0	0	0	111.1	L87 G109 V110 A115 V116 M117	L87-L113 HydrophobicContact CD1-CD1 4.25Å; G109-L113 PolarHBondContact O-N 3.32Å; V110-L113 WeakPolarHBondContact O-CB 3.29Å; V110-L113 PolarHBondContact O-N 3.47Å; L113-A115 PolarHBondContact O-N 2.84Å; L113-V116 PolarHBondContact O-N 3.15Å; L113-M117 HydrophobicContact CD1-CG 4.39Å; L113-M117 HydrophobicContact CD1-SD 4.24Å; L113-M117 HydrophobicContact CG-SD 4.06Å; L113-M117 VanDerWaalsContact O-CG 3.26Å; L113-M117 WeakPolarHBondContact O-CG 3.48Å; L113-M117 PolarHBondContact O-N 3.48Å
114	F	98.8	Very high	98.7	Very high	121 Å²	121	50.8 Å²	50.8	53%	0.531	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-38.1	178.8	-71.4	-52.4	0	0	0	112.9	V110 L111 L112 M117 A118	V110-F114 HydrophobicContact CG1-CD2 3.83Å; V110-F114 HydrophobicContact CG1-CE2 3.45Å; V110-F114 VanDerWaalsContact CG1-CE2 3.45Å; V110-F114 HydrophobicContact CG1-CZ 4.4Å; V110-F114 VanDerWaalsContact O-CD2 3.29Å; V110-F114 WeakPolarHBondContact O-CD2 3.34Å; V110-F114 PolarHBondContact O-N 2.94Å; V110-F114 VanDerWaalsContact O-N 3.08Å; L111-F114 PolarHBondContact O-N 3.1Å; L112-F114 PolarHBondContact O-N 3.35Å; F114-M117 HydrophobicContact CD1-SD 4.11Å; F114-M117 PolarHBondContact O-N 2.9Å; F114-A118 WeakPolarHBondContact O-CB 3.35Å; F114-A118 PolarHBondContact O-N 3.33Å
115	A	98.8	Very high	98.7	Very high	15 Å²	15	45.7 Å²	45.7	12%	0.124	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-42.9	176.5	0	0	0	0	0	111.8	L111 L112 L113 A118 T119 I182	L111-A115 WeakPolarHBondContact O-CB 3.45Å; L111-A115 PolarHBondContact O-N 3.28Å; L112-A115 PolarHBondContact O-N 2.97Å; L113-A115 PolarHBondContact O-N 2.84Å; A115-A118 PolarHBondContact O-N 3.5Å; A115-T119 WeakPolarHBondContact O-CB 3.44Å; A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 PolarHBondContact O-OG1 3.13Å; A115-I182 HydrophobicContact CB-CD1 4.19Å; A115-I182 HydrophobicContact CB-CG1 3.68Å
116	V	98.9	Very high	98.7	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.055	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-40.1	175.7	176	0	0	0	0	111	F83 F84 L87 L112 L113 T119 A120 I182	F83-V116 HydrophobicContact CD2-CG1 4.12Å; F83-V116 HydrophobicContact CE2-CG1 4.1Å; F83-V116 HydrophobicContact CE2-CG2 3.86Å; F83-V116 HydrophobicContact CG-CG1 4.49Å; F83-V116 HydrophobicContact CZ-CG1 4.43Å; F83-V116 HydrophobicContact CZ-CG2 3.86Å; F84-V116 HydrophobicContact CE1-CG1 4.46Å; F84-V116 HydrophobicContact CE2-CG1 4.18Å; F84-V116 HydrophobicContact CZ-CG1 3.92Å; L87-V116 HydrophobicContact CD1-CB 3.97Å; L87-V116 HydrophobicContact CD1-CG1 3.65Å; L87-V116 HydrophobicContact CD1-CG2 4.29Å; L112-V116 WeakPolarHBondContact O-CG2 3.46Å; L112-V116 PolarHBondContact O-N 3.22Å; L113-V116 PolarHBondContact O-N 3.15Å; V116-T119 PolarHBondContact O-N 3.49Å; V116-A120 WeakPolarHBondContact O-CB 3.44Å; V116-A120 PolarHBondContact O-N 3.47Å; V116-I182 HydrophobicContact CG2-CD1 3.83Å; V116-I182 HydrophobicContact CG2-CG1 4.4Å; V116-I182 HydrophobicContact CG2-CG2 4.18Å
117	M	98.7	Very high	98.7	Very high	91 Å²	91	44.6 Å²	44.6	45%	0.448	24%	0.244	S	C	.	.	H	α-helix	trans	-57.8	-50.4	173.5	-72.6	173.4	71.1	0	0	112.3	F84 L113 F114 T119 A120 F121	F84-M117 HydrophobicContact CE1-CG 3.85Å; F84-M117 HydrophobicContact CZ-CG 4.19Å; L113-M117 HydrophobicContact CD1-CG 4.39Å; L113-M117 HydrophobicContact CD1-SD 4.24Å; L113-M117 HydrophobicContact CG-SD 4.06Å; L113-M117 VanDerWaalsContact O-CG 3.26Å; L113-M117 WeakPolarHBondContact O-CG 3.48Å; L113-M117 PolarHBondContact O-N 3.48Å; F114-M117 HydrophobicContact CD1-SD 4.11Å; F114-M117 PolarHBondContact O-N 2.9Å; M117-T119 VanDerWaalsContact C-N 3.34Å; M117-T119 PolarHBondContact O-N 2.69Å; M117-A120 PolarHBondContact O-N 2.91Å; M117-F121 WeakPolarHBondContact O-CB 3.44Å; M117-F121 PolarHBondContact O-N 3.07Å
118	A	98.6	Very high	98.7	Very high	40 Å²	40	42.9 Å²	42.9	33%	0.331	23%	0.232	S	C	.	.	H	α-helix	trans	-60.8	-45.1	177.4	0	0	0	0	0	111.5	F114 A115 F121 M122	F114-A118 WeakPolarHBondContact O-CB 3.35Å; F114-A118 PolarHBondContact O-N 3.33Å; A115-A118 PolarHBondContact O-N 3.5Å; A118-F121 PolarHBondContact O-N 2.82Å; A118-M122 HydrophobicContact CB-CE 4.1Å; A118-M122 WeakPolarHBondContact O-CE 3.39Å; A118-M122 PolarHBondContact O-N 3.47Å
119	T	98.9	Very high	98.7	Very high	12 Å²	12	42.7 Å²	42.7	7%	0.074	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-49.9	179	-56.9	0	0	0	0	111.3	A115 V116 M117 M122 G123 H175 L178 P179 I182	A115-T119 WeakPolarHBondContact O-CB 3.44Å; A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 PolarHBondContact O-OG1 3.13Å; V116-T119 PolarHBondContact O-N 3.49Å; M117-T119 VanDerWaalsContact C-N 3.34Å; M117-T119 PolarHBondContact O-N 2.69Å; T119-M122 PolarHBondContact O-N 3.46Å; T119-G123 PolarHBondContact O-N 3.35Å; T119-H175 PolarHBondContact O-CE1 3.36Å; T119-H175 PolarHBondContact O-ND1 2.72Å; T119-L178 HydrophobicContact CG2-CB 4.42Å; T119-L178 WeakPolarHBondContact OG1-CB 3.27Å; T119-P179 HydrophobicContact CG2-CG 3.89Å; T119-I182 WeakPolarHBondContact OG1-CD1 3.36Å
120	A	98.7	Very high	98.6	Very high	32 Å²	32	48.2 Å²	48.2	26%	0.264	26%	0.255	S	S	.	.	H	α-helix	trans	-66.7	-39.6	-178.8	0	0	0	0	0	112.5	F84 V116 M117 G123 Y124	F84-A120 HydrophobicContact CE2-CB 3.49Å; F84-A120 VanDerWaalsContact CE2-CB 3.49Å; F84-A120 HydrophobicContact CZ-CB 3.88Å; V116-A120 WeakPolarHBondContact O-CB 3.44Å; V116-A120 PolarHBondContact O-N 3.47Å; M117-A120 PolarHBondContact O-N 2.91Å; A120-G123 PolarHBondContact O-N 2.96Å; A120-Y124 WeakPolarHBondContact O-CB 3.49Å; A120-Y124 PolarHBondContact O-N 3.5Å
121	F	98.8	Very high	98.5	Very high	61 Å²	61	52.4 Å²	52.4	27%	0.268	27%	0.273	S	S	.	.	H	α-helix	trans	-57.4	-52.3	174	169.7	-106.3	0	0	0	111.2	M117 A118 G123 Y124 V125 I139 T140 F171	M117-F121 WeakPolarHBondContact O-CB 3.44Å; M117-F121 PolarHBondContact O-N 3.07Å; A118-F121 PolarHBondContact O-N 2.82Å; F121-G123 VanDerWaalsContact C-N 3.33Å; F121-G123 PolarHBondContact O-N 3.38Å; F121-Y124 WeakPolarHBondContact O-CB 3.39Å; F121-Y124 PolarHBondContact O-N 3.05Å; F121-V125 WeakPolarHBondContact O-CG2 3.31Å; F121-V125 PolarHBondContact O-N 3.11Å; F121-I139 HydrophobicContact CD2-CG2 4.38Å; F121-I139 HydrophobicContact CE2-CB 3.75Å; F121-I139 HydrophobicContact CE2-CG1 4.04Å; F121-I139 HydrophobicContact CE2-CG2 3.73Å; F121-I139 HydrophobicContact CZ-CB 3.94Å; F121-I139 HydrophobicContact CZ-CG2 3.83Å; F121-T140 HydrophobicContact CE1-CG2 4.23Å; F121-T140 HydrophobicContact CZ-CG2 4.14Å; F121-F171 AromaticContact CE1-CE2 3.86Å; F121-F171 HydrophobicContact CE1-CE2 3.86Å; F121-F171 HydrophobicContact CE1-CZ 4.23Å; F121-F171 HydrophobicContact CZ-CE2 4.46Å
122	M	98.6	Very high	98.5	Very high	20 Å²	20	48.4 Å²	48.4	10%	0.099	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-37.7	179.1	-72.8	179.8	-81.1	0	0	112.4	A118 T119 Y124 V125 L126 F171 F174 H175 L178	A118-M122 HydrophobicContact CB-CE 4.1Å; A118-M122 WeakPolarHBondContact O-CE 3.39Å; A118-M122 PolarHBondContact O-N 3.47Å; T119-M122 PolarHBondContact O-N 3.46Å; M122-Y124 VanDerWaalsContact C-N 3.3Å; M122-Y124 PolarHBondContact O-N 3.43Å; M122-V125 WeakPolarHBondContact O-CB 3.38Å; M122-V125 PolarHBondContact O-N 3.25Å; M122-V125 VanDerWaalsContact O-N 3.13Å; M122-L126 WeakPolarHBondContact O-CG 3.35Å; M122-F171 HydrophobicContact CB-CB 4.36Å; M122-F171 HydrophobicContact CB-CD2 4.3Å; M122-F171 HydrophobicContact CB-CG 4.39Å; M122-F171 HydrophobicContact CG-CB 4.34Å; M122-F171 HydrophobicContact CG-CD1 4.28Å; M122-F171 HydrophobicContact CG-CD2 3.85Å; M122-F171 HydrophobicContact CG-CE2 4.18Å; M122-F171 HydrophobicContact CG-CG 3.91Å; M122-F171 HydrophobicContact SD-CD1 4.26Å; M122-F171 HydrophobicContact SD-CG 4.37Å; M122-F174 HydrophobicContact CE-CB 4.05Å; M122-F174 HydrophobicContact SD-CB 3.46Å; M122-F174 WeakPolarHBondContact SD-CB 3.41Å; M122-F174 HydrophobicContact SD-CG 4.32Å; M122-H175 HydrophobicContact CB-CB 4.07Å; M122-L178 HydrophobicContact CE-CD1 3.2Å
123	G	98.6	Very high	98.4	Very high	17 Å²	17	49.9 Å²	49.9	18%	0.175	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-38.8	174.7	0	0	0	0	0	112.8	T119 A120 F121 V125 L126 P127 H175	T119-G123 PolarHBondContact O-N 3.35Å; A120-G123 PolarHBondContact O-N 2.96Å; F121-G123 VanDerWaalsContact C-N 3.33Å; F121-G123 PolarHBondContact O-N 3.38Å; G123-V125 PolarHBondContact O-N 2.99Å; G123-L126 WeakPolarHBondContact O-CB 3.42Å; G123-L126 PolarHBondContact O-N 3.26Å; G123-P127 WeakPolarHBondContact O-CD 3.37Å; G123-H175 WeakPolarHBondContact CA-CE1 3.36Å; G123-H175 VanDerWaalsContact CA-ND1 3.29Å; G123-H175 WeakPolarHBondContact CA-ND1 3.44Å; G123-H175 PolarHBondContact N-ND1 2.97Å
124	Y	98.6	Very high	98.4	Very high	138 Å²	138	55 Å²	55	54%	0.541	28%	0.275	S	S	.	.	H	α-helix	trans	-67.1	-21.5	177.4	-170.9	-99.8	0	0	0	113.4	A120 F121 M122 P127 M131 S132	A120-Y124 WeakPolarHBondContact O-CB 3.49Å; A120-Y124 PolarHBondContact O-N 3.5Å; F121-Y124 WeakPolarHBondContact O-CB 3.39Å; F121-Y124 PolarHBondContact O-N 3.05Å; M122-Y124 VanDerWaalsContact C-N 3.3Å; M122-Y124 PolarHBondContact O-N 3.43Å; Y124-P127 WeakPolarHBondContact O-CD 3.25Å; Y124-M131 HydrophobicContact CE1-CB 4.29Å; Y124-M131 WeakPolarHBondContact OH-CB 3.49Å; Y124-S132 VanDerWaalsContact O-CB 3.27Å; Y124-S132 WeakPolarHBondContact O-CB 3.46Å; Y124-S132 PolarHBondContact O-OG 3.28Å
125	V	98.7	Very high	98.3	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-76.6	-30.2	176	-178.3	0	0	0	0	111.7	F121 M122 G123 W128 A136 F171	F121-V125 WeakPolarHBondContact O-CG2 3.31Å; F121-V125 PolarHBondContact O-N 3.11Å; M122-V125 WeakPolarHBondContact O-CB 3.38Å; M122-V125 PolarHBondContact O-N 3.25Å; M122-V125 VanDerWaalsContact O-N 3.13Å; G123-V125 PolarHBondContact O-N 2.99Å; V125-W128 HydrophobicContact CG1-CE3 3.95Å; V125-W128 HydrophobicContact CG1-CZ3 3.71Å; V125-W128 PolarHBondContact O-N 3.41Å; V125-A136 HydrophobicContact CG1-CB 4.12Å; V125-A136 HydrophobicContact CG2-CB 3.78Å; V125-F171 HydrophobicContact CB-CD2 3.96Å; V125-F171 HydrophobicContact CG1-CD2 4Å; V125-F171 HydrophobicContact CG2-CD2 3.9Å; V125-F171 HydrophobicContact CG2-CE2 4.06Å
126	L	98.8	Very high	98.3	Very high	17 Å²	17	49.9 Å²	49.9	9%	0.089	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-36.4	-170.5	-54.1	-176.9	0	0	0	115.5	Y48 M122 G123 W128 L168 F172 H175	Y48-L126 HydrophobicContact CE2-CB 4.46Å; Y48-L126 WeakPolarHBondContact CE2-O 3.3Å; Y48-L126 PolarHBondContact OH-O 3.12Å; M122-L126 WeakPolarHBondContact O-CG 3.35Å; G123-L126 WeakPolarHBondContact O-CB 3.42Å; G123-L126 PolarHBondContact O-N 3.26Å; L126-W128 PolarHBondContact O-N 3.41Å; L126-W128 VanDerWaalsContact O-N 3.08Å; L126-L168 HydrophobicContact CD2-CD1 4.14Å; L126-F172 HydrophobicContact CD1-CD2 3.94Å; L126-F172 HydrophobicContact CD2-CB 3.86Å; L126-F172 HydrophobicContact CD2-CD2 4.4Å; L126-H175 HydrophobicContact CD1-CB 4.26Å; L126-H175 VanDerWaalsContact CD1-CD2 3.46Å; L126-H175 WeakPolarHBondContact CD1-CD2 3.32Å
127	P	98.5	Very high	98.2	Very high	39 Å²	39	50.9 Å²	50.9	25%	0.253	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.6	174.4	-24.5	35.6	0	0	0	114.3	F56 G123 Y124 G129	F56-P127 WeakPolarHBondContact CA-O 3.49Å; F56-P127 VanDerWaalsContact CD2-O 3.31Å; F56-P127 WeakPolarHBondContact CD2-O 3.44Å; G123-P127 WeakPolarHBondContact O-CD 3.37Å; Y124-P127 WeakPolarHBondContact O-CD 3.25Å; P127-G129 PolarHBondContact O-N 2.91Å
128	W	98.4	Very high	98.2	Very high	40 Å²	40	50.9 Å²	50.9	15%	0.152	27%	0.269	C	S	.	.			trans	54.3	35.7	177.3	-150.9	-112.5	0	0	0	114.3	T52 A55 V125 L126 F133 V163 L168	T52-W128 HydrophobicContact CG2-CH2 4.22Å; T52-W128 HydrophobicContact CG2-CZ2 3.49Å; T52-W128 VanDerWaalsContact CG2-CZ2 3.49Å; A55-W128 HydrophobicContact CB-CB 3.88Å; A55-W128 HydrophobicContact CB-CG 4.47Å; V125-W128 HydrophobicContact CG1-CE3 3.95Å; V125-W128 HydrophobicContact CG1-CZ3 3.71Å; V125-W128 PolarHBondContact O-N 3.41Å; L126-W128 PolarHBondContact O-N 3.41Å; L126-W128 VanDerWaalsContact O-N 3.08Å; W128-F133 HydrophobicContact CH2-CD2 4.07Å; W128-F133 AromaticContact CZ2-CD2 3.79Å; W128-F133 HydrophobicContact CZ2-CD2 3.79Å; W128-F133 HydrophobicContact CZ2-CE2 4.19Å; W128-V163 HydrophobicContact CH2-CG1 3.57Å; W128-V163 HydrophobicContact CZ3-CG1 4.04Å; W128-L168 HydrophobicContact CD2-CD1 4.43Å; W128-L168 HydrophobicContact CD2-CD2 3.88Å; W128-L168 HydrophobicContact CE3-CB 4.22Å; W128-L168 HydrophobicContact CE3-CD1 3.63Å; W128-L168 HydrophobicContact CE3-CD2 3.86Å; W128-L168 HydrophobicContact CE3-CG 4.1Å; W128-L168 HydrophobicContact CG-CD2 4.22Å; W128-L168 HydrophobicContact CH2-CB 4.07Å; W128-L168 HydrophobicContact CZ3-CB 3.8Å; W128-L168 HydrophobicContact CZ3-CD1 3.9Å; W128-L168 HydrophobicContact CZ3-CD2 4.26Å; W128-L168 HydrophobicContact CZ3-CG 4.2Å
129	G	97.9	Very high	98.2	Very high	19 Å²	19	53.1 Å²	53.1	20%	0.196	27%	0.274	C	S	.	.			trans	-81.6	176.9	170.7	0	0	0	0	0	112.8	P127 M131 S132 F133	P127-G129 PolarHBondContact O-N 2.91Å; G129-M131 PolarHBondContact O-N 3.48Å; G129-S132 WeakPolarHBondContact O-CB 3.28Å; G129-S132 PolarHBondContact O-N 3.39Å; G129-S132 VanDerWaalsContact O-N 3.16Å; G129-F133 PolarHBondContact O-N 3.32Å
130	Q	97.9	Very high	98.1	Very high	141 Å²	141	53 Å²	53	66%	0.659	27%	0.273	S	S	*	.	H	α-helix	trans	-55.9	-50.9	179.9	-72.5	-69.1	-2.6	0	0	112.6	S132 F133 W134	Q130-S132 VanDerWaalsContact C-N 3.31Å; Q130-S132 PolarHBondContact O-N 3.28Å; Q130-F133 PolarHBondContact O-N 2.96Å; Q130-W134 PolarHBondContact O-N 2.91Å; Q130-W134 VanDerWaalsContact OE1-NE1 3.07Å
131	M	97.1	Very high	98.1	Very high	137 Å²	137	54.9 Å²	54.9	68%	0.675	28%	0.279	S	S	*	.	H	α-helix	trans	-66	-34.6	178.8	-64.9	-56.2	-126.5	0	0	112.5	Y124 G129 G135	Y124-M131 HydrophobicContact CE1-CB 4.29Å; Y124-M131 WeakPolarHBondContact OH-CB 3.49Å; G129-M131 PolarHBondContact O-N 3.48Å; M131-G135 WeakPolarHBondContact O-CA 3.47Å; M131-G135 PolarHBondContact O-N 3.45Å
132	S	97.1	Very high	98.1	Very high	9 Å²	9	57.5 Å²	57.5	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-50.3	175	-59.8	0	0	0	0	111.3	Y124 G129 Q130 A136	Y124-S132 VanDerWaalsContact O-CB 3.27Å; Y124-S132 WeakPolarHBondContact O-CB 3.46Å; Y124-S132 PolarHBondContact O-OG 3.28Å; G129-S132 WeakPolarHBondContact O-CB 3.28Å; G129-S132 PolarHBondContact O-N 3.39Å; G129-S132 VanDerWaalsContact O-N 3.16Å; Q130-S132 VanDerWaalsContact C-N 3.31Å; Q130-S132 PolarHBondContact O-N 3.28Å; S132-A136 WeakPolarHBondContact O-CB 3.44Å; S132-A136 PolarHBondContact O-N 3.34Å
133	F	97.8	Very high	98	Very high	53 Å²	53	59.5 Å²	59.5	23%	0.232	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-50.9	-178.2	177.5	-92.3	0	0	0	112.7	W128 G129 Q130 A136 T137 V163	W128-F133 HydrophobicContact CH2-CD2 4.07Å; W128-F133 AromaticContact CZ2-CD2 3.79Å; W128-F133 HydrophobicContact CZ2-CD2 3.79Å; W128-F133 HydrophobicContact CZ2-CE2 4.19Å; G129-F133 PolarHBondContact O-N 3.32Å; Q130-F133 PolarHBondContact O-N 2.96Å; F133-A136 PolarHBondContact O-N 3.15Å; F133-T137 PolarHBondContact O-N 3.47Å; F133-T137 PolarHBondContact O-OG1 3.23Å; F133-V163 HydrophobicContact CD2-CG1 4.12Å; F133-V163 HydrophobicContact CE2-CB 4.19Å; F133-V163 HydrophobicContact CE2-CG1 4.12Å; F133-V163 VanDerWaalsContact CE2-O 3.24Å; F133-V163 WeakPolarHBondContact CE2-O 3.43Å
134	W	98.3	Very high	97.9	Very high	144 Å²	144	60.9 Å²	60.9	55%	0.545	31%	0.313	S	S	.	.	H	α-helix	trans	-69.7	-36.4	-178.9	-70.3	115.7	0	0	0	111.8	Q130 T137 V138	Q130-W134 PolarHBondContact O-N 2.91Å; Q130-W134 VanDerWaalsContact OE1-NE1 3.07Å; W134-T137 PolarHBondContact O-N 3.19Å; W134-V138 WeakPolarHBondContact O-CG2 3.36Å; W134-V138 PolarHBondContact O-N 2.86Å
135	G	97.4	Very high	97.9	Very high	26 Å²	26	58.3 Å²	58.3	27%	0.268	32%	0.32	S	S	.	.	H	α-helix	trans	-59.7	-47.2	171.8	0	0	0	0	0	111.7	M131 T137 I139	M131-G135 WeakPolarHBondContact O-CA 3.47Å; M131-G135 PolarHBondContact O-N 3.45Å; G135-T137 PolarHBondContact O-N 3.13Å; G135-I139 WeakPolarHBondContact O-CB 3.32Å; G135-I139 VanDerWaalsContact O-CG1 3.24Å; G135-I139 WeakPolarHBondContact O-CG1 3.32Å; G135-I139 PolarHBondContact O-N 3.31Å
136	A	97.4	Very high	97.9	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-58.2	-49	175.8	0	0	0	0	0	111.7	V125 S132 F133 T140 V163	V125-A136 HydrophobicContact CG1-CB 4.12Å; V125-A136 HydrophobicContact CG2-CB 3.78Å; S132-A136 WeakPolarHBondContact O-CB 3.44Å; S132-A136 PolarHBondContact O-N 3.34Å; F133-A136 PolarHBondContact O-N 3.15Å; A136-T140 WeakPolarHBondContact O-CB 2.95Å; A136-T140 WeakPolarHBondContact O-CG2 3.36Å; A136-T140 PolarHBondContact O-N 2.78Å; A136-T140 PolarHBondContact O-OG1 3.23Å; A136-V163 HydrophobicContact CB-CG1 4.11Å; A136-V163 HydrophobicContact CB-CG2 4.24Å
137	T	97.9	Very high	97.9	Very high	31 Å²	31	65 Å²	65	19%	0.19	36%	0.36	C	S	.	.	H	α-helix	trans	-58.6	-52.5	-179.2	-60.2	0	0	0	0	111.5	F133 W134 G135 T140 N141	F133-T137 PolarHBondContact O-N 3.47Å; F133-T137 PolarHBondContact O-OG1 3.23Å; W134-T137 PolarHBondContact O-N 3.19Å; G135-T137 PolarHBondContact O-N 3.13Å; T137-T140 PolarHBondContact O-OG1 3.09Å; T137-N141 WeakPolarHBondContact O-CB 3.43Å; T137-N141 PolarHBondContact O-N 2.92Å; T137-N141 VanDerWaalsContact O-N 3.14Å
138	V	98.4	Very high	97.8	Very high	91 Å²	91	74.3 Å²	74.3	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-65.7	-48.6	-176.4	172.4	0	0	0	0	111.3	W134 N141 L142	W134-V138 WeakPolarHBondContact O-CG2 3.36Å; W134-V138 PolarHBondContact O-N 2.86Å; V138-N141 PolarHBondContact O-N 3.05Å; V138-L142 PolarHBondContact O-N 3.23Å
139	I	98.1	Very high	97.8	Very high	86 Å²	86	77.3 Å²	77.3	44%	0.441	41%	0.41	S	S	.	.	H	α-helix	trans	-68.2	-45.8	-173.6	-64.6	-62.4	0	0	0	111.7	F121 G135 N141 L142	F121-I139 HydrophobicContact CD2-CG2 4.38Å; F121-I139 HydrophobicContact CE2-CB 3.75Å; F121-I139 HydrophobicContact CE2-CG1 4.04Å; F121-I139 HydrophobicContact CE2-CG2 3.73Å; F121-I139 HydrophobicContact CZ-CB 3.94Å; F121-I139 HydrophobicContact CZ-CG2 3.83Å; G135-I139 WeakPolarHBondContact O-CB 3.32Å; G135-I139 VanDerWaalsContact O-CG1 3.24Å; G135-I139 WeakPolarHBondContact O-CG1 3.32Å; G135-I139 PolarHBondContact O-N 3.31Å; I139-N141 VanDerWaalsContact C-N 3.3Å; I139-N141 PolarHBondContact O-N 3.2Å; I139-L142 HydrophobicContact CD1-CD1 4.37Å; I139-L142 WeakPolarHBondContact O-CB 3.46Å; I139-L142 PolarHBondContact O-N 2.87Å
140	T	98.1	Very high	97.8	Very high	9 Å²	9	76.5 Å²	76.5	6%	0.055	40%	0.402	C	S	.	.	H	α-helix	trans	-67.2	-33.8	179	54.1	0	0	0	0	111.9	F121 A136 T137 L142 L143 V154 I157 W158 F171	F121-T140 HydrophobicContact CE1-CG2 4.23Å; F121-T140 HydrophobicContact CZ-CG2 4.14Å; A136-T140 WeakPolarHBondContact O-CB 2.95Å; A136-T140 WeakPolarHBondContact O-CG2 3.36Å; A136-T140 PolarHBondContact O-N 2.78Å; A136-T140 PolarHBondContact O-OG1 3.23Å; T137-T140 PolarHBondContact O-OG1 3.09Å; T140-L142 PolarHBondContact O-N 3.36Å; T140-L143 WeakPolarHBondContact O-CB 3.45Å; T140-L143 PolarHBondContact O-N 3.32Å; T140-V154 WeakPolarHBondContact O-CG2 3.4Å; T140-I157 HydrophobicContact CG2-CG2 4.34Å; T140-W158 PolarHBondContact OG1-NE1 3.19Å; T140-F171 HydrophobicContact CG2-CZ 4.12Å
141	N	97.8	Very high	97.8	Very high	73 Å²	73	74 Å²	74	39%	0.39	40%	0.396	S	S	.	.	H	α-helix	trans	-69.6	-14.1	178.8	-161.7	43.2	0	0	0	113.7	T137 V138 I139 L143 S144 W158	T137-N141 WeakPolarHBondContact O-CB 3.43Å; T137-N141 PolarHBondContact O-N 2.92Å; T137-N141 VanDerWaalsContact O-N 3.14Å; V138-N141 PolarHBondContact O-N 3.05Å; I139-N141 VanDerWaalsContact C-N 3.3Å; I139-N141 PolarHBondContact O-N 3.2Å; N141-L143 PolarHBondContact O-N 3.42Å; N141-S144 VanDerWaalsContact O-CB 3.25Å; N141-S144 WeakPolarHBondContact O-CB 3.44Å; N141-S144 PolarHBondContact O-N 3.24Å; N141-S144 PolarHBondContact O-OG 3.46Å; N141-W158 HydrophobicContact CB-CH2 4.35Å; N141-W158 HydrophobicContact CB-CZ2 4.14Å
142	L	98	Very high	97.8	Very high	116 Å²	116	71.9 Å²	71.9	61%	0.607	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-57.3	-27.8	170.6	-64.7	175.3	0	0	0	112.5	V138 I139 T140 S144 A145	V138-L142 PolarHBondContact O-N 3.23Å; I139-L142 HydrophobicContact CD1-CD1 4.37Å; I139-L142 WeakPolarHBondContact O-CB 3.46Å; I139-L142 PolarHBondContact O-N 2.87Å; T140-L142 PolarHBondContact O-N 3.36Å; L142-S144 PolarHBondContact O-N 3.04Å; L142-A145 WeakPolarHBondContact O-CB 3.32Å; L142-A145 PolarHBondContact O-N 3.04Å
143	L	97.4	Very high	97.9	Very high	61 Å²	61	74.1 Å²	74.1	32%	0.319	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-67.8	-19.2	177.2	-64.5	171.8	0	0	0	113.1	T140 N141 A145 I146 G150 L153 V154 I157	T140-L143 WeakPolarHBondContact O-CB 3.45Å; T140-L143 PolarHBondContact O-N 3.32Å; N141-L143 PolarHBondContact O-N 3.42Å; L143-A145 PolarHBondContact O-N 3.16Å; L143-A145 VanDerWaalsContact O-N 3.15Å; L143-I146 HydrophobicContact CD2-CD1 4.04Å; L143-I146 WeakPolarHBondContact O-CB 3.39Å; L143-I146 WeakPolarHBondContact O-CG1 3.41Å; L143-I146 PolarHBondContact O-N 3.34Å; L143-I146 VanDerWaalsContact O-N 3.12Å; L143-G150 WeakPolarHBondContact O-CA 3.38Å; L143-L153 HydrophobicContact CB-CD2 4.27Å; L143-L153 HydrophobicContact CD1-CD2 4.26Å; L143-L153 HydrophobicContact CD2-CD2 4.44Å; L143-V154 HydrophobicContact CB-CG2 3.79Å; L143-I157 HydrophobicContact CD1-CD1 3.27Å
144	S	97.6	Very high	97.9	Very high	46 Å²	46	71.7 Å²	71.7	32%	0.322	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-60.4	-22.3	174.1	67.6	0	0	0	0	113	N141 L142 I146	N141-S144 VanDerWaalsContact O-CB 3.25Å; N141-S144 WeakPolarHBondContact O-CB 3.44Å; N141-S144 PolarHBondContact O-N 3.24Å; N141-S144 PolarHBondContact O-OG 3.46Å; L142-S144 PolarHBondContact O-N 3.04Å; S144-I146 PolarHBondContact O-N 3.2Å
145	A	98.3	Very high	97.9	Very high	85 Å²	85	69.2 Å²	69.2	70%	0.702	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-72.7	-10.2	178.7	0	0	0	0	0	113.5	L142 L143 P147	L142-A145 WeakPolarHBondContact O-CB 3.32Å; L142-A145 PolarHBondContact O-N 3.04Å; L143-A145 PolarHBondContact O-N 3.16Å; L143-A145 VanDerWaalsContact O-N 3.15Å; A145-P147 WeakPolarHBondContact O-CD 3.31Å
146	I	98.2	Very high	98	Very high	69 Å²	69	76.8 Å²	76.8	35%	0.354	41%	0.407	S	S	.	.	S	Bend	trans	-70.6	122	176.1	-60.1	173.9	0	0	0	109	L143 S144 I149 G150 L153	L143-I146 HydrophobicContact CD2-CD1 4.04Å; L143-I146 WeakPolarHBondContact O-CB 3.39Å; L143-I146 WeakPolarHBondContact O-CG1 3.41Å; L143-I146 PolarHBondContact O-N 3.34Å; L143-I146 VanDerWaalsContact O-N 3.12Å; S144-I146 PolarHBondContact O-N 3.2Å; I146-I149 HydrophobicContact CB-CG1 4.49Å; I146-I149 HydrophobicContact CG2-CD1 4.04Å; I146-I149 HydrophobicContact CG2-CG1 3.62Å; I146-G150 VanDerWaalsContact O-CA 3.29Å; I146-G150 WeakPolarHBondContact O-CA 3.45Å; I146-G150 PolarHBondContact O-N 3.31Å; I146-L153 HydrophobicContact CD1-CD2 4.13Å
147	P	97.9	Very high	98	Very high	90 Å²	90	78.3 Å²	78.3	58%	0.584	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	142	-178.5	-25.6	34.6	0	0	0	112.7	A145 I149	A145-P147 WeakPolarHBondContact O-CD 3.31Å; P147-I149 PolarHBondContact O-N 2.85Å
148	Y	96.8	Very high	98	Very high	233 Å²	233	77.9 Å²	77.9	91%	0.914	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	-41.9	176.3	-45.6	-67.4	0	0	0	116.6
149	I	98.1	Very high	98	Very high	104 Å²	104	75.5 Å²	75.5	53%	0.533	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-9.6	-172.4	62.5	168.1	0	0	0	114.3	I146 P147 T151 T152 L153	I146-I149 HydrophobicContact CB-CG1 4.49Å; I146-I149 HydrophobicContact CG2-CD1 4.04Å; I146-I149 HydrophobicContact CG2-CG1 3.62Å; P147-I149 PolarHBondContact O-N 2.85Å; I149-T151 PolarHBondContact O-N 3.29Å; I149-T152 PolarHBondContact O-N 3.41Å; I149-L153 WeakPolarHBondContact O-CB 3.41Å; I149-L153 PolarHBondContact O-N 2.79Å
150	G	98.1	Very high	97.9	Very high	2 Å²	2	72.8 Å²	72.8	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-60.6	-49.7	-168.5	0	0	0	0	0	114.4	L143 I146 L153 V154	L143-G150 WeakPolarHBondContact O-CA 3.38Å; I146-G150 VanDerWaalsContact O-CA 3.29Å; I146-G150 WeakPolarHBondContact O-CA 3.45Å; I146-G150 PolarHBondContact O-N 3.31Å; G150-L153 WeakPolarHBondContact O-CB 3.46Å; G150-L153 PolarHBondContact O-N 3.48Å; G150-V154 WeakPolarHBondContact O-CG2 3.48Å; G150-V154 PolarHBondContact O-N 3.48Å
151	T	97.7	Very high	97.9	Very high	87 Å²	87	81 Å²	81	53%	0.534	43%	0.432	S	S	.	.	H	α-helix	trans	-62.4	-46.4	-179.8	50.5	0	0	0	0	111.6	I149 L153 V154 E155	I149-T151 PolarHBondContact O-N 3.29Å; T151-L153 VanDerWaalsContact C-N 3.29Å; T151-L153 PolarHBondContact O-N 3.47Å; T151-V154 PolarHBondContact O-N 3.33Å; T151-E155 PolarHBondContact O-N 2.96Å
152	T	98.3	Very high	97.9	Very high	93 Å²	93	80.5 Å²	80.5	57%	0.571	43%	0.434	S	S	*	.	H	α-helix	trans	-59.1	-39.7	175.6	-50.4	0	0	0	0	111.8	I149 W156	I149-T152 PolarHBondContact O-N 3.41Å; T152-W156 VanDerWaalsContact O-CB 3.24Å; T152-W156 WeakPolarHBondContact O-CB 3.34Å; T152-W156 PolarHBondContact O-N 3.46Å
153	L	98.2	Very high	97.9	Very high	56 Å²	56	75.1 Å²	75.1	29%	0.293	41%	0.406	S	S	.	.	H	α-helix	trans	-65.3	-42.4	177.9	-177.9	63.8	0	0	0	112	L143 I146 I149 G150 T151 W156 I157	L143-L153 HydrophobicContact CB-CD2 4.27Å; L143-L153 HydrophobicContact CD1-CD2 4.26Å; L143-L153 HydrophobicContact CD2-CD2 4.44Å; I146-L153 HydrophobicContact CD1-CD2 4.13Å; I149-L153 WeakPolarHBondContact O-CB 3.41Å; I149-L153 PolarHBondContact O-N 2.79Å; G150-L153 WeakPolarHBondContact O-CB 3.46Å; G150-L153 PolarHBondContact O-N 3.48Å; T151-L153 VanDerWaalsContact C-N 3.29Å; T151-L153 PolarHBondContact O-N 3.47Å; L153-W156 HydrophobicContact CD1-CE3 4.3Å; L153-W156 PolarHBondContact O-N 2.82Å; L153-I157 HydrophobicContact CD1-CD1 4.43Å; L153-I157 HydrophobicContact CG-CD1 4.2Å; L153-I157 VanDerWaalsContact O-CG1 3.32Å; L153-I157 WeakPolarHBondContact O-CG1 3.29Å; L153-I157 PolarHBondContact O-N 2.83Å
154	V	98.5	Very high	97.9	Very high	3 Å²	3	76.3 Å²	76.3	2%	0.018	41%	0.412	C	S	.	.	H	α-helix	trans	-63.5	-50.6	178	172.1	0	0	0	0	111	T140 L143 G150 T151 W156 I157 W158	T140-V154 WeakPolarHBondContact O-CG2 3.4Å; L143-V154 HydrophobicContact CB-CG2 3.79Å; G150-V154 WeakPolarHBondContact O-CG2 3.48Å; G150-V154 PolarHBondContact O-N 3.48Å; T151-V154 PolarHBondContact O-N 3.33Å; V154-W156 PolarHBondContact O-N 3.47Å; V154-I157 PolarHBondContact O-N 3.31Å; V154-I157 VanDerWaalsContact O-N 3.13Å; V154-W158 HydrophobicContact CG1-CD2 3.68Å; V154-W158 VanDerWaalsContact CG1-CE2 3.44Å; V154-W158 HydrophobicContact CG1-CE3 3.73Å; V154-W158 HydrophobicContact CG1-CH2 3.42Å; V154-W158 VanDerWaalsContact CG1-CH2 3.42Å; V154-W158 HydrophobicContact CG1-CZ2 3.34Å; V154-W158 HydrophobicContact CG1-CZ3 3.6Å; V154-W158 PolarHBondContact O-N 2.89Å
155	E	98.3	Very high	97.9	Very high	91 Å²	91	79.1 Å²	79.1	43%	0.425	42%	0.419	S	S	.	.	H	α-helix	trans	-62	-34.7	177.9	-69.5	-179.8	-179.1	0	0	111.7	T151 W158 G159 G160	T151-E155 PolarHBondContact O-N 2.96Å; E155-W158 PolarHBondContact O-N 2.81Å; E155-G159 WeakPolarHBondContact O-CA 3.36Å; E155-G159 PolarHBondContact O-N 3.2Å; E155-G160 WeakPolarHBondContact CA-O 3.36Å; E155-G160 PolarHBondContact O-N 2.96Å
156	W	98.4	Very high	97.9	Very high	186 Å²	186	77 Å²	77	71%	0.705	40%	0.402	S	S	*	.	H	α-helix	trans	-65.2	-44.7	173.6	-179	81.4	0	0	0	112.2	T152 L153 V154 W158 G159 R170	T152-W156 VanDerWaalsContact O-CB 3.24Å; T152-W156 WeakPolarHBondContact O-CB 3.34Å; T152-W156 PolarHBondContact O-N 3.46Å; L153-W156 HydrophobicContact CD1-CE3 4.3Å; L153-W156 PolarHBondContact O-N 2.82Å; V154-W156 PolarHBondContact O-N 3.47Å; W156-W158 VanDerWaalsContact C-N 3.33Å; W156-W158 PolarHBondContact O-N 3.08Å; W156-G159 PolarHBondContact O-N 3.08Å; W156-R170 PolarHBondContact O-NH1 3.49Å
157	I	97.7	Very high	98	Very high	33 Å²	33	73.8 Å²	73.8	17%	0.169	39%	0.385	C	S	.	.	H	α-helix	trans	-61.9	-42.2	176	-71.7	168.5	0	0	0	110.6	T140 L143 L153 V154 R170 F171	T140-I157 HydrophobicContact CG2-CG2 4.34Å; L143-I157 HydrophobicContact CD1-CD1 3.27Å; L153-I157 HydrophobicContact CD1-CD1 4.43Å; L153-I157 HydrophobicContact CG-CD1 4.2Å; L153-I157 VanDerWaalsContact O-CG1 3.32Å; L153-I157 WeakPolarHBondContact O-CG1 3.29Å; L153-I157 PolarHBondContact O-N 2.83Å; V154-I157 PolarHBondContact O-N 3.31Å; V154-I157 VanDerWaalsContact O-N 3.13Å; I157-R170 WeakPolarHBondContact O-CD 3.26Å; I157-R170 PolarHBondContact O-NH1 2.87Å; I157-F171 HydrophobicContact CG2-CE1 4.23Å; I157-F171 HydrophobicContact CG2-CZ 4.42Å
158	W	98.5	Very high	98	Very high	21 Å²	21	69.5 Å²	69.5	8%	0.08	36%	0.358	C	S	.	.	H	α-helix	trans	-70.8	-33.4	177	-65.4	-14.2	0	0	0	112.4	T140 N141 V154 E155 W156 G160 F161 S162 V163 T167	T140-W158 PolarHBondContact OG1-NE1 3.19Å; N141-W158 HydrophobicContact CB-CH2 4.35Å; N141-W158 HydrophobicContact CB-CZ2 4.14Å; V154-W158 HydrophobicContact CG1-CD2 3.68Å; V154-W158 VanDerWaalsContact CG1-CE2 3.44Å; V154-W158 HydrophobicContact CG1-CE3 3.73Å; V154-W158 HydrophobicContact CG1-CH2 3.42Å; V154-W158 VanDerWaalsContact CG1-CH2 3.42Å; V154-W158 HydrophobicContact CG1-CZ2 3.34Å; V154-W158 HydrophobicContact CG1-CZ3 3.6Å; V154-W158 PolarHBondContact O-N 2.89Å; E155-W158 PolarHBondContact O-N 2.81Å; W156-W158 VanDerWaalsContact C-N 3.33Å; W156-W158 PolarHBondContact O-N 3.08Å; W158-G160 VanDerWaalsContact C-N 3.3Å; W158-F161 WeakPolarHBondContact CZ3-O 3.33Å; W158-S162 VanDerWaalsContact CE3-CA 3.43Å; W158-V163 HydrophobicContact CD2-CG2 4.35Å; W158-V163 HydrophobicContact CG-CG2 4.31Å; W158-V163 HydrophobicContact CZ2-CG2 4.31Å; W158-T167 WeakPolarHBondContact CA-OG1 3.3Å; W158-T167 PolarHBondContact O-N 3.25Å; W158-T167 PolarHBondContact O-OG1 2.77Å
159	G	97.8	Very high	98.1	Very high	41 Å²	41	61.2 Å²	61.2	42%	0.423	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	32.1	-168.6	0	0	0	0	0	112.5	E155 W156 R170	E155-G159 WeakPolarHBondContact O-CA 3.36Å; E155-G159 PolarHBondContact O-N 3.2Å; W156-G159 PolarHBondContact O-N 3.08Å; G159-R170 VanDerWaalsContact CA-NH2 3.27Å
160	G	96.8	Very high	98.1	Very high	30 Å²	30	59.9 Å²	59.9	31%	0.309	32%	0.319	S	S	.	.	S	Bend	trans	171.1	-171	-174.2	0	0	0	0	0	111	E155 W158 S162	E155-G160 WeakPolarHBondContact CA-O 3.36Å; E155-G160 PolarHBondContact O-N 2.96Å; W158-G160 VanDerWaalsContact C-N 3.3Å; G160-S162 VanDerWaalsContact C-N 3.34Å
161	F	97.7	Very high	98.1	Very high	181 Å²	181	60.3 Å²	60.3	79%	0.794	32%	0.321	S	S	*	.	S	Bend	trans	-84.1	-8.8	-176.8	-55.1	-68.1	0	0	0	114.1	W158	W158-F161 WeakPolarHBondContact CZ3-O 3.33Å
162	S	97.4	Very high	98.2	Very high	62 Å²	62	58.4 Å²	58.4	43%	0.434	31%	0.305	S	S	.	.	S	Bend	trans	-154.5	168.5	179.4	58.2	0	0	0	0	110.4	W158 G160 D164	W158-S162 VanDerWaalsContact CE3-CA 3.43Å; G160-S162 VanDerWaalsContact C-N 3.34Å; S162-D164 PolarHBondContact O-N 3.41Å
163	V	98.3	Very high	98.2	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	30%	0.3	C	S	.	.	S	Bend	trans	-62.2	117.3	167.3	173.8	0	0	0	0	109.1	W128 F133 A136 W158 T167	W128-V163 HydrophobicContact CH2-CG1 3.57Å; W128-V163 HydrophobicContact CZ3-CG1 4.04Å; F133-V163 HydrophobicContact CD2-CG1 4.12Å; F133-V163 HydrophobicContact CE2-CB 4.19Å; F133-V163 HydrophobicContact CE2-CG1 4.12Å; F133-V163 VanDerWaalsContact CE2-O 3.24Å; F133-V163 WeakPolarHBondContact CE2-O 3.43Å; A136-V163 HydrophobicContact CB-CG1 4.11Å; A136-V163 HydrophobicContact CB-CG2 4.24Å; W158-V163 HydrophobicContact CD2-CG2 4.35Å; W158-V163 HydrophobicContact CG-CG2 4.31Å; W158-V163 HydrophobicContact CZ2-CG2 4.31Å; V163-T167 HydrophobicContact CG1-CG2 4.19Å; V163-T167 HydrophobicContact CG2-CG2 4.48Å
164	D	98.1	Very high	98.2	Very high	86 Å²	86	59.2 Å²	59.2	46%	0.46	31%	0.309	S	S	.	.	S	Bend	trans	-154.6	-159.4	-179	-163.3	1.6	0	0	0	110.9	S162 A166 T167 L168	S162-D164 PolarHBondContact O-N 3.41Å; D164-A166 VanDerWaalsContact C-N 3.32Å; D164-A166 PolarHBondContact O-N 3.39Å; D164-T167 PolarHBondContact N-OG1 2.93Å; D164-T167 WeakPolarHBondContact O-CA 3.44Å; D164-T167 VanDerWaalsContact O-CB 3.28Å; D164-T167 WeakPolarHBondContact O-CB 3.48Å; D164-T167 PolarHBondContact O-N 3.2Å; D164-T167 PolarHBondContact O-OG1 2.94Å; D164-L168 PolarHBondContact O-N 3.34Å
165	K	97.9	Very high	98.2	Very high	105 Å²	105	60.4 Å²	60.4	46%	0.457	31%	0.314	S	S	.	.	H	α-helix	trans	-49.5	-43.8	-177.4	179.6	170.5	174.9	158.4	0	114.6	D51 T52 T167 L168 T169	D51-K165 WeakPolarHBondContact OD2-CE 3.15Å; D51-K165 IonicContact OD2-NZ 2.68Å; D51-K165 PolarHBondContact OD2-NZ 3.08Å; T52-K165 HydrophobicContact CG2-CB 4.04Å; K165-T167 VanDerWaalsContact C-N 3.3Å; K165-T167 PolarHBondContact O-N 3.22Å; K165-L168 PolarHBondContact O-N 3.3Å; K165-T169 WeakPolarHBondContact O-CB 3.35Å; K165-T169 PolarHBondContact O-N 3.42Å; K165-T169 PolarHBondContact O-OG1 3.41Å
166	A	98.1	Very high	98.2	Very high	42 Å²	42	60 Å²	60	35%	0.347	31%	0.312	S	S	.	.	H	α-helix	trans	-63.3	-38.2	178.2	0	0	0	0	0	111.9	D164 R170	D164-A166 VanDerWaalsContact C-N 3.32Å; D164-A166 PolarHBondContact O-N 3.39Å; A166-R170 VanDerWaalsContact O-CG 3.31Å; A166-R170 WeakPolarHBondContact O-CG 3.46Å; A166-R170 PolarHBondContact O-N 2.7Å; A166-R170 PolarHBondContact O-NE 3.3Å
167	T	98.4	Very high	98.3	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	30%	0.301	C	S	.	.	H	α-helix	trans	-67.5	-47.5	176.1	-40.5	0	0	0	0	111.5	W158 V163 D164 K165 T169 R170 F171	W158-T167 WeakPolarHBondContact CA-OG1 3.3Å; W158-T167 PolarHBondContact O-N 3.25Å; W158-T167 PolarHBondContact O-OG1 2.77Å; V163-T167 HydrophobicContact CG1-CG2 4.19Å; V163-T167 HydrophobicContact CG2-CG2 4.48Å; D164-T167 PolarHBondContact N-OG1 2.93Å; D164-T167 WeakPolarHBondContact O-CA 3.44Å; D164-T167 VanDerWaalsContact O-CB 3.28Å; D164-T167 WeakPolarHBondContact O-CB 3.48Å; D164-T167 PolarHBondContact O-N 3.2Å; D164-T167 PolarHBondContact O-OG1 2.94Å; K165-T167 VanDerWaalsContact C-N 3.3Å; K165-T167 PolarHBondContact O-N 3.22Å; T167-T169 PolarHBondContact O-N 3.44Å; T167-R170 VanDerWaalsContact O-CG 3.24Å; T167-R170 WeakPolarHBondContact O-CG 3.46Å; T167-R170 PolarHBondContact O-N 3.34Å; T167-F171 HydrophobicContact CG2-CD1 4.17Å; T167-F171 HydrophobicContact CG2-CD2 4.46Å; T167-F171 HydrophobicContact CG2-CE1 3.9Å; T167-F171 HydrophobicContact CG2-CE2 4.23Å; T167-F171 HydrophobicContact CG2-CG 4.43Å; T167-F171 HydrophobicContact CG2-CZ 3.94Å; T167-F171 VanDerWaalsContact O-CB 3.3Å; T167-F171 WeakPolarHBondContact O-CB 3.37Å; T167-F171 WeakPolarHBondContact O-CD1 3.3Å; T167-F171 WeakPolarHBondContact O-CG 3.38Å; T167-F171 PolarHBondContact O-N 3.49Å
168	L	98.6	Very high	98.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-45.2	-178.2	-178.9	56.1	0	0	0	112	T52 A55 L126 W128 D164 K165 R170 F171 F172	T52-L168 HydrophobicContact CG2-CB 4.42Å; T52-L168 HydrophobicContact CG2-CD2 3.93Å; A55-L168 HydrophobicContact CB-CD2 3.68Å; L126-L168 HydrophobicContact CD2-CD1 4.14Å; W128-L168 HydrophobicContact CD2-CD1 4.43Å; W128-L168 HydrophobicContact CD2-CD2 3.88Å; W128-L168 HydrophobicContact CE3-CB 4.22Å; W128-L168 HydrophobicContact CE3-CD1 3.63Å; W128-L168 HydrophobicContact CE3-CD2 3.86Å; W128-L168 HydrophobicContact CE3-CG 4.1Å; W128-L168 HydrophobicContact CG-CD2 4.22Å; W128-L168 HydrophobicContact CH2-CB 4.07Å; W128-L168 HydrophobicContact CZ3-CB 3.8Å; W128-L168 HydrophobicContact CZ3-CD1 3.9Å; W128-L168 HydrophobicContact CZ3-CD2 4.26Å; W128-L168 HydrophobicContact CZ3-CG 4.2Å; D164-L168 PolarHBondContact O-N 3.34Å; K165-L168 PolarHBondContact O-N 3.3Å; L168-R170 PolarHBondContact O-N 2.92Å; L168-F171 PolarHBondContact O-N 3.39Å; L168-F172 PolarHBondContact O-N 3.45Å
169	T	98.6	Very high	98.3	Very high	59 Å²	59	55.3 Å²	55.3	36%	0.362	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-45.5	-178.4	-52.3	0	0	0	0	111.3	S50 K165 T167 F172 A173	S50-T169 PolarHBondContact O-OG1 2.88Å; K165-T169 WeakPolarHBondContact O-CB 3.35Å; K165-T169 PolarHBondContact O-N 3.42Å; K165-T169 PolarHBondContact O-OG1 3.41Å; T167-T169 PolarHBondContact O-N 3.44Å; T169-F172 PolarHBondContact O-N 2.93Å; T169-A173 PolarHBondContact O-N 3.33Å
170	R	98.3	Very high	98.4	Very high	75 Å²	75	58.1 Å²	58.1	28%	0.283	30%	0.303	S	S	.	.	H	α-helix	trans	-72.2	-35.2	178.8	72.9	-175.5	64.3	-166.3	-11.5	112.3	W156 I157 G159 A166 T167 L168 F172 A173 F174	W156-R170 PolarHBondContact O-NH1 3.49Å; I157-R170 WeakPolarHBondContact O-CD 3.26Å; I157-R170 PolarHBondContact O-NH1 2.87Å; G159-R170 VanDerWaalsContact CA-NH2 3.27Å; A166-R170 VanDerWaalsContact O-CG 3.31Å; A166-R170 WeakPolarHBondContact O-CG 3.46Å; A166-R170 PolarHBondContact O-N 2.7Å; A166-R170 PolarHBondContact O-NE 3.3Å; T167-R170 VanDerWaalsContact O-CG 3.24Å; T167-R170 WeakPolarHBondContact O-CG 3.46Å; T167-R170 PolarHBondContact O-N 3.34Å; L168-R170 PolarHBondContact O-N 2.92Å; R170-F172 VanDerWaalsContact C-N 3.29Å; R170-F172 PolarHBondContact O-N 3.44Å; R170-A173 PolarHBondContact O-N 3.35Å; R170-F174 HydrophobicContact CB-CD2 4.39Å; R170-F174 HydrophobicContact CB-CE2 4.34Å; R170-F174 WeakPolarHBondContact O-CD2 3.27Å; R170-F174 PolarHBondContact O-N 3.33Å
171	F	98.7	Very high	98.5	Very high	11 Å²	11	60.5 Å²	60.5	5%	0.048	31%	0.308	C	S	.	.	H	α-helix	trans	-64.7	-37.1	176.7	-85.1	22.7	0	0	0	110.8	F121 M122 V125 T140 I157 T167 L168 H175	F121-F171 AromaticContact CE1-CE2 3.86Å; F121-F171 HydrophobicContact CE1-CE2 3.86Å; F121-F171 HydrophobicContact CE1-CZ 4.23Å; F121-F171 HydrophobicContact CZ-CE2 4.46Å; M122-F171 HydrophobicContact CB-CB 4.36Å; M122-F171 HydrophobicContact CB-CD2 4.3Å; M122-F171 HydrophobicContact CB-CG 4.39Å; M122-F171 HydrophobicContact CG-CB 4.34Å; M122-F171 HydrophobicContact CG-CD1 4.28Å; M122-F171 HydrophobicContact CG-CD2 3.85Å; M122-F171 HydrophobicContact CG-CE2 4.18Å; M122-F171 HydrophobicContact CG-CG 3.91Å; M122-F171 HydrophobicContact SD-CD1 4.26Å; M122-F171 HydrophobicContact SD-CG 4.37Å; V125-F171 HydrophobicContact CB-CD2 3.96Å; V125-F171 HydrophobicContact CG1-CD2 4Å; V125-F171 HydrophobicContact CG2-CD2 3.9Å; V125-F171 HydrophobicContact CG2-CE2 4.06Å; T140-F171 HydrophobicContact CG2-CZ 4.12Å; I157-F171 HydrophobicContact CG2-CE1 4.23Å; I157-F171 HydrophobicContact CG2-CZ 4.42Å; T167-F171 HydrophobicContact CG2-CD1 4.17Å; T167-F171 HydrophobicContact CG2-CD2 4.46Å; T167-F171 HydrophobicContact CG2-CE1 3.9Å; T167-F171 HydrophobicContact CG2-CE2 4.23Å; T167-F171 HydrophobicContact CG2-CG 4.43Å; T167-F171 HydrophobicContact CG2-CZ 3.94Å; T167-F171 VanDerWaalsContact O-CB 3.3Å; T167-F171 WeakPolarHBondContact O-CB 3.37Å; T167-F171 WeakPolarHBondContact O-CD1 3.3Å; T167-F171 WeakPolarHBondContact O-CG 3.38Å; T167-F171 PolarHBondContact O-N 3.49Å; L168-F171 PolarHBondContact O-N 3.39Å; F171-H175 WeakPolarHBondContact O-CB 3.46Å; F171-H175 PolarHBondContact O-N 3.22Å
172	F	98.8	Very high	98.5	Very high	47 Å²	47	52.1 Å²	52.1	21%	0.206	27%	0.271	C	S	.	.	H	α-helix	trans	-59.9	-48.5	170.3	177.2	-113.3	0	0	0	111.7	A45 Y48 L126 L168 T169 R170 F174 H175 F176	A45-F172 HydrophobicContact CB-CE2 4.28Å; A45-F172 HydrophobicContact CB-CZ 4.06Å; Y48-F172 AromaticContact CD1-CD2 3.72Å; Y48-F172 HydrophobicContact CD1-CD2 3.72Å; Y48-F172 AromaticContact CD1-CE2 3.61Å; Y48-F172 HydrophobicContact CD1-CE2 3.61Å; Y48-F172 HydrophobicContact CD1-CG 4.34Å; Y48-F172 HydrophobicContact CD1-CZ 4.15Å; Y48-F172 HydrophobicContact CE1-CB 4.38Å; Y48-F172 AromaticContact CE1-CD2 3.59Å; Y48-F172 HydrophobicContact CE1-CD2 3.59Å; Y48-F172 HydrophobicContact CE1-CE2 4.01Å; Y48-F172 AromaticContact CE1-CG 3.97Å; Y48-F172 HydrophobicContact CE1-CG 3.97Å; L126-F172 HydrophobicContact CD1-CD2 3.94Å; L126-F172 HydrophobicContact CD2-CB 3.86Å; L126-F172 HydrophobicContact CD2-CD2 4.4Å; L168-F172 PolarHBondContact O-N 3.45Å; T169-F172 PolarHBondContact O-N 2.93Å; R170-F172 VanDerWaalsContact C-N 3.29Å; R170-F172 PolarHBondContact O-N 3.44Å; F172-F174 PolarHBondContact O-N 3Å; F172-H175 PolarHBondContact O-N 2.99Å; F172-F176 HydrophobicContact CZ-CD2 4.4Å; F172-F176 WeakPolarHBondContact O-CB 3.33Å; F172-F176 PolarHBondContact O-N 3.48Å
173	A	98.8	Very high	98.6	Very high	57 Å²	57	50.7 Å²	50.7	47%	0.471	26%	0.263	S	S	.	.	H	α-helix	trans	-60.2	-45.5	178.6	0	0	0	0	0	112.7	T169 R170 F176 I177	T169-A173 PolarHBondContact O-N 3.33Å; R170-A173 PolarHBondContact O-N 3.35Å; A173-F176 PolarHBondContact O-N 3.19Å; A173-I177 PolarHBondContact O-N 3.08Å; A173-I177 VanDerWaalsContact O-N 3.11Å
174	F	98.8	Very high	98.6	Very high	109 Å²	109	53.2 Å²	53.2	48%	0.478	28%	0.284	S	S	.	.	H	α-helix	trans	-67.1	-42	177	-76.3	-58.9	0	0	0	112.5	M122 R170 F172 F176 I177 L178	M122-F174 HydrophobicContact CE-CB 4.05Å; M122-F174 HydrophobicContact SD-CB 3.46Å; M122-F174 WeakPolarHBondContact SD-CB 3.41Å; M122-F174 HydrophobicContact SD-CG 4.32Å; R170-F174 HydrophobicContact CB-CD2 4.39Å; R170-F174 HydrophobicContact CB-CE2 4.34Å; R170-F174 WeakPolarHBondContact O-CD2 3.27Å; R170-F174 PolarHBondContact O-N 3.33Å; F172-F174 PolarHBondContact O-N 3Å; F174-F176 PolarHBondContact O-N 2.93Å; F174-I177 WeakPolarHBondContact O-CG2 3.45Å; F174-I177 PolarHBondContact O-N 3.28Å; F174-L178 WeakPolarHBondContact O-CB 3.4Å; F174-L178 WeakPolarHBondContact O-CD1 3.38Å; F174-L178 VanDerWaalsContact O-CG 3.27Å; F174-L178 WeakPolarHBondContact O-CG 3.34Å; F174-L178 PolarHBondContact O-N 3.24Å
175	H	98.9	Very high	98.6	Very high	28 Å²	28	51 Å²	51	13%	0.13	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-33.9	175	-179.3	69.9	0	0	0	111.9	T119 M122 G123 L126 F171 F172 P179	T119-H175 PolarHBondContact O-CE1 3.36Å; T119-H175 PolarHBondContact O-ND1 2.72Å; M122-H175 HydrophobicContact CB-CB 4.07Å; G123-H175 WeakPolarHBondContact CA-CE1 3.36Å; G123-H175 VanDerWaalsContact CA-ND1 3.29Å; G123-H175 WeakPolarHBondContact CA-ND1 3.44Å; G123-H175 PolarHBondContact N-ND1 2.97Å; L126-H175 HydrophobicContact CD1-CB 4.26Å; L126-H175 VanDerWaalsContact CD1-CD2 3.46Å; L126-H175 WeakPolarHBondContact CD1-CD2 3.32Å; F171-H175 WeakPolarHBondContact O-CB 3.46Å; F171-H175 PolarHBondContact O-N 3.22Å; F172-H175 PolarHBondContact O-N 2.99Å; H175-P179 WeakPolarHBondContact O-CD 3.49Å; H175-P179 WeakPolarHBondContact O-CG 3.43Å
176	F	98.8	Very high	98.7	Very high	83 Å²	83	47.4 Å²	47.4	36%	0.364	26%	0.262	S	S	.	.	H	α-helix	trans	-72.6	-43.2	177.9	-166.1	-82.9	0	0	0	112.7	L42 A45 F172 A173 F174 F180	L42-F176 HydrophobicContact CD1-CE2 4.23Å; L42-F176 HydrophobicContact CD1-CZ 3.99Å; A45-F176 HydrophobicContact CB-CD2 4.25Å; A45-F176 HydrophobicContact CB-CE2 3.93Å; F172-F176 HydrophobicContact CZ-CD2 4.4Å; F172-F176 WeakPolarHBondContact O-CB 3.33Å; F172-F176 PolarHBondContact O-N 3.48Å; A173-F176 PolarHBondContact O-N 3.19Å; F174-F176 PolarHBondContact O-N 2.93Å; F176-F180 HydrophobicContact CD1-CE2 4.09Å; F176-F180 AromaticContact CE1-CE2 3.86Å; F176-F180 HydrophobicContact CE1-CE2 3.86Å; F176-F180 HydrophobicContact CE1-CZ 4.45Å; F176-F180 VanDerWaalsContact O-CD2 3.28Å; F176-F180 WeakPolarHBondContact O-CD2 3.28Å; F176-F180 VanDerWaalsContact O-CE2 3.25Å; F176-F180 WeakPolarHBondContact O-CE2 3.09Å
177	I	98.8	Very high	98.7	Very high	93 Å²	93	51.1 Å²	51.1	48%	0.477	27%	0.274	S	S	.	.	H	α-helix	trans	-76.6	-36.5	-176.5	-166.2	97.3	0	0	0	113	A173 F174 F180 I181	A173-I177 PolarHBondContact O-N 3.08Å; A173-I177 VanDerWaalsContact O-N 3.11Å; F174-I177 WeakPolarHBondContact O-CG2 3.45Å; F174-I177 PolarHBondContact O-N 3.28Å; I177-F180 WeakPolarHBondContact O-CB 3.44Å; I177-F180 PolarHBondContact O-N 3.4Å; I177-F180 VanDerWaalsContact O-N 3.09Å; I177-I181 HydrophobicContact CG1-CD1 4.29Å; I177-I181 PolarHBondContact O-N 2.98Å
178	L	98.7	Very high	98.7	Very high	30 Å²	30	53.7 Å²	53.7	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-37.8	-171.8	-78.2	166.6	0	0	0	115.3	T119 M122 F174 F180 I181 I182	T119-L178 HydrophobicContact CG2-CB 4.42Å; T119-L178 WeakPolarHBondContact OG1-CB 3.27Å; M122-L178 HydrophobicContact CE-CD1 3.2Å; F174-L178 WeakPolarHBondContact O-CB 3.4Å; F174-L178 WeakPolarHBondContact O-CD1 3.38Å; F174-L178 VanDerWaalsContact O-CG 3.27Å; F174-L178 WeakPolarHBondContact O-CG 3.34Å; F174-L178 PolarHBondContact O-N 3.24Å; L178-F180 PolarHBondContact O-N 2.82Å; L178-I181 HydrophobicContact CD2-CD1 4.05Å; L178-I181 CarbonylContact O-C 3.41Å; L178-I181 WeakPolarHBondContact O-CA 3.17Å; L178-I181 WeakPolarHBondContact O-CB 3.41Å; L178-I181 PolarHBondContact O-N 3.42Å; L178-I182 WeakPolarHBondContact O-CG1 3.21Å; L178-I182 PolarHBondContact O-N 2.95Å
179	P	98.8	Very high	98.7	Very high	19 Å²	19	55.1 Å²	55.1	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-53.9	-34.3	173.1	-29.2	35	0	0	0	114	I38 T119 H175 I182 A183	I38-P179 HydrophobicContact CD1-CB 4.23Å; I38-P179 HydrophobicContact CG1-CB 3.72Å; T119-P179 HydrophobicContact CG2-CG 3.89Å; H175-P179 WeakPolarHBondContact O-CD 3.49Å; H175-P179 WeakPolarHBondContact O-CG 3.43Å; P179-I182 PolarHBondContact O-N 2.91Å; P179-A183 PolarHBondContact O-N 2.85Å
180	F	98.6	Very high	98.7	Very high	100 Å²	100	55.8 Å²	55.8	44%	0.439	30%	0.298	S	S	.	.	H	α-helix	trans	-75.4	-35.1	176.7	-57.9	-76.7	0	0	0	112.1	I38 F176 I177 L178 I182 A183 A184	I38-F180 HydrophobicContact CG2-CE1 4.08Å; I38-F180 HydrophobicContact CG2-CZ 4.25Å; F176-F180 HydrophobicContact CD1-CE2 4.09Å; F176-F180 AromaticContact CE1-CE2 3.86Å; F176-F180 HydrophobicContact CE1-CE2 3.86Å; F176-F180 HydrophobicContact CE1-CZ 4.45Å; F176-F180 VanDerWaalsContact O-CD2 3.28Å; F176-F180 WeakPolarHBondContact O-CD2 3.28Å; F176-F180 VanDerWaalsContact O-CE2 3.25Å; F176-F180 WeakPolarHBondContact O-CE2 3.09Å; I177-F180 WeakPolarHBondContact O-CB 3.44Å; I177-F180 PolarHBondContact O-N 3.4Å; I177-F180 VanDerWaalsContact O-N 3.09Å; L178-F180 PolarHBondContact O-N 2.82Å; F180-I182 VanDerWaalsContact C-N 3.33Å; F180-A183 PolarHBondContact O-N 3.12Å; F180-A184 PolarHBondContact O-N 3.33Å
181	I	98.8	Very high	98.7	Very high	79 Å²	79	56.6 Å²	56.6	41%	0.405	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-41.8	171	-62.9	170.7	0	0	0	109.9	I177 L178 A183 A184 L185	I177-I181 HydrophobicContact CG1-CD1 4.29Å; I177-I181 PolarHBondContact O-N 2.98Å; L178-I181 HydrophobicContact CD2-CD1 4.05Å; L178-I181 CarbonylContact O-C 3.41Å; L178-I181 WeakPolarHBondContact O-CA 3.17Å; L178-I181 WeakPolarHBondContact O-CB 3.41Å; L178-I181 PolarHBondContact O-N 3.42Å; I181-A183 VanDerWaalsContact C-N 3.33Å; I181-A183 PolarHBondContact O-N 3.11Å; I181-A184 PolarHBondContact O-N 2.93Å; I181-L185 HydrophobicContact CG2-CD1 4.21Å; I181-L185 HydrophobicContact CG2-CG 4.5Å; I181-L185 WeakPolarHBondContact O-CG 3.49Å; I181-L185 PolarHBondContact O-N 2.81Å
182	I	98.9	Very high	98.6	Very high	6 Å²	6	59.3 Å²	59.3	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-42.9	174.5	-68.3	162.1	0	0	0	110.5	L34 L112 A115 V116 T119 L178 P179 F180 A184 L185 A186	L34-I182 HydrophobicContact CD1-CB 4.37Å; L34-I182 HydrophobicContact CD1-CG2 3.89Å; L34-I182 HydrophobicContact CD2-CG2 3.97Å; L112-I182 HydrophobicContact CD2-CG2 3.84Å; A115-I182 HydrophobicContact CB-CD1 4.19Å; A115-I182 HydrophobicContact CB-CG1 3.68Å; V116-I182 HydrophobicContact CG2-CD1 3.83Å; V116-I182 HydrophobicContact CG2-CG1 4.4Å; V116-I182 HydrophobicContact CG2-CG2 4.18Å; T119-I182 WeakPolarHBondContact OG1-CD1 3.36Å; L178-I182 WeakPolarHBondContact O-CG1 3.21Å; L178-I182 PolarHBondContact O-N 2.95Å; P179-I182 PolarHBondContact O-N 2.91Å; F180-I182 VanDerWaalsContact C-N 3.33Å; I182-A184 VanDerWaalsContact C-N 3.35Å; I182-A184 PolarHBondContact O-N 2.77Å; I182-L185 PolarHBondContact O-N 3.49Å; I182-A186 WeakPolarHBondContact O-CB 3.32Å; I182-A186 PolarHBondContact O-N 3.39Å
183	A	98.8	Very high	98.6	Very high	32 Å²	32	58.8 Å²	58.8	26%	0.264	32%	0.318	S	S	.	.	H	α-helix	trans	-60.6	-42.8	175.6	0	0	0	0	0	112.2	L34 P179 F180 I181 A186 I187	L34-A183 HydrophobicContact CD2-CB 4.02Å; P179-A183 PolarHBondContact O-N 2.85Å; F180-A183 PolarHBondContact O-N 3.12Å; I181-A183 VanDerWaalsContact C-N 3.33Å; I181-A183 PolarHBondContact O-N 3.11Å; A183-A186 PolarHBondContact O-N 3.39Å; A183-I187 WeakPolarHBondContact O-CG1 3.34Å; A183-I187 PolarHBondContact O-N 3.46Å; A183-I187 VanDerWaalsContact O-N 3.15Å
184	A	98.7	Very high	98.5	Very high	55 Å²	55	59.4 Å²	59.4	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-64.3	-44.5	175.3	0	0	0	0	0	112.2	F180 I181 I182 A186 I187 V188	F180-A184 PolarHBondContact O-N 3.33Å; I181-A184 PolarHBondContact O-N 2.93Å; I182-A184 VanDerWaalsContact C-N 3.35Å; I182-A184 PolarHBondContact O-N 2.77Å; A184-A186 VanDerWaalsContact C-N 3.3Å; A184-A186 PolarHBondContact O-N 3.09Å; A184-I187 WeakPolarHBondContact O-CB 3.29Å; A184-I187 PolarHBondContact O-N 2.91Å; A184-V188 PolarHBondContact O-N 3.09Å; A184-V188 VanDerWaalsContact O-N 3.16Å
185	L	98.7	Very high	98.4	Very high	41 Å²	41	61.3 Å²	61.3	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-62.8	-35.6	175.2	-73.3	173.4	0	0	0	112.2	L112 I181 I182 I187 V188 H189	L112-L185 HydrophobicContact CD2-CB 3.55Å; L112-L185 HydrophobicContact CD2-CD1 4.49Å; L112-L185 HydrophobicContact CG-CB 4.06Å; I181-L185 HydrophobicContact CG2-CD1 4.21Å; I181-L185 HydrophobicContact CG2-CG 4.5Å; I181-L185 WeakPolarHBondContact O-CG 3.49Å; I181-L185 PolarHBondContact O-N 2.81Å; I182-L185 PolarHBondContact O-N 3.49Å; L185-I187 VanDerWaalsContact C-N 3.33Å; L185-I187 PolarHBondContact O-N 3.35Å; L185-V188 PolarHBondContact O-N 2.82Å; L185-H189 WeakPolarHBondContact O-CB 3.33Å; L185-H189 PolarHBondContact O-N 2.96Å
186	A	98.7	Very high	98.2	Very high	29 Å²	29	63.6 Å²	63.6	24%	0.24	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-35.5	176.1	0	0	0	0	0	112	L112 I182 A183 A184 H189 L190	L112-A186 HydrophobicContact CD2-CB 4.44Å; I182-A186 WeakPolarHBondContact O-CB 3.32Å; I182-A186 PolarHBondContact O-N 3.39Å; A183-A186 PolarHBondContact O-N 3.39Å; A184-A186 VanDerWaalsContact C-N 3.3Å; A184-A186 PolarHBondContact O-N 3.09Å; A186-H189 WeakPolarHBondContact O-CB 3.35Å; A186-H189 PolarHBondContact O-N 3.17Å; A186-L190 WeakPolarHBondContact O-CG 3.5Å; A186-L190 PolarHBondContact O-N 3.22Å
187	I	98.4	Very high	98.1	Very high	119 Å²	119	60.2 Å²	60.2	61%	0.61	33%	0.326	S	S	*	.	H	α-helix	trans	-63.7	-45	172	-66	166.5	0	0	0	110.4	A183 A184 L185 H189 L190 L191	A183-I187 WeakPolarHBondContact O-CG1 3.34Å; A183-I187 PolarHBondContact O-N 3.46Å; A183-I187 VanDerWaalsContact O-N 3.15Å; A184-I187 WeakPolarHBondContact O-CB 3.29Å; A184-I187 PolarHBondContact O-N 2.91Å; L185-I187 VanDerWaalsContact C-N 3.33Å; L185-I187 PolarHBondContact O-N 3.35Å; I187-H189 VanDerWaalsContact C-N 3.32Å; I187-H189 PolarHBondContact O-N 3.46Å; I187-L190 PolarHBondContact O-N 3.48Å; I187-L191 WeakPolarHBondContact O-CB 3.36Å; I187-L191 PolarHBondContact O-N 3Å
188	V	98.6	Very high	98	Very high	56 Å²	56	57.5 Å²	57.5	34%	0.339	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-39.4	176.3	177.1	0	0	0	0	111.4	I108 A184 L185 L190 L191 F192	I108-V188 HydrophobicContact CD1-CG1 4.19Å; I108-V188 HydrophobicContact CG1-CG1 4.25Å; A184-V188 PolarHBondContact O-N 3.09Å; A184-V188 VanDerWaalsContact O-N 3.16Å; L185-V188 PolarHBondContact O-N 2.82Å; V188-L190 PolarHBondContact O-N 2.95Å; V188-L191 WeakPolarHBondContact O-CB 3.31Å; V188-L191 PolarHBondContact O-N 3.47Å; V188-F192 HydrophobicContact CG1-CD2 3.89Å; V188-F192 HydrophobicContact CG1-CE2 3.66Å; V188-F192 WeakPolarHBondContact O-CD2 3.24Å; V188-F192 PolarHBondContact O-N 3.35Å; V188-F192 VanDerWaalsContact O-N 3.08Å
189	H	98.6	Very high	97.9	Very high	29 Å²	29	57.2 Å²	57.2	13%	0.134	31%	0.314	C	S	.	.	H	α-helix	trans	-59.7	-46.2	175.7	-172.9	76	0	0	0	111.8	T105 I108 G109 L112 L185 A186 I187 L193	T105-H189 VanDerWaalsContact CG2-CE1 3.42Å; T105-H189 WeakPolarHBondContact CG2-CE1 3.47Å; T105-H189 PolarHBondContact O-CE1 3.43Å; T105-H189 PolarHBondContact O-ND1 3.13Å; I108-H189 HydrophobicContact CB-CB 4.44Å; I108-H189 HydrophobicContact CG2-CB 3.66Å; G109-H189 PolarHBondContact N-ND1 3.05Å; L112-H189 HydrophobicContact CD1-CB 3.81Å; L185-H189 WeakPolarHBondContact O-CB 3.33Å; L185-H189 PolarHBondContact O-N 2.96Å; A186-H189 WeakPolarHBondContact O-CB 3.35Å; A186-H189 PolarHBondContact O-N 3.17Å; I187-H189 VanDerWaalsContact C-N 3.32Å; I187-H189 PolarHBondContact O-N 3.46Å; H189-L193 WeakPolarHBondContact O-CB 3.17Å; H189-L193 PolarHBondContact O-N 3.06Å
190	L	98.3	Very high	97.9	Very high	73 Å²	73	56.4 Å²	56.4	38%	0.382	31%	0.309	S	S	.	.	H	α-helix	trans	-68.9	-33.8	176.8	-70.7	173.7	0	0	0	112.4	A186 I187 V188 L193 H194	A186-L190 WeakPolarHBondContact O-CG 3.5Å; A186-L190 PolarHBondContact O-N 3.22Å; I187-L190 PolarHBondContact O-N 3.48Å; V188-L190 PolarHBondContact O-N 2.95Å; L190-L193 HydrophobicContact CD2-CD2 4.14Å; L190-L193 PolarHBondContact O-N 3.37Å; L190-H194 WeakPolarHBondContact O-CB 3.18Å; L190-H194 PolarHBondContact O-CD2 3.41Å; L190-H194 PolarHBondContact O-N 2.95Å
191	L	97.8	Very high	97.9	Very high	93 Å²	93	53.6 Å²	53.6	49%	0.487	30%	0.301	S	S	.	.	H	α-helix	trans	-59	-53.1	174.5	-174.8	158.6	0	0	0	110.4	I187 V188 L193 H194 E195	I187-L191 WeakPolarHBondContact O-CB 3.36Å; I187-L191 PolarHBondContact O-N 3Å; V188-L191 WeakPolarHBondContact O-CB 3.31Å; V188-L191 PolarHBondContact O-N 3.47Å; L191-L193 VanDerWaalsContact C-N 3.3Å; L191-L193 PolarHBondContact O-N 3.06Å; L191-H194 PolarHBondContact O-N 3.36Å; L191-H194 VanDerWaalsContact O-N 3.11Å; L191-E195 PolarHBondContact O-N 3.46Å
192	F	98.3	Very high	97.8	Very high	67 Å²	67	54 Å²	54	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-35.3	177.1	-75.2	-59.5	0	0	0	113	E104 T105 I108 V188 H194 E195	E104-F192 HydrophobicContact CB-CB 4.18Å; E104-F192 HydrophobicContact CB-CD1 3.66Å; E104-F192 HydrophobicContact CB-CD2 4.03Å; E104-F192 HydrophobicContact CB-CE1 3.94Å; E104-F192 HydrophobicContact CB-CE2 4.28Å; E104-F192 HydrophobicContact CB-CG 3.71Å; E104-F192 HydrophobicContact CB-CZ 4.24Å; E104-F192 HydrophobicContact CG-CD1 4.2Å; E104-F192 HydrophobicContact CG-CE1 4.14Å; T105-F192 VanDerWaalsContact OG1-C 3.31Å; T105-F192 WeakPolarHBondContact OG1-CB 3.24Å; I108-F192 HydrophobicContact CG1-CD2 4Å; I108-F192 HydrophobicContact CG1-CE2 4.12Å; V188-F192 HydrophobicContact CG1-CD2 3.89Å; V188-F192 HydrophobicContact CG1-CE2 3.66Å; V188-F192 WeakPolarHBondContact O-CD2 3.24Å; V188-F192 PolarHBondContact O-N 3.35Å; V188-F192 VanDerWaalsContact O-N 3.08Å; F192-H194 VanDerWaalsContact C-N 3.29Å; F192-H194 PolarHBondContact O-N 3Å; F192-E195 PolarHBondContact O-N 2.91Å
193	L	98	Very high	97.6	Very high	36 Å²	36	56.1 Å²	56.1	19%	0.188	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-38.2	173.6	179.2	64.5	0	0	0	112	T105 H189 L190 L191 E195 T196 G197	T105-L193 HydrophobicContact CG2-CB 4.1Å; T105-L193 HydrophobicContact CG2-CD1 4.42Å; T105-L193 PolarHBondContact OG1-N 3.45Å; H189-L193 WeakPolarHBondContact O-CB 3.17Å; H189-L193 PolarHBondContact O-N 3.06Å; L190-L193 HydrophobicContact CD2-CD2 4.14Å; L190-L193 PolarHBondContact O-N 3.37Å; L191-L193 VanDerWaalsContact C-N 3.3Å; L191-L193 PolarHBondContact O-N 3.06Å; L193-E195 VanDerWaalsContact C-N 3.31Å; L193-E195 PolarHBondContact O-N 3.21Å; L193-T196 PolarHBondContact O-N 3.16Å; L193-T196 PolarHBondContact O-OG1 3.41Å; L193-G197 CarbonylContact O-C 3.24Å; L193-G197 VanDerWaalsContact O-CA 3.32Å; L193-G197 WeakPolarHBondContact O-CA 3.46Å; L193-G197 PolarHBondContact O-N 2.93Å
194	H	97.1	Very high	97.5	Very high	70 Å²	70	60.5 Å²	60.5	32%	0.324	35%	0.349	S	S	.	.	H	α-helix	trans	-74.2	-19.9	-178.8	-69.6	174	0	0	0	113.5	L190 L191 F192 T196	L190-H194 WeakPolarHBondContact O-CB 3.18Å; L190-H194 PolarHBondContact O-CD2 3.41Å; L190-H194 PolarHBondContact O-N 2.95Å; L191-H194 PolarHBondContact O-N 3.36Å; L191-H194 VanDerWaalsContact O-N 3.11Å; F192-H194 VanDerWaalsContact C-N 3.29Å; F192-H194 PolarHBondContact O-N 3Å; H194-T196 VanDerWaalsContact C-N 3.34Å
195	E	96.3	Very high	97.3	Very high	149 Å²	149	63.8 Å²	63.8	70%	0.696	36%	0.359	S	S	*	.	H	α-helix	trans	-65.1	-37.3	171.8	-66.9	-62.4	130.9	0	0	112	L191 F192 L193	L191-E195 PolarHBondContact O-N 3.46Å; F192-E195 PolarHBondContact O-N 2.91Å; L193-E195 VanDerWaalsContact C-N 3.31Å; L193-E195 PolarHBondContact O-N 3.21Å
196	T	94.6	Very high	97.2	Very high	76 Å²	76	62.7 Å²	62.7	47%	0.466	36%	0.355	S	S	.	.	H	α-helix	trans	-101	-23.8	-179.3	60.1	0	0	0	0	113.6	F102 L193 H194	F102-T196 HydrophobicContact CD1-CG2 4.31Å; L193-T196 PolarHBondContact O-N 3.16Å; L193-T196 PolarHBondContact O-OG1 3.41Å; H194-T196 VanDerWaalsContact C-N 3.34Å
197	G	95.8	Very high	97.1	Very high	12 Å²	12	66.2 Å²	66.2	12%	0.124	37%	0.369	C	S	.	.			trans	75.2	175.7	-162.9	0	0	0	0	0	112.8	L193	L193-G197 CarbonylContact O-C 3.24Å; L193-G197 VanDerWaalsContact O-CA 3.32Å; L193-G197 WeakPolarHBondContact O-CA 3.46Å; L193-G197 PolarHBondContact O-N 2.93Å
198	S	97.2	Very high	97	Very high	37 Å²	37	65.6 Å²	65.6	26%	0.259	38%	0.382	S	S	.	.			trans	-73.6	141.9	179	-73.4	0	0	0	0	112.3	P17	P17-S198 WeakPolarHBondContact CG-O 3.44Å
199	N	97.8	Very high	96.9	Very high	23 Å²	23	67.4 Å²	67.4	12%	0.123	39%	0.39	C	S	.	.			trans	-68.8	174.9	160.9	-167.6	16.7	0	0	0	110	I20 W24 Y97 F102	I20-N199 WeakPolarHBondContact CG2-O 3.28Å; W24-N199 VanDerWaalsContact CE2-O 3.23Å; W24-N199 HydrophobicContact CZ2-CB 4.35Å; W24-N199 WeakPolarHBondContact CZ2-O 3.44Å; W24-N199 PolarHBondContact NE1-O 2.86Å; Y97-N199 PolarHBondContact O-ND2 2.99Å; F102-N199 HydrophobicContact CE2-CB 3.73Å; F102-N199 HydrophobicContact CZ-CB 4.01Å
200	N	98.4	Very high	96.9	Very high	3 Å²	3	69.3 Å²	69.3	2%	0.016	40%	0.398	C	S	.	.			trans	-142.1	168.8	177	74.7	83.9	0	0	0	112.8	P17 N19 I20 T202 G203 L204	P17-N200 HydrophobicContact CB-CB 3.74Å; P17-N200 HydrophobicContact CG-CB 4.05Å; N19-N200 PolarHBondContact ND2-OD1 3.01Å; N19-N200 VanDerWaalsContact ND2-OD1 3.14Å; N19-N200 WeakPolarHBondContact OD1-CB 3.38Å; I20-N200 HydrophobicContact CG2-CB 4.05Å; N200-T202 PolarHBondContact O-N 2.97Å; N200-T202 VanDerWaalsContact O-N 3.13Å; N200-T202 PolarHBondContact OD1-N 3.03Å; N200-T202 VanDerWaalsContact OD1-N 3.08Å; N200-T202 PolarHBondContact OD1-OG1 3.47Å; N200-G203 PolarHBondContact O-N 3.22Å; N200-G203 VanDerWaalsContact O-N 3.1Å; N200-L204 PolarHBondContact ND2-O 3.33Å
201	P	98.3	Very high	96.9	Very high	40 Å²	40	67.6 Å²	67.6	26%	0.26	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-23.1	-172	-28.6	37.7	0	0	0	116.5	N19 W24 Y97	N19-P201 VanDerWaalsContact O-CD 3.28Å; N19-P201 WeakPolarHBondContact O-CD 3.47Å; N19-P201 WeakPolarHBondContact O-CG 3.49Å; W24-P201 HydrophobicContact CH2-CG 4.2Å; W24-P201 HydrophobicContact CZ3-CG 3.93Å; Y97-P201 HydrophobicContact CD1-CB 4.28Å; Y97-P201 HydrophobicContact CE1-CB 3.7Å; Y97-P201 HydrophobicContact CE1-CG 4.46Å
202	T	97.3	Very high	96.9	Very high	87 Å²	87	65.9 Å²	65.9	53%	0.534	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-14.4	179.6	68.2	0	0	0	0	112.7	N200 L204	N200-T202 PolarHBondContact O-N 2.97Å; N200-T202 VanDerWaalsContact O-N 3.13Å; N200-T202 PolarHBondContact OD1-N 3.03Å; N200-T202 VanDerWaalsContact OD1-N 3.08Å; N200-T202 PolarHBondContact OD1-OG1 3.47Å; T202-L204 PolarHBondContact O-N 2.68Å; T202-L204 PolarHBondContact OG1-N 2.82Å
203	G	95	Very high	96.9	Very high	51 Å²	51	64.3 Å²	64.3	53%	0.526	38%	0.376	S	S	.	.			trans	68.2	6	-175	0	0	0	0	0	114.6	N200	N200-G203 PolarHBondContact O-N 3.22Å; N200-G203 VanDerWaalsContact O-N 3.1Å
204	L	95.4	Very high	96.9	Very high	125 Å²	125	67.3 Å²	67.3	65%	0.654	39%	0.389	S	S	*	.	S	Bend	trans	-89.8	159.5	176.9	-58.7	178.3	0	0	0	111	N200 T202 S206	N200-L204 PolarHBondContact ND2-O 3.33Å; T202-L204 PolarHBondContact O-N 2.68Å; T202-L204 PolarHBondContact OG1-N 2.82Å; L204-S206 PolarHBondContact O-N 3.47Å
205	N	95.9	Very high	96.9	Very high	123 Å²	123	67.2 Å²	67.2	66%	0.658	39%	0.394	S	S	*	.			trans	-60.1	129.8	172	-173	-21.7	0	0	0	109.8	D207	N205-D207 PolarHBondContact ND2-OD2 3.36Å; N205-D207 VanDerWaalsContact OD1-CB 3.28Å; N205-D207 WeakPolarHBondContact OD1-CB 3.41Å; N205-D207 PolarHBondContact OD1-N 3.45Å; N205-D207 PolarHBondContact OD1-OD2 3.06Å; N205-D207 VanDerWaalsContact OD1-OD2 3.06Å
206	S	96.1	Very high	97	Very high	19 Å²	19	66.2 Å²	66.2	13%	0.133	39%	0.385	C	S	.	.			trans	-103.7	3.9	-177.4	56.9	0	0	0	0	114.3	P17 L204 A208 D209 K210	P17-S206 WeakPolarHBondContact CG-OG 3.44Å; L204-S206 PolarHBondContact O-N 3.47Å; S206-A208 PolarHBondContact O-N 2.92Å; S206-A208 VanDerWaalsContact O-N 3.08Å; S206-D209 CarbonylContact O-C 3.57Å; S206-D209 VanDerWaalsContact O-C 3.24Å; S206-D209 PolarHBondContact O-N 2.86Å; S206-K210 WeakPolarHBondContact O-CG 3.39Å
207	D	96.1	Very high	97.2	Very high	102 Å²	102	63.1 Å²	63.1	55%	0.545	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.1	-177.6	-70.7	-28.3	0	0	0	113.3	N205 D209 K210	N205-D207 PolarHBondContact ND2-OD2 3.36Å; N205-D207 VanDerWaalsContact OD1-CB 3.28Å; N205-D207 WeakPolarHBondContact OD1-CB 3.41Å; N205-D207 PolarHBondContact OD1-N 3.45Å; N205-D207 PolarHBondContact OD1-OD2 3.06Å; N205-D207 VanDerWaalsContact OD1-OD2 3.06Å; D207-D209 VanDerWaalsContact C-N 3.27Å; D207-D209 PolarHBondContact O-N 3.42Å; D207-K210 WeakPolarHBondContact OD1-CE 3.41Å; D207-K210 IonicContact OD1-NZ 2.65Å; D207-K210 PolarHBondContact OD1-NZ 3.49Å
208	A	96.1	Very high	97.3	Very high	107 Å²	107	64.5 Å²	64.5	88%	0.884	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-19.8	175.9	0	0	0	0	0	113.7	S206	S206-A208 PolarHBondContact O-N 2.92Å; S206-A208 VanDerWaalsContact O-N 3.08Å
209	D	97.1	Very high	97.3	Very high	93 Å²	93	68.1 Å²	68.1	50%	0.497	39%	0.387	S	S	.	.	S	Bend	trans	-146.3	76.9	-177.3	-173.3	23.9	0	0	0	111.7	S18 S206 D207	S18-D209 VanDerWaalsContact CB-OD2 3.3Å; S18-D209 WeakPolarHBondContact CB-OD2 3.3Å; S18-D209 PolarHBondContact N-O 3.49Å; S18-D209 VanDerWaalsContact OG-CG 3.24Å; S18-D209 PolarHBondContact OG-OD2 3.33Å; S206-D209 CarbonylContact O-C 3.57Å; S206-D209 VanDerWaalsContact O-C 3.24Å; S206-D209 PolarHBondContact O-N 2.86Å; D207-D209 VanDerWaalsContact C-N 3.27Å; D207-D209 PolarHBondContact O-N 3.42Å
210	K	97.7	Very high	97.4	Very high	70 Å²	70	69.4 Å²	69.4	30%	0.304	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143	171.7	-66.6	-172.2	174.2	167.2	0	110.7	P15 A16 S206 D207	P15-K210 HydrophobicContact CB-CB 4.14Å; P15-K210 HydrophobicContact CB-CD 3.86Å; A16-K210 VanDerWaalsContact O-CA 3.31Å; A16-K210 WeakPolarHBondContact O-CA 3.24Å; S206-K210 WeakPolarHBondContact O-CG 3.39Å; D207-K210 WeakPolarHBondContact OD1-CE 3.41Å; D207-K210 IonicContact OD1-NZ 2.65Å; D207-K210 PolarHBondContact OD1-NZ 3.49Å
211	I	98.1	Very high	97.4	Very high	37 Å²	37	70.4 Å²	70.4	19%	0.19	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	152	173.2	61.9	179.6	0	0	0	109.4	A16 Y216 Y217	A16-I211 PolarHBondContact N-O 3.49Å; A16-I211 PolarHBondContact O-N 2.99Å; I211-Y216 HydrophobicContact CB-CD2 4.12Å; I211-Y216 HydrophobicContact CB-CE2 4.28Å; I211-Y216 HydrophobicContact CD1-CD1 4.3Å; I211-Y216 HydrophobicContact CD1-CD2 3.95Å; I211-Y216 HydrophobicContact CD1-CG 3.77Å; I211-Y216 HydrophobicContact CG1-CD2 4.28Å; I211-Y217 HydrophobicContact CD1-CE2 3.81Å; I211-Y217 HydrophobicContact CG1-CE2 3.82Å
212	P	97.8	Very high	97.4	Very high	56 Å²	56	72.4 Å²	72.4	36%	0.364	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	147.2	173.5	28.4	-35.7	0	0	0	110.3	H214 Y216	P212-H214 VanDerWaalsContact C-N 3.33Å; P212-H214 WeakPolarHBondContact CB-O 3.38Å; P212-H214 WeakPolarHBondContact CG-O 3.44Å; P212-H214 PolarHBondContact O-N 2.61Å; P212-Y216 HydrophobicContact CG-CD2 4.3Å; P212-Y216 HydrophobicContact CG-CE2 4.17Å; P212-Y216 WeakPolarHBondContact O-CD2 3.32Å
213	F	98.3	Very high	97.5	Very high	35 Å²	35	73.2 Å²	73.2	15%	0.154	40%	0.404	C	S	.	.	S	Bend	trans	-62	-42.8	178.8	-170.8	-84	0	0	0	111.7	F11 I12 L14 P215 Y216 Y217 T218	F11-F213 VanDerWaalsContact O-CD1 3.25Å; F11-F213 WeakPolarHBondContact O-CD1 3.13Å; I12-F213 PolarHBondContact O-N 2.96Å; L14-F213 HydrophobicContact CB-CB 3.96Å; L14-F213 HydrophobicContact CD2-CD2 4.14Å; L14-F213 WeakPolarHBondContact O-CB 3.36Å; L14-F213 PolarHBondContact O-N 2.77Å; F213-P215 CarbonylContact O-C 3.58Å; F213-Y216 PolarHBondContact O-N 2.99Å; F213-Y217 HydrophobicContact CD2-CD2 4.1Å; F213-Y217 HydrophobicContact CD2-CG 4.16Å; F213-Y217 HydrophobicContact CE2-CG 4.21Å; F213-Y217 PolarHBondContact O-N 3.14Å; F213-T218 PolarHBondContact O-N 3.44Å
214	H	98	Very high	97.6	Very high	98 Å²	98	71.4 Å²	71.4	45%	0.454	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	133.2	170.6	-172.3	73	0	0	0	111	I12 P212 T218	I12-H214 HydrophobicContact CG2-CB 4.02Å; I12-H214 PolarHBondContact O-N 3.49Å; P212-H214 VanDerWaalsContact C-N 3.33Å; P212-H214 WeakPolarHBondContact CB-O 3.38Å; P212-H214 WeakPolarHBondContact CG-O 3.44Å; P212-H214 PolarHBondContact O-N 2.61Å; H214-T218 PolarHBondContact ND1-OG1 2.99Å; H214-T218 VanDerWaalsContact ND1-OG1 3.16Å
215	P	98	Very high	97.8	Very high	68 Å²	68	67.4 Å²	67.4	44%	0.442	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.6	-12	1.8	35.2	-35.7	0	0	0	114.5	F213 Y217 T218 I219	F213-P215 CarbonylContact O-C 3.58Å; P215-Y217 PolarHBondContact O-N 2.93Å; P215-T218 PolarHBondContact O-N 3.36Å; P215-I219 WeakPolarHBondContact O-CG2 3.49Å; P215-I219 PolarHBondContact O-N 3.23Å
216	Y	98.3	Very high	97.9	Very high	128 Å²	128	66.9 Å²	66.9	50%	0.502	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-53.6	-163	-62.3	-78.1	0	0	0	114	I211 P212 F213 I219 K220	I211-Y216 HydrophobicContact CB-CD2 4.12Å; I211-Y216 HydrophobicContact CB-CE2 4.28Å; I211-Y216 HydrophobicContact CD1-CD1 4.3Å; I211-Y216 HydrophobicContact CD1-CD2 3.95Å; I211-Y216 HydrophobicContact CD1-CG 3.77Å; I211-Y216 HydrophobicContact CG1-CD2 4.28Å; P212-Y216 HydrophobicContact CG-CD2 4.3Å; P212-Y216 HydrophobicContact CG-CE2 4.17Å; P212-Y216 WeakPolarHBondContact O-CD2 3.32Å; F213-Y216 PolarHBondContact O-N 2.99Å; Y216-I219 WeakPolarHBondContact O-CG2 3.42Å; Y216-K220 WeakPolarHBondContact O-CB 3.22Å; Y216-K220 PolarHBondContact O-N 3.22Å
217	Y	98.3	Very high	98	Very high	11 Å²	11	70.1 Å²	70.1	4%	0.043	38%	0.377	C	S	.	.	H	α-helix	trans	-84.2	-25.6	-180	-66.4	-57.1	0	0	0	112.4	A16 P17 S18 I20 I211 F213 P215 K220 D221	A16-Y217 HydrophobicContact CB-CD2 3.58Å; A16-Y217 HydrophobicContact CB-CE2 3.42Å; A16-Y217 VanDerWaalsContact CB-CE2 3.42Å; P17-Y217 PolarHBondContact O-OH 3.05Å; S18-Y217 VanDerWaalsContact C-OH 3.3Å; S18-Y217 PolarHBondContact O-OH 3.29Å; I20-Y217 HydrophobicContact CD1-CD1 3.82Å; I20-Y217 HydrophobicContact CD1-CD2 4.3Å; I20-Y217 HydrophobicContact CD1-CE1 3.52Å; I20-Y217 HydrophobicContact CD1-CE2 3.97Å; I20-Y217 HydrophobicContact CD1-CG 4.24Å; I20-Y217 HydrophobicContact CG1-CD1 4.07Å; I20-Y217 HydrophobicContact CG1-CE1 3.25Å; I20-Y217 HydrophobicContact CG1-CE2 4.06Å; I20-Y217 WeakPolarHBondContact CG1-OH 3.46Å; I211-Y217 HydrophobicContact CD1-CE2 3.81Å; I211-Y217 HydrophobicContact CG1-CE2 3.82Å; F213-Y217 HydrophobicContact CD2-CD2 4.1Å; F213-Y217 HydrophobicContact CD2-CG 4.16Å; F213-Y217 HydrophobicContact CE2-CG 4.21Å; F213-Y217 PolarHBondContact O-N 3.14Å; P215-Y217 PolarHBondContact O-N 2.93Å; Y217-K220 HydrophobicContact CD1-CD 3.82Å; Y217-K220 HydrophobicContact CE1-CD 4.04Å; Y217-K220 PolarHBondContact O-N 2.95Å; Y217-D221 VanDerWaalsContact O-CB 3.23Å; Y217-D221 WeakPolarHBondContact O-CB 3.25Å; Y217-D221 VanDerWaalsContact O-CG 3.32Å; Y217-D221 PolarHBondContact O-N 2.73Å
218	T	98.2	Very high	98.1	Very high	42 Å²	42	65.6 Å²	65.6	26%	0.258	35%	0.352	S	S	.	.	H	α-helix	trans	-57.8	-51.2	170.1	-44	0	0	0	0	111.5	F213 H214 P215 D221 I222	F213-T218 PolarHBondContact O-N 3.44Å; H214-T218 PolarHBondContact ND1-OG1 2.99Å; H214-T218 VanDerWaalsContact ND1-OG1 3.16Å; P215-T218 PolarHBondContact O-N 3.36Å; T218-D221 PolarHBondContact O-N 3.48Å; T218-I222 HydrophobicContact CG2-CD1 4.17Å; T218-I222 VanDerWaalsContact O-CG1 3.27Å; T218-I222 WeakPolarHBondContact O-CG1 3.24Å; T218-I222 PolarHBondContact O-N 3.24Å
219	I	98.4	Very high	98.1	Very high	113 Å²	113	64.2 Å²	64.2	58%	0.579	33%	0.326	S	S	*	.	H	α-helix	trans	-69.7	-36.6	-178.5	-167.1	60.9	0	0	0	112	P215 Y216 I222 L223	P215-I219 WeakPolarHBondContact O-CG2 3.49Å; P215-I219 PolarHBondContact O-N 3.23Å; Y216-I219 WeakPolarHBondContact O-CG2 3.42Å; I219-I222 PolarHBondContact O-N 2.94Å; I219-L223 PolarHBondContact O-N 3.26Å
220	K	98.5	Very high	98	Very high	50 Å²	50	66.2 Å²	66.2	22%	0.217	34%	0.336	C	S	.	.	H	α-helix	trans	-64.2	-41.1	176.3	-169.7	-167.4	172.5	-162	0	111.6	I20 S21 N25 Y216 Y217 L223 G224	I20-K220 PolarHBondContact O-NZ 3.23Å; S21-K220 VanDerWaalsContact C-NZ 3.26Å; S21-K220 PolarHBondContact O-NZ 2.77Å; N25-K220 PolarHBondContact ND2-O 3.34Å; N25-K220 WeakPolarHBondContact OD1-CE 3.5Å; N25-K220 PolarHBondContact OD1-NZ 3.42Å; Y216-K220 WeakPolarHBondContact O-CB 3.22Å; Y216-K220 PolarHBondContact O-N 3.22Å; Y217-K220 HydrophobicContact CD1-CD 3.82Å; Y217-K220 HydrophobicContact CE1-CD 4.04Å; Y217-K220 PolarHBondContact O-N 2.95Å; K220-L223 PolarHBondContact O-N 3.25Å; K220-G224 PolarHBondContact O-N 3.33Å
221	D	98.4	Very high	97.9	Very high	24 Å²	24	68.4 Å²	68.4	13%	0.128	35%	0.35	C	S	.	.	H	α-helix	trans	-68.3	-41	176.5	-80.2	1.5	0	0	0	111.8	N25 S28 Y217 T218 L223 G224 I225	N25-D221 PolarHBondContact ND2-OD1 3.42Å; S28-D221 WeakPolarHBondContact CB-OD2 3.41Å; S28-D221 PolarHBondContact OG-OD1 3.21Å; S28-D221 PolarHBondContact OG-OD2 3.18Å; Y217-D221 VanDerWaalsContact O-CB 3.23Å; Y217-D221 WeakPolarHBondContact O-CB 3.25Å; Y217-D221 VanDerWaalsContact O-CG 3.32Å; Y217-D221 PolarHBondContact O-N 2.73Å; T218-D221 PolarHBondContact O-N 3.48Å; D221-L223 VanDerWaalsContact C-N 3.29Å; D221-L223 PolarHBondContact O-N 2.77Å; D221-G224 PolarHBondContact O-N 3.46Å; D221-G224 VanDerWaalsContact O-N 3.12Å; D221-I225 VanDerWaalsContact O-CG1 3.24Å; D221-I225 WeakPolarHBondContact O-CG1 3.48Å; D221-I225 PolarHBondContact O-N 2.92Å
222	I	98.6	Very high	97.5	Very high	81 Å²	81	67.9 Å²	67.9	42%	0.415	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-43.9	173	-70.6	165.7	0	0	0	110.8	T218 I219 G224 I225 L226	T218-I222 HydrophobicContact CG2-CD1 4.17Å; T218-I222 VanDerWaalsContact O-CG1 3.27Å; T218-I222 WeakPolarHBondContact O-CG1 3.24Å; T218-I222 PolarHBondContact O-N 3.24Å; I219-I222 PolarHBondContact O-N 2.94Å; I222-G224 PolarHBondContact O-N 3.4Å; I222-I225 PolarHBondContact O-N 3.26Å; I222-L226 HydrophobicContact CG2-CD1 4.21Å; I222-L226 WeakPolarHBondContact O-CG 3.49Å; I222-L226 PolarHBondContact O-N 2.62Å
223	L	98.6	Very high	96.5	Very high	104 Å²	104	73.4 Å²	73.4	55%	0.545	37%	0.371	S	S	.	.	H	α-helix	trans	-60.2	-45.5	175.1	177.2	62.8	0	0	0	111.8	I219 K220 D221 I225 L226 I227	I219-L223 PolarHBondContact O-N 3.26Å; K220-L223 PolarHBondContact O-N 3.25Å; D221-L223 VanDerWaalsContact C-N 3.29Å; D221-L223 PolarHBondContact O-N 2.77Å; L223-I225 VanDerWaalsContact C-N 3.31Å; L223-I225 PolarHBondContact O-N 2.95Å; L223-L226 PolarHBondContact O-N 3.13Å; L223-I227 HydrophobicContact CD1-CD1 4.2Å; L223-I227 HydrophobicContact CD1-CG1 4.48Å; L223-I227 HydrophobicContact CG-CD1 4.12Å; L223-I227 WeakPolarHBondContact O-CG1 3.33Å; L223-I227 PolarHBondContact O-N 3.05Å; L223-I227 VanDerWaalsContact O-N 3.07Å
224	G	98.4	Very high	96.4	Very high	14 Å²	14	75.3 Å²	75.3	14%	0.144	38%	0.381	C	S	.	.	H	α-helix	trans	-58.9	-42.8	175.9	0	0	0	0	0	112.5	K220 D221 I222 I227 M228	K220-G224 PolarHBondContact O-N 3.33Å; D221-G224 PolarHBondContact O-N 3.46Å; D221-G224 VanDerWaalsContact O-N 3.12Å; I222-G224 PolarHBondContact O-N 3.4Å; G224-I227 PolarHBondContact O-N 3.22Å; G224-M228 WeakPolarHBondContact O-CB 3.4Å; G224-M228 PolarHBondContact O-N 3.35Å
225	I	98.5	Very high	96.3	Very high	40 Å²	40	74.1 Å²	74.1	21%	0.205	38%	0.378	C	S	.	.	H	α-helix	trans	-62.7	-44.3	177.9	-69.1	164.7	0	0	0	110.8	L29 V32 D221 I222 L223 I227 M228 F229	L29-I225 HydrophobicContact CD2-CB 4.45Å; L29-I225 HydrophobicContact CD2-CG1 3.85Å; V32-I225 HydrophobicContact CG2-CD1 3.78Å; V32-I225 HydrophobicContact CG2-CG1 3.98Å; D221-I225 VanDerWaalsContact O-CG1 3.24Å; D221-I225 WeakPolarHBondContact O-CG1 3.48Å; D221-I225 PolarHBondContact O-N 2.92Å; I222-I225 PolarHBondContact O-N 3.26Å; L223-I225 VanDerWaalsContact C-N 3.31Å; L223-I225 PolarHBondContact O-N 2.95Å; I225-I227 VanDerWaalsContact C-N 3.35Å; I225-I227 PolarHBondContact O-N 3.04Å; I225-M228 PolarHBondContact O-N 3.24Å; I225-F229 HydrophobicContact CG2-CD2 3.56Å; I225-F229 HydrophobicContact CG2-CE2 3.49Å; I225-F229 VanDerWaalsContact CG2-CE2 3.49Å; I225-F229 VanDerWaalsContact O-CD2 3.28Å; I225-F229 WeakPolarHBondContact O-CD2 3.29Å; I225-F229 PolarHBondContact O-N 3.3Å
226	L	98.3	Very high	96.2	Very high	113 Å²	113	74.4 Å²	74.4	59%	0.592	37%	0.374	S	S	*	.	H	α-helix	trans	-60.8	-43.4	177.1	-70.9	171.3	0	0	0	111.9	I222 L223 F229 L230	I222-L226 HydrophobicContact CG2-CD1 4.21Å; I222-L226 WeakPolarHBondContact O-CG 3.49Å; I222-L226 PolarHBondContact O-N 2.62Å; L223-L226 PolarHBondContact O-N 3.13Å; L226-F229 PolarHBondContact O-N 3.39Å; L226-L230 WeakPolarHBondContact O-CB 3.2Å; L226-L230 PolarHBondContact O-N 2.96Å
227	I	98.1	Very high	96.1	Very high	87 Å²	87	71.3 Å²	71.3	45%	0.446	37%	0.366	S	S	.	.	H	α-helix	trans	-64.1	-43.6	176.5	-65.5	166.8	0	0	0	110.6	L223 G224 I225 F229 L230 I231	L223-I227 HydrophobicContact CD1-CD1 4.2Å; L223-I227 HydrophobicContact CD1-CG1 4.48Å; L223-I227 HydrophobicContact CG-CD1 4.12Å; L223-I227 WeakPolarHBondContact O-CG1 3.33Å; L223-I227 PolarHBondContact O-N 3.05Å; L223-I227 VanDerWaalsContact O-N 3.07Å; G224-I227 PolarHBondContact O-N 3.22Å; I225-I227 VanDerWaalsContact C-N 3.35Å; I225-I227 PolarHBondContact O-N 3.04Å; I227-F229 PolarHBondContact O-N 3.02Å; I227-L230 WeakPolarHBondContact O-CB 3.39Å; I227-L230 PolarHBondContact O-N 3.15Å; I227-I231 HydrophobicContact CG2-CD1 3.99Å; I227-I231 WeakPolarHBondContact O-CG1 3.47Å; I227-I231 PolarHBondContact O-N 3.44Å; I227-I231 VanDerWaalsContact O-N 3.14Å
228	M	97.8	Very high	96	Very high	7 Å²	7	75.1 Å²	75.1	3%	0.034	39%	0.387	C	S	.	.	H	α-helix	trans	-60.4	-45.5	177.8	-176.1	-167.1	70.2	0	0	111.5	L29 V32 C33 M82 G224 I225 L230 I231 L232	L29-M228 HydrophobicContact CB-SD 4.05Å; L29-M228 HydrophobicContact CD2-CB 4Å; L29-M228 HydrophobicContact CD2-CE 4.48Å; L29-M228 HydrophobicContact CD2-SD 3.9Å; L29-M228 HydrophobicContact CG-SD 4.41Å; V32-M228 HydrophobicContact CB-CE 4.19Å; V32-M228 HydrophobicContact CG1-CE 3.7Å; C33-M228 VanDerWaalsContact SG-SD 3.65Å; M82-M228 HydrophobicContact CE-CG 4.11Å; M82-M228 HydrophobicContact CG-CG 3.84Å; M82-M228 HydrophobicContact CG-SD 4.11Å; M82-M228 HydrophobicContact SD-CG 3.91Å; G224-M228 WeakPolarHBondContact O-CB 3.4Å; G224-M228 PolarHBondContact O-N 3.35Å; I225-M228 PolarHBondContact O-N 3.24Å; M228-L230 VanDerWaalsContact C-N 3.33Å; M228-L230 PolarHBondContact O-N 3.3Å; M228-I231 PolarHBondContact O-N 2.95Å; M228-L232 WeakPolarHBondContact O-CB 3.42Å; M228-L232 PolarHBondContact O-N 3.49Å
229	F	96.6	Very high	95.8	Very high	77 Å²	77	77.3 Å²	77.3	34%	0.338	40%	0.395	S	S	.	.	H	α-helix	trans	-65.1	-35.8	177.1	-82.5	-63.6	0	0	0	112.7	V32 V36 I225 L226 I227 I231 L232 M233	V32-F229 HydrophobicContact CG1-CE2 3.93Å; V32-F229 HydrophobicContact CG1-CZ 3.86Å; V36-F229 HydrophobicContact CG2-CE1 4.05Å; V36-F229 HydrophobicContact CG2-CZ 3.92Å; I225-F229 HydrophobicContact CG2-CD2 3.56Å; I225-F229 HydrophobicContact CG2-CE2 3.49Å; I225-F229 VanDerWaalsContact CG2-CE2 3.49Å; I225-F229 VanDerWaalsContact O-CD2 3.28Å; I225-F229 WeakPolarHBondContact O-CD2 3.29Å; I225-F229 PolarHBondContact O-N 3.3Å; L226-F229 PolarHBondContact O-N 3.39Å; I227-F229 PolarHBondContact O-N 3.02Å; F229-I231 VanDerWaalsContact C-N 3.26Å; F229-I231 PolarHBondContact O-N 2.96Å; F229-L232 HydrophobicContact CD1-CD2 4.19Å; F229-L232 HydrophobicContact CE1-CD2 4.31Å; F229-L232 PolarHBondContact O-N 3.12Å; F229-M233 VanDerWaalsContact O-CG 3.24Å; F229-M233 WeakPolarHBondContact O-CG 3.41Å; F229-M233 PolarHBondContact O-N 2.83Å; F229-M233 VanDerWaalsContact O-N 3.11Å
230	L	96.2	Very high	95.7	Very high	135 Å²	135	74.7 Å²	74.7	71%	0.707	38%	0.382	S	S	*	.	H	α-helix	trans	-61.6	-34.2	174.2	-178.8	65.9	0	0	0	112.5	L226 I227 M228	L226-L230 WeakPolarHBondContact O-CB 3.2Å; L226-L230 PolarHBondContact O-N 2.96Å; I227-L230 WeakPolarHBondContact O-CB 3.39Å; I227-L230 PolarHBondContact O-N 3.15Å; M228-L230 VanDerWaalsContact C-N 3.33Å; M228-L230 PolarHBondContact O-N 3.3Å
231	I	94.9	Very high	95.4	Very high	117 Å²	117	76.6 Å²	76.6	60%	0.6	40%	0.395	S	S	*	.	H	α-helix	trans	-81.5	-29.8	177.9	-61.2	165.5	0	0	0	111.5	M82 I227 M228 F229	M82-I231 HydrophobicContact CE-CB 3.85Å; M82-I231 HydrophobicContact CE-CG2 3.64Å; I227-I231 HydrophobicContact CG2-CD1 3.99Å; I227-I231 WeakPolarHBondContact O-CG1 3.47Å; I227-I231 PolarHBondContact O-N 3.44Å; I227-I231 VanDerWaalsContact O-N 3.14Å; M228-I231 PolarHBondContact O-N 2.95Å; F229-I231 VanDerWaalsContact C-N 3.26Å; F229-I231 PolarHBondContact O-N 2.96Å
232	L	89.7	Confident	95.2	Very high	25 Å²	25	81 Å²	81	13%	0.131	42%	0.417	C	S	.	.	H	α-helix	trans	-74.5	-31.6	-178.9	-178.5	62.9	0	0	0	113.1	N78 M82 M228 F229	N78-L232 HydrophobicContact CB-CD1 3.96Å; M82-L232 HydrophobicContact CB-CD1 4.15Å; M82-L232 HydrophobicContact CE-CB 4.35Å; M228-L232 WeakPolarHBondContact O-CB 3.42Å; M228-L232 PolarHBondContact O-N 3.49Å; F229-L232 HydrophobicContact CD1-CD2 4.19Å; F229-L232 HydrophobicContact CE1-CD2 4.31Å; F229-L232 PolarHBondContact O-N 3.12Å
233	M	76.6	Confident	94.9	Very high	172 Å²	172	81 Å²	81	85%	0.847	42%	0.417	S	S	*	.			trans	-84	0	178.7	-59.6	-126.8	94.2	0	0	111.8	L71 M75 F229	L71-M233 HydrophobicContact CD1-CE 3.99Å; M75-M233 HydrophobicContact SD-CE 4.16Å; F229-M233 VanDerWaalsContact O-CG 3.24Å; F229-M233 WeakPolarHBondContact O-CG 3.41Å; F229-M233 PolarHBondContact O-N 2.83Å; F229-M233 VanDerWaalsContact O-N 3.11Å

Retrieved 233 of 233 residues in 49.9 ms (Link to these results)

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